@MOLECULE receptor_wat.pdb 4098 3552 157 0 0 PROTEIN AMBER ff03.r1 @ATOM 1 N 24.4330 43.6770 16.8420 N.4 1 PRO1 -0.4217 2 CD 24.8270 45.1200 16.6490 C.3 1 PRO1 0.0485 3 CG 26.1660 45.3480 17.3170 C.3 1 PRO1 0.1061 4 CB 26.8160 43.8830 17.1830 C.3 1 PRO1 -0.1233 5 CA 25.7080 42.9760 16.7810 C.3 1 PRO1 0.2520 6 C 25.4900 41.6800 17.5620 C.2 1 PRO1 0.6805 7 O 25.0410 41.7420 18.7100 O.2 1 PRO1 -0.5992 8 N 25.8890 40.5720 16.9750 N.am 2 LEU2 -0.3552 9 CA 25.6940 39.1980 17.5250 C.3 2 LEU2 -0.1015 10 CB 25.9300 38.3050 16.2500 C.3 2 LEU2 -0.1444 11 CG 25.6110 36.8150 16.4410 C.3 2 LEU2 0.1920 12 CD1 24.1190 36.7370 16.9590 C.3 2 LEU2 -0.1230 13 CD2 25.8450 36.1420 15.0960 C.3 2 LEU2 -0.1230 14 C 26.5780 39.0010 18.7550 C.2 2 LEU2 0.5735 15 O 27.8070 39.0470 18.6690 O.2 2 LEU2 -0.5578 16 N 25.9840 38.7770 19.9420 N.am 3 HIE3 -0.5281 17 CA 26.6800 38.6440 21.2110 C.3 3 HIE3 0.0312 18 CB 26.5060 40.0300 21.9000 C.3 3 HIE3 -0.1523 19 CG 27.1140 40.2490 23.2400 C.ar 3 HIE3 0.2784 20 ND1 28.0890 39.4570 23.8450 N.ar 3 HIE3 -0.4233 21 CE1 28.3790 40.0870 25.0140 C.ar 3 HIE3 0.0260 22 NE2 27.5650 41.1530 25.2100 N.ar 3 HIE3 -0.0980 23 CD2 26.7300 41.2510 24.0870 C.ar 3 HIE3 -0.2976 24 C 26.1460 37.4900 22.0590 C.2 3 HIE3 0.6624 25 O 25.0480 36.9860 21.9200 O.2 3 HIE3 -0.5290 26 N 27.0320 36.9460 22.8730 N.am 4 VAL4 -0.4501 27 CA 26.8460 35.6370 23.4790 C.3 4 VAL4 -0.0519 28 CB 27.3680 34.4660 22.6070 C.3 4 VAL4 0.3952 29 CG1 27.3430 33.1040 23.3060 C.3 4 VAL4 -0.0901 30 CG2 26.6920 34.3200 21.2140 C.3 4 VAL4 -0.0901 31 C 27.5200 35.7760 24.8660 C.2 4 VAL4 0.4474 32 O 28.6670 36.3180 24.9770 O.2 4 VAL4 -0.4046 33 N 26.9350 35.1720 25.8840 N.am 5 THR5 -0.2454 34 CA 27.4620 35.1160 27.2590 C.3 5 THR5 -0.2712 35 CB 26.9890 36.3670 27.9420 C.3 5 THR5 0.2379 36 CG2 25.6220 36.2850 28.5280 C.3 5 THR5 -0.1765 37 OG1 27.9240 36.6840 29.0070 O.3 5 THR5 -0.6019 38 C 27.1940 33.7780 27.9160 C.2 5 THR5 0.5599 39 O 26.0360 33.3120 27.8340 O.2 5 THR5 -0.5520 40 N 28.1180 33.2830 28.6730 N.am 6 PHE6 -0.3713 41 CA 28.0390 32.1320 29.4510 C.3 6 PHE6 -0.0301 42 CB 29.4320 31.4020 29.3960 C.3 6 PHE6 -0.0987 43 CG 29.7760 30.8410 28.0250 C.ar 6 PHE6 0.0213 44 CD1 30.5810 31.5680 27.1440 C.ar 6 PHE6 -0.0831 45 CE1 30.8240 31.0830 25.8370 C.ar 6 PHE6 -0.1570 46 CZ 30.1520 29.9620 25.3910 C.ar 6 PHE6 -0.0998 47 CE2 29.2400 29.2440 26.2330 C.ar 6 PHE6 -0.1570 48 CD2 29.0620 29.7420 27.5090 C.ar 6 PHE6 -0.0831 49 C 27.8680 32.4750 30.9590 C.2 6 PHE6 0.5480 50 O 28.6990 32.9330 31.7430 O.2 6 PHE6 -0.5068 51 N 26.6080 32.3100 31.3540 N.am 7 VAL7 -0.4501 52 CA 25.9490 32.7640 32.6450 C.3 7 VAL7 -0.0519 53 CB 24.4380 33.1190 32.4870 C.3 7 VAL7 0.3952 54 CG1 23.9990 33.9480 33.7270 C.3 7 VAL7 -0.0901 55 CG2 24.2580 33.9950 31.2510 C.3 7 VAL7 -0.0901 56 C 26.0850 31.5750 33.6560 C.2 7 VAL7 0.4474 57 O 26.0870 30.3880 33.2970 O.2 7 VAL7 -0.4046 58 N 26.2140 32.0330 34.8730 N.am 8 CYS8 -0.3962 59 CA 26.6750 31.2390 36.0970 C.3 8 CYS8 -0.0735 60 CB 28.1580 30.9040 35.8270 C.3 8 CYS8 -0.2214 61 SG 29.1020 32.4290 35.7580 S.3 8 CYS8 -0.2852 62 C 26.4110 31.8610 37.5190 C.2 8 CYS8 0.6430 63 O 25.7500 32.8940 37.6120 O.2 8 CYS8 -0.5849 64 N 26.7400 31.1120 38.6060 N.am 9 THR9 -0.2454 65 CA 26.8390 31.8690 39.8900 C.3 9 THR9 -0.2712 66 CB 26.7880 30.8470 41.0300 C.3 9 THR9 0.2379 67 CG2 26.8330 31.3850 42.4630 C.3 9 THR9 -0.1765 68 OG1 25.6340 30.0620 40.9180 O.3 9 THR9 -0.6019 69 C 28.1840 32.6810 40.0660 C.2 9 THR9 0.5599 70 O 28.1370 33.8880 40.3700 O.2 9 THR9 -0.5520 71 N 29.3030 32.0210 39.9370 N.am 10 GLY10 -0.3743 72 CA 30.6680 32.4700 40.3000 C.3 10 GLY10 -0.1288 73 C 31.4480 33.2520 39.2090 C.2 10 GLY10 0.5806 74 O 31.6000 34.4420 39.2660 O.2 10 GLY10 -0.5092 75 N 31.8120 32.4910 38.1930 N.am 11 ASN11 -0.4301 76 CA 32.5790 32.9460 36.9530 C.3 11 ASN11 0.0446 77 CB 32.2870 34.3380 36.5050 C.3 11 ASN11 -0.0936 78 CG 32.7820 34.6240 35.0410 C.2 11 ASN11 0.5835 79 OD1 33.3310 35.6850 34.7040 O.2 11 ASN11 -0.5268 80 ND2 32.7170 33.6230 34.1750 N.am 11 ASN11 -0.7817 81 C 34.0700 32.6260 37.1340 C.2 11 ASN11 0.6171 82 O 34.8850 33.4090 36.7770 O.2 11 ASN11 -0.5239 83 N 34.4860 31.6110 37.8670 N.am 12 ILE12 -0.4510 84 CA 35.8740 31.0630 38.0010 C.3 12 ILE12 -0.1019 85 CB 36.4490 31.0620 39.4760 C.3 12 ILE12 0.0622 86 CG2 36.3400 32.4040 40.1220 C.3 12 ILE12 -0.1300 87 CG1 35.7000 30.0620 40.3570 C.3 12 ILE12 0.0222 88 CD1 36.6380 29.5660 41.4500 C.3 12 ILE12 -0.1013 89 C 36.1130 29.6960 37.2910 C.2 12 ILE12 0.5694 90 O 37.2950 29.3870 37.0470 O.2 12 ILE12 -0.6195 91 N 35.0900 28.9870 36.8370 N.am 13 CYS13 -0.3962 92 CA 35.2590 27.5460 36.4020 C.3 13 CYS13 -0.0735 93 CB 34.6410 26.5490 37.4350 C.3 13 CYS13 -0.2214 94 SG 35.5070 26.4240 38.9930 S.3 13 CYS13 -0.2852 95 C 34.6670 27.3410 34.9810 C.2 13 CYS13 0.6430 96 O 35.1770 27.8590 34.0010 O.2 13 CYS13 -0.5849 97 N 33.5670 26.5760 34.8790 N.am 14 ARG14 -0.3009 98 CA 32.8860 26.1930 33.6380 C.3 14 ARG14 -0.1314 99 CB 31.4670 25.7010 33.9390 C.3 14 ARG14 0.0367 100 CG 31.4320 24.2700 34.4920 C.3 14 ARG14 0.0125 101 CD 30.1590 23.8840 35.2460 C.3 14 ARG14 0.1263 102 NE 29.9040 24.6800 36.5470 N.pl3 14 ARG14 -0.4649 103 CZ 28.7470 24.6190 37.2030 C.2 14 ARG14 0.5655 104 NH1 27.5750 24.2020 36.6810 N.pl3 14 ARG14 -0.6858 105 NH2 28.7490 24.9940 38.4610 N.pl3 14 ARG14 -0.6858 106 C 32.8020 27.3200 32.6060 C.2 14 ARG14 0.7303 107 O 33.2070 27.2030 31.4070 O.2 14 ARG14 -0.5783 108 N 32.1370 28.3580 33.0890 N.am 15 SER15 -0.5414 109 CA 31.9310 29.5020 32.2420 C.3 15 SER15 0.1181 110 CB 30.9350 30.5040 32.8750 C.3 15 SER15 0.1470 111 OG 31.3070 30.9410 34.1830 O.3 15 SER15 -0.6403 112 C 33.2140 30.1580 31.5670 C.2 15 SER15 0.4834 113 O 33.0670 30.3080 30.3450 O.2 15 SER15 -0.5808 114 N 34.2930 30.5290 32.2600 N.am 16 PRO16 -0.0881 115 CD 34.4040 30.5320 33.7790 C.3 16 PRO16 -0.0119 116 CG 35.9340 30.8560 34.0860 C.3 16 PRO16 0.0131 117 CB 36.5950 31.1950 32.7680 C.3 16 PRO16 -0.0034 118 CA 35.5680 30.8460 31.6420 C.3 16 PRO16 -0.0346 119 C 36.1460 29.7020 30.6950 C.2 16 PRO16 0.3337 120 O 36.7340 30.1320 29.6610 O.2 16 PRO16 -0.4346 121 N 35.9010 28.3800 30.9070 N.am 17 MET17 -0.3949 122 CA 36.3510 27.4110 29.9210 C.3 17 MET17 -0.0877 123 CB 36.3140 26.0180 30.6030 C.3 17 MET17 0.0192 124 CG 37.1410 25.8500 31.8490 C.3 17 MET17 -0.2082 125 SD 37.2660 24.1350 32.5940 S.3 17 MET17 -0.2120 126 CE 38.6470 23.6500 31.4290 C.3 17 MET17 -0.2847 127 C 35.5720 27.4060 28.6070 C.2 17 MET17 0.5997 128 O 36.2170 27.6450 27.5760 O.2 17 MET17 -0.5664 129 N 34.2510 27.2960 28.6900 N.am 18 ALA18 -0.4048 130 CA 33.1740 27.5800 27.6790 C.3 18 ALA18 -0.0277 131 CB 31.8640 27.7590 28.3380 C.3 18 ALA18 -0.2300 132 C 33.4910 28.8420 26.7980 C.2 18 ALA18 0.5702 133 O 33.3590 28.7670 25.5580 O.2 18 ALA18 -0.5551 134 N 33.8300 29.9970 27.4610 N.am 19 GLU19 -0.4234 135 CA 34.2660 31.2240 26.8810 C.3 19 GLU19 0.0316 136 CB 34.4000 32.3090 27.9370 C.3 19 GLU19 0.0748 137 CG 34.4870 33.7430 27.3940 C.3 19 GLU19 -0.0339 138 CD 35.3480 34.6520 28.2480 C.2 19 GLU19 0.7652 139 OE1 36.3480 35.2160 27.7040 O.co2 19 GLU19 -0.8240 140 OE2 35.0130 34.9990 29.4550 O.co2 19 GLU19 -0.8240 141 C 35.5110 31.0090 26.0930 C.2 19 GLU19 0.4697 142 O 35.5000 31.3520 24.8970 O.2 19 GLU19 -0.5925 143 N 36.6130 30.6390 26.7740 N.am 20 LYS20 -0.4359 144 CA 37.9470 30.5870 26.1160 C.3 20 LYS20 -0.0388 145 CB 39.0620 30.5290 27.1580 C.3 20 LYS20 -0.1083 146 CG 39.3160 31.6490 28.1630 C.3 20 LYS20 0.0333 147 CD 39.1410 33.0270 27.5180 C.3 20 LYS20 -0.0478 148 CE 39.0290 34.1310 28.5560 C.3 20 LYS20 -0.0700 149 NZ 39.1030 35.5430 28.1840 N.4 20 LYS20 -0.2504 150 C 38.0190 29.4670 25.0710 C.2 20 LYS20 0.7251 151 O 38.8020 29.5820 24.0790 O.2 20 LYS20 -0.5632 152 N 37.2160 28.3970 25.0930 N.am 21 MET21 -0.3949 153 CA 37.0390 27.3650 24.0790 C.3 21 MET21 -0.0877 154 CB 36.6650 26.0010 24.6610 C.3 21 MET21 0.0192 155 CG 37.6290 25.4380 25.6530 C.3 21 MET21 -0.2082 156 SD 37.1670 23.8300 26.4150 S.3 21 MET21 -0.2120 157 CE 37.0370 22.8300 24.9430 C.3 21 MET21 -0.2847 158 C 36.0910 27.8060 22.9540 C.2 21 MET21 0.5997 159 O 36.5130 27.5770 21.8430 O.2 21 MET21 -0.5664 160 N 35.1040 28.6870 23.1320 N.am 22 PHE22 -0.3713 161 CA 34.2490 29.1000 22.0050 C.3 22 PHE22 -0.0301 162 CB 32.8710 29.6570 22.5010 C.3 22 PHE22 -0.0987 163 CG 31.7300 29.8560 21.4400 C.ar 22 PHE22 0.0213 164 CD1 31.4230 28.9460 20.4190 C.ar 22 PHE22 -0.0831 165 CE1 30.3060 29.1800 19.6060 C.ar 22 PHE22 -0.1570 166 CZ 29.5350 30.3850 19.6570 C.ar 22 PHE22 -0.0998 167 CE2 29.7720 31.2690 20.7250 C.ar 22 PHE22 -0.1570 168 CD2 30.9050 31.0470 21.5690 C.ar 22 PHE22 -0.0831 169 C 34.9410 30.0970 21.1070 C.2 22 PHE22 0.5480 170 O 35.1260 29.8880 19.9270 O.2 22 PHE22 -0.5068 171 N 35.3200 31.2510 21.7300 N.am 23 ALA23 -0.4048 172 CA 35.8030 32.4840 21.0940 C.3 23 ALA23 -0.0277 173 CB 36.1510 33.5300 22.1910 C.3 23 ALA23 -0.2300 174 C 36.9910 32.2940 20.2090 C.2 23 ALA23 0.5702 175 O 37.0210 32.6870 19.0480 O.2 23 ALA23 -0.5551 176 N 37.9480 31.4360 20.6800 N.am 24 GLN24 -0.3874 177 CA 39.1030 30.9160 19.9650 C.3 24 GLN24 0.0375 178 CB 40.0200 30.1460 20.9550 C.3 24 GLN24 -0.0321 179 CG 41.3210 29.5250 20.3860 C.3 24 GLN24 -0.0203 180 CD 42.3610 30.3170 19.5740 C.2 24 GLN24 0.6678 181 OE1 43.3400 30.7720 20.1800 O.2 24 GLN24 -0.6285 182 NE2 42.0800 30.7080 18.3970 N.am 24 GLN24 -0.8834 183 C 38.7240 30.0720 18.7630 C.2 24 GLN24 0.4186 184 O 39.1900 30.2020 17.6380 O.2 24 GLN24 -0.5653 185 N 37.8380 29.1020 18.9590 N.am 25 GLN25 -0.3874 186 CA 37.2710 28.2240 17.9050 C.3 25 GLN25 0.0375 187 CB 36.3740 27.0820 18.5190 C.3 25 GLN25 -0.0321 188 CG 37.2600 25.9610 19.0790 C.3 25 GLN25 -0.0203 189 CD 36.3990 24.7190 19.5430 C.2 25 GLN25 0.6678 190 OE1 35.2590 24.3950 19.1330 O.2 25 GLN25 -0.6285 191 NE2 36.8720 24.0520 20.5420 N.am 25 GLN25 -0.8834 192 C 36.4740 28.9960 16.8230 C.2 25 GLN25 0.4186 193 O 36.4900 28.5850 15.6900 O.2 25 GLN25 -0.5653 194 N 35.8600 30.1980 17.1340 N.am 26 LEU26 -0.3552 195 CA 35.2340 31.0790 16.1160 C.3 26 LEU26 -0.1015 196 CB 34.2110 32.0650 16.7410 C.3 26 LEU26 -0.1444 197 CG 32.8590 31.4750 17.2220 C.3 26 LEU26 0.1920 198 CD1 32.0610 32.6030 17.8620 C.3 26 LEU26 -0.1230 199 CD2 32.0770 30.8710 16.0800 C.3 26 LEU26 -0.1230 200 C 36.3130 31.9100 15.3320 C.2 26 LEU26 0.5735 201 O 36.2380 32.0860 14.1290 O.2 26 LEU26 -0.5578 202 N 37.3550 32.3070 16.0050 N.am 27 ARG27 -0.3009 203 CA 38.5600 32.8990 15.4580 C.3 27 ARG27 -0.1314 204 CB 39.4790 33.4020 16.6120 C.3 27 ARG27 0.0367 205 CG 40.7060 34.2460 16.1220 C.3 27 ARG27 0.0125 206 CD 41.4420 35.0380 17.1730 C.3 27 ARG27 0.1263 207 NE 40.5490 36.1370 17.6520 N.pl3 27 ARG27 -0.4649 208 CZ 40.8820 37.3030 18.1260 C.2 27 ARG27 0.5655 209 NH1 42.1300 37.5390 18.3480 N.pl3 27 ARG27 -0.6858 210 NH2 40.0520 38.2970 18.5080 N.pl3 27 ARG27 -0.6858 211 C 39.2430 31.9250 14.4640 C.2 27 ARG27 0.7303 212 O 39.7080 32.4200 13.3990 O.2 27 ARG27 -0.5783 213 N 39.1020 30.5900 14.6640 N.am 28 HIE28 -0.5281 214 CA 39.5020 29.5830 13.7040 C.3 28 HIE28 0.0312 215 CB 39.8140 28.2870 14.4280 C.3 28 HIE28 -0.1523 216 CG 41.1450 28.1790 15.1750 C.ar 28 HIE28 0.2784 217 ND1 42.2610 28.9760 14.9490 N.ar 28 HIE28 -0.4233 218 CE1 43.1960 28.5710 15.7520 C.ar 28 HIE28 0.0260 219 NE2 42.7690 27.6270 16.5520 N.ar 28 HIE28 -0.0980 220 CD2 41.4930 27.3140 16.1790 C.ar 28 HIE28 -0.2976 221 C 38.5960 29.3620 12.5310 C.2 28 HIE28 0.6624 222 O 39.0510 28.8350 11.5690 O.2 28 HIE28 -0.5290 223 N 37.3240 29.8570 12.6340 N.am 29 ARG29 -0.3009 224 CA 36.3740 29.8470 11.5030 C.3 29 ARG29 -0.1314 225 CB 35.0190 29.3210 11.9170 C.3 29 ARG29 0.0367 226 CG 33.9870 28.9230 10.7870 C.3 29 ARG29 0.0125 227 CD 32.9140 27.8620 11.2430 C.3 29 ARG29 0.1263 228 NE 31.9530 27.6160 10.1480 N.pl3 29 ARG29 -0.4649 229 CZ 30.7990 28.2590 9.9860 C.2 29 ARG29 0.5655 230 NH1 30.2500 29.1150 10.8380 N.pl3 29 ARG29 -0.6858 231 NH2 30.1530 28.0350 8.8650 N.pl3 29 ARG29 -0.6858 232 C 36.3660 31.1920 10.7640 C.2 29 ARG29 0.7303 233 O 35.7430 31.2280 9.6880 O.2 29 ARG29 -0.5783 234 N 37.0150 32.1970 11.3320 N.am 30 GLY30 -0.3743 235 CA 37.2200 33.5330 10.7960 C.3 30 GLY30 -0.1288 236 C 36.1810 34.5530 11.3200 C.2 30 GLY30 0.5806 237 O 35.9070 35.5620 10.6960 O.2 30 GLY30 -0.5092 238 N 35.5760 34.2400 12.4580 N.am 31 LEU31 -0.3552 239 CA 34.4150 34.8990 13.0800 C.3 31 LEU31 -0.1015 240 CB 33.2310 33.9100 13.0290 C.3 31 LEU31 -0.1444 241 CG 32.8770 33.5760 11.5900 C.3 31 LEU31 0.1920 242 CD1 31.7400 32.4750 11.6170 C.3 31 LEU31 -0.1230 243 CD2 32.3530 34.8370 10.7470 C.3 31 LEU31 -0.1230 244 C 34.7500 35.5460 14.4360 C.2 31 LEU31 0.5735 245 O 33.8450 36.0370 15.1070 O.2 31 LEU31 -0.5578 246 N 35.9640 35.6260 14.8720 N.am 32 GLY32 -0.3743 247 CA 36.2320 36.0060 16.2190 C.3 32 GLY32 -0.1288 248 C 35.9310 37.4920 16.4490 C.2 32 GLY32 0.5806 249 O 35.2330 37.8810 17.3860 O.2 32 GLY32 -0.5092 250 N 36.6380 38.3130 15.6580 N.am 33 ASP33 -0.5582 251 CA 36.5270 39.7610 15.6140 C.3 33 ASP33 0.0072 252 CB 37.6300 40.3990 14.7820 C.3 33 ASP33 -0.0476 253 CG 37.6680 41.9800 14.8350 C.2 33 ASP33 0.7452 254 OD1 37.6540 42.6020 15.9660 O.co2 33 ASP33 -0.7304 255 OD2 37.7680 42.5590 13.7110 O.co2 33 ASP33 -0.7304 256 C 35.1340 40.3100 15.1470 C.2 33 ASP33 0.4432 257 O 34.8100 41.5080 15.2560 O.2 33 ASP33 -0.5014 258 N 34.2950 39.4370 14.6460 N.am 34 ALA34 -0.4048 259 CA 32.9180 39.6470 14.2030 C.3 34 ALA34 -0.0277 260 CB 32.7290 38.9050 12.8700 C.3 34 ALA34 -0.2300 261 C 31.7200 39.2550 15.1660 C.2 34 ALA34 0.5702 262 O 30.6660 39.8800 15.1660 O.2 34 ALA34 -0.5551 263 N 31.9530 38.2130 16.0180 N.am 35 VAL35 -0.4501 264 CA 30.9860 37.7190 16.9760 C.3 35 VAL35 -0.0519 265 CB 30.7270 36.2080 16.6990 C.3 35 VAL35 0.3952 266 CG1 29.5170 35.6830 17.6360 C.3 35 VAL35 -0.0901 267 CG2 30.1750 35.9330 15.2500 C.3 35 VAL35 -0.0901 268 C 31.5370 37.8740 18.3940 C.2 35 VAL35 0.4474 269 O 32.7620 37.7520 18.6400 O.2 35 VAL35 -0.4046 270 N 30.6260 38.1630 19.3590 N.am 36 ARG36 -0.3009 271 CA 31.1010 38.5950 20.7010 C.3 36 ARG36 -0.1314 272 CB 30.5680 40.0070 20.9790 C.3 36 ARG36 0.0367 273 CG 31.2110 40.5460 22.2720 C.3 36 ARG36 0.0125 274 CD 30.8560 41.9920 22.5570 C.3 36 ARG36 0.1263 275 NE 31.5580 42.6020 23.7080 N.pl3 36 ARG36 -0.4649 276 CZ 31.1830 43.7300 24.2990 C.2 36 ARG36 0.5655 277 NH1 30.1200 44.4300 23.8420 N.pl3 36 ARG36 -0.6858 278 NH2 31.9010 44.2060 25.3120 N.pl3 36 ARG36 -0.6858 279 C 30.8010 37.6500 21.8930 C.2 36 ARG36 0.7303 280 O 29.6880 37.1220 22.0260 O.2 36 ARG36 -0.5783 281 N 31.8810 37.3210 22.6790 N.am 37 VAL37 -0.4501 282 CA 31.8110 36.2200 23.6620 C.3 37 VAL37 -0.0519 283 CB 32.6420 35.0250 23.1110 C.3 37 VAL37 0.3952 284 CG1 32.5210 33.8130 24.0370 C.3 37 VAL37 -0.0901 285 CG2 32.0890 34.5230 21.7310 C.3 37 VAL37 -0.0901 286 C 32.3840 36.7290 25.0130 C.2 37 VAL37 0.4474 287 O 33.5130 37.1960 25.0840 O.2 37 VAL37 -0.4046 288 N 31.5230 36.6980 26.0510 N.am 38 THR38 -0.2454 289 CA 31.8040 36.8750 27.5270 C.3 38 THR38 -0.2712 290 CB 31.1520 38.2650 27.9250 C.3 38 THR38 0.2379 291 CG2 31.7730 39.3780 27.0560 C.3 38 THR38 -0.1765 292 OG1 29.7880 38.1290 27.5200 O.3 38 THR38 -0.6019 293 C 31.3530 35.7020 28.4150 C.2 38 THR38 0.5599 294 O 30.7300 34.7090 27.9850 O.2 38 THR38 -0.5520 295 N 31.6650 35.8760 29.6790 N.am 39 SER39 -0.5414 296 CA 31.2210 35.0560 30.7740 C.3 39 SER39 0.1181 297 CB 32.1530 33.8760 30.9390 C.3 39 SER39 0.1470 298 OG 33.4460 34.1240 31.4370 O.3 39 SER39 -0.6403 299 C 31.1430 35.9270 32.0710 C.2 39 SER39 0.4834 300 O 31.9160 36.9040 32.1940 O.2 39 SER39 -0.5808 301 N 30.2690 35.6620 33.0130 N.am 40 ALA40 -0.4048 302 CA 29.9630 36.6090 34.1340 C.3 40 ALA40 -0.0277 303 CB 29.4540 37.9530 33.5980 C.3 40 ALA40 -0.2300 304 C 29.0070 35.8790 35.1360 C.2 40 ALA40 0.5702 305 O 28.0520 35.3190 34.7080 O.2 40 ALA40 -0.5551 306 N 29.1640 36.1020 36.4520 N.am 41 GLY41 -0.3743 307 CA 28.3060 35.4730 37.4570 C.3 41 GLY41 -0.1288 308 C 27.0520 36.2990 37.9550 C.2 41 GLY41 0.5806 309 O 27.1000 37.5510 37.9230 O.2 41 GLY41 -0.5092 310 N 25.8780 35.6240 38.2200 N.am 42 THR42 -0.2454 311 CA 24.6540 36.1810 38.8560 C.3 42 THR42 -0.2712 312 CB 23.3720 35.3020 38.6420 C.3 42 THR42 0.2379 313 CG2 22.9820 34.9940 37.2520 C.3 42 THR42 -0.1765 314 OG1 23.5740 33.9790 39.1130 O.3 42 THR42 -0.6019 315 C 24.8720 36.4440 40.3500 C.2 42 THR42 0.5599 316 O 24.1320 37.3150 40.8310 O.2 42 THR42 -0.5520 317 N 25.8650 35.8690 41.0690 N.am 43 GLY43 -0.3743 318 CA 26.1980 36.2780 42.4540 C.3 43 GLY43 -0.1288 319 C 27.1020 37.5370 42.5150 C.2 43 GLY43 0.5806 320 O 27.2300 38.3870 41.6600 O.2 43 GLY43 -0.5092 321 N 27.7080 37.7060 43.6760 N.am 44 ASN44 -0.4301 322 CA 28.8300 38.7200 43.9320 C.3 44 ASN44 0.0446 323 CB 28.2890 39.8250 44.8480 C.3 44 ASN44 -0.0936 324 CG 28.0640 39.3080 46.2810 C.2 44 ASN44 0.5835 325 OD1 28.9820 39.1100 47.0390 O.2 44 ASN44 -0.5268 326 ND2 26.8050 39.0600 46.7530 N.am 44 ASN44 -0.7817 327 C 30.1260 38.0810 44.5120 C.2 44 ASN44 0.6171 328 O 31.1460 38.7440 44.5930 O.2 44 ASN44 -0.5239 329 N 30.0320 36.8450 44.9870 N.am 45 TRP45 -0.4276 330 CA 30.9360 36.3110 46.0410 C.3 45 TRP45 -0.0201 331 CB 30.1740 35.1000 46.6450 C.3 45 TRP45 -0.0984 332 CG 30.4720 34.6130 48.0310 C.ar 45 TRP45 -0.0998 333 CD1 31.3900 33.6160 48.3280 C.ar 45 TRP45 -0.1741 334 NE1 31.3460 33.4190 49.6780 N.ar 45 TRP45 -0.2984 335 CE2 30.4030 34.1970 50.3550 C.ar 45 TRP45 0.1415 336 CZ2 30.0180 34.2830 51.7150 C.ar 45 TRP45 -0.2107 337 CH2 29.0390 35.2380 52.0570 C.ar 45 TRP45 -0.1330 338 CZ3 28.4650 36.0630 51.0610 C.ar 45 TRP45 -0.1641 339 CE3 28.8400 35.9920 49.7070 C.ar 45 TRP45 -0.1540 340 CD2 29.8070 34.9920 49.2980 C.ar 45 TRP45 0.0896 341 C 32.3640 36.0440 45.4400 C.2 45 TRP45 0.5841 342 O 33.2090 35.5820 46.2150 O.2 45 TRP45 -0.4947 343 N 32.5810 36.1030 44.1240 N.am 46 HIE46 -0.5281 344 CA 33.8460 35.8500 43.4390 C.3 46 HIE46 0.0312 345 CB 33.7700 34.5550 42.5820 C.3 46 HIE46 -0.1523 346 CG 33.6130 33.2680 43.3100 C.ar 46 HIE46 0.2784 347 ND1 34.6220 32.4090 43.7010 N.ar 46 HIE46 -0.4233 348 CE1 33.9820 31.5120 44.5210 C.ar 46 HIE46 0.0260 349 NE2 32.6400 31.7250 44.5940 N.ar 46 HIE46 -0.0980 350 CD2 32.4230 32.8910 43.8890 C.ar 46 HIE46 -0.2976 351 C 34.4400 37.0170 42.6230 C.2 46 HIE46 0.6624 352 O 35.6050 36.9040 42.2830 O.2 46 HIE46 -0.5290 353 N 33.6580 38.1510 42.3830 N.am 47 VAL47 -0.4501 354 CA 34.0430 39.2660 41.4920 C.3 47 VAL47 -0.0519 355 CB 32.9530 40.3880 41.3700 C.3 47 VAL47 0.3952 356 CG1 33.4240 41.3340 40.2410 C.3 47 VAL47 -0.0901 357 CG2 31.5150 40.0340 41.0140 C.3 47 VAL47 -0.0901 358 C 35.4460 39.8340 41.9610 C.2 47 VAL47 0.4474 359 O 35.6500 40.1680 43.1510 O.2 47 VAL47 -0.4046 360 N 36.3470 39.8810 40.9400 N.am 48 GLY48 -0.3743 361 CA 37.7820 40.2560 41.1330 C.3 48 GLY48 -0.1288 362 C 38.7750 39.1470 40.9490 C.2 48 GLY48 0.5806 363 O 39.9750 39.4110 40.7600 O.2 48 GLY48 -0.5092 364 N 38.3570 37.9010 41.2580 N.am 49 SER49 -0.5414 365 CA 39.2390 36.7230 41.1950 C.3 49 SER49 0.1181 366 CB 38.6220 35.5460 41.9490 C.3 49 SER49 0.1470 367 OG 38.3750 35.7830 43.3920 O.3 49 SER49 -0.6403 368 C 39.4480 36.4050 39.7130 C.2 49 SER49 0.4834 369 O 38.6110 36.7790 38.8120 O.2 49 SER49 -0.5808 370 N 40.4960 35.6390 39.3880 N.am 50 CYS50 -0.3962 371 CA 40.7310 35.0470 38.0390 C.3 50 CYS50 -0.0735 372 CB 42.1650 35.0840 37.6050 C.3 50 CYS50 -0.2214 373 SG 43.1900 33.8880 38.4960 S.3 50 CYS50 -0.2852 374 C 40.0830 33.6480 37.9530 C.2 50 CYS50 0.6430 375 O 39.3240 33.2330 38.8680 O.2 50 CYS50 -0.5849 376 N 40.2410 32.8680 36.9120 N.am 51 ALA51 -0.4048 377 CA 39.8670 31.4910 36.8520 C.3 51 ALA51 -0.0277 378 CB 39.8100 31.0040 35.3880 C.3 51 ALA51 -0.2300 379 C 40.6920 30.5500 37.7960 C.2 51 ALA51 0.5702 380 O 41.8260 30.8590 38.1440 O.2 51 ALA51 -0.5551 381 N 40.1910 29.3730 38.1000 N.am 52 ASP52 -0.5582 382 CA 40.9770 28.3740 38.7640 C.3 52 ASP52 0.0072 383 CB 39.8920 27.3090 39.0980 C.3 52 ASP52 -0.0476 384 CG 40.4820 26.2470 40.0840 C.2 52 ASP52 0.7452 385 OD1 40.9790 25.1920 39.5910 O.co2 52 ASP52 -0.7304 386 OD2 40.5200 26.5250 41.3500 O.co2 52 ASP52 -0.7304 387 C 42.2060 27.8020 38.0570 C.2 52 ASP52 0.4432 388 O 42.2410 27.7460 36.8190 O.2 52 ASP52 -0.5014 389 N 43.1650 27.3740 38.9230 N.am 53 GLU53 -0.4234 390 CA 44.5220 26.9400 38.4290 C.3 53 GLU53 0.0316 391 CB 45.5760 26.7100 39.6460 C.3 53 GLU53 0.0748 392 CG 45.7380 28.0480 40.4280 C.3 53 GLU53 -0.0339 393 CD 46.7120 27.7550 41.5850 C.2 53 GLU53 0.7652 394 OE1 48.0050 27.6990 41.3360 O.co2 53 GLU53 -0.8240 395 OE2 46.2520 27.4970 42.6870 O.co2 53 GLU53 -0.8240 396 C 44.3940 25.6410 37.5830 C.2 53 GLU53 0.4697 397 O 45.2290 25.3040 36.7970 O.2 53 GLU53 -0.5925 398 N 43.3270 24.8050 37.8350 N.am 54 ARG54 -0.3009 399 CA 42.9450 23.6170 37.0670 C.3 54 ARG54 -0.1314 400 CB 42.2940 22.5480 38.0060 C.3 54 ARG54 0.0367 401 CG 43.2710 22.0890 39.0750 C.3 54 ARG54 0.0125 402 CD 42.5940 21.3330 40.1810 C.3 54 ARG54 0.1263 403 NE 43.4950 20.3870 40.9020 N.pl3 54 ARG54 -0.4649 404 CZ 43.2490 19.6840 42.0570 C.2 54 ARG54 0.5655 405 NH1 42.1520 19.9290 42.6990 N.pl3 54 ARG54 -0.6858 406 NH2 44.0670 18.6780 42.4040 N.pl3 54 ARG54 -0.6858 407 C 42.0900 23.9730 35.7460 C.2 54 ARG54 0.7303 408 O 42.4570 23.4290 34.6960 O.2 54 ARG54 -0.5783 409 N 41.1470 24.8740 35.8160 N.am 55 ALA55 -0.4048 410 CA 40.5260 25.5120 34.6260 C.3 55 ALA55 -0.0277 411 CB 39.5540 26.5690 35.1130 C.3 55 ALA55 -0.2300 412 C 41.6000 26.0270 33.6350 C.2 55 ALA55 0.5702 413 O 41.6270 25.5770 32.5100 O.2 55 ALA55 -0.5551 414 N 42.4340 26.8870 34.1530 N.am 56 ALA56 -0.4048 415 CA 43.6030 27.4160 33.4600 C.3 56 ALA56 -0.0277 416 CB 44.4400 28.3280 34.4160 C.3 56 ALA56 -0.2300 417 C 44.5230 26.3340 32.8960 C.2 56 ALA56 0.5702 418 O 44.9860 26.3740 31.7520 O.2 56 ALA56 -0.5551 419 N 44.8330 25.3700 33.7210 N.am 57 GLY57 -0.3743 420 CA 45.7140 24.2410 33.3900 C.3 57 GLY57 -0.1288 421 C 45.2280 23.3530 32.2510 C.2 57 GLY57 0.5806 422 O 45.9350 23.0400 31.2890 O.2 57 GLY57 -0.5092 423 N 43.9400 23.0240 32.2440 N.am 58 VAL58 -0.4501 424 CA 43.3270 22.1530 31.2090 C.3 58 VAL58 -0.0519 425 CB 42.0320 21.5370 31.7660 C.3 58 VAL58 0.3952 426 CG1 41.2520 20.7220 30.6570 C.3 58 VAL58 -0.0901 427 CG2 42.2010 20.5060 32.9940 C.3 58 VAL58 -0.0901 428 C 43.1500 23.0490 29.9800 C.2 58 VAL58 0.4474 429 O 43.3350 22.5660 28.8380 O.2 58 VAL58 -0.4046 430 N 42.8200 24.3420 30.1260 N.am 59 LEU59 -0.3552 431 CA 42.8630 25.2270 28.9530 C.3 59 LEU59 -0.1015 432 CB 42.3770 26.5720 29.3940 C.3 59 LEU59 -0.1444 433 CG 40.8230 26.6990 29.6520 C.3 59 LEU59 0.1920 434 CD1 40.5860 28.1310 30.3350 C.3 59 LEU59 -0.1230 435 CD2 40.1310 26.5810 28.3300 C.3 59 LEU59 -0.1230 436 C 44.2200 25.2430 28.2890 C.2 59 LEU59 0.5735 437 O 44.2580 24.8930 27.1350 O.2 59 LEU59 -0.5578 438 N 45.2770 25.7360 29.0330 N.am 60 ARG60 -0.3009 439 CA 46.5600 26.0290 28.4780 C.3 60 ARG60 -0.1314 440 CB 47.2680 26.7150 29.6580 C.3 60 ARG60 0.0367 441 CG 48.5170 27.3950 29.1020 C.3 60 ARG60 0.0125 442 CD 49.5220 28.0630 30.0560 C.3 60 ARG60 0.1263 443 NE 48.8600 29.0510 30.9140 N.pl3 60 ARG60 -0.4649 444 CZ 48.3070 29.0110 32.1630 C.2 60 ARG60 0.5655 445 NH1 48.1950 27.8870 32.8940 N.pl3 60 ARG60 -0.6858 446 NH2 47.7320 30.0960 32.6260 N.pl3 60 ARG60 -0.6858 447 C 47.1970 24.7710 28.0040 C.2 60 ARG60 0.7303 448 O 47.9850 24.8530 27.0680 O.2 60 ARG60 -0.5783 449 N 46.9980 23.5690 28.6160 N.am 61 ALA61 -0.4048 450 CA 47.4030 22.3010 28.0170 C.3 61 ALA61 -0.0277 451 CB 46.7830 21.1410 28.8250 C.3 61 ALA61 -0.2300 452 C 47.0740 22.1400 26.5160 C.2 61 ALA61 0.5702 453 O 47.9620 21.9330 25.7350 O.2 61 ALA61 -0.5551 454 N 45.8350 22.2980 26.1790 N.am 62 HIE62 -0.5281 455 CA 45.2720 22.0790 24.8290 C.3 62 HIE62 0.0312 456 CB 43.8640 21.7350 25.0000 C.3 62 HIE62 -0.1523 457 CG 43.6600 20.3490 25.5910 C.ar 62 HIE62 0.2784 458 ND1 44.2480 19.2180 25.0380 N.ar 62 HIE62 -0.4233 459 CE1 43.6590 18.2090 25.6900 C.ar 62 HIE62 0.0260 460 NE2 43.0400 18.6390 26.8300 N.ar 62 HIE62 -0.0980 461 CD2 42.8910 20.0430 26.6520 C.ar 62 HIE62 -0.2976 462 C 45.5160 23.2940 23.9460 C.2 62 HIE62 0.6624 463 O 45.0050 23.2770 22.8240 O.2 62 HIE62 -0.5290 464 N 46.2630 24.3060 24.4100 N.am 63 GLY63 -0.3743 465 CA 46.4840 25.4920 23.5450 C.3 63 GLY63 -0.1288 466 C 45.3800 26.5610 23.5200 C.2 63 GLY63 0.5806 467 O 45.2470 27.2380 22.4530 O.2 63 GLY63 -0.5092 468 N 44.6190 26.8340 24.5880 N.am 64 TYR64 -0.4876 469 CA 43.5960 27.8760 24.5720 C.3 64 TYR64 0.0096 470 CB 42.1820 27.3600 25.0760 C.3 64 TYR64 -0.0519 471 CG 41.4110 26.3140 24.3210 C.ar 64 TYR64 0.1126 472 CD1 41.6730 24.9610 24.4600 C.ar 64 TYR64 -0.1835 473 CE1 41.2160 24.0590 23.4830 C.ar 64 TYR64 -0.1818 474 CZ 40.3460 24.5110 22.4720 C.ar 64 TYR64 0.2063 475 OH 39.7060 23.7090 21.5300 O.3 64 TYR64 -0.4212 476 CE2 40.1570 25.8820 22.3470 C.ar 64 TYR64 -0.1818 477 CD2 40.7320 26.8340 23.2200 C.ar 64 TYR64 -0.1835 478 C 44.1490 29.0520 25.4370 C.2 64 TYR64 0.6223 479 O 45.0770 28.8320 26.2680 O.2 64 TYR64 -0.5266 480 N 43.6730 30.2870 25.2120 N.am 65 PRO65 -0.0881 481 CD 42.9500 30.7150 24.0360 C.3 65 PRO65 -0.0119 482 CG 43.0880 32.2090 24.0390 C.3 65 PRO65 0.0131 483 CB 43.1850 32.5900 25.5160 C.3 65 PRO65 -0.0034 484 CA 43.8640 31.3420 26.1930 C.3 65 PRO65 -0.0346 485 C 43.5240 31.1070 27.5910 C.2 65 PRO65 0.3337 486 O 42.7150 30.2040 27.7910 O.2 65 PRO65 -0.4346 487 N 43.8980 31.9950 28.5300 N.am 66 THR66 -0.2454 488 CA 43.8570 31.8430 29.9750 C.3 66 THR66 -0.2712 489 CB 45.0150 31.0200 30.4810 C.3 66 THR66 0.2379 490 CG2 44.7620 29.5190 30.2000 C.3 66 THR66 -0.1765 491 OG1 46.2250 31.5740 29.7870 O.3 66 THR66 -0.6019 492 C 43.7070 33.2040 30.6900 C.2 66 THR66 0.5599 493 O 43.2550 33.2270 31.8180 O.2 66 THR66 -0.5520 494 N 43.9570 34.3830 30.1290 N.am 67 ASP67 -0.5582 495 CA 43.7280 35.7400 30.6530 C.3 67 ASP67 0.0072 496 CB 44.3440 36.7040 29.7320 C.3 67 ASP67 -0.0476 497 CG 44.2290 38.1290 30.2780 C.2 67 ASP67 0.7452 498 OD1 43.2810 38.8580 29.9290 O.co2 67 ASP67 -0.7304 499 OD2 45.1710 38.5470 30.9020 O.co2 67 ASP67 -0.7304 500 C 42.1810 35.9100 30.8170 C.2 67 ASP67 0.4432 501 O 41.4180 35.9250 29.8300 O.2 67 ASP67 -0.5014 502 N 41.7090 36.1460 32.0300 N.am 68 HIE68 -0.5281 503 CA 40.3260 36.2660 32.4350 C.3 68 HIE68 0.0312 504 CB 39.7330 34.8820 32.5280 C.3 68 HIE68 -0.1523 505 CG 38.4760 34.6900 33.2740 C.ar 68 HIE68 0.2784 506 ND1 38.4740 34.4030 34.6670 N.ar 68 HIE68 -0.4233 507 CE1 37.1670 34.3120 34.9730 C.ar 68 HIE68 0.0260 508 NE2 36.3850 34.5840 33.9050 N.ar 68 HIE68 -0.0980 509 CD2 37.1710 34.8350 32.7860 C.ar 68 HIE68 -0.2976 510 C 40.1700 37.0300 33.7500 C.2 68 HIE68 0.6624 511 O 41.1880 37.1460 34.4850 O.2 68 HIE68 -0.5290 512 N 38.9410 37.4430 34.1100 N.am 69 ARG69 -0.3009 513 CA 38.5790 37.9290 35.5010 C.3 69 ARG69 -0.1314 514 CB 39.0390 39.3700 35.6800 C.3 69 ARG69 0.0367 515 CG 39.1560 39.7580 37.1940 C.3 69 ARG69 0.0125 516 CD 39.4140 41.2180 37.5480 C.3 69 ARG69 0.1263 517 NE 40.7100 41.6880 37.0220 N.pl3 69 ARG69 -0.4649 518 CZ 41.3220 42.8040 37.3860 C.2 69 ARG69 0.5655 519 NH1 40.9140 43.6050 38.3820 N.pl3 69 ARG69 -0.6858 520 NH2 42.5100 43.0940 36.9640 N.pl3 69 ARG69 -0.6858 521 C 37.0630 37.7900 35.8010 C.2 69 ARG69 0.7303 522 O 36.2970 38.2290 34.9590 O.2 69 ARG69 -0.5783 523 N 36.6370 37.2090 36.9020 N.am 70 ALA70 -0.4048 524 CA 35.1810 37.0610 37.2130 C.3 70 ALA70 -0.0277 525 CB 34.9930 36.5650 38.6970 C.3 70 ALA70 -0.2300 526 C 34.5220 38.3950 37.1110 C.2 70 ALA70 0.5702 527 O 35.0440 39.4030 37.5660 O.2 70 ALA70 -0.5551 528 N 33.3570 38.4840 36.5620 N.am 71 ALA71 -0.4048 529 CA 32.5710 39.6710 36.2690 C.3 71 ALA71 -0.0277 530 CB 32.7010 39.9690 34.7820 C.3 71 ALA71 -0.2300 531 C 31.1110 39.4520 36.7580 C.2 71 ALA71 0.5702 532 O 30.8110 38.2840 36.9710 O.2 71 ALA71 -0.5551 533 N 30.2480 40.4770 36.9290 N.am 72 GLN72 -0.3874 534 CA 28.8580 40.3630 37.2740 C.3 72 GLN72 0.0375 535 CB 28.6400 41.4890 38.3230 C.3 72 GLN72 -0.0321 536 CG 27.2550 41.5860 38.9680 C.3 72 GLN72 -0.0203 537 CD 27.1420 42.5550 40.1310 C.2 72 GLN72 0.6678 538 OE1 27.4450 43.7550 39.9900 O.2 72 GLN72 -0.6285 539 NE2 26.6090 42.1310 41.3150 N.am 72 GLN72 -0.8834 540 C 27.9620 40.5750 36.0520 C.2 72 GLN72 0.4186 541 O 28.1910 41.4590 35.2340 O.2 72 GLN72 -0.5653 542 N 26.9510 39.7280 35.9480 N.am 73 VAL73 -0.4501 543 CA 25.9080 39.8880 34.8970 C.3 73 VAL73 -0.0519 544 CB 25.0020 38.6790 34.8260 C.3 73 VAL73 0.3952 545 CG1 23.7580 38.9450 33.9570 C.3 73 VAL73 -0.0901 546 CG2 25.7750 37.4050 34.5260 C.3 73 VAL73 -0.0901 547 C 25.1130 41.2510 34.9090 C.2 73 VAL73 0.4474 548 O 24.5230 41.5710 35.9330 O.2 73 VAL73 -0.4046 549 N 25.2300 42.0930 33.8400 N.am 74 GLY74 -0.3743 550 CA 24.7190 43.4480 33.7890 C.3 74 GLY74 -0.1288 551 C 24.4030 43.8540 32.3470 C.2 74 GLY74 0.5806 552 O 24.1720 42.9970 31.4800 O.2 74 GLY74 -0.5092 553 N 24.1640 45.1390 32.0460 N.am 75 THR75 -0.2454 554 CA 23.5200 45.5580 30.7740 C.3 75 THR75 -0.2712 555 CB 23.3390 47.0970 30.8430 C.3 75 THR75 0.2379 556 CG2 22.7420 47.7820 29.6550 C.3 75 THR75 -0.1765 557 OG1 22.5170 47.4320 31.9890 O.3 75 THR75 -0.6019 558 C 24.2770 45.1760 29.5450 C.2 75 THR75 0.5599 559 O 23.7320 44.7320 28.4960 O.2 75 THR75 -0.5520 560 N 25.6030 45.1960 29.6290 N.am 76 GLU76 -0.4234 561 CA 26.5160 44.6140 28.6910 C.3 76 GLU76 0.0316 562 CB 27.9810 44.7980 29.1260 C.3 76 GLU76 0.0748 563 CG 28.9850 44.3810 28.1110 C.3 76 GLU76 -0.0339 564 CD 29.3230 45.4160 26.9920 C.2 76 GLU76 0.7652 565 OE1 30.4100 45.9400 26.9460 O.co2 76 GLU76 -0.8240 566 OE2 28.4720 45.9510 26.2640 O.co2 76 GLU76 -0.8240 567 C 26.1930 43.1440 28.3720 C.2 76 GLU76 0.4697 568 O 26.4530 42.7110 27.2270 O.2 76 GLU76 -0.5925 569 N 25.6740 42.2930 29.2430 N.am 77 HIE77 -0.5281 570 CA 25.5750 40.8410 29.1010 C.3 77 HIE77 0.0312 571 CB 26.0050 40.1570 30.3750 C.3 77 HIE77 -0.1523 572 CG 27.4700 40.3840 30.7540 C.ar 77 HIE77 0.2784 573 ND1 27.7750 41.1930 31.7990 N.ar 77 HIE77 -0.4233 574 CE1 29.1060 41.3050 31.8710 C.ar 77 HIE77 0.0260 575 NE2 29.6710 40.3990 31.0170 N.ar 77 HIE77 -0.0980 576 CD2 28.6130 39.9000 30.2540 C.ar 77 HIE77 -0.2976 577 C 24.2180 40.4590 28.6500 C.2 77 HIE77 0.6624 578 O 24.1020 39.3510 28.0840 O.2 77 HIE77 -0.5290 579 N 23.2630 41.3680 28.8730 N.am 78 LEU78 -0.3552 580 CA 21.7950 41.1580 28.7530 C.3 78 LEU78 -0.1015 581 CB 21.0760 41.9080 29.9350 C.3 78 LEU78 -0.1444 582 CG 21.3990 41.2450 31.3310 C.3 78 LEU78 0.1920 583 CD1 20.8770 42.1020 32.4180 C.3 78 LEU78 -0.1230 584 CD2 20.7920 39.8480 31.3220 C.3 78 LEU78 -0.1230 585 C 21.3230 41.6410 27.4170 C.2 78 LEU78 0.5735 586 O 20.2640 41.2450 26.9180 O.2 78 LEU78 -0.5578 587 N 22.1770 42.3240 26.6900 N.am 79 ALA79 -0.4048 588 CA 22.0390 42.6170 25.2640 C.3 79 ALA79 -0.0277 589 CB 22.8500 43.8750 24.9540 C.3 79 ALA79 -0.2300 590 C 22.4230 41.3890 24.3560 C.2 79 ALA79 0.5702 591 O 22.2250 41.3530 23.1480 O.2 79 ALA79 -0.5551 592 N 23.1150 40.4220 24.9570 N.am 80 ALA80 -0.4048 593 CA 23.4140 39.2230 24.3330 C.3 80 ALA80 -0.0277 594 CB 23.9160 38.3200 25.4120 C.3 80 ALA80 -0.2300 595 C 22.2170 38.6750 23.4860 C.2 80 ALA80 0.5702 596 O 21.0970 38.6060 23.9390 O.2 80 ALA80 -0.5551 597 N 22.4930 38.1280 22.2940 N.am 81 ASP81 -0.5582 598 CA 21.5350 