USER MOD reduce.3.24.130724 H: found=0, std=0, add=1274, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1276 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 42 SER OG : rot 165:sc= -0.631 USER MOD Set 1.2: B 84 MET CE :methyl 144:sc= -0.342 (180deg=-1.36!) USER MOD Set 2.1: A 38 MET CE :methyl -166:sc= -0.259 (180deg=-0.616) USER MOD Set 2.2: A 42 SER OG : rot 96:sc= 0.83 USER MOD Set 3.1: A 40 ASN :FLIP amide:sc= -3.51! C(o=-9.8!,f=-8.7!) USER MOD Set 3.2: B 40 ASN : amide:sc= -2.45! C(o=-8.7!,f=-11!) USER MOD Set 3.3: B 52 GLN : amide:sc= -2.69! C(o=-8.7!,f=-13!) USER MOD Single : A 7 ASN :FLIP amide:sc= 0 F(o=-0.73,f=0) USER MOD Single : A 11 SER OG : rot 180:sc= 0.00203 USER MOD Single : A 13 THR OG1 : rot 21:sc= -0.325 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 88:sc= 1.09 USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 MET CE :methyl 169:sc= -0.196 (180deg=-0.44) USER MOD Single : A 25 LYS NZ :NH3+ 178:sc= 1.28 (180deg=1.22) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 GLN :FLIP amide:sc= 0 F(o=-1.5!,f=0) USER MOD Single : A 45 SER OG : rot 61:sc= 1.3 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= -0.117 K(o=-0.12,f=-1.9) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 105:sc= 0.634 USER MOD Single : A 59 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0499) USER MOD Single : A 63 LYS NZ :NH3+ -162:sc= 1.27 (180deg=1.15) USER MOD Single : A 65 ASN : amide:sc= -0.372 K(o=-0.37,f=-2.6!) USER MOD Single : A 66 GLN :FLIP amide:sc= -0.592 F(o=-2.5!,f=-0.59) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 GLN : amide:sc= -0.701 K(o=-0.7,f=-1.7) USER MOD Single : A 74 MET CE :methyl 160:sc= -0.203 (180deg=-0.811) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot -12:sc= -2.26! USER MOD Single : A 84 MET CE :methyl -176:sc= -0.381 (180deg=-0.388) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 161:sc= -0.112 (180deg=-0.437) USER MOD Single : B 7 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 11 SER OG : rot 180:sc= 0.0155 USER MOD Single : B 13 THR OG1 : rot 13:sc= -1.48! USER MOD Single : B 14 TYR OH : rot 180:sc= 0 USER MOD Single : B 16 THR OG1 : rot 180:sc= -0.577 USER MOD Single : B 21 ASN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : B 23 MET CE :methyl 172:sc= -0.017 (180deg=-0.14) USER MOD Single : B 25 LYS NZ :NH3+ -169:sc= -0.0136 (180deg=-0.203) USER MOD Single : B 26 THR OG1 : rot 180:sc= 0 USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 30 GLN :FLIP amide:sc= -0.467 F(o=-2.5!,f=-0.47) USER MOD Single : B 38 MET CE :methyl 136:sc= -2.21 (180deg=-5.37!) USER MOD Single : B 45 SER OG : rot -49:sc= 1.21 USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 53 SER OG : rot 180:sc=-0.00156 USER MOD Single : B 57 SER OG : rot 141:sc= 1.23 USER MOD Single : B 59 LYS NZ :NH3+ -160:sc= -0.122 (180deg=-0.585) USER MOD Single : B 63 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0494) USER MOD Single : B 65 ASN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : B 66 GLN :FLIP amide:sc= -0.191 F(o=-3.1!,f=-0.19) USER MOD Single : B 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 74 MET CE :methyl 178:sc= 0 (180deg=-0.00273) USER MOD Single : B 78 THR OG1 : rot 35:sc= 0.999 USER MOD Single : B 83 THR OG1 : rot 68:sc= 1.03 USER MOD Single : B 89 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0559) USER MOD Single : B 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 7 14.918 -12.059 -9.969 1.00 0.00 N ATOM 2 CA ASN A 7 15.598 -12.816 -8.920 1.00 0.00 C ATOM 3 C ASN A 7 16.700 -11.987 -8.274 1.00 0.00 C ATOM 4 O ASN A 7 16.929 -12.072 -7.070 1.00 0.00 O ATOM 5 CB ASN A 7 16.192 -14.105 -9.482 1.00 0.00 C ATOM 6 CG ASN A 7 15.152 -15.056 -10.054 1.00 0.00 C ATOM 7 OD1 ASN A 7 13.968 -15.091 -9.461 1.00 0.00 O flip ATOM 8 ND2 ASN A 7 15.423 -15.762 -11.020 1.00 0.00 N flip ATOM 0 HA ASN A 7 14.856 -13.066 -8.162 1.00 0.00 H new ATOM 0 HB2 ASN A 7 16.911 -13.854 -10.262 1.00 0.00 H new ATOM 0 HB3 ASN A 7 16.744 -14.615 -8.693 1.00 0.00 H new ATOM 0 HD21 ASN A 7 16.347 -15.706 -11.449 1.00 0.00 H new ATOM 0 HD22 ASN A 7 14.725 -16.405 -11.394 1.00 0.00 H new ATOM 15 N GLY A 8 17.377 -11.188 -9.086 1.00 0.00 N ATOM 16 CA GLY A 8 18.463 -10.344 -8.594 1.00 0.00 C ATOM 17 C GLY A 8 17.982 -9.069 -7.906 1.00 0.00 C ATOM 18 O GLY A 8 18.715 -8.085 -7.827 1.00 0.00 O ATOM 0 H GLY A 8 17.196 -11.104 -10.086 1.00 0.00 H new ATOM 0 HA2 GLY A 8 19.070 -10.918 -7.894 1.00 0.00 H new ATOM 0 HA3 GLY A 8 19.110 -10.075 -9.429 1.00 0.00 H new ATOM 22 N LEU A 9 16.757 -9.091 -7.421 1.00 0.00 N ATOM 23 CA LEU A 9 16.188 -7.970 -6.704 1.00 0.00 C ATOM 24 C LEU A 9 16.416 -8.148 -5.196 1.00 0.00 C ATOM 25 O LEU A 9 16.828 -9.231 -4.764 1.00 0.00 O ATOM 26 CB LEU A 9 14.689 -7.836 -7.046 1.00 0.00 C ATOM 27 CG LEU A 9 13.957 -9.128 -7.450 1.00 0.00 C ATOM 28 CD1 LEU A 9 13.888 -10.117 -6.294 1.00 0.00 C ATOM 29 CD2 LEU A 9 12.567 -8.806 -7.967 1.00 0.00 C ATOM 0 H LEU A 9 16.128 -9.888 -7.514 1.00 0.00 H new ATOM 0 HA LEU A 9 16.681 -7.047 -7.008 1.00 0.00 H new ATOM 0 HB2 LEU A 9 14.179 -7.411 -6.181 1.00 0.00 H new ATOM 0 HB3 LEU A 9 14.588 -7.118 -7.860 1.00 0.00 H new ATOM 0 HG LEU A 9 14.527 -9.601 -8.250 1.00 0.00 H new ATOM 0 HD11 LEU A 9 13.364 -11.017 -6.616 1.00 0.00 H new ATOM 0 HD12 LEU A 9 14.898 -10.378 -5.978 1.00 0.00 H new ATOM 0 HD13 LEU A 9 13.352 -9.665 -5.460 1.00 0.00 H new ATOM 0 HD21 LEU A 9 12.061 -9.729 -8.249 1.00 0.00 H new ATOM 0 HD22 LEU A 9 11.996 -8.303 -7.187 1.00 0.00 H new ATOM 0 HD23 LEU A 9 12.644 -8.154 -8.837 1.00 0.00 H new ATOM 41 N PRO A 10 16.193 -7.087 -4.377 1.00 0.00 N ATOM 42 CA PRO A 10 16.376 -7.146 -2.917 1.00 0.00 C ATOM 43 C PRO A 10 15.714 -8.374 -2.277 1.00 0.00 C ATOM 44 O PRO A 10 14.733 -8.914 -2.801 1.00 0.00 O ATOM 45 CB PRO A 10 15.707 -5.853 -2.407 1.00 0.00 C ATOM 46 CG PRO A 10 15.033 -5.246 -3.600 1.00 0.00 C ATOM 47 CD PRO A 10 15.776 -5.748 -4.799 1.00 0.00 C ATOM 0 HA PRO A 10 17.431 -7.229 -2.657 1.00 0.00 H new ATOM 0 HB2 PRO A 10 14.986 -6.070 -1.619 1.00 0.00 H new ATOM 0 HB3 PRO A 10 16.445 -5.171 -1.985 1.00 0.00 H new ATOM 0 HG2 PRO A 10 13.983 -5.535 -3.643 1.00 0.00 H new ATOM 0 HG3 PRO A 10 15.062 -4.157 -3.552 1.00 0.00 H new ATOM 0 HD2 PRO A 10 15.142 -5.781 -5.685 1.00 0.00 H new ATOM 0 HD3 PRO A 10 16.630 -5.115 -5.042 1.00 0.00 H new ATOM 55 N SER A 11 16.252 -8.793 -1.136 1.00 0.00 N ATOM 56 CA SER A 11 15.757 -9.964 -0.412 1.00 0.00 C ATOM 57 C SER A 11 14.264 -9.847 -0.100 1.00 0.00 C ATOM 58 O SER A 11 13.541 -10.843 -0.093 1.00 0.00 O ATOM 59 CB SER A 11 16.557 -10.142 0.873 1.00 0.00 C ATOM 60 OG SER A 11 16.668 -8.912 1.572 1.00 0.00 O ATOM 0 H SER A 11 17.043 -8.332 -0.686 1.00 0.00 H new ATOM 0 HA SER A 11 15.887 -10.840 -1.048 1.00 0.00 H new ATOM 0 HB2 SER A 11 16.073 -10.884 1.508 1.00 0.00 H new ATOM 0 HB3 SER A 11 17.551 -10.523 0.638 1.00 0.00 H new ATOM 0 HG SER A 11 17.183 -9.048 2.394 1.00 0.00 H new ATOM 66 N GLU A 12 13.818 -8.622 0.137 1.00 0.00 N ATOM 67 CA GLU A 12 12.419 -8.330 0.419 1.00 0.00 C ATOM 68 C GLU A 12 11.525 -8.857 -0.713 1.00 0.00 C ATOM 69 O GLU A 12 10.526 -9.526 -0.478 1.00 0.00 O ATOM 70 CB GLU A 12 12.246 -6.814 0.567 1.00 0.00 C ATOM 71 CG GLU A 12 13.176 -6.195 1.606 1.00 0.00 C ATOM 72 CD GLU A 12 13.239 -4.682 1.524 1.00 0.00 C ATOM 73 OE1 GLU A 12 12.408 -4.011 2.164 1.00 0.00 O ATOM 74 OE2 GLU A 12 14.139 -4.159 0.830 1.00 0.00 O ATOM 0 H GLU A 12 14.419 -7.798 0.139 1.00 0.00 H new ATOM 0 HA GLU A 12 12.124 -8.824 1.345 1.00 0.00 H new ATOM 0 HB2 GLU A 12 12.425 -6.340 -0.398 1.00 0.00 H new ATOM 0 HB3 GLU A 12 11.213 -6.599 0.841 1.00 0.00 H new ATOM 0 HG2 GLU A 12 12.842 -6.485 2.602 1.00 0.00 H new ATOM 0 HG3 GLU A 12 14.179 -6.602 1.475 1.00 0.00 H new ATOM 81 N THR A 13 11.911 -8.549 -1.932 1.00 0.00 N ATOM 82 CA THR A 13 11.181 -8.975 -3.121 1.00 0.00 C ATOM 83 C THR A 13 11.522 -10.414 -3.532 1.00 0.00 C ATOM 84 O THR A 13 10.907 -10.970 -4.432 1.00 0.00 O ATOM 85 CB THR A 13 11.478 -8.031 -4.296 1.00 0.00 C ATOM 86 OG1 THR A 13 12.877 -7.729 -4.333 1.00 0.00 O ATOM 87 CG2 THR A 13 10.699 -6.738 -4.168 1.00 0.00 C ATOM 0 H THR A 13 12.743 -7.994 -2.134 1.00 0.00 H new ATOM 0 HA THR A 13 10.121 -8.939 -2.869 1.00 0.00 H new ATOM 0 HB THR A 13 11.177 -8.533 -5.215 1.00 0.00 H new ATOM 0 HG1 THR A 13 13.374 -8.419 -3.845 1.00 0.00 H new ATOM 0 HG21 THR A 13 10.929 -6.089 -5.013 1.00 0.00 H new ATOM 0 HG22 THR A 13 9.631 -6.956 -4.158 1.00 0.00 H