37.1910 21.6360 C.3 81 ASP81 0.0072 599 CB 22.0730 36.9290 20.2800 C.3 81 ASP81 -0.0476 600 CG 21.9700 38.1710 19.3940 C.2 81 ASP81 0.7452 601 OD1 21.0360 38.2550 18.5670 O.co2 81 ASP81 -0.7304 602 OD2 22.8510 39.0570 19.4390 O.co2 81 ASP81 -0.7304 603 C 21.3250 35.8820 22.3460 C.2 81 ASP81 0.4432 604 O 20.2900 35.2590 22.1510 O.2 81 ASP81 -0.5014 605 N 22.2100 35.6200 23.3430 N.am 82 LEU82 -0.3552 606 CA 22.1640 34.3680 24.0790 C.3 82 LEU82 -0.1015 607 CB 22.7740 33.2250 23.1950 C.3 82 LEU82 -0.1444 608 CG 22.4540 31.7830 23.6830 C.3 82 LEU82 0.1920 609 CD1 21.0130 31.3130 23.3960 C.3 82 LEU82 -0.1230 610 CD2 23.4260 30.8740 22.9180 C.3 82 LEU82 -0.1230 611 C 22.7350 34.5390 25.5050 C.2 82 LEU82 0.5735 612 O 23.8270 35.0900 25.8030 O.2 82 LEU82 -0.5578 613 N 22.0080 33.8800 26.3970 N.am 83 LEU83 -0.3552 614 CA 22.2520 33.6850 27.8240 C.3 83 LEU83 -0.1015 615 CB 21.1030 34.2250 28.6840 C.3 83 LEU83 -0.1444 616 CG 20.7110 35.6890 28.4630 C.3 83 LEU83 0.1920 617 CD1 21.9430 36.7170 28.4890 C.3 83 LEU83 -0.1230 618 CD2 19.8760 35.9590 27.2240 C.3 83 LEU83 -0.1230 619 C 22.4350 32.1590 27.8320 C.2 83 LEU83 0.5735 620 O 21.5000 31.3920 27.9940 O.2 83 LEU83 -0.5578 621 N 23.6610 31.6820 27.8190 N.am 84 VAL84 -0.4501 622 CA 24.0060 30.2370 28.0330 C.3 84 VAL84 -0.0519 623 CB 25.2910 29.9340 27.1770 C.3 84 VAL84 0.3952 624 CG1 25.5200 28.4310 27.3770 C.3 84 VAL84 -0.0901 625 CG2 25.1630 30.2320 25.7040 C.3 84 VAL84 -0.0901 626 C 24.1390 29.9360 29.4890 C.2 84 VAL84 0.4474 627 O 25.1210 30.3770 30.1300 O.2 84 VAL84 -0.4046 628 N 23.1640 29.1920 30.0430 N.am 85 ALA85 -0.4048 629 CA 23.3460 28.4910 31.3580 C.3 85 ALA85 -0.0277 630 CB 21.9360 28.0450 31.7710 C.3 85 ALA85 -0.2300 631 C 24.3690 27.4070 31.1930 C.2 85 ALA85 0.5702 632 O 24.4730 26.7270 30.1760 O.2 85 ALA85 -0.5551 633 N 25.1240 27.1380 32.2680 N.am 86 LEU86 -0.3552 634 CA 25.9630 25.9190 32.3950 C.3 86 LEU86 -0.1015 635 CB 27.3200 26.3610 32.9620 C.3 86 LEU86 -0.1444 636 CG 28.4060 26.8530 31.9250 C.3 86 LEU86 0.1920 637 CD1 28.9290 25.6650 31.1420 C.3 86 LEU86 -0.1230 638 CD2 27.8540 27.9510 31.0210 C.3 86 LEU86 -0.1230 639 C 25.2840 24.7680 33.2030 C.2 86 LEU86 0.5735 640 O 25.5360 23.6260 32.9170 O.2 86 LEU86 -0.5578 641 N 24.4030 25.0770 34.1420 N.am 87 ASP87 -0.5582 642 CA 23.5660 24.0470 34.8010 C.3 87 ASP87 0.0072 643 CB 24.0690 23.5810 36.1750 C.3 87 ASP87 -0.0476 644 CG 24.1430 24.6760 37.2650 C.2 87 ASP87 0.7452 645 OD1 23.0660 25.0560 37.8480 O.co2 87 ASP87 -0.7304 646 OD2 25.2580 25.0740 37.5930 O.co2 87 ASP87 -0.7304 647 C 22.2000 24.7700 34.9470 C.2 87 ASP87 0.4432 648 O 22.0280 25.9370 34.5970 O.2 87 ASP87 -0.5014 649 N 21.2200 24.0270 35.3850 N.am 88 ARG88 -0.3009 650 CA 19.7810 24.3810 35.4830 C.3 88 ARG88 -0.1314 651 CB 18.9840 23.1910 36.0600 C.3 88 ARG88 0.0367 652 CG 19.3260 23.1110 37.5530 C.3 88 ARG88 0.0125 653 CD 18.5270 21.9710 38.1530 C.3 88 ARG88 0.1263 654 NE 17.0400 22.2660 38.2430 N.pl3 88 ARG88 -0.4649 655 CZ 16.1860 21.7400 39.0280 C.2 88 ARG88 0.5655 656 NH1 16.4750 20.9570 40.0880 N.pl3 88 ARG88 -0.6858 657 NH2 14.9230 22.0170 38.6870 N.pl3 88 ARG88 -0.6858 658 C 19.4680 25.6110 36.2560 C.2 88 ARG88 0.7303 659 O 18.3890 26.1830 35.9210 O.2 88 ARG88 -0.5783 660 N 20.3080 26.0510 37.1990 N.am 89 ASN89 -0.4301 661 CA 20.0340 27.2210 38.0180 C.3 89 ASN89 0.0446 662 CB 20.9710 27.1050 39.2560 C.3 89 ASN89 -0.0936 663 CG 20.7320 28.2830 40.1930 C.2 89 ASN89 0.5835 664 OD1 21.7280 28.9700 40.4300 O.2 89 ASN89 -0.5268 665 ND2 19.5030 28.5240 40.6080 N.am 89 ASN89 -0.7817 666 C 20.1450 28.6480 37.3800 C.2 89 ASN89 0.6171 667 O 19.1860 29.4480 37.4020 O.2 89 ASN89 -0.5239 668 N 21.1770 28.7970 36.5820 N.am 90 HIE90 -0.5281 669 CA 21.3870 30.1090 35.8680 C.3 90 HIE90 0.0312 670 CB 22.6820 30.1550 35.0560 C.3 90 HIE90 -0.1523 671 CG 23.8100 29.3430 35.6990 C.ar 90 HIE90 0.2784 672 ND1 24.4890 28.2100 35.1760 N.ar 90 HIE90 -0.4233 673 CE1 25.2390 27.7000 36.1920 C.ar 90 HIE90 0.0260 674 NE2 25.0390 28.4040 37.3040 N.ar 90 HIE90 -0.0980 675 CD2 24.1560 29.4600 37.0280 C.ar 90 HIE90 -0.2976 676 C 20.1520 30.5060 34.9770 C.2 90 HIE90 0.6624 677 O 19.6560 31.6440 34.9790 O.2 90 HIE90 -0.5290 678 N 19.6290 29.4710 34.2990 N.am 91 ALA91 -0.4048 679 CA 18.3850 29.5760 33.4630 C.3 91 ALA91 -0.0277 680 CB 18.1450 28.1100 32.9960 C.3 91 ALA91 -0.2300 681 C 17.1750 30.0590 34.3570 C.2 91 ALA91 0.5702 682 O 16.4890 31.0080 33.9450 O.2 91 ALA91 -0.5551 683 N 16.8870 29.4270 35.4900 N.am 92 ARG92 -0.3009 684 CA 15.7760 29.8490 36.3500 C.3 92 ARG92 -0.1314 685 CB 15.6730 28.9390 37.5050 C.3 92 ARG92 0.0367 686 CG 14.3760 29.2110 38.2580 C.3 92 ARG92 0.0125 687 CD 14.0850 28.1140 39.3360 C.3 92 ARG92 0.1263 688 NE 15.2490 28.0070 40.2320 N.pl3 92 ARG92 -0.4649 689 CZ 15.6160 28.7250 41.2630 C.2 92 ARG92 0.5655 690 NH1 15.1090 29.9000 41.5500 N.pl3 92 ARG92 -0.6858 691 NH2 16.5420 28.1710 42.0160 N.pl3 92 ARG92 -0.6858 692 C 15.8460 31.3410 36.8000 C.2 92 ARG92 0.7303 693 O 14.8700 32.0920 36.8650 O.2 92 ARG92 -0.5783 694 N 17.0790 31.7600 37.0550 N.am 93 LEU93 -0.3552 695 CA 17.5110 33.0590 37.6260 C.3 93 LEU93 -0.1015 696 CB 18.8670 32.9500 38.2750 C.3 93 LEU93 -0.1444 697 CG 18.9270 32.1320 39.5470 C.3 93 LEU93 0.1920 698 CD1 20.3380 31.9700 40.1640 C.3 93 LEU93 -0.1230 699 CD2 17.9290 32.5710 40.5670 C.3 93 LEU93 -0.1230 700 C 17.5120 34.2100 36.5700 C.2 93 LEU93 0.5735 701 O 17.0670 35.3150 36.8360 O.2 93 LEU93 -0.5578 702 N 17.7680 33.8300 35.3160 N.am 94 LEU94 -0.3552 703 CA 17.4120 34.6950 34.1580 C.3 94 LEU94 -0.1015 704 CB 18.2030 34.1710 32.9810 C.3 94 LEU94 -0.1444 705 CG 19.7410 34.1800 33.1040 C.3 94 LEU94 0.1920 706 CD1 20.3190 33.3440 31.9290 C.3 94 LEU94 -0.1230 707 CD2 20.1860 35.6720 32.9250 C.3 94 LEU94 -0.1230 708 C 15.9350 34.7310 33.9240 C.2 94 LEU94 0.5735 709 O 15.4190 35.8390 33.6330 O.2 94 LEU94 -0.5578 710 N 15.2280 33.5880 33.9430 N.am 95 ARG95 -0.3009 711 CA 13.7110 33.5840 33.7850 C.3 95 ARG95 -0.1314 712 CB 13.1880 32.1370 33.6810 C.3 95 ARG95 0.0367 713 CG 11.6530 32.0080 33.8430 C.3 95 ARG95 0.0125 714 CD 10.8870 32.5190 32.6920 C.3 95 ARG95 0.1263 715 NE 9.4200 32.3720 32.8410 N.pl3 95 ARG95 -0.4649 716 CZ 8.6670 33.2750 33.3340 C.2 95 ARG95 0.5655 717 NH1 9.1840 34.3720 33.9170 N.pl3 95 ARG95 -0.6858 718 NH2 7.3750 33.0120 33.3830 N.pl3 95 ARG95 -0.6858 719 C 13.0340 34.4450 34.8290 C.2 95 ARG95 0.7303 720 O 12.0150 35.1090 34.6720 O.2 95 ARG95 -0.5783 721 N 13.7120 34.6850 35.9790 N.am 96 GLN96 -0.3874 722 CA 13.3070 35.5940 37.0900 C.3 96 GLN96 0.0375 723 CB 13.7820 34.9930 38.4490 C.3 96 GLN96 -0.0321 724 CG 12.9140 33.7490 38.8560 C.3 96 GLN96 -0.0203 725 CD 13.4710 33.1550 40.1280 C.2 96 GLN96 0.6678 726 OE1 14.2460 32.2140 40.1880 O.2 96 GLN96 -0.6285 727 NE2 12.8640 33.5130 41.2310 N.am 96 GLN96 -0.8834 728 C 13.8070 37.0360 36.9640 C.2 96 GLN96 0.4186 729 O 13.0050 37.9330 37.2620 O.2 96 GLN96 -0.5653 730 N 14.9920 37.3720 36.4390 N.am 97 LEU97 -0.3552 731 CA 15.5310 38.7120 36.5420 C.3 97 LEU97 -0.1015 732 CB 16.9830 38.7120 36.0370 C.3 97 LEU97 -0.1444 733 CG 17.7080 40.0460 36.0220 C.3 97 LEU97 0.1920 734 CD1 17.9440 40.4890 37.5230 C.3 97 LEU97 -0.1230 735 CD2 19.0550 39.9070 35.2690 C.3 97 LEU97 -0.1230 736 C 14.7010 39.6810 35.7100 C.2 97 LEU97 0.5735 737 O 14.3600 40.7780 36.0930 O.2 97 LEU97 -0.5578 738 N 14.3910 39.1610 34.4980 N.am 98 GLY98 -0.3743 739 CA 13.8400 39.8910 33.4220 C.3 98 GLY98 -0.1288 740 C 13.9560 39.2060 31.9920 C.2 98 GLY98 0.5806 741 O 13.3630 39.6480 31.0110 O.2 98 GLY98 -0.5092 742 N 14.6030 38.0090 31.9220 N.am 99 VAL99 -0.4501 743 CA 14.7860 37.4230 30.6020 C.3 99 VAL99 -0.0519 744 CB 16.1050 36.6850 30.5210 C.3 99 VAL99 0.3952 745 CG1 16.3890 36.0370 29.1450 C.3 99 VAL99 -0.0901 746 CG2 17.3450 37.5790 30.9300 C.3 99 VAL99 -0.0901 747 C 13.6260 36.4950 30.2820 C.2 99 VAL99 0.4474 748 O 13.2580 35.7190 31.1360 O.2 99 VAL99 -0.4046 749 N 13.0530 36.4860 29.0350 N.am 100 GLU100 -0.4234 750 CA 12.0590 35.5010 28.5920 C.3 100 GLU100 0.0316 751 CB 11.2010 36.0300 27.4240 C.3 100 GLU100 0.0748 752 CG 11.8290 36.5230 26.1260 C.3 100 GLU100 -0.0339 753 CD 12.2660 38.0560 26.1160 C.2 100 GLU100 0.7652 754 OE1 13.2680 38.4170 26.8660 O.co2 100 GLU100 -0.8240 755 OE2 11.5900 38.8790 25.4820 O.co2 100 GLU100 -0.8240 756 C 12.6710 34.1580 28.2320 C.2 100 GLU100 0.4697 757 O 13.6000 34.0730 27.4680 O.2 100 GLU100 -0.5925 758 N 12.0970 33.0580 28.7500 N.am 101 ALA101 -0.4048 759 CA 12.5610 31.6830 28.4290 C.3 101 ALA101 -0.0277 760 CB 11.3830 30.7100 28.6440 C.3 101 ALA101 -0.2300 761 C 13.2990 31.4120 27.0440 C.2 101 ALA101 0.5702 762 O 14.3390 30.7410 26.9730 O.2 101 ALA101 -0.5551 763 N 12.6130 31.8830 25.9610 N.am 102 ALA102 -0.4048 764 CA 13.1300 31.6030 24.5880 C.3 102 ALA102 -0.0277 765 CB 12.0780 32.3330 23.6970 C.3 102 ALA102 -0.2300 766 C 14.5540 32.1180 24.2980 C.2 102 ALA102 0.5702 767 O 15.2260 31.6010 23.4130 O.2 102 ALA102 -0.5551 768 N 15.1170 33.0040 25.1410 N.am 103 ARG103 -0.3009 769 CA 16.5150 33.5000 25.1140 C.3 103 ARG103 -0.1314 770 CB 16.4730 34.9770 25.4860 C.3 103 ARG103 0.0367 771 CG 15.8070 35.9370 24.4620 C.3 103 ARG103 0.0125 772 CD 15.5440 37.3140 25.0480 C.3 103 ARG103 0.1263 773 NE 16.7310 38.1210 25.1940 N.pl3 103 ARG103 -0.4649 774 CZ 16.8460 39.1030 26.0680 C.2 103 ARG103 0.5655 775 NH1 15.8390 39.5000 26.8830 N.pl3 103 ARG103 -0.6858 776 NH2 18.0940 39.5560 26.2400 N.pl3 103 ARG103 -0.6858 777 C 17.5230 32.7130 25.9790 C.2 103 ARG103 0.7303 778 O 18.7550 32.9170 25.8430 O.2 103 ARG103 -0.5783 779 N 17.0390 31.8750 26.8800 N.am 104 VAL104 -0.4501 780 CA 17.7710 31.0660 27.7830 C.3 104 VAL104 -0.0519 781 CB 16.9970 30.8160 29.0900 C.3 104 VAL104 0.3952 782 CG1 17.6630 29.8210 30.1180 C.3 104 VAL104 -0.0901 783 CG2 16.7210 32.1150 29.8550 C.3 104 VAL104 -0.0901 784 C 18.0010 29.6990 27.1270 C.2 104 VAL104 0.4474 785 O 16.9840 29.0440 26.7610 O.2 104 VAL104 -0.4046 786 N 19.2930 29.2600 27.0690 N.am 105 ARG105 -0.3009 787 CA 19.6320 27.8800 26.6990 C.3 105 ARG105 -0.1314 788 CB 19.8830 27.8030 25.2350 C.3 105 ARG105 0.0367 789 CG 18.7160 27.8100 24.3030 C.3 105 ARG105 0.0125 790 CD 19.0500 27.4690 22.8690 C.3 105 ARG105 0.1263 791 NE 19.5500 26.1090 22.7020 N.pl3 105 ARG105 -0.4649 792 CZ 19.6730 25.3360 21.5830 C.2 105 ARG105 0.5655 793 NH1 19.4750 25.7930 20.3200 N.pl3 105 ARG105 -0.6858 794 NH2 20.0990 24.1160 21.6850 N.pl3 105 ARG105 -0.6858 795 C 20.5670 27.2800 27.5640 C.2 105 ARG105 0.7303 796 O 21.6190 27.8570 27.9640 O.2 105 ARG105 -0.5783 797 N 20.3400 25.9790 27.8840 N.am 106 MET106 -0.3949 798 CA 21.2510 25.1320 28.7010 C.3 106 MET106 -0.0877 799 CB 20.3700 23.8730 29.1050 C.3 106 MET106 0.0192 800 CG 19.5580 24.0170 30.4310 C.3 106 MET106 -0.2082 801 SD 18.2130 25.1960 30.3220 S.3 106 MET106 -0.2120 802 CE 17.6560 24.9320 32.0060 C.3 106 MET106 -0.2847 803 C 22.3770 24.6480 27.6650 C.2 106 MET106 0.5997 804 O 22.0460 24.1000 26.6210 O.2 106 MET106 -0.5664 805 N 23.6910 24.8720 27.9730 N.am 107 LEU107 -0.3552 806 CA 24.8600 24.4390 27.1210 C.3 107 LEU107 -0.1015 807 CB 26.2190 24.7970 27.7510 C.3 107 LEU107 -0.1444 808 CG 27.5020 24.8610 26.9030 C.3 107 LEU107 0.1920 809 CD1 27.3120 25.5220 25.5550 C.3 107 LEU107 -0.1230 810 CD2 28.7030 25.3790 27.7050 C.3 107 LEU107 -0.1230 811 C 24.7160 22.9820 26.5770 C.2 107 LEU107 0.5735 812 O 24.9920 22.8180 25.4310 O.2 107 LEU107 -0.5578 813 N 24.3140 22.0110 27.3810 N.am 108 ARG108 -0.3009 814 CA 24.1190 20.6120 26.9310 C.3 108 ARG108 -0.1314 815 CB 24.2090 19.6070 28.1010 C.3 108 ARG108 0.0367 816 CG 25.4950 19.8010 28.8670 C.3 108 ARG108 0.0125 817 CD 25.5910 18.8170 30.0170 C.3 108 ARG108 0.1263 818 NE 25.7990 17.5150 29.4290 N.pl3 108 ARG108 -0.4649 819 CZ 25.9800 16.3060 29.9750 C.2 108 ARG108 0.5655 820 NH1 25.8160 16.0470 31.3190 N.pl3 108 ARG108 -0.6858 821 NH2 26.2740 15.2740 29.1820 N.pl3 108 ARG108 -0.6858 822 C 22.9530 20.3930 25.9730 C.2 108 ARG108 0.7303 823 O 22.8040 19.3400 25.3130 O.2 108 ARG108 -0.5783 824 N 22.1630 21.4270 25.7370 N.am 109 SER109 -0.5414 825 CA 21.1060 21.4130 24.7080 C.3 109 SER109 0.1181 826 CB 20.0790 22.5370 24.9210 C.3 109 SER109 0.1470 827 OG 20.7110 23.7060 24.4910 O.3 109 SER109 -0.6403 828 C 21.6620 21.3880 23.2880 C.2 109 SER109 0.4834 829 O 20.9580 20.8700 22.4320 O.2 109 SER109 -0.5808 830 N 22.9430 21.8600 23.0980 N.am 110 PHE110 -0.3713 831 CA 23.5260 22.1330 21.8390 C.3 110 PHE110 -0.0301 832 CB 24.5700 23.3030 21.9040 C.3 110 PHE110 -0.0987 833 CG 23.8950 24.6870 22.0490 C.ar 110 PHE110 0.0213 834 CD1 23.8130 25.2310 23.3350 C.ar 110 PHE110 -0.0831 835 CE1 23.1850 26.4910 23.5380 C.ar 110 PHE110 -0.1570 836 CZ 22.6360 27.1750 22.4450 C.ar 110 PHE110 -0.0998 837 CE2 22.7470 26.6260 21.1800 C.ar 110 PHE110 -0.1570 838 CD2 23.3590 25.3660 20.9500 C.ar 110 PHE110 -0.0831 839 C 24.0880 20.7740 21.2020 C.2 110 PHE110 0.5480 840 O 23.9490 20.5770 19.9760 O.2 110 PHE110 -0.5068 841 N 24.6380 19.9230 22.0460 N.am 111 ASP111 -0.5582 842 CA 25.0520 18.5020 21.7610 C.3 111 ASP111 0.0072 843 CB 25.3940 17.9140 23.1460 C.3 111 ASP111 -0.0476 844 CG 26.2480 16.6220 22.9790 C.2 111 ASP111 0.7452 845 OD1 27.0340 16.3860 23.8950 O.co2 111 ASP111 -0.7304 846 OD2 26.0980 15.8300 22.0110 O.co2 111 ASP111 -0.7304 847 C 23.9460 17.7170 20.9730 C.2 111 ASP111 0.4432 848 O 22.8600 17.5050 21.5140 O.2 111 ASP111 -0.5014 849 N 24.1880 17.3530 19.6940 N.am 112 PRO112 -0.0881 850 CD 25.4140 17.4590 18.8660 C.3 112 PRO112 -0.0119 851 CG 25.2820 16.5070 17.6910 C.3 112 PRO112 0.0131 852 CB 23.7550 16.5400 17.4820 C.3 112 PRO112 -0.0034 853 CA 23.1180 16.7440 18.8610 C.3 112 PRO112 -0.0346 854 C 22.5660 15.4230 19.4030 C.2 112 PRO112 0.3337 855 O 21.5400 14.9420 18.9150 O.2 112 PRO112 -0.4346 856 N 23.2330 14.8580 20.4090 N.am 113 ARG113 -0.3009 857 CA 22.8080 13.7140 21.1510 C.3 113 ARG113 -0.1314 858 CB 24.1090 12.9730 21.7610 C.3 113 ARG113 0.0367 859 CG 25.1390 12.6240 20.6750 C.3 113 ARG113 0.0125 860 CD 26.4630 12.1630 21.3020 C.3 113 ARG113 0.1263 861 NE 27.0930 13.2350 22.1560 N.pl3 113 ARG113 -0.4649 862 CZ 27.9800 12.9690 23.0510 C.2 113 ARG113 0.5655 863 NH1 28.5380 11.8050 23.1810 N.pl3 113 ARG113 -0.6858 864 NH2 28.3430 13.9060 23.9210 N.pl3 113 ARG113 -0.6858 865 C 21.7720 13.8520 22.3180 C.2 113 ARG113 0.7303 866 O 21.4500 12.8530 22.9980 O.2 113 ARG113 -0.5783 867 N 21.3380 15.0970 22.5150 N.am 114 SER114 -0.5414 868 CA 20.4440 15.6330 23.5400 C.3 114 SER114 0.1181 869 CB 20.8730 17.0760 24.0180 C.3 114 SER114 0.1470 870 OG 22.0610 16.8850 24.7640 O.3 114 SER114 -0.6403 871 C 18.9230 15.5460 23.1050 C.2 114 SER114 0.4834 872 O 18.5720 15.9790 22.0080 O.2 114 SER114 -0.5808 873 N 18.0710 15.0600 24.0560 N.am 115 GLY115 -0.3743 874 CA 16.6780 15.0340 23.8930 C.3 115 GLY115 -0.1288 875 C 15.9350 16.3700 24.2630 C.2 115 GLY115 0.5806 876 O 16.5730 17.4230 24.1520 O.2 115 GLY115 -0.5092 877 N 14.6680 16.2630 24.6230 N.am 116 THR116 -0.2454 878 CA 13.8260 17.3380 25.1540 C.3 116 THR116 -0.2712 879 CB 12.3450 17.1960 24.7600 C.3 116 THR116 0.2379 880 CG2 11.4680 18.3340 25.1240 C.3 116 THR116 -0.1765 881 OG1 12.2170 16.9550 23.3350 O.3 116 THR116 -0.6019 882 C 14.0370 17.4810 26.6470 C.2 116 THR116 0.5599 883 O 14.0050 18.5530 27.1590 O.2 116 THR116 -0.5520 884 N 14.4430 16.4090 27.4040 N.am 117 HIE117 -0.5281 885 CA 14.9900 16.6180 28.7760 C.3 117 HIE117 0.0312 886 CB 14.8850 15.3130 29.5110 C.3 117 HIE117 -0.1523 887 CG 15.3210 15.5690 30.9200 C.ar 117 HIE117 0.2784 888 ND1 14.5260 16.2150 31.9020 N.ar 117 HIE117 -0.4233 889 CE1 15.3430 16.4230 32.9560 C.ar 117 HIE117 0.0260 890 NE2 16.5860 15.9730 32.6690 N.ar 117 HIE117 -0.0980 891 CD2 16.6160 15.4260 31.3840 C.ar 117 HIE117 -0.2976 892 C 16.4260 17.1310 28.8270 C.2 117 HIE117 0.6624 893 O 17.3210 16.6090 28.1570 O.2 117 HIE117 -0.5290 894 N 16.6950 18.1930 29.5600 N.am 118 ALA118 -0.4048 895 CA 17.9850 18.8720 29.5790 C.3 118 ALA118 -0.0277 896 CB 17.7120 20.3720 29.9680 C.3 118 ALA118 -0.2300 897 C 19.0590 18.2580 30.6100 C.2 118 ALA118 0.5702 898 O 18.7800 17.8800 31.7490 O.2 118 ALA118 -0.5551 899 N 20.3460 18.3550 30.1710 N.am 119 LEU119 -0.3552 900 CA 21.4520 17.9230 31.0470 C.3 119 LEU119 -0.1015 901 CB 22.4020 17.0520 30.2300 C.3 119 LEU119 -0.1444 902 CG 21.6660 15.7620 29.7590 C.3 119 LEU119 0.1920 903 CD1 22.5580 15.1200 28.6480 C.3 119 LEU119 -0.1230 904 CD2 21.4590 14.7520 30.9520 C.3 119 LEU119 -0.1230 905 C 22.2250 19.0850 31.5450 C.2 119 LEU119 0.5735 906 O 22.3170 20.1090 30.8240 O.2 119 LEU119 -0.5578 907 N 22.8220 18.9370 32.7340 N.am 120 ASP120 -0.5582 908 CA 23.7200 19.9390 33.3420 C.3 120 ASP120 0.0072 909 CB 23.5140 20.0170 34.8430 C.3 120 ASP120 -0.0476 910 CG 21.9860 20.3670 35.1540 C.2 120 ASP120 0.7452 911 OD1 21.4480 21.4020 34.6830 O.co2 120 ASP120 -0.7304 912 OD2 21.3910 19.5050 35.8870 O.co2 120 ASP120 -0.7304 913 C 25.2150 19.7460 33.0830 C.2 120 ASP120 0.4432 914 O 25.6110 18.6170 33.0190 O.2 120 ASP120 -0.5014 915 N 25.9950 20.8440 33.0800 N.am 121 VAL121 -0.4501 916 CA 27.4570 20.7910 33.0010 C.3 121 VAL121 -0.0519 917 CB 28.1570 21.8660 32.0920 C.3 121 VAL121 0.3952 918 CG1 29.6510 21.6070 31.9530 C.3 121 VAL121 -0.0901 919 CG2 27.6020 21.8970 30.6640 C.3 121 VAL121 -0.0901 920 C 27.9480 20.9610 34.4450 C.2 121 VAL121 0.4474 921 O 27.8770 22.0660 34.9660 O.2 121 VAL121 -0.4046 922 N 28.3840 19.8940 35.1270 N.am 122 GLU122 -0.4234 923 CA 28.6240 19.8500 36.5650 C.3 122 GLU122 0.0316 924 CB 28.6470 18.3130 36.9950 C.3 122 GLU122 0.0748 925 CG 27.3950 17.5120 36.6510 C.3 122 GLU122 -0.0339 926 CD 27.4250 16.1010 37.2550 C.2 122 GLU122 0.7652 927 OE1 28.2910 15.3240 36.9230 O.co2 122 GLU122 -0.8240 928 OE2 26.4850 15.7640 38.0360 O.co2 122 GLU122 -0.8240 929 C 29.8790 20.6270 37.0780 C.2 122 GLU122 0.4697 930 O 30.9380 20.6680 36.5180 O.2 122 GLU122 -0.5925 931 N 29.7250 20.9820 38.3430 N.am 123 ASP123 -0.5582 932 CA 30.7490 21.7680 39.0460 C.3 123 ASP123 0.0072 933 CB 30.0980 22.0770 40.4050 C.3 123 ASP123 -0.0476 934 CG 31.0870 22.8630 41.2550 C.2 123 ASP123 0.7452 935 OD1 31.6300 22.2660 42.2560 O.co2 123 ASP123 -0.7304 936 OD2 31.3010 24.0830 40.9860 O.co2 123 ASP123 -0.7304 937 C 32.0980 20.9690 39.2180 C.2 123 ASP123 0.4432 938 O 32.1150 19.8330 39.7620 O.2 123 ASP123 -0.5014 939 N 33.2180 21.5600 38.7390 N.am 124 PRO124 -0.0881 940 CD 33.3160 22.7550 37.9310 C.3 124 PRO124 -0.0119 941 CG 34.7920 22.8900 37.5450 C.3 124 PRO124 0.0131 942 CB 35.3390 21.4910 37.8190 C.3 124 PRO124 -0.0034 943 CA 34.4950 20.9330 38.9050 C.3 124 PRO124 -0.0346 944 C 35.2360 21.2770 40.2250 C.2 124 PRO124 0.3337 945 O 36.2950 20.7390 40.5640 O.2 124 PRO124 -0.4346 946 N 34.7750 22.3730 40.9070 N.am 125 TYR125 -0.4876 947 CA 35.6670 23.0770 41.8500 C.3 125 TYR125 0.0096 948 CB 35.1120 24.4840 42.1210 C.3 125 TYR125 -0.0519 949 CG 36.0220 25.3260 43.0970 C.ar 125 TYR125 0.1126 950 CD1 37.0740 26.1270 42.5580 C.ar 125 TYR125 -0.1835 951 CE1 37.8940 26.9200 43.3930 C.ar 125 TYR125 -0.1818 952 CZ 37.7330 26.8740 44.8000 C.ar 125 TYR125 0.2063 953 OH 38.6250 27.5650 45.5570 O.3 125 TYR125 -0.4212 954 CE2 36.8420 25.8790 45.3340 C.ar 125 TYR125 -0.1818 955 CD2 35.9190 25.2830 44.4990 C.ar 125 TYR125 -0.1835 956 C 35.9850 22.3250 43.2000 C.2 125 TYR125 0.6223 957 O 37.0390 22.4510 43.8010 O.2 125 TYR125 -0.5266 958 N 35.1010 21.5020 43.7010 N.am 126 TYR126 -0.4876 959 CA 35.2250 20.5970 44.8370 C.3 126 TYR126 0.0096 960 CB 33.9330 20.6850 45.6090 C.3 126 TYR126 -0.0519 961 CG 33.6630 22.0730 46.2290 C.ar 126 TYR126 0.1126 962 CD1 32.7420 22.9660 45.6210 C.ar 126 TYR126 -0.1835 963 CE1 32.6740 24.2980 46.2360 C.ar 126 TYR126 -0.1818 964 CZ 33.4360 24.6510 47.3740 C.ar 126 TYR126 0.2063 965 OH 33.3450 25.9660 47.8590 O.3 126 TYR126 -0.4212 966 CE2 34.4160 23.8030 47.8790 C.ar 126 TYR126 -0.1818 967 CD2 34.4400 22.4530 47.3760 C.ar 126 TYR126 -0.1835 968 C 35.5170 19.1770 44.3860 C.2 126 TYR126 0.6223 969 O 35.7140 18.2830 45.2590 O.2 126 TYR126 -0.5266 970 N 35.6120 18.9070 43.1200 N.am 127 GLY127 -0.3743 971 CA 36.3940 17.8420 42.5920 C.3 127 GLY127 -0.1288 972 C 37.8650 18.2250 42.4380 C.2 127 GLY127 0.5806 973 O 38.4530 18.9680 43.2260 O.2 127 GLY127 -0.5092 974 N 38.4350 17.6030 41.3650 N.am 128 ASP128 -0.5582 975 CA 39.8150 17.8040 40.9690 C.3 128 ASP128 0.0072 976 CB 40.7900 16.7070 41.5210 C.3 128 ASP128 -0.0476 977 CG 40.6130 15.3120 40.8850 C.2 128 ASP128 0.7452 978 OD1 40.0740 14.4520 41.5750 O.co2 128 ASP128 -0.7304 979 OD2 40.9200 15.0990 39.6490 O.co2 128 ASP128 -0.7304 980 C 40.0720 17.9540 39.4560 C.2 128 ASP128 0.4432 981 O 39.1540 17.8140 38.6210 O.2 128 ASP128 -0.5014 982 N 41.3440 18.2060 39.0330 N.am 129 HIE129 -0.5281 983 CA 41.7600 18.2340 37.6480 C.3 129 HIE129 0.0312 984 CB 43.3480 18.1540 37.6850 C.3 129 HIE129 -0.1523 985 CG 43.9090 17.0100 38.5020 C.ar 129 HIE129 0.2784 986 ND1 43.8980 16.9450 39.8930 N.ar 129 HIE129 -0.4233 987 CE1 44.4410 15.6980 40.1180 C.ar 129 HIE129 0.0260 988 NE2 44.8700 15.1010 39.0550 N.ar 129 HIE129 -0.0980 989 CD2 44.5190 15.8980 37.9850 C.ar 129 HIE129 -0.2976 990 C 41.2070 17.1950 36.6800 C.2 129 HIE129 0.6624 991 O 40.9930 17.4690 35.4960 O.2 129 HIE129 -0.5290 992 N 40.8940 16.0240 37.1460 N.am 130 SER130 -0.5414 993 CA 40.1200 15.0180 36.3940 C.3 130 SER130 0.1181 994 CB 40.1760 13.6470 37.0680 C.3 130 SER130 0.1470 995 OG 41.5230 13.3220 37.2460 O.3 130 SER130 -0.6403 996 C 38.6180 15.3420 36.1620 C.2 130 SER130 0.4834 997 O 38.1910 15.0700 35.0500 O.2 130 SER130 -0.5808 998 N 37.8650 16.0200 37.0320 N.am 131 ASP131 -0.5582 999 CA 36.5030 16.5620 36.8040 C.3 131 ASP131 0.0072 1000 CB 35.8580 16.9550 38.1100 C.3 131 ASP131 -0.0476 1001 CG 35.6140 15.7200 38.9810 C.2 131 ASP131 0.7452 1002 OD1 36.3440 15.5050 39.9550 O.co2 131 ASP131 -0.7304 1003 OD2 34.6230 14.9950 38.6730 O.co2 131 ASP131 -0.7304 1004 C 36.6450 17.7250 35.8640 C.2 131 ASP131 0.4432 1005 O 35.8630 17.8900 34.9640 O.2 131 ASP131 -0.5014 1006 N 37.6070 18.5920 36.0770 N.am 132 PHE132 -0.3713 1007 CA 37.9310 19.6350 35.0910 C.3 132 PHE132 -0.0301 1008 CB 39.1220 20.4980 35.5320 C.3 132 PHE132 -0.0987 1009 CG 38.7740 21.5300 36.5810 C.ar 132 PHE132 0.0213 1010 CD1 39.0480 21.3000 37.9540 C.ar 132 PHE132 -0.0831 1011 CE1 38.7930 22.3230 38.8660 C.ar 132 PHE132 -0.1570 1012 CZ 38.2450 23.5720 38.4310 C.ar 132 PHE132 -0.0998 1013 CE2 37.8550 23.7760 37.1030 C.ar 132 PHE132 -0.1570 1014 CD2 38.0580 22.6860 36.1730 C.ar 132 PHE132 -0.0831 1015 C 38.2170 19.1310 33.6310 C.2 132 PHE132 0.5480 1016 O 37.6630 19.6220 32.6790 O.2 132 PHE132 -0.5068 1017 N 39.0270 18.0900 33.5170 N.am 133 GLU133 -0.4234 1018 CA 39.1370 17.3110 32.2690 C.3 133 GLU133 0.0316 1019 CB 40.2820 16.3090 32.4620 C.3 133 GLU133 0.0748 1020 CG 41.5560 17.1110 32.2810 C.3 133 GLU133 -0.0339 1021 CD 42.7680 16.1830 32.2190 C.2 133 GLU133 0.7652 1022 OE1 43.1320 15.6620 33.3110 O.co2 133 GLU133 -0.8240 1023 OE2 43.3240 16.0040 31.0910 O.co2 133 GLU133 -0.8240 1024 C 37.8100 16.7280 31.7680 C.2 133 GLU133 0.4697 1025 O 37.6940 16.6230 30.5590 O.2 133 GLU133 -0.5925 1026 N 36.8000 16.3390 32.5850 N.am 134 GLU134 -0.4234 1027 CA 35.4820 15.9620 32.0660 C.3 134 GLU134 0.0316 1028 CB 34.7860 15.1710 33.1860 C.3 134 GLU134 0.0748 1029 CG 33.4990 14.5340 32.8440 C.3 134 GLU134 -0.0339 1030 CD 32.8840 13.9110 34.1230 C.2 134 GLU134 0.7652 1031 OE1 33.3600 12.7710 34.4730 O.co2 134 GLU134 -0.8240 1032 OE2 31.9130 14.4710 34.7380 O.co2 134 GLU134 -0.8240 1033 C 34.6520 17.2250 31.6580 C.2 134 GLU134 0.4697 1034 O 34.0610 17.1290 30.5890 O.2 134 GLU134 -0.5925 1035 N 34.6150 18.3130 32.4230 N.am 135 VAL135 -0.4501 1036 CA 34.1430 19.7070 31.9260 C.3 135 VAL135 -0.0519 1037 CB 34.3460 20.8110 32.9850 C.3 135 VAL135 0.3952 1038 CG1 33.9410 22.1920 32.3920 C.3 135 VAL135 -0.0901 1039 CG2 33.4850 20.6320 34.3180 C.3 135 VAL135 -0.0901 1040 C 34.7140 20.1150 30.6250 C.2 135 VAL135 0.4474 1041 O 33.9190 20.3440 29.6630 O.2 135 VAL135 -0.4046 1042 N 36.0030 20.1240 30.3760 N.am 136 PHE136 -0.3713 1043 CA 36.4940 20.3150 29.0010 C.3 136 PHE136 -0.0301 1044 CB 38.0040 20.1440 29.1070 C.3 136 PHE136 -0.0987 1045 CG 38.5830 20.3850 27.7390 C.ar 136 PHE136 0.0213 1046 CD1 39.1200 21.6520 27.3960 C.ar 136 PHE136 -0.0831 1047 CE1 39.8160 21.8600 26.2130 C.ar 136 PHE136 -0.1570 1048 CZ 40.0070 20.7700 25.2720 C.ar 136 PHE136 -0.0998 1049 CE2 39.4400 19.5240 25.5900 C.ar 136 PHE136 -0.1570 1050 CD2 38.8210 19.3240 26.8260 C.ar 136 PHE136 -0.0831 1051 C 35.9760 19.2400 27.9630 C.2 136 PHE136 0.5480 1052 O 35.7320 19.6960 26.8370 O.2 136 PHE136 -0.5068 1053 N 35.7370 17.9570 28.2650 N.am 137 ALA137 -0.4048 1054 CA 35.1360 17.0370 27.2530 C.3 137 ALA137 -0.0277 1055 CB 35.5390 15.6030 27.6700 C.3 137 ALA137 -0.2300 1056 C 33.6050 17.1770 27.0760 C.2 137 ALA137 0.5702 1057 O 33.1770 17.1940 25.9020 O.2 137 ALA137 -0.5551 1058 N 32.7630 17.3230 28.0930 N.am 138 VAL138 -0.4501 1059 CA 31.3970 17.6990 27.9570 C.3 138 VAL138 -0.0519 1060 CB 30.7280 17.8530 29.3730 C.3 138 VAL138 0.3952 1061 CG1 29.2330 18.1900 29.0950 C.3 138 VAL138 -0.0901 1062 CG2 30.7380 16.6160 30.3550 C.3 138 VAL138 -0.0901 1063 C 31.2500 18.9770 27.1120 C.2 138 VAL138 0.4474 1064 O 30.4950 18.9530 26.1380 O.2 138 VAL138 -0.4046 1065 N 32.1000 19.9850 27.3260 N.am 139 ILE139 -0.4510 1066 CA 31.9190 21.2790 26.6640 C.3 139 ILE139 -0.1019 1067 CB 32.7580 22.4230 27.3420 C.3 139 ILE139 0.0622 1068 CG2 32.9420 23.6160 26.2700 C.3 139 ILE139 -0.1300 1069 CG1 31.9730 22.8430 28.5760 C.3 139 ILE139 0.0222 1070 CD1 32.8080 23.7190 29.4290 C.3 139 ILE139 -0.1013 1071 C 32.4310 21.1430 25.1990 C.2 139 ILE139 0.5694 1072 O 31.7120 21.6340 24.2430 O.2 139 ILE139 -0.6195 1073 N 33.5790 20.4220 24.9320 N.am 140 GLU140 -0.4234 1074 CA 33.9830 20.1740 23.5600 C.3 140 GLU140 0.0316 1075 CB 35.4200 19.5490 23.5180 C.3 140 GLU140 0.0748 1076 CG 35.9680 19.4970 22.0640 C.3 140 GLU140 -0.0339 1077 CD 37.2140 18.5930 22.0950 C.2 140 GLU140 0.7652 1078 OE1 38.3240 19.1020 22.2080 O.co2 140 GLU140 -0.8240 1079 OE2 37.0500 17.3310 22.1540 O.co2 140 GLU140 -0.8240 1080 C 32.8990 19.3880 22.7160 C.2 140 GLU140 0.4697 1081 O 32.7220 19.5970 21.5290 O.2 140 GLU140 -0.5925 1082 N 32.0240 18.6010 23.3590 N.am 141 SER141 -0.5414 1083 CA 30.8220 18.0000 22.7120 C.3 141 SER141 0.1181 1084 CB 30.2520 16.8960 23.5900 C.3 141 SER141 0.1470 1085 OG 31.3150 16.0300 24.1350 O.3 141 SER141 -0.6403 1086 C 29.6620 18.9270 22.4930 C.2 141 SER141 0.4834 1087 O 28.8980 18.6360 21.5590 O.2 141 SER141 -0.5808 1088 N 29.5190 20.0580 23.2630 N.am 142 ALA142 -0.4048 1089 CA 28.4890 21.0710 23.0030 C.3 142 ALA142 -0.0277 1090 CB 28.0210 21.6260 24.3500 C.3 142 ALA142 -0.2300 1091 C 28.8920 22.1650 21.9730 C.2 142 ALA142 0.5702 1092 O 28.0120 22.6980 21.3570 O.2 142 ALA142 -0.5551 1093 N 30.1420 22.4550 21.7460 N.am 143 LEU143 -0.3552 1094 CA 30.5530 23.6790 20.8610 C.3 143 LEU143 -0.1015 1095 CB 32.0210 24.0650 21.0330 C.3 143 LEU143 -0.1444 1096 CG 32.3310 24.5050 22.5060 C.3 143 LEU143 0.1920 1097 CD1 33.8420 24.7710 22.6090 C.3 143 LEU143 -0.1230 1098 CD2 31.7350 25.8290 23.0550 C.3 143 LEU143 -0.1230 1099 C 30.2450 23.5110 19.3820 C.2 143 LEU143 0.5735 1100 O 29.8950 24.4670 18.7470 O.2 143 LEU143 -0.5578 1101 N 30.2100 22.3010 18.7620 N.am 144 PRO144 -0.0881 1102 CD 30.7310 21.0630 19.2610 C.3 144 PRO144 -0.0119 1103 CG 30.7850 20.0540 18.0590 C.3 144 PRO144 0.0131 1104 CB 29.6450 20.5390 17.2610 C.3 144 PRO144 -0.0034 1105 CA 29.6360 22.0340 17.4650 C.3 144 PRO144 -0.0346 1106 C 28.2010 22.4780 17.2950 C.2 144 PRO144 0.3337 1107 O 27.7960 22.6710 16.1400 O.2 144 PRO144 -0.4346 1108 N 27.4510 22.4740 18.3730 N.am 145 GLY145 -0.3743 1109 CA 26.0110 22.8300 18.2910 C.3 145 GLY145 -0.1288 1110 C 25.8720 24.3420 18.4700 C.2 145 GLY145 0.5806 1111 O 24.9920 25.0330 17.8970 O.2 145 GLY145 -0.5092 1112 N 26.7570 24.9760 19.1990 N.am 146 LEU146 -0.3552 1113 CA 26.7830 26.4350 19.3910 C.3 146 LEU146 -0.1015 1114 CB 27.6460 26.8350 20.5640 C.3 146 LEU146 -0.1444 1115 CG 27.3300 28.1890 21.2170 C.3 146 LEU146 0.1920 1116 CD1 25.9060 28.4750 21.6770 C.3 146 LEU146 -0.1230 1117 CD2 28.2960 28.4010 22.4020 C.3 146 LEU146 -0.1230 1118 C 27.2650 27.1470 18.1000 C.2 146 LEU146 0.5735 1119 O 26.6820 28.1300 17.7290 O.2 146 LEU146 -0.5578 1120 N 28.2120 26.5470 17.4220 N.am 147 HIE147 -0.5281 1121 CA 28.7750 26.8610 16.1020 C.3 147 HIE147 0.0312 1122 CB 29.9070 25.9530 15.7590 C.3 147 HIE147 -0.1523 1123 CG 31.1900 26.0690 16.4610 C.ar 147 HIE147 0.2784 1124 ND1 31.6840 27.2640 16.9870 N.ar 147 HIE147 -0.4233 1125 CE1 32.8490 27.0050 17.5750 C.ar 147 HIE147 0.0260 1126 NE2 33.1460 25.7060 17.4630 N.ar 147 HIE147 -0.0980 1127 CD2 32.0630 25.1340 16.7790 C.ar 147 HIE147 -0.2976 1128 C 27.6940 26.8280 15.0420 C.2 147 HIE147 0.6624 1129 O 27.7030 27.6860 14.1490 O.2 147 HIE147 -0.5290 1130 N 26.8130 25.7670 15.1180 N.am 148 ASP148 -0.5582 1131 CA 25.6590 25.4610 14.2350 C.3 148 ASP148 0.0072 1132 CB 25.3250 23.9470 14.3770 C.3 148 ASP148 -0.0476 1133 CG 24.2210 23.5870 13.3910 C.2 148 ASP148 0.7452 1134 OD1 24.3880 23.7330 12.1480 O.co2 148 ASP148 -0.7304 1135 OD2 23.0910 23.3140 13.8450 O.co2 148 ASP148 -0.7304 1136 C 24.4970 26.3990 14.4670 C.2 148 ASP148 0.4432 1137 O 23.8250 26.7640 13.5210 O.2 148 ASP148 -0.5014 1138 N 24.3350 26.9350 15.6930 N.am 149 TRP149 -0.4276 1139 CA 23.3650 28.0630 16.0280 C.3 149 TRP149 -0.0201 1140 CB 23.0660 28.0260 17.5250 C.3 149 TRP149 -0.0984 1141 CG 22.2660 29.2000 18.0680 C.ar 149 TRP149 -0.0998 1142 CD1 20.8890 29.3060 18.1560 C.ar 149 TRP149 -0.1741 1143 NE1 20.5290 30.5670 18.6340 N.ar 149 TRP149 -0.2984 1144 CE2 21.6390 31.3560 18.8370 C.ar 149 TRP149 0.1415 1145 CZ2 21.7550 32.6540 19.3480 C.ar 149 TRP149 -0.2107 1146 CH2 23.0320 33.1490 19.6060 C.ar 149 TRP149 -0.1330 1147 CZ3 24.1990 32.2670 19.5490 C.ar 149 TRP149 -0.1641 1148 CE3 24.0150 30.9590 19.0690 C.ar 149 TRP149 -0.1540 1149 CD2 22.7570 30.4680 18.6820 C.ar 149 TRP149 0.0896 1150 C 23.8250 29.4990 15.6300 C.2 149 TRP149 0.5841 1151 O 23.0750 30.1740 14.9520 O.2 149 TRP149 -0.4947 1152 N 24.9890 29.9410 16.1080 N.am 150 VAL150 -0.4501 1153 CA 25.4530 31.3300 15.8120 C.3 150 VAL150 -0.0519 1154 CB 26.7730 31.5170 16.6540 C.3 150 VAL150 0.3952 1155 CG1 28.1010 30.9230 15.9740 C.3 150 VAL150 -0.0901 1156 CG2 26.9650 33.0100 16.9030 C.3 150 VAL150 -0.0901 1157 C 25.7020 31.4760 14.3080 C.2 150 VAL150 0.4474 1158 O 25.4940 32.5410 13.7920 O.2 150 VAL150 -0.4046 1159 N 26.1310 30.5110 13.5020 N.am 151 ASP151 -0.5582 1160 CA 26.2790 30.6380 12.0050 C.3 151 ASP151 0.0072 1161 CB 26.8420 29.2470 11.4850 C.3 151 ASP151 -0.0476 1162 CG 26.9110 29.1310 9.9250 C.2 151 ASP151 0.7452 1163 OD1 26.0180 28.3670 9.3960 O.co2 151 ASP151 -0.7304 1164 OD2 27.8630 29.6480 9.3140 O.co2 151 ASP151 -0.7304 1165 C 24.9600 31.0060 11.3050 C.2 151 ASP151 0.4432 1166 O 25.0030 31.6740 10.2580 O.2 151 ASP151 -0.5014 1167 N 23.8410 30.4780 11.8070 N.am 152 GLU152 -0.4234 1168 CA 22.4630 30.7010 11.2770 C.3 152 GLU152 0.0316 1169 CB 21.5340 29.6760 11.9650 C.3 152 GLU152 0.0748 1170 CG 21.6010 28.2180 11.5450 C.3 152 GLU152 -0.0339 1171 CD 20.9750 28.0490 10.2040 C.2 152 