new ATOM 0 HG23 THR A 13 10.976 -6.237 -3.240 1.00 0.00 H new ATOM 95 N TYR A 14 12.475 -11.011 -2.849 1.00 0.00 N ATOM 96 CA TYR A 14 12.982 -12.325 -3.212 1.00 0.00 C ATOM 97 C TYR A 14 12.302 -13.419 -2.371 1.00 0.00 C ATOM 98 O TYR A 14 12.510 -14.611 -2.586 1.00 0.00 O ATOM 99 CB TYR A 14 14.505 -12.332 -2.995 1.00 0.00 C ATOM 100 CG TYR A 14 15.189 -13.641 -3.286 1.00 0.00 C ATOM 101 CD1 TYR A 14 15.565 -13.977 -4.573 1.00 0.00 C ATOM 102 CD2 TYR A 14 15.462 -14.536 -2.264 1.00 0.00 C ATOM 103 CE1 TYR A 14 16.197 -15.174 -4.838 1.00 0.00 C ATOM 104 CE2 TYR A 14 16.087 -15.732 -2.513 1.00 0.00 C ATOM 105 CZ TYR A 14 16.456 -16.051 -3.804 1.00 0.00 C ATOM 106 OH TYR A 14 17.086 -17.248 -4.065 1.00 0.00 O ATOM 0 H TYR A 14 12.922 -10.604 -2.028 1.00 0.00 H new ATOM 0 HA TYR A 14 12.759 -12.535 -4.258 1.00 0.00 H new ATOM 0 HB2 TYR A 14 14.949 -11.561 -3.625 1.00 0.00 H new ATOM 0 HB3 TYR A 14 14.710 -12.056 -1.961 1.00 0.00 H new ATOM 0 HD1 TYR A 14 15.361 -13.292 -5.383 1.00 0.00 H new ATOM 0 HD2 TYR A 14 15.177 -14.288 -1.252 1.00 0.00 H new ATOM 0 HE1 TYR A 14 16.487 -15.423 -5.848 1.00 0.00 H new ATOM 0 HE2 TYR A 14 16.289 -16.419 -1.704 1.00 0.00 H new ATOM 0 HH TYR A 14 17.195 -17.749 -3.230 1.00 0.00 H new ATOM 116 N ILE A 15 11.468 -13.005 -1.449 1.00 0.00 N ATOM 117 CA ILE A 15 10.813 -13.927 -0.539 1.00 0.00 C ATOM 118 C ILE A 15 9.523 -14.490 -1.168 1.00 0.00 C ATOM 119 O ILE A 15 9.078 -14.002 -2.200 1.00 0.00 O ATOM 120 CB ILE A 15 10.469 -13.202 0.779 1.00 0.00 C ATOM 121 CG1 ILE A 15 10.208 -14.207 1.893 1.00 0.00 C ATOM 122 CG2 ILE A 15 9.270 -12.267 0.590 1.00 0.00 C ATOM 123 CD1 ILE A 15 9.567 -13.602 3.101 1.00 0.00 C ATOM 0 H ILE A 15 11.222 -12.026 -1.304 1.00 0.00 H new ATOM 0 HA ILE A 15 11.493 -14.754 -0.337 1.00 0.00 H new ATOM 0 HB ILE A 15 11.326 -12.593 1.067 1.00 0.00 H new ATOM 0 HG12 ILE A 15 9.568 -15.003 1.512 1.00 0.00 H new ATOM 0 HG13 ILE A 15 11.152 -14.668 2.184 1.00 0.00 H new ATOM 0 HG21 ILE A 15 9.046 -11.767 1.532 1.00 0.00 H new ATOM 0 HG22 ILE A 15 9.506 -11.521 -0.169 1.00 0.00 H new ATOM 0 HG23 ILE A 15 8.403 -12.846 0.272 1.00 0.00 H new ATOM 0 HD11 ILE A 15 9.410 -14.374 3.855 1.00 0.00 H new ATOM 0 HD12 ILE A 15 10.216 -12.825 3.507 1.00 0.00 H new ATOM 0 HD13 ILE A 15 8.608 -13.165 2.824 1.00 0.00 H new ATOM 135 N THR A 16 8.936 -15.520 -0.552 1.00 0.00 N ATOM 136 CA THR A 16 7.688 -16.085 -1.039 1.00 0.00 C ATOM 137 C THR A 16 6.520 -15.657 -0.142 1.00 0.00 C ATOM 138 O THR A 16 6.724 -15.217 0.995 1.00 0.00 O ATOM 139 CB THR A 16 7.740 -17.639 -1.139 1.00 0.00 C ATOM 140 OG1 THR A 16 6.487 -18.143 -1.623 1.00 0.00 O ATOM 141 CG2 THR A 16 8.040 -18.269 0.209 1.00 0.00 C ATOM 0 H THR A 16 9.309 -15.974 0.282 1.00 0.00 H new ATOM 0 HA THR A 16 7.535 -15.697 -2.046 1.00 0.00 H new ATOM 0 HB THR A 16 8.540 -17.900 -1.832 1.00 0.00 H new ATOM 0 HG1 THR A 16 6.500 -18.165 -2.603 1.00 0.00 H new ATOM 0 HG21 THR A 16 8.069 -19.354 0.105 1.00 0.00 H new ATOM 0 HG22 THR A 16 9.005 -17.913 0.571 1.00 0.00 H new ATOM 0 HG23 THR A 16 7.262 -17.994 0.921 1.00 0.00 H new ATOM 149 N CYS A 17 5.308 -15.794 -0.659 1.00 0.00 N ATOM 150 CA CYS A 17 4.094 -15.391 0.050 1.00 0.00 C ATOM 151 C CYS A 17 3.928 -16.179 1.348 1.00 0.00 C ATOM 152 O CYS A 17 3.460 -15.644 2.352 1.00 0.00 O ATOM 153 CB CYS A 17 2.888 -15.616 -0.848 1.00 0.00 C ATOM 154 SG CYS A 17 3.273 -15.463 -2.620 1.00 0.00 S ATOM 0 H CYS A 17 5.134 -16.188 -1.584 1.00 0.00 H new ATOM 0 HA CYS A 17 4.175 -14.334 0.304 1.00 0.00 H new ATOM 0 HB2 CYS A 17 2.481 -16.609 -0.656 1.00 0.00 H new ATOM 0 HB3 CYS A 17 2.111 -14.897 -0.588 1.00 0.00 H new ATOM 159 N ALA A 18 4.326 -17.452 1.319 1.00 0.00 N ATOM 160 CA ALA A 18 4.231 -18.315 2.491 1.00 0.00 C ATOM 161 C ALA A 18 4.979 -17.711 3.679 1.00 0.00 C ATOM 162 O ALA A 18 4.417 -17.561 4.769 1.00 0.00 O ATOM 163 CB ALA A 18 4.770 -19.703 2.168 1.00 0.00 C ATOM 0 H ALA A 18 4.717 -17.906 0.494 1.00 0.00 H new ATOM 0 HA ALA A 18 3.180 -18.403 2.767 1.00 0.00 H new ATOM 0 HB1 ALA A 18 4.694 -20.338 3.051 1.00 0.00 H new ATOM 0 HB2 ALA A 18 4.188 -20.139 1.356 1.00 0.00 H new ATOM 0 HB3 ALA A 18 5.814 -19.626 1.866 1.00 0.00 H new ATOM 169 N GLU A 19 6.243 -17.363 3.464 1.00 0.00 N ATOM 170 CA GLU A 19 7.060 -16.755 4.507 1.00 0.00 C ATOM 171 C GLU A 19 6.554 -15.357 4.860 1.00 0.00 C ATOM 172 O GLU A 19 6.677 -14.915 6.003 1.00 0.00 O ATOM 173 CB GLU A 19 8.513 -16.682 4.057 1.00 0.00 C ATOM 174 CG GLU A 19 9.121 -18.020 3.681 1.00 0.00 C ATOM 175 CD GLU A 19 10.529 -17.877 3.142 1.00 0.00 C ATOM 176 OE1 GLU A 19 10.682 -17.546 1.949 1.00 0.00 O ATOM 177 OE2 GLU A 19 11.487 -18.098 3.907 1.00 0.00 O ATOM 0 H GLU A 19 6.725 -17.492 2.574 1.00 0.00 H new ATOM 0 HA GLU A 19 6.989 -17.379 5.398 1.00 0.00 H new ATOM 0 HB2 GLU A 19 8.582 -16.012 3.200 1.00 0.00 H new ATOM 0 HB3 GLU A 19 9.106 -16.239 4.857 1.00 0.00 H new ATOM 0 HG2 GLU A 19 9.133 -18.670 4.556 1.00 0.00 H new ATOM 0 HG3 GLU A 19 8.494 -18.504 2.932 1.00 0.00 H new ATOM 184 N ALA A 20 5.982 -14.664 3.873 1.00 0.00 N ATOM 185 CA ALA A 20 5.439 -13.332 4.090 1.00 0.00 C ATOM 186 C ALA A 20 4.304 -13.377 5.109 1.00 0.00 C ATOM 187 O ALA A 20 4.086 -12.424 5.857 1.00 0.00 O ATOM 188 CB ALA A 20 4.957 -12.733 2.779 1.00 0.00 C ATOM 0 H ALA A 20 5.885 -15.008 2.918 1.00 0.00 H new ATOM 0 HA ALA A 20 6.231 -12.697 4.486 1.00 0.00 H new ATOM 0 HB1 ALA A 20 4.554 -11.737 2.961 1.00 0.00 H new ATOM 0 HB2 ALA A 20 5.792 -12.665 2.081 1.00 0.00 H new ATOM 0 HB3 ALA A 20 4.179 -13.367 2.354 1.00 0.00 H new ATOM 194 N ASN A 21 3.596 -14.503 5.139 1.00 0.00 N ATOM 195 CA ASN A 21 2.509 -14.702 6.091 1.00 0.00 C ATOM 196 C ASN A 21 3.082 -14.841 7.492 1.00 0.00 C ATOM 197 O ASN A 21 2.542 -14.301 8.455 1.00 0.00 O ATOM 198 CB ASN A 21 1.684 -15.941 5.725 1.00 0.00 C ATOM 199 CG ASN A 21 0.545 -16.202 6.701 1.00 0.00 C ATOM 200 OD1 ASN A 21 -0.552 -15.653 6.557 1.00 0.00 O ATOM 201 ND2 ASN A 21 0.784 -17.055 7.686 1.00 0.00 N ATOM 0 H ASN A 21 3.757 -15.292 4.513 1.00 0.00 H new ATOM 0 HA ASN A 21 1.847 -13.837 6.057 1.00 0.00 H new ATOM 0 HB2 ASN A 21 1.275 -15.816 4.722 1.00 0.00 H new ATOM 0 HB3 ASN A 21 2.339 -16.812 5.697 1.00 0.00 H new ATOM 0 HD21 ASN A 21 0.049 -17.278 8.357 1.00 0.00 H new ATOM 0 HD22 ASN A 21 1.703 -17.489 7.773 1.00 0.00 H new ATOM 208 N GLU A 22 4.172 -15.594 7.594 1.00 0.00 N ATOM 209 CA GLU A 22 4.884 -15.738 8.856 1.00 0.00 C ATOM 210 C GLU A 22 5.281 -14.367 9.391 1.00 0.00 C ATOM 211 O GLU A 22 5.115 -14.080 10.570 1.00 0.00 O ATOM 212 CB GLU A 22 6.121 -16.625 8.683 1.00 0.00 C ATOM 213 CG GLU A 22 5.802 -18.019 8.179 1.00 0.00 C ATOM 214 CD GLU A 22 4.741 -18.700 9.011 1.00 0.00 C ATOM 215 OE1 GLU A 22 5.056 -19.155 10.128 1.00 0.00 O ATOM 216 OE2 GLU A 22 3.583 -18.774 8.553 1.00 0.00 O ATOM 0 H GLU A 22 4.581 -16.114 6.817 1.00 0.00 H new ATOM 0 HA GLU A 22 4.221 -16.218 9.576 1.00 0.00 H new ATOM 0 HB2 GLU A 22 6.808 -16.144 7.987 1.00 0.00 H new ATOM 0 HB3 GLU A 22 6.639 -16.703 9.639 1.00 0.00 H new ATOM 0 HG2 GLU A 22 5.467 -17.961 7.143 1.00 0.00 H new ATOM 0 HG3 GLU A 22 6.710 -18.622 8.187 1.00 0.00 H new ATOM 223 N MET A 23 5.804 -13.529 8.504 1.00 0.00 N ATOM 224 CA MET A 23 6.150 -12.156 8.854 1.00 0.00 C ATOM 225 C MET A 23 4.904 -11.383 9.298 1.00 0.00 C ATOM 226 O MET A 23 4.936 -10.670 10.291 1.00 0.00 O ATOM 227 CB MET A 23 6.798 -11.455 7.661 1.00 0.00 C ATOM 228 CG MET A 23 8.114 -12.073 7.219 1.00 0.00 C ATOM 229 SD MET A 23 8.750 -11.347 5.694 1.00 0.00 S ATOM 230 CE MET A 23 8.929 -9.631 6.171 1.00 0.00 C ATOM 0 H MET A 23 5.998 -13.777 7.534 1.00 0.00 H new ATOM 0 HA MET A 23 6.859 -12.181 9.681 1.00 0.00 H new ATOM 0 HB2 MET A 23 6.102 -11.470 6.822 1.00 0.00 H new ATOM 0 HB3 MET A 23 6.968 -10.409 7.916 1.00 0.00 H new ATOM 0 HG2 MET A 23 8.853 -11.949 8.011 1.00 0.00 H new ATOM 0 HG3 MET A 23 7.977 -13.145 7.076 1.00 0.00 H new ATOM 0 HE1 MET A 23 9.491 -9.097 5.405 1.00 0.00 H new ATOM 0 HE2 MET A 23 7.943 -9.179 6.279 1.00 0.00 H new ATOM 0 HE3 MET A 23 9.462 -9.571 7.120 1.00 0.00 H new ATOM 240 N ALA A 24 3.817 -11.539 8.538 1.00 0.00 N ATOM 241 CA ALA A 24 2.526 -10.888 8.841 1.00 0.00 C ATOM 242 C ALA A 24 2.092 -11.098 10.297 1.00 0.00 C ATOM 243 O ALA A 24 1.402 -10.257 10.877 1.00 0.00 O ATOM 244 CB ALA A 24 1.441 -11.389 7.895 1.00 0.00 C ATOM 0 H ALA A 24 3.800 -12.116 7.697 1.00 0.00 H new ATOM 0 HA ALA A 24 2.669 -9.817 8.695 1.00 0.00 H new ATOM 0 HB1 ALA A 24 0.497 -10.899 8.132 1.00 0.00 H new ATOM 0 HB2 ALA A 24 1.720 -11.159 6.867 1.00 0.00 H new ATOM 0 HB3 ALA A 24 1.329 -12.467 8.008 1.00 0.00 H new ATOM 250 N LYS A 25 2.489 -12.230 10.874 1.00 0.00 N ATOM 251 CA LYS A 25 2.178 -12.554 12.275 1.00 0.00 C ATOM 252 C LYS A 25 2.719 -11.491 13.244 1.00 0.00 C ATOM 253 O LYS A 25 2.194 -11.324 14.346 1.00 0.00 O ATOM 254 CB LYS A 25 2.749 -13.927 12.648 1.00 0.00 C ATOM 255 CG LYS A 25 2.126 -15.092 11.891 1.00 0.00 C ATOM 256 CD LYS A 25 2.840 -16.401 12.211 1.00 0.00 C ATOM 257 CE LYS A 25 2.164 -17.584 11.536 1.00 0.00 C ATOM 258 NZ LYS A 25 2.909 -18.854 11.758 1.00 0.00 N ATOM 0 H LYS A 25 3.032 -12.947 10.393 1.00 0.00 H new ATOM 0 HA LYS A 25 1.092 -12.573 12.366 1.00 0.00 H new ATOM 0 HB2 LYS A 25 3.823 -13.923 12.464 1.00 0.00 H new ATOM 0 HB3 LYS A 25 2.609 -14.087 13.717 1.00 0.00 H new ATOM 0 HG2 LYS A 25 1.071 -15.177 12.152 1.00 0.00 H new ATOM 0 HG3 LYS A 25 2.175 -14.901 10.819 1.00 0.00 H new ATOM 0 HD2 LYS A 25 3.878 -16.339 11.885 1.00 0.00 H new ATOM 0 HD3 LYS A 25 2.853 -16.555 13.290 1.00 0.00 H new ATOM 0 HE2 LYS A 25 1.149 -17.688 11.918 1.00 0.00 H new ATOM 0 HE3 LYS A 25 2.084 -17.393 10.