GLU152 0.7652 1172 OE1 21.6620 27.8010 9.1670 O.co2 152 GLU152 -0.8240 1173 OE2 19.7540 28.2220 10.1390 O.co2 152 GLU152 -0.8240 1174 C 21.9170 32.1090 11.5730 C.2 152 GLU152 0.4697 1175 O 21.2950 32.6840 10.6900 O.2 152 GLU152 -0.5925 1176 N 22.4330 32.7430 12.6050 N.am 153 ARG153 -0.3009 1177 CA 22.2240 34.1250 13.0670 C.3 153 ARG153 -0.1314 1178 CB 22.5700 34.2450 14.5290 C.3 153 ARG153 0.0367 1179 CG 21.8860 33.4300 15.7010 C.3 153 ARG153 0.0125 1180 CD 20.3260 33.3570 15.6530 C.3 153 ARG153 0.1263 1181 NE 19.6560 34.6440 15.8520 N.pl3 153 ARG153 -0.4649 1182 CZ 18.3780 34.9570 15.7390 C.2 153 ARG153 0.5655 1183 NH1 17.4550 34.0880 15.5570 N.pl3 153 ARG153 -0.6858 1184 NH2 18.0980 36.2670 15.8640 N.pl3 153 ARG153 -0.6858 1185 C 23.1140 35.0950 12.2180 C.2 153 ARG153 0.7303 1186 O 22.8340 36.2740 12.1020 O.2 153 ARG153 -0.5783 1187 N 24.1470 34.5960 11.5670 N.am 154 LEU154 -0.3552 1188 CA 24.9900 35.2800 10.5360 C.3 154 LEU154 -0.1015 1189 CB 26.4210 34.6980 10.3270 C.3 154 LEU154 -0.1444 1190 CG 27.4320 35.1650 11.3990 C.3 154 LEU154 0.1920 1191 CD1 28.8120 34.5870 11.0580 C.3 154 LEU154 -0.1230 1192 CD2 27.5140 36.6900 11.5870 C.3 154 LEU154 -0.1230 1193 C 24.1640 35.3860 9.1810 C.2 154 LEU154 0.5735 1194 O 24.3180 36.3100 8.3550 O.2 154 LEU154 -0.5578 1195 N 23.1970 34.4220 9.0310 N.am 155 ALA155 -0.4048 1196 CA 22.3040 34.4280 7.9260 C.3 155 ALA155 -0.0277 1197 CB 21.8450 32.9830 7.6630 C.3 155 ALA155 -0.2300 1198 C 21.1270 35.5340 8.1430 C.2 155 ALA155 0.5702 1199 O 20.2920 35.6500 7.2610 O.2 155 ALA155 -0.5551 1200 N 21.0240 36.1860 9.3050 N.am 156 ARG156 -0.4953 1201 CA 19.9650 37.2180 9.5770 C.3 156 ARG156 -0.1223 1202 CB 19.7190 37.3590 11.0520 C.3 156 ARG156 0.0158 1203 CG 19.1690 36.0440 11.6650 C.3 156 ARG156 0.0137 1204 CD 17.6790 35.8080 11.5960 C.3 156 ARG156 0.1833 1205 NE 17.3720 34.4330 12.0680 N.pl3 156 ARG156 -0.4687 1206 CZ 16.1390 34.0340 12.2850 C.2 156 ARG156 0.5778 1207 NH1 15.1810 34.8560 12.3790 N.pl3 156 ARG156 -0.7123 1208 NH2 15.9250 32.7830 12.3210 N.pl3 156 ARG156 -0.7123 1209 C 20.1730 38.4730 8.8630 C.2 156 ARG156 0.6488 1210 O 19.1730 39.0910 8.4740 O.co2 156 ARG156 -0.7394 1211 OXT 21.3940 38.8470 8.7500 O.co2 156 ARG156 -0.7394 1212 O 33.5310 46.9410 29.1590 O.t3p 157 HOH1 -0.8340 1213 O 10.5530 43.3350 26.6480 O.t3p 157 HOH1 -0.8340 1214 O 20.1360 47.0180 25.7530 O.t3p 157 HOH1 -0.8340 1215 O 16.5850 39.1390 21.7250 O.t3p 157 HOH1 -0.8340 1216 O 19.7980 45.0090 23.1540 O.t3p 157 HOH1 -0.8340 1217 O 24.3500 49.3160 27.0700 O.t3p 157 HOH1 -0.8340 1218 O 22.4980 50.7530 28.1570 O.t3p 157 HOH1 -0.8340 1219 O 27.3850 47.8350 31.5310 O.t3p 157 HOH1 -0.8340 1220 O 20.5920 50.0440 33.4200 O.t3p 157 HOH1 -0.8340 1221 O 28.2990 47.8800 34.0470 O.t3p 157 HOH1 -0.8340 1222 O 23.5970 46.7110 39.7040 O.t3p 157 HOH1 -0.8340 1223 O 18.7190 47.8810 32.6650 O.t3p 157 HOH1 -0.8340 1224 O 23.3730 46.3380 20.0540 O.t3p 157 HOH1 -0.8340 1225 O 16.4060 39.1420 18.9240 O.t3p 157 HOH1 -0.8340 1226 O 24.9700 48.2560 36.0610 O.t3p 157 HOH1 -0.8340 1227 O 23.6680 49.4870 24.3770 O.t3p 157 HOH1 -0.8340 1228 O 20.9340 42.6880 40.0910 O.t3p 157 HOH1 -0.8340 1229 O 20.7280 52.6760 31.9410 O.t3p 157 HOH1 -0.8340 1230 O 23.2250 50.8190 33.3760 O.t3p 157 HOH1 -0.8340 1231 O 16.4050 34.9770 19.2730 O.t3p 157 HOH1 -0.8340 1232 O 11.6030 21.5160 41.3540 O.t3p 157 HOH1 -0.8340 1233 O 10.7730 24.9220 40.4120 O.t3p 157 HOH1 -0.8340 1234 O 5.7860 28.4530 32.8090 O.t3p 157 HOH1 -0.8340 1235 O 3.0150 33.7500 30.2450 O.t3p 157 HOH1 -0.8340 1236 O 14.5270 31.9030 18.7530 O.t3p 157 HOH1 -0.8340 1237 O 5.9450 35.2270 30.4630 O.t3p 157 HOH1 -0.8340 1238 O 8.7830 35.1930 30.2500 O.t3p 157 HOH1 -0.8340 1239 O 15.4630 44.4980 27.6270 O.t3p 157 HOH1 -0.8340 1240 O 20.4370 44.0690 37.4410 O.t3p 157 HOH1 -0.8340 1241 O 17.9610 44.0570 33.0430 O.t3p 157 HOH1 -0.8340 1242 O 21.9960 47.4620 23.4550 O.t3p 157 HOH1 -0.8340 1243 O 17.0850 43.9300 23.0740 O.t3p 157 HOH1 -0.8340 1244 O 15.6230 42.5840 29.4490 O.t3p 157 HOH1 -0.8340 1245 O 22.9950 45.9760 37.2100 O.t3p 157 HOH1 -0.8340 1246 O 26.5570 48.8260 28.3720 O.t3p 157 HOH1 -0.8340 1247 O 18.6180 46.0440 28.3460 O.t3p 157 HOH1 -0.8340 1248 O 15.7480 44.8090 31.3000 O.t3p 157 HOH1 -0.8340 1249 O 19.0420 46.9260 35.4250 O.t3p 157 HOH1 -0.8340 1250 O 16.3740 10.4060 23.8520 O.t3p 157 HOH1 -0.8340 1251 O 18.3180 11.2140 21.8680 O.t3p 157 HOH1 -0.8340 1252 O 24.6340 9.1170 18.3510 O.t3p 157 HOH1 -0.8340 1253 O 21.3060 9.4920 20.3650 O.t3p 157 HOH1 -0.8340 1254 O 16.4690 13.2320 19.8750 O.t3p 157 HOH1 -0.8340 1255 O 13.6840 15.1190 19.4480 O.t3p 157 HOH1 -0.8340 1256 O 19.5600 12.0560 17.6820 O.t3p 157 HOH1 -0.8340 1257 O 19.9540 12.9530 15.0080 O.t3p 157 HOH1 -0.8340 1258 O 14.3570 12.6350 21.2880 O.t3p 157 HOH1 -0.8340 1259 O 23.6010 7.8890 21.1890 O.t3p 157 HOH1 -0.8340 1260 O 19.4800 22.8430 12.7990 O.t3p 157 HOH1 -0.8340 1261 O 16.8720 23.6480 15.7770 O.t3p 157 HOH1 -0.8340 1262 O 18.7180 23.7630 8.5810 O.t3p 157 HOH1 -0.8340 1263 O 27.0550 20.1100 13.5430 O.t3p 157 HOH1 -0.8340 1264 O 32.3920 21.0390 14.3440 O.t3p 157 HOH1 -0.8340 1265 O 31.3080 14.1170 18.4020 O.t3p 157 HOH1 -0.8340 1266 O 19.6410 20.9290 14.6210 O.t3p 157 HOH1 -0.8340 1267 O 19.7650 23.1540 16.4720 O.t3p 157 HOH1 -0.8340 1268 O 22.2410 20.5930 10.0860 O.t3p 157 HOH1 -0.8340 1269 O 20.2100 50.2820 29.6260 O.t3p 157 HOH1 -0.8340 1270 O 23.6200 51.7170 30.7020 O.t3p 157 HOH1 -0.8340 1271 O 26.5820 49.9650 24.4680 O.t3p 157 HOH1 -0.8340 1272 O 27.2660 46.6530 36.8840 O.t3p 157 HOH1 -0.8340 1273 O 14.0520 43.5450 25.3540 O.t3p 157 HOH1 -0.8340 1274 O 14.0790 39.3870 22.5780 O.t3p 157 HOH1 -0.8340 1275 O 28.5110 44.7760 32.7730 O.t3p 157 HOH1 -0.8340 1276 O 20.2960 42.9840 18.9180 O.t3p 157 HOH1 -0.8340 1277 O 32.4810 44.7700 32.3880 O.t3p 157 HOH1 -0.8340 1278 O 10.0700 39.4630 29.4170 O.t3p 157 HOH1 -0.8340 1279 O 9.3050 42.8550 31.6330 O.t3p 157 HOH1 -0.8340 1280 O 18.4550 42.0320 41.2790 O.t3p 157 HOH1 -0.8340 1281 O 11.1290 43.2960 29.4760 O.t3p 157 HOH1 -0.8340 1282 O 13.4680 45.5610 33.6760 O.t3p 157 HOH1 -0.8340 1283 O 14.4000 44.1110 36.1280 O.t3p 157 HOH1 -0.8340 1284 O 22.2090 49.0120 19.6190 O.t3p 157 HOH1 -0.8340 1285 O 24.4350 46.1010 22.7870 O.t3p 157 HOH1 -0.8340 1286 O 21.3390 9.9520 17.5010 O.t3p 157 HOH1 -0.8340 1287 O 10.1600 11.6710 28.9120 O.t3p 157 HOH1 -0.8340 1288 O 8.9850 15.0990 25.3370 O.t3p 157 HOH1 -0.8340 1289 O 7.1340 16.5350 26.4240 O.t3p 157 HOH1 -0.8340 1290 O 12.2370 11.9100 24.6580 O.t3p 157 HOH1 -0.8340 1291 O 14.7240 10.7520 28.7060 O.t3p 157 HOH1 -0.8340 1292 O 8.3030 15.2690 22.6440 O.t3p 157 HOH1 -0.8340 1293 O 8.2550 17.5000 28.9690 O.t3p 157 HOH1 -0.8340 1294 O 7.8060 18.2640 24.3760 O.t3p 157 HOH1 -0.8340 1295 O 14.9890 12.2130 25.3890 O.t3p 157 HOH1 -0.8340 1296 O 8.8170 17.9740 21.4190 O.t3p 157 HOH1 -0.8340 1297 O 12.9160 15.0790 35.5340 O.t3p 157 HOH1 -0.8340 1298 O 13.1460 10.5590 31.0400 O.t3p 157 HOH1 -0.8340 1299 O 18.6220 12.7820 30.1540 O.t3p 157 HOH1 -0.8340 1300 O 17.1160 10.5520 30.6550 O.t3p 157 HOH1 -0.8340 1301 O 17.0150 10.3240 26.7620 O.t3p 157 HOH1 -0.8340 1302 O 12.3210 26.1200 30.5600 O.t3p 157 HOH1 -0.8340 1303 O 7.7800 27.3890 26.7610 O.t3p 157 HOH1 -0.8340 1304 O 8.9700 29.1170 35.7750 O.t3p 157 HOH1 -0.8340 1305 O 10.2790 26.9480 32.1760 O.t3p 157 HOH1 -0.8340 1306 O 13.0990 32.2070 45.4840 O.t3p 157 HOH1 -0.8340 1307 O 9.1230 27.1130 41.5640 O.t3p 157 HOH1 -0.8340 1308 O 11.4090 28.2150 42.6250 O.t3p 157 HOH1 -0.8340 1309 O 2.8270 36.4490 32.7140 O.t3p 157 HOH1 -0.8340 1310 O 9.2200 28.6220 38.9760 O.t3p 157 HOH1 -0.8340 1311 O 4.6780 37.1160 34.7550 O.t3p 157 HOH1 -0.8340 1312 O 5.0540 33.5390 35.8830 O.t3p 157 HOH1 -0.8340 1313 O 14.9040 37.6110 41.7440 O.t3p 157 HOH1 -0.8340 1314 O 10.6900 43.2600 37.7550 O.t3p 157 HOH1 -0.8340 1315 O 12.7350 36.8780 43.1890 O.t3p 157 HOH1 -0.8340 1316 O 16.3630 39.8900 42.1360 O.t3p 157 HOH1 -0.8340 1317 O 10.0360 39.7270 38.4380 O.t3p 157 HOH1 -0.8340 1318 O 15.0470 41.8470 39.5540 O.t3p 157 HOH1 -0.8340 1319 O 13.7100 40.8180 41.7360 O.t3p 157 HOH1 -0.8340 1320 O 13.4080 43.7860 38.7820 O.t3p 157 HOH1 -0.8340 1321 O 16.9020 45.7300 39.8420 O.t3p 157 HOH1 -0.8340 1322 O 8.1810 39.1000 35.7220 O.t3p 157 HOH1 -0.8340 1323 O 9.6380 14.4980 31.4620 O.t3p 157 HOH1 -0.8340 1324 O 18.1660 12.7240 27.4250 O.t3p 157 HOH1 -0.8340 1325 O 11.5810 12.9550 22.2770 O.t3p 157 HOH1 -0.8340 1326 O 15.1860 24.2540 34.6810 O.t3p 157 HOH1 -0.8340 1327 O 6.5610 20.1690 26.2230 O.t3p 157 HOH1 -0.8340 1328 O 14.4530 19.0910 35.1220 O.t3p 157 HOH1 -0.8340 1329 O 13.0580 26.9230 33.7240 O.t3p 157 HOH1 -0.8340 1330 O 15.6900 29.2300 19.1870 O.t3p 157 HOH1 -0.8340 1331 O 11.9800 22.3100 27.6170 O.t3p 157 HOH1 -0.8340 1332 O 3.7330 30.5580 32.4400 O.t3p 157 HOH1 -0.8340 1333 O 5.7940 34.4030 27.6280 O.t3p 157 HOH1 -0.8340 1334 O 10.8810 18.1690 35.4850 O.t3p 157 HOH1 -0.8340 1335 O 8.5680 21.1410 23.9530 O.t3p 157 HOH1 -0.8340 1336 O 11.8110 19.4740 33.2200 O.t3p 157 HOH1 -0.8340 1337 O 10.7510 20.1710 22.0180 O.t3p 157 HOH1 -0.8340 1338 O 14.7070 21.6050 22.9270 O.t3p 157 HOH1 -0.8340 1339 O 11.5850 20.4690 29.5910 O.t3p 157 HOH1 -0.8340 1340 O 13.3810 21.1220 31.6280 O.t3p 157 HOH1 -0.8340 1341 O 10.7080 20.0300 39.0920 O.t3p 157 HOH1 -0.8340 1342 O 7.7750 30.8270 23.7190 O.t3p 157 HOH1 -0.8340 1343 O 12.6510 21.4090 35.8670 O.t3p 157 HOH1 -0.8340 1344 O 10.6510 34.1110 21.3080 O.t3p 157 HOH1 -0.8340 1345 O 15.3550 24.6570 27.5040 O.t3p 157 HOH1 -0.8340 1346 O 11.9180 26.5110 25.8240 O.t3p 157 HOH1 -0.8340 1347 O 12.3690 21.8970 20.4960 O.t3p 157 HOH1 -0.8340 1348 O 7.3640 36.0650 26.2090 O.t3p 157 HOH1 -0.8340 1349 O 10.3990 25.6170 37.6910 O.t3p 157 HOH1 -0.8340 1350 O 12.6300 23.3730 33.4380 O.t3p 157 HOH1 -0.8340 1351 O 16.2200 21.5870 34.8760 O.t3p 157 HOH1 -0.8340 1352 O 8.0650 27.7000 30.4330 O.t3p 157 HOH1 -0.8340 1353 O 9.7310 22.5340 38.3160 O.t3p 157 HOH1 -0.8340 1354 O 12.7060 18.7710 37.9370 O.t3p 157 HOH1 -0.8340 1355 O 14.8560 26.5280 21.1110 O.t3p 157 HOH1 -0.8340 1356 O 15.1140 24.2880 22.7890 O.t3p 157 HOH1 -0.8340 1357 O 12.1050 36.7660 21.2520 O.t3p 157 HOH1 -0.8340 1358 O 14.0330 23.7630 29.8690 O.t3p 157 HOH1 -0.8340 1359 O 14.3820 25.5980 25.0940 O.t3p 157 HOH1 -0.8340 1360 O 12.1160 27.9000 22.2870 O.t3p 157 HOH1 -0.8340 1361 O 17.4150 23.0440 26.8230 O.t3p 157 HOH1 -0.8340 1362 O 11.3380 24.8900 28.2340 O.t3p 157 HOH1 -0.8340 1363 O 11.4410 29.5210 19.7450 O.t3p 157 HOH1 -0.8340 1364 O 9.5140 23.2810 25.9390 O.t3p 157 HOH1 -0.8340 1365 O 36.7060 28.0860 5.5290 O.t3p 157 HOH1 -0.8340 1366 O 44.3340 33.5950 12.1680 O.t3p 157 HOH1 -0.8340 1367 O 34.4440 32.2990 5.9310 O.t3p 157 HOH1 -0.8340 1368 O 43.4590 36.4550 12.6820 O.t3p 157 HOH1 -0.8340 1369 O 36.7660 33.5230 5.3220 O.t3p 157 HOH1 -0.8340 1370 O 36.8670 36.4690 5.7530 O.t3p 157 HOH1 -0.8340 1371 O 45.3500 37.5020 14.3470 O.t3p 157 HOH1 -0.8340 1372 O 13.3350 36.0860 15.7710 O.t3p 157 HOH1 -0.8340 1373 O 10.1590 35.5750 13.7340 O.t3p 157 HOH1 -0.8340 1374 O 6.4300 38.6850 26.3940 O.t3p 157 HOH1 -0.8340 1375 O 7.0700 35.7970 23.4960 O.t3p 157 HOH1 -0.8340 1376 O 8.0850 38.4410 23.8790 O.t3p 157 HOH1 -0.8340 1377 O 7.2590 33.4260 22.0460 O.t3p 157 HOH1 -0.8340 1378 O 9.0810 30.8060 19.2070 O.t3p 157 HOH1 -0.8340 1379 O 13.7910 36.1440 18.4990 O.t3p 157 HOH1 -0.8340 1380 O 12.2850 33.9130 19.0000 O.t3p 157 HOH1 -0.8340 1381 O 12.1840 33.6860 15.1070 O.t3p 157 HOH1 -0.8340 1382 O 14.0910 39.3180 15.2610 O.t3p 157 HOH1 -0.8340 1383 O 9.6220 42.4520 23.4660 O.t3p 157 HOH1 -0.8340 1384 O 33.6500 42.0480 28.3080 O.t3p 157 HOH1 -0.8340 1385 O 26.3060 48.4210 20.6020 O.t3p 157 HOH1 -0.8340 1386 O 39.0410 46.7340 12.9360 O.t3p 157 HOH1 -0.8340 1387 O 35.1690 47.9460 27.2360 O.t3p 157 HOH1 -0.8340 1388 O 35.7570 22.9690 10.7580 O.t3p 157 HOH1 -0.8340 1389 O 30.1530 23.8000 5.4950 O.t3p 157 HOH1 -0.8340 1390 O 33.3520 25.5550 4.6800 O.t3p 157 HOH1 -0.8340 1391 O 35.8500 25.7950 6.7800 O.t3p 157 HOH1 -0.8340 1392 O 31.4540 22.5800 7.5300 O.t3p 157 HOH1 -0.8340 1393 O 33.0660 27.6820 6.3540 O.t3p 157 HOH1 -0.8340 1394 O 38.9990 23.1820 11.7520 O.t3p 157 HOH1 -0.8340 1395 O 33.7390 25.1980 8.1930 O.t3p 157 HOH1 -0.8340 1396 O 30.3230 26.7650 5.7750 O.t3p 157 HOH1 -0.8340 1397 O 40.0520 37.1330 8.7180 O.t3p 157 HOH1 -0.8340 1398 O 43.7450 31.1940 10.8470 O.t3p 157 HOH1 -0.8340 1399 O 41.4800 33.6330 10.6350 O.t3p 157 HOH1 -0.8340 1400 O 41.2730 24.6810 13.2360 O.t3p 157 HOH1 -0.8340 1401 O 43.7880 26.7870 10.8800 O.t3p 157 HOH1 -0.8340 1402 O 38.8220 32.6290 7.3670 O.t3p 157 HOH1 -0.8340 1403 O 40.8130 29.5720 8.4200 O.t3p 157 HOH1 -0.8340 1404 O 16.5990 41.3500 12.6990 O.t3p 157 HOH1 -0.8340 1405 O 22.6120 37.1050 4.4170 O.t3p 157 HOH1 -0.8340 1406 O 18.8830 36.5220 3.4990 O.t3p 157 HOH1 -0.8340 1407 O 22.0540 43.0690 9.0640 O.t3p 157 HOH1 -0.8340 1408 O 16.5230 39.2600 5.7660 O.t3p 157 HOH1 -0.8340 1409 O 14.8220 40.1940 7.8300 O.t3p 157 HOH1 -0.8340 1410 O 22.7830 48.4180 13.2200 O.t3p 157 HOH1 -0.8340 1411 O 17.2280 43.6890 8.2310 O.t3p 157 HOH1 -0.8340 1412 O 25.6650 37.0410 3.9540 O.t3p 157 HOH1 -0.8340 1413 O 20.1210 44.3940 13.6070 O.t3p 157 HOH1 -0.8340 1414 O 15.0230 37.2970 8.1310 O.t3p 157 HOH1 -0.8340 1415 O 14.2210 38.9880 11.9210 O.t3p 157 HOH1 -0.8340 1416 O 18.4540 39.2840 3.9740 O.t3p 157 HOH1 -0.8340 1417 O 17.5780 38.8460 13.4750 O.t3p 157 HOH1 -0.8340 1418 O 24.6080 43.8170 11.4830 O.t3p 157 HOH1 -0.8340 1419 O 23.6220 34.0390 2.7450 O.t3p 157 HOH1 -0.8340 1420 O 24.5390 39.5440 7.0140 O.t3p 157 HOH1 -0.8340 1421 O 18.4720 40.3310 15.7370 O.t3p 157 HOH1 -0.8340 1422 O 21.1370 48.3010 15.7870 O.t3p 157 HOH1 -0.8340 1423 O 11.1240 41.7520 21.4260 O.t3p 157 HOH1 -0.8340 1424 O 11.8950 37.9390 13.1800 O.t3p 157 HOH1 -0.8340 1425 O 14.5000 30.5740 9.8600 O.t3p 157 HOH1 -0.8340 1426 O 16.0240 30.1640 7.4890 O.t3p 157 HOH1 -0.8340 1427 O 16.5080 33.3140 5.8460 O.t3p 157 HOH1 -0.8340 1428 O 11.5440 33.7680 12.1970 O.t3p 157 HOH1 -0.8340 1429 O 10.5160 31.4010 10.9440 O.t3p 157 HOH1 -0.8340 1430 O 18.8890 32.4330 4.1810 O.t3p 157 HOH1 -0.8340 1431 O 16.4750 32.8530 8.7110 O.t3p 157 HOH1 -0.8340 1432 O 21.5930 29.5670 3.0890 O.t3p 157 HOH1 -0.8340 1433 O 21.2010 32.2260 2.2680 O.t3p 157 HOH1 -0.8340 1434 O 18.2300 25.6840 6.1280 O.t3p 157 HOH1 -0.8340 1435 O 20.0150 29.3750 5.4230 O.t3p 157 HOH1 -0.8340 1436 O 20.7810 26.2590 5.2450 O.t3p 157 HOH1 -0.8340 1437 O 25.4910 31.5980 4.5370 O.t3p 157 HOH1 -0.8340 1438 O 23.9850 29.3670 5.0390 O.t3p 157 HOH1 -0.8340 1439 O 11.5640 30.1450 13.2550 O.t3p 157 HOH1 -0.8340 1440 O 13.4550 31.1930 14.9200 O.t3p 157 HOH1 -0.8340 1441 O 19.5320 41.9940 12.2870 O.t3p 157 HOH1 -0.8340 1442 O 22.6810 39.7740 4.8000 O.t3p 157 HOH1 -0.8340 1443 O 20.8800 18.5110 15.8220 O.t3p 157 HOH1 -0.8340 1444 O 26.1260 13.1050 13.7620 O.t3p 157 HOH1 -0.8340 1445 O 34.3720 24.7760 12.2940 O.t3p 157 HOH1 -0.8340 1446 O 29.3690 16.1820 18.6700 O.t3p 157 HOH1 -0.8340 1447 O 28.1050 30.4300 5.3110 O.t3p 157 HOH1 -0.8340 1448 O 17.3840 20.9610 18.4170 O.t3p 157 HOH1 -0.8340 1449 O 32.5220 18.0200 13.6410 O.t3p 157 HOH1 -0.8340 1450 O 34.8080 19.1230 14.7020 O.t3p 157 HOH1 -0.8340 1451 O 14.7140 29.2040 16.2840 O.t3p 157 HOH1 -0.8340 1452 O 26.2260 27.3570 4.7910 O.t3p 157 HOH1 -0.8340 1453 O 28.0460 22.9650 10.5880 O.t3p 157 HOH1 -0.8340 1454 O 17.6440 30.6810 16.5010 O.t3p 157 HOH1 -0.8340 1455 O 28.4530 24.4460 7.9590 O.t3p 157 HOH1 -0.8340 1456 O 27.1620 39.9520 13.6660 O.t3p 157 HOH1 -0.8340 1457 O 26.3990 40.8720 9.4480 O.t3p 157 HOH1 -0.8340 1458 O 29.3580 37.7180 6.7800 O.t3p 157 HOH1 -0.8340 1459 O 33.6960 42.9160 9.4940 O.t3p 157 HOH1 -0.8340 1460 O 28.7850 39.3850 9.1120 O.t3p 157 HOH1 -0.8340 1461 O 31.7500 34.4590 7.4020 O.t3p 157 HOH1 -0.8340 1462 O 37.5480 25.2860 14.3310 O.t3p 157 HOH1 -0.8340 1463 O 21.8900 12.1190 26.3310 O.t3p 157 HOH1 -0.8340 1464 O 17.4600 27.0290 13.3860 O.t3p 157 HOH1 -0.8340 1465 O 28.8650 11.4710 17.9230 O.t3p 157 HOH1 -0.8340 1466 O 27.4430 13.7430 16.0730 O.t3p 157 HOH1 -0.8340 1467 O 23.7130 13.1600 15.1530 O.t3p 157 HOH1 -0.8340 1468 O 25.7320 19.2180 15.9070 O.t3p 157 HOH1 -0.8340 1469 O 26.0820 21.0520 11.1330 O.t3p 157 HOH1 -0.8340 1470 O 23.8150 23.3540 8.3250 O.t3p 157 HOH1 -0.8340 1471 O 29.1140 18.4980 12.8610 O.t3p 157 HOH1 -0.8340 1472 O 23.1410 24.9750 5.7830 O.t3p 157 HOH1 -0.8340 1473 O 31.6200 24.4720 11.5630 O.t3p 157 HOH1 -0.8340 1474 O 20.2070 25.4020 14.1720 O.t3p 157 HOH1 -0.8340 1475 O 17.3240 15.5240 18.6240 O.t3p 157 HOH1 -0.8340 1476 O 27.4510 16.3130 13.7190 O.t3p 157 HOH1 -0.8340 1477 O 23.6790 17.7630 13.6540 O.t3p 157 HOH1 -0.8340 1478 O 30.8930 21.8040 12.0710 O.t3p 157 HOH1 -0.8340 1479 O 15.4320 26.0120 18.4790 O.t3p 157 HOH1 -0.8340 1480 O 17.4940 29.8570 13.6660 O.t3p 157 HOH1 -0.8340 1481 O 19.1270 16.0910 15.4980 O.t3p 157 HOH1 -0.8340 1482 O 36.6700 43.7090 22.0990 O.t3p 157 HOH1 -0.8340 1483 O 29.3340 47.2100 19.5080 O.t3p 157 HOH1 -0.8340 1484 O 29.0750 46.8400 12.9870 O.t3p 157 HOH1 -0.8340 1485 O 41.7880 40.4230 16.4780 O.t3p 157 HOH1 -0.8340 1486 O 31.8330 47.4500 21.6080 O.t3p 157 HOH1 -0.8340 1487 O 35.3670 44.9400 10.4160 O.t3p 157 HOH1 -0.8340 1488 O 34.9820 44.8370 26.5790 O.t3p 157 HOH1 -0.8340 1489 O 31.9100 45.7360 15.6640 O.t3p 157 HOH1 -0.8340 1490 O 42.0540 41.8840 13.1610 O.t3p 157 HOH1 -0.8340 1491 O 29.0910 49.4640 15.4200 O.t3p 157 HOH1 -0.8340 1492 O 21.1120 41.8280 16.1360 O.t3p 157 HOH1 -0.8340 1493 O 37.1210 37.5650 24.0060 O.t3p 157 HOH1 -0.8340 1494 O 41.3970 43.0810 15.6560 O.t3p 157 HOH1 -0.8340 1495 O 39.1540 39.7350 21.4730 O.t3p 157 HOH1 -0.8340 1496 O 44.1800 40.2230 18.4270 O.t3p 157 HOH1 -0.8340 1497 O 35.7280 40.0730 11.4550 O.t3p 157 HOH1 -0.8340 1498 O 40.3010 36.6380 11.9200 O.t3p 157 HOH1 -0.8340 1499 O 44.0790 39.9950 14.5340 O.t3p 157 HOH1 -0.8340 1500 O 36.1350 41.5560 8.8260 O.t3p 157 HOH1 -0.8340 1501 O 33.1850 42.5270 19.5730 O.t3p 157 HOH1 -0.8340 1502 O 26.7460 48.6270 13.1130 O.t3p 157 HOH1 -0.8340 1503 O 34.6950 41.4300 23.2490 O.t3p 157 HOH1 -0.8340 1504 O 36.2190 41.0200 20.8790 O.t3p 157 HOH1 -0.8340 1505 O 36.7030 44.1700 19.2340 O.t3p 157 HOH1 -0.8340 1506 O 23.9040 40.8690 11.9930 O.t3p 157 HOH1 -0.8340 1507 O 34.2380 39.0910 8.0160 O.t3p 157 HOH1 -0.8340 1508 O 38.6460 42.6270 10.0480 O.t3p 157 HOH1 -0.8340 1509 O 31.8360 42.4720 11.7910 O.t3p 157 HOH1 -0.8340 1510 O 31.4970 40.4630 9.1920 O.t3p 157 HOH1 -0.8340 1511 O 34.1990 46.2070 14.1950 O.t3p 157 HOH1 -0.8340 1512 O 29.1420 45.9210 15.4250 O.t3p 157 HOH1 -0.8340 1513 O 32.2910 45.4980 19.4580 O.t3p 157 HOH1 -0.8340 1514 O 39.9990 43.3340 20.0850 O.t3p 157 HOH1 -0.8340 1515 O 35.2960 42.1650 25.7420 O.t3p 157 HOH1 -0.8340 1516 O 30.4200 43.3350 18.7040 O.t3p 157 HOH1 -0.8340 1517 O 31.9800 43.1960 16.0290 O.t3p 157 HOH1 -0.8340 1518 O 36.3310 45.5880 24.0040 O.t3p 157 HOH1 -0.8340 1519 O 24.0280 50.5930 17.4790 O.t3p 157 HOH1 -0.8340 1520 O 28.1050 34.5960 4.9620 O.t3p 157 HOH1 -0.8340 1521 O 15.9390 17.3300 38.7900 O.t3p 157 HOH1 -0.8340 1522 O 22.0270 17.0280 38.4610 O.t3p 157 HOH1 -0.8340 1523 O 18.4050 17.5000 36.4030 O.t3p 157 HOH1 -0.8340 1524 O 29.4620 26.7730 49.6210 O.t3p 157 HOH1 -0.8340 1525 O 29.8010 24.8940 47.7160 O.t3p 157 HOH1 -0.8340 1526 O 12.3070 18.1730 41.1280 O.t3p 157 HOH1 -0.8340 1527 O 15.9250 15.9680 36.2100 O.t3p 157 HOH1 -0.8340 1528 O 18.0700 14.0260 36.1430 O.t3p 157 HOH1 -0.8340 1529 O 21.0810 14.8870 36.4740 O.t3p 157 HOH1 -0.8340 1530 O 23.2030 37.0060 50.2770 O.t3p 157 HOH1 -0.8340 1531 O 26.2230 34.5650 54.2580 O.t3p 157 HOH1 -0.8340 1532 O 29.4140 39.4770 52.3650 O.t3p 157 HOH1 -0.8340 1533 O 15.2050 13.0760 35.1590 O.t3p 157 HOH1 -0.8340 1534 O 21.3300 11.7210 33.9400 O.t3p 157 HOH1 -0.8340 1535 O 18.6200 11.5780 34.0540 O.t3p 157 HOH1 -0.8340 1536 O 20.4540 19.2220 41.1050 O.t3p 157 HOH1 -0.8340 1537 O 17.9600 18.3080 41.9590 O.t3p 157 HOH1 -0.8340 1538 O 29.3500 22.2030 46.4950 O.t3p 157 HOH1 -0.8340 1539 O 19.1650 16.5560 38.8050 O.t3p 157 HOH1 -0.8340 1540 O 37.0330 39.3130 47.3620 O.t3p 157 HOH1 -0.8340 1541 O 37.5160 42.4630 45.7180 O.t3p 157 HOH1 -0.8340 1542 O 32.9010 29.6270 51.3250 O.t3p 157 HOH1 -0.8340 1543 O 26.9490 43.7490 46.8070 O.t3p 157 HOH1 -0.8340 1544 O 31.5250 40.5500 50.8150 O.t3p 157 HOH1 -0.8340 1545 O 36.8630 43.0640 39.5920 O.t3p 157 HOH1 -0.8340 1546 O 35.0120 44.5000 40.6790 O.t3p 157 HOH1 -0.8340 1547 O 39.8970 41.5810 44.0540 O.t3p 157 HOH1 -0.8340 1548 O 33.1050 43.7910 45.9420 O.t3p 157 HOH1 -0.8340 1549 O 42.6020 38.7160 42.9620 O.t3p 157 HOH1 -0.8340 1550 O 28.2500 42.5270 48.8430 O.t3p 157 HOH1 -0.8340 1551 O 23.2630 13.9180 34.5390 O.t3p 157 HOH1 -0.8340 1552 O 24.0980 14.2160 42.1130 O.t3p 157 HOH1 -0.8340 1553 O 23.5840 13.3100 37.3270 O.t3p 157 HOH1 -0.8340 1554 O 26.9390 11.3990 40.2460 O.t3p 157 HOH1 -0.8340 1555 O 31.4550 26.1790 51.4380 O.t3p 157 HOH1 -0.8340 1556 O 14.9000 16.1020 41.0720 O.t3p 157 HOH1 -0.8340 1557 O 18.1970 19.2540 44.9010 O.t3p 157 HOH1 -0.8340 1558 O 26.5660 11.8200 36.1320 O.t3p 157 HOH1 -0.8340 1559 O 28.6850 11.1860 37.6520 O.t3p 157 HOH1 -0.8340 1560 O 14.1360 19.4930 43.2880 O.t3p 157 HOH1 -0.8340 1561 O 24.7110 11.1910 33.4150 O.t3p 157 HOH1 -0.8340 1562 O 19.4370 29.6050 46.2190 O.t3p 157 HOH1 -0.8340 1563 O 32.9500 37.8150 49.9630 O.t3p 157 HOH1 -0.8340 1564 O 32.5990 43.2190 35.6270 O.t3p 157 HOH1 -0.8340 1565 O 33.9980 40.8200 46.0570 O.t3p 157 HOH1 -0.8340 1566 O 41.6120 26.6320 46.7690 O.t3p 157 HOH1 -0.8340 1567 O 38.6010 28.3550 49.7910 O.t3p 157 HOH1 -0.8340 1568 O 38.2660 24.8820 49.5310 O.t3p 157 HOH1 -0.8340 1569 O 34.4400 33.8680 55.1420 O.t3p 157 HOH1 -0.8340 1570 O 45.3220 30.4780 43.9620 O.t3p 157 HOH1 -0.8340 1571 O 44.5050 10.3370 37.8420 O.t3p 157 HOH1 -0.8340 1572 O 41.8990 11.1420 40.8210 O.t3p 157 HOH1 -0.8340 1573 O 43.7440 11.2570 33.6250 O.t3p 157 HOH1 -0.8340 1574 O 47.6620 11.8830 38.5620 O.t3p 157 HOH1 -0.8340 1575 O 44.7900 10.6480 41.5160 O.t3p 157 HOH1 -0.8340 1576 O 47.1740 14.9920 35.6540 O.t3p 157 HOH1 -0.8340 1577 O 43.4800 15.8410 44.5010 O.t3p 157 HOH1 -0.8340 1578 O 39.5970 9.1740 36.8650 O.t3p 157 HOH1 -0.8340 1579 O 48.8310 19.7130 32.3350 O.t3p 157 HOH1 -0.8340 1580 O 47.7630 13.7200 42.8810 O.t3p 157 HOH1 -0.8340 1581 O 47.1000 19.3860 34.5860 O.t3p 157 HOH1 -0.8340 1582 O 49.3240 13.5800 40.2060 O.t3p 157 HOH1 -0.8340 1583 O 44.7810 14.6190 46.5360 O.t3p 157 HOH1 -0.8340 1584 O 32.0440 15.8030 47.5860 O.t3p 157 HOH1 -0.8340 1585 O 35.0020 12.6490 44.9180 O.t3p 157 HOH1 -0.8340 1586 O 39.3400 17.8470 47.6320 O.t3p 157 HOH1 -0.8340 1587 O 34.4290 14.3160 47.2510 O.t3p 157 HOH1 -0.8340 1588 O 32.3900 23.5590 51.2530 O.t3p 157 HOH1 -0.8340 1589 O 35.4750 19.5380 49.6150 O.t3p 157 HOH1 -0.8340 1590 O 39.8820 14.0230 46.1550 O.t3p 157 HOH1 -0.8340 1591 O 44.2900 17.5580 48.1870 O.t3p 157 HOH1 -0.8340 1592 O 37.1410 15.3940 47.3310 O.t3p 157 HOH1 -0.8340 1593 O 34.7190 21.7720 51.1250 O.t3p 157 HOH1 -0.8340 1594 O 37.0050 23.1440 52.5410 O.t3p 157 HOH1 -0.8340 1595 O 37.4560 22.3350 49.7300 O.t3p 157 HOH1 -0.8340 1596 O 41.5260 22.5760 47.3300 O.t3p 157 HOH1 -0.8340 1597 O 34.7350 24.3950 53.5580 O.t3p 157 HOH1 -0.8340 1598 O 32.8020 18.3200 48.7630 O.t3p 157 HOH1 -0.8340 1599 O 38.8140 22.4340 47.4420 O.t3p 157 HOH1 -0.8340 1600 O 41.7800 16.4870 46.9640 O.t3p 157 HOH1 -0.8340 1601 O 45.0770 26.4990 46.4070 O.t3p 157 HOH1 -0.8340 1602 O 35.5790 30.8290 51.6920 O.t3p 157 HOH1 -0.8340 1603 O 48.1400 30.6140 44.3890 O.t3p 157 HOH1 -0.8340 1604 O 47.8200 22.2780 35.6370 O.t3p 157 HOH1 -0.8340 1605 O 47.7700 24.3400 44.9370 O.t3p 157 HOH1 -0.8340 1606 O 47.4740 31.7700 40.3360 O.t3p 157 HOH1 -0.8340 1607 O 50.7770 26.4930 36.4370 O.t3p 157 HOH1 -0.8340 1608 O 50.8060 22.3350 33.6610 O.t3p 157 HOH1 -0.8340 1609 O 46.7950 22.4110 40.4990 O.t3p 157 HOH1 -0.8340 1610 O 50.0920 25.5640 44.3280 O.t3p 157 HOH1 -0.8340 1611 O 50.1930 28.5090 44.7590 O.t3p 157 HOH1 -0.8340 1612 O 15.3410 30.1970 45.2360 O.t3p 157 HOH1 -0.8340 1613 O 17.1910 30.8640 47.2780 O.t3p 157 HOH1 -0.8340 1614 O 25.9250 41.1490 49.7570 O.t3p 157 HOH1 -0.8340 1615 O 23.3520 41.9300 48.4610 O.t3p 157 HOH1 -0.8340 1616 O 23.6090 39.6900 50.1400 O.t3p 157 HOH1 -0.8340 1617 O 25.9100 38.4460 54.1740 O.t3p 157 HOH1 -0.8340 1618 O 27.4170 31.3580 54.2660 O.t3p 157 HOH1 -0.8340 1619 O 27.2920 33.6270 56.9200 O.t3p 157 HOH1 -0.8340 1620 O 48.7050 18.5970 38.5800 O.t3p 157 HOH1 -0.8340 1621 O 46.3920 19.7210 45.3590 O.t3p 157 HOH1 -0.8340 1622 O 49.7720 18.5150 42.1570 O.t3p 157 HOH1 -0.8340 1623 O 49.2530 16.1210 39.8410 O.t3p 157 HOH1 -0.8340 1624 O 47.0660 17.2380 47.1980 O.t3p 157 HOH1 -0.8340 1625 O 43.0950 9.3840 35.5710 O.t3p 157 HOH1 -0.8340 1626 O 47.3760 17.0580 32.3900 O.t3p 157 HOH1 -0.8340 1627 O 40.1730 9.1350 39.6930 O.t3p 157 HOH1 -0.8340 1628 O 42.5110 11.4000 43.8920 O.t3p 157 HOH1 -0.8340 1629 O 52.1880 27.4450 38.7090 O.t3p 157 HOH1 -0.8340 1630 O 51.4260 28.3650 34.4920 O.t3p 157 HOH1 -0.8340 1631 O 52.3490 25.5310 40.5320 O.t3p 157 HOH1 -0.8340 1632 O 49.8550 24.6170 41.3850 O.t3p 157 HOH1 -0.8340 1633 O 52.4730 27.7570 42.3830 O.t3p 157 HOH1 -0.8340 1634 O 47.6510 21.6930 43.7480 O.t3p 157 HOH1 -0.8340 1635 O 48.9290 28.3630 37.0370 O.t3p 157 HOH1 -0.8340 1636 O 50.1690 31.6320 39.2960 O.t3p 157 HOH1 -0.8340 1637 O 55.2480 27.9190 29.7390 O.t3p 157 HOH1 -0.8340 1638 O 47.8340 23.6390 38.2160 O.t3p 157 HOH1 -0.8340 1639 O 50.3010 23.8090 35.8300 O.t3p 157 HOH1 -0.8340 1640 O 44.3490 36.2190 24.3140 O.t3p 157 HOH1 -0.8340 1641 O 49.7370 35.0890 29.2050 O.t3p 157 HOH1 -0.8340 1642 O 48.8280 33.3720 27.1680 O.t3p 157 HOH1 -0.8340 1643 O 49.3090 29.3530 26.2500 O.t3p 157 HOH1 -0.8340 1644 O 46.7110 39.9540 26.7170 O.t3p 157 HOH1 -0.8340 1645 O 47.5860 35.5390 18.6140 O.t3p 157 HOH1 -0.8340 1646 O 41.8480 40.9580 32.0310 O.t3p 157 HOH1 -0.8340 1647 O 44.3460 41.1970 34.1310 O.t3p 157 HOH1 -0.8340 1648 O 46.9490 36.1060 25.2720 O.t3p 157 HOH1 -0.8340 1649 O 50.6900 24.5350 28.9980 O.t3p 157 HOH1 -0.8340 1650 O 43.8740 41.9590 26.9240 O.t3p 157 HOH1 -0.8340 1651 O 41.5610 43.0830 33.7040 O.t3p 157 HOH1 -0.8340 1652 O 44.9410 41.8770 30.5010 O.t3p 157 HOH1 -0.8340 1653 O 47.8320 40.9170 29.2630 O.t3p 157 HOH1 -0.8340 1654 O 39.6700 37.1360 23.1460 O.t3p 157 HOH1 -0.8340 1655 O 49.6340 31.3110 36.5270 O.t3p 157 HOH1 -0.8340 1656 O 51.6670 33.4830 33.9940 O.t3p 157 HOH1 -0.8340 1657 O 42.5450 40.4200 20.7350 O.t3p 157 HOH1 -0.8340 1658 O 53.4890 30.8620 31.1560 O.t3p 157 HOH1 -0.8340 1659 O 40.6180 24.1780 17.8330 O.t3p 157 HOH1 -0.8340 1660 O 45.8060 13.7530 30.2890 O.t3p 157 HOH1 -0.8340 1661 O 50.5170 19.0910 29.5810 O.t3p 157 HOH1 -0.8340 1662 O 49.0110 16.8610 30.0820 O.t3p 157 HOH1 -0.8340 1663 O 26.6000 11.5550 27.1110 O.t3p 157 HOH1 -0.8340 1664 O 35.8160 10.7170 39.9140 O.t3p 157 HOH1 -0.8340 1665 O 38.7400 21.1030 17.3130 O.t3p 157 HOH1 -0.8340 1666 O 40.5580 16.7110 23.1100 O.t3p 157 HOH1 -0.8340 1667 O 45.1320 13.2760 23.5750 O.t3p 157 HOH1 -0.8340 1668 O 48.9100 16.6330 26.1890 O.t3p 157 HOH1 -0.8340 1669 O 44.2990 38.6720 21.6650 O.t3p 157 HOH1 -0.8340 1670 O 46.2090 36.6620 22.0150 O.t3p 157 HOH1 -0.8340 1671 O 52.5870 31.8940 27.7330 O.t3p 157 HOH1 -0.8340 1672 O 51.5030 24.9720 31.7900 O.t3p 157 HOH1 -0.8340 1673 O 48.7320 34.7660 33.4000 O.t3p 157 HOH1 -0.8340 1674 O 49.2160 37.9160 31.7560 O.t3p 157 HOH1 -0.8340 1675 O 44.2520 38.3710 38.1070 O.t3p 157 HOH1 -0.8340 1676 O 46.1950 39.1780 36.1230 O.t3p 157 HOH1 -0.8340 1677 O 46.7510 32.8380 20.5380 O.t3p 157 HOH1 -0.8340 1678 O 47.0090 30.5970 22.2160 O.t3p 157 HOH1 -0.8340 1679 O 50.4870 24.7790 22.1280 O.t3p 157 HOH1 -0.8340 1680 O 47.3270 32.3210 17.9060 O.t3p 157 HOH1 -0.8340 1681 O 43.4130 24.0810 16.2110 O.t3p 157 HOH1 -0.8340 1682 O 50.9470 21.9360 23.0040 O.t3p 157 HOH1 -0.8340 1683 O 46.9570 26.0470 18.4530 O.t3p 157 HOH1 -0.8340 1684 O 45.3250 31.0290 14.6970 O.t3p 157 HOH1 -0.8340 1685 O 47.0430 27.9510 14.0760 O.t3p 157 HOH1 -0.8340 1686 O 46.6090 35.5130 15.7110 O.t3p 157 HOH1 -0.8340 1687 O 51.7000 20.0390 24.9300 O.t3p 157 HOH1 -0.8340 1688 O 8.9920 30.1320 42.2670 O.t3p 157 HOH1 -0.8340 1689 O 5.7300 30.2950 36.3680 O.t3p 157 HOH1 -0.8340 1690 O 3.1560 31.0750 35.0720 O.t3p 157 HOH1 -0.8340 1691 O 7.5640 34.6110 37.1050 O.t3p 157 HOH1 -0.8340 1692 O 8.2200 33.5640 39.4860 O.t3p 157 HOH1 -0.8340 1693 O 3.9910 33.7750 33.1480 O.t3p 157 HOH1 -0.8340 1694 O 10.7070 32.4070 43.5350 O.t3p 157 HOH1 -0.8340 1695 O 7.2000 37.4030 37.5630 O.t3p 157 HOH1 -0.8340 1696 O 10.3150 35.0650 42.7130 O.t3p 157 HOH1 -0.8340 1697 O 14.6040 34.4370 44.9820 O.t3p 157 HOH1 -0.8340 1698 O 52.2750 24.5440 26.7350 O.t3p 157 HOH1 -0.8340 1699 O 50.9590 26.5010 24.1520 O.t3p 157 HOH1 -0.8340 1700 O 49.3210 28.4400 23.3810 O.t3p 157 HOH1 -0.8340 1701 O 52.7170 28.8760 27.0290 O.t3p 157 HOH1 -0.8340 1702 O 34.9100 40.0600 29.6720 O.t3p 157 HOH1 -0.8340 1703 O 46.4220 38.2130 18.1800 O.t3p 157 HOH1 -0.8340 1704 O 48.2410 33.8210 23.9760 O.t3p 157 HOH1 -0.8340 1705 O 46.1630 35.7950 40.8310 O.t3p 157 HOH1 -0.8340 1706 O 38.8180 42.1680 33.1250 O.t3p 157 HOH1 -0.8340 1707 O 40.6780 41.5030 29.6770 O.t3p 157 HOH1 -0.8340 1708 O 42.8200 45.0550 32.0920 O.t3p 157 HOH1 -0.8340 1709 O 46.4700 46.4340 36.9560 O.t3p 157 HOH1 -0.8340 1710 O 45.2010 43.4880 32.8800 O.t3p 157 HOH1 -0.8340 1711 O 46.9290 43.5910 37.8320 O.t3p 157 HOH1 -0.8340 1712 O 43.9680 46.8130 36.0930 O.t3p 157 HOH1 -0.8340 1713 O 48.2690 16.7150 23.2790 O.t3p 157 HOH1 -0.8340 1714 O 40.5580 22.6850 15.1730 O.t3p 157 HOH1 -0.8340 1715 O 45.5790 21.4280 18.8750 O.t3p 157 HOH1 -0.8340 1716 O 46.2530 18.9440 20.7150 O.t3p 157 HOH1 -0.8340 1717 O 48.7670 29.9570 15.2040 O.t3p 157 HOH1 -0.8340 1718 O 41.0240 38.5240 45.2960 O.t3p 157 HOH1 -0.8340 1719 O 41.7890 35.4080 45.1180 O.t3p 157 HOH1 -0.8340 1720 O 31.7980 32.3710 54.7420 O.t3p 157 HOH1 -0.8340 1721 O 23.2100 44.6060 43.6350 O.t3p 157 HOH1 -0.8340 1722 O 34.7230 42.7580 32.1410 O.t3p 157 HOH1 -0.8340 1723 O 44.8920 38.2880 41.0170 O.t3p 157 HOH1 -0.8340 1724 O 26.1410 46.0830 43.8510 O.t3p 157 HOH1 -0.8340 1725 O 36.5730 43.4260 34.1820 O.t3p 157 HOH1 -0.8340 1726 O 28.9780 46.0480 43.6390 O.t3p 157 HOH1 -0.8340 1727 O 41.5110 48.6530 40.0990 O.t3p 157 HOH1 -0.8340 1728 O 38.9480 47.5270 39.0600 O.t3p 157 HOH1 -0.8340 1729 O 42.3040 45.6170 41.9790 O.t3p 157 HOH1 -0.8340 1730 O 44.0500 45.4040 39.3860 O.t3p 157 HOH1 -0.8340 1731 O 40.0760 45.4090 35.1490 O.t3p 157 HOH1 -0.8340 1732 O 23.8950 8.1570 23.9020 O.t3p 157 HOH1 -0.8340 1733 O 28.6350 8.8570 18.9450 O.t3p 157 HOH1 -0.8340 1734 O 36.1800 43.2340 36.9000 O.t3p 157 HOH1 -0.8340 1735 O 32.1740 46.5060 40.8860 O.t3p 157 HOH1 -0.8340 1736 O 32.6250 45.6970 38.0740 O.t3p 157 HOH1 -0.8340 1737 O 33.4470 36.4350 52.6130 O.t3p 157 HOH1 -0.8340 1738 O 23.9270 41.4140 45.8290 O.t3p 157 HOH1 -0.8340 1739 O 32.7230 44.0290 42.1470 O.t3p 157 HOH1 -0.8340 1740 O 36.1320 45.4640 43.2250 O.t3p 157 HOH1 -0.8340 1741 O 36.6950 45.9380 35.6740 O.t3p 157 HOH1 -0.8340 1742 O 23.2620 42.5700 41.7750 O.t3p 157 HOH1 -0.8340 