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 2.396 -19.640 11.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 3.858 -18.777 11.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 2.993 -19.033 12.779 1.00 0.00 H new ATOM 272 N THR A 26 3.750 -10.773 12.826 1.00 0.00 N ATOM 273 CA THR A 26 4.355 -9.763 13.675 1.00 0.00 C ATOM 274 C THR A 26 4.416 -8.398 12.976 1.00 0.00 C ATOM 275 O THR A 26 4.353 -7.356 13.628 1.00 0.00 O ATOM 276 CB THR A 26 5.771 -10.195 14.150 1.00 0.00 C ATOM 277 OG1 THR A 26 6.335 -9.212 15.030 1.00 0.00 O ATOM 278 CG2 THR A 26 6.710 -10.422 12.970 1.00 0.00 C ATOM 0 H THR A 26 4.183 -10.871 11.908 1.00 0.00 H new ATOM 0 HA THR A 26 3.717 -9.662 14.553 1.00 0.00 H new ATOM 0 HB THR A 26 5.658 -11.136 14.689 1.00 0.00 H new ATOM 0 HG1 THR A 26 7.225 -9.504 15.319 1.00 0.00 H new ATOM 0 HG21 THR A 26 7.691 -10.723 13.338 1.00 0.00 H new ATOM 0 HG22 THR A 26 6.307 -11.206 12.330 1.00 0.00 H new ATOM 0 HG23 THR A 26 6.805 -9.499 12.398 1.00 0.00 H new ATOM 286 N ASP A 27 4.524 -8.407 11.654 1.00 0.00 N ATOM 287 CA ASP A 27 4.594 -7.184 10.880 1.00 0.00 C ATOM 288 C ASP A 27 3.652 -7.251 9.696 1.00 0.00 C ATOM 289 O ASP A 27 4.077 -7.310 8.541 1.00 0.00 O ATOM 290 CB ASP A 27 6.025 -6.917 10.410 1.00 0.00 C ATOM 291 CG ASP A 27 6.941 -6.497 11.543 1.00 0.00 C ATOM 292 OD1 ASP A 27 6.801 -5.357 12.037 1.00 0.00 O ATOM 293 OD2 ASP A 27 7.806 -7.302 11.950 1.00 0.00 O ATOM 0 H ASP A 27 4.565 -9.259 11.095 1.00 0.00 H new ATOM 0 HA ASP A 27 4.287 -6.358 11.522 1.00 0.00 H new ATOM 0 HB2 ASP A 27 6.423 -7.816 9.940 1.00 0.00 H new ATOM 0 HB3 ASP A 27 6.014 -6.137 9.648 1.00 0.00 H new ATOM 298 N SER A 28 2.366 -7.263 9.996 1.00 0.00 N ATOM 299 CA SER A 28 1.329 -7.329 8.981 1.00 0.00 C ATOM 300 C SER A 28 1.361 -6.094 8.086 1.00 0.00 C ATOM 301 O SER A 28 1.076 -6.173 6.895 1.00 0.00 O ATOM 302 CB SER A 28 -0.051 -7.469 9.646 1.00 0.00 C ATOM 303 OG SER A 28 -1.079 -7.647 8.683 1.00 0.00 O ATOM 0 H SER A 28 2.010 -7.227 10.951 1.00 0.00 H new ATOM 0 HA SER A 28 1.515 -8.204 8.358 1.00 0.00 H new ATOM 0 HB2 SER A 28 -0.042 -8.317 10.330 1.00 0.00 H new ATOM 0 HB3 SER A 28 -0.260 -6.581 10.242 1.00 0.00 H new ATOM 0 HG SER A 28 -1.942 -7.734 9.138 1.00 0.00 H new ATOM 309 N ALA A 29 1.735 -4.962 8.664 1.00 0.00 N ATOM 310 CA ALA A 29 1.772 -3.706 7.929 1.00 0.00 C ATOM 311 C ALA A 29 2.745 -3.778 6.753 1.00 0.00 C ATOM 312 O ALA A 29 2.334 -3.705 5.608 1.00 0.00 O ATOM 313 CB ALA A 29 2.139 -2.553 8.854 1.00 0.00 C ATOM 0 H ALA A 29 2.018 -4.887 9.641 1.00 0.00 H new ATOM 0 HA ALA A 29 0.774 -3.527 7.528 1.00 0.00 H new ATOM 0 HB1 ALA A 29 2.161 -1.623 8.285 1.00 0.00 H new ATOM 0 HB2 ALA A 29 1.398 -2.474 9.649 1.00 0.00 H new ATOM 0 HB3 ALA A 29 3.121 -2.735 9.290 1.00 0.00 H new ATOM 319 N GLN A 30 4.025 -3.981 7.055 1.00 0.00 N ATOM 320 CA GLN A 30 5.082 -4.017 6.044 1.00 0.00 C ATOM 321 C GLN A 30 4.799 -5.006 4.905 1.00 0.00 C ATOM 322 O GLN A 30 5.120 -4.729 3.760 1.00 0.00 O ATOM 323 CB GLN A 30 6.430 -4.354 6.690 1.00 0.00 C ATOM 324 CG GLN A 30 6.827 -3.425 7.825 1.00 0.00 C ATOM 325 CD GLN A 30 8.295 -3.541 8.186 1.00 0.00 C ATOM 326 OE1 GLN A 30 9.123 -2.752 7.527 1.00 0.00 O flip ATOM 327 NE2 GLN A 30 8.680 -4.331 9.043 1.00 0.00 N flip ATOM 0 H GLN A 30 4.360 -4.125 8.007 1.00 0.00 H new ATOM 0 HA GLN A 30 5.114 -3.020 5.604 1.00 0.00 H new ATOM 0 HB2 GLN A 30 6.394 -5.376 7.068 1.00 0.00 H new ATOM 0 HB3 GLN A 30 7.205 -4.325 5.924 1.00 0.00 H new ATOM 0 HG2 GLN A 30 6.606 -2.396 7.541 1.00 0.00 H new ATOM 0 HG3 GLN A 30 6.222 -3.650 8.703 1.00 0.00 H new ATOM 0 HE21 GLN A 30 8.007 -4.923 9.530 1.00 0.00 H new ATOM 0 HE22 GLN A 30 9.673 -4.395 9.269 1.00 0.00 H new ATOM 336 N VAL A 31 4.188 -6.139 5.217 1.00 0.00 N ATOM 337 CA VAL A 31 3.962 -7.166 4.204 1.00 0.00 C ATOM 338 C VAL A 31 2.673 -6.944 3.412 1.00 0.00 C ATOM 339 O VAL A 31 2.668 -7.072 2.197 1.00 0.00 O ATOM 340 CB VAL A 31 3.983 -8.600 4.793 1.00 0.00 C ATOM 341 CG1 VAL A 31 5.358 -8.928 5.339 1.00 0.00 C ATOM 342 CG2 VAL A 31 2.930 -8.766 5.873 1.00 0.00 C ATOM 0 H VAL A 31 3.843 -6.371 6.148 1.00 0.00 H new ATOM 0 HA VAL A 31 4.800 -7.071 3.514 1.00 0.00 H new ATOM 0 HB VAL A 31 3.750 -9.297 3.988 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.355 -9.938 5.749 1.00 0.00 H new ATOM 0 HG12 VAL A 31 6.093 -8.864 4.537 1.00 0.00 H new ATOM 0 HG13 VAL A 31 5.616 -8.218 6.125 1.00 0.00 H new ATOM 0 HG21 VAL A 31 2.969 -9.782 6.267 1.00 0.00 H new ATOM 0 HG22 VAL A 31 3.120 -8.057 6.679 1.00 0.00 H new ATOM 0 HG23 VAL A 31 1.943 -8.579 5.451 1.00 0.00 H new ATOM 352 N ALA A 32 1.594 -6.582 4.100 1.00 0.00 N ATOM 353 CA ALA A 32 0.306 -6.387 3.436 1.00 0.00 C ATOM 354 C ALA A 32 0.305 -5.102 2.634 1.00 0.00 C ATOM 355 O ALA A 32 -0.460 -4.945 1.680 1.00 0.00 O ATOM 356 CB ALA A 32 -0.828 -6.385 4.451 1.00 0.00 C ATOM 0 H ALA A 32 1.583 -6.419 5.107 1.00 0.00 H new ATOM 0 HA ALA A 32 0.149 -7.219 2.749 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -1.777 -6.239 3.936 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -0.845 -7.338 4.979 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -0.675 -5.577 5.166 1.00 0.00 H new ATOM 362 N GLU A 33 1.170 -4.192 3.018 1.00 0.00 N ATOM 363 CA GLU A 33 1.283 -2.923 2.363 1.00 0.00 C ATOM 364 C GLU A 33 1.984 -3.073 1.024 1.00 0.00 C ATOM 365 O GLU A 33 1.390 -2.840 -0.013 1.00 0.00 O ATOM 366 CB GLU A 33 2.071 -1.984 3.263 1.00 0.00 C ATOM 367 CG GLU A 33 2.300 -0.606 2.710 1.00 0.00 C ATOM 368 CD GLU A 33 3.330 0.141 3.513 1.00 0.00 C ATOM 369 OE1 GLU A 33 2.969 0.726 4.551 1.00 0.00 O ATOM 370 OE2 GLU A 33 4.513 0.137 3.109 1.00 0.00 O ATOM 0 H GLU A 33 1.815 -4.318 3.798 1.00 0.00 H new ATOM 0 HA GLU A 33 0.288 -2.518 2.178 1.00 0.00 H new ATOM 0 HB2 GLU A 33 1.546 -1.893 4.214 1.00 0.00 H new ATOM 0 HB3 GLU A 33 3.039 -2.438 3.475 1.00 0.00 H new ATOM 0 HG2 GLU A 33 2.627 -0.678 1.673 1.00 0.00 H new ATOM 0 HG3 GLU A 33 1.362 -0.051 2.711 1.00 0.00 H new ATOM 377 N ILE A 34 3.237 -3.511 1.066 1.00 0.00 N ATOM 378 CA ILE A 34 4.066 -3.623 -0.132 1.00 0.00 C ATOM 379 C ILE A 34 3.414 -4.477 -1.211 1.00 0.00 C ATOM 380 O ILE A 34 3.552 -4.188 -2.407 1.00 0.00 O ATOM 381 CB ILE A 34 5.497 -4.143 0.182 1.00 0.00 C ATOM 382 CG1 ILE A 34 6.327 -4.205 -1.097 1.00 0.00 C ATOM 383 CG2 ILE A 34 5.450 -5.513 0.854 1.00 0.00 C ATOM 384 CD1 ILE A 34 7.771 -4.611 -0.880 1.00 0.00 C ATOM 0 H ILE A 34 3.706 -3.797 1.925 1.00 0.00 H new ATOM 0 HA ILE A 34 4.159 -2.609 -0.520 1.00 0.00 H new ATOM 0 HB ILE A 34 5.968 -3.446 0.875 1.00 0.00 H new ATOM 0 HG12 ILE A 34 5.862 -4.911 -1.785 1.00 0.00 H new ATOM 0 HG13 ILE A 34 6.304 -3.228 -1.580 1.00 0.00 H new ATOM 0 HG21 ILE A 34 6.465 -5.851 1.062 1.00 0.00 H new ATOM 0 HG22 ILE A 34 4.893 -5.441 1.788 1.00 0.00 H new ATOM 0 HG23 ILE A 34 4.958 -6.226 0.192 1.00 0.00 H new ATOM 0 HD11 ILE A 34 8.291 -4.631 -1.838 1.00 0.00 H new ATOM 0 HD12 ILE A 34 8.255 -3.893 -0.219 1.00 0.00 H new ATOM 0 HD13 ILE A 34 7.806 -5.602 -0.427 1.00 0.00 H new ATOM 396 N VAL A 35 2.673 -5.493 -0.802 1.00 0.00 N ATOM 397 CA VAL A 35 2.019 -6.358 -1.759 1.00 0.00 C ATOM 398 C VAL A 35 0.875 -5.635 -2.477 1.00 0.00 C ATOM 399 O VAL A 35 0.652 -5.840 -3.664 1.00 0.00 O ATOM 400 CB VAL A 35 1.503 -7.660 -1.117 1.00 0.00 C ATOM 401 CG1 VAL A 35 2.650 -8.492 -0.584 1.00 0.00 C ATOM 402 CG2 VAL A 35 0.483 -7.388 -0.029 1.00 0.00 C ATOM 0 H VAL A 35 2.512 -5.735 0.176 1.00 0.00 H new ATOM 0 HA VAL A 35 2.777 -6.629 -2.494 1.00 0.00 H new ATOM 0 HB VAL A 35 1.000 -8.229 -1.899 1.00 0.00 H new ATOM 0 HG11 VAL A 35 2.259 -9.406 -0.136 1.00 0.00 H new ATOM 0 HG12 VAL A 35 3.324 -8.748 -1.401 1.00 0.00 H new ATOM 0 HG13 VAL A 35 3.194 -7.922 0.169 1.00 0.00 H new ATOM 0 HG21 VAL A 35 0.145 -8.333 0.397 1.00 0.00 H new ATOM 0 HG22 VAL A 35 0.938 -6.779 0.752 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -0.369 -6.856 -0.453 1.00 0.00 H new ATOM 412 N ALA A 36 0.176 -4.769 -1.756 1.00 0.00 N ATOM 413 CA ALA A 36 -0.911 -4.006 -2.333 1.00 0.00 C ATOM 414 C ALA A 36 -0.363 -2.783 -3.039 1.00 0.00 C ATOM 415 O ALA A 36 -0.841 -2.393 -4.097 1.00 0.00 O ATOM 416 CB ALA A 36 -1.904 -3.600 -1.257 1.00 0.00 C ATOM 0 H ALA A 36 0.347 -4.580 -0.768 1.00 0.00 H new ATOM 0 HA ALA A 36 -1.432 -4.628 -3.061 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -2.715 -3.027 -1.707 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -2.311 -4.493 -0.782 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -1.400 -2.988 -0.509 1.00 0.00 H new ATOM 422 N VAL A 37 0.638 -2.176 -2.425 1.00 0.00 N ATOM 423 CA VAL A 37 1.313 -1.024 -2.978 1.00 0.00 C ATOM 424 C VAL A 37 1.847 -1.312 -4.374 1.00 0.00 C ATOM 425 O VAL A 37 1.418 -0.680 -5.336 1.00 0.00 O ATOM 426 CB VAL A 37 2.449 -0.540 -2.043 1.00 0.00 C ATOM 427 CG1 VAL A 37 3.341 0.468 -2.732 1.00 0.00 C ATOM 428 CG2 VAL A 37 1.860 0.070 -0.791 1.00 0.00 C ATOM 0 H VAL A 37 1.005 -2.475 -1.521 1.00 0.00 H new ATOM 0 HA VAL A 37 0.579 -0.222 -3.060 1.00 0.00 H new ATOM 0 HB VAL A 37 3.058 -1.405 -1.779 1.00 0.00 H new ATOM 0 HG11 VAL A 37 4.127 0.786 -2.047 1.00 0.00 H new ATOM 0 HG12 VAL A 37 3.791 0.013 -3.614 1.00 0.00 H new ATOM 0 HG13 VAL A 37 2.749 1.333 -3.032 1.00 0.00 H new ATOM 0 HG21 VAL A 37 2.664 0.408 -0.138 1.00 0.00 H new ATOM 0 HG22 VAL A 37 1.231 0.918 -1.061 1.00 0.00 H new ATOM 0 HG23 VAL A 37 1.260 -0.676 -0.271 1.00 0.00 H new ATOM 438 N MET A 38 2.764 -2.267 -4.502 1.00 0.00 N ATOM 439 CA MET A 38 3.304 -2.611 -5.805 1.00 0.00 C ATOM 440 C MET A 38 2.233 -3.291 -6.648 1.00 0.00 C ATOM 441 O MET A 38 2.136 -3.052 -7.837 1.00 0.00 O ATOM 442 CB MET A 38 4.524 -3.540 -5.634 1.00 0.00 C ATOM 443 CG MET A 38 5.529 -3.519 -6.793 1.00 0.00 C ATOM 444 SD MET A 38 4.902 -4.228 -8.335 1.00 0.00 S ATOM 445 CE MET A 38 4.576 -5.919 -7.834 1.00 0.00 C ATOM 0 H MET A 38 3.143 -2.809 -3.725 1.00 0.00 H new ATOM 0 HA MET A 38 3.623 -1.702 -6.315 1.00 0.00 H new ATOM 0 HB2 MET A 38 5.045 -3.264 -4.717 1.00 0.00 H new ATOM 0 HB3 MET A 38 4.167 -4.561 -5.502 1.00 0.00 H new ATOM 0 HG2 MET A 38 5.832 -2.488 -6.977 1.00 0.00 H new ATOM 0 HG3 MET A 38 6.423 -4.065 -6.493 1.00 0.00 H new ATOM 0 HE1 MET A 38 4.425 -6.538 -8.718 1.00 0.00 H new ATOM 0 HE2 MET A 38 5.424 -6.300 -7.265 1.00 0.00 H new ATOM 0 HE3 MET A 38 3.680 -5.948 -7.213 1.00 0.00 H new ATOM 455 N GLY A 39 1.411 -4.118 -6.000 1.00 0.00 N ATOM 456 CA GLY A 39 0.355 -4.838 -6.695 1.00 0.00 C ATOM 457 C GLY A 39 -0.603 -3.921 -7.434 1.00 0.00 C ATOM 458 O GLY A 39 -0.873 -4.125 -8.617 1.00 0.00 O ATOM 0 H GLY A 39 1.460 -4.302 -4.998 1.00 0.00 H new ATOM 0 HA2 GLY A 39 0.803 -5.533 -7.405 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -0.205 -5.435 -5.975 1.00 0.00 H new ATOM 462 N ASN A 40 -1.121 -2.917 -6.743 1.00 0.00 N ATOM 463 CA ASN A 40 -2.035 -1.975 -7.362 1.00 0.00 C ATOM 464 C ASN A 40 -1.307 -1.151 -8.427 1.00 0.00 C ATOM 465 O ASN A 40 -1.879 -0.801 -9.457 1.00 0.00 O ATOM 466 CB ASN A 40 -2.701 -1.067 -6.306 1.00 0.00 C ATOM 467 CG ASN A 40 -2.115 0.333 -6.237 1.00 0.00 C ATOM 468 OD1 ASN A 40 -1.119 0.515 -5.397 1.00 0.00 O flip ATOM 469 ND2 ASN A 40 -2.564 1.239 -6.928 1.00 0.00 N flip ATOM 0 H ASN A 40 -0.924 -2.736 -5.759 1.00 0.00 H new ATOM 0 HA ASN A 40 -2.830 -2.538 -7.851 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -3.766 -0.994 -6.525 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -2.608 -1.537 -5.327 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -3.337 1.057 -7.568 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -2.164 2.175 -6.864 1.00 0.00 H new ATOM 476 N ALA A 41 -0.033 -0.875 -8.178 1.00 0.00 N ATOM 477 CA ALA A 41 0.784 -0.120 -9.114 1.00 0.00 C ATOM 478 C ALA A 41 1.074 -0.922 -10.381 1.00 0.00 C ATOM 479 O ALA A 41 1.141 -0.360 -11.477 1.00 0.00 O ATOM 480 CB ALA A 41 2.084 0.314 -8.452 1.00 0.00 C ATOM 0 H ALA A 41 0.457 -1.165 -7.331 1.00 0.00 H new ATOM 0 HA ALA A 41 0.221 0.767 -9.405 1.00 0.00 H new ATOM 0 HB1 ALA A 41 2.685 0.878 -9.165 1.00 0.00 H new ATOM 0 HB2 ALA A 41 1.861 0.941 -7.589 1.00 0.00 H new ATOM 0 HB3 ALA A 41 2.638 -0.566 -8.127 1.00 0.00 H new ATOM 486 N SER A 42 1.212 -2.235 -10.245 1.00 0.00 N ATOM 487 CA SER A 42 1.518 -3.077 -11.381 1.00 0.00 C ATOM 488 C SER A 42 0.255 -3.363 -12.176 1.00 0.00 C ATOM 489 O SER A 42 0.273 -3.381 -13.407 1.00 0.00 O ATOM 490 CB SER A 42 2.189 -4.384 -10.932 1.00 0.00 C ATOM 491 OG SER A 42 1.364 -5.106 -10.035 1.00 0.00 O ATOM 0 H SER A 42 1.116 -2.733 -9.360 1.00 0.00 H new ATOM 0 HA SER A 42 2.221 -2.547 -12.024 1.00 0.00 H new ATOM 0 HB2 SER A 42 2.408 -5.001 -11.804 1.00 0.00 H new ATOM 0 HB3 SER A 42 3.142 -4.160 -10.452 1.00 0.00 H new ATOM 0 HG SER A 42 0.860 -5.786 -10.529 1.00 0.00 H new ATOM 497 N VAL A 43 -0.851 -3.566 -11.471 1.00 0.00 N ATOM 498 CA VAL A 43 -2.108 -3.817 -12.137 1.00 0.00 C ATOM 499 C VAL A 43 -2.595 -2.552 -12.831 1.00 0.00 C ATOM 500 O VAL A 43 -3.205 -2.620 -13.895 1.00 0.00 O ATOM 501 CB VAL A 43 -3.199 -4.377 -11.179 1.00 0.00 C ATOM 502 CG1 VAL A 43 -3.608 -3.354 -10.151 1.00 0.00 C ATOM 503 CG2 VAL A 43 -4.411 -4.869 -11.966 1.00 0.00 C ATOM 0 H VAL A 43 -0.897 -3.561 -10.452 1.00 0.00 H new ATOM 0 HA VAL A 43 -1.927 -4.591 -12.883 1.00 0.00 H new ATOM 0 HB VAL A 43 -2.768 -5.225 -10.647 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -4.371 -3.779 -9.499 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -2.740 -3.069 -9.556 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -4.009 -2.474 -10.653 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -5.160 -5.256 -11.276 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -4.835 -4.042 -12.536 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -4.104 -5.661 -12.649 1.00 0.00 H new ATOM 513 N ALA A 44 -2.294 -1.376 -12.255 1.00 0.00 N ATOM 514 CA ALA A 44 -2.657 -0.119 -12.883 1.00 0.00 C ATOM 515 C ALA A 44 -1.779 0.139 -14.091 1.00 0.00 C ATOM 516 O ALA A 44 -2.089 0.964 -14.923 1.00 0.00 O ATOM 517 CB ALA A 44 -2.540 1.027 -11.890 1.00 0.00 C ATOM 0 H ALA A 44 -1.805 -1.282 -11.365 1.00 0.00 H new ATOM 0 HA ALA A 44 -3.694 -0.185 -13.213 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -2.816 1.961 -12.379 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -3.207 0.847 -11.047 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -1.513 1.095 -11.532 1.00 0.00 H new ATOM 523 N SER A 45 -0.701 -0.603 -14.190 1.00 0.00 N ATOM 524 CA SER A 45 0.194 -0.483 -15.319 1.00 0.00 C ATOM 525 C SER A 45 -0.378 -1.255 -16.502 1.00 0.00 C ATOM 526 O SER A 45 0.148 -1.208 -17.611 1.00 0.00 O ATOM 527 CB SER A 45 1.598 -0.992 -14.961 1.00 0.00 C ATOM 528 OG SER A 45 2.194 -0.186 -13.950 1.00 0.00 O ATOM 0 H SER A 45 -0.421 -1.299 -13.499 1.00 0.00 H new ATOM 0 HA SER A 45 0.286 0.569 -15.591 1.00 0.00 H new ATOM 0 HB2 SER A 45 1.537 -2.025 -14.618 1.00 0.00 H new ATOM 0 HB3 SER A 45 2.227 -0.988 -15.851 1.00 0.00 H new ATOM 0 HG SER A 45 1.645 -0.220 -13.139 1.00 0.00 H new ATOM 534 N ARG A 46 -1.470 -1.969 -16.240 1.00 0.00 N ATOM 535 CA ARG A 46 -2.151 -2.735 -17.262 1.00 0.00 C ATOM 536 C ARG A 46 -3.580 -2.211 -17.433 1.00 0.00 C ATOM 537 O ARG A 46 -4.215 -2.413 -18.471 1.00 0.00 O ATOM 538 CB ARG A 46 -2.179 -4.223 -16.859 1.00 0.00 C ATOM 539 CG ARG A 46 -2.719 -5.165 -17.930 1.00 0.00 C ATOM 540 CD ARG A 46 -1.824 -5.182 -19.159 1.00 0.00 C ATOM 541 NE ARG A 46 -0.466 -5.647 -18.850 1.00 0.00 N ATOM 542 CZ ARG A 46 0.648 -4.934 -19.056 1.00 0.00 C ATOM 543 NH1 ARG A 46 0.577 -3.722 -19.602 1.00 0.00 N ATOM 544 NH2 ARG A 46 1.829 -5.442 -18.732 1.00 0.00 N ATOM 0 H ARG A 46 -1.900 -2.028 -15.317 1.00 0.00 H new ATOM 0 HA ARG A 46 -1.620 -2.631 -18.208 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -1.167 -4.534 -16.598 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -2.787 -4.330 -15.961 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -2.799 -6.173 -17.523 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -3.725 -4.856 -18.215 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -2.264 -5.829 -19.918 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -1.775 -4.180 -19.585 1.00 0.00 H new ATOM 0 HE ARG A 46 -0.364 -6.580 -18.450 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -0.329 -3.333 -19.865 1.00 0.00 H new ATOM 0 HH12 ARG A 46 1.428 -3.182 -19.757 1.00 0.00 H new ATOM 0 HH21 ARG A 46 1.888 -6.376 -18.326 1.00 0.00 H new ATOM 0 HH22 ARG A 46 2.678 -4.899 -18.889 1.00 0.00 H new ATOM 558 N ASP A 47 -4.062 -1.520 -16.409 1.00 0.00 N ATOM 559 CA ASP A 47 -5.429 -1.025 -16.383 1.00 0.00 C ATOM 560 C ASP A 47 -5.506 0.498 -16.160 1.00 0.00 C ATOM 561 O ASP A 47 -5.929 1.235 -17.051 1.00 0.00 O ATOM 562 CB ASP A 47 -6.181 -1.756 -15.289 1.00 0.00 C ATOM 563 CG ASP A 47 -7.604 -1.314 -15.173 1.00 0.00 C ATOM 564 OD1 ASP A 47 -8.354 -1.430 -16.167 1.00 0.00 O ATOM 565 OD2 ASP A 47 -7.983 -0.857 -14.087 1.00 0.00 O ATOM 0 H ASP A 47 -3.519 -1.288 -15.577 1.00 0.00 H new ATOM 0 HA ASP A 47 -5.881 -1.215 -17.357 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -6.153 -2.827 -15.488 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -5.676 -1.595 -14.337 1.00 0.00 H new ATOM 570 N LEU A 48 -5.102 0.942 -14.953 1.00 0.00 N ATOM 571 CA LEU A 48 -5.085 2.380 -14.547 1.00 0.00 C ATOM 572 C LEU A 48 -6.414 2.877 -13.962 1.00 0.00 C ATOM 573 O LEU A 48 -6.620 4.086 -13.828 1.00 0.00 O ATOM 574 CB LEU A 48 -4.601 3.325 -15.674 1.00 0.00 C ATOM 575 CG LEU A 48 -3.086 3.561 -15.757 1.00 0.00 C ATOM 576 CD1 LEU A 48 -2.741 4.351 -17.004 1.00 0.00 C ATOM 577 CD2 LEU A 48 -2.584 4.295 -14.510 1.00 0.00 C ATOM 0 H LEU A 48 -4.774 0.315 -14.219 1.00 0.00 H new ATOM 0 HA LEU A 48 -4.350 2.417 -13.743 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -4.937 2.920 -16.629 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -5.092 4.290 -15.546 1.00 0.00 H new ATOM 0 HG LEU A 48 -2.592 2.591 -15.809 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -1.663 4.510 -17.048 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -3.062 3.797 -17.886 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -3.249 5.315 -16.976 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -1.508 4.452 -14.589 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -3.087 5.259 -14.428 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -2.799 3.697 -13.624 1.00 0.00 H new ATOM 589 N LYS A 49 -7.308 1.967 -13.608 1.00 0.00 N ATOM 590 CA LYS A 49 -8.555 2.363 -12.950 1.00 0.00 C ATOM 591 C LYS A 49 -8.790 1.483 -11.725 1.00 0.00 C ATOM 592 O LYS A 49 -9.911 1.364 -11.220 1.00 0.00 O ATOM 593 CB LYS A 49 -9.746 2.302 -13.929 1.00 0.00 C ATOM 594 CG LYS A 49 -10.257 0.904 -14.231 1.00 0.00 C ATOM 595 CD LYS A 49 -11.171 0.890 -15.439 1.00 0.00 C ATOM 596 CE LYS A 49 -10.392 1.134 -16.721 1.00 0.00 C ATOM 597 NZ LYS A 49 -11.282 1.192 -17.901 1.00 0.00 N ATOM 0 H LYS A 49 -7.202 0.964 -13.759 1.00 0.00 H new ATOM 0 HA LYS A 49 -8.468 3.399 -12.621 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -10.566 2.891 -13.518 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -9.452 2.775 -14.866 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -9.412 0.238 -14.406 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -10.793 0.518 -13.364 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -11.684 -0.070 -15.499 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -11.939 1.655 -15.326 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -9.838 2.069 -16.637 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -9.658 0.339 -16.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -10.714 1.360 -18.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -11.792 0.291 -17.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -11.966 1.966 -17.782 1.00 0.00 H new ATOM 611 N ILE A 50 -7.695 0.901 -11.237 1.00 0.00 N ATOM 612 CA ILE A 50 -7.714 0.003 -10.087 1.00 0.00 C ATOM 613 C ILE A 50 -8.281 0.710 -8.834 1.00 0.00 C ATOM 614 O ILE A 50 -8.159 1.930 -8.682 1.00 0.00 O ATOM 615 CB ILE A 50 -6.281 -0.552 -9.791 1.00 0.00 C ATOM 616 CG1 ILE A 50 -6.326 -1.639 -8.706 1.00 0.00 C ATOM 617 CG2 ILE A 50 -5.341 0.577 -9.377 1.00 0.00 C ATOM 618 CD1 ILE A 50 -7.113 -2.873 -9.104 1.00 0.00 C ATOM 0 H ILE A 50 -6.765 1.041 -11.632 1.00 0.00 H new ATOM 0 HA ILE A 50 -8.369 -0.833 -10.333 1.00 0.00 H new ATOM 0 HB ILE A 50 -5.898 -1.002 -10.707 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -5.306 -1.934 -8.459 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -6.764 -1.217 -7.801 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -4.350 0.170 -9.176 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -5.276 1.310 -10.181 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -5.725 1.059 -8.478 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -7.098 -3.593 -8.286 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -8.144 -2.593 -9.322 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -6.664 -3.321 -9.990 1.00 0.00 H new ATOM 630 N GLU A 51 -8.907 -0.064 -7.959 1.00 0.00 N ATOM 631 CA GLU A 51 -9.515 0.467 -6.754 1.00 0.00 C ATOM 632 C GLU A 51 -8.528 0.412 -5.584 1.00 0.00 C ATOM 633 O GLU A 51 -7.675 -0.473 -5.521 1.00 0.00 O ATOM 634 CB GLU A 51 -10.784 -0.328 -6.435 1.00 0.00 C ATOM 635 CG GLU A 51 -11.632 0.252 -5.319 1.00 0.00 C ATOM 636 CD GLU A 51 -12.922 -0.512 -5.135 1.00 0.00 C ATOM 637 OE1 GLU A 51 -13.889 -0.230 -5.866 1.00 0.00 O ATOM 638 OE2 GLU A 51 -12.973 -1.402 -4.267 1.00 0.00 O ATOM 0 H GLU A 51 -9.006 -1.073 -8.066 1.00 0.00 H new ATOM 0 HA GLU A 51 -9.781 1.512 -6.914 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -11.391 -0.394 -7.338 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -10.501 -1.346 -6.166 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -11.066 0.237 -4.388 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -11.857 1.296 -5.539 1.00 0.00 H new ATOM 645 N GLN A 52 -8.652 1.360 -4.667 1.00 0.00 N ATOM 646 CA GLN A 52 -7.755 1.457 -3.520 1.00 0.00 C ATOM 647 C GLN A 52 -8.531 1.439 -2.199 1.00 0.00 C ATOM 648 O GLN A 52 -9.025 2.473 -1.735 1.00 0.00 O ATOM 649 CB GLN A 52 -6.892 2.721 -3.643 1.00 0.00 C ATOM 650 CG GLN A 52 -7.680 3.975 -4.015 1.00 0.00 C ATOM 651 CD GLN A 52 -6.791 5.170 -4.290 1.00 0.00 C ATOM 652 OE1 GLN A 52 -5.663 5.029 -4.750 1.00 0.00 O ATOM 653 NE2 GLN A 52 -7.302 6.357 -4.018 1.00 0.00 N ATOM 0 H GLN A 52 -9.373 2.081 -4.694 1.00 0.00 H new ATOM 0 HA GLN A 52 -7.101 0.585 -3.515 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -6.380 2.893 -2.696 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -6.122 2.551 -4.395 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -8.286 3.769 -4.897 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -8.368 4.219 -3.206 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -8.245 6.431 -3.636 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -6.754 7.200 -4.190 1.00 0.00 H new ATOM 662 N SER A 53 -8.682 0.253 -1.625 1.00 0.00 N ATOM 663 CA SER A 53 -9.386 0.102 -0.355 1.00 0.00 C ATOM 664 C SER A 53 -8.627 -0.844 0.606 1.00 0.00 C ATOM 665 O SER A 53 -7.944 -1.770 0.162 1.00 0.00 O ATOM 666 CB SER A 53 -10.796 -0.423 -0.615 1.00 0.00 C ATOM 667 OG SER A 53 -11.482 0.415 -1.533 1.00 0.00 O ATOM 0 H SER A 53 -8.327 -0.619 -2.017 1.00 0.00 H new ATOM 0 HA SER A 53 -9.442 1.079 0.126 1.00 0.00 H new ATOM 0 HB2 SER A 53 -10.745 -1.438 -1.010 1.00 0.00 H new ATOM 0 HB3 SER A 53 -11.349 -0.473 0.323 1.00 0.00 H new ATOM 0 HG SER A 53 -12.383 0.062 -1.688 1.00 0.00 H new ATOM 673 N PRO A 54 -8.769 -0.614 1.944 1.00 0.00 N ATOM 674 CA PRO A 54 -8.090 -1.419 3.007 1.00 0.00 C ATOM 675 C PRO A 54 -8.550 -2.886 3.053 1.00 0.00 C ATOM 676 O PRO A 54 -7.992 -3.705 3.772 1.00 0.00 O ATOM 677 CB PRO A 54 -8.507 -0.703 4.301 1.00 0.00 C ATOM 678 CG PRO A 54 -9.760 0.022 3.953 1.00 0.00 C ATOM 679 CD PRO A 54 -9.596 0.460 2.532 1.00 0.00 C ATOM 0 HA PRO A 54 -7.015 -1.472 2.837 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -8.674 -1.415 5.110 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -7.733 -0.014 4.638 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -10.630 -0.625 4.065 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -9.912 0.878 4.611 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -10.557 0.552 2.025 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -9.105 1.431 2.463 1.00 0.00 H new ATOM 687 N GLU