1743 O 30.9040 30.8860 52.4800 O.t3p 157 HOH1 -0.8340 1744 O 42.2100 41.3740 42.1400 O.t3p 157 HOH1 -0.8340 1745 O 30.8460 44.9660 34.6960 O.t3p 157 HOH1 -0.8340 1746 O 39.3270 13.4890 21.3500 O.t3p 157 HOH1 -0.8340 1747 O 35.0530 17.0640 16.3500 O.t3p 157 HOH1 -0.8340 1748 O 38.2450 12.9640 28.4290 O.t3p 157 HOH1 -0.8340 1749 O 38.5950 14.7990 23.6540 O.t3p 157 HOH1 -0.8340 1750 O 35.6540 18.7220 18.3050 O.t3p 157 HOH1 -0.8340 1751 O 33.7270 12.4820 24.5000 O.t3p 157 HOH1 -0.8340 1752 O 33.8680 9.6450 29.9430 O.t3p 157 HOH1 -0.8340 1753 O 30.7730 9.3700 24.7840 O.t3p 157 HOH1 -0.8340 1754 O 32.1650 10.5780 32.0070 O.t3p 157 HOH1 -0.8340 1755 O 39.9030 18.4300 17.7480 O.t3p 157 HOH1 -0.8340 1756 O 46.6190 17.0610 28.1330 O.t3p 157 HOH1 -0.8340 1757 O 36.1930 11.5110 26.1770 O.t3p 157 HOH1 -0.8340 1758 O 24.0300 11.5190 29.3070 O.t3p 157 HOH1 -0.8340 1759 O 31.5650 9.3730 36.0980 O.t3p 157 HOH1 -0.8340 1760 O 32.7810 10.3420 22.5130 O.t3p 157 HOH1 -0.8340 1761 O 33.3930 12.2580 28.3440 O.t3p 157 HOH1 -0.8340 1762 O 28.6030 12.5960 34.3600 O.t3p 157 HOH1 -0.8340 1763 O 36.8640 10.6090 34.4270 O.t3p 157 HOH1 -0.8340 1764 O 30.6100 11.4800 20.2720 O.t3p 157 HOH1 -0.8340 1765 O 26.9040 8.5300 21.1980 O.t3p 157 HOH1 -0.8340 1766 O 21.1760 10.1220 28.2680 O.t3p 157 HOH1 -0.8340 1767 O 28.5090 7.7420 25.1910 O.t3p 157 HOH1 -0.8340 1768 O 28.9590 6.9330 22.3800 O.t3p 157 HOH1 -0.8340 1769 O 26.2400 8.9940 26.2080 O.t3p 157 HOH1 -0.8340 1770 O 39.5670 13.8580 26.0640 O.t3p 157 HOH1 -0.8340 1771 O 44.9040 14.7860 26.8660 O.t3p 157 HOH1 -0.8340 1772 O 33.6160 16.0230 20.7670 O.t3p 157 HOH1 -0.8340 1773 O 42.7190 12.6510 28.3390 O.t3p 157 HOH1 -0.8340 1774 O 36.1180 13.4340 20.2090 O.t3p 157 HOH1 -0.8340 1775 O 29.6590 13.7610 27.9970 O.t3p 157 HOH1 -0.8340 1776 O 36.8770 12.3790 36.4640 O.t3p 157 HOH1 -0.8340 1777 O 36.8430 12.5730 31.9980 O.t3p 157 HOH1 -0.8340 1778 O 40.4330 10.7880 33.4360 O.t3p 157 HOH1 -0.8340 1779 O 34.7540 14.3390 22.6080 O.t3p 157 HOH1 -0.8340 1780 O 29.1140 11.0790 27.8860 O.t3p 157 HOH1 -0.8340 1781 O 27.4570 10.8380 30.3590 O.t3p 157 HOH1 -0.8340 1782 O 50.0610 19.0340 26.8520 O.t3p 157 HOH1 -0.8340 1783 O 39.0690 15.7290 19.6710 O.t3p 157 HOH1 -0.8340 1784 O 43.4770 19.2650 21.7040 O.t3p 157 HOH1 -0.8340 1785 H2 23.8142 43.3686 16.1058 H 1 PRO1 0.4219 1786 H3 24.0005 43.5463 17.7453 H 1 PRO1 0.4219 1787 HA 25.8765 42.7015 15.7397 H 1 PRO1 -0.0217 1788 H 26.3621 40.6575 16.0868 H 2 LEU2 0.2624 1789 HA 24.6526 39.0941 17.8297 H 2 LEU2 0.1370 1790 H 24.9774 38.6951 19.9515 H 3 HIE3 0.2817 1791 HA 27.7395 38.4776 21.0163 H 3 HIE3 0.0852 1792 H 27.8749 37.4609 23.0838 H 4 VAL4 0.4400 1793 HA 25.7779 35.4883 23.6374 H 4 VAL4 -0.0262 1794 H 26.0544 34.7107 25.7057 H 5 THR5 0.2553 1795 HA 28.5452 35.2041 27.1752 H 5 THR5 0.1638 1796 H 28.9928 33.7869 28.7029 H 6 PHE6 0.2341 1797 HA 27.2391 31.4779 29.1041 H 6 PHE6 0.1024 1798 H 26.0089 31.8161 30.7080 H 7 VAL7 0.4400 1799 HA 26.4827 33.6305 33.0355 H 7 VAL7 -0.0262 1800 H 25.9873 33.0062 35.0201 H 8 CYS8 0.2952 1801 HA 26.1359 30.2920 36.0704 H 8 CYS8 0.1405 1802 H 26.9052 30.1172 38.5490 H 9 THR9 0.2553 1803 HA 25.9916 32.5492 39.9755 H 9 THR9 0.1638 1804 H 29.2298 31.0940 39.5429 H 10 GLY10 0.2540 1805 HA2 30.5836 33.1152 41.1745 H 10 GLY10 0.0889 1806 HA3 31.2538 31.5935 40.5771 H 10 GLY10 0.0889 1807 H 31.5589 31.5144 38.2404 H 11 ASN11 0.2545 1808 HA 32.2371 32.3004 36.1441 H 11 ASN11 0.0596 1809 H 33.7750 31.1414 38.4094 H 12 ILE12 0.3288 1810 HA 36.5034 31.7693 37.4596 H 12 ILE12 0.1742 1811 H 34.1777 29.4167 36.7797 H 13 CYS13 0.2952 1812 HA 36.3283 27.3419 36.3461 H 13 CYS13 0.1405 1813 H 33.1704 26.2310 35.7414 H 14 ARG14 0.2337 1814 HA 33.4404 25.3679 33.1908 H 14 ARG14 0.0533 1815 H 31.7812 28.3467 34.0342 H 15 SER15 0.3454 1816 HA 31.3784 29.0950 31.3952 H 15 SER15 0.1422 1817 HA 35.4277 31.7395 31.0337 H 16 PRO16 0.0600 1818 H 35.4134 28.0764 31.7378 H 17 MET17 0.2805 1819 HA 37.3914 27.6367 29.6872 H 17 MET17 0.1231 1820 H 33.9125 26.9660 29.5825 H 18 ALA18 0.2943 1821 HA 33.1008 26.7180 27.0159 H 18 ALA18 0.1208 1822 H 33.7630 29.9740 28.4685 H 19 GLU19 0.3068 1823 HA 33.4926 31.5451 26.1832 H 19 GLU19 0.0651 1824 H 36.5323 30.3921 27.7500 H 20 LYS20 0.2513 1825 HA 38.0686 31.5270 25.5778 H 20 LYS20 0.1295 1826 H 36.6557 28.2897 25.9265 H 21 MET21 0.2805 1827 HA 38.0154 27.2335 23.6127 H 21 MET21 0.1231 1828 H 34.9413 29.0752 24.0501 H 22 PHE22 0.2341 1829 HA 34.0451 28.2110 21.4082 H 22 PHE22 0.1024 1830 H 35.2620 31.2578 22.7383 H 23 ALA23 0.2943 1831 HA 34.9931 32.8893 20.4875 H 23 ALA23 0.1208 1832 H 37.8394 31.1280 21.6357 H 24 GLN24 0.3006 1833 HA 39.6690 31.7714 19.5960 H 24 GLN24 0.1523 1834 H 37.5231 28.9487 19.9063 H 25 GLN25 0.3006 1835 HA 38.1093 27.7404 17.4035 H 25 GLN25 0.1523 1836 H 35.8370 30.4895 18.1008 H 26 LEU26 0.2624 1837 HA 34.7051 30.4490 15.4009 H 26 LEU26 0.1370 1838 H 37.3201 32.1909 17.0077 H 27 ARG27 0.2337 1839 HA 38.2546 33.7760 14.8873 H 27 ARG27 0.0533 1840 H 38.6937 30.2807 15.5345 H 28 HIE28 0.2817 1841 HA 40.4489 29.9273 13.2882 H 28 HIE28 0.0852 1842 H 37.0235 30.2439 13.5172 H 29 ARG29 0.2337 1843 HA 36.7684 29.1211 10.7919 H 29 ARG29 0.0533 1844 H 37.4133 32.0145 12.2420 H 30 GLY30 0.2540 1845 HA2 38.2160 33.8732 11.0795 H 30 GLY30 0.0889 1846 HA3 37.1569 33.4911 9.7086 H 30 GLY30 0.0889 1847 H 35.9590 33.4519 12.9604 H 31 LEU31 0.2624 1848 HA 34.1466 35.7204 12.4156 H 31 LEU31 0.1370 1849 H 36.7321 35.4166 14.2505 H 32 GLY32 0.2540 1850 HA2 35.6094 35.4103 16.8865 H 32 GLY32 0.0889 1851 HA3 37.2815 35.8146 16.4428 H 32 GLY32 0.0889 1852 H 37.3090 37.8853 15.0360 H 33 ASP33 0.3197 1853 HA 36.6697 40.1121 16.6360 H 33 ASP33 0.0824 1854 H 34.6462 38.4945 14.5538 H 34 ALA34 0.2943 1855 HA 32.8148 40.7107 13.9888 H 34 ALA34 0.1208 1856 H 32.8546 37.7595 15.9773 H 35 VAL35 0.4400 1857 HA 30.0542 38.2763 16.8798 H 35 VAL35 -0.0262 1858 H 29.6373 38.0855 19.1677 H 36 ARG36 0.2337 1859 HA 32.1858 38.6789 20.6353 H 36 ARG36 0.0533 1860 H 32.7401 37.8432 22.5821 H 37 VAL37 0.4400 1861 HA 30.7735 35.9139 23.7961 H 37 VAL37 -0.0262 1862 H 30.5562 36.5338 25.8091 H 38 THR38 0.2553 1863 HA 32.8830 36.9759 27.6435 H 38 THR38 0.1638 1864 H 32.2697 36.6538 29.9015 H 39 SER39 0.3454 1865 HA 30.2230 34.6817 30.5459 H 39 SER39 0.1422 1866 H 29.7797 34.7790 32.9814 H 40 ALA40 0.2943 1867 HA 30.8980 36.8024 34.6599 H 40 ALA40 0.1208 1868 H 29.8985 36.7243 36.7575 H 41 GLY41 0.2540 1869 HA2 27.9365 34.5387 37.0343 H 41 GLY41 0.0889 1870 HA3 28.9202 35.2330 38.3249 H 41 GLY41 0.0889 1871 H 25.8464 34.6501 37.9544 H 42 THR42 0.2553 1872 HA 24.4614 37.1458 38.3869 H 42 THR42 0.1638 1873 H 26.4028 35.1282 40.6423 H 43 GLY43 0.2540 1874 HA2 25.2704 36.4908 42.9854 H 43 GLY43 0.0889 1875 HA3 26.7081 35.4534 42.9519 H 43 GLY43 0.0889 1876 H 27.4121 37.1274 44.4491 H 44 ASN44 0.2545 1877 HA 29.0861 39.1782 42.9767 H 44 ASN44 0.0596 1878 H 29.3139 36.2394 44.6159 H 45 TRP45 0.2417 1879 HA 31.0335 37.0695 46.8177 H 45 TRP45 0.1066 1880 H 31.7911 36.3471 43.5438 H 46 HIE46 0.2817 1881 HA 34.5709 35.6410 44.2257 H 46 HIE46 0.0852 1882 H 32.7658 38.2128 42.8522 H 47 VAL47 0.4400 1883 HA 34.1839 38.8463 40.4959 H 47 VAL47 -0.0262 1884 H 36.0308 39.6517 40.0086 H 48 GLY48 0.2540 1885 HA2 38.0217 41.0421 40.4170 H 48 GLY48 0.0889 1886 HA3 37.8996 40.6595 42.1387 H 48 GLY48 0.0889 1887 H 37.3974 37.7709 41.5450 H 49 SER49 0.3454 1888 HA 40.1997 36.9717 41.6458 H 49 SER49 0.1422 1889 H 41.1775 35.4477 40.1085 H 50 CYS50 0.2952 1890 HA 40.1863 35.6756 37.3346 H 50 CYS50 0.1405 1891 H 40.6603 33.2725 36.0870 H 51 ALA51 0.2943 1892 HA 38.8408 31.4482 37.2169 H 51 ALA51 0.1208 1893 H 39.2315 29.1679 37.8606 H 52 ASP52 0.3197 1894 HA 41.3147 28.8010 39.7083 H 52 ASP52 0.0824 1895 H 42.9644 27.3467 39.9125 H 53 GLU53 0.3068 1896 HA 44.9152 27.7263 37.7846 H 53 GLU53 0.0651 1897 H 42.7492 25.0351 38.6308 H 54 ARG54 0.2337 1898 HA 43.8768 23.1768 36.7118 H 54 ARG54 0.0533 1899 H 40.8214 25.1529 36.7305 H 55 ALA55 0.2943 1900 HA 39.9456 24.7469 34.1104 H 55 ALA55 0.1208 1901 H 42.2584 27.2068 35.0948 H 56 ALA56 0.2943 1902 HA 43.2539 28.0289 32.6290 H 56 ALA56 0.1208 1903 H 44.4401 25.4026 34.6509 H 57 GLY57 0.2540 1904 HA2 46.6881 24.6434 33.1120 H 57 GLY57 0.0889 1905 HA3 45.8359 23.6249 34.2809 H 57 GLY57 0.0889 1906 H 43.3488 23.3844 32.9793 H 58 VAL58 0.4400 1907 HA 44.0233 21.3509 30.9644 H 58 VAL58 -0.0262 1908 H 42.5460 24.7017 31.0291 H 59 LEU59 0.2624 1909 HA 42.1474 24.8424 28.2263 H 59 LEU59 0.1370 1910 H 45.1340 25.8971 30.0198 H 60 ARG60 0.2337 1911 HA 46.4558 26.7287 27.6488 H 60 ARG60 0.0533 1912 H 46.5516 23.5554 29.5219 H 61 ALA61 0.2943 1913 HA 48.4854 22.2253 28.1208 H 61 ALA61 0.1208 1914 H 45.1958 22.5973 26.9015 H 62 HIE62 0.2817 1915 HA 45.7801 21.2246 24.3818 H 62 HIE62 0.0852 1916 H 46.6691 24.2621 25.3337 H 63 GLY63 0.2540 1917 HA2 47.4009 25.9761 23.8811 H 63 GLY63 0.0889 1918 HA3 46.6401 25.1424 22.5244 H 63 GLY63 0.0889 1919 H 44.7576 26.3003 25.4342 H 64 TYR64 0.2635 1920 HA 43.4848 28.2293 23.5469 H 64 TYR64 0.0955 1921 HA 44.9331 31.5542 26.1862 H 65 PRO65 0.0600 1922 H 44.2513 32.8773 28.1882 H 66 THR66 0.2553 1923 HA 42.9540 31.2755 30.1998 H 66 THR66 0.1638 1924 H 44.3647 34.3419 29.2059 H 67 ASP67 0.3197 1925 HA 44.2017 35.8289 31.6307 H 67 ASP67 0.0824 1926 H 42.3972 36.2555 32.7611 H 68 HIE68 0.2817 1927 HA 39.7911 36.8132 31.6588 H 68 HIE68 0.0852 1928 H 38.2133 37.4286 33.4098 H 69 ARG69 0.2337 1929 HA 39.1195 37.3142 36.2207 H 69 ARG69 0.0533 1930 H 37.3154 36.8510 37.5590 H 70 ALA70 0.2943 1931 HA 34.7178 36.3586 36.5200 H 70 ALA70 0.1208 1932 H 32.9323 37.6061 36.2994 H 71 ALA71 0.2943 1933 HA 32.9955 40.5077 36.8238 H 71 ALA71 0.1208 1934 H 30.6138 41.4099 36.8026 H 72 GLN72 0.3006 1935 HA 28.6601 39.3888 37.7211 H 72 GLN72 0.1523 1936 H 26.8851 38.9558 36.5957 H 73 VAL73 0.4400 1937 HA 26.4545 39.8876 33.9539 H 73 VAL73 -0.0262 1938 H 25.7095 41.7445 33.0223 H 74 GLY74 0.2540 1939 HA2 23.8087 43.5095 34.3854 H 74 GLY74 0.0889 1940 HA3 25.4645 44.1292 34.1993 H 74 GLY74 0.0889 1941 H 24.4325 45.8505 32.7106 H 75 THR75 0.2553 1942 HA 22.5324 45.0995 30.7236 H 75 THR75 0.1638 1943 H 26.0044 45.6651 30.4283 H 76 GLU76 0.3068 1944 HA 26.3975 45.1668 27.7591 H 76 GLU76 0.0651 1945 H 25.3072 42.6888 30.0968 H 77 HIE77 0.2817 1946 HA 26.2737 40.5422 28.3195 H 77 HIE77 0.0852 1947 H 23.5689 42.2896 29.1508 H 78 LEU78 0.2624 1948 HA 21.5852 40.0915 28.8348 H 78 LEU78 0.1370 1949 H 23.0004 42.6775 27.1560 H 79 ALA79 0.2943 1950 HA 20.9904 42.8483 25.0766 H 79 ALA79 0.1208 1951 H 23.4336 40.5694 25.9040 H 80 ALA80 0.2943 1952 HA 24.2421 39.4075 23.6487 H 80 ALA80 0.1208 1953 H 23.3632 38.3533 21.8334 H 81 ASP81 0.3197 1954 HA 20.5717 37.6914 21.5372 H 81 ASP81 0.0824 1955 H 22.9121 36.3074 23.5766 H 82 LEU82 0.2624 1956 HA 21.1082 34.1264 24.2016 H 82 LEU82 0.1370 1957 H 21.1661 33.4522 26.0389 H 83 LEU83 0.2624 1958 HA 23.1856 34.1702 28.1085 H 83 LEU83 0.1370 1959 H 24.4185 32.3295 27.6545 H 84 VAL84 0.4400 1960 HA 23.1886 29.6338 27.6380 H 84 VAL84 -0.0262 1961 H 22.2821 29.1024 29.5589 H 85 ALA85 0.2943 1962 HA 23.7136 29.2103 32.0898 H 85 ALA85 0.1208 1963 H 25.1221 27.7991 33.0316 H 86 LEU86 0.2624 1964 HA 26.1413 25.5439 31.3872 H 86 LEU86 0.1370 1965 H 24.2984 26.0432 34.4171 H 87 ASP87 0.3197 1966 HA 23.4562 23.1870 34.1404 H 87 ASP87 0.0824 1967 H 21.4708 23.0990 35.6948 H 88 ARG88 0.2337 1968 HA 19.4221 24.5428 34.4666 H 88 ARG88 0.0533 1969 H 21.1711 25.5483 37.3490 H 89 ASN89 0.2545 1970 HA 19.0126 27.1176 38.3844 H 89 ASN89 0.0596 1971 H 21.8275 28.0363 36.4468 H 90 HIE90 0.2817 1972 HA 21.4746 30.8741 36.6394 H 90 HIE90 0.0852 1973 H 20.0956 28.5769 34.3540 H 91 ALA91 0.2943 1974 HA 18.5366 30.2407 32.6126 H 91 ALA91 0.1208 1975 H 17.4485 28.6343 35.7666 H 92 ARG92 0.2337 1976 HA 14.8608 29.7331 35.7694 H 92 ARG92 0.0533 1977 H 17.8192 31.1102 36.8313 H 93 LEU93 0.2624 1978 HA 16.7965 33.3287 38.4037 H 93 LEU93 0.1370 1979 H 18.2119 32.9381 35.1498 H 94 LEU94 0.2624 1980 HA 17.7491 35.7092 34.3723 H 94 LEU94 0.1370 1981 H 15.7131 32.7105 34.0649 H 95 ARG95 0.2337 1982 HA 13.5038 34.0525 32.8229 H 95 ARG95 0.0533 1983 H 14.5871 34.1944 36.0958 H 96 GLN96 0.3006 1984 HA 12.2176 35.6249 37.1079 H 96 GLN96 0.1523 1985 H 15.5284 36.6665 35.9545 H 97 LEU97 0.2624 1986 HA 15.5132 39.0274 37.5852 H 97 LEU97 0.1370 1987 H 14.5672 38.1771 34.3531 H 98 GLY98 0.2540 1988 HA2 12.7823 40.0498 33.6322 H 98 GLY98 0.0889 1989 HA3 14.3315 40.8629 33.3785 H 98 GLY98 0.0889 1990 H 14.9423 37.5464 32.7532 H 99 VAL99 0.4400 1991 HA 14.7961 38.2275 29.8667 H 99 VAL99 -0.0262 1992 H 13.3330 37.2026 28.3806 H 100 GLU100 0.3068 1993 HA 11.3845 35.3294 29.4308 H 100 GLU100 0.0651 1994 H 11.3184 33.1707 29.3834 H 101 ALA101 0.2943 1995 HA 13.2893 31.4337 29.2008 H 101 ALA101 0.1208 1996 H 11.7642 32.4156 26.0874 H 102 ALA102 0.2943 1997 HA 13.0862 30.5310 24.3959 H 102 ALA102 0.1208 1998 H 14.5232 33.3708 25.8710 H 103 ARG103 0.2337 1999 HA 16.8590 33.4376 24.0816 H 103 ARG103 0.0533 2000 H 16.0328 31.8037 26.9299 H 104 VAL104 0.4400 2001 HA 18.7295 31.5349 28.0053 H 104 VAL104 -0.0262 2002 H 20.0389 29.9050 27.2875 H 105 ARG105 0.2337 2003 HA 18.7111 27.3174 26.8526 H 105 ARG105 0.0533 2004 H 19.4895 25.5552 27.5418 H 106 MET106 0.2805 2005 HA 21.6627 25.6577 29.5625 H 106 MET106 0.1231 2006 H 23.8938 25.3624 28.8323 H 107 LEU107 0.2624 2007 HA 24.7975 25.0683 26.2332 H 107 LEU107 0.1370 2008 H 24.1310 22.2339 28.3489 H 108 ARG108 0.2337 2009 HA 25.0024 20.4000 26.3287 H 108 ARG108 0.0533 2010 H 22.2891 22.2649 26.2866 H 109 SER109 0.3454 2011 HA 20.5645 20.4763 24.8399 H 109 SER109 0.1422 2012 H 23.5075 22.0231 23.9195 H 110 PHE110 0.2341 2013 HA 22.7191 22.4713 21.1889 H 110 PHE110 0.1024 2014 H 24.7992 20.2597 22.9845 H 111 ASP111 0.3197 2015 HA 25.9601 18.5199 21.1583 H 111 ASP111 0.0824 2016 HA 22.2977 17.4556 18.7674 H 112 PRO112 0.0600 2017 H 24.1154 15.2749 20.6692 H 113 ARG113 0.2337 2018 HA 22.3700 13.0240 20.4298 H 113 ARG113 0.0533 2019 H 21.6808 15.7770 21.8516 H 114 SER114 0.3454 2020 HA 20.5501 14.9812 24.4072 H 114 SER114 0.1422 2021 H 18.4621 14.7030 24.9160 H 115 GLY115 0.2540 2022 HA2 16.4651 14.8082 22.8481 H 115 GLY115 0.0889 2023 HA3 16.2730 14.2314 24.5093 H 115 GLY115 0.0889 2024 H 14.2395 15.3540 24.5226 H 116 THR116 0.2553 2025 HA 14.1808 18.2633 24.7002 H 116 THR116 0.1638 2026 H 14.3707 15.4738 27.0294 H 117 HIE117 0.2817 2027 HA 14.3550 17.3432 29.2849 H 117 HIE117 0.0852 2028 H 15.9595 18.5603 30.1467 H 118 ALA118 0.2943 2029 HA 18.4091 18.8435 28.5753 H 118 ALA118 0.1208 2030 H 20.5416 18.7210 29.2502 H 119 LEU119 0.2624 2031 HA 21.0574 17.3527 31.8879 H 119 LEU119 0.1370 2032 H 22.6469 18.0854 33.2481 H 120 ASP120 0.3197 2033 HA 23.4450 20.9095 32.9290 H 120 ASP120 0.0824 2034 H 25.5499 21.7490 33.1349 H 121 VAL121 0.4400 2035 HA 27.7483 19.8005 32.6514 H 121 VAL121 -0.0262 2036 H 28.5613 19.0496 34.6019 H 122 GLU122 0.3068 2037 HA 27.7550 20.3001 37.0449 H 122 GLU122 0.0651 2038 H 28.8871 20.7075 38.8356 H 123 ASP123 0.3197 2039 HA 30.9362 22.6966 38.5068 H 123 ASP123 0.0824 2040 HA 34.4026 19.8526 38.7943 H 124 PRO124 0.0600 2041 H 33.8292 22.6977 40.7651 H 125 TYR125 0.2635 2042 HA 36.6191 23.2114 41.3367 H 125 TYR125 0.0955 2043 H 34.2051 21.4919 43.2347 H 126 TYR126 0.2635 2044 HA 36.0406 20.9397 45.4738 H 126 TYR126 0.0955 2045 H 35.1003 19.4875 42.4709 H 127 GLY127 0.2540 2046 HA2 36.3228 16.9876 43.2651 H 127 GLY127 0.0889 2047 HA3 35.9969 17.5597 41.6170 H 127 GLY127 0.0889 2048 H 37.8667 16.9709 40.8195 H 128 ASP128 0.3197 2049 HA 40.1272 18.7439 41.4242 H 128 ASP128 0.0824 2050 H 42.0454 18.3859 39.7371 H 129 HIE129 0.2817 2051 HA 41.4963 19.2149 37.2525 H 129 HIE129 0.0852 2052 H 41.1988 15.7877 38.0795 H 130 SER130 0.3454 2053 HA 40.5854 14.9169 35.4135 H 130 SER130 0.1422 2054 H 38.2666 16.1813 37.9446 H 131 ASP131 0.3197 2055 HA 35.8935 15.7949 36.3264 H 131 ASP131 0.0824 2056 H 38.1361 18.5422 36.9359 H 132 PHE132 0.2341 2057 HA 37.0659 20.2956 35.0337 H 132 PHE132 0.1024 2058 H 39.5889 17.8199 34.3116 H 133 GLU133 0.3068 2059 HA 39.4707 18.0103 31.5024 H 133 GLU133 0.0651 2060 H 36.9608 16.3081 33.5816 H 134 GLU134 0.3068 2061 HA 35.6086 15.3180 31.1957 H 134 GLU134 0.0651 2062 H 34.9116 18.2274 33.3847 H 135 VAL135 0.4400 2063 HA 33.0667 19.6266 31.7735 H 135 VAL135 -0.0262 2064 H 36.6614 19.9992 31.1317 H 136 PHE136 0.2341 2065 HA 36.2535 21.3195 28.6527 H 136 PHE136 0.1024 2066 H 35.9652 17.6085 29.1851 H 137 ALA137 0.2943 2067 HA 35.6035 17.2483 26.2913 H 137 ALA137 0.1208 2068 H 33.1155 17.1561 29.0246 H 138 VAL138 0.4400 2069 HA 30.8821 16.8939 27.4328 H 138 VAL138 -0.0262 2070 H 32.8798 19.8528 27.9542 H 139 ILE139 0.3288 2071 HA 30.8627 21.5478 26.6621 H 139 ILE139 0.1742 2072 H 34.1388 20.0664 25.6938 H 140 GLU140 0.3068 2073 HA 34.0707 21.1550 23.0930 H 140 GLU140 0.0651 2074 H 32.1881 18.4043 24.3360 H 141 SER141 0.3454 2075 HA 31.1155 17.5713 21.7538 H 141 SER141 0.1422 2076 H 30.1492 20.1972 24.0399 H 142 ALA142 0.2943 2077 HA 27.6375 20.5424 22.5744 H 142 ALA142 0.1208 2078 H 30.8634 21.8757 22.1511 H 143 LEU143 0.2624 2079 HA 29.9639 24.5277 21.2085 H 143 LEU143 0.1370 2080 HA 30.2503 22.5044 16.6972 H 144 PRO144 0.0600 2081 H 27.8562 22.2270 19.2646 H 145 GLY145 0.2540 2082 HA2 25.6152 22.5375 17.3184 H 145 GLY145 0.0889 2083 HA3 25.4614 22.3160 19.0795 H 145 GLY145 0.0889 2084 H 27.4686 24.4271 19.6598 H 146 LEU146 0.2624 2085 HA 25.7645 26.7648 19.5958 H 146 LEU146 0.1370 2086 H 28.6185 25.7428 17.8782 H 147 HIE147 0.2817 2087 HA 29.1670 27.8772 16.1430 H 147 HIE147 0.0852 2088 H 26.9746 25.1147 15.8719 H 148 ASP148 0.3197 2089 HA 25.9936 25.6175 13.2095 H 148 ASP148 0.0824 2090 H 24.8971 26.5623 16.4448 H 149 TRP149 0.2417 2091 HA 22.4320 27.8601 15.5022 H 149 TRP149 0.1066 2092 H 25.5615 29.3318 16.6747 H 150 VAL150 0.4400 2093 HA 24.7010 32.0497 16.1355 H 150 VAL150 -0.0262 2094 H 26.3765 29.6260 13.9223 H 151 ASP151 0.3197 2095 HA 27.0148 31.4134 11.7920 H 151 ASP151 0.0824 2096 H 23.9346 29.8770 12.6133 H 152 GLU152 0.3068 2097 HA 22.4571 30.5294 10.2006 H 152 GLU152 0.0651 2098 H 23.0707 32.1969 13.1664 H 153 ARG153 0.2337 2099 HA 21.1763 34.3912 12.9274 H 153 ARG153 0.0533 2100 H 24.3980 33.6433 11.7895 H 154 LEU154 0.2624 2101 HA 25.1275 36.3026 10.8874 H 154 LEU154 0.1370 2102 H 23.1189 33.6908 9.7234 H 155 ALA155 0.2943 2103 HA 22.8787 34.7424 7.0548 H 155 ALA155 0.1208 2104 H 21.6892 35.9755 10.0352 H 156 ARG156 0.3139 2105 HA 19.0440 36.8020 9.1686 H 156 ARG156 0.0931 2106 HB2 20.6573 37.6140 11.5447 H 156 ARG156 0.0404 2107 HB3 18.9986 38.1598 11.2191 H 156 ARG156 0.0404 2108 HG2 19.6541 35.2160 11.1482 H 156 ARG156 -0.0014 2109 HG3 19.4679 36.0093 12.7126 H 156 ARG156 -0.0014 2110 HD2 17.1670 36.5321 12.2297 H 156 ARG156 0.0487 2111 HD3 17.3403 35.9228 10.5663 H 156 ARG156 0.0487 2112 HE 18.1321 33.7871 12.2264 H 156 ARG156 0.3431 2113 HB2 26.3603 33.6102 10.3591 H 154 LEU154 0.0525 2114 HB3 26.7842 35.0013 9.3451 H 154 LEU154 0.0525 2115 HG 27.1225 34.7338 12.3510 H 154 LEU154 0.0008 2116 HB2 23.6322 34.0095 14.5948 H 153 ARG153 0.0280 2117 HB3 22.4700 35.2997 14.7855 H 153 ARG153 0.0280 2118 HG2 22.2703 32.4105 15.6688 H 153 ARG153 0.0030 2119 HG3 22.1804 33.8789 16.6497 H 153 ARG153 0.0030 2120 HD2 20.0325 32.9666 14.6786 H 153 ARG153 0.0681 2121 HD3 19.9858 32.6644 16.4228 H 153 ARG153 0.0681 2122 HE 20.2628 35.4072 16.1154 H 153 ARG153 0.3263 2123 HB2 21.7558 29.7108 13.0316 H 152 GLU152 -0.0035 2124 HB3 20.5069 30.0143 11.8281 H 152 GLU152 -0.0035 2125 HG2 22.6433 27.9023 11.4998 H 152 GLU152 -0.0041 2126 HG3 21.0684 27.6063 12.2732 H 152 GLU152 -0.0041 2127 HB2 27.8479 29.1140 11.8833 H 151 ASP151 -0.0148 2128 HB3 26.2065 28.4481 11.8670 H 151 ASP151 -0.0148 2129 HB 26.6349 31.0261 17.6173 H 150 VAL150 -0.1157 2130 HB2 22.5049 27.1146 17.7317 H 149 TRP149 0.0654 2131 HB3 24.0124 27.9766 18.0634 H 149 TRP149 0.0654 2132 HE3 24.8728 30.3070 18.9949 H 149 TRP149 0.1231 2133 HZ3 25.1723 32.6112 19.8663 H 149 TRP149 0.1192 2134 HH2 23.1618 34.1930 19.8503 H 149 TRP149 0.1195 2135 HZ2 20.8784 33.2558 19.5373 H 149 TRP149 0.1255 2136 HD1 20.1921 28.5242 17.8923 H 149 TRP149 0.1706 2137 HB2 26.2145 23.3551 14.1613 H 148 ASP148 -0.0148 2138 HB3 24.9878 23.7416 15.3930 H 148 ASP148 -0.0148 2139 HB2 30.1159 26.1001 14.6994 H 147 HIE147 0.0546 2140 HB3 29.5557 24.9289 15.8850 H 147 HIE147 0.0546 2141 HD2 31.9599 24.0842 16.5475 H 147 HIE147 0.1604 2142 HE1 33.4664 27.7388 18.0717 H 147 HIE147 0.1268 2143 HB2 27.5416 26.0659 21.3293 H 146 LEU146 0.0525 2144 HB3 28.6848 26.8494 20.2342 H 146 LEU146 0.0525 2145 HG 27.5750 28.9525 20.4786 H 146 LEU146 0.0008 2146 HB2 28.7135 20.0981 17.6159 H 144 PRO144 0.0194 2147 HB3 29.7956 20.3036 16.2074 H 144 PRO144 0.0194 2148 HG2 30.6386 19.0254 18.3885 H 144 PRO144 0.0196 2149 HG3 31.7188 20.1565 17.5062 H 144 PRO144 0.0196 2150 HD2 31.7324 21.2162 19.6632 H 144 PRO144 0.0440 2151 HD3 30.0756 20.6741 20.0403 H 144 PRO144 0.0440 2152 HB2 32.6445 23.2071 20.7811 H 143 LEU143 0.0525 2153 HB3 32.2556 24.8877 20.3575 H 143 LEU143 0.0525 2154 HG 32.0678 23.6911 23.1816 H 143 LEU143 0.0008 2155 HB2 29.5710 16.2875 22.9950 H 141 SER141 0.0401 2156 HB3 29.7001 17.3457 24.4153 H 141 SER141 0.0401 2157 HB2 35.3790 18.5362 23.9188 H 140 GLU140 -0.0035 2158 HB3 36.0903 20.1504 24.1321 H 140 GLU140 -0.0035 2159 HG2 35.2168 19.0788 21.3939 H 140 GLU140 -0.0041 2160 HG3 36.2436 20.4988 21.7346 H 140 GLU140 -0.0041 2161 HB 33.7341 22.0390 27.6383 H 139 ILE139 0.0617 2162 HG12 31.0783 23.3843 28.2684 H 139 ILE139 0.0116 2163 HG13 31.6839 21.9565 29.1405 H 139 ILE139 0.0116 2164 HB 31.1853 18.7019 29.8812 H 138 VAL138 -0.1157 2165 HB2 38.4113 20.8650 29.8158 H 136 PHE136 0.0610 2166 HB3 38.2389 19.1312 29.4343 H 136 PHE136 0.0610 2167 HD2 38.5120 18.3253 27.0973 H 136 PHE136 0.0985 2168 HE2 39.4832 18.7163 24.8744 H 136 PHE136 0.1237 2169 HZ 40.5658 20.9123 24.3589 H 136 PHE136 0.1147 2170 HE1 40.2177 22.8376 25.9911 H 136 PHE136 0.1237 2171 HD1 38.9833 22.4801 28.0757 H 136 PHE136 0.0985 2172 HB 35.4016 20.8444 33.2547 H 135 VAL135 -0.1157 2173 HB2 35.4685 14.3848 33.5087 H 134 GLU134 -0.0035 2174 HB3 34.6202 15.8447 34.0267 H 134 GLU134 -0.0035 2175 HG2 33.6645 13.7534 32.1015 H 134 GLU134 -0.0041 2176 HG3 32.8179 15.2828 32.4397 H 134 GLU134 -0.0041 2177 HB2 40.2439 15.8748 33.4611 H 133 GLU133 -0.0035 2178 HB3 40.2235 15.5230 31.7090 H 133 GLU133 -0.0035 2179 HG2 41.4926 17.6805 31.3538 H 133 GLU133 -0.0041 2180 HG3 41.6711 17.7985 33.1189 H 133 GLU133 -0.0041 2181 HB2 39.8904 19.8406 35.9388 H 132 PHE132 0.0610 2182 HB3 39.5259 21.0096 34.6583 H 132 PHE132 0.0610 2183 HD2 37.6651 22.7519 35.1692 H 132 PHE132 0.0985 2184 HE2 37.4191 24.7112 36.7841 H 132 PHE132 0.1237 2185 HZ 38.1301 24.3749 39.1441 H 132 PHE132 0.1147 2186 HE1 39.0114 22.1716 39.9128 H 132 PHE132 0.1237 2187 HD1 39.4458 20.3523 38.2856 H 132 PHE132 0.0985 2188 HB2 36.5146 17.6441 38.6410 H 131 ASP131 -0.0148 2189 HB3 34.9066 17.4472 37.9082 H 131 ASP131 -0.0148 2190 HB2 39.6937 12.9015 36.4357 H 130 SER130 0.0401 2191 HB3 39.6756 13.6903 38.0354 H 130 SER130 0.0401 2192 HB2 43.7055 18.0460 36.6610 H 129 HIE129 0.0546 2193 HB3 43.7328 19.0901 38.0895 H 129 HIE129 0.0546 2194 HD2 44.6920 15.6858 36.9403 H 129 HIE129 0.1604 2195 HE1 44.5028 15.2563 41.1016 H 129 HIE129 0.1268 2196 HB2 41.8124 17.0372 41.3371 H 128 ASP128 -0.0148 2197 HB3 40.6413 16.6197 42.5973 H 128 ASP128 -0.0148 2198 HB2 33.9646 19.9508 46.4140 H 126 TYR126 0.0191 2199 HB3 33.1091 20.4349 44.9406 H 126 TYR126 0.0191 2200 HD2 35.0530 21.7137 47.8700 H 126 TYR126 0.1327 2201 HE2 35.1284 24.1419 48.6165 H 126 TYR126 0.1373 2202 HE1 32.0164 25.0368 45.8023 H 126 TYR126 0.1373 2203 HD1 32.1373 22.6871 44.7708 H 126 TYR126 0.1327 2204 HB2 35.0345 25.0157 41.1726 H 125 TYR125 0.0191 2205 HB3 34.1171 24.3929 42.5568 H 125 TYR125 0.0191 2206 HD2 35.0825 24.7617 44.9406 H 125 TYR125 0.1327 2207 HE2 36.8948 25.6016 46.3764 H 125 TYR125 0.1373 2208 HE1 38.6450 27.5624 42.9574 H 125 TYR125 0.1373 2209 HD1 37.2466 26.1270 41.4919 H 125 TYR125 0.1327 2210 HB2 35.2645 20.8725 36.9246 H 124 PRO124 0.0194 2211 HB3 36.3770 21.5525 38.1460 H 124 PRO124 0.0194 2212 HG2 34.9006 23.1555 36.4934 H 124 PRO124 0.0196 2213 HG3 35.2876 23.6256 38.1786 H 124 PRO124 0.0196 2214 HD2 32.6992 22.6584 37.0375 H 124 PRO124 0.0440 2215 HD3 33.0009 23.6233 38.5096 H 124 PRO124 0.0440 2216 HB2 29.1951 22.6683 40.2526 H 123 ASP123 -0.0148 2217 HB3 29.8435 21.1445 40.9088 H 123 ASP123 -0.0148 2218 HB2 29.4944 17.8392 36.4995 H 122 GLU122 -0.0035 2219 HB3 28.8045 18.2595 38.0722 H 122 GLU122 -0.0035 2220 HG2 26.5233 18.0404 37.0370 H 122 GLU122 -0.0041 2221 HG3 27.3109 17.4326 35.5672 H 122 GLU122 -0.0041 2222 HB 28.0145 22.8484 32.5422 H 121 VAL121 -0.1157 2223 HB2 23.7659 19.0574 35.2944 H 120 ASP120 -0.0148 2224 HB3 24.1564 20.7936 35.2581 H 120 ASP120 -0.0148 2225 HB2 23.2580 16.7753 30.8455 H 119 LEU119 0.0525 2226 HB3 22.7471 17.6102 29.3597 H 119 LEU119 0.0525 2227 HG 20.6972 16.0298 29.3374 H 119 LEU119 0.0008 2228 HB2 15.5333 14.5692 29.0478 H 117 HIE117 0.0546 2229 HB3 13.8527 14.9633 29.5001 H 117 HIE117 0.0546 2230 HD2 17.4595 14.9901 30.8693 H 117 HIE117 0.1604 2231 HE1 15.0484 16.8803 33.8890 H 117 HIE117 0.1268 2232 HB 11.9585 16.3147 25.2719 H 116 THR116 0.0447 2233 HB2 20.0967 17.5174 24.6430 H 114 SER114 0.0401 2234 HB3 21.0692 17.7141 23.1563 H 114 SER114 0.0401 2235 HB2 24.5784 13.6321 22.4913 H 113 ARG113 0.0280 2236 HB3 23.7945 12.0564 22.2601 H 113 ARG113 0.0280 2237 HG2 24.7420 11.8232 20.0512 H 113 ARG113 0.0030 2238 HG3 25.3213 13.5034 20.0573 H 113 ARG113 0.0030 2239 HD2 26.2713 11.2876 21.9225 H 113 ARG113 0.0681 2240 HD3 27.1563 11.8895 20.5066 H 113 ARG113 0.0681 2241 HE 26.8093 14.1949 22.0212 H 113 ARG113 0.3263 2242 HB2 23.4857 17.3630 16.8200 H 112 PRO112 0.0194 2243 HB3 23.4189 15.5953 17.0546 H 112 PRO112 0.0194 2244 HG2 25.8171 16.8717 16.8142 H 112 PRO112 0.0196 2245 HG3 25.6161 15.5055 17.9621 H 112 PRO112 0.0196 2246 HD2 26.2854 17.1889 19.4624 H 112 PRO112 0.0440 2247 HD3 25.5222 18.4801 18.5002 H 112 PRO112 0.0440 2248 HB2 25.9587 18.6483 23.7205 H 111 ASP111 -0.0148 2249 HB3 24.4718 17.6725 23.6745 H 111 ASP111 -0.0148 2250 HB2 25.2243 23.1412 22.7606 H 110 PHE110 0.0610 2251 HB3 25.1692 23.2944 20.9935 H 110 PHE110 0.0610 2252 HD2 23.4092 24.9446 19.9569 H 110 PHE110 0.0985 2253 HE2 22.3540 27.1756 20.3375 H 110 PHE110 0.1237 2254 HZ 22.1322 28.1195 22.5885 H 110 PHE110 0.1147 2255 HE1 23.1316 26.9180 24.5286 H 110 PHE110 0.1237 2256 HD1 24.2272 24.6935 24.1752 H 110 PHE110 0.0985 2257 HB2 19.1818 22.3500 24.3309 H 109 SER109 0.0401 2258 HB3 19.8232 22.6159 25.9776 H 109 SER109 0.0401 2259 HB2 23.3647 19.7622 28.7727 H 108 ARG108 0.0280 2260 HB3 24.1740 18.5913 27.7070 H 108 ARG108 0.0280 2261 HG2 26.3384 19.6470 28.1939 H 108 ARG108 0.0030 2262 HG3 25.5295 20.8172 29.2597 H 108 ARG108 0.0030 2263 HD2 26.4291 19.0756 30.6642 H 108 ARG108 0.0681 2264 HD3 24.6635 18.8226 30.5896 H 108 ARG108 0.0681 2265 HE 25.8100 17.5164 28.4191 H 108 ARG108 0.3263 2266 HB2 26.0992 25.7813 28.2036 H 107 LEU107 0.0525 2267 HB3 26.3990 24.0880 28.5590 H 107 LEU107 0.0525 2268 HG 27.7418 23.8222 26.6760 H 107 LEU107 0.0008 2269 HB2 19.6627 23.6853 28.2972 H 106 MET106 0.0488 2270 HB3 21.0268 23.0078 29.1956 H 106 MET106 0.0488 2271 HG2 19.1424 23.0427 30.6883 H 106 MET106 0.1242 2272 HG3 20.2357 24.3302 31.2252 H 106 MET106 0.1242 2273 HB2 20.5078 28.6565 24.9720 H 105 ARG105 0.0280 2274 HB3 20.4579 26.8972 25.0425 H 105 ARG105 0.0280 2275 HG2 17.9890 27.0826 24.6642 H 105 ARG105 0.0030 2276 HG3 18.2586 28.7991 24.3270 H 105 ARG105 0.0030 2277 HD2 19.8124 28.1637 22.5166 H 105 ARG105 0.0681 2278 HD3 18.1541 27.5916 22.2604 H 105 ARG105 0.0681 2279 HE 19.8562 25.6652 23.5560 H 105 ARG105 0.3263 2280 HB 16.0304 30.3939 28.8149 H 104 VAL104 -0.1157 2281 HB2 15.9264 35.0654 26.4249 H 103 ARG103 0.0280 2282 HB3 17.4956 35.3149 25.6543 H 103 ARG103 0.0280 2283 HG2 16.4668 36.0430 23.6008 H 103 ARG103 0.0030 2284 HG3 14.8618 35.5049 24.1336 H 103 ARG103 0.0030 2285 HD2 14.8498 37.8395 24.3923 H 103 ARG103 0.0681 2286 HD3 15.0791 37.1950 26.0267 H 103 ARG103 0.0681 2287 HE 17.5185 37.9232 24.5933 H 103 ARG103 0.3263 2288 HB2 10.5257 35.2199 27.1489 H 100 GLU100 -0.0035 2289 HB3 10.5884 36.8423 27.8153 H 100 GLU100 -0.0035 2290 HG2 12.7156 35.9196 25.9313 H 100 GLU100 -0.0041 2291 HG3 11.1177 36.3620 25.3159 H 100 GLU100 -0.0041 2292 HB 16.0534 35.8718 31.2450 H 99 VAL99 -0.1157 2293 HB2 17.5526 38.0356 36.6743 H 97 LEU97 0.0525 2294 HB3 16.9900 38.3104 35.0237 H 97 LEU97 0.0525 2295 HG 17.0881 40.7884 35.5194 H 97 LEU97 0.0008 2296 HB2 13.6959 35.7549 39.2237 H 96 GLN96 0.0310 2297 HB3 14.8249 34.6884 38.3608 H 96 GLN96 0.0310 2298 HG2 11.8826 34.0612 39.0198 H 96 GLN96 0.0308 2299 HG3 12.9478 33.0046 38.0605 H 96 GLN96 0.0308 2300 HB2 13.4635 31.7427 32.7029 H 95 ARG95 0.0280 2301 HB3 13.6722 31.5345 34.4495 H 95 ARG95 0.0280 2302 HG2 11.4093 30.9541 33.9769 H 95 ARG95 0.0030 2303 HG3 11.3484 32.5537 34.7360 H 95 ARG95 0.0030 2304 HD2 11.1160 33.5775 32.5688 H 95 ARG95 0.0681 2305 HD3 11.2034 31.9854 31.7958 H 95 ARG95 0.0681 2306 HE 8.9933 31.5092 32.5352 H 95 ARG95 0.3263 2307 HB2 17.8939 33.1396 32.8116 H 94 LEU94 0.0525 2308 HB3 17.9300 34.7552 32.1022 H 94 LEU94 0.0525 2309 HG 20.0631 33.7840 34.0671 H 94 LEU94 0.0008 2310 HB2 19.5468 32.4962 37.5538 H 93 LEU93 0.0525 2311 HB3 19.2233 33.9560 38.4967 H 93 LEU93 0.0525 2312 HG 18.6212 31.1265 39.2581 H 93 LEU93 0.0008 2313 HB2 16.5200 29.1021 38.1715 H 92 ARG92 0.0280 2314 HB3 15.6799 27.9066 37.1553 H 92 ARG92 0.0280 2315 HG2 14.4524 30.1793 38.7527 H 92 ARG92 0.0030 2316 HG3 13.5506 29.2389 37.5467 H 92 ARG92 0.0030 2317 HD2 13.2033 28.3927 39.9131 H 92 ARG92 0.0681 2318 HD3 13.9126 27.1562 38.8452 H 92 ARG92 0.0681 2319 HE 15.8744 27.2451 40.0120 H 92 ARG92 0.3263 2320 HB2 22.4852 29.7527 34.0623 H 90 HIE90 0.0546 2321 HB3 23.0029 31.1923 34.9605 H 90 HIE90 0.0546 2322 HD2 23.8150 30.2153 37.7206 H 90 HIE90 0.1604 2323 HE1 25.8991 26.8493 36.1079 H 90 HIE90 0.1268 2324 HB2 20.7611 26.1744 39.7832 H 89 ASN89 0.0433 2325 HB3 22.0099 27.1087 38.9263 H 89 ASN89 0.0433 2326 HB2 17.9147 23.3566 35.9284 H 88 ARG88 0.0280 2327 HB3 19.2810 22.2685 35.5611 H 88 ARG88 0.0280 2328 HG2 19.0614 24.0474 38.0442 H 88 ARG88 0.0030 2329 HG3 20.3917 22.9187 37.6767 H 88 ARG88 0.0030 2330 HD2 18.6676 21.0855 37.5331 H 88 ARG88 0.0681 2331 HD3 18.9060 21.7640 39.1538 H 88 ARG88 0.0681 2332 HE 16.6857 22.9630 37.6036 H 88 ARG88 0.3263 2333 HB2 23.3980 22.7989 36.5302 H 87 ASP87 -0.0148 2334 HB3 25.0630 23.1515 36.0503 H 87 ASP87 -0.0148 2335 HB2 27.1346 27.1800 33.6570 H 86 LEU86 0.0525 2336 HB3 27.7407 25.5274 33.5243 H 86 LEU86 0.0525 2337 HG 29.2389 27.2731 32.4889 H 86 LEU86 0.0008 2338 HB 26.1369 30.4866 27.5859 H 84 VAL84 -0.1157 2339 HB2 20.2236 33.6132 28.4828 H 83 LEU83 0.0525 2340 HB3 21.3734 34.0990 29.7324 H 83 LEU83 0.0525 2341 HG 20.0809 