A 55 -9.573 -3.198 2.292 1.00 0.00 N ATOM 688 CA GLU A 55 -10.095 -4.556 2.235 1.00 0.00 C ATOM 689 C GLU A 55 -9.488 -5.319 1.063 1.00 0.00 C ATOM 690 O GLU A 55 -9.565 -6.545 0.998 1.00 0.00 O ATOM 691 CB GLU A 55 -11.619 -4.549 2.122 1.00 0.00 C ATOM 692 CG GLU A 55 -12.329 -4.023 3.358 1.00 0.00 C ATOM 693 CD GLU A 55 -13.835 -4.064 3.216 1.00 0.00 C ATOM 694 OE1 GLU A 55 -14.426 -5.136 3.456 1.00 0.00 O ATOM 695 OE2 GLU A 55 -14.431 -3.029 2.858 1.00 0.00 O ATOM 0 H GLU A 55 -10.067 -2.531 1.699 1.00 0.00 H new ATOM 0 HA GLU A 55 -9.818 -5.059 3.161 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -11.906 -3.941 1.264 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -11.963 -5.564 1.923 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -12.032 -4.614 4.224 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -12.012 -2.998 3.548 1.00 0.00 H new ATOM 702 N LEU A 56 -8.871 -4.589 0.145 1.00 0.00 N ATOM 703 CA LEU A 56 -8.283 -5.196 -1.036 1.00 0.00 C ATOM 704 C LEU A 56 -6.887 -5.714 -0.745 1.00 0.00 C ATOM 705 O LEU A 56 -6.476 -6.745 -1.271 1.00 0.00 O ATOM 706 CB LEU A 56 -8.261 -4.206 -2.201 1.00 0.00 C ATOM 707 CG LEU A 56 -9.634 -3.716 -2.676 1.00 0.00 C ATOM 708 CD1 LEU A 56 -9.483 -2.722 -3.810 1.00 0.00 C ATOM 709 CD2 LEU A 56 -10.507 -4.889 -3.107 1.00 0.00 C ATOM 0 H LEU A 56 -8.766 -3.576 0.197 1.00 0.00 H new ATOM 0 HA LEU A 56 -8.904 -6.045 -1.321 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -7.667 -3.340 -1.908 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -7.750 -4.673 -3.043 1.00 0.00 H new ATOM 0 HG LEU A 56 -10.123 -3.214 -1.841 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -10.468 -2.386 -4.133 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -8.902 -1.866 -3.468 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -8.970 -3.198 -4.646 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -11.476 -4.518 -3.440 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -10.022 -5.422 -3.925 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -10.648 -5.567 -2.265 1.00 0.00 H new ATOM 721 N SER A 57 -6.160 -4.995 0.097 1.00 0.00 N ATOM 722 CA SER A 57 -4.829 -5.399 0.508 1.00 0.00 C ATOM 723 C SER A 57 -4.883 -6.726 1.260 1.00 0.00 C ATOM 724 O SER A 57 -4.243 -7.699 0.867 1.00 0.00 O ATOM 725 CB SER A 57 -4.250 -4.307 1.379 1.00 0.00 C ATOM 726 OG SER A 57 -5.288 -3.693 2.115 1.00 0.00 O ATOM 0 H SER A 57 -6.477 -4.119 0.512 1.00 0.00 H new ATOM 0 HA SER A 57 -4.194 -5.545 -0.366 1.00 0.00 H new ATOM 0 HB2 SER A 57 -3.506 -4.724 2.058 1.00 0.00 H new ATOM 0 HB3 SER A 57 -3.740 -3.567 0.762 1.00 0.00 H new ATOM 0 HG SER A 57 -5.254 -3.998 3.046 1.00 0.00 H new ATOM 732 N ALA A 58 -5.642 -6.746 2.354 1.00 0.00 N ATOM 733 CA ALA A 58 -5.879 -7.974 3.119 1.00 0.00 C ATOM 734 C ALA A 58 -6.283 -9.134 2.195 1.00 0.00 C ATOM 735 O ALA A 58 -5.953 -10.290 2.450 1.00 0.00 O ATOM 736 CB ALA A 58 -6.949 -7.739 4.175 1.00 0.00 C ATOM 0 H ALA A 58 -6.107 -5.922 2.734 1.00 0.00 H new ATOM 0 HA ALA A 58 -4.948 -8.249 3.615 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -7.115 -8.659 4.736 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -6.622 -6.953 4.856 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -7.878 -7.436 3.691 1.00 0.00 H new ATOM 742 N LYS A 59 -6.977 -8.807 1.118 1.00 0.00 N ATOM 743 CA LYS A 59 -7.419 -9.797 0.150 1.00 0.00 C ATOM 744 C LYS A 59 -6.238 -10.288 -0.708 1.00 0.00 C ATOM 745 O LYS A 59 -6.004 -11.490 -0.818 1.00 0.00 O ATOM 746 CB LYS A 59 -8.516 -9.193 -0.736 1.00 0.00 C ATOM 747 CG LYS A 59 -9.150 -10.160 -1.721 1.00 0.00 C ATOM 748 CD LYS A 59 -10.252 -9.470 -2.512 1.00 0.00 C ATOM 749 CE LYS A 59 -10.961 -10.424 -3.460 1.00 0.00 C ATOM 750 NZ LYS A 59 -10.056 -10.950 -4.511 1.00 0.00 N ATOM 0 H LYS A 59 -7.249 -7.851 0.890 1.00 0.00 H new ATOM 0 HA LYS A 59 -7.824 -10.657 0.683 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -9.298 -8.787 -0.094 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -8.093 -8.356 -1.292 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -8.391 -10.544 -2.403 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -9.560 -11.016 -1.186 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -10.978 -9.040 -1.822 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -9.826 -8.644 -3.082 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -11.376 -11.256 -2.891 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -11.799 -9.910 -3.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -10.605 -11.514 -5.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -9.601 -10.157 -5.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -9.327 -11.549 -4.073 1.00 0.00 H new ATOM 764 N VAL A 60 -5.489 -9.348 -1.288 1.00 0.00 N ATOM 765 CA VAL A 60 -4.349 -9.674 -2.170 1.00 0.00 C ATOM 766 C VAL A 60 -3.244 -10.460 -1.431 1.00 0.00 C ATOM 767 O VAL A 60 -2.438 -11.135 -2.053 1.00 0.00 O ATOM 768 CB VAL A 60 -3.745 -8.398 -2.841 1.00 0.00 C ATOM 769 CG1 VAL A 60 -2.945 -7.566 -1.856 1.00 0.00 C ATOM 770 CG2 VAL A 60 -2.895 -8.767 -4.050 1.00 0.00 C ATOM 0 H VAL A 60 -5.647 -8.348 -1.166 1.00 0.00 H new ATOM 0 HA VAL A 60 -4.750 -10.315 -2.955 1.00 0.00 H new ATOM 0 HB VAL A 60 -4.581 -7.787 -3.182 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -2.543 -6.689 -2.363 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -3.592 -7.248 -1.039 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -2.124 -8.163 -1.458 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -2.487 -7.861 -4.498 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -2.078 -9.416 -3.736 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -3.511 -9.288 -4.783 1.00 0.00 H new ATOM 780 N VAL A 61 -3.237 -10.389 -0.109 1.00 0.00 N ATOM 781 CA VAL A 61 -2.219 -11.094 0.664 1.00 0.00 C ATOM 782 C VAL A 61 -2.742 -12.449 1.163 1.00 0.00 C ATOM 783 O VAL A 61 -2.104 -13.482 0.960 1.00 0.00 O ATOM 784 CB VAL A 61 -1.642 -10.239 1.843 1.00 0.00 C ATOM 785 CG1 VAL A 61 -2.713 -9.851 2.850 1.00 0.00 C ATOM 786 CG2 VAL A 61 -0.492 -10.972 2.529 1.00 0.00 C ATOM 0 H VAL A 61 -3.911 -9.861 0.446 1.00 0.00 H new ATOM 0 HA VAL A 61 -1.387 -11.276 -0.017 1.00 0.00 H new ATOM 0 HB VAL A 61 -1.259 -9.314 1.412 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -2.265 -9.260 3.648 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -3.484 -9.263 2.352 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -3.159 -10.752 3.272 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -0.106 -10.361 3.345 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -0.851 -11.922 2.926 1.00 0.00 H new ATOM 0 HG23 VAL A 61 0.303 -11.158 1.807 1.00 0.00 H new ATOM 796 N GLU A 62 -3.910 -12.430 1.800 1.00 0.00 N ATOM 797 CA GLU A 62 -4.527 -13.650 2.316 1.00 0.00 C ATOM 798 C GLU A 62 -4.784 -14.664 1.205 1.00 0.00 C ATOM 799 O GLU A 62 -4.493 -15.850 1.356 1.00 0.00 O ATOM 800 CB GLU A 62 -5.837 -13.334 3.031 1.00 0.00 C ATOM 801 CG GLU A 62 -6.526 -14.561 3.605 1.00 0.00 C ATOM 802 CD GLU A 62 -7.896 -14.258 4.149 1.00 0.00 C ATOM 803 OE1 GLU A 62 -7.990 -13.775 5.293 1.00 0.00 O ATOM 804 OE2 GLU A 62 -8.899 -14.520 3.438 1.00 0.00 O ATOM 0 H GLU A 62 -4.450 -11.582 1.972 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.826 -14.088 3.026 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -5.640 -12.627 3.837 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -6.513 -12.841 2.333 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -6.608 -15.322 2.829 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -5.909 -14.981 4.400 1.00 0.00 H new ATOM 811 N LYS A 63 -5.321 -14.196 0.090 1.00 0.00 N ATOM 812 CA LYS A 63 -5.665 -15.092 -0.995 1.00 0.00 C ATOM 813 C LYS A 63 -4.417 -15.611 -1.700 1.00 0.00 C ATOM 814 O LYS A 63 -4.246 -16.809 -1.848 1.00 0.00 O ATOM 815 CB LYS A 63 -6.616 -14.419 -1.993 1.00 0.00 C ATOM 816 CG LYS A 63 -7.875 -13.832 -1.354 1.00 0.00 C ATOM 817 CD LYS A 63 -8.556 -14.822 -0.420 1.00 0.00 C ATOM 818 CE LYS A 63 -9.833 -14.243 0.167 1.00 0.00 C ATOM 819 NZ LYS A 63 -10.393 -15.106 1.235 1.00 0.00 N ATOM 0 H LYS A 63 -5.525 -13.212 -0.084 1.00 0.00 H new ATOM 0 HA LYS A 63 -6.185 -15.946 -0.561 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -6.079 -13.624 -2.511 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -6.910 -15.149 -2.747 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -7.613 -12.931 -0.799 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -8.573 -13.533 -2.136 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -8.787 -15.738 -0.964 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -7.874 -15.093 0.386 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -9.629 -13.251 0.571 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -10.572 -14.119 -0.