35.9590 29.3105 H 83 LEU83 0.0008 2342 HB2 22.3847 33.3347 22.1828 H 82 LEU82 0.0525 2343 HB3 23.8565 33.3492 23.1658 H 82 LEU82 0.0525 2344 HG 22.6535 31.7092 24.7520 H 82 LEU82 0.0008 2345 HB2 23.1201 36.6379 20.3633 H 81 ASP81 -0.0148 2346 HB3 21.5104 36.1152 19.8226 H 81 ASP81 -0.0148 2347 HB2 21.4112 42.9450 29.9508 H 78 LEU78 0.0525 2348 HB3 19.9989 41.8840 29.7696 H 78 LEU78 0.0525 2349 HG 22.4803 41.1588 31.4385 H 78 LEU78 0.0008 2350 HB2 25.3816 40.5290 31.1881 H 77 HIE77 0.0546 2351 HB3 25.8353 39.0855 30.2688 H 77 HIE77 0.0546 2352 HD2 28.7021 39.2372 29.4059 H 77 HIE77 0.1604 2353 HE1 29.6456 41.9973 32.5003 H 77 HIE77 0.1268 2354 HB2 28.1398 45.8534 29.3476 H 76 GLU76 -0.0035 2355 HB3 28.1480 44.2228 30.0367 H 76 GLU76 -0.0035 2356 HG2 29.9109 44.1504 28.6379 H 76 GLU76 -0.0041 2357 HG3 28.6282 43.4682 27.6340 H 76 GLU76 -0.0041 2358 HB 24.3237 47.5335 31.0098 H 75 THR75 0.0447 2359 HB 24.6200 38.5490 35.8386 H 73 VAL73 -0.1157 2360 HB2 29.3642 41.3362 39.1232 H 72 GLN72 0.0310 2361 HB3 28.8591 42.4440 37.8455 H 72 GLN72 0.0310 2362 HG2 26.9829 40.5944 39.3296 H 72 GLN72 0.0308 2363 HG3 26.5382 41.8820 38.2020 H 72 GLN72 0.0308 2364 HB2 38.3186 40.0327 35.2004 H 69 ARG69 0.0280 2365 HB3 40.0113 39.4957 35.2036 H 69 ARG69 0.0280 2366 HG2 38.2207 39.4701 37.6740 H 69 ARG69 0.0030 2367 HG3 39.9554 39.1606 37.6323 H 69 ARG69 0.0030 2368 HD2 38.6181 41.8299 37.1235 H 69 ARG69 0.0681 2369 HD3 39.4084 41.3282 38.6324 H 69 ARG69 0.0681 2370 HE 41.1666 41.1124 36.3290 H 69 ARG69 0.3263 2371 HB2 39.5535 34.5427 31.5078 H 68 HIE68 0.0546 2372 HB3 40.4846 34.2271 32.9688 H 68 HIE68 0.0546 2373 HD2 36.8527 35.0818 31.7839 H 68 HIE68 0.1604 2374 HE1 36.7895 34.0535 35.9513 H 68 HIE68 0.1268 2375 HB2 45.3974 36.4540 29.6056 H 67 ASP67 -0.0148 2376 HB3 43.8431 36.6481 28.7655 H 67 ASP67 -0.0148 2377 HB 45.1185 31.1705 31.5556 H 66 THR66 0.0447 2378 HB2 43.7987 33.4815 25.6456 H 65 PRO65 0.0194 2379 HB3 42.1903 32.7515 25.9314 H 65 PRO65 0.0194 2380 HG2 43.9883 32.5122 23.5046 H 65 PRO65 0.0196 2381 HG3 42.2090 32.6695 23.5880 H 65 PRO65 0.0196 2382 HD2 43.3912 30.2885 23.1352 H 65 PRO65 0.0440 2383 HD3 41.9002 30.4320 24.1135 H 65 PRO65 0.0440 2384 HB2 42.3401 26.9613 26.0781 H 64 TYR64 0.0191 2385 HB3 41.5351 28.2319 25.1729 H 64 TYR64 0.0191 2386 HD2 40.6504 27.8966 23.0450 H 64 TYR64 0.1327 2387 HE2 39.5368 26.2400 21.5386 H 64 TYR64 0.1373 2388 HE1 41.5302 23.0260 23.5077 H 64 TYR64 0.1373 2389 HD1 42.2258 24.6005 25.3149 H 64 TYR64 0.1327 2390 HB2 43.4057 22.4671 25.6648 H 62 HIE62 0.0546 2391 HB3 43.3693 21.7811 24.0298 H 62 HIE62 0.0546 2392 HD2 42.2894 20.7184 27.2422 H 62 HIE62 0.1604 2393 HE1 43.6712 17.1818 25.3566 H 62 HIE62 0.1268 2394 HB2 46.6086 27.4566 30.1089 H 60 ARG60 0.0280 2395 HB3 47.5520 25.9711 30.4023 H 60 ARG60 0.0280 2396 HG2 49.0678 26.6351 28.5477 H 60 ARG60 0.0030 2397 HG3 48.1897 28.1504 28.3877 H 60 ARG60 0.0030 2398 HD2 49.9802 27.2979 30.6826 H 60 ARG60 0.0681 2399 HD3 50.2968 28.5584 29.4708 H 60 ARG60 0.0681 2400 HE 48.7993 29.9642 30.4867 H 60 ARG60 0.3263 2401 HB2 42.8903 26.8237 30.3221 H 59 LEU59 0.0525 2402 HB3 42.6595 27.3035 28.6369 H 59 LEU59 0.0525 2403 HG 40.4890 25.9059 30.3209 H 59 LEU59 0.0008 2404 HB 41.3887 22.3518 32.0982 H 58 VAL58 -0.1157 2405 HB2 41.4187 22.9838 38.4878 H 54 ARG54 0.0280 2406 HB3 41.9848 21.6889 37.4106 H 54 ARG54 0.0280 2407 HG2 43.7626 22.9645 39.4992 H 54 ARG54 0.0030 2408 HG3 44.0233 21.4476 38.6159 H 54 ARG54 0.0030 2409 HD2 42.2044 22.0527 40.9009 H 54 ARG54 0.0681 2410 HD3 41.7598 20.7709 39.7613 H 54 ARG54 0.0681 2411 HE 44.4047 20.2447 40.4869 H 54 ARG54 0.3263 2412 HB2 45.1991 25.9373 40.3161 H 53 GLU53 -0.0035 2413 HB3 46.5407 26.4041 39.2412 H 53 GLU53 -0.0035 2414 HG2 44.7748 28.3758 40.8191 H 53 GLU53 -0.0041 2415 HG3 46.1552 28.8139 39.7742 H 53 GLU53 -0.0041 2416 HB2 39.0354 27.7978 39.5621 H 52 ASP52 -0.0148 2417 HB3 39.5742 26.8146 38.1800 H 52 ASP52 -0.0148 2418 HB2 42.2134 34.8602 36.5393 H 50 CYS50 0.1465 2419 HB3 42.5606 36.0854 37.7749 H 50 CYS50 0.1465 2420 HB2 37.6686 35.3061 41.4783 H 49 SER49 0.0401 2421 HB3 39.2836 34.6856 41.8481 H 49 SER49 0.0401 2422 HB 32.9420 40.9525 42.3024 H 47 VAL47 -0.1157 2423 HB2 32.9190 34.6568 41.9085 H 46 HIE46 0.0546 2424 HB3 34.6752 34.4946 41.9779 H 46 HIE46 0.0546 2425 HD2 31.4830 33.4163 43.8060 H 46 HIE46 0.1604 2426 HE1 34.4904 30.7208 45.0520 H 46 HIE46 0.1268 2427 HB2 29.1158 35.3609 46.6293 H 45 TRP45 0.0654 2428 HB3 30.3118 34.2576 45.9672 H 45 TRP45 0.0654 2429 HE3 28.4143 36.6716 48.9836 H 45 TRP45 0.1231 2430 HZ3 27.7081 36.7763 51.3521 H 45 TRP45 0.1192 2431 HH2 28.7253 35.3405 53.0853 H 45 TRP45 0.1195 2432 HZ2 30.4583 33.6404 52.4630 H 45 TRP45 0.1255 2433 HD1 32.0207 33.0940 47.6236 H 45 TRP45 0.1706 2434 HB2 27.3409 40.1843 44.4480 H 44 ASN44 0.0433 2435 HB3 29.0017 40.6493 44.8732 H 44 ASN44 0.0433 2436 HB 22.5291 35.7517 39.1667 H 42 THR42 0.0447 2437 HB2 31.6715 33.1747 31.6205 H 39 SER39 0.0401 2438 HB3 32.2534 33.3881 29.9695 H 39 SER39 0.0401 2439 HB 31.2462 38.4738 28.9906 H 38 THR38 0.0447 2440 HB 33.6882 35.3138 23.0103 H 37 VAL37 -0.1157 2441 HB2 29.4851 39.9709 21.0981 H 36 ARG36 0.0280 2442 HB3 30.8211 40.6625 20.1457 H 36 ARG36 0.0280 2443 HG2 30.8719 39.9347 23.1084 H 36 ARG36 0.0030 2444 HG3 32.2944 40.4593 22.1890 H 36 ARG36 0.0030 2445 HD2 29.7846 42.0434 22.7508 H 36 ARG36 0.0681 2446 HD3 31.0743 42.5826 21.6673 H 36 ARG36 0.0681 2447 HE 32.3753 42.1296 24.0672 H 36 ARG36 0.3263 2448 HB 31.6306 35.6261 16.8803 H 35 VAL35 -0.1157 2449 HB2 37.4896 40.0975 13.7440 H 33 ASP33 -0.0148 2450 HB3 38.5906 40.0169 15.1276 H 33 ASP33 -0.0148 2451 HB2 33.5062 32.9942 13.5522 H 31 LEU31 0.0525 2452 HB3 32.3660 34.3581 13.5180 H 31 LEU31 0.0525 2453 HG 33.7569 33.1628 11.0969 H 31 LEU31 0.0008 2454 HB2 35.1907 28.4318 12.5236 H 29 ARG29 0.0280 2455 HB3 34.5479 30.0723 12.5507 H 29 ARG29 0.0280 2456 HG2 34.5428 28.5084 9.9460 H 29 ARG29 0.0030 2457 HG3 33.4693 29.8226 10.4541 H 29 ARG29 0.0030 2458 HD2 33.4152 26.9289 11.5002 H 29 ARG29 0.0681 2459 HD3 32.3802 28.2388 12.1155 H 29 ARG29 0.0681 2460 HE 32.1900 26.9054 9.4705 H 29 ARG29 0.3263 2461 HB2 39.0201 28.1249 15.1571 H 28 HIE28 0.0546 2462 HB3 39.7712 27.4771 13.6998 H 28 HIE28 0.0546 2463 HD2 40.8752 26.5326 16.5964 H 28 HIE28 0.1604 2464 HE1 44.2019 28.9640 15.7595 H 28 HIE28 0.1268 2465 HB2 38.8819 34.0209 17.2817 H 27 ARG27 0.0280 2466 HB3 39.8470 32.5395 17.1676 H 27 ARG27 0.0280 2467 HG2 41.4189 33.5592 15.6657 H 27 ARG27 0.0030 2468 HG3 40.3594 34.9377 15.3542 H 27 ARG27 0.0030 2469 HD2 42.3497 35.4627 16.7444 H 27 ARG27 0.0681 2470 HD3 41.7012 34.3867 18.0077 H 27 ARG27 0.0681 2471 HE 39.5576 35.9506 17.6013 H 27 ARG27 0.3263 2472 HB2 34.6897 32.5316 17.6020 H 26 LEU26 0.0525 2473 HB3 33.9993 32.8434 16.0079 H 26 LEU26 0.0525 2474 HG 33.0513 30.7052 17.9694 H 26 LEU26 0.0008 2475 HB2 35.7642 27.4951 19.3225 H 25 GLN25 0.0310 2476 HB3 35.7241 26.6762 17.7437 H 25 GLN25 0.0310 2477 HG2 37.9562 25.6396 18.3044 H 25 GLN25 0.0308 2478 HG3 37.8239 26.3428 19.9301 H 25 GLN25 0.0308 2479 HB2 40.3075 30.8420 21.7430 H 24 GLN24 0.0310 2480 HB3 39.4333 29.3465 21.4074 H 24 GLN24 0.0310 2481 HG2 41.8584 29.1232 21.2450 H 24 GLN24 0.0308 2482 HG3 41.0232 28.6741 19.7734 H 24 GLN24 0.0308 2483 HB2 32.4949 28.9658 23.2552 H 22 PHE22 0.0610 2484 HB3 33.0511 30.6170 22.9849 H 22 PHE22 0.0610 2485 HD2 31.1541 31.7816 22.3205 H 22 PHE22 0.0985 2486 HE2 29.1089 32.1023 20.9049 H 22 PHE22 0.1237 2487 HZ 28.7965 30.6078 18.9011 H 22 PHE22 0.1147 2488 HE1 30.0119 28.4124 18.9055 H 22 PHE22 0.1237 2489 HD1 32.0405 28.0742 20.2607 H 22 PHE22 0.0985 2490 HB2 35.6972 26.0999 25.1526 H 21 MET21 0.0488 2491 HB3 36.5631 25.2922 23.8393 H 21 MET21 0.0488 2492 HG2 37.7418 26.1659 26.4564 H 21 MET21 0.1242 2493 HG3 38.5946 25.3187 25.1617 H 21 MET21 0.1242 2494 HB2 39.9902 30.4104 26.5990 H 20 LYS20 0.0452 2495 HB3 38.9156 29.6134 27.7311 H 20 LYS20 0.0452 2496 HG2 38.6109 31.5516 28.9885 H 20 LYS20 0.0102 2497 HG3 40.3319 31.5606 28.5480 H 20 LYS20 0.0102 2498 HD2 40.0020 33.2291 26.8809 H 20 LYS20 0.0707 2499 HD3 38.2391 33.0213 26.9060 H 20 LYS20 0.0707 2500 HE2 38.0660 33.9933 29.0478 H 20 LYS20 0.1195 2501 HE3 39.8023 33.9523 29.3031 H 20 LYS20 0.1195 2502 HB2 33.5320 32.2493 28.5936 H 19 GLU19 -0.0035 2503 HB3 35.2941 32.1082 28.5272 H 19 GLU19 -0.0035 2504 HG2 33.4804 34.1590 27.3510 H 19 GLU19 -0.0041 2505 HG3 34.8991 33.7132 26.3853 H 19 GLU19 -0.0041 2506 HB2 35.2772 25.8066 30.8646 H 17 MET17 0.0488 2507 HB3 36.6398 25.2744 29.8757 H 17 MET17 0.0488 2508 HG2 38.1540 26.1756 31.6124 H 17 MET17 0.1242 2509 HG3 36.7416 26.5195 32.6108 H 17 MET17 0.1242 2510 HB2 36.8416 32.2562 32.7345 H 16 PRO16 0.0194 2511 HB3 37.4995 30.5998 32.6427 H 16 PRO16 0.0194 2512 HG2 36.4169 29.9869 34.5327 H 16 PRO16 0.0196 2513 HG3 36.0031 31.7067 34.7640 H 16 PRO16 0.0196 2514 HD2 33.7578 31.2980 34.2077 H 16 PRO16 0.0440 2515 HD3 34.1403 29.5521 34.1769 H 16 PRO16 0.0440 2516 HB2 30.8691 31.3780 32.2270 H 15 SER15 0.0401 2517 HB3 29.9530 30.0340 32.9293 H 15 SER15 0.0401 2518 HB2 31.0170 26.3682 34.6742 H 14 ARG14 0.0280 2519 HB3 30.8789 25.7390 33.0220 H 14 ARG14 0.0280 2520 HG2 31.5459 23.5835 33.6530 H 14 ARG14 0.0030 2521 HG3 32.2819 24.1389 35.1618 H 14 ARG14 0.0030 2522 HD2 30.2261 22.8271 35.5039 H 14 ARG14 0.0681 2523 HD3 29.3067 24.0248 34.5813 H 14 ARG14 0.0681 2524 HE 30.6408 25.2666 36.9118 H 14 ARG14 0.3263 2525 HB2 33.6203 26.8700 37.6427 H 13 CYS13 0.1465 2526 HB3 34.6053 25.5592 36.9800 H 13 CYS13 0.1465 2527 HB 37.5003 30.7764 39.4403 H 12 ILE12 0.0617 2528 HG12 34.8363 30.5490 40.8098 H 12 ILE12 0.0116 2529 HG13 35.3677 29.2191 39.7510 H 12 ILE12 0.0116 2530 HB2 31.2095 34.4978 36.5455 H 11 ASN11 0.0433 2531 HB3 32.7734 35.0372 37.1851 H 11 ASN11 0.0433 2532 HB 27.6436 30.1830 40.9072 H 9 THR9 0.0447 2533 HB2 28.5415 30.2736 36.6293 H 8 CYS8 0.1465 2534 HB3 28.2456 30.3778 34.8764 H 8 CYS8 0.1465 2535 HB 23.8394 32.2120 32.4027 H 7 VAL7 -0.1157 2536 HB2 30.2055 32.1158 29.6793 H 6 PHE6 0.0610 2537 HB3 29.4280 30.5851 30.1177 H 6 PHE6 0.0610 2538 HD2 28.3346 29.2618 28.1468 H 6 PHE6 0.0985 2539 HE2 28.7207 28.3620 25.8883 H 6 PHE6 0.1237 2540 HZ 30.3178 29.6169 24.3811 H 6 PHE6 0.1147 2541 HE1 31.5300 31.5860 25.1928 H 6 PHE6 0.1237 2542 HD1 31.0190 32.5027 27.4615 H 6 PHE6 0.0985 2543 HB 27.0042 37.1811 27.2174 H 5 THR5 0.0447 2544 HB 28.4178 34.6831 22.4100 H 4 VAL4 -0.1157 2545 HB2 26.9328 40.7760 21.2296 H 3 HIE3 0.0546 2546 HB3 25.4375 40.2290 21.9826 H 3 HIE3 0.0546 2547 HD2 25.9428 41.9723 23.9244 H 3 HIE3 0.1604 2548 HE1 29.1564 39.7785 25.6973 H 3 HIE3 0.1268 2549 HB2 25.2994 38.6867 15.4470 H 2 LEU2 0.0525 2550 HB3 26.9728 38.4006 15.9475 H 2 LEU2 0.0525 2551 HG 26.2816 36.3884 17.1869 H 2 LEU2 0.0008 2552 HB2 27.5982 43.8842 16.4238 H 1 PRO1 0.0284 2553 HB3 27.2271 43.5679 18.1421 H 1 PRO1 0.0284 2554 HG2 26.7552 46.0988 16.7905 H 1 PRO1 -0.0006 2555 HG3 26.0360 45.6208 18.3643 H 1 PRO1 -0.0006 2556 HD2 24.9057 45.3399 15.5843 H 1 PRO1 0.0399 2557 HD3 24.0768 45.7680 17.1021 H 1 PRO1 0.0399 2558 HE2 25.4561 28.2094 38.2030 H 90 HIE90 0.2669 2559 HE2 42.7521 18.0836 27.6229 H 62 HIE62 0.2669 2560 HE2 27.5605 41.7632 26.0148 H 3 HIE3 0.2669 2561 HE2 45.3658 14.2220 39.0154 H 129 HIE129 0.2669 2562 HE1 19.5789 30.8620 18.8081 H 149 TRP149 0.3224 2563 HE2 30.6463 40.1446 30.9518 H 77 HIE77 0.2669 2564 HE2 35.3752 34.6023 33.9178 H 68 HIE68 0.2669 2565 HE2 33.9744 25.2363 17.7995 H 147 HIE147 0.2669 2566 HE2 17.3780 16.0250 33.2936 H 117 HIE117 0.2669 2567 HE1 31.9489 32.7613 50.1514 H 45 TRP45 0.3224 2568 HE2 31.9518 31.1534 45.0627 H 46 HIE46 0.2669 2569 HE2 43.2892 27.2061 17.3085 H 28 HIE28 0.2669 2570 HH21 16.6931 32.1358 12.2152 H 156 ARG156 0.4062 2571 HH22 14.9864 32.4350 12.4555 H 156 ARG156 0.4062 2572 HH11 15.3589 35.8483 12.3180 H 156 ARG156 0.4062 2573 HH12 14.2385 34.5195 12.5151 H 156 ARG156 0.4062 2574 HH21 18.8437 36.9303 16.0193 H 153 ARG153 0.3911 2575 HH22 17.1421 36.5872 15.8026 H 153 ARG153 0.3911 2576 HH11 17.6911 33.1090 15.4797 H 153 ARG153 0.3911 2577 HH12 16.4909 34.3817 15.4908 H 153 ARG153 0.3911 2578 HH21 27.9315 14.8271 23.8722 H 113 ARG113 0.3911 2579 HH22 29.0304 13.6969 24.6309 H 113 ARG113 0.3911 2580 HH11 28.2901 11.0532 22.5537 H 113 ARG113 0.3911 2581 HH12 29.2203 11.6506 23.9095 H 113 ARG113 0.3911 2582 HH21 26.3799 15.4152 28.1875 H 108 ARG108 0.3911 2583 HH22 26.3907 14.3515 29.5762 H 108 ARG108 0.3911 2584 HH11 25.5690 16.7950 31.9511 H 108 ARG108 0.3911 2585 HH12 25.9428 15.1091 31.6716 H 108 ARG108 0.3911 2586 HH21 20.3031 23.7263 22.5942 H 105 ARG105 0.3911 2587 HH22 20.2268 23.5549 20.8550 H 105 ARG105 0.3911 2588 HH11 19.1819 26.7475 20.1681 H 105 ARG105 0.3911 2589 HH12 19.6209 25.1782 19.5320 H 105 ARG105 0.3911 2590 HH21 18.8461 39.1970 25.6694 H 103 ARG103 0.3911 2591 HH22 18.2837 40.2577 26.9413 H 103 ARG103 0.3911 2592 HH11 14.9202 39.0912 26.7889 H 103 ARG103 0.3911 2593 HH12 16.0074 40.2057 27.5856 H 103 ARG103 0.3911 2594 HE21 12.1434 34.2203 41.2071 H 96 GLN96 0.4083 2595 HE22 13.1168 33.0809 42.1082 H 96 GLN96 0.4083 2596 HH21 7.0181 32.1539 32.9876 H 95 ARG95 0.3911 2597 HH22 6.7423 33.6693 33.8163 H 95 ARG95 0.3911 2598 HH11 10.1829 34.5214 33.9176 H 95 ARG95 0.3911 2599 HH12 8.5726 35.0466 34.3544 H 95 ARG95 0.3911 2600 HH21 16.9129 27.2631 41.7745 H 92 ARG92 0.3911 2601 HH22 16.8819 28.6536 42.8355 H 92 ARG92 0.3911 2602 HH11 14.3960 30.3008 40.9574 H 92 ARG92 0.3911 2603 HH12 15.4315 30.4041 42.3636 H 92 ARG92 0.3911 2604 HD21 18.7473 27.9139 40.3307 H 89 ASN89 0.3551 2605 HD22 19.3178 29.3188 41.2031 H 89 ASN89 0.3551 2606 HH21 14.7328 22.5985 37.8834 H 88 ARG88 0.3911 2607 HH22 14.1592 21.6447 39.2331 H 88 ARG88 0.3911 2608 HH11 17.4372 20.7542 40.3187 H 88 ARG88 0.3911 2609 HH12 15.7292 20.5736 40.6509 H 88 ARG88 0.3911 2610 HE21 26.3263 41.1677 41.4257 H 72 GLN72 0.4083 2611 HE22 26.4976 42.7810 42.0800 H 72 GLN72 0.4083 2612 HH21 42.9604 42.5081 36.2756 H 69 ARG69 0.3911 2613 HH22 42.9880 43.9079 37.3236 H 69 ARG69 0.3911 2614 HH11 40.0403 43.4218 38.8544 H 69 ARG69 0.3911 2615 HH12 41.4817 44.3928 38.6599 H 69 ARG69 0.3911 2616 HH21 47.7494 30.9481 32.0840 H 60 ARG60 0.3911 2617 HH22 47.2718 30.0790 33.5249 H 60 ARG60 0.3911 2618 HH11 48.5771 27.0185 32.5479 H 60 ARG60 0.3911 2619 HH12 47.7285 27.9118 33.7895 H 60 ARG60 0.3911 2620 HH21 44.8869 18.4784 41.8490 H 54 ARG54 0.3911 2621 HH22 43.8625 18.1202 43.2208 H 54 ARG54 0.3911 2622 HH11 41.5310 20.6585 42.3792 H 54 ARG54 0.3911 2623 HH12 41.9169 19.3902 43.5203 H 54 ARG54 0.3911 2624 HD21 26.0034 39.2129 46.1579 H 44 ASN44 0.3551 2625 HD22 26.6766 38.7239 47.6967 H 44 ASN44 0.3551 2626 HH21 32.7097 43.6979 25.6407 H 36 ARG36 0.3911 2627 HH22 31.6376 45.0757 25.7528 H 36 ARG36 0.3911 2628 HH11 29.5867 44.0837 23.0573 H 36 ARG36 0.3911 2629 HH12 29.8594 45.2992 24.2854 H 36 ARG36 0.3911 2630 HH21 30.5340 27.3964 8.1815 H 29 ARG29 0.3911 2631 HH22 29.2751 28.5013 8.6862 H 29 ARG29 0.3911 2632 HH11 30.7126 29.3258 11.7107 H 29 ARG29 0.3911 2633 HH12 29.3694 29.5559 10.6139 H 29 ARG29 0.3911 2634 HH21 39.0530 38.1883 18.4064 H 27 ARG27 0.3911 2635 HH22 40.4302 39.1496 18.8955 H 27 ARG27 0.3911 2636 HH11 42.8239 36.8399 18.1248 H 27 ARG27 0.3911 2637 HH12 42.4137 38.4232 18.7452 H 27 ARG27 0.3911 2638 HE21 37.7640 24.3054 20.9422 H 25 GLN25 0.4083 2639 HE22 36.3497 23.2763 20.9236 H 25 GLN25 0.4083 2640 HE21 41.2221 30.4110 17.9544 H 24 GLN24 0.4083 2641 HE22 42.7166 31.3173 17.9034 H 24 GLN24 0.4083 2642 HH21 29.6052 25.3126 38.8916 H 14 ARG14 0.3911 2643 HH22 27.8943 24.9639 38.9983 H 14 ARG14 0.3911 2644 HH11 27.5291 23.9040 35.7171 H 14 ARG14 0.3911 2645 HH12 26.7435 24.1878 37.2541 H 14 ARG14 0.3911 2646 HD21 32.3162 32.7388 34.4535 H 11 ASN11 0.3551 2647 HD22 33.0685 33.7444 33.2359 H 11 ASN11 0.3551 2648 HG 20.9340 24.2480 25.2513 H 109 SER109 0.4463 2649 HG 22.5060 17.7278 24.8793 H 114 SER114 0.4463 2650 HG 34.0218 34.3890 30.7160 H 39 SER39 0.4463 2651 HZ1 38.1881 35.9624 28.2688 H 20 LYS20 0.2946 2652 HZ2 39.7494 36.0190 28.7969 H 20 LYS20 0.2946 2653 HZ3 39.4230 35.6233 27.2294 H 20 LYS20 0.2946 2654 HG 31.7120 16.4528 24.9000 H 141 SER141 0.4463 2655 HG 41.7529 13.4057 38.1743 H 130 SER130 0.4463 2656 HG 30.1939 32.2441 35.0107 H 8 CYS8 0.1893 2657 HG 31.8899 30.2918 34.5836 H 15 SER15 0.4463 2658 HG 37.4298 35.8392 43.5503 H 49 SER49 0.4463 2659 HG 42.8265 32.6482 38.1558 H 50 CYS50 0.1893 2660 HO1 23.6639 49.8483 27.4727 H.t3p 157 HOH1 0.4170 2661 HO2 25.0867 49.2329 27.6755 H.t3p 157 HOH1 0.4170 2662 HO3 38.5488 23.2092 46.9471 H.t3p 157 HOH1 0.4170 2663 HO4 38.6296 21.6483 46.9272 H.t3p 157 HOH1 0.4170 2664 HO5 41.4308 41.1523 31.1917 H.t3p 157 HOH1 0.4170 2665 HO6 41.7465 41.7064 32.6191 H.t3p 157 HOH1 0.4170 2666 HO7 11.8414 21.6640 28.3096 H.t3p 157 HOH1 0.4170 2667 HO8 11.7258 23.1770 27.9331 H.t3p 157 HOH1 0.4170 2668 HO9 14.1371 37.3518 42.2549 H.t3p 157 HOH1 0.4170 2669 HO10 15.2391 38.4456 42.0717 H.t3p 157 HOH1 0.4170 2670 HO11 29.1068 10.5937 28.7110 H.t3p 157 HOH1 0.4170 2671 HO12 29.5621 10.5627 27.2160 H.t3p 157 HOH1 0.4170 2672 HO13 27.5001 11.3846 27.3885 H.t3p 157 HOH1 0.4170 2673 HO14 26.2256 10.7587 26.7343 H.t3p 157 HOH1 0.4170 2674 HO15 49.3497 19.6522 27.0197 H.t3p 157 HOH1 0.4170 2675 HO16 50.5603 18.8961 27.6570 H.t3p 157 HOH1 0.4170 2676 HO17 15.6945 13.0131 20.3932 H.t3p 157 HOH1 0.4170 2677 HO18 16.4208 14.1474 19.5996 H.t3p 157 HOH1 0.4170 2678 HO19 14.9952 26.3319 25.0547 H.t3p 157 HOH1 0.4170 2679 HO20 14.6893 24.9596 25.7376 H.t3p 157 HOH1 0.4170 2680 HO21 14.4558 42.5464 39.2755 H.t3p 157 HOH1 0.4170 2681 HO22 14.6819 41.4067 40.3215 H.t3p 157 HOH1 0.4170 2682 HO23 31.9361 44.7889 15.8001 H.t3p 157 HOH1 0.4170 2683 HO24 32.6742 46.0069 15.1553 H.t3p 157 HOH1 0.4170 2684 HO25 29.5823 26.1062 48.9449 H.t3p 157 HOH1 0.4170 2685 HO26 30.1161 26.6519 50.3093 H.t3p 157 HOH1 0.4170 2686 HO27 23.3292 40.0970 50.9599 H.t3p 157 HOH1 0.4170 2687 HO28 23.1013 40.0529 49.4142 H.t3p 157 HOH1 0.4170 2688 HO29 27.7843 19.5390 13.3014 H.t3p 157 HOH1 0.4170 2689 HO30 26.6620 20.4784 12.7518 H.t3p 157 HOH1 0.4170 2690 HO31 12.9334 35.2486 15.5393 H.t3p 157 HOH1 0.4170 2691 HO32 13.4958 36.1132 16.7142 H.t3p 157 HOH1 0.4170 2692 HO33 18.0953 12.0022 30.3292 H.t3p 157 HOH1 0.4170 2693 HO34 18.6125 12.9697 29.2154 H.t3p 157 HOH1 0.4170 2694 HO35 18.9818 12.8322 26.9362 H.t3p 157 HOH1 0.4170 2695 HO36 17.5659 13.4369 27.2061 H.t3p 157 HOH1 0.4170 2696 HO37 8.2990 15.6312 25.7399 H.t3p 157 HOH1 0.4170 2697 HO38 8.8581 15.0787 24.3885 H.t3p 157 HOH1 0.4170 2698 HO39 26.0133 8.4372 26.9529 H.t3p 157 HOH1 0.4170 2699 HO40 25.6011 8.8649 25.5071 H.t3p 157 HOH1 0.4170 2700 HO41 26.5869 13.3283 14.5707 H.t3p 157 HOH1 0.4170 2701 HO42 25.1865 13.0463 13.9354 H.t3p 157 HOH1 0.4170 2702 HO43 7.2160 35.9238 25.2739 H.t3p 157 HOH1 0.4170 2703 HO44 7.1529 36.9716 26.4321 H.t3p 157 HOH1 0.4170 2704 HG1 28.6962 37.1179 28.6369 H 5 THR5 0.4055 2705 HO45 50.1210 27.1568 36.6500 H.t3p 157 HOH1 0.4170 2706 HO46 50.3427 25.6563 36.2710 H.t3p 157 HOH1 0.4170 2707 HO47 50.8841 23.5413 36.5403 H.t3p 157 HOH1 0.4170 2708 HO48 49.3913 23.6804 36.0984 H.t3p 157 HOH1 0.4170 2709 HO49 40.0545 17.4386 22.7449 H.t3p 157 HOH1 0.4170 2710 HO50 39.9659 15.9927 23.3328 H.t3p 157 HOH1 0.4170 2711 HO51 39.0001 14.3702 24.4078 H.t3p 157 HOH1 0.4170 2712 HO52 37.6426 14.7735 23.7464 H.t3p 157 HOH1 0.4170 2713 HO53 11.4355 19.5716 38.6715 H.t3p 157 HOH1 0.4170 2714 HO54 10.5594 20.8663 38.6506 H.t3p 157 HOH1 0.4170 2715 HO55 15.6828 39.2283 22.0321 H.t3p 157 HOH1 0.4170 2716 HO56 16.5976 39.1329 20.7679 H.t3p 157 HOH1 0.4170 2717 HO57 11.6057 26.4100 31.1261 H.t3p 157 HOH1 0.4170 2718 HO58 11.9602 25.7053 29.7763 H.t3p 157 HOH1 0.4170 2719 HO59 10.3880 24.9993 28.2752 H.t3p 157 HOH1 0.4170 2720 HO60 11.6904 25.4264 27.5238 H.t3p 157 HOH1 0.4170 2721 HO61 39.0722 13.9450 22.1521 H.t3p 157 HOH1 0.4170 2722 HO62 39.3056 14.1007 20.6141 H.t3p 157 HOH1 0.4170 2723 HO63 46.9520 32.6576 19.6197 H.t3p 157 HOH1 0.4170 2724 HO64 46.8578 32.0374 21.0517 H.t3p 157 HOH1 0.4170 2725 HO65 34.7544 41.6727 26.3589 H.t3p 157 HOH1 0.4170 2726 HO66 36.2201 41.9842 25.9140 H.t3p 157 HOH1 0.4170 2727 HO67 42.4685 39.6215 42.6820 H.t3p 157 HOH1 0.4170 2728 HO68 42.0992 38.5508 43.7596 H.t3p 157 HOH1 0.4170 2729 HO69 21.4595 30.4727 2.8094 H.t3p 157 HOH1 0.4170 2730 HO70 21.0903 29.4014 3.8866 H.t3p 157 HOH1 0.4170 2731 HO71 29.9519 21.7565 12.2394 H.t3p 157 HOH1 0.4170 2732 HO72 31.1087 21.2642 11.3105 H.t3p 157 HOH1 0.4170 2733 HO73 36.4364 43.3592 35.1270 H.t3p 157 HOH1 0.4170 2734 HO74 36.6577 44.3472 33.9362 H.t3p 157 HOH1 0.4170 2735 HO75 12.8626 33.1606 19.1281 H.t3p 157 HOH1 0.4170 2736 HO76 11.7043 33.7467 18.2575 H.t3p 157 HOH1 0.4170 2737 HO77 17.3643 31.8009 47.3699 H.t3p 157 HOH1 0.4170 2738 HO78 16.9910 30.4908 48.1364 H.t3p 157 HOH1 0.4170 2739 HO79 18.1592 39.7539 3.1939 H.t3p 157 HOH1 0.4170 2740 HO80 19.2226 39.7224 4.3391 H.t3p 157 HOH1 0.4170 2741 HO81 49.5885 16.1085 30.2102 H.t3p 157 HOH1 0.4170 2742 HO82 48.4303 16.6947 29.3395 H.t3p 157 HOH1 0.4170 2743 HO83 43.3879 8.5173 35.2896 H.t3p 157 HOH1 0.4170 2744 HO84 42.1466 9.3739 35.7004 H.t3p 157 HOH1 0.4170 2745 HO85 52.2462 26.7532 39.3679 H.t3p 157 HOH1 0.4170 2746 HO86 51.9065 27.0690 37.8750 H.t3p 157 HOH1 0.4170 2747 HO87 15.5209 43.8060 28.2858 H.t3p 157 HOH1 0.4170 2748 HO88 14.9869 44.1728 26.8629 H.t3p 157 HOH1 0.4170 2749 HO89 35.3289 13.7185 22.1600 H.t3p 157 HOH1 0.4170 2750 HO90 35.2642 14.8506 23.2359 H.t3p 157 HOH1 0.4170 2751 HO91 34.9106 41.6937 24.1435 H.t3p 157 HOH1 0.4170 2752 HO92 35.4940 41.4024 22.7226 H.t3p 157 HOH1 0.4170 2753 HO93 20.1767 11.3266 17.6193 H.t3p 157 HOH1 0.4170 2754 HO94 19.5316 12.5232 16.8470 H.t3p 157 HOH1 0.4170 2755 HO95 30.5044 31.4910 51.8551 H.t3p 157 HOH1 0.4170 2756 HO96 30.2507 30.2495 52.7702 H.t3p 157 HOH1 0.4170 2757 HO97 14.1177 43.2483 35.8242 H.t3p 157 HOH1 0.4170 2758 HO98 14.1550 44.2222 37.0466 H.t3p 157 HOH1 0.4170 2759 HO99 12.5129 43.4493 38.7407 H.t3p 157 HOH1 0.4170 2760 HO100 13.4490 44.5073 39.4099 H.t3p 157 HOH1 0.4170 2761 HO101 7.7981 34.2374 37.9546 H.t3p 157 HOH1 0.4170 2762 HO102 7.4283 35.5540 37.1971 H.t3p 157 HOH1 0.4170 2763 HO103 7.6287 37.5622 38.4039 H.t3p 157 HOH1 0.4170 2764 HO104 6.2573 37.5414 37.6543 H.t3p 157 HOH1 0.4170 2765 HO105 16.0844 24.0859 27.2629 H.t3p 157 HOH1 0.4170 2766 HO106 14.7606 24.1858 28.0878 H.t3p 157 HOH1 0.4170 2767 HO107 40.0373 14.5817 26.4780 H.t3p 157 HOH1 0.4170 2768 HO108 40.1504 13.1035 25.9824 H.t3p 157 HOH1 0.4170 2769 HO109 12.0028 12.2830 23.8081 H.t3p 157 HOH1 0.4170 2770 HO110 13.1686 12.0537 24.8243 H.t3p 157 HOH1 0.4170 2771 HO111 15.0922 11.9899 26.3141 H.t3p 157 HOH1 0.4170 2772 HO112 15.3313 13.0932 25.2329 H.t3p 157 HOH1 0.4170 2773 HO113 34.2710 43.6124 9.8112 H.t3p 157 HOH1 0.4170 2774 HO114 34.2254 42.1961 9.1508 H.t3p 157 HOH1 0.4170 2775 HO115 20.0944 42.4658 40.4934 H.t3p 157 HOH1 0.4170 2776 HO116 21.6305 42.6138 40.7434 H.t3p 157 HOH1 0.4170 2777 HO117 23.3355 41.7285 42.2253 H.t3p 157 HOH1 0.4170 2778 HO118 24.0136 42.6877 41.1941 H.t3p 157 HOH1 0.4170 2779 HO119 32.8505 15.3001 47.4727 H.t3p 157 HOH1 0.4170 2780 HO120 32.2492 16.6524 47.9768 H.t3p 157 HOH1 0.4170 2781 HO121 44.2570 41.2099 30.4423 H.t3p 157 HOH1 0.4170 2782 HO122 44.8871 42.3160 31.3499 H.t3p 157 HOH1 0.4170 2783 HO123 44.6079 44.2083 33.0937 H.t3p 157 HOH1 0.4170 2784 HO124 46.0848 43.7034 33.1779 H.t3p 157 HOH1 0.4170 2785 HO125 40.5507 8.2685 39.8435 H.t3p 157 HOH1 0.4170 2786 HO126 39.3121 9.1843 40.1086 H.t3p 157 HOH1 0.4170 2787 HO127 11.5308 44.1597 29.5697 H.t3p 157 HOH1 0.4170 2788 HO128 11.8103 42.6238 29.4917 H.t3p 157 HOH1 0.4170 2789 HO129 15.8914 11.0357 24.3876 H.t3p 157 HOH1 0.4170 2790 HO130 16.9639 10.8746 23.2615 H.t3p 157 HOH1 0.4170 2791 HO131 24.7966 38.7892 7.5432 H.t3p 157 HOH1 0.4170 2792 HO132 23.8976 39.2705 6.3582 H.t3p 157 HOH1 0.4170 2793 HO133 21.7940 40.0962 4.9600 H.t3p 157 HOH1 0.4170 2794 HO134 23.0391 40.1990 4.0207 H.t3p 157 HOH1 0.4170 2795 HO135 22.1606 10.2611 17.1195 H.t3p 157 HOH1 0.4170 2796 HO136 20.9672 9.2667 16.9457 H.t3p 157 HOH1 0.4170 2797 HO137 36.5497 44.3758 22.7751 H.t3p 157 HOH1 0.4170 2798 HO138 36.6404 44.1206 21.2353 H.t3p 157 HOH1 0.4170 2799 HO139 48.5948 24.7748 44.7207 H.t3p 157 HOH1 0.4170 2800 HO140 47.7520 23.4711 44.5359 H.t3p 157 HOH1 0.4170 2801 HO141 47.1704 21.7873 42.9256 H.t3p 157 HOH1 0.4170 2802 HO142 48.5514 21.4263 43.5626 H.t3p 157 HOH1 0.4170 2803 HO143 15.9149 45.6176 30.8157 H.t3p 157 HOH1 0.4170 2804 HO144 14.9157 44.8827 31.7669 H.t3p 157 HOH1 0.4170 2805 HO145 48.7593 23.8407 38.3555 H.t3p 157 HOH1 0.4170 2806 HO146 47.3536 24.4486 38.0425 H.t3p 157 HOH1 0.4170 2807 HO147 15.5828 16.9090 39.5724 H.t3p 157 HOH1 0.4170 2808 HO148 15.8508 16.7400 38.0414 H.t3p 157 HOH1 0.4170 2809 HO149 21.4827 9.4438 19.4255 H.t3p 157 HOH1 0.4170 2810 HO150 21.9780 9.0050 20.8419 H.t3p 157 HOH1 0.4170 2811 HO151 18.9058 15.6379 38.8833 H.t3p 157 HOH1 0.4170 2812 HO152 18.7436 17.0666 39.4964 H.t3p 157 HOH1 0.4170 2813 HO153 29.5390 39.9706 9.1819 H.t3p 157 HOH1 0.4170 2814 HO154 28.8397 38.7120 9.7904 H.t3p 157 HOH1 0.4170 2815 HO155 35.1830 14.9015 47.3208 H.t3p 157 HOH1 0.4170 2816 HO156 34.4835 13.6432 47.9297 H.t3p 157 HOH1 0.4170 2817 HO157 29.0996 46.5025 13.8824 H.t3p 157 HOH1 0.4170 2818 HO158 28.3422 47.4490 12.8951 H.t3p 157 HOH1 0.4170 2819 HO159 51.2391 24.5381 28.2140 H.t3p 157 HOH1 0.4170 2820 HO160 51.2317 24.7069 29.7682 H.t3p 157 HOH1 0.4170 2821 HO161 24.4585 45.2528 23.2300 H.t3p 157 HOH1 0.4170 2822 HO162 25.1823 46.6288 23.0685 H.t3p 157 HOH1 0.4170 2823 HO163 21.8630 50.1820 28.5894 H.t3p 157 HOH1 0.4170 2824 HO164 22.8889 51.3417 28.8026 H.t3p 157 HOH1 0.4170 2825 HO165 23.4313 52.6539 30.6491 H.t3p 157 HOH1 0.4170 2826 HO166 24.5280 51.5593 30.4433 H.t3p 157 HOH1 0.4170 2827 HO167 34.3767 43.9289 41.1107 H.t3p 157 HOH1 0.4170 2828 HO168 35.4029 45.0881 41.3252 H.t3p 157 HOH1 0.4170 2829 HO169 23.9831 46.0993 20.7519 H.t3p 157 HOH1 0.4170 2830 HO170 23.1452 47.2644 20.1318 H.t3p 157 HOH1 0.4170 2831 HO171 23.0930 48.7906 24.0599 H.t3p 157 HOH1 0.4170 2832 HO172 24.5801 49.2480 24.2124 H.t3p 157 HOH1 0.4170 2833 HO173 18.2560 30.2135 13.2093 H.t3p 157 HOH1 0.4170 2834 HO174 16.6949 30.2246 13.2885 H.t3p 157 HOH1 0.4170 2835 HO175 6.8994 35.2156 30.3914 H.t3p 157 HOH1 0.4170 2836 HO176 5.5585 34.9795 29.6230 H.t3p 157 HOH1 0.4170 2837 HO177 32.1737 30.0855 51.7457 H.t3p 157 HOH1 0.4170 2838 HO178 33.7180 30.0929 51.5027 H.t3p 157 HOH1 0.4170 2839 HO179 27.8697 8.3547 25.5545 H.t3p 157 HOH1 0.4170 2840 HO180 28.1688 7.3722 24.3763 H.t3p 157 HOH1 0.4170 2841 HO181 28.8901 6.0346 22.0570 H.t3p 157 HOH1 0.4170 2842 HO182 29.8154 7.2911 22.1465 H.t3p 157 HOH1 0.4170 2843 HO183 13.2645 35.3640 18.6742 H.t3p 157 HOH1 0.4170 2844 HO184 13.4271 36.8887 18.9778 H.t3p 157 HOH1 0.4170 2845 HO185 24.9645 30.8181 4.7125 H.t3p 157 HOH1 0.4170 2846 HO186 26.4094 31.4147 4.7348 H.t3p 157 HOH1 0.4170 2847 HO187 10.6466 25.1568 39.4927 H.t3p 157 HOH1 0.4170 2848 HO188 10.2971 25.5391 40.9677 H.t3p 157 HOH1 0.4170 2849 HO189 15.5312 23.3636 34.7461 H.t3p 157 HOH1 0.4170 2850 HO190 14.3147 24.2307 34.2855 H.t3p 157 HOH1 0.4170 2851 HO191 50.9451 28.6948 44.1968 H.t3p 157 HOH1 0.4170 2852 HO192 50.4742 28.4949 45.6738 H.t3p 157 HOH1 0.4170 2853 HO193 44.8951 38.6381 37.4503 H.t3p 157 HOH1 0.4170 2854 HO194 44.6485 38.4109 38.9773 H.t3p 157 HOH1 0.4170 2855 HO195 45.4850 38.9185 41.4258 H.t3p 157 HOH1 0.4170 2856 HO196 44.1003 38.2037 41.5483 H.t3p 157 HOH1 0.4170 2857 HO197 49.3495 17.4687 26.3460 H.t3p 157 HOH1 0.4170 2858 HO198 48.6638 16.5698 25.2662 H.t3p 157 HOH1 0.4170 2859 HO199 30.6132 23.3684 6.2149 H.t3p 157 HOH1 0.4170 2860 HO200 30.2164 24.7494 5.5988 H.t3p 157 HOH1 0.4170 2861 HO201 31.0862 27.0843 5.2935 H.t3p 157 HOH1 0.4170 2862 HO202 29.5291 27.1566 5.4108 H.t3p 157 HOH1 0.4170 2863 HO203 12.1577 24.0326 32.9300 H.t3p 157 HOH1 0.4170 2864 HO204 12.0612 23.0357 34.1301 H.t3p 157 HOH1 0.4170 2865 HO205 2.9396 32.0017 35.1749 H.t3p 157 HOH1 0.4170 2866 HO206 2.4104 30.5409 35.3461 H.t3p 157 HOH1 0.4170 2867 HO207 20.3750 11.6706 33.9802 H.t3p 157 HOH1 0.4170 2868 HO208 21.6154 12.5948 34.2069 H.t3p 157 HOH1 0.4170 2869 HO209 22.5253 46.7420 23.1119 H.t3p 157 HOH1 0.4170 2870 HO210 21.4338 47.8041 22.7599 H.t3p 157 HOH1 0.4170 2871 HO211 4.7084 33.6157 34.9937 H.t3p 157 HOH1 0.4170 2872 HO212 5.9093 33.9660 35.9313 H.t3p 157 HOH1 0.4170 2873 HO213 45.1864 17.4547 47.8676 H.t3p 157 HOH1 0.4170 2874 HO214 43.6862 17.1092 47.5952 H.t3p 157 HOH1 0.4170 2875 HO215 41.8855 16.4701 46.0128 H.t3p 157 HOH1 0.4170 2876 HO216 41.7471 15.5903 47.2974 H.t3p 157 HOH1 0.4170 2877 HO217 19.5382 22.1510 13.4578 H.t3p 157 HOH1 0.4170 2878 HO218 19.7058 23.6834 13.1976 H.t3p 157 HOH1 0.4170 2879 HO219 9.9185 27.4965 41.9332 H.t3p 157 HOH1 0.4170 2880 HO220 8.7606 27.7039 40.9038 H.t3p 157 HOH1 0.4170 2881 HO221 35.0221 43.9966 26.1226 H.t3p 157 HOH1 0.4170 2882 HO222 35.3751 45.5169 26.0317 H.t3p 157 HOH1 0.4170 2883 HO223 37.1856 45.9157 24.2842 H.t3p 157 HOH1 0.4170 2884 HO224 35.8123 46.3107 23.6506 H.t3p 157 HOH1 0.4170 2885 HO225 21.0180 32.2460 1.3287 H.t3p 157 HOH1 0.4170 2886 HO226 21.9903 32.7359 2.4502 H.t3p 157 HOH1 0.4170 2887 HO227 42.9993 41.8839 42.3225 H.t3p 157 HOH1 0.4170 2888 HO228 42.0275 41.3938 41.2006 H.t3p 157 HOH1 0.4170 2889 HO229 45.5743 46.5697 36.6470 H.t3p 157 HOH1 0.4170 2890 HO230 46.5803 45.5222 37.2257 H.t3p 157 HOH1 0.4170 2891 HO231 48.5265 28.0571 23.0091 H.t3p 157 HOH1 0.4170 2892 HO232 49.7545 28.9800 22.7202 H.t3p 157 HOH1 0.4170 2893 HO233 41.3248 10.4744 40.4458 H.t3p 157 HOH1 0.4170 2894 HO234 42.7703 10.7716 40.9618 H.t3p 157 HOH1 0.4170 2895 HO235 19.9904 22.8309 17.3443 H.t3p 157 HOH1 0.4170 2896 HO236 20.4319 23.7754 16.1797 H.t3p 157 HOH1 0.4170 2897 HO237 13.6254 32.9870 45.3084 H.t3p 157 HOH1 0.4170 2898 HO238 13.6571 31.4302 45.4482 H.t3p 157 HOH1 0.4170 2899 HO239 30.3510 45.3403 35.4248 H.t3p 157 HOH1 0.4170 2900 HO240 31.3073 45.6644 34.2316 H.t3p 157 HOH1 0.4170 2901 HO241 16.9339 40.4935 12.9644 H.t3p 157 HOH1 0.4170 2902 HO242 17.3306 41.9188 12.4591 H.t3p 157 HOH1 0.4170 2903 HO243 19.9704 41.2691 12.7326 H.t3p 157 HOH1 0.4170 2904 HO244 19.8386 42.0442 11.3816 H.t3p 157 HOH1 0.4170 2905 HO245 36.6884 34.4608 5.4972 H.t3p 157 HOH1 0.4170 2906 HO246 37.4700 33.1558 5.8565 H.t3p 157 HOH1 0.4170 2907 HO247 41.6548 41.3286 16.1979 H.t3p 157 HOH1 0.4170 2908 HO248 42.5081 40.0370 15.9793 H.t3p 157 HOH1 0.4170 2909 HO249 41.1956 21.9716 15.1460 H.t3p 157 HOH1 0.4170 2910 HO250 39.6872 22.3424 14.9716 H.t3p 157 HOH1 0.4170 2911 HO251 35.2166 20.3016 50.1311 H.t3p 157 HOH1 0.4170 2912 HO252 34.6925 19.0853 49.3003 H.t3p 157 HOH1 0.4170 2913 HO253 32.5406 19.0433 48.1932 H.t3p 157 HOH1 0.4170 2914 HO254 32.3866 18.4222 49.6193 H.t3p 157 HOH1 0.4170 2915 HO255 10.1265 35.0841 41.7747 H.t3p 157 HOH1 0.4170 2916 HO256 9.5786 35.4425 43.1941 H.t3p 157 HOH1 0.4170 2917 HO257 33.7144 13.1409 23.8058 H.t3p 157 HOH1 0.4170 2918 HO258 33.4531 11.6370 24.1435 H.t3p 157 HOH1 0.4170 2919 HO259 50.4243 31.5088 36.0245 H.t3p 157 HOH1 0.4170 2920 HO260 48.9325 31.9078 36.2663 H.t3p 157 HOH1 0.4170 2921 HO261 8.8631 21.8085 24.5724 H.t3p 157 HOH1 0.4170 2922 HO262 9.2959 20.8878 23.3853 H.t3p 157 HOH1 0.4170 2923 HO263 11.3016 20.7583 21.5001 H.t3p 157 HOH1 0.4170 2924 HO264 11.3022 19.6464 22.5988 H.t3p 157 HOH1 0.4170 2925 HO265 22.6365 38.0522 4.5529 H.t3p 157 HOH1 0.4170 2926 HO266 23.4962 36.7849 4.2385 H.t3p 157 HOH1 0.4170 2927 HO267 23.3061 24.3157 5.1090 H.t3p 157 HOH1 0.4170 2928 HO268 23.8562 25.6112 5.7891 H.t3p 157 HOH1 0.4170 2929 HO269 14.1891 10.6866 29.4971 H.t3p 157 HOH1 0.4170 2930 HO270 15.6508 10.7210 28.9434 H.t3p 157 HOH1 0.4170 2931 HO271 17.6750 9.7757 30.6218 H.t3p 157 HOH1 0.4170 2932 HO272 16.7199 10.6230 31.5235 H.t3p 157 HOH1 0.4170 2933 HO273 10.5735 33.3125 43.2550 H.t3p 157 HOH1 0.4170 2934 HO274 11.5003 32.3510 44.0678 H.t3p 157 HOH1 0.4170 2935 HO275 24.5430 28.5901 5.0031 H.t3p 157 HOH1 0.4170 2936 HO276 23.2937 29.2940 4.3810 H.t3p 157 HOH1 0.4170 2937 HO277 32.6159 42.6794 15.5341 H.t3p 157 HOH1 0.4170 2938 HO278 31.0950 42.8957 15.8220 H.t3p 157 HOH1 0.4170 2939 HO279 33.2928 9.9601 30.6402 H.t3p 157 HOH1 0.4170 2940 HO280 33.9185 10.3022 29.2489 H.t3p 157 HOH1 0.4170 2941 HO281 49.2975 14.5271 40.0700 H.t3p 157 HOH1 0.4170 2942 HO282 50.2142 13.2611 40.0576 H.t3p 157 HOH1 0.4170 2943 HO283 49.9649 26.5127 44.3365 H.t3p 157 HOH1 0.4170 2944 HO284 50.3789 25.2885 43.4574 H.t3p 157 HOH1 0.4170 2945 HO285 49.7829 23.6785 41.2113 H.t3p 157 HOH1 0.4170 2946 HO286 49.1655 25.0829 40.9119 H.t3p 157 HOH1 0.4170 2947 HO287 11.2018 18.6192 34.7036 H.t3p 157 HOH1 0.4170 2948 HO288 11.4543 18.3665 36.2256 H.t3p 157 HOH1 0.4170 2949 HO289 12.9766 18.0332 38.4835 H.t3p 157 HOH1 0.4170 2950 HO290 13.4418 19.3733 37.8270 H.t3p 157 HOH1 0.4170 2951 HO291 47.2561 16.7630 27.4837 H.t3p 157 HOH1 0.4170 2952 HO292 45.8225 16.5347 28.0641 H.t3p 157 HOH1 0.4170 2953 HO293 21.8371 41.2031 16.1292 H.t3p 157 HOH1 0.4170 2954 HO294 21.2299 42.4613 15.4280 H.t3p 157 HOH1 0.4170 2955 HO295 36.8686 11.2368 35.1495 H.t3p 157 HOH1 0.4170 2956 HO296 36.8571 11.0805 33.5940 H.t3p 157 HOH1 0.4170 2957 HO297 39.7215 36.2833 22.7141 H.t3p 157 HOH1 0.4170 2958 HO298 40.2661 37.1510 23.8948 H.t3p 157 HOH1 0.4170 2959 HO299 7.9839 33.4895 21.4241 H.t3p 157 HOH1 0.4170 2960 HO300 6.4421 33.2773 21.5697 H.t3p 157 HOH1 0.4170 2961 HO301 29.3756 11.8362 37.5234 H.t3p 157 HOH1 0.4170 2962 HO302 29.0102 10.3213 37.4014 H.t3p 157 HOH1 0.4170 2963 HO303 23.7386 45.5111 36.8263 H.t3p 157 HOH1 0.4170 2964 HO304 22.8002 46.7533 36.6865 H.t3p 157 HOH1 0.4170 2965 HO305 21.6054 25.8104 5.4329 H.t3p 157 HOH1 0.4170 2966 HO306 20.6162 26.2415 4.3023 H.t3p 157 HOH1 0.4170 2967 HO307 39.5968 38.9668 21.8337 H.t3p 157 HOH1 0.4170 2968 HO308 38.2062 39.6153 21.5335 H.t3p 157 HOH1 0.4170 2969 HO309 36.4403 41.8445 20.4461 H.t3p 157 HOH1 0.4170 2970 HO310 35.5568 40.5576 20.3653 H.t3p 157 HOH1 0.4170 2971 HO311 18.9088 14.4722 36.2597 H.t3p 157 HOH1 0.4170 2972 HO312 18.0641 13.5731 35.2998 H.t3p 157 HOH1 0.4170 2973 HO313 18.2630 11.5787 33.1659 H.t3p 157 HOH1 0.4170 2974 HO314 18.3615 10.7721 34.5011 H.t3p 157 HOH1 0.4170 2975 HO315 18.5921 15.9773 16.2836 H.t3p 157 HOH1 0.4170 2976 HO316 18.5569 16.2094 14.7383 H.t3p 157 HOH1 0.4170 2977 HO317 15.0570 26.3480 20.1926 H.t3p 157 HOH1 0.4170 2978 HO318 13.9906 26.9320 21.1754 H.t3p 157 HOH1 0.4170 2979 HO319 37.4486 15.4594 48.2351 H.t3p 157 HOH1 0.4170 2980 HO320 37.2605 16.2359 46.8916 H.t3p 157 HOH1 0.4170 2981 HO321 31.8046 40.5286 10.0960 H.t3p 157 HOH1 0.4170 2982 HO322 31.6166 41.3048 8.7524 H.t3p 157 HOH1 0.4170 2983 HO323 17.4715 27.9815 13.4803 H.t3p 157 HOH1 0.4170 2984 HO324 18.3102 26.6722 13.6432 H.t3p 157 HOH1 0.4170 2985 HO325 20.3163 25.2192 15.1052 H.t3p 157 HOH1 0.4170 2986 HO326 21.0272 25.7433 13.8155 H.t3p 157 HOH1 0.4170 2987 HO327 30.6557 14.8117 18.4922 H.t3p 157 HOH1 0.4170 2988 HO328 31.0659 13.3771 18.9589 H.t3p 157 HOH1 0.4170 2989 HO329 50.6250 22.8633 34.4384 H.t3p 157 HOH1 0.4170 2990 HO330 51.0468 22.9088 32.9337 H.t3p 157 HOH1 0.4170 2991 HO331 52.4071 25.2376 31.9583 H.t3p 157 HOH1 0.4170 2992 HO332 50.9069 25.6512 32.1056 H.t3p 157 HOH1 0.4170 2993 HO333 30.4717 10.7235 19.7021 H.t3p 157 HOH1 0.4170 2994 HO334 29.8224 11.6347 20.7936 H.t3p 157 HOH1 0.4170 2995 HO335 23.7036 7.9826 22.1361 H.t3p 157 HOH1 0.4170 2996 HO336 24.3852 8.2173 20.7491 H.t3p 157 HOH1 0.4170 2997 HO337 27.5922 7.9952 21.5938 H.t3p 157 HOH1 0.4170 2998 HO338 26.7236 9.2840 21.7594 H.t3p 157 HOH1 0.4170 2999 HO339 20.0383 49.4338 30.0350 H.t3p 157 HOH1 0.4170 3000 HO340 19.4831 50.5096 29.0463 H.t3p 157 HOH1 0.4170 3001 HO341 49.9113 16.3684 39.1916 H.t3p 157 HOH1 0.4170 3002 HO342 48.3847 16.3742 39.5275 H.t3p 157 HOH1 0.4170 3003 HO343 38.3435 13.2735 27.5286 H.t3p 157 HOH1 0.4170 3004 HO344 37.5622 12.2941 28.4637 H.t3p 157 HOH1 0.4170 3005 HO345 5.1229 29.1329 32.6898 H.t3p 157 HOH1 0.4170 3006 HO346 6.3306 28.3967 32.0238 H.t3p 157 HOH1 0.4170 3007 HO347 7.8019 26.9443 29.9077 H.t3p 157 HOH1 0.4170 3008 HO348 8.3418 28.4102 29.8540 H.t3p 157 HOH1 0.4170 3009 HO349 25.9151 19.2860 14.9699 H.t3p 157 HOH1 0.4170 3010 HO350 24.9337 18.7070 16.0403 H.t3p 157 HOH1 0.4170 3011 HO351 14.8504 22.5502 22.8784 H.t3p 157 HOH1 0.4170 3012 HO352 14.0334 21.3511 22.2960 H.t3p 157 HOH1 0.4170 3013 HO353 12.4681 21.5441 19.6118 H.t3p 157 HOH1 0.4170 3014 HO354 11.9594 22.7610 20.4507 H.t3p 157 HOH1 0.4170 3015 HO355 44.6440 41.9954 33.6950 H.t3p 157 HOH1 0.4170 3016 HO356 45.0679 40.8185 34.6327 H.t3p 157 HOH1 0.4170 3017 HO357 46.4819 38.4111 35.6273 H.t3p 157 HOH1 0.4170 3018 HO358 46.9485 39.5769 36.5581 H.t3p 157 HOH1 0.4170 3019 HO359 34.8886 25.3382 53.6136 H.t3p 157 HOH1 0.4170 3020 HO360 34.5449 24.0507 54.4307 H.t3p 157 HOH1 0.4170 3021 HO361 35.2743 23.5988 11.2933 H.t3p 157 HOH1 0.4170 3022 HO362 36.6831 22.9883 10.9991 H.t3p 157 HOH1 0.4170 3023 HO363 17.5954 30.4142 15.5830 H.t3p 157 HOH1 0.4170 3024 HO364 17.6387 29.9042 17.0602 H.t3p 157 HOH1 0.4170 3025 HO365 31.7312 25.2697 51.3234 H.t3p 157 HOH1 0.4170 3026 HO366 32.2019 26.7598 51.2932 H.t3p 157 HOH1 0.4170 3027 HO367 39.1177 20.2349 17.4543 H.t3p 157 HOH1 0.4170 3028 HO368 37.9561 21.2022 17.8533 H.t3p 157 HOH1 0.4170 3029 HO369 17.8432 18.5172 42.8857 H.t3p 157 HOH1 0.4170 3030 HO370 17.9091 17.3599 41.8373 H.t3p 157 HOH1 0.4170 3031 HO371 27.9318 25.2488 7.9605 H.t3p 157 HOH1 0.4170 3032 HO372 29.3788 24.6671 7.8576 H.t3p 157 HOH1 0.4170 3033 HO373 3.5317 30.7384 33.3582 H.t3p 157 HOH1 0.4170 3034 HO374 2.9406 30.2621 31.9918 H.t3p 157 HOH1 0.4170 3035 HO375 37.6228 36.8336 5.2925 H.t3p 157 HOH1 0.4170 3036 HO376 36.9455 36.6517 6.6893 H.t3p 157 HOH1 0.4170 3037 HO377 45.1563 11.4288 41.9312 H.t3p 157 HOH1 0.4170 3038 HO378 44.8508 9.9075 42.1195 H.t3p 157 HOH1 0.4170 3039 HO379 18.7382 37.4545 3.6594 H.t3p 157 HOH1 0.4170 3040 HO380 18.0589 36.1109 3.2382 H.t3p 157 HOH1 0.4170 3041 HO381 45.7930 36.8022 14.8269 H.t3p 157 HOH1 0.4170 3042 HO382 45.9907 37.9871 13.8270 H.t3p 157 HOH1 0.4170 3043 HO383 12.1953 36.2786 42.6735 H.t3p 157 HOH1 0.4170 3044 HO384 12.2234 37.6553 43.4132 H.t3p 157 HOH1 0.4170 3045 HO385 27.0955 46.0712 43.7797 H.t3p 157 HOH1 0.4170 3046 HO386 25.8516 46.9542 44.1221 H.t3p 157 HOH1 0.4170 3047 HO387 35.2715 17.6668 17.0607 H.t3p 157 HOH1 0.4170 3048 HO388 35.7798 16.4566 16.2120 H.t3p 157 HOH1 0.4170 3049 HO389 27.2056 40.3693 9.3344 H.t3p 157 HOH1 0.4170 3050 HO390 26.5058 41.4880 10.1728 H.t3p 157 HOH1 0.4170 3051 HO391 20.3217 17.7403 15.7188 H.t3p 157 HOH1 0.4170 3052 HO392 20.4117 19.1792 16.3224 H.t3p 157 HOH1 0.4170 3053 HO393 27.3070 48.9678 27.7944 H.t3p 157 HOH1 0.4170 3054 HO394 26.5543 47.9178 28.6742 H.t3p 157 HOH1 0.4170 3055 HH 38.2116 27.8211 46.3847 H 125 TYR125 0.3297 3056 HO395 10.6416 34.9453 13.1984 H.t3p 157 HOH1 0.4170 3057 HO396 9.4122 35.1391 14.1446 H.t3p 157 HOH1 0.4170 3058 HO397 5.8934 38.8871 25.6275 H.t3p 157 HOH1 0.4170 3059 HO398 5.9023 38.7809 27.1869 H.t3p 157 HOH1 0.4170 3060 HO399 44.4620 30.5734 10.9773 H.t3p 157 HOH1 0.4170 3061 HO400 43.6360 31.3634 9.9112 H.t3p 157 HOH1 0.4170 3062 HO401 48.2127 12.4453 39.1067 H.t3p 157 HOH1 0.4170 3063 HO402 48.1774 11.5428 37.8307 H.t3p 157 HOH1 0.4170 3064 HO403 30.1280 39.8399 51.8408 H.t3p 157 HOH1 0.4170 3065 HO404 29.1727 40.0996 53.0508 H.t3p 157 HOH1 0.4170 3066 HO405 34.0934 41.3485 28.7879 H.t3p 157 HOH1 0.4170 3067 HO406 33.0264 42.4869 28.8865 H.t3p 157 HOH1 0.4170 3068 HO407 19.7055 21.3213 15.4917 H.t3p 157 HOH1 0.4170 3069 HO408 18.8588 20.3790 14.5760 H.t3p 157 HOH1 0.4170 3070 HO409 14.8534 12.2453 34.8388 H.t3p 157 HOH1 0.4170 3071 HO410 15.8315 13.4230 34.5240 H.t3p 157 HOH1 0.4170 3072 HO411 13.3804 44.1804 25.1061 H.t3p 157 HOH1 0.4170 3073 HO412 14.6621 43.4256 24.6261 H.t3p 157 HOH1 0.4170 3074 HO413 32.0760 21.9443 7.1761 H.t3p 157 HOH1 0.4170 3075 HO414 30.8207 22.1294 8.0887 H.t3p 157 HOH1 0.4170 3076 HO415 8.2007 18.4551 29.0003 H.t3p 157 HOH1 0.4170 3077 HO416 9.1708 17.2301 29.0370 H.t3p 157 HOH1 0.4170 3078 HO417 52.6271 30.9626 27.5157 H.t3p 157 HOH1 0.4170 3079 HO418 52.3550 32.3948 26.9510 H.t3p 157 HOH1 0.4170 3080 HO419 51.1229 19.6851 25.6067 H.t3p 157 HOH1 0.4170 3081 HO420 52.0169 19.3257 24.3759 H.t3p 157 HOH1 0.4170 3082 HO421 21.6521 11.4535 26.9765 H.t3p 157 HOH1 0.4170 3083 HO422 22.7786 12.4292 26.5055 H.t3p 157 HOH1 0.4170 3084 HO423 8.6857 30.4317 18.4197 H.t3p 157 HOH1 0.4170 3085 HO424 8.4830 30.6979 19.9466 H.t3p 157 HOH1 0.4170 3086 HO425 10.8703 30.9764 11.7253 H.t3p 157 HOH1 0.4170 3087 HO426 9.5728 31.2453 10.8962 H.t3p 157 HOH1 0.4170 3088 HO427 22.7407 49.4926 18.9845 H.t3p 157 HOH1 0.4170 3089 HO428 21.3170 48.9210 19.2840 H.t3p 157 HOH1 0.4170 3090 HO429 34.1077 47.2948 28.4819 H.t3p 157 HOH1 0.4170 3091 HO430 33.2526 47.6469 29.7425 H.t3p 157 HOH1 0.4170 3092 HO431 23.6062 23.8563 7.5374 H.t3p 157 HOH1 0.4170 3093 HO432 24.6289 23.6824 8.7069 H.t3p 157 HOH1 0.4170 3094 HO433 45.3566 19.0477 21.0344 H.t3p 157 HOH1 0.4170 3095 HO434 46.3550 18.0749 20.3271 H.t3p 157 HOH1 0.4170 3096 HO435 9.4366 18.6779 21.6109 H.t3p 157 HOH1 0.4170 3097 HO436 8.9552 17.6623 20.5246 H.t3p 157 HOH1 0.4170 3098 HO437 28.3576 13.4691 16.0050 H.t3p 157 HOH1 0.4170 3099 HO438 27.0293 13.2938 16.8101 H.t3p 157 HOH1 0.4170 3100 HO439 11.3025 21.0170 40.5944 H.t3p 157 HOH1 0.4170 3101 HO440 11.2242 21.1436 42.1503 H.t3p 157 HOH1 0.4170 3102 HO441 13.6309 14.4534 35.4169 H.t3p 157 HOH1 0.4170 3103 HO442 12.0871 14.6660 35.2920 H.t3p 157 HOH1 0.4170 3104 HO443 51.2038 21.2889 23.6609 H.t3p 157 HOH1 0.4170 3105 HO444 50.7039 21.4890 22.1932 H.t3p 157 HOH1 0.4170 3106 HO445 33.6042 24.2504 8.1813 H.t3p 157 HOH1 0.4170 3107 HO446 33.8661 25.4908 9.0954 H.t3p 157 HOH1 0.4170 3108 HO447 33.3174 18.4038 14.0102 H.t3p 157 HOH1 0.4170 3109 HO448 32.6689 17.0913 13.4616 H.t3p 157 HOH1 0.4170 3110 HO449 13.6932 10.2777 31.7733 H.t3p 157 HOH1 0.4170 3111 HO450 12.4467 9.9205 30.9004 H.t3p 157 HOH1 0.4170 3112 HO451 16.4971 33.1619 6.7910 H.t3p 157 HOH1 0.4170 3113 HO452 15.6982 33.7516 5.5834 H.t3p 157 HOH1 0.4170 3114 HO453 23.3460 37.9512 50.2288 H.t3p 157 HOH1 0.4170 3115 HO454 22.6806 36.7231 49.5264 H.t3p 157 HOH1 0.4170 3116 HO455 18.9089 44.6554 23.1278 H.t3p 157 HOH1 0.4170 3117 HO456 19.8480 45.7892 22.6017 H.t3p 157 HOH1 0.4170 3118 HO457 31.9644 43.8514 35.2900 H.t3p 157 HOH1 0.4170 3119 HO458 33.1932 43.6565 36.2367 H.t3p 157 HOH1 0.4170 3120 HO459 25.5950 21.8227 11.4248 H.t3p 157 HOH1 0.4170 3121 HO460 25.4851 20.4440 10.6967 H.t3p 157 HOH1 0.4170 3122 HO461 13.7656 45.0979 34.4591 H.t3p 157 HOH1 0.4170 3123 HO462 13.4384 46.5012 33.8532 H.t3p 157 HOH1 0.4170 3124 HO463 17.4166 11.1615 26.9934 H.t3p 157 HOH1 0.4170 3125 HO464 16.9645 9.7682 27.5397 H.t3p 157 HOH1 0.4170 3126 HO465 45.7829 20.6765 19.4317 H.t3p 157 HOH1 0.4170 3127 HO466 46.3419 21.6451 18.3392 H.t3p 157 HOH1 0.4170 3128 HO467 26.5620 34.2675 55.1023 H.t3p 157 HOH1 0.4170 3129 HO468 25.2721 34.4566 54.2394 H.t3p 157 HOH1 0.4170 3130 HO469 16.6151 33.6814 9.1696 H.t3p 157 HOH1 0.4170 3131 HO470 17.1708 32.2381 8.9433 H.t3p 157 HOH1 0.4170 3132 HO471 28.8780 17.5870 13.0357 H.t3p 157 HOH1 0.4170 3133 HO472 29.8864 18.7319 13.3758 H.t3p 157 HOH1 0.4170 3134 HO473 26.3930 26.9587 5.6452 H.t3p 157 HOH1 0.4170 3135 HO474 25.9769 26.6770 4.1651 H.t3p 157 HOH1 0.4170 3136 HO475 7.6174 31.6209 23.2080 H.t3p 157 HOH1 0.4170 3137 HO476 6.9515 30.3530 23.8352 H.t3p 157 HOH1 0.4170 3138 HO477 23.2331 40.8138 12.6735 H.t3p 157 HOH1 0.4170 3139 HO478 23.5726 40.4758 11.1856 H.t3p 157 HOH1 0.4170 3140 HO479 4.8303 38.0610 34.7519 H.t3p 157 HOH1 0.4170 3141 HO480 5.5044 36.6591 34.5981 H.t3p 157 HOH1 0.4170 3142 HO481 11.2504 33.8148 14.9398 H.t3p 157 HOH1 0.4170 3143 HO482 12.6038 33.3379 14.3203 H.t3p 157 HOH1 0.4170 3144 HO483 19.9955 28.4658 5.7216 H.t3p 157 HOH1 0.4170 3145 HO484 19.1239 29.6664 5.2302 H.t3p 157 HOH1 0.4170 3146 HO485 39.7880 9.1611 37.8029 H.t3p 157 HOH1 0.4170 3147 HO486 38.6511 9.1153 36.7307 H.t3p 157 HOH1 0.4170 3148 HO487 9.5299 27.2046 31.6382 H.t3p 157 HOH1 0.4170 3149 HO488 10.5685 27.6964 32.6978 H.t3p 157 HOH1 0.4170 3150 HO489 11.2027 34.0441 20.5287 H.t3p 157 HOH1 0.4170 3151 HO490 9.8928 34.6630 21.1163 H.t3p 157 HOH1 0.4170 3152 HO491 36.4077 27.2877 5.9649 H.t3p 157 HOH1 0.4170 3153 HO492 37.6516 28.0388 5.3879 H.t3p 157 HOH1 0.4170 3154 HO493 29.1155 48.3784 34.0815 H.t3p 157 HOH1 0.4170 3155 HO494 27.6488 48.2930 34.6153 H.t3p 157 HOH1 0.4170 3156 HO495 32.0652 39.8372 50.4738 H.t3p 157 HOH1 0.4170 3157 HO496 32.0620 41.1240 51.3612 H.t3p 157 HOH1 0.4170 3158 HO497 34.4623 40.6368 45.2403 H.t3p 157 HOH1 0.4170 3159 HO498 33.2394 40.2408 46.1294 H.t3p 157 HOH1 0.4170 3160 HO499 13.5971 39.9679 21.9893 H.t3p 157 HOH1 0.4170 3161 HO500 13.6597 38.5266 22.5909 H.t3p 157 HOH1 0.4170 3162 HO501 31.9821 46.8144 20.9080 H.t3p 157 HOH1 0.4170 3163 HO502 32.5957 47.4736 22.1859 H.t3p 157 HOH1 0.4170 3164 HO503 14.5363 11.8585 21.8182 H.t3p 157 HOH1 0.4170 3165 HO504 13.6210 12.4581 20.7021 H.t3p 157 HOH1 0.4170 3166 HO505 23.7950 18.1798 12.8001 H.t3p 157 HOH1 0.4170 3167 HO506 23.8896 16.8318 13.5855 H.t3p 157 HOH1 0.4170 3168 HO507 15.5878 38.7239 18.6557 H.t3p 157 HOH1 0.4170 3169 HO508 16.4232 40.0440 18.6041 H.t3p 157 HOH1 0.4170 3170 HO509 17.2345 44.3039 32.4708 H.t3p 157 HOH1 0.4170 3171 HO510 17.8218 44.4280 33.9143 H.t3p 157 HOH1 0.4170 3172 HG1 29.3834 38.9977 27.4623 H 38 THR38 0.4055 3173 HO511 35.4404 11.8074 25.6652 H.t3p 157 HOH1 0.4170 3174 HO512 36.8870 11.2212 25.5849 H.t3p 157 HOH1 0.4170 3175 HO513 30.1028 25.3097 46.9083 H.t3p 157 HOH1 0.4170 3176 HO514 30.4518 24.2562 48.0091 H.t3p 157 HOH1 0.4170 3177 HO515 33.1910 44.1328 32.3098 H.t3p 157 HOH1 0.4170 3178 HO516 32.2306 45.0779 31.5170 H.t3p 157 HOH1 0.4170 3179 HO517 16.0187 29.1663 20.0837 H.t3p 157 HOH1 0.4170 3180 HO518 15.0183 28.5629 19.0453 H.t3p 157 HOH1 0.4170 3181 HO519 44.3843 14.3602 27.5478 H.t3p 157 HOH1 0.4170 3182 HO520 45.4813 14.1420 26.4558 H.t3p 157 HOH1 0.4170 3183 HO521 29.1704 38.2638 7.5436 H.t3p 157 HOH1 0.4170 3184 HO522 30.1146 38.0718 6.3124 H.t3p 157 HOH1 0.4170 3185 HO523 15.4811 34.3193 45.3468 H.t3p 157 HOH1 0.4170 3186 HO524 14.6672 34.5731 44.0366 H.t3p 157 HOH1 0.4170 3187 HO525 37.3783 12.2126 31.2911 H.t3p 157 HOH1 0.4170 3188 HO526 35.9443 12.6894 31.6898 H.t3p 157 HOH1 0.4170 3189 HO527 47.2418 31.3824 17.7387 H.t3p 157 HOH1 0.4170 3190 HO528 46.7176 32.8016 17.3457 H.t3p 157 HOH1 0.4170 3191 HO529 25.1229 40.6437 49.8896 H.t3p 157 HOH1 0.4170 3192 HO530 26.2317 41.4882 50.5979 H.t3p 157 HOH1 0.4170 3193 HO531 49.6492 29.5997 15.3056 H.t3p 157 HOH1 0.4170 3194 HO532 48.7957 30.7166 14.6222 H.t3p 157 HOH1 0.4170 3195 HO533 35.3087 48.8801 27.3915 H.t3p 157 HOH1 0.4170 3196 HO534 36.0096 47.4890 27.2621 H.t3p 157 HOH1 0.4170 3197 HO535 27.4089 43.3170 47.5268 H.t3p 157 HOH1 0.4170 3198 HO536 27.4348 43.6168 45.9929 H.t3p 157 HOH1 0.4170 3199 HO537 10.3290 44.0634 37.3802 H.t3p 157 HOH1 0.4170 3200 HO538 10.7296 42.5826 37.0798 H.t3p 157 HOH1 0.4170 3201 HO539 50.3680 27.2006 23.8738 H.t3p 157 HOH1 0.4170 3202 HO540 51.8542 26.8374 24.1930 H.t3p 157 HOH1 0.4170 3203 HO541 17.3896 22.2504 27.3576 H.t3p 157 HOH1 0.4170 3204 HO542 17.3433 22.8081 25.8981 H.t3p 157 HOH1 0.4170 3205 HO543 27.9955 29.8964 6.0981 H.t3p 157 HOH1 0.4170 3206 HO544 28.4335 29.8828 4.5976 H.t3p 157 HOH1 0.4170 3207 HO545 11.4406 38.6402 13.6470 H.t3p 157 HOH1 0.4170 3208 HO546 11.3130 37.5685 12.5165 H.t3p 157 HOH1 0.4170 3209 HO547 36.2246 23.5741 52.8906 H.t3p 157 HOH1 0.4170 3210 HO548 37.6377 23.0077 53.2462 H.t3p 157 HOH1 0.4170 3211 HO549 32.1603 10.7305 21.8965 H.t3p 157 HOH1 0.4170 3212 HO550 33.5339 9.9971 22.0330 H.t3p 157 HOH1 0.4170 3213 HO551 20.2557 47.9853 15.5873 H.t3p 157 HOH1 0.4170 3214 HO552 21.0830 49.1759 16.1716 H.t3p 157 HOH1 0.4170 3215 HO553 17.2811 39.6608 42.2801 H.t3p 157 HOH1 0.4170 3216 HO554 16.0268 40.3561 42.9015 H.t3p 157 HOH1 0.4170 3217 HO555 36.1770 43.5962 39.9949 H.t3p 157 HOH1 0.4170 3218 HO556 36.4640 42.3300 39.1247 H.t3p 157 HOH1 0.4170 3219 HO557 33.4384 24.7189 12.0907 H.t3p 157 HOH1 0.4170 3220 HO558 34.5092 24.5783 13.2204 H.t3p 157 HOH1 0.4170 3221 HO559 10.8119 39.2582 38.1307 H.t3p 157 HOH1 0.4170 3222 HO560 10.2080 40.0963 39.3042 H.t3p 157 HOH1 0.4170 3223 HO561 6.3525 34.9942 27.1232 H.t3p 157 HOH1 0.4170 3224 HO562 6.1060 33.5039 27.5252 H.t3p 157 HOH1 0.4170 3225 HO563 35.0092 39.2959 29.1040 H.t3p 157 HOH1 0.4170 3226 HO564 34.3909 39.8214 30.4400 H.t3p 157 HOH1 0.4170 3227 HO565 31.8847 21.2979 13.5747 H.t3p 157 HOH1 0.4170 3228 HO566 32.5730 21.8100 14.8817 H.t3p 157 HOH1 0.4170 3229 HO567 33.2514 26.3030 5.2687 H.t3p 157 HOH1 0.4170 3230 HO568 33.1161 25.8159 3.7898 H.t3p 157 HOH1 0.4170 3231 HO569 45.1164 14.3784 30.5118 H.t3p 157 HOH1 0.4170 3232 HO570 46.2901 13.5159 31.0800 H.t3p 157 HOH1 0.4170 3233 HO571 40.6327 41.5152 43.4452 H.t3p 157 HOH1 0.4170 3234 HO572 40.0648 42.2836 44.6821 H.t3p 157 HOH1 0.4170 3235 HO573 12.7893 41.0769 41.6978 H.t3p 157 HOH1 0.4170 3236 HO574 14.1036 41.1566 42.5402 H.t3p 157 HOH1 0.4170 3237 HO575 15.8431 29.2913 7.1398 H.t3p 157 HOH1 0.4170 3238 HO576 16.9564 30.2395 7.6920 H.t3p 157 HOH1 0.4170 3239 HO577 18.0190 38.9235 14.3210 H.t3p 157 HOH1 0.4170 3240 HO578 16.8507 38.2282 13.5497 H.t3p 157 HOH1 0.4170 3241 HO579 14.8445 24.6948 23.6124 H.t3p 157 HOH1 0.4170 3242 HO580 16.0426 24.4624 22.6359 H.t3p 157 HOH1 0.4170 3243 HO581 33.3803 42.8749 45.9775 H.t3p 157 HOH1 0.4170 3244 HO582 33.0713 44.1491 46.8291 H.t3p 157 HOH1 0.4170 3245 HO583 49.3128 29.0627 25.3379 H.t3p 157 HOH1 0.4170 3246 HO584 49.5566 30.2767 26.2924 H.t3p 157 HOH1 0.4170 3247 HO585 23.4491 51.1399 32.5025 H.t3p 157 HOH1 0.4170 3248 HO586 23.7814 50.0712 33.5937 H.t3p 157 HOH1 0.4170 3249 HO587 14.9047 31.0348 18.8940 H.t3p 157 HOH1 0.4170 3250 HO588 15.1311 32.4338 18.2338 H.t3p 157 HOH1 0.4170 3251 HO589 16.6344 15.3257 36.1878 H.t3p 157 HOH1 0.4170 3252 HO590 16.0515 16.6074 35.5090 H.t3p 157 HOH1 0.4170 3253 HO591 47.0553 38.7669 17.7235 H.t3p 157 HOH1 0.4170 3254 HO592 46.2045 38.6070 19.0248 H.t3p 157 HOH1 0.4170 3255 HO593 13.8080 19.2756 44.1606 H.t3p 157 HOH1 0.4170 3256 HO594 14.1305 20.4432 43.1729 H.t3p 157 HOH1 0.4170 3257 HO595 10.9305 39.5113 29.8335 H.t3p 157 HOH1 0.4170 3258 HO596 9.5363 40.2059 29.6990 H.t3p 157 HOH1 0.4170 3259 HO597 46.7183 34.7531 15.1393 H.t3p 157 HOH1 0.4170 3260 HO598 47.4680 35.8197 16.0014 H.t3p 157 HOH1 0.4170 3261 HO599 33.9084 27.8834 6.7615 H.t3p 157 HOH1 0.4170 3262 HO600 32.7631 28.4412 5.8560 H.t3p 157 HOH1 0.4170 3263 HO601 23.3700 13.7153 35.4684 H.t3p 157 HOH1 0.4170 3264 HO602 24.1106 13.8540 34.0988 H.t3p 157 HOH1 0.4170 3265 HO603 7.1825 34.8784 23.2516 H.t3p 157 HOH1 0.4170 3266 HO604 6.1957 36.0904 23.2395 H.t3p 157 HOH1 0.4170 3267 HO605 42.1576 45.5219 31.5827 H.t3p 157 HOH1 0.4170 3268 HO606 43.2865 45.6749 32.6527 H.t3p 157 HOH1 0.4170 3269 HO607 37.9442 22.3706 48.9074 H.t3p 157 HOH1 0.4170 3270 HO608 37.1316 21.4455 49.8708 H.t3p 157 HOH1 0.4170 3271 HO609 19.6247 32.3671 3.5722 H.t3p 157 HOH1 0.4170 3272 HO610 19.0570 33.1352 4.8094 H.t3p 157 HOH1 0.4170 3273 HO611 20.3597 9.6978 28.0036 H.t3p 157 HOH1 0.4170 3274 HO612 21.8723 9.4675 28.3231 H.t3p 157 HOH1 0.4170 3275 HO613 47.9280 16.9915 31.6108 H.t3p 157 HOH1 0.4170 3276 HO614 46.8696 16.2522 32.4926 H.t3p 157 HOH1 0.4170 3277 HO615 24.3887 42.8989 11.6418 H.t3p 157 HOH1 0.4170 3278 HO616 25.2896 44.0933 12.0956 H.t3p 157 HOH1 0.4170 3279 HO617 21.1690 15.8202 36.2799 H.t3p 157 HOH1 0.4170 3280 HO618 21.3636 14.7201 37.3732 H.t3p 157 HOH1 0.4170 3281 HO619 14.8879 39.2442 7.9287 H.t3p 157 HOH1 0.4170 3282 HO620 14.2524 40.5475 8.5132 H.t3p 157 HOH1 0.4170 3283 HO621 12.1802 20.6483 30.3189 H.t3p 157 HOH1 0.4170 3284 HO622 11.7557 19.5918 29.2480 H.t3p 157 HOH1 0.4170 3285 HO623 18.2721 15.4839 18.4983 H.t3p 157 HOH1 0.4170 3286 HO624 16.8924 15.6032 17.7733 H.t3p 157 HOH1 0.4170 3287 HO625 8.9598 24.0574 25.8601 H.t3p 157 HOH1 0.4170 3288 HO626 9.4557 22.9369 26.8303 H.t3p 157 HOH1 0.4170 3289 HO627 23.8868 13.1363 16.0940 H.t3p 157 HOH1 0.4170 3290 HO628 23.2381 13.9623 14.9364 H.t3p 157 HOH1 0.4170 3291 HO629 47.6871 43.2328 37.3703 H.t3p 157 HOH1 0.4170 3292 HO630 47.0906 43.5699 38.7752 H.t3p 157 HOH1 0.4170 3293 HO631 45.7292 36.6459 40.8945 H.t3p 157 HOH1 0.4170 3294 HO632 46.9948 35.8243 41.3038 H.t3p 157 HOH1 0.4170 3295 HO633 4.9047 30.5451 35.9525 H.t3p 157 HOH1 0.4170 3296 HO634 5.7772 29.3414 36.4365 H.t3p 157 HOH1 0.4170 3297 HO635 18.8242 47.5699 33.5641 H.t3p 157 HOH1 0.4170 3298 HO636 18.1184 47.3025 32.1950 H.t3p 157 HOH1 0.4170 3299 HO637 35.9630 31.0194 50.8361 H.t3p 157 HOH1 0.4170 3300 HO638 36.1418 30.2160 52.1650 H.t3p 157 HOH1 0.4170 3301 HO639 13.8836 19.8235 35.3574 H.t3p 157 HOH1 0.4170 3302 HO640 14.0378 18.2683 35.3810 H.t3p 157 HOH1 0.4170 3303 HO641 25.9301 37.8187 3.4629 H.t3p 157 HOH1 0.4170 3304 HO642 26.1154 37.0284 4.7985 H.t3p 157 HOH1 0.4170 3305 HO643 29.1697 42.7921 48.8393 H.t3p 157 HOH1 0.4170 3306 HO644 27.8488 42.7791 49.6747 H.t3p 157 HOH1 0.4170 3307 HO645 39.4260 36.5974 12.3060 H.t3p 157 HOH1 0.4170 3308 HO646 40.7917 37.3576 12.3169 H.t3p 157 HOH1 0.4170 3309 HO647 8.4915 16.1504 22.3217 H.t3p 157 HOH1 0.4170 3310 HO648 7.3697 15.0839 22.5391 H.t3p 157 HOH1 0.4170 3311 HO649 19.9198 43.5740 13.1560 H.t3p 157 HOH1 0.4170 3312 HO650 19.7956 45.1311 13.0902 H.t3p 157 HOH1 0.4170 3313 HO651 34.8376 45.6599 10.7592 H.t3p 157 HOH1 0.4170 3314 HO652 35.9292 44.5978 11.1110 H.t3p 157 HOH1 0.4170 3315 HO653 51.4678 25.2573 40.7866 H.t3p 157 HOH1 0.4170 3316 HO654 52.8226 24.7830 40.1680 H.t3p 157 HOH1 0.4170 3317 HO655 14.4974 37.0164 8.8801 H.t3p 157 HOH1 0.4170 3318 HO656 14.7003 36.8706 7.3371 H.t3p 157 HOH1 0.4170 3319 HO657 49.6246 17.8352 41.4994 H.t3p 157 HOH1 0.4170 3320 HO658 50.0447 18.1095 42.9801 H.t3p 157 HOH1 0.4170 3321 HO659 38.0456 42.6008 33.4887 H.t3p 157 HOH1 0.4170 3322 HO660 38.5438 41.4331 32.5763 H.t3p 157 HOH1 0.4170 3323 HO661 36.8694 41.9806 9.2695 H.t3p 157 HOH1 0.4170 3324 HO662 36.2707 41.5909 7.8791 H.t3p 157 HOH1 0.4170 3325 HO663 42.6372 35.2628 45.5371 H.t3p 157 HOH1 0.4170 3326 HO664 41.1198 34.8894 45.5645 H.t3p 157 HOH1 0.4170 3327 HO665 27.7118 47.8511 32.4305 H.t3p 157 HOH1 0.4170 3328 HO666 27.6059 48.6586 31.0960 H.t3p 157 HOH1 0.4170 3329 HO667 13.4385 38.6351 12.3445 H.t3p 157 HOH1 0.4170 3330 HO668 14.1642 38.8464 10.9760 H.t3p 157 HOH1 0.4170 3331 HO669 27.0782 46.2333 37.7235 H.t3p 157 HOH1 0.4170 3332 HO670 28.0333 47.2180 36.9746 H.t3p 157 HOH1 0.4170 3333 HO671 26.8981 16.5987 14.4462 H.t3p 157 HOH1 0.4170 3334 HO672 26.8984 16.0280 12.9912 H.t3p 157 HOH1 0.4170 3335 HO673 28.5075 15.7936 18.8221 H.t3p 157 HOH1 0.4170 3336 HO674 29.3464 16.7045 17.8683 H.t3p 157 HOH1 0.4170 3337 HO675 23.5526 41.7499 47.5426 H.t3p 157 HOH1 0.4170 3338 HO676 23.3392 42.8761 48.6057 H.t3p 157 HOH1 0.4170 3339 HO677 40.9954 33.3013 11.3909 H.t3p 157 HOH1 0.4170 3340 HO678 40.8763 33.7757 9.9060 H.t3p 157 HOH1 0.4170 3341 HO679 32.8104 43.2004 42.6182 H.t3p 157 HOH1 0.4170 3342 HO680 31.9701 43.9827 41.5577 H.t3p 157 HOH1 0.4170 3343 HO681 19.4112 47.6256 35.9640 H.t3p 157 HOH1 0.4170 3344 HO682 19.6307 46.1713 35.4347 H.t3p 157 HOH1 0.4170 3345 HO683 9.0457 34.5526 29.5888 H.t3p 157 HOH1 0.4170 3346 HO684 9.0940 36.0614 29.9943 H.t3p 157 HOH1 0.4170 3347 HO685 28.1740 23.4306 9.7615 H.t3p 157 HOH1 0.4170 3348 HO686 28.7028 23.2529 11.2219 H.t3p 157 HOH1 0.4170 3349 HO687 22.8432 12.7825 37.6256 H.t3p 157 HOH1 0.4170 3350 HO688 23.6190 14.1242 37.8292 H.t3p 157 HOH1 0.4170 3351 HO689 12.0867 27.5423 42.6919 H.t3p 157 HOH1 0.4170 3352 HO690 11.2200 28.5652 43.4956 H.t3p 157 HOH1 0.4170 3353 HO691 7.8252 32.6964 39.5732 H.t3p 157 HOH1 0.4170 3354 HO692 9.1721 33.4893 39.5503 H.t3p 157 HOH1 0.4170 3355 HO693 29.2595 46.7112 43.0088 H.t3p 157 HOH1 0.4170 3356 HO694 29.2652 45.1843 43.3429 H.t3p 157 HOH1 0.4170 3357 HO695 7.8318 38.4960 36.3773 H.t3p 157 HOH1 0.4170 3358 HO696 7.7037 38.9901 34.8996 H.t3p 157 HOH1 0.4170 3359 HO697 34.0132 15.4352 21.4096 H.t3p 157 HOH1 0.4170 3360 HO698 34.0432 15.9046 19.9187 H.t3p 157 HOH1 0.4170 3361 HO699 41.0044 37.6147 45.5945 H.t3p 157 HOH1 0.4170 3362 HO700 40.1329 38.8156 45.1033 H.t3p 157 HOH1 0.4170 3363 HO701 45.1558 13.7945 46.2263 H.t3p 157 HOH1 0.4170 3364 HO702 44.1658 14.4424 47.2477 H.t3p 157 HOH1 0.4170 3365 HO703 47.6169 28.6188 14.4515 H.t3p 157 HOH1 0.4170 3366 HO704 47.5421 27.1479 13.9269 H.t3p 157 HOH1 0.4170 3367 HO705 11.2718 19.2312 32.4673 H.t3p 157 HOH1 0.4170 3368 HO706 11.7626 20.4204 33.3548 H.t3p 157 HOH1 0.4170 3369 HO707 43.9871 47.1893 35.2131 H.t3p 157 HOH1 0.4170 3370 HO708 43.5131 47.4110 36.6860 H.t3p 157 HOH1 0.4170 3371 HO709 15.4762 15.3863 41.3401 H.t3p 157 HOH1 0.4170 3372 HO710 14.8380 16.7438 41.7795 H.t3p 157 HOH1 0.4170 3373 HO711 49.2748 29.2315 36.8312 H.t3p 157 HOH1 0.4170 3374 HO712 48.1368 28.2050 36.5234 H.t3p 157 HOH1 0.4170 3375 HO713 23.4616 34.8965 2.3510 H.t3p 157 HOH1 0.4170 3376 HO714 23.7628 34.1419 3.6862 H.t3p 157 HOH1 0.4170 3377 HO715 40.6909 18.3334 17.2130 H.t3p 157 HOH1 0.4170 3378 HO716 39.2653 17.7604 17.5006 H.t3p 157 HOH1 0.4170 3379 HO717 19.1147 25.8834 5.8218 H.t3p 157 HOH1 0.4170 3380 HO718 17.7370 25.2604 5.4253 H.t3p 157 HOH1 0.4170 3381 HO719 31.3725 23.5637 11.7359 H.t3p 157 HOH1 0.4170 3382 HO720 31.0701 25.0571 12.0842 H.t3p 157 HOH1 0.4170 3383 HO721 23.3811 46.4474 38.8095 H.t3p 157 HOH1 0.4170 3384 HO722 23.1170 46.1616 40.3237 H.t3p 157 HOH1 0.4170 3385 HO723 18.6648 30.0379 46.5831 H.t3p 157 HOH1 0.4170 3386 HO724 20.1825 29.7353 46.8051 H.t3p 157 HOH1 0.4170 3387 HO725 19.1064 19.1760 45.1895 H.t3p 157 HOH1 0.4170 3388 HO726 17.9190 20.1677 44.9657 H.t3p 157 HOH1 0.4170 3389 HO727 12.8676 18.5776 41.7900 H.t3p 157 HOH1 0.4170 3390 HO728 12.3425 17.2207 41.2179 H.t3p 157 HOH1 0.4170 3391 HO729 38.4352 31.9664 7.9393 H.t3p 157 HOH1 0.4170 3392 HO730 39.0988 33.3808 7.8908 H.t3p 157 HOH1 0.4170 3393 HO731 33.4388 39.4910 8.3589 H.t3p 157 HOH1 0.4170 3394 HO732 34.0324 38.2321 7.6468 H.t3p 157 HOH1 0.4170 3395 HO733 47.6141 30.8004 22.9293 H.t3p 157 HOH1 0.4170 3396 HO734 46.1530 30.3693 22.5789 H.t3p 157 HOH1 0.4170 3397 HO735 48.4945 29.7283 44.4668 H.t3p 157 HOH1 0.4170 3398 HO736 48.5536 31.0594 43.6495 H.t3p 157 HOH1 0.4170 3399 HO737 42.8374 45.5519 41.1869 H.t3p 157 HOH1 0.4170 3400 HO738 42.4566 44.8500 42.5309 H.t3p 157 HOH1 0.4170 3401 HO739 12.2273 30.5126 13.8390 H.t3p 157 HOH1 0.4170 3402 HO740 11.8860 29.3238 12.8833 H.t3p 157 HOH1 0.4170 3403 HO741 29.4685 12.8237 27.9582 H.t3p 157 HOH1 0.4170 3404 HO742 29.5407 14.1473 27.1292 H.t3p 157 HOH1 0.4170 3405 HO743 45.2464 36.1800 24.6447 H.t3p 157 HOH1 0.4170 3406 HO744 43.7361 36.0793 25.0359 H.t3p 157 HOH1 0.4170 3407 HO745 38.0167 37.4143 23.7038 H.t3p 157 HOH1 0.4170 3408 HO746 36.9948 38.4980 24.1787 H.t3p 157 HOH1 0.4170 3409 HO747 7.3994 18.8861 24.9792 H.t3p 157 HOH1 0.4170 3410 HO748 7.1679 17.5939 24.1310 H.t3p 157 HOH1 0.4170 3411 HO749 32.4317 42.6142 11.0554 H.t3p 157 HOH1 0.4170 3412 HO750 31.8837 43.2175 12.3895 H.t3p 157 HOH1 0.4170 3413 HH 40.1894 23.7409 20.7012 H 64 TYR64 0.3297 3414 HO751 18.0192 42.8324 41.5717 H.t3p 157 HOH1 0.4170 3415 HO752 17.9027 41.5845 40.6379 H.t3p 157 HOH1 0.4170 3416 HO753 19.5984 18.9084 41.3980 H.t3p 157 HOH1 0.4170 3417 HO754 20.7913 19.8624 41.7314 H.t3p 157 HOH1 0.4170 3418 HO755 48.6754 32.4992 27.5302 H.t3p 157 HOH1 0.4170 3419 HO756 49.4883 33.3195 26.4770 H.t3p 157 HOH1 0.4170 3420 HO757 15.5670 25.0719 18.3598 H.t3p 157 HOH1 0.4170 3421 HO758 16.2268 26.4828 18.2281 H.t3p 157 HOH1 0.4170 3422 HO759 15.0122 30.4362 9.0632 H.t3p 157 HOH1 0.4170 3423 HO760 13.9772 29.7933 10.0428 H.t3p 157 HOH1 0.4170 3424 HO761 53.0469 23.9978 26.8834 H.t3p 157 HOH1 0.4170 3425 HO762 51.7765 24.1976 25.9949 H.t3p 157 HOH1 0.4170 3426 HO763 46.8162 20.3855 44.8161 H.t3p 157 HOH1 0.4170 3427 HO764 45.4438 19.8504 45.3397 H.t3p 157 HOH1 0.4170 3428 HO765 34.5100 45.3847 13.8164 H.t3p 157 HOH1 0.4170 3429 HO766 34.8755 46.5715 14.7657 H.t3p 157 HOH1 0.4170 3430 HO767 31.5456 44.8998 19.4055 H.t3p 157 HOH1 0.4170 3431 HO768 32.3899 45.9585 18.6247 H.t3p 157 HOH1 0.4170 3432 HO769 29.6261 46.5304 15.9823 H.t3p 157 HOH1 0.4170 3433 HO770 29.5762 45.0680 15.4326 H.t3p 157 HOH1 0.4170 3434 HO771 19.3442 40.6847 15.5626 H.t3p 157 HOH1 0.4170 3435 HO772 17.8641 41.0507 15.9065 H.t3p 157 HOH1 0.4170 3436 HO773 48.3660 31.7243 39.9918 H.t3p 157 HOH1 0.4170 3437 HO774 47.2617 32.6776 40.5539 H.t3p 157 HOH1 0.4170 3438 HO775 44.1224 36.8223 13.2661 H.t3p 157 HOH1 0.4170 3439 HO776 43.0454 35.7015 13.1031 H.t3p 157 HOH1 0.4170 3440 HO777 23.0853 7.8929 24.3388 H.t3p 157 HOH1 0.4170 3441 HO778 24.6146 7.6012 24.2012 H.t3p 157 HOH1 0.4170 3442 HO779 3.4520 36.6742 33.4031 H.t3p 157 HOH1 0.4170 3443 HO780 2.3477 37.2338 32.4484 H.t3p 157 HOH1 0.4170 3444 HO781 44.7582 40.2060 17.6643 H.t3p 157 HOH1 0.4170 3445 HO782 44.7060 40.1991 19.2264 H.t3p 157 HOH1 0.4170 3446 HO783 47.2081 36.4071 18.4731 H.t3p 157 HOH1 0.4170 3447 HO784 47.9150 35.4754 19.5106 H.t3p 157 HOH1 0.4170 3448 HO785 17.7902 23.4912 15.9976 H.t3p 157 HOH1 0.4170 3449 HO786 16.6969 23.3283 14.8919 H.t3p 157 HOH1 0.4170 3450 HO787 39.0827 14.4228 46.4979 H.t3p 157 HOH1 0.4170 3451 HO788 39.6531 13.2846 45.5905 H.t3p 157 HOH1 0.4170 3452 HO789 17.0033 21.5081 34.3315 H.t3p 157 HOH1 0.4170 3453 HO790 16.4443 21.3976 35.7871 H.t3p 157 HOH1 0.4170 3454 HO791 49.4279 34.5051 28.5123 H.t3p 157 HOH1 0.4170 3455 HO792 50.6576 34.9045 29.3913 H.t3p 157 HOH1 0.4170 3456 HO793 32.4909 11.1761 32.6795 H.t3p 157 HOH1 0.4170 3457 HO794 31.8522 9.7732 32.4202 H.t3p 157 HOH1 0.4170 3458 HO795 32.5304 12.2270 27.9302 H.t3p 157 HOH1 0.4170 