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -11.390 -14.857 1.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -10.328 -16.103 0.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -9.855 -14.965 2.114 1.00 0.00 H new ATOM 833 N LEU A 64 -3.576 -14.702 -2.146 1.00 0.00 N ATOM 834 CA LEU A 64 -2.316 -15.066 -2.810 1.00 0.00 C ATOM 835 C LEU A 64 -1.536 -16.147 -2.028 1.00 0.00 C ATOM 836 O LEU A 64 -0.947 -17.050 -2.623 1.00 0.00 O ATOM 837 CB LEU A 64 -1.443 -13.834 -3.027 1.00 0.00 C ATOM 838 CG LEU A 64 -0.148 -14.069 -3.801 1.00 0.00 C ATOM 839 CD1 LEU A 64 -0.450 -14.686 -5.161 1.00 0.00 C ATOM 840 CD2 LEU A 64 0.621 -12.764 -3.958 1.00 0.00 C ATOM 0 H LEU A 64 -3.732 -13.697 -2.066 1.00 0.00 H new ATOM 0 HA LEU A 64 -2.578 -15.489 -3.780 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -2.030 -13.084 -3.557 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -1.192 -13.413 -2.053 1.00 0.00 H new ATOM 0 HG LEU A 64 0.474 -14.766 -3.239 1.00 0.00 H new ATOM 0 HD11 LEU A 64 0.482 -14.848 -5.702 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -0.960 -15.639 -5.023 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -1.089 -14.012 -5.732 1.00 0.00 H new ATOM 0 HD21 LEU A 64 1.542 -12.948 -4.512 1.00 0.00 H new ATOM 0 HD22 LEU A 64 0.009 -12.044 -4.501 1.00 0.00 H new ATOM 0 HD23 LEU A 64 0.864 -12.364 -2.974 1.00 0.00 H new ATOM 852 N ASN A 65 -1.557 -16.049 -0.698 1.00 0.00 N ATOM 853 CA ASN A 65 -0.855 -16.999 0.185 1.00 0.00 C ATOM 854 C ASN A 65 -1.325 -18.446 -0.016 1.00 0.00 C ATOM 855 O ASN A 65 -0.626 -19.380 0.339 1.00 0.00 O ATOM 856 CB ASN A 65 -1.036 -16.587 1.652 1.00 0.00 C ATOM 857 CG ASN A 65 -0.179 -17.404 2.606 1.00 0.00 C ATOM 858 OD1 ASN A 65 0.937 -17.802 2.275 1.00 0.00 O ATOM 859 ND2 ASN A 65 -0.698 -17.659 3.794 1.00 0.00 N ATOM 0 H ASN A 65 -2.057 -15.314 -0.198 1.00 0.00 H new ATOM 0 HA ASN A 65 0.202 -16.964 -0.081 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -0.787 -15.531 1.761 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -2.085 -16.697 1.928 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -0.169 -18.204 4.475 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -1.627 -17.311 4.030 1.00 0.00 H new ATOM 866 N GLN A 66 -2.489 -18.625 -0.617 1.00 0.00 N ATOM 867 CA GLN A 66 -2.991 -19.972 -0.842 1.00 0.00 C ATOM 868 C GLN A 66 -2.409 -20.501 -2.136 1.00 0.00 C ATOM 869 O GLN A 66 -2.109 -21.675 -2.256 1.00 0.00 O ATOM 870 CB GLN A 66 -4.527 -20.031 -0.848 1.00 0.00 C ATOM 871 CG GLN A 66 -5.183 -19.574 -2.132 1.00 0.00 C ATOM 872 CD GLN A 66 -6.615 -19.181 -1.918 1.00 0.00 C ATOM 873 OE1 GLN A 66 -6.811 -17.936 -1.562 1.00 0.00 O flip ATOM 874 NE2 GLN A 66 -7.530 -19.991 -2.055 1.00 0.00 N flip ATOM 0 H GLN A 66 -3.093 -17.874 -0.952 1.00 0.00 H new ATOM 0 HA GLN A 66 -2.673 -20.605 -0.014 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -4.836 -21.056 -0.646 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -4.902 -19.417 -0.029 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -4.631 -18.727 -2.541 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -5.132 -20.374 -2.871 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -7.324 -20.950 -2.334 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -8.495 -19.704 -1.889 1.00 0.00 H new ATOM 883 N VAL A 67 -2.243 -19.608 -3.105 1.00 0.00 N ATOM 884 CA VAL A 67 -1.614 -19.953 -4.368 1.00 0.00 C ATOM 885 C VAL A 67 -0.161 -20.327 -4.120 1.00 0.00 C ATOM 886 O VAL A 67 0.308 -21.370 -4.565 1.00 0.00 O ATOM 887 CB VAL A 67 -1.673 -18.780 -5.373 1.00 0.00 C ATOM 888 CG1 VAL A 67 -1.114 -19.198 -6.727 1.00 0.00 C ATOM 889 CG2 VAL A 67 -3.096 -18.260 -5.513 1.00 0.00 C ATOM 0 H VAL A 67 -2.539 -18.634 -3.036 1.00 0.00 H new ATOM 0 HA VAL A 67 -2.157 -20.795 -4.797 1.00 0.00 H new ATOM 0 HB VAL A 67 -1.053 -17.971 -4.986 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -1.166 -18.356 -7.418 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -0.076 -19.509 -6.612 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -1.700 -20.028 -7.122 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -3.113 -17.435 -6.225 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -3.743 -19.061 -5.870 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -3.453 -17.911 -4.544 1.00 0.00 H new ATOM 899 N CYS A 68 0.540 -19.477 -3.372 1.00 0.00 N ATOM 900 CA CYS A 68 1.937 -19.716 -3.022 1.00 0.00 C ATOM 901 C CYS A 68 2.062 -20.859 -2.010 1.00 0.00 C ATOM 902 O CYS A 68 3.163 -21.276 -1.661 1.00 0.00 O ATOM 903 CB CYS A 68 2.547 -18.436 -2.463 1.00 0.00 C ATOM 904 SG CYS A 68 2.214 -16.962 -3.494 1.00 0.00 S ATOM 0 H CYS A 68 0.158 -18.610 -2.994 1.00 0.00 H new ATOM 0 HA CYS A 68 2.479 -20.010 -3.921 1.00 0.00 H new ATOM 0 HB2 CYS A 68 2.157 -18.264 -1.460 1.00 0.00 H new ATOM 0 HB3 CYS A 68 3.625 -18.567 -2.368 1.00 0.00 H new ATOM 909 N ALA A 69 0.923 -21.360 -1.546 1.00 0.00 N ATOM 910 CA ALA A 69 0.905 -22.507 -0.646 1.00 0.00 C ATOM 911 C ALA A 69 0.807 -23.782 -1.473 1.00 0.00 C ATOM 912 O ALA A 69 1.143 -24.873 -1.014 1.00 0.00 O ATOM 913 CB ALA A 69 -0.251 -22.419 0.336 1.00 0.00 C ATOM 0 H ALA A 69 0.001 -20.991 -1.778 1.00 0.00 H new ATOM 0 HA ALA A 69 1.826 -22.515 -0.063 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -0.237 -23.288 0.993 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -0.154 -21.512 0.932 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -1.193 -22.393 -0.212 1.00 0.00 H new ATOM 919 N LYS A 70 0.353 -23.620 -2.712 1.00 0.00 N ATOM 920 CA LYS A 70 0.235 -24.728 -3.648 1.00 0.00 C ATOM 921 C LYS A 70 1.563 -24.965 -4.318 1.00 0.00 C ATOM 922 O LYS A 70 1.866 -26.076 -4.757 1.00 0.00 O ATOM 923 CB LYS A 70 -0.831 -24.434 -4.709 1.00 0.00 C ATOM 924 CG LYS A 70 -2.215 -24.967 -4.381 1.00 0.00 C ATOM 925 CD LYS A 70 -2.728 -24.452 -3.053 1.00 0.00 C ATOM 926 CE LYS A 70 -4.148 -24.904 -2.817 1.00 0.00 C ATOM 927 NZ LYS A 70 -4.684 -24.430 -1.519 1.00 0.00 N ATOM 0 H LYS A 70 0.058 -22.721 -3.092 1.00 0.00 H new ATOM 0 HA LYS A 70 -0.064 -25.619 -3.095 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -0.896 -23.355 -4.850 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -0.507 -24.861 -5.658 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -2.909 -24.681 -5.172 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -2.187 -26.056 -4.360 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -2.088 -24.811 -2.247 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -2.680 -23.363 -3.037 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -4.782 -24.537 -3.624 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -4.190 -25.993 -2.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -5.661 -24.766 -1.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -4.097 -24.800 -0.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -4.671 -23.390 -1.497 1.00 0.00 H new ATOM 941 N ASP A 71 2.354 -23.917 -4.382 1.00 0.00 N ATOM 942 CA ASP A 71 3.675 -23.969 -4.979 1.00 0.00 C ATOM 943 C ASP A 71 4.581 -22.966 -4.271 1.00 0.00 C ATOM 944 O ASP A 71 4.569 -21.776 -4.586 1.00 0.00 O ATOM 945 CB ASP A 71 3.607 -23.654 -6.478 1.00 0.00 C ATOM 946 CG ASP A 71 4.939 -23.832 -7.187 1.00 0.00 C ATOM 947 OD1 ASP A 71 5.307 -24.986 -7.488 1.00 0.00 O ATOM 948 OD2 ASP A 71 5.603 -22.821 -7.485 1.00 0.00 O ATOM 0 H ASP A 71 2.100 -22.998 -4.020 1.00 0.00 H new ATOM 0 HA ASP A 71 4.079 -24.975 -4.865 1.00 0.00 H new ATOM 0 HB2 ASP A 71 2.864 -24.301 -6.945 1.00 0.00 H new ATOM 0 HB3 ASP A 71 3.265 -22.628 -6.612 1.00 0.00 H new ATOM 953 N PRO A 72 5.351 -23.434 -3.274 1.00 0.00 N ATOM 954 CA PRO A 72 6.240 -22.570 -2.471 1.00 0.00 C ATOM 955 C PRO A 72 7.344 -21.921 -3.302 1.00 0.00 C ATOM 956 O PRO A 72 7.976 -20.959 -2.869 1.00 0.00 O ATOM 957 CB PRO A 72 6.852 -23.537 -1.441 1.00 0.00 C ATOM 958 CG PRO A 72 5.946 -24.723 -1.438 1.00 0.00 C ATOM 959 CD PRO A 72 5.413 -24.835 -2.835 1.00 0.00 C ATOM 0 HA PRO A 72 5.692 -21.738 -2.029 1.00 0.00 H new ATOM 0 HB2 PRO A 72 7.868 -23.817 -1.718 1.00 0.00 H new ATOM 0 HB3 PRO A 72 6.906 -23.079 -0.453 1.00 0.00 H new ATOM 0 HG2 PRO A 72 6.485 -25.626 -1.152 1.00 0.00 H new ATOM 0 HG3 PRO A 72 5.136 -24.594 -0.720 1.00 0.00 H