3459 HO796 33.4349 13.0074 28.9380 H.t3p 157 HOH1 0.4170 3460 HO797 18.5699 24.3461 7.8365 H.t3p 157 HOH1 0.4170 3461 HO798 18.6959 22.8534 8.2838 H.t3p 157 HOH1 0.4170 3462 HO799 25.7230 47.7303 36.3309 H.t3p 157 HOH1 0.4170 3463 HO800 25.2750 49.0826 35.6869 H.t3p 157 HOH1 0.4170 3464 HO801 53.6038 28.5500 27.1823 H.t3p 157 HOH1 0.4170 3465 HO802 52.4870 28.7532 26.1080 H.t3p 157 HOH1 0.4170 3466 HO803 38.2694 48.2016 39.0847 H.t3p 157 HOH1 0.4170 3467 HO804 39.0717 47.2317 38.1579 H.t3p 157 HOH1 0.4170 3468 HO805 34.8144 13.1947 45.6817 H.t3p 157 HOH1 0.4170 3469 HO806 34.2165 12.1592 44.6746 H.t3p 157 HOH1 0.4170 3470 HO807 47.4817 16.5010 47.6455 H.t3p 157 HOH1 0.4170 3471 HO808 47.0515 17.0716 46.2555 H.t3p 157 HOH1 0.4170 3472 HO809 17.2246 39.2687 5.1149 H.t3p 157 HOH1 0.4170 3473 HO810 16.0808 38.4113 5.7478 H.t3p 157 HOH1 0.4170 3474 HO811 47.4061 35.3677 24.8692 H.t3p 157 HOH1 0.4170 3475 HO812 47.4044 36.9197 25.0557 H.t3p 157 HOH1 0.4170 3476 HO813 30.6354 43.0174 17.8271 H.t3p 157 HOH1 0.4170 3477 HO814 29.5241 43.6719 18.7099 H.t3p 157 HOH1 0.4170 3478 HO815 10.1690 42.1971 22.7230 H.t3p 157 HOH1 0.4170 3479 HO816 8.7010 42.4337 23.2058 H.t3p 157 HOH1 0.4170 3480 HO817 27.3218 11.5939 36.6741 H.t3p 157 HOH1 0.4170 3481 HO818 25.7601 11.6110 36.6042 H.t3p 157 HOH1 0.4170 3482 HO819 44.0294 10.0156 37.0760 H.t3p 157 HOH1 0.4170 3483 HO820 45.3312 9.8612 37.9272 H.t3p 157 HOH1 0.4170 3484 HO821 47.1511 22.8319 39.7165 H.t3p 157 HOH1 0.4170 3485 HO822 47.3674 21.6903 40.7619 H.t3p 157 HOH1 0.4170 3486 HO823 35.0756 25.5760 7.2983 H.t3p 157 HOH1 0.4170 3487 HO824 35.8868 25.2311 6.0074 H.t3p 157 HOH1 0.4170 3488 HO825 32.3198 46.2444 39.9768 H.t3p 157 HOH1 0.4170 3489 HO826 31.9269 47.4302 40.9169 H.t3p 157 HOH1 0.4170 3490 HO827 49.9903 18.3112 29.7562 H.t3p 157 HOH1 0.4170 3491 HO828 51.4178 18.9381 29.8663 H.t3p 157 HOH1 0.4170 3492 HO829 39.4322 16.4990 20.1086 H.t3p 157 HOH1 0.4170 3493 HO830 38.1435 15.8788 19.4781 H.t3p 157 HOH1 0.4170 3494 HO831 34.5745 22.5170 50.5417 H.t3p 157 HOH1 0.4170 3495 HO832 33.9112 21.5774 51.6002 H.t3p 157 HOH1 0.4170 3496 HO833 31.4977 31.8722 53.9822 H.t3p 157 HOH1 0.4170 3497 HO834 31.8333 31.7968 55.5070 H.t3p 157 HOH1 0.4170 3498 HO835 35.2688 32.7338 5.7147 H.t3p 157 HOH1 0.4170 3499 HO836 34.5050 31.3697 5.7097 H.t3p 157 HOH1 0.4170 3500 HO837 9.4841 29.5267 39.1433 H.t3p 157 HOH1 0.4170 3501 HO838 8.3539 28.6126 38.5685 H.t3p 157 HOH1 0.4170 3502 HO839 10.9514 33.0742 11.9076 H.t3p 157 HOH1 0.4170 3503 HO840 11.9106 34.2136 11.4333 H.t3p 157 HOH1 0.4170 3504 HO841 41.9456 43.8613 33.3008 H.t3p 157 HOH1 0.4170 3505 HO842 42.0055 42.8997 34.5317 H.t3p 157 HOH1 0.4170 3506 HO843 15.5612 35.3537 19.0232 H.t3p 157 HOH1 0.4170 3507 HO844 16.9653 35.6620 19.6378 H.t3p 157 HOH1 0.4170 3508 HO845 46.2673 30.5236 44.1052 H.t3p 157 HOH1 0.4170 3509 HO846 44.9109 31.2801 44.2843 H.t3p 157 HOH1 0.4170 3510 HO847 48.1145 33.8773 23.0289 H.t3p 157 HOH1 0.4170 3511 HO848 47.8538 33.0085 24.3018 H.t3p 157 HOH1 0.4170 3512 HO849 28.0365 8.8575 19.6920 H.t3p 157 HOH1 0.4170 3513 HO850 28.2943 8.2772 18.2639 H.t3p 157 HOH1 0.4170 3514 HO851 28.7868 10.5825 18.2704 H.t3p 157 HOH1 0.4170 3515 HO852 28.5764 12.0989 18.5854 H.t3p 157 HOH1 0.4170 3516 HO853 24.2980 49.9922 16.7845 H.t3p 157 HOH1 0.4170 3517 HO854 24.8037 50.9440 17.9164 H.t3p 157 HOH1 0.4170 3518 HO855 47.1276 41.2604 29.8127 H.t3p 157 HOH1 0.4170 3519 HO856 48.4679 41.6110 29.0892 H.t3p 157 HOH1 0.4170 3520 HO857 35.2415 43.2037 37.0858 H.t3p 157 HOH1 0.4170 3521 HO858 36.5663 43.9955 37.3326 H.t3p 157 HOH1 0.4170 3522 HO859 40.1532 17.3938 47.4094 H.t3p 157 HOH1 0.4170 3523 HO860 39.5445 18.6932 48.0300 H.t3p 157 HOH1 0.4170 3524 HO861 47.1226 20.1773 35.1241 H.t3p 157 HOH1 0.4170 3525 HO862 47.3916 18.6376 35.1067 H.t3p 157 HOH1 0.4170 3526 HO863 39.4810 22.4178 11.4358 H.t3p 157 HOH1 0.4170 3527 HO864 39.3912 23.9776 11.3922 H.t3p 157 HOH1 0.4170 3528 HO865 23.4024 41.9864 45.2692 H.t3p 157 HOH1 0.4170 3529 HO866 23.7230 40.5000 45.6311 H.t3p 157 HOH1 0.4170 3530 HO867 10.7440 43.3221 27.5859 H.t3p 157 HOH1 0.4170 3531 HO868 10.7447 44.2038 26.2948 H.t3p 157 HOH1 0.4170 3532 HO869 43.6926 19.2519 22.6365 H.t3p 157 HOH1 0.4170 3533 HO870 42.8815 18.5427 21.5040 H.t3p 157 HOH1 0.4170 3534 HO871 26.3481 48.5714 13.9818 H.t3p 157 HOH1 0.4170 3535 HO872 27.0253 49.5274 12.9470 H.t3p 157 HOH1 0.4170 3536 HO873 17.9036 11.8002 21.2348 H.t3p 157 HOH1 0.4170 3537 HO874 18.6517 10.4398 21.4148 H.t3p 157 HOH1 0.4170 3538 HO875 21.0891 16.8733 38.5737 H.t3p 157 HOH1 0.4170 3539 HO876 22.3176 17.6958 39.0821 H.t3p 157 HOH1 0.4170 3540 HO877 40.5709 22.5260 47.3694 H.t3p 157 HOH1 0.4170 3541 HO878 41.8965 21.7001 47.4379 H.t3p 157 HOH1 0.4170 3542 HO879 23.2280 43.8994 42.9895 H.t3p 157 HOH1 0.4170 3543 HO880 22.3360 44.6639 44.0210 H.t3p 157 HOH1 0.4170 3544 HO881 32.5481 46.4628 37.5049 H.t3p 157 HOH1 0.4170 3545 HO882 31.9715 45.0449 37.8211 H.t3p 157 HOH1 0.4170 3546 HO883 10.6520 13.1858 22.2744 H.t3p 157 HOH1 0.4170 3547 HO884 12.1050 13.7401 22.1181 H.t3p 157 HOH1 0.4170 3548 HO885 33.1861 37.0144 53.3289 H.t3p 157 HOH1 0.4170 3549 HO886 34.3777 36.2267 52.6944 H.t3p 157 HOH1 0.4170 3550 HO887 48.2513 19.6035 33.0888 H.t3p 157 HOH1 0.4170 3551 HO888 49.4969 19.0254 32.3423 H.t3p 157 HOH1 0.4170 3552 HO889 13.0333 21.8534 32.1382 H.t3p 157 HOH1 0.4170 3553 HO890 14.2214 21.3721 31.2440 H.t3p 157 HOH1 0.4170 3554 HO891 15.9656 30.4222 45.9255 H.t3p 157 HOH1 0.4170 3555 HO892 15.0254 29.3035 45.3708 H.t3p 157 HOH1 0.4170 3556 HO893 40.0377 42.2049 29.7934 H.t3p 157 HOH1 0.4170 3557 HO894 40.2362 40.7189 29.3512 H.t3p 157 HOH1 0.4170 3558 HO895 43.1797 39.7875 21.0715 H.t3p 157 HOH1 0.4170 3559 HO896 41.8934 40.6089 21.4102 H.t3p 157 HOH1 0.4170 3560 HO897 35.9413 19.5580 17.9380 H.t3p 157 HOH1 0.4170 3561 HO898 36.3573 18.3480 18.8357 H.t3p 157 HOH1 0.4170 3562 HO899 13.8980 30.4932 15.3999 H.t3p 157 HOH1 0.4170 3563 HO900 14.0956 31.6785 14.4003 H.t3p 157 HOH1 0.4170 3564 HO901 26.7621 50.7349 25.0075 H.t3p 157 HOH1 0.4170 3565 HO902 26.9093 50.1137 23.5809 H.t3p 157 HOH1 0.4170 3566 HO903 18.6754 17.1641 37.2576 H.t3p 157 HOH1 0.4170 3567 HO904 19.0563 18.1250 36.0847 H.t3p 157 HOH1 0.4170 3568 HO905 33.1071 37.3789 50.8005 H.t3p 157 HOH1 0.4170 3569 HO906 32.3886 37.2645 49.4172 H.t3p 157 HOH1 0.4170 3570 HO907 44.2488 40.8070 14.0565 H.t3p 157 HOH1 0.4170 3571 HO908 44.8643 39.7396 15.0180 H.t3p 157 HOH1 0.4170 3572 HO909 14.8236 28.4442 15.7122 H.t3p 157 HOH1 0.4170 3573 HO910 14.1889 28.9573 17.0453 H.t3p 157 HOH1 0.4170 3574 HO911 40.5992 23.7096 16.9985 H.t3p 157 HOH1 0.4170 3575 HO912 41.4454 24.6525 17.9137 H.t3p 157 HOH1 0.4170 3576 HO913 35.8783 43.8687 18.8528 H.t3p 157 HOH1 0.4170 3577 HO914 37.4308 43.6877 18.8418 H.t3p 157 HOH1 0.4170 3578 HO915 43.9401 15.4089 45.2206 H.t3p 157 HOH1 0.4170 3579 HO916 43.9727 15.7214 43.6891 H.t3p 157 HOH1 0.4170 3580 HO917 48.0530 34.1738 33.7233 H.t3p 157 HOH1 0.4170 3581 HO918 48.6571 35.6102 33.8450 H.t3p 157 HOH1 0.4170 3582 HO919 20.7315 47.1602 25.0172 H.t3p 157 HOH1 0.4170 3583 HO920 19.4147 47.6455 25.7061 H.t3p 157 HOH1 0.4170 3584 HO921 29.2484 44.8360 33.3803 H.t3p 157 HOH1 0.4170 3585 HO922 27.6964 44.6861 33.2675 H.t3p 157 HOH1 0.4170 3586 HO923 11.9069 28.4022 21.4994 H.t3p 157 HOH1 0.4170 3587 HO924 11.3993 27.2954 22.4793 H.t3p 157 HOH1 0.4170 3588 HO925 7.4459 16.8777 27.2616 H.t3p 157 HOH1 0.4170 3589 HO926 6.3565 15.9960 26.5696 H.t3p 157 HOH1 0.4170 3590 HO927 12.4168 21.3469 36.7930 H.t3p 157 HOH1 0.4170 3591 HO928 11.8562 21.3790 35.3344 H.t3p 157 HOH1 0.4170 3592 HO929 30.0040 8.8170 24.9222 H.t3p 157 HOH1 0.4170 3593 HO930 31.0309 9.7719 25.6136 H.t3p 157 HOH1 0.4170 3594 HO931 35.3477 42.9836 32.8302 H.t3p 157 HOH1 0.4170 3595 HO932 35.1535 42.8177 31.2881 H.t3p 157 HOH1 0.4170 3596 HO933 21.5101 50.3142 33.4047 H.t3p 157 HOH1 0.4170 3597 HO934 20.0652 50.7257 33.8371 H.t3p 157 HOH1 0.4170 3598 HO935 48.2449 13.6768 42.0551 H.t3p 157 HOH1 0.4170 3599 HO936 48.2102 14.3168 43.4811 H.t3p 157 HOH1 0.4170 3600 HO937 40.7600 26.8981 46.4233 H.t3p 157 HOH1 0.4170 3601 HO938 41.4920 26.1916 47.6103 H.t3p 157 HOH1 0.4170 3602 HO939 4.4407 34.4860 32.6914 H.t3p 157 HOH1 0.4170 3603 HO940 3.0531 33.9626 33.1853 H.t3p 157 HOH1 0.4170 3604 HO941 41.0347 24.0157 13.8816 H.t3p 157 HOH1 0.4170 3605 HO942 41.9823 25.2226 13.5822 H.t3p 157 HOH1 0.4170 3606 HO943 22.2667 48.3813 14.0252 H.t3p 157 HOH1 0.4170 3607 HO944 22.1970 48.3963 12.4634 H.t3p 157 HOH1 0.4170 3608 HO945 9.9157 43.0026 30.9108 H.t3p 157 HOH1 0.4170 3609 HO946 9.2582 43.6408 32.1776 H.t3p 157 HOH1 0.4170 3610 HO947 8.7878 22.4757 38.1635 H.t3p 157 HOH1 0.4170 3611 HO948 10.1677 22.8110 37.5105 H.t3p 157 HOH1 0.4170 3612 HO949 39.2794 42.8223 9.3574 H.t3p 157 HOH1 0.4170 3613 HO950 39.0145 41.9742 10.6433 H.t3p 157 HOH1 0.4170 3614 HO951 19.7531 13.8872 14.9515 H.t3p 157 HOH1 0.4170 3615 HO952 20.8651 12.8068 14.7536 H.t3p 157 HOH1 0.4170 3616 HO953 27.4723 11.3339 39.4538 H.t3p 157 HOH1 0.4170 3617 HO954 27.4799 11.2068 41.0119 H.t3p 157 HOH1 0.4170 3618 HO955 14.2457 24.3501 30.5945 H.t3p 157 HOH1 0.4170 3619 HO956 13.0867 23.7635 29.7251 H.t3p 157 HOH1 0.4170 3620 HO957 10.6167 29.9698 19.5571 H.t3p 157 HOH1 0.4170 3621 HO958 12.1564 30.1569 19.7508 H.t3p 157 HOH1 0.4170 3622 HO959 20.5809 51.9961 31.2835 H.t3p 157 HOH1 0.4170 3623 HO960 20.7776 53.5301 31.5118 H.t3p 157 HOH1 0.4170 3624 HO961 40.6894 48.2920 39.7659 H.t3p 157 HOH1 0.4170 3625 HO962 41.6297 49.5411 39.7621 H.t3p 157 HOH1 0.4170 3626 HO963 43.1695 11.8358 28.5598 H.t3p 157 HOH1 0.4170 3627 HO964 42.3718 13.0499 29.1368 H.t3p 157 HOH1 0.4170 3628 HO965 47.0755 40.2671 27.5448 H.t3p 157 HOH1 0.4170 3629 HO966 47.3024 39.3075 26.3317 H.t3p 157 HOH1 0.4170 3630 HO967 21.2024 44.6396 37.3719 H.t3p 157 HOH1 0.4170 3631 HO968 19.8801 44.1867 36.6714 H.t3p 157 HOH1 0.4170 3632 HO969 12.7828 26.1906 25.5678 H.t3p 157 HOH1 0.4170 3633 HO970 11.2971 26.3570 25.1120 H.t3p 157 HOH1 0.4170 3634 HO971 48.5997 17.5306 22.9025 H.t3p 157 HOH1 0.4170 3635 HO972 47.3203 16.6702 23.1599 H.t3p 157 HOH1 0.4170 3636 HO973 49.9886 31.5237 38.3622 H.t3p 157 HOH1 0.4170 3637 HO974 50.6678 30.8795 39.6139 H.t3p 157 HOH1 0.4170 3638 HO975 20.5463 42.6295 18.0648 H.t3p 157 HOH1 0.4170 3639 HO976 19.3759 42.7837 19.0898 H.t3p 157 HOH1 0.4170 3640 HO977 34.8965 18.3789 15.2976 H.t3p 157 HOH1 0.4170 3641 HO978 35.5826 19.1777 14.1424 H.t3p 157 HOH1 0.4170 3642 HO979 5.9922 19.6982 26.8322 H.t3p 157 HOH1 0.4170 3643 HO980 7.2420 20.6295 26.7134 H.t3p 157 HOH1 0.4170 3644 HO981 33.6143 33.4002 55.0170 H.t3p 157 HOH1 0.4170 3645 HO982 34.9695 33.4124 55.7965 H.t3p 157 HOH1 0.4170 3646 HO983 27.2054 34.3294 57.5645 H.t3p 157 HOH1 0.4170 3647 HO984 28.2149 33.3906 56.8278 H.t3p 157 HOH1 0.4170 3648 HO985 44.3615 38.7573 22.6163 H.t3p 157 HOH1 0.4170 3649 HO986 45.1557 38.8405 21.2728 H.t3p 157 HOH1 0.4170 3650 HO987 50.6544 25.3897 22.8458 H.t3p 157 HOH1 0.4170 3651 HO988 50.2231 25.2672 21.3481 H.t3p 157 HOH1 0.4170 3652 HO989 15.6877 42.9763 30.3197 H.t3p 157 HOH1 0.4170 3653 HO990 16.3986 42.0485 29.2819 H.t3p 157 HOH1 0.4170 3654 HO991 47.8246 22.7247 36.4835 H.t3p 157 HOH1 0.4170 3655 HO992 47.2258 22.7323 35.0397 H.t3p 157 HOH1 0.4170 3656 HO993 44.8617 45.8970 39.5060 H.t3p 157 HOH1 0.4170 3657 HO994 44.2572 44.4851 39.2157 H.t3p 157 HOH1 0.4170 3658 HO995 50.8046 33.8600 33.8195 H.t3p 157 HOH1 0.4170 3659 HO996 52.3248 33.9299 33.4613 H.t3p 157 HOH1 0.4170 3660 HO997 35.9891 12.4770 36.8078 H.t3p 157 HOH1 0.4170 3661 HO998 37.4546 12.0618 37.1583 H.t3p 157 HOH1 0.4170 3662 HO999 24.7577 11.5292 28.6852 H.t3p 157 HOH1 0.4170 3663 HO1000 24.3033 11.9333 30.1255 H.t3p 157 HOH1 0.4170 3664 HO1001 41.1630 43.6184 16.4128 H.t3p 157 HOH1 0.4170 3665 HO1002 40.6909 43.1146 15.0106 H.t3p 157 HOH1 0.4170 3666 HO1003 16.8954 43.6070 22.1931 H.t3p 157 HOH1 0.4170 3667 HO1004 17.0091 43.2106 23.7008 H.t3p 157 HOH1 0.4170 3668 HO1005 36.1146 44.7565 43.8695 H.t3p 157 HOH1 0.4170 3669 HO1006 37.0354 45.7495 43.0889 H.t3p 157 HOH1 0.4170 3670 HO1007 40.1253 36.9872 9.6612 H.t3p 157 HOH1 0.4170 3671 HO1008 39.8335 38.0501 8.5525 H.t3p 157 HOH1 0.4170 3672 HO1009 33.1350 23.4432 51.8427 H.t3p 157 HOH1 0.4170 3673 HO1010 31.6912 22.9528 51.4988 H.t3p 157 HOH1 0.4170 3674 HO1011 10.6119 26.5417 37.5652 H.t3p 157 HOH1 0.4170 3675 HO1012 9.4868 25.4633 37.4449 H.t3p 157 HOH1 0.4170 3676 HO1013 43.5204 10.6116 34.2956 H.t3p 157 HOH1 0.4170 3677 HO1014 44.6866 11.4228 33.6428 H.t3p 157 HOH1 0.4170 3678 HO1015 44.1329 32.7751 11.7169 H.t3p 157 HOH1 0.4170 3679 HO1016 45.1417 33.4929 12.6714 H.t3p 157 HOH1 0.4170 3680 HO1017 10.7654 42.1270 20.6216 H.t3p 157 HOH1 0.4170 3681 HO1018 11.1395 40.7977 21.3538 H.t3p 157 HOH1 0.4170 3682 HO1019 27.5191 40.4293 12.9171 H.t3p 157 HOH1 0.4170 3683 HO1020 26.2924 40.2925 13.8759 H.t3p 157 HOH1 0.4170 3684 HO1021 40.8540 43.2163 20.4989 H.t3p 157 HOH1 0.4170 3685 HO1022 39.8280 44.2683 19.9667 H.t3p 157 HOH1 0.4170 3686 HG1 23.8414 34.0043 40.0347 H 42 THR42 0.4055 3687 HG1 22.8723 47.0074 32.7733 H 75 THR75 0.4055 3688 HD11 28.2597 25.5293 25.0165 H 107 LEU107 0.0224 3689 HD12 26.5716 24.9665 24.9794 H 107 LEU107 0.0224 3690 HD13 26.9674 26.5462 25.6979 H 107 LEU107 0.0224 3691 HO1023 35.4173 39.5295 10.7309 H.t3p 157 HOH1 0.4170 3692 HO1024 35.2356 40.8937 11.4720 H.t3p 157 HOH1 0.4170 3693 HD11 21.4072 33.3331 31.9909 H 94 LEU94 0.0224 3694 HD12 20.0137 33.7891 30.9820 H 94 LEU94 0.0224 3695 HD13 19.9414 32.3232 31.9891 H 94 LEU94 0.0224 3696 HO1025 32.3745 9.0725 35.6850 H.t3p 157 HOH1 0.4170 3697 HO1026 31.1134 9.9791 35.5107 H.t3p 157 HOH1 0.4170 3698 HD21 19.5691 40.8681 35.2626 H 97 LEU97 0.0224 3699 HD22 18.8666 39.5892 34.2435 H 97 LEU97 0.0224 3700 HD23 19.6769 39.1656 35.7707 H 97 LEU97 0.0224 3701 HD21 30.6466 25.7732 23.0368 H 143 LEU143 0.0224 3702 HD22 32.0663 26.6613 22.4340 H 143 LEU143 0.0224 3703 HD23 32.0739 25.9827 24.0795 H 143 LEU143 0.0224 3704 HO1027 16.7805 20.4051 18.9100 H.t3p 157 HOH1 0.4170 3705 HO1028 18.2841 20.7634 18.6757 H.t3p 157 HOH1 0.4170 3706 HB1 29.2400 38.6202 34.4330 H 40 ALA40 0.0774 3707 HB2 30.2159 38.4018 32.9607 H 40 ALA40 0.0774 3708 HB3 28.5446 37.7923 33.0190 H 40 ALA40 0.0774 3709 HO1029 28.6032 47.1398 18.8938 H.t3p 157 HOH1 0.4170 3710 HO1030 29.4865 46.3599 19.9206 H.t3p 157 HOH1 0.4170 3711 HG21 26.7015 35.2824 20.7023 H 4 VAL4 -0.0090 3712 HG22 27.2387 33.5876 20.6201 H 4 VAL4 -0.0090 3713 HG23 25.6621 33.9873 21.3430 H 4 VAL4 -0.0090 3714 HO1031 24.7266 9.4516 17.4590 H.t3p 157 HOH1 0.4170 3715 HO1032 24.3233 8.2121 18.3214 H.t3p 157 HOH1 0.4170 3716 HB1 21.9848 27.5228 32.7265 H 85 ALA85 0.0774 3717 HB2 21.5299 27.3762 31.0121 H 85 ALA85 0.0774 3718 HB3 21.2920 28.9191 31.8672 H 85 ALA85 0.0774 3719 HO1033 12.7410 36.0529 21.1946 H.t3p 157 HOH1 0.4170 3720 HO1034 11.5023 36.7166 20.5100 H.t3p 157 HOH1 0.4170 3721 HO1035 2.7100 33.7422 29.3377 H.t3p 157 HOH1 0.4170 3722 HO1036 2.3660 33.3227 30.8040 H.t3p 157 HOH1 0.4170 3723 HO1037 9.4140 11.9488 28.3804 H.t3p 157 HOH1 0.4170 3724 HO1038 10.5663 10.9008 28.5147 H.t3p 157 HOH1 0.4170 3725 HO1039 25.8331 39.3999 54.1534 H.t3p 157 HOH1 0.4170 3726 HO1040 26.6860 38.1995 54.6774 H.t3p 157 HOH1 0.4170 3727 HD11 29.5362 34.9085 11.8065 H 154 LEU154 0.0224 3728 HD12 29.1224 34.9436 10.0759 H 154 LEU154 0.0224 3729 HD13 28.7578 33.4984 11.0489 H 154 LEU154 0.0224 3730 HG21 10.4485 18.1262 24.7990 H 116 THR116 0.0600 3731 HG22 11.8272 19.2399 24.6357 H 116 THR116 0.0600 3732 HG23 11.4835 18.4734 26.2049 H 116 THR116 0.0600 3733 HG1 12.7799 16.2194 23.0826 H 116 THR116 0.4055 3734 HO1041 13.4804 15.8706 18.8913 H.t3p 157 HOH1 0.4170 3735 HO1042 12.8848 14.8133 19.8770 H.t3p 157 HOH1 0.4170 3736 HO1043 29.2971 12.8604 33.7562 H.t3p 157 HOH1 0.4170 3737 HO1044 28.6883 11.6627 34.5549 H.t3p 157 HOH1 0.4170 3738 HO1045 8.1507 29.8509 41.9074 H.t3p 157 HOH1 0.4170 3739 HO1046 9.1849 29.6285 43.0579 H.t3p 157 HOH1 0.4170 3740 HG21 25.3702 37.2355 28.9984 H 5 THR5 0.0600 3741 HG22 25.5941 35.4916 29.2749 H 5 THR5 0.0600 3742 HG23 24.9012 36.0675 27.7398 H 5 THR5 0.0600 3743 HG21 33.7269 19.6757 34.7817 H 135 VAL135 -0.0090 3744 HG22 33.7168 21.4406 35.0112 H 135 VAL135 -0.0090 3745 HG23 32.4236 20.6580 34.0712 H 135 VAL135 -0.0090 3746 HG11 23.3198 37.9958 33.6487 H 73 VAL73 -0.0090 3747 HG12 23.0271 39.5122 34.5333 H 73 VAL73 -0.0090 3748 HG13 24.0467 39.5157 33.0743 H 73 VAL73 -0.0090 3749 HO1047 7.7734 27.5229 25.8132 H.t3p 157 HOH1 0.4170 3750 HO1048 7.5097 26.4923 26.9589 H.t3p 157 HOH1 0.4170 3751 HO1049 42.8960 27.1159 10.7684 H.t3p 157 HOH1 0.4170 3752 HO1050 43.8198 25.8622 10.6350 H.t3p 157 HOH1 0.4170 3753 HB1 21.9265 32.7634 6.5985 H 155 ALA155 0.0774 3754 HB2 20.8082 32.8682 7.9790 H 155 ALA155 0.0774 3755 HB3 22.4747 32.2937 8.2255 H 155 ALA155 0.0774 3756 HG1 47.0050 31.0896 30.0673 H 66 THR66 0.4055 3757 HO1051 36.4737 13.3058 19.3296 H.t3p 157 HOH1 0.4170 3758 HO1052 36.4003 14.2842 20.5463 H.t3p 157 HOH1 0.4170 3759 HO1053 36.7653 42.7411 46.2427 H.t3p 157 HOH1 0.4170 3760 HO1054 37.2582 41.7341 45.1537 H.t3p 157 HOH1 0.4170 3761 HO1055 48.4982 37.4434 31.3346 H.t3p 157 HOH1 0.4170 3762 HO1056 50.0184 37.3977 31.6951 H.t3p 157 HOH1 0.4170 3763 HG21 31.7677 16.3396 30.5816 H 138 VAL138 -0.0090 3764 HG22 30.2315 15.7739 29.8834 H 138 VAL138 -0.0090 3765 HG23 30.2213 16.8804 31.2776 H 138 VAL138 -0.0090 3766 HO1057 8.8963 29.2628 34.8318 H.t3p 157 HOH1 0.4170 3767 HO1058 8.8542 29.9477 36.2363 H.t3p 157 HOH1 0.4170 3768 HG21 22.6771 48.8530 29.8471 H 75 THR75 0.0600 3769 HG22 23.3701 47.6072 28.7815 H 75 THR75 0.0600 3770 HG23 21.7439 47.3849 29.4702 H 75 THR75 0.0600 3771 HD21 28.6702 28.4027 30.4571 H 86 LEU86 0.0224 3772 HD22 27.3684 28.7131 31.6305 H 86 LEU86 0.0224 3773 HD23 27.1286 27.5220 30.3297 H 86 LEU86 0.0224 3774 HO1059 31.5812 34.3532 6.4658 H.t3p 157 HOH1 0.4170 3775 HO1060 31.7462 33.6007 7.8257 H.t3p 157 HOH1 0.4170 3776 HO1061 18.1580 45.7488 29.1318 H.t3p 157 HOH1 0.4170 3777 HO1062 18.0790 46.6854 27.8830 H.t3p 157 HOH1 0.4170 3778 HO1063 48.5198 19.4338 38.1538 H.t3p 157 HOH1 0.4170 3779 HO1064 49.6128 18.5877 38.8833 H.t3p 157 HOH1 0.4170 3780 HD21 16.9506 32.6741 40.0979 H 93 LEU93 0.0224 3781 HD22 17.8734 31.8289 41.3634 H 93 LEU93 0.0224 3782 HD23 18.2345 33.5302 40.9849 H 93 LEU93 0.0224 3783 HG21 33.1398 24.5502 26.7956 H 139 ILE139 0.0302 3784 HG22 33.7791 23.3860 25.6109 H 139 ILE139 0.0302 3785 HG23 32.0316 23.7172 25.6792 H 139 ILE139 0.0302 3786 HO1065 29.2056 21.3413 46.1040 H.t3p 157 HOH1 0.4170 3787 HO1066 29.5748 22.8312 45.8086 H.t3p 157 HOH1 0.4170 3788 HG21 24.5589 33.4383 30.3635 H 7 VAL7 -0.0090 3789 HG22 24.8755 34.8882 31.3460 H 7 VAL7 -0.0090 3790 HG23 23.2112 34.2849 31.1604 H 7 VAL7 -0.0090 3791 HD11 21.0380 31.6496 39.3923 H 93 LEU93 0.0224 3792 HD12 20.6652 32.9240 40.5775 H 93 LEU93 0.0224 3793 HD13 20.3042 31.2228 40.9569 H 93 LEU93 0.0224 3794 HG11 27.9711 29.8560 15.7930 H 150 VAL150 -0.0090 3795 HG12 28.9501 31.0776 16.6398 H 150 VAL150 -0.0090 3796 HG13 28.2837 31.4324 15.0278 H 150 VAL150 -0.0090 3797 HD11 32.2404 24.0163 30.3108 H 139 ILE139 0.0238 3798 HD12 33.7027 23.1787 29.7383 H 139 ILE139 0.0238 3799 HD13 33.0961 24.6068 28.8660 H 139 ILE139 0.0238 3800 HO1067 32.6769 41.7452 19.3563 H.t3p 157 HOH1 0.4170 3801 HO1068 34.0646 42.2700 19.8495 H.t3p 157 HOH1 0.4170 3802 HO1069 38.5553 25.7917 49.4599 H.t3p 157 HOH1 0.4170 3803 HO1070 39.0295 24.3048 49.5453 H.t3p 157 HOH1 0.4170 3804 HO1071 8.4250 39.3266 24.0073 H.t3p 157 HOH1 0.4170 3805 HO1072 7.1322 38.4745 23.7937 H.t3p 157 HOH1 0.4170 3806 HD11 22.0846 14.2086 28.2828 H 119 LEU119 0.0224 3807 HD12 22.6744 15.8240 27.8240 H 119 LEU119 0.0224 3808 HD13 23.5374 14.8800 29.0619 H 119 LEU119 0.0224 3809 HD21 29.5055 25.6551 27.0210 H 107 LEU107 0.0224 3810 HD22 28.4033 26.2522 28.2844 H 107 LEU107 0.0224 3811 HD23 29.0534 24.5980 28.3798 H 107 LEU107 0.0224 3812 HG11 32.8874 34.0754 25.0295 H 37 VAL37 -0.0090 3813 HG12 33.1134 32.9900 23.6371 H 37 VAL37 -0.0090 3814 HG13 31.4762 33.5097 24.1038 H 37 VAL37 -0.0090 3815 HG11 24.1171 33.3457 34.6277 H 7 VAL7 -0.0090 3816 HG12 22.9539 34.2378 33.6185 H 7 VAL7 -0.0090 3817 HG13 24.6178 34.8420 33.8040 H 7 VAL7 -0.0090 3818 HB1 18.2705 27.4336 33.8415 H 91 ALA91 0.0774 3819 HB2 17.1329 28.0154 32.6025 H 91 ALA91 0.0774 3820 HB3 18.8632 27.8547 32.2168 H 91 ALA91 0.0774 3821 HG1 25.6763 29.3394 41.5486 H 9 THR9 0.4055 3822 HO1073 42.6974 11.4786 44.8276 H.t3p 157 HOH1 0.4170 3823 HO1074 41.5815 11.5672 43.7363 H.t3p 157 HOH1 0.4170 3824 HO1075 23.4821 14.8267 42.5178 H.t3p 157 HOH1 0.4170 3825 HO1076 23.6125 13.5385 41.6424 H.t3p 157 HOH1 0.4170 3826 HB1 39.5232 29.9526 35.3652 H 51 ALA51 0.0774 3827 HB2 39.0758 31.5926 34.8379 H 51 ALA51 0.0774 3828 HB3 40.7905 31.1233 34.9270 H 51 ALA51 0.0774 3829 HD11 36.1125 28.8518 42.0840 H 12 ILE12 0.0238 3830 HD12 36.9712 30.4105 42.0533 H 12 ILE12 0.0238 3831 HD13 37.5018 29.0812 40.9951 H 12 ILE12 0.0238 3832 HO1077 36.9041 38.4722 47.8008 H.t3p 157 HOH1 0.4170 3833 HO1078 37.9614 39.5451 47.3826 H.t3p 157 HOH1 0.4170 3834 HD21 20.9952 39.3568 32.2736 H 78 LEU78 0.0224 3835 HD22 19.7146 39.9212 31.1740 H 78 LEU78 0.0224 3836 HD23 21.2313 39.2662 30.5117 H 78 LEU78 0.0224 3837 HD21 32.6559 30.0652 15.6286 H 26 LEU26 0.0224 3838 HD22 31.1338 30.4742 16.4556 H 26 LEU26 0.0224 3839 HD23 31.8763 31.6376 15.3315 H 26 LEU26 0.0224 3840 HG21 26.7895 30.5528 43.1656 H 9 THR9 0.0600 3841 HG22 27.7593 31.9394 42.6138 H 9 THR9 0.0600 3842 HG23 25.9826 32.0462 42.6297 H 9 THR9 0.0600 3843 HD21 39.0539 26.6648 28.4744 H 59 LEU59 0.0224 3844 HD22 40.3633 25.6141 27.8836 H 59 LEU59 0.0224 3845 HD23 40.4721 27.3777 27.6690 H 59 LEU59 0.0224 3846 HD11 22.5513 36.5336 29.3747 H 83 LEU83 0.0224 3847 HD12 22.5514 36.5773 27.5955 H 83 LEU83 0.0224 3848 HD13 21.5634 37.7385 28.5140 H 83 LEU83 0.0224 3849 HO1079 55.7549 27.7244 30.5273 H.t3p 157 HOH1 0.4170 3850 HO1080 55.4617 27.2827 29.0565 H.t3p 157 HOH1 0.4170 3851 HO1081 29.7523 49.7000 16.0706 H.t3p 157 HOH1 0.4170 3852 HO1082 28.7170 50.2596 15.0414 H.t3p 157 HOH1 0.4170 3853 HO1083 27.7510 30.4610 54.2682 H.t3p 157 HOH1 0.4170 3854 HO1084 27.0983 31.5781 53.3907 H.t3p 157 HOH1 0.4170 3855 HG21 17.1564 38.0413 31.8989 H 99 VAL99 -0.0090 3856 HG22 17.4957 38.3557 30.1803 H 99 VAL99 -0.0090 3857 HG23 18.2373 36.9561 30.9922 H 99 VAL99 -0.0090 3858 HG11 17.8806 28.8758 29.6207 H 104 VAL104 -0.0090 3859 HG12 16.9791 29.6454 30.9484 H 104 VAL104 -0.0090 3860 HG13 18.5891 30.2546 30.4954 H 104 VAL104 -0.0090 3861 HD21 21.2711 35.7399 33.0029 H 94 LEU94 0.0224 3862 HD22 19.7272 36.2834 33.7020 H 94 LEU94 0.0224 3863 HD23 19.8689 36.0308 31.9458 H 94 LEU94 0.0224 3864 HD11 29.3724 24.9436 31.8283 H 86 LEU86 0.0224 3865 HD12 29.6841 26.0022 30.4319 H 86 LEU86 0.0224 3866 HD13 28.1068 25.1951 30.6023 H 86 LEU86 0.0224 3867 HO1085 25.4634 48.7580 20.9064 H.t3p 157 HOH1 0.4170 3868 HO1086 26.9948 49.0549 20.8021 H.t3p 157 HOH1 0.4170 3869 HB1 18.6547 20.9185 29.9939 H 118 ALA118 0.0774 3870 HB2 17.0504 20.8241 29.2291 H 118 ALA118 0.0774 3871 HB3 17.2413 20.4127 30.9503 H 118 ALA118 0.0774 3872 HB1 47.0811 20.1900 28.3835 H 61 ALA61 0.0774 3873 HB2 45.6964 21.2254 28.8061 H 61 ALA61 0.0774 3874 HB3 47.1332 21.1886 29.8561 H 61 ALA61 0.0774 3875 HB1 39.0839 27.0531 34.2570 H 55 ALA55 0.0774 3876 HB2 38.7880 26.1007 35.7311 H 55 ALA55 0.0774 3877 HB3 40.0910 27.3129 35.7014 H 55 ALA55 0.0774 3878 HD11 34.3901 23.9009 22.2475 H 143 LEU143 0.0224 3879 HD12 34.0998 25.6398 22.0034 H 143 LEU143 0.0224 3880 HD13 34.1074 24.9613 23.6489 H 143 LEU143 0.0224 3881 HD21 33.2048 35.3820 10.3401 H 31 LEU31 0.0224 3882 HD22 31.7202 34.4900 9.9301 H 31 LEU31 0.0224 3883 HD23 31.7777 35.4954 11.3978 H 31 LEU31 0.0224 3884 HE1 17.3635 23.8897 32.1333 H 106 MET106 0.1284 3885 HE2 18.4647 25.1692 32.6973 H 106 MET106 0.1284 3886 HE3 16.8016 25.5769 32.2114 H 106 MET106 0.1284 3887 HB1 31.1028 27.9631 27.5850 H 18 ALA18 0.0774 3888 HB2 31.9193 28.5956 29.0345 H 18 ALA18 0.0774 3889 HB3 31.6034 26.8506 28.8812 H 18 ALA18 0.0774 3890 HG21 27.8731 33.1680 17.4848 H 150 VAL150 -0.0090 3891 HG22 27.0504 33.5293 15.9484 H 150 VAL150 -0.0090 3892 HG23 26.1086 33.3997 17.4532 H 150 VAL150 -0.0090 3893 HG21 22.7806 35.9218 36.7165 H 42 THR42 0.0600 3894 HG22 22.0851 34.3746 37.2553 H 42 THR42 0.0600 3895 HG23 23.7921 34.4577 36.7577 H 42 THR42 0.0600 3896 HO1087 42.2751 41.4812 12.3213 H.t3p 157 HOH1 0.4170 3897 HO1088 42.7523 42.4852 13.4201 H.t3p 157 HOH1 0.4170 3898 HO1089 44.1200 23.8757 15.5992 H.t3p 157 HOH1 0.4170 3899 HO1090 43.1808 23.2949 16.7053 H.t3p 157 HOH1 0.4170 3900 HD21 28.0845 29.3590 22.8769 H 146 LEU146 0.0224 3901 HD22 29.3235 28.3950 22.0383 H 146 LEU146 0.0224 3902 HD23 28.1627 27.5985 23.1275 H 146 LEU146 0.0224 3903 HG21 25.0851 36.5622 34.4841 H 73 VAL73 -0.0090 3904 HG22 26.5108 37.2332 35.3116 H 73 VAL73 -0.0090 3905 HG23 26.2839 37.5060 33.5674 H 73 VAL73 -0.0090 3906 HO1091 53.7232 30.5941 32.0446 H.t3p 157 HOH1 0.4170 3907 HO1092 52.9793 31.6715 31.1902 H.t3p 157 HOH1 0.4170 3908 HD11 31.4629 32.2130 10.5959 H 31 LEU31 0.0224 3909 HD12 30.8679 32.8665 12.1407 H 31 LEU31 0.0224 3910 HD13 32.1058 31.5875 12.1333 H 31 LEU31 0.0224 3911 HO1093 40.6523 11.1752 34.2835 H.t3p 157 HOH1 0.4170 3912 HO1094 40.8802 9.9467 33.3443 H.t3p 157 HOH1 0.4170 3913 HG21 25.0002 31.3003 25.5617 H 84 VAL84 -0.0090 3914 HG22 24.3186 29.6782 25.2936 H 84 VAL84 -0.0090 3915 HG23 26.0774 29.9324 25.1919 H 84 VAL84 -0.0090 3916 HO1095 21.3742 42.8699 8.4202 H.t3p 157 HOH1 0.4170 3917 HO1096 21.7319 43.7340 9.6725 H.t3p 157 HOH1 0.4170 3918 HD11 18.4643 41.4466 37.5422 H 97 LEU97 0.0224 3919 HD12 16.9830 40.5878 38.0278 H 97 LEU97 0.0224 3920 HD13 18.5468 39.7376 38.0331 H 97 LEU97 0.0224 3921 HO1097 36.9714 24.5224 14.3063 H.t3p 157 HOH1 0.4170 3922 HO1098 38.4372 25.0072 14.5498 H.t3p 157 HOH1 0.4170 3923 HG21 26.5279 22.0802 30.6950 H 121 VAL121 -0.0090 3924 HG22 28.0900 22.6933 30.1020 H 121 VAL121 -0.0090 3925 HG23 27.7935 20.9399 30.1789 H 121 VAL121 -0.0090 3926 HD11 31.1027 32.2183 18.2110 H 26 LEU26 0.0224 3927 HD12 32.6186 33.0086 18.7062 H 26 LEU26 0.0224 3928 HD13 31.8907 33.3899 17.1272 H 26 LEU26 0.0224 3929 HB1 22.7616 44.1129 23.8940 H 79 ALA79 0.0774 3930 HB2 23.8974 43.7018 25.2011 H 79 ALA79 0.0774 3931 HB3 22.4699 44.7074 25.5461 H 79 ALA79 0.0774 3932 HO1099 38.6179 29.3042 49.9136 H.t3p 157 HOH1 0.4170 3933 HO1100 37.7818 28.1031 49.3647 H.t3p 157 HOH1 0.4170 3934 HO1101 45.7417 31.7952 14.3027 H.t3p 157 HOH1 0.4170 3935 HO1102 45.9745 30.5331 15.1955 H.t3p 157 HOH1 0.4170 3936 HO1103 39.7886 45.3651 34.2370 H.t3p 157 HOH1 0.4170 3937 HO1104 41.0199 45.5652 35.1787 H.t3p 157 HOH1 0.4170 3938 HG21 42.7347 20.9951 33.8089 H 58 VAL58 -0.0090 3939 HG22 42.7654 19.6348 32.6616 H 58 VAL58 -0.0090 3940 HG23 41.2172 20.1906 33.3416 H 58 VAL58 -0.0090 3941 HG11 27.8138 33.1890 24.2854 H 4 VAL4 -0.0090 3942 HG12 27.8871 32.3766 22.7035 H 4 VAL4 -0.0090 3943 HG13 26.3104 32.7763 23.4264 H 4 VAL4 -0.0090 3944 HD11 20.3091 31.9491 23.9327 H 82 LEU82 0.0224 3945 HD12 20.8167 31.3766 22.3257 H 82 LEU82 0.0224 3946 HD13 20.8948 30.2810 23.7263 H 82 LEU82 0.0224 3947 HO1105 47.9988 14.7614 35.2265 H.t3p 157 HOH1 0.4170 3948 HO1106 46.4722 15.0142 35.0034 H.t3p 157 HOH1 0.4170 3949 HO1107 28.7541 33.9456 5.2301 H.t3p 157 HOH1 0.4170 3950 HO1108 28.5419 35.3104 4.4984 H.t3p 157 HOH1 0.4170 3951 HO1109 17.7684 44.4739 8.3211 H.t3p 157 HOH1 0.4170 3952 HO1110 17.4662 43.2285 7.4263 H.t3p 157 HOH1 0.4170 3953 HG21 36.8655 33.1428 39.5169 H 12 ILE12 0.0302 3954 HG22 35.2895 32.6830 40.2045 H 12 ILE12 0.0302 3955 HG23 36.7850 32.3658 41.1163 H 12 ILE12 0.0302 3956 HO1111 21.8263 19.8656 10.5499 H.t3p 157 HOH1 0.4170 3957 HO1112 21.5740 21.0952 9.6180 H.t3p 157 HOH1 0.4170 3958 HD11 21.1002 41.6439 33.3815 H 78 LEU78 0.0224 3959 HD12 21.3483 43.0834 32.3647 H 78 LEU78 0.0224 3960 HD13 19.7980 42.2107 32.3086 H 78 LEU78 0.0224 3961 HB1 24.1499 37.3429 24.9892 H 80 ALA80 0.0774 3962 HB2 23.1494 38.2096 26.1790 H 80 ALA80 0.0774 3963 HB3 24.8147 38.7486 25.8556 H 80 ALA80 0.0774 3964 HG11 34.4552 41.6352 40.4252 H 47 VAL47 -0.0090 3965 HG12 33.3625 40.8159 39.2840 H 47 VAL47 -0.0090 3966 HG13 32.7861 42.2175 40.2175 H 47 VAL47 -0.0090 3967 HE1 36.1142 23.0749 24.4171 H 21 MET21 0.1284 3968 HE2 37.8891 23.0284 24.2929 H 21 MET21 0.1284 3969 HE3 37.0287 21.7757 25.2196 H 21 MET21 0.1284 3970 HO1113 16.6012 46.5102 39.3762 H.t3p 157 HOH1 0.4170 3971 HO1114 17.7626 45.8988 40.2256 H.t3p 157 HOH1 0.4170 3972 HG21 32.1386 35.3326 21.0029 H 37 VAL37 -0.0090 3973 HG22 31.0535 34.2039 21.8492 H 37 VAL37 -0.0090 3974 HG23 32.6903 33.6834 21.3823 H 37 VAL37 -0.0090 3975 HG11 30.1080 21.5732 32.9420 H 121 VAL121 -0.0090 3976 HG12 29.8088 20.6543 31.4474 H 121 VAL121 -0.0090 3977 HG13 30.1058 22.4076 31.3697 H 121 VAL121 -0.0090 3978 HO1115 51.6497 29.0104 33.8214 H.t3p 157 HOH1 0.4170 3979 HO1116 50.6457 28.6541 34.9651 H.t3p 157 HOH1 0.4170 3980 HD21 20.8356 15.2151 31.7168 H 119 LEU119 0.0224 3981 HD22 20.9712 13.8497 30.5833 H 119 LEU119 0.0224 3982 HD23 22.4271 14.4925 31.3805 H 119 LEU119 0.0224 3983 HO1117 24.9152 10.2852 33.1824 H.t3p 157 HOH1 0.4170 3984 HO1118 25.4254 11.7622 33.1328 H.t3p 157 HOH1 0.4170 3985 HO1119 9.5080 15.2022 32.0972 H.t3p 157 HOH1 0.4170 3986 HO1120 10.2736 14.7766 30.8027 H.t3p 157 HOH1 0.4170 3987 HB1 31.7075 39.0459 12.5168 H 34 ALA34 0.0774 3988 HB2 33.4263 39.3013 12.1319 H 34 ALA34 0.0774 3989 HB3 32.9196 37.8417 13.0158 H 34 ALA34 0.0774 3990 HB1 36.5095 34.4454 21.7202 H 23 ALA23 0.0774 3991 HB2 35.2600 33.7492 22.7794 H 23 ALA23 0.0774 3992 HB3 36.9270 33.1286 22.8427 H 23 ALA23 0.0774 3993 HO1121 26.7835 10.9377 31.0318 H.t3p 157 HOH1 0.4170 3994 HO1122 27.8921 11.6785 30.2160 H.t3p 157 HOH1 0.4170 3995 HB1 35.1236 14.8874 26.9604 H 137 ALA137 0.0774 3996 HB2 35.1516 15.3924 28.6668 H 137 ALA137 0.0774 3997 HB3 36.6257 15.5186 27.6771 H 137 ALA137 0.0774 3998 HD21 26.5254 37.0806 11.8282 H 154 LEU154 0.0224 3999 HD22 27.8716 37.1506 10.6661 H 154 LEU154 0.0224 4000 HD23 28.2034 36.9194 12.3995 H 154 LEU154 0.0224 4001 HO1123 43.0937 42.5105 26.9809 H.t3p 157 HOH1 0.4170 4002 HO1124 43.7542 41.1800 27.4671 H.t3p 157 HOH1 0.4170 4003 HB1 11.7035 29.6940 28.4134 H 101 ALA101 0.0774 4004 HB2 10.5580 30.9881 27.9882 H 101 ALA101 0.0774 4005 HB3 11.0548 30.7606 29.6822 H 101 ALA101 0.0774 4006 HG11 41.0954 21.3546 29.7832 H 58 VAL58 -0.0090 4007 HG12 40.2874 20.4031 31.0519 H 58 VAL58 -0.0090 4008 HG13 41.8353 19.8465 30.3719 H 58 VAL58 -0.0090 4009 HG11 34.5000 22.3717 31.4737 H 135 VAL135 -0.0090 4010 HG12 32.8732 22.1942 32.1734 H 135 VAL135 -0.0090 4011 HG13 34.1657 22.9773 33.1137 H 135 VAL135 -0.0090 4012 HG 34.6944 26.7984 39.9851 H 13 CYS13 0.1893 4013 HB1 45.3085 28.7142 33.8825 H 56 ALA56 0.0774 4014 HB2 44.7714 27.7454 35.2756 H 56 ALA56 0.0774 4015 HB3 43.8235 29.1598 34.7567 H 56 