new ATOM 0 HD2 PRO A 72 6.069 -25.429 -3.471 1.00 0.00 H new ATOM 0 HD3 PRO A 72 4.432 -25.309 -2.857 1.00 0.00 H new ATOM 967 N GLN A 73 7.569 -22.453 -4.495 1.00 0.00 N ATOM 968 CA GLN A 73 8.593 -21.942 -5.393 1.00 0.00 C ATOM 969 C GLN A 73 8.199 -20.588 -5.991 1.00 0.00 C ATOM 970 O GLN A 73 8.999 -19.949 -6.683 1.00 0.00 O ATOM 971 CB GLN A 73 8.877 -22.947 -6.524 1.00 0.00 C ATOM 972 CG GLN A 73 9.542 -24.253 -6.081 1.00 0.00 C ATOM 973 CD GLN A 73 8.620 -25.173 -5.302 1.00 0.00 C ATOM 974 OE1 GLN A 73 8.558 -25.121 -4.075 1.00 0.00 O ATOM 975 NE2 GLN A 73 7.890 -26.010 -6.011 1.00 0.00 N ATOM 0 H GLN A 73 7.049 -23.248 -4.866 1.00 0.00 H new ATOM 0 HA GLN A 73 9.498 -21.802 -4.801 1.00 0.00 H new ATOM 0 HB2 GLN A 73 7.937 -23.187 -7.021 1.00 0.00 H new ATOM 0 HB3 GLN A 73 9.515 -22.466 -7.265 1.00 0.00 H new ATOM 0 HG2 GLN A 73 9.908 -24.781 -6.962 1.00 0.00 H new ATOM 0 HG3 GLN A 73 10.411 -24.018 -5.466 1.00 0.00 H new ATOM 0 HE21 GLN A 73 7.971 -26.022 -7.028 1.00 0.00 H new ATOM 0 HE22 GLN A 73 7.244 -26.646 -5.543 1.00 0.00 H new ATOM 984 N MET A 74 6.973 -20.154 -5.729 1.00 0.00 N ATOM 985 CA MET A 74 6.493 -18.882 -6.235 1.00 0.00 C ATOM 986 C MET A 74 6.861 -17.746 -5.296 1.00 0.00 C ATOM 987 O MET A 74 6.278 -17.601 -4.220 1.00 0.00 O ATOM 988 CB MET A 74 4.974 -18.910 -6.451 1.00 0.00 C ATOM 989 CG MET A 74 4.521 -19.841 -7.561 1.00 0.00 C ATOM 990 SD MET A 74 2.730 -19.809 -7.823 1.00 0.00 S ATOM 991 CE MET A 74 2.474 -18.089 -8.260 1.00 0.00 C ATOM 0 H MET A 74 6.294 -20.668 -5.167 1.00 0.00 H new ATOM 0 HA MET A 74 6.978 -18.711 -7.196 1.00 0.00 H new ATOM 0 HB2 MET A 74 4.491 -19.210 -5.521 1.00 0.00 H new ATOM 0 HB3 MET A 74 4.632 -17.900 -6.677 1.00 0.00 H new ATOM 0 HG2 MET A 74 5.023 -19.564 -8.488 1.00 0.00 H new ATOM 0 HG3 MET A 74 4.830 -20.859 -7.323 1.00 0.00 H new ATOM 0 HE1 MET A 74 1.524 -17.984 -8.784 1.00 0.00 H new ATOM 0 HE2 MET A 74 2.458 -17.482 -7.355 1.00 0.00 H new ATOM 0 HE3 MET A 74 3.284 -17.754 -8.908 1.00 0.00 H new ATOM 1001 N LEU A 75 7.849 -16.959 -5.694 1.00 0.00 N ATOM 1002 CA LEU A 75 8.270 -15.800 -4.916 1.00 0.00 C ATOM 1003 C LEU A 75 7.193 -14.726 -4.977 1.00 0.00 C ATOM 1004 O LEU A 75 6.489 -14.595 -5.980 1.00 0.00 O ATOM 1005 CB LEU A 75 9.594 -15.251 -5.457 1.00 0.00 C ATOM 1006 CG LEU A 75 10.744 -16.262 -5.552 1.00 0.00 C ATOM 1007 CD1 LEU A 75 12.013 -15.584 -6.048 1.00 0.00 C ATOM 1008 CD2 LEU A 75 10.987 -16.936 -4.206 1.00 0.00 C ATOM 0 H LEU A 75 8.377 -17.101 -6.555 1.00 0.00 H new ATOM 0 HA LEU A 75 8.418 -16.101 -3.879 1.00 0.00 H new ATOM 0 HB2 LEU A 75 9.416 -14.837 -6.449 1.00 0.00 H new ATOM 0 HB3 LEU A 75 9.912 -14.426 -4.819 1.00 0.00 H new ATOM 0 HG LEU A 75 10.461 -17.031 -6.271 1.00 0.00 H new ATOM 0 HD11 LEU A 75 12.817 -16.317 -6.109 1.00 0.00 H new ATOM 0 HD12 LEU A 75 11.836 -15.157 -7.035 1.00 0.00 H new ATOM 0 HD13 LEU A 75 12.296 -14.791 -5.356 1.00 0.00 H new ATOM 0 HD21 LEU A 75 11.807 -17.648 -4.299 1.00 0.00 H new ATOM 0 HD22 LEU A 75 11.244 -16.182 -3.462 1.00 0.00 H new ATOM 0 HD23 LEU A 75 10.084 -17.461 -3.893 1.00 0.00 H new ATOM 1020 N LEU A 76 7.098 -13.962 -3.910 1.00 0.00 N ATOM 1021 CA LEU A 76 6.081 -12.934 -3.737 1.00 0.00 C ATOM 1022 C LEU A 76 6.043 -11.950 -4.907 1.00 0.00 C ATOM 1023 O LEU A 76 4.972 -11.643 -5.425 1.00 0.00 O ATOM 1024 CB LEU A 76 6.330 -12.203 -2.399 1.00 0.00 C ATOM 1025 CG LEU A 76 5.361 -11.075 -2.017 1.00 0.00 C ATOM 1026 CD1 LEU A 76 5.262 -10.974 -0.505 1.00 0.00 C ATOM 1027 CD2 LEU A 76 5.833 -9.743 -2.590 1.00 0.00 C ATOM 0 H LEU A 76 7.737 -14.036 -3.119 1.00 0.00 H new ATOM 0 HA LEU A 76 5.103 -13.415 -3.716 1.00 0.00 H new ATOM 0 HB2 LEU A 76 6.313 -12.946 -1.602 1.00 0.00 H new ATOM 0 HB3 LEU A 76 7.337 -11.787 -2.425 1.00 0.00 H new ATOM 0 HG LEU A 76 4.380 -11.305 -2.433 1.00 0.00 H new ATOM 0 HD11 LEU A 76 4.573 -10.172 -0.238 1.00 0.00 H new ATOM 0 HD12 LEU A 76 4.895 -11.917 -0.101 1.00 0.00 H new ATOM 0 HD13 LEU A 76 6.247 -10.760 -0.089 1.00 0.00 H new ATOM 0 HD21 LEU A 76 5.133 -8.957 -2.308 1.00 0.00 H new ATOM 0 HD22 LEU A 76 6.821 -9.507 -2.196 1.00 0.00 H new ATOM 0 HD23 LEU A 76 5.883 -9.812 -3.677 1.00 0.00 H new ATOM 1039 N ILE A 77 7.209 -11.478 -5.331 1.00 0.00 N ATOM 1040 CA ILE A 77 7.283 -10.486 -6.400 1.00 0.00 C ATOM 1041 C ILE A 77 6.642 -10.997 -7.704 1.00 0.00 C ATOM 1042 O ILE A 77 5.925 -10.264 -8.380 1.00 0.00 O ATOM 1043 CB ILE A 77 8.749 -10.023 -6.660 1.00 0.00 C ATOM 1044 CG1 ILE A 77 8.773 -8.788 -7.568 1.00 0.00 C ATOM 1045 CG2 ILE A 77 9.597 -11.147 -7.252 1.00 0.00 C ATOM 1046 CD1 ILE A 77 8.171 -7.552 -6.927 1.00 0.00 C ATOM 0 H ILE A 77 8.113 -11.763 -4.954 1.00 0.00 H new ATOM 0 HA ILE A 77 6.711 -9.623 -6.060 1.00 0.00 H new ATOM 0 HB ILE A 77 9.186 -9.754 -5.698 1.00 0.00 H new ATOM 0 HG12 ILE A 77 9.804 -8.575 -7.851 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.230 -9.012 -8.486 1.00 0.00 H new ATOM 0 HG21 ILE A 77 10.612 -10.787 -7.420 1.00 0.00 H new ATOM 0 HG22 ILE A 77 9.620 -11.989 -6.560 1.00 0.00 H new ATOM 0 HG23 ILE A 77 9.165 -11.468 -8.200 1.00 0.00 H new ATOM 0 HD11 ILE A 77 8.222 -6.718 -7.627 1.00 0.00 H new ATOM 0 HD12 ILE A 77 7.130 -7.746 -6.669 1.00 0.00 H new ATOM 0 HD13 ILE A 77 8.728 -7.303 -6.024 1.00 0.00 H new ATOM 1058 N THR A 78 6.896 -12.254 -8.040 1.00 0.00 N ATOM 1059 CA THR A 78 6.343 -12.849 -9.236 1.00 0.00 C ATOM 1060 C THR A 78 4.884 -13.239 -9.020 1.00 0.00 C ATOM 1061 O THR A 78 4.046 -13.029 -9.886 1.00 0.00 O ATOM 1062 CB THR A 78 7.155 -14.089 -9.647 1.00 0.00 C ATOM 1063 OG1 THR A 78 8.550 -13.753 -9.684 1.00 0.00 O ATOM 1064 CG2 THR A 78 6.724 -14.596 -11.017 1.00 0.00 C ATOM 0 H THR A 78 7.486 -12.881 -7.493 1.00 0.00 H new ATOM 0 HA THR A 78 6.395 -12.109 -10.035 1.00 0.00 H new ATOM 0 HB THR A 78 6.976 -14.876 -8.915 1.00 0.00 H new ATOM 0 HG1 THR A 78 9.070 -14.542 -9.944 1.00 0.00 H new ATOM 0 HG21 THR A 78 7.314 -15.473 -11.283 1.00 0.00 H new ATOM 0 HG22 THR A 78 5.668 -14.864 -10.990 1.00 0.00 H new ATOM 0 HG23 THR A 78 6.881 -13.814 -11.760 1.00 0.00 H new ATOM 1072 N ALA A 79 4.602 -13.814 -7.860 1.00 0.00 N ATOM 1073 CA ALA A 79 3.250 -14.234 -7.497 1.00 0.00 C ATOM 1074 C ALA A 79 2.214 -13.117 -7.704 1.00 0.00 C ATOM 1075 O ALA A 79 1.111 -13.372 -8.202 1.00 0.00 O ATOM 1076 CB ALA A 79 3.233 -14.726 -6.064 1.00 0.00 C ATOM 0 H ALA A 79 5.301 -14.004 -7.142 1.00 0.00 H new ATOM 0 HA ALA A 79 2.966 -15.049 -8.163 1.00 0.00 H new ATOM 0 HB1 ALA A 79 2.223 -15.038 -5.798 1.00 0.00 H new ATOM 0 HB2 ALA A 79 3.913 -15.572 -5.962 1.00 0.00 H new ATOM 0 HB3 ALA A 79 3.551 -13.923 -5.400 1.00 0.00 H new ATOM 1082 N ILE A 80 2.578 -11.886 -7.334 1.00 0.00 N ATOM 1083 CA ILE A 80 1.687 -10.731 -7.497 1.00 0.00 C ATOM 1084 C ILE A 80 1.266 -10.550 -8.966 1.00 0.00 C ATOM 1085 O ILE A 80 0.129 -10.161 -9.255 1.00 0.00 O ATOM 1086 CB ILE A 80 2.349 -9.422 -6.980 1.00 0.00 C ATOM 1087 CG1 ILE A 80 2.655 -9.532 -5.482 1.00 0.00 C ATOM 1088 CG2 ILE A 80 1.453 -8.216 -7.254 1.00 0.00 C ATOM 1089 CD1 ILE A 80 3.332 -8.306 -4.902 1.00 0.00 C ATOM 0 H ILE A 80 3.483 -11.662 -6.920 1.00 0.00 H new ATOM 0 HA ILE A 80 0.799 -10.933 -6.899 1.00 0.00 H new ATOM 0 HB ILE A 80 3.287 -9.279 -7.517 1.00 0.00 H new ATOM 0 HG12 ILE A 80 1.724 -9.710 -4.943 1.00 0.00 H new ATOM 0 HG13 ILE A 80 3.292 -10.400 -5.314 1.00 0.00 H new ATOM 0 HG21 ILE A 80 1.936 -7.312 -6.884 1.00 0.00 H new ATOM 0 HG22 ILE A 80 1.285 -8.124 -8.327 1.00 0.00 H new ATOM 0 HG23 ILE A 80 0.497 -8.350 -6.747 1.00 0.00 H new ATOM 0 HD11 ILE A 80 3.516 -8.460 -3.839 1.00 0.00 H new ATOM 0 HD12 ILE A 80 4.280 -8.138 -5.413 1.00 0.00 H new ATOM 0 HD13 ILE A 80 2.688 -7.437 -5.036 1.00 0.00 H new ATOM 1101 N ASP A 81 2.178 -10.867 -9.885 1.00 0.00 N ATOM 1102 CA ASP A 81 1.909 -10.747 -11.326 1.00 0.00 C ATOM 1103 C ASP A 81 0.711 -11.604 -11.720 1.00 0.00 C ATOM 1104 O ASP A 81 -0.143 -11.184 -12.498 1.00 0.00 O ATOM 1105 CB ASP A 81 3.140 -11.169 -12.138 1.00 0.00 C ATOM 1106 CG ASP A 81 2.927 -11.062 -13.638 1.00 0.00 C ATOM 1107 OD1 ASP A 81 3.190 -9.984 -14.205 1.00 0.00 O ATOM 1108 OD2 ASP A 81 2.515 -12.065 -14.263 1.00 0.00 O ATOM 0 H ASP A 81 3.112 -11.210 -9.661 1.00 0.00 H new ATOM 0 HA ASP A 81 1.682 -9.703 -11.544 1.00 0.00 H new ATOM 0 HB2 ASP A 81 3.988 -10.547 -11.852 1.00 0.00 H new ATOM 0 HB3 ASP A 81 3.400 -12.197 -11.886 1.00 0.00 H new ATOM 1113 N ASP A 82 0.639 -12.793 -11.148 1.00 0.00 N ATOM 1114 CA ASP A 82 -0.465 -13.710 -11.414 1.00 0.00 C ATOM 1115 C ASP A 82 -1.717 