ALA56 0.0774 4016 HO1125 52.4017 26.9381 42.8734 H.t3p 157 HOH1 0.4170 4017 HO1126 51.7089 27.8564 41.8151 H.t3p 157 HOH1 0.4170 4018 HE1 38.9546 22.6250 31.6361 H 17 MET17 0.1284 4019 HE2 39.4950 24.3196 31.5725 H 17 MET17 0.1284 4020 HE3 38.2964 23.7231 30.3995 H 17 MET17 0.1284 4021 HD11 39.5231 28.2677 30.5342 H 59 LEU59 0.0224 4022 HD12 40.9333 28.9157 29.6630 H 59 LEU59 0.0224 4023 HD13 41.1408 28.1830 31.2718 H 59 LEU59 0.0224 4024 HO1127 46.8632 35.9736 22.1349 H.t3p 157 HOH1 0.4170 4025 HO1128 45.3451 36.2651 21.9039 H.t3p 157 HOH1 0.4170 4026 HB1 35.4621 35.5884 38.8164 H 70 ALA70 0.0774 4027 HB2 35.4576 37.2768 39.3793 H 70 ALA70 0.0774 4028 HB3 33.9293 36.4872 38.9221 H 70 ALA70 0.0774 4029 HO1129 35.3649 10.3467 40.6727 H.t3p 157 HOH1 0.4170 4030 HO1130 35.5839 10.2185 39.1305 H.t3p 157 HOH1 0.4170 4031 HG11 26.4008 28.1193 26.8156 H 84 VAL84 -0.0090 4032 HG12 24.6491 27.8805 27.0212 H 84 VAL84 -0.0090 4033 HG13 25.6725 28.2245 28.4363 H 84 VAL84 -0.0090 4034 HH 32.4361 26.1546 48.1039 H 126 TYR126 0.3297 4035 HG11 29.7820 35.8217 18.6842 H 35 VAL35 -0.0090 4036 HG12 29.3412 34.6247 17.4429 H 35 VAL35 -0.0090 4037 HG13 28.6124 36.2484 17.4120 H 35 VAL35 -0.0090 4038 HO1131 44.7774 25.7303 46.8924 H.t3p 157 HOH1 0.4170 4039 HO1132 44.6661 26.5106 45.5426 H.t3p 157 HOH1 0.4170 4040 HD11 23.6840 35.7794 16.6727 H 2 LEU2 0.0224 4041 HD12 23.5383 37.5464 16.5166 H 2 LEU2 0.0224 4042 HD13 24.1059 36.8319 18.0448 H 2 LEU2 0.0224 4043 HG21 45.6036 28.9328 30.5690 H 66 THR66 0.0600 4044 HG22 43.8499 29.2035 30.7066 H 66 THR66 0.0600 4045 HG23 44.6538 29.3635 29.1266 H 66 THR66 0.0600 4046 HG21 30.9130 36.2501 14.5132 H 35 VAL35 -0.0090 4047 HG22 29.2507 36.4913 15.1016 H 35 VAL35 -0.0090 4048 HG23 29.9786 34.8673 15.1322 H 35 VAL35 -0.0090 4049 HG21 31.3304 40.3377 27.3229 H 38 THR38 0.0600 4050 HG22 32.8489 39.4143 27.2269 H 38 THR38 0.0600 4051 HG23 31.5790 39.1685 26.0041 H 38 THR38 0.0600 4052 HD21 19.0347 35.2666 27.1942 H 83 LEU83 0.0224 4053 HD22 19.5028 36.9827 27.2537 H 83 LEU83 0.0224 4054 HD23 20.4909 35.8221 26.3345 H 83 LEU83 0.0224 4055 HD21 25.6308 35.0766 15.1801 H 2 LEU2 0.0224 4056 HD22 26.8837 36.2809 14.7963 H 2 LEU2 0.0224 4057 HD23 25.1885 36.5867 14.3481 H 2 LEU2 0.0224 4058 HO1133 46.8260 26.9662 18.6857 H.t3p 157 HOH1 0.4170 4059 HO1134 46.3000 25.5092 18.8950 H.t3p 157 HOH1 0.4170 4060 HB1 12.3402 32.2064 22.6466 H 102 ALA102 0.0774 4061 HB2 11.0909 31.9079 23.8786 H 102 ALA102 0.0774 4062 HB3 12.0673 33.3947 23.9434 H 102 ALA102 0.0774 4063 HG11 15.5409 35.4180 28.8523 H 99 VAL99 -0.0090 4064 HG12 17.2838 35.4183 29.2128 H 99 VAL99 -0.0090 4065 HG13 16.5429 36.8180 28.4004 H 99 VAL99 -0.0090 4066 HO1135 45.0216 13.0023 22.6644 H.t3p 157 HOH1 0.4170 4067 HO1136 45.2924 14.2191 23.6072 H.t3p 157 HOH1 0.4170 4068 HO1137 13.8942 26.9155 34.1898 H.t3p 157 HOH1 0.4170 4069 HO1138 12.3653 27.2167 34.3157 H.t3p 157 HOH1 0.4170 4070 HO1139 41.2709 29.7635 7.6016 H.t3p 157 HOH1 0.4170 4071 HO1140 41.2028 28.8005 8.8312 H.t3p 157 HOH1 0.4170 4072 HO1141 36.7101 46.5842 36.3800 H.t3p 157 HOH1 0.4170 4073 HO1142 36.7726 46.3842 34.8307 H.t3p 157 HOH1 0.4170 4074 HG21 16.2581 32.8401 29.1856 H 104 VAL104 -0.0090 4075 HG22 17.6594 32.5190 30.2350 H 104 VAL104 -0.0090 4076 HG23 16.0496 31.9100 30.6888 H 104 VAL104 -0.0090 4077 HB1 32.1189 40.8573 34.5367 H 71 ALA71 0.0774 4078 HB2 32.3285 39.1207 34.2078 H 71 ALA71 0.0774 4079 HB3 33.7488 40.1420 34.5364 H 71 ALA71 0.0774 4080 HO1143 14.7232 39.7150 15.8601 H.t3p 157 HOH1 0.4170 4081 HO1144 14.5012 38.5823 14.8063 H.t3p 157 HOH1 0.4170 4082 HG11 28.7053 18.3111 30.0410 H 138 VAL138 -0.0090 4083 HG12 29.1698 19.1156 28.5229 H 138 VAL138 -0.0090 4084 HG13 28.7775 17.3794 28.5261 H 138 VAL138 -0.0090 4085 HD11 25.2181 28.3271 20.8445 H 146 LEU146 0.0224 4086 HD12 25.8373 29.5053 22.0262 H 146 LEU146 0.0224 4087 HD13 25.6438 27.7977 22.4897 H 146 LEU146 0.0224 4088 HO1145 39.3159 47.6355 12.7687 H.t3p 157 HOH1 0.4170 4089 HO1146 39.1212 46.2217 12.1314 H.t3p 157 HOH1 0.4170 4090 HG21 31.1077 39.3627 41.7700 H 47 VAL47 -0.0090 4091 HG22 31.4923 39.5421 40.0416 H 47 VAL47 -0.0090 4092 HG23 30.9158 40.9437 40.9751 H 47 VAL47 -0.0090 4093 HD21 23.1405 30.8391 21.8666 H 82 LEU82 0.0224 4094 HD22 24.4382 31.2687 23.0065 H 82 LEU82 0.0224 4095 HD23 23.3901 29.8687 23.3378 H 82 LEU82 0.0224 4096 HB1 27.2537 22.3825 24.1851 H 142 ALA142 0.0774 4097 HB2 27.6092 20.8166 24.9529 H 142 ALA142 0.0774 4098 HB3 28.8666 22.0739 24.8720 H 142 ALA142 0.0774 @BOND 1 1786 1 1 2 1785 1 1 3 5 1 1 4 1787 5 1 5 6 5 1 6 6 8 am 7 1788 8 1 8 9 8 1 9 1789 9 1 10 14 9 1 11 14 16 am 12 1790 16 1 13 17 16 1 14 1791 17 1 15 24 17 1 16 24 26 am 17 1792 26 1 18 26 27 1 19 1793 27 1 20 31 27 1 21 31 33 am 22 1794 33 1 23 34 33 1 24 1795 34 1 25 38 34 1 26 38 40 am 27 1796 40 1 28 41 40 1 29 1797 41 1 30 49 41 1 31 49 51 am 32 1798 51 1 33 52 51 1 34 1799 52 1 35 56 52 1 36 56 58 am 37 1800 58 1 38 59 58 1 39 1801 59 1 40 62 59 1 41 62 64 am 42 1802 64 1 43 65 64 1 44 1803 65 1 45 69 65 1 46 69 71 am 47 1804 71 1 48 72 71 1 49 1806 72 1 50 1805 72 1 51 73 72 1 52 73 75 am 53 1807 75 1 54 76 75 1 55 1808 76 1 56 81 76 1 57 81 83 am 58 1809 83 1 59 84 83 1 60 1810 84 1 61 89 84 1 62 89 91 am 63 1811 91 1 64 92 91 1 65 1812 92 1 66 95 92 1 67 95 97 am 68 1813 97 1 69 98 97 1 70 1814 98 1 71 106 98 1 72 106 108 am 73 1815 108 1 74 109 108 1 75 1816 109 1 76 112 109 1 77 112 114 am 78 118 114 1 79 1817 118 1 80 119 118 1 81 119 121 am 82 1818 121 1 83 122 121 1 84 1819 122 1 85 127 122 1 86 127 129 am 87 1820 129 1 88 130 129 1 89 1821 130 1 90 132 130 1 91 132 134 am 92 1822 134 1 93 135 134 1 94 1823 135 1 95 141 135 1 96 141 143 am 97 1824 143 1 98 144 143 1 99 1825 144 1 100 150 144 1 101 150 152 am 102 1826 152 1 103 153 152 1 104 1827 153 1 105 158 153 1 106 158 160 am 107 1828 160 1 108 161 160 1 109 1829 161 1 110 169 161 1 111 169 171 am 112 1830 171 1 113 172 171 1 114 1831 172 1 115 174 172 1 116 174 176 am 117 1832 176 1 118 177 176 1 119 1833 177 1 120 183 177 1 121 183 185 am 122 1834 185 1 123 186 185 1 124 1835 186 1 125 192 186 1 126 192 194 am 127 1836 194 1 128 195 194 1 129 1837 195 1 130 200 195 1 131 200 202 am 132 1838 202 1 133 203 202 1 134 1839 203 1 135 211 203 1 136 211 213 am 137 1840 213 1 138 214 213 1 139 1841 214 1 140 221 214 1 141 221 223 am 142 1842 223 1 143 223 224 1 144 1843 224 1 145 232 224 1 146 232 234 am 147 1844 234 1 148 235 234 1 149 1846 235 1 150 1845 235 1 151 236 235 1 152 236 238 am 153 1847 238 1 154 239 238 1 155 1848 239 1 156 244 239 1 157 244 246 am 158 1849 246 1 159 247 246 1 160 1851 247 1 161 1850 247 1 162 248 247 1 163 248 250 am 164 1852 250 1 165 251 250 1 166 1853 251 1 167 256 251 1 168 256 257 2 169 256 258 am 170 1854 258 1 171 259 258 1 172 1855 259 1 173 261 259 1 174 261 263 am 175 1856 263 1 176 264 263 1 177 1857 264 1 178 268 264 1 179 268 270 am 180 1858 270 1 181 271 270 1 182 1859 271 1 183 279 271 1 184 279 281 am 185 1860 281 1 186 282 281 1 187 1861 282 1 188 286 282 1 189 286 288 am 190 1862 288 1 191 289 288 1 192 1863 289 1 193 293 289 1 194 293 295 am 195 1864 295 1 196 296 295 1 197 1865 296 1 198 299 296 1 199 299 301 am 200 1866 301 1 201 302 301 1 202 1867 302 1 203 304 302 1 204 304 306 am 205 1868 306 1 206 307 306 1 207 1870 307 1 208 1869 307 1 209 308 307 1 210 308 310 am 211 1871 310 1 212 311 310 1 213 1872 311 1 214 315 311 1 215 315 317 am 216 1873 317 1 217 318 317 1 218 1875 318 1 219 1874 318 1 220 319 318 1 221 319 321 am 222 1876 321 1 223 322 321 1 224 1877 322 1 225 327 322 1 226 327 329 am 227 1878 329 1 228 330 329 1 229 1879 330 1 230 341 330 1 231 341 343 am 232 1880 343 1 233 344 343 1 234 1881 344 1 235 351 344 1 236 351 353 am 237 1882 353 1 238 353 354 1 239 1883 354 1 240 358 354 1 241 358 360 am 242 1884 360 1 243 361 360 1 244 1886 361 1 245 1885 361 1 246 362 361 1 247 362 364 am 248 1887 364 1 249 365 364 1 250 1888 365 1 251 368 365 1 252 368 370 am 253 1889 370 1 254 371 370 1 255 1890 371 1 256 374 371 1 257 374 376 am 258 1891 376 1 259 377 376 1 260 1892 377 1 261 379 377 1 262 379 381 am 263 1893 381 1 264 382 381 1 265 1894 382 1 266 387 382 1 267 387 389 am 268 1895 389 1 269 390 389 1 270 1896 390 1 271 396 390 1 272 396 398 am 273 1897 398 1 274 399 398 1 275 1898 399 1 276 407 399 1 277 407 409 am 278 1899 409 1 279 410 409 1 280 1900 410 1 281 412 410 1 282 412 414 am 283 1901 414 1 284 415 414 1 285 1902 415 1 286 417 415 1 287 417 419 am 288 1903 419 1 289 420 419 1 290 1905 420 1 291 1904 420 1 292 421 420 1 293 421 423 am 294 1906 423 1 295 424 423 1 296 1907 424 1 297 428 424 1 298 428 430 am 299 1908 430 1 300 431 430 1 301 1909 431 1 302 436 431 1 303 436 438 am 304 1910 438 1 305 439 438 1 306 1911 439 1 307 447 439 1 308 447 449 am 309 1912 449 1 310 450 449 1 311 1913 450 1 312 452 450 1 313 452 454 am 314 1914 454 1 315 455 454 1 316 1915 455 1 317 462 455 1 318 462 464 am 319 1916 464 1 320 464 465 1 321 1918 465 1 322 1917 465 1 323 466 465 1 324 466 468 am 325 1919 468 1 326 469 468 1 327 1920 469 1 328 478 469 1 329 478 479 2 330 478 480 am 331 484 480 1 332 1921 484 1 333 485 484 1 334 485 487 am 335 1922 487 1 336 488 487 1 337 1923 488 1 338 492 488 1 339 492 494 am 340 1924 494 1 341 495 494 1 342 1925 495 1 343 500 495 1 344 500 502 am 345 1926 502 1 346 503 502 1 347 1927 503 1 348 510 503 1 349 510 512 am 350 1928 512 1 351 512 513 1 352 1929 513 1 353 521 513 1 354 521 523 am 355 1930 523 1 356 524 523 1 357 1931 524 1 358 526 524 1 359 526 528 am 360 1932 528 1 361 529 528 1 362 1933 529 1 363 531 529 1 364 531 533 am 365 1934 533 1 366 534 533 1 367 1935 534 1 368 540 534 1 369 540 542 am 370 1936 542 1 371 543 542 1 372 1937 543 1 373 547 543 1 374 547 549 am 375 1938 549 1 376 550 549 1 377 1940 550 1 378 1939 550 1 379 551 550 1 380 551 553 am 381 1941 553 1 382 554 553 1 383 1942 554 1 384 558 554 1 385 558 560 am 386 1943 560 1 387 561 560 1 388 1944 561 1 389 567 561 1 390 567 569 am 391 1945 569 1 392 570 569 1 393 1946 570 1 394 577 570 1 395 577 579 am 396 1947 579 1 397 579 580 1 398 1948 580 1 399 585 580 1 400 585 587 am 401 1949 587 1 402 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1325 1 2635 2850 1326 1 2636 2849 1326 1 2637 3643 1327 1 2638 3642 1327 1 2639 3302 1328 1 2640 3301 1328 1 2641 4069 1329 1 2642 4068 1329 1 2643 3180 1330 1 2644 3179 1330 1 2645 2667 1331 1 2646 2666 1331 1 2647 3034 1332 1 2648 3033 1332 1 2649 3224 1333 1 2650 3223 1333 1 2651 2948 1334 1 2652 2947 1334 1 2653 2922 1335 1 2654 2921 1335 1 2655 3368 1336 1 2656 3367 1336 1 2657 2924 1337 1 2658 2923 1337 1 2659 3011 1338 1 2660 3012 1338 1 2661 3284 1339 1 2662 3283 1339 1 2663 3552 1340 1 2664 3553 1340 1 2665 2714 1341 1 2666 2713 1341 1 2667 3137 1342 1 2668 3136 1342 1 2669 3591 1343 1 2670 3590 1343 1 2671 3151 1344 1 2672 3150 1344 1 2673 2766 1345 1 2674 2765 1345 1 2675 3633 1346 1 2676 3632 1346 1 2677 3014 1347 1 2678 3013 1347 1 2679 2702 1348 1 2680 2703 1348 1 2681 3675 1349 1 2682 3674 1349 1 2683 2864 1350 1 2684 2863 1350 1 2685 3453 1351 1 2686 3452 1351 1 2687 3008 1352 1 2688 3007 1352 1 2689 3611 1353 1 2690 3610 1353 1 2691 2950 1354 1 2692 2949 1354 1 2693 2978 1355 1 2694 2977 1355 1 2695 3242 1356 1 2696 3241 1356 1 2697 3720 1357 1 2698 3719 1357 1 2699 3619 1358 1 2700 3618 1358 1 2701 2679 1359 1 2702 2678 1359 1 2703 3587 1360 1 2704 3586 1360 1 2705 3204 1361 1 2706 3203 1361 1 2707 2720 1362 1 2708 2719 1362 1 2709 3620 1363 1 2710 3621 1363 1 2711 3288 1364 1 2712 3287 1364 1 2713 3153 1365 1 2714 3152 1365 1 2715 3679 1366 1 2716 3678 1366 1 2717 3499 1367 1 2718 3498 1367 1 2719 3438 1368 1 2720 3439 1368 1 2721 2906 1369 1 2722 2905 1369 1 2723 3036 1370 1 2724 3035 1370 1 2725 3042 1371 1 2726 3041 1371 1 2727 2691 1372 1 2728 2690 1372 1 2729 3057 1373 1 2730 3056 1373 1 2731 3059 1374 1 2732 3058 1374 1 2733 3266 1375 1 2734 3265 1375 1 2735 3805 1376 1 2736 3804 1376 1 2737 2960 1377 1 2738 2959 1377 1 2739 3085 1378 1 2740 3084 1378 1 2741 2844 1379 1 2742 2843 1379 1 2743 2736 1380 1 2744 2735 1380 1 2745 3143 1381 1 2746 3142 1381 1 2747 4081 1382 1 2748 4080 1382 1 2749 3479 1383 1 2750 3478 1383 1 2751 3067 1384 1 2752 3066 1384 1 2753 3868 1385 1 2754 3867 1385 1 2755 4089 1386 1 2756 4088 1386 1 2757 3196 1387 1 2758 3195 1387 1 2759 3022 1388 1 2760 3021 1388 1 2761 2860 1389 1 2762 2859 1389 1 2763 3230 1390 1 2764 3229 1390 1 2765 3487 1391 1 2766 3486 1391 1 2767 3075 1392 1 2768 3074 1392 1 2769 3262 1393 1 2770 3261 1393 1 2771 3527 1394 1 2772 3526 1394 1 2773 3107 1395 1 2774 3106 1395 1 2775 2862 1396 1 2776 2861 1396 1 2777 3671 1397 1 2778 3670 1397 1 2779 3061 1398 1 2780 3060 1398 1 2781 3340 1399 1 2782 3339 1399 1 2783 3605 1400 1 2784 3604 1400 1 2785 3752 1401 1 2786 3751 1401 1 2787 3392 1402 1 2788 3391 1402 1 2789 4071 1403 1 2790 4070 1403 1 2791 2902 1404 1 2792 2901 1404 1 2793 2926 1405 1 2794 2925 1405 1 2795 3040 1406 1 2796 3039 1406 1 2797 3917 1407 1 2798 3916 1407 1 2799 3473 1408 1 2800 3472 1408 1 2801 3282 1409 1 2802 3281 1409 1 2803 3607 1410 1 2804 3606 1410 1 2805 3952 1411 1 2806 3951 1411 1 2807 3304 1412 1 2808 3303 1412 1 2809 3312 1413 1 2810 3311 1413 1 2811 3318 1414 1 2812 3317 1414 1 2813 3330 1415 1 2814 3329 1415 1 2815 2740 1416 1 2816 2739 1416 1 2817 3239 1417 1 2818 3240 1417 1 2819 3278 1418 1 2820 3277 1418 1 2821 3376 1419 1 2822 3375 1419 1 2823 2792 1420 1 2824 2791 1420 1 2825 3435 1421 1 2826 3434 1421 1 2827 3214 1422 1 2828 3213 1422 1 2829 3681 1423 1 2830 3680 1423 1 2831 3208 1424 1 2832 3207 1424 1 2833 3423 1425 1 2834 3422 1425 1 2835 3238 1426 1 2836 3237 1426 1 2837 3113 1427 1 2838 3112 1427 1 2839 3503 1428 1 2840 3502 1428 1 2841 3087 1429 1 2842 3086 1429 1 2843 3272 1430 1 2844 3271 1430 1 2845 3131 1431 1 2846 3130 1431 1 2847 2730 1432 1 2848 2729 1432 1 2849 2886 1433 1 2850 2885 1433 1 2851 3380 1434 1 2852 3379 1434 1 2853 3145 1435 1 2854 3144 1435 1 2855 2966 1436 1 2856 2965 1436 1 2857 2846 1437 1 2858 2845 1437 1 2859 2936 1438 1 2860 2935 1438 1 2861 3402 1439 1 2862 3401 1439 1 2863 3563 1440 1 2864 3562 1440 1 2865 2904 1441 1 2866 2903 1441 1 2867 2794 1442 1 2868 2793 1442 1 2869 3052 1443 1 2870 3051 1443 1 2871 2701 1444 1 2872 2700 1444 1 2873 3220 1445 1 2874 3219 1445 1 2875 3336 1446 1 2876 3335 1446 1 2877 3206 1447 1 2878 3205 1447 1 2879 3705 1448 1 2880 3704 1448 1 2881 3109 1449 1 2882 3108 1449 1 2883 3641 1450 1 2884 3640 1450 1 2885 3573 1451 1 2886 3572 1451 1 2887 3135 1452 1 2888 3134 1452 1 2889 3348 1453 1 2890 3347 1453 1 2891 3023 1454 1 2892 3024 1454 1 2893 3032 1455 1 2894 3031 1455 1 2895 3683 1456 1 2896 3682 1456 1 2897 3050 1457 1 2898 3049 1457 1 2899 3184 1458 1 2900 3183 1458 1 2901 2774 1459 1 2902 2773 1459 1 2903 2814 1460 1 2904 2813 1460 1 2905 3774 1461 1 2906 3775 1461 1 2907 3922 1462 1 2908 3921 1462 1 2909 3083 1463 1 2910 3082 1463 1 2911 2984 1464 1 2912 2983 1464 1 2913 3515 1465 1 2914 3514 1465 1 2915 3099 1466 1 2916 3098 1466 1 2917 3290 1467 1 2918 3289 1467 1 2919 3010 1468 1 2920 3009 1468 1 2921 3121 1469 1 2922 3120 1469 1 2923 3093 1470 1 2924 3092 1470 1 2925 3133 1471 1 2926 3132 1471 1 2927 2928 1472 1 2928 2927 1472 1 2929 3382 1473 1 2930 3381 1473 1 2931 2986 1474 1 2932 2985 1474 1 2933 3286 1475 1 2934 3285 1475 1 2935 3334 1476 1 2936 3333 1476 1 2937 3167 1477 1 2938 3166 1477 1 2939 2732 1478 1 2940 2731 1478 1 2941 3421 1479 1 2942 3420 1479 1 2943 2834 1480 1 2944 2833 1480 1 2945 2976 1481 1 2946 2975 1481 1 2947 2798 1482 1 2948 2797 1482 1 2949 3710 1483 1 2950 3709 1483 1 2951 2818 1484 1 2952 2817 1484 1 2953 2908 1485 1 2954 2907 1485 1 2955 3163 1486 1 2956 3162 1486 1 2957 3314 1487 1 2958 3313 1487 1 2959 2882 1488 1 2960 2881 1488 1 2961 2683 1489 1 2962 2682 1489 1 2963 3897 1490 1 2964 3896 1490 1 2965 3852 1491 1 2966 3851 1491 1 2967 2954 1492 1 2968 2953 1492 1 2969 3408 1493 1 2970 3407 1493 1 2971 3665 1494 1 2972 3664 1494 1 2973 2967 1495 1 2974 2968 1495 1 2975 3445 1496 1 2976 3444 1496 1 2977 3692 1497 1 2978 3691 1497 1 2979 3308 1498 1 2980 3307 1498 1 2981 3571 1499 1 2982 3570 1499 1 2983 3324 1500 1 2984 3323 1500 1 2985 3801 1501 1 2986 3800 1501 1 2987 3535 1502 1 2988 3534 1502 1 2989 2752 1503 1 2990 2751 1503 1 2991 2970 1504 1 2992 2969 1504 1 2993 3577 1505 1 2994 3576 1505 1 2995 3139 1506 1 2996 3138 1506 1 2997 3394 1507 1 2998 3393 1507 1 2999 3613 1508 1 3000 3612 1508 1 3001 3412 1509 1 3002 3411 1509 1 3003 2982 1510 1 3004 2981 1510 1 3005 3429 1511 1 3006 3428 1511 1 3007 3433 1512 1 3008 3432 1512 1 3009 3431 1513 1 3010 3430 1513 1 3011 3685 1514 1 3012 3684 1514 1 3013 2726 1515 1 3014 2725 1515 1 3015 3477 1516 1 3016 3476 1516 1 3017 2938 1517 1 3018 2937 1517 1 3019 2884 1518 1 3020 2883 1518 1 3021 3517 1519 1 3022 3516 1519 1 3023 3950 1520 1 3024 3949 1520 1 3025 2808 1521 1 3026 2807 1521 1 3027 3539 1522 1 3028 3538 1522 1 3029 3567 1523 1 3030 3566 1523 1 3031 2685 1524 1 3032 2684 1524 1 3033 3176 1525 1 3034 3175 1525 1 3035 3390 1526 1 3036 3389 1526 1 3037 3252 1527 1 3038 3251 1527 1 3039 2972 1528 1 3040 2971 1528 1 3041 3280 1529 1 3042 3279 1529 1 3043 3115 1530 1 3044 3114 1530 1 3045 3129 1531 1 3046 3128 1531 1 3047 3065 1532 1 3048 3064 1532 1 3049 3071 1533 1 3050 3070 1533 1 3051 2868 1534 1 3052 2867 1534 1 3053 2974 1535 1 3054 2973 1535 1 3055 3417 1536 1 3056 3416 1536 1 3057 3030 1537 1 3058 3029 1537 1 3059 3787 1538 1 3060 3786 1538 1 3061 2812 1539 1 3062 2811 1539 1 3063 3832 1540 1 3064 3833 1540 1 3065 3760 1541 1 3066 3759 1541 1 3067 2838 1542 1 3068 2837 1542 1 3069 3198 1543 1 3070 3197 1543 1 3071 3157 1544 1 3072 3156 1544 1 3073 3218 1545 1 3074 3217 1545 1 3075 2828 1546 1 3076 2827 1546 1 3077 3234 1547 1 3078 3233 1547 1 3079 3243 1548 1 3080 3244 1548 1 3081 2728 1549 1 3082 2727 1549 1 3083 3306 1550 1 3084 3305 1550 1 3085 3264 1551 1 3086 3263 1551 1 3087 3824 1552 1 3088 3825 1552 1 3089 3350 1553 1 3090 3349 1553 1 3091 3617 1554 1 3092 3616 1554 1 3093 3026 1555 1 3094 3025 1555 1 3095 3372 1556 1 3096 3371 1556 1 3097 3388 1557 1 3098 3387 1557 1 3099 3481 1558 1 3100 3480 1558 1 3101 2962 1559 1 3102 2961 1559 1 3103 3256 1560 1 3104 3255 1560 1 3105 3984 1561 1 3106 3983 1561 1 3107 3386 1562 1 3108 3385 1562 1 3109 3569 1563 1 3110 3568 1563 1 3111 3119 1564 1 3112 3118 1564 1 3113 3159 1565 1 3114 3158 1565 1 3115 3601 1566 1 3116 3600 1566 1 3117 3933 1567 1 3118 3932 1567 1 3119 3803 1568 1 3120 3802 1568 1 3121 3645 1569 1 3122 3644 1569 1 3123 3509 1570 1 3124 3508 1570 1 3125 3483 1571 1 3126 3482 1571 1 3127 2894 1572 1 3128 2893 1572 1 3129 3677 1573 1 3130 3676 1573 1 3131 3063 1574 1 3132 3062 1574 1 3133 3038 1575 1 3134 3037 1575 1 3135 3948 1576 1 3136 3947 1576 1 3137 3579 1577 1 3138 3578 1577 1 3139 3147 1578 1 3140 3146 1578 1 3141 3551 1579 1 3142 3550 1579 1 3143 3599 1580 1 3144 3598 1580 1 3145 3525 1581 1 3146 3524 1581 1 3147 2942 1582 1 3148 2941 1582 1 3149 3364 1583 1 3150 3363 1583 1 3151 2780 1584 1 3152 2779 1584 1 3153 3468 1585 1 3154 3469 1585 1 3155 3523 1586 1 3156 3522 1586 1 3157 2816 1587 1 3158 2815 1587 1 3159 3673 1588 1 3160 3672 1588 1 3161 2912 1589 1 3162 2911 1589 1 3163 3451 1590 1 3164 3450 1590 1 3165 2874 1591 1 3166 2873 1591 1 3167 2980 1592 1 3168 2979 1592 1 3169 3495 1593 1 3170 3494 1593 1 3171 3210 1594 1 3172 3209 1594 1 3173 3270 1595 1 3174 3269 1595 1 3175 3541 1596 1 3176 3540 1596 1 3177 3020 1597 1 3178 3019 1597 1 3179 2914 1598 1 3180 2913 1598 1 3181 2663 1599 1 3182 2662 1599 1 3183 2876 1600 1 3184 2875 1600 1 3185 4038 1601 1 3186 4039 1601 1 3187 3300 1602 1 3188 3299 1602 1 3189 3398 1603 1 3190 3397 1603 1 3191 3654 1604 1 3192 3655 1604 1 3193 2800 1605 1 3194 2799 1605 1 3195 3436 1606 1 3196 3437 1606 1 3197 2706 1607 1 3198 2705 1607 1 3199 2990 1608 1 3200 2989 1608 1 3201 3485 1609 1 3202 3484 1609 1 3203 2944 1610 1 3204 2943 1610 1 3205 2852 1611 1 3206 2851 1611 1 3207 3555 1612 1 3208 3554 1612 1 3209 2738 1613 1 3210 2737 1613 1 3211 3192 1614 1 3212 3191 1614 1 3213 3338 1615 1 3214 3337 1615 1 3215 2687 1616 1 3216 2686 1616 1 3217 3726 1617 1 3218 3725 1617 1 3219 3854 1618 1 3220 3853 1618 1 3221 3647 1619 1 3222 3646 1619 1 3223 3779 1620 1 3224 3778 1620 1 3225 3427 1621 1 3226 3426 1621 1 3227 3320 1622 1 3228 3319 1622 1 3229 3002 1623 1 3230 3001 1623 1 3231 3471 1624 1 3232 3470 1624 1 3233 2744 1625 1 3234 2743 1625 1 3235 3276 1626 1 3236 3275 1626 1 3237 2786 1627 1 3238 2785 1627 1 3239 3822 1628 1 3240 3823 1628 1 3241 2746 1629 1 3242 2745 1629 1 3243 3979 1630 1 3244 3978 1630 1 3245 3316 1631 1 3246 3315 1631 1 3247 2946 1632 1 3248 2945 1632 1 3249 4017 1633 1 3250 4016 1633 1 3251 2802 1634 1 3252 2801 1634 1 3253 3374 1635 1 3254 3373 1635 1 3255 3637 1636 1 3256 3636 1636 1 3257 3850 1637 1 3258 3849 1637 1 3259 2806 1638 1 3260 2805 1638 1 3261 2708 1639 1 3262 2707 1639 1 3263 3406 1640 1 3264 3405 1640 1 3265 3455 1641 1 3266 3454 1641 1 3267 3419 1642 1 3268 3418 1642 1 3269 3246 1643 1 3270 3245 1643 1 3271 3629 1644 1 3272 3628 1644 1 3273 3446 1645 1 3274 3447 1645 1 3275 2665 1646 1 3276 2664 1646 1 3277 3016 1647 1 3278 3015 1647 1 3279 3475 1648 1 3280 3474 1648 1 3281 2820 1649 1 3282 2819 1649 1 3283 4002 1650 1 3284 4001 1650 1 3285 3505 1651 1 3286 3504 1651 1 3287 2782 1652 1 3288 2781 1652 1 3289 3519 1653 1 3290 3518 1653 1 3291 2958 1654 1 3292 2957 1654 1 3293 2920 1655 1 3294 2919 1655 1 3295 3659 1656 1 3296 3658 1656 1 3297 3559 1657 1 3298 3558 1657 1 3299 3907 1658 1 3300 3906 1658 1 3301 3575 1659 1 3302 3574 1659 1 3303 3232 1660 1 3304 3231 1660 1 3305 3491 1661 1 3306 3490 1661 1 3307 2742 1662 1 3308 2741 1662 1 3309 2673 1663 1 3310 2672 1663 1 3311 4029 1664 1 3312 4030 1664 1 3313 3028 1665 1 3314 3027 1665 1 3315 2710 1666 1 3316 2709 1666 1 3317 4067 1667 1 3318 4066 1667 1 3319 2858 1668 1 3320 2857 1668 1 3321 3648 1669 1 3322 3649 1669 1 3323 4025 1670 1 3324 4024 1670 1 3325 3079 1671 1 3326 3078 1671 1 3327 2992 1672 1 3328 2991 1672 1 3329 3581 1673 1 3330 3580 1673 1 3331 3762 1674 1 3332 3761 1674 1 3333 2854 1675 1 3334 2853 1675 1 3335 3018 1676 1 3336 3017 1676 1 3337 2724 1677 1 3338 2723 1677 1 3339 3396 1678 1 3340 3395 1678 1 3341 3651 1679 1 3342 3650 1679 1 3343 3190 1680 1 3344 3189 1680 1 3345 3899 1681 1 3346 3898 1681 1 3347 3105 1682 1 3348 3104 1682 1 3349 4059 1683 1 3350 4058 1683 1 3351 3935 1684 1 3352 3934 1684 1 3353 3366 1685 1 3354 3365 1685 1 3355 3260 1686 1 3356 3259 1686 1 3357 3081 1687 1 3358 3080 1687 1 3359 3739 1688 1 3360 3738 1688 1 3361 3296 1689 1 3362 3295 1689 1 3363 2866 1690 1 3364 2865 1690 1 3365 2762 1691 1 3366 2761 1691 1 3367 3354 1692 1 3368 3353 1692 1 3369 3603 1693 1 3370 3602 1693 1 3371 2934 1694 1 3372 2933 1694 1 3373 2764 1695 1 3374 2763 1695 1 3375 2916 1696 1 3376 2915 1696 1 3377 3186 1697 1 3378 3185 1697 1 3379 3425 1698 1 3380 3424 1698 1 3381 3202 1699 1 3382 3201 1699 1 3383 2892 1700 1 3384 2891 1700 1 3385 3464 1701 1 3386 3465 1701 1 3387 3226 1702 1 3388 3225 1702 1 3389 3254 1703 1 3390 3253 1703 1 3391 3511 1704 1 3392 3510 1704 1 3393 3294 1705 1 3394 3293 1705 1 3395 3322 1706 1 3396 3321 1706 1 3397 3557 1707 1 3398 3556 1707 1 3399 3268 1708 1 3400 3267 1708 1 3401 2890 1709 1 3402 2889 1709 1 3403 2784 1710 1 3404 2783 1710 1 3405 3292 1711 1 3406 3291 1711 1 3407 3370 1712 1 3408 3369 1712 1 3409 3635 1713 1 3410 3634 1713 1 3411 2910 1714 1 3412 2909 1714 1 3413 3127 1715 1 3414 3126 1715 1 3415 3095 1716 1 3416 3094 1716 1 3417 3194 1717 1 3418 3193 1717 1 3419 3362 1718 1 3420 3361 1718 1 3421 3326 1719 1 3422 3325 1719 1 3423 3497 1720 1 3424 3496 1720 1 3425 3543 1721 1 3426 3542 1721 1 3427 3595 1722 1 3428 3594 1722 1 3429 2856 1723 1 3430 2855 1723 1 3431 3046 1724 1 3432 3045 1724 1 3433 2734 1725 1 3434 2733 1725 1 3435 3356 1726 1 3436 3355 1726 1 3437 3625 1727 1 3438 3624 1727 1 3439 3467 1728 1 3440 3466 1728 1 3441 3400 1729 1 3442 3399 1729 1 3443 3657 1730 1 3444 3656 1730 1 3445 3937 1731 1 3446 3936 1731 1 3447 3441 1732 1 3448 3440 1732 1 3449 3513 1733 1 3450 3512 1733 1 3451 3521 1734 1 3452 3520 1734 1 3453 3489 1735 1 3454 3488 1735 1 3455 3545 1736 1 3456 3544 1736 1 3457 3549 1737 1 3458 3548 1737 1 3459 3529 1738 1 3460 3528 1738 1 3461 3342 1739 1 3462 3341 1739 1 3463 3669 1740 1 3464 3668 1740 1 3465 4073 1741 1 3466 4072 1741 1 3467 2778 1742 1 3468 2777 1742 1 3469 2756 1743 1 3470 2755 1743 1 3471 2888 1744 1 3472 2887 1744 1 3473 2900 1745 1 3474 2899 1745 1 3475 2722 1746 1 3476 2721 1746 1 3477 3048 1747 1 3478 3047 1747 1 3479 3004 1748 1 3480 3003 1748 1 3481 2712 1749 1 3482 2711 1749 1 3483 3561 1750 1 3484 3560 1750 1 3485 2918 1751 1 3486 2917 1751 1 3487 2940 1752 1 3488 2939 1752 1 3489 3593 1753 1 3490 3592 1753 1 3491 3457 1754 1 3492 3456 1754 1 3493 3378 1755 1 3494 3377 1755 1 3495 2952 1756 1 3496 2951 1756 1 3497 3174 1757 1 3498 3173 1757 1 3499 3663 1758 1 3500 3662 1758 1 3501 3697 1759 1 3502 3696 1759 1 3503 3212 1760 1 3504 3211 1760 1 3505 3459 1761 1 3506 3458 1761 1 3507 3737 1762 1 3508 3736 1762 1 3509 2956 1763 1 3510 2955 1763 1 3511 2994 1764 1 3512 2993 1764 1 3513 2998 1765 1 3514 2997 1765 1 3515 3274 1766 1 3516 3273 1766 1 3517 2840 1767 1 3518 2839 1767 1 3519 2842 1768 1 3520 2841 1768 1 3521 2699 1769 1 3522 2698 1769 1 3523 2768 1770 1 3524 2767 1770 1 3525 3182 1771 1 3526 3181 1771 1 3527 3360 1772 1 3528 3359 1772 1 3529 3627 1773 1 3530 3626 1773 1 3531 3758 1774 1 3532 3757 1774 1 3533 3404 1775 1 3534 3403 1775 1 3535 3661 1776 1 3536 3660 1776 1 3537 3188 1777 1 3538 3187 1777 1 3539 3912 1778 1 3540 3911 1778 1 3541 2750 1779 1 3542 2749 1779 1 3543 2671 1780 1 3544 2670 1780 1 3545 3994 1781 1 3546 3993 1781 1 3547 2675 1782 1 3548 2674 1782 1 3549 3493 1783 1 3550 3492 1783 1 3551 3533 1784 1 3552 3532 1784 1 @SUBSTRUCTURE 1 PRO1 5 RESIDUE 4 A PRO 1 ROOT 2 LEU2 9 RESIDUE 4 A LEU 2 3 HIE3 17 RESIDUE 4 A HIE 2 4 VAL4 27 RESIDUE 4 A VAL 2 5 THR5 34 RESIDUE 4 A THR 2 6 PHE6 41 RESIDUE 4 A PHE 2 7 VAL7 52 RESIDUE 4 A VAL 2 8 CYS8 59 RESIDUE 4 A CYS 2 9 THR9 65 RESIDUE 4 A THR 2 10 GLY10 72 RESIDUE 4 A GLY 2 11 ASN11 76 RESIDUE 4 A ASN 2 12 ILE12 84 RESIDUE 4 A ILE 2 13 CYS13 92 RESIDUE 4 A CYS 2 14 ARG14 98 RESIDUE 4 A ARG 2 15 SER15 109 RESIDUE 4 A SER 2 16 PRO16 118 RESIDUE 4 A PRO 2 17 MET17 122 RESIDUE 4 A MET 2 18 ALA18 130 RESIDUE 4 A ALA 2 19 GLU19 135 RESIDUE 4 A GLU 2 20 LYS20 144 RESIDUE 4 A LYS 2 21 MET21 153 RESIDUE 4 A MET 2 22 PHE22 161 RESIDUE 4 A PHE 2 23 ALA23 172 RESIDUE 4 A ALA 2 24 GLN24 177 RESIDUE 4 A GLN 2 25 GLN25 186 RESIDUE 4 A GLN 2 26 LEU26 195 RESIDUE 4 A LEU 2 27 ARG27 203 RESIDUE 4 A ARG 2 28 HIE28 214 RESIDUE 4 A HIE 2 29 ARG29 224 RESIDUE 4 A ARG 2 30 GLY30 235 RESIDUE 4 A GLY 2 31 LEU31 239 RESIDUE 4 A LEU 2 32 GLY32 247 RESIDUE 4 A GLY 2 33 ASP33 251 RESIDUE 4 A ASP 2 34 ALA34 259 RESIDUE 4 A ALA 2 35 VAL35 264 RESIDUE 4 A VAL 2 36 ARG36 271 RESIDUE 4 A ARG 2 37 VAL37 282 RESIDUE 4 A VAL 2 38 THR38 289 RESIDUE 4 A THR 2 39 SER39 296 RESIDUE 4 A SER 2 40 ALA40 302 RESIDUE 4 A ALA 2 41 GLY41 307 RESIDUE 4 A GLY 2 42 THR42 311 RESIDUE 4 A THR 2 43 GLY43 318 RESIDUE 4 A GLY 2 44 ASN44 322 RESIDUE 4 A ASN 2 45 TRP45 330 RESIDUE 4 A TRP 2 46 HIE46 344 RESIDUE 4 A HIE 2 47 VAL47 354 RESIDUE 4 A VAL 2 48 GLY48 361 RESIDUE 4 A GLY 2 49 SER49 365 RESIDUE 4 A SER 2 50 CYS50 371 RESIDUE 4 A CYS 2 51 ALA51 377 RESIDUE 4 A ALA 2 52 ASP52 382 RESIDUE 4 A ASP 2 53 GLU53 390 RESIDUE 4 A GLU 2 54 ARG54 399 RESIDUE 4 A ARG 2 55 ALA55 410 RESIDUE 4 A ALA 2 56 ALA56 415 RESIDUE 4 A ALA 2 57 GLY57 420 RESIDUE 4 A GLY 2 58 VAL58 424 RESIDUE 4 A VAL 2 59 LEU59 431 RESIDUE 4 A LEU 2 60 ARG60 439 RESIDUE 4 A ARG 2 61 ALA61 450 RESIDUE 4 A ALA 2 62 HIE62 455 RESIDUE 4 A HIE 2 63 GLY63 465 RESIDUE 4 A GLY 2 64 TYR64 469 RESIDUE 4 A TYR 2 65 PRO65 484 RESIDUE 4 A PRO 2 66 THR66 488 RESIDUE 4 A THR 2 67 ASP67 495 RESIDUE 4 A ASP 2 68 HIE68 503 RESIDUE 4 A HIE 2 69 ARG69 513 RESIDUE 4 A ARG 2 70 ALA70 524 RESIDUE 4 A ALA 2 71 ALA71 529 RESIDUE 4 A ALA 2 72 GLN72 534 RESIDUE 4 A GLN 2 73 VAL73 543 RESIDUE 4 A VAL 2 74 GLY74 550 RESIDUE 4 A GLY 2 75 THR75 554 RESIDUE 4 A THR 2 76 GLU76 561 RESIDUE 4 A GLU 2 77 HIE77 570 RESIDUE 4 A HIE 2 78 LEU78 580 RESIDUE 4 A LEU 2 79 ALA79 588 RESIDUE 4 A ALA 2 80 ALA80 593 RESIDUE 4 A ALA 2 81 ASP81 598 RESIDUE 4 A ASP 2 82 LEU82 606 RESIDUE 4 A LEU 2 83 LEU83 614 RESIDUE 4 A LEU 2 84 VAL84 622 RESIDUE 4 A VAL 2 85 ALA85 629 RESIDUE 4 A ALA 2 86 LEU86 634 RESIDUE 4 A LEU 2 87 ASP87 642 RESIDUE 4 A ASP 2 88 ARG88 650 RESIDUE 4 A ARG 2 89 ASN89 661 RESIDUE 4 A ASN 2 90 HIE90 669 RESIDUE 4 A HIE 2 91 ALA91 679 RESIDUE 4 A ALA 2 92 ARG92 684 RESIDUE 4 A ARG 2 93 LEU93 695 RESIDUE 4 A LEU 2 94 LEU94 703 RESIDUE 4 A LEU 2 95 ARG95 711 RESIDUE 4 A ARG 2 96 GLN96 722 RESIDUE 4 A GLN 2 97 LEU97 731 RESIDUE 4 A LEU 2 98 GLY98 739 RESIDUE 4 A GLY 2 99 VAL99 743 RESIDUE 4 A VAL 2 100 GLU100 750 RESIDUE 4 A GLU 2 101 ALA101 759 RESIDUE 4 A ALA 2 102 ALA102 764 RESIDUE 4 A ALA 2 103 ARG103 769 RESIDUE 4 A ARG 2 104 VAL104 780 RESIDUE 4 A VAL 2 105 ARG105 787 RESIDUE 4 A ARG 2 106 MET106 798 RESIDUE 4 A MET 2 107 LEU107 806 RESIDUE 4 A LEU 2 108 ARG108 814 RESIDUE 4 A ARG 2 109 SER109 825 RESIDUE 4 A SER 2 110 PHE110 831 RESIDUE 4 A PHE 2 111 ASP111 842 RESIDUE 4 A ASP 2 112 PRO112 853 RESIDUE 4 A PRO 2 113 ARG113 857 RESIDUE 4 A ARG 2 114 SER114 868 RESIDUE 4 A SER 2 115 GLY115 874 RESIDUE 4 A GLY 2 116 THR116 878 RESIDUE 4 A THR 2 117 HIE117 885 RESIDUE 4 A HIE 2 118 ALA118 895 RESIDUE 4 A ALA 2 119 LEU119 900 RESIDUE 4 A LEU 2 120 ASP120 908 RESIDUE 4 A ASP 2 121 VAL121 916 RESIDUE 4 A VAL 2 122 GLU122 923 RESIDUE 4 A GLU 2 123 ASP123 932 RESIDUE 4 A ASP 2 124 PRO124 943 RESIDUE 4 A PRO 2 125 TYR125 947 RESIDUE 4 A TYR 2 126 TYR126 959 RESIDUE 4 A TYR 2 127 GLY127 971 RESIDUE 4 A GLY 2 128 ASP128 975 RESIDUE 4 A ASP 2 129 HIE129 983 RESIDUE 4 A HIE 2 130 SER130 993 RESIDUE 4 A SER 2 131 ASP131 999 RESIDUE 4 A ASP 2 132 PHE132 1007 RESIDUE 4 A PHE 2 133 GLU133 1018 RESIDUE 4 A GLU 2 134 GLU134 1027 RESIDUE 4 A GLU 2 135 VAL135 1036 RESIDUE 4 A VAL 2 136 PHE136 1043 RESIDUE 4 A PHE 2 137 ALA137 1054 RESIDUE 4 A ALA 2 138 VAL138 1059 RESIDUE 4 A VAL 2 139 ILE139 1066 RESIDUE 4 A ILE 2 140 GLU140 1074 RESIDUE 4 A GLU 2 141 SER141 1083 RESIDUE 4 A SER 2 142 ALA142 1089 RESIDUE 4 A ALA 2 143 LEU143 1094 RESIDUE 4 A LEU 2 144 PRO144 1105 RESIDUE 4 A PRO 2 145 GLY145 1109 RESIDUE 4 A GLY 2 146 LEU146 1113 RESIDUE 4 A LEU 2 147 HIE147 1121 RESIDUE 4 A HIE 2 148 ASP148 1131 RESIDUE 4 A ASP 2 149 TRP149 1139 RESIDUE 4 A TRP 2 150 VAL150 1153 RESIDUE 4 A VAL 2 151 ASP151 1160 RESIDUE 4 A ASP 2 152 GLU152 1168 RESIDUE 4 A GLU 2 153 ARG153 1177 RESIDUE 4 A ARG 2 154 LEU154 1188 RESIDUE 4 A LEU 2 155 ALA155 1196 RESIDUE 4 A ALA 2 156 ARG156 1201 RESIDUE 4 A ARG 1 157 HOH1 2660 RESIDUE 4 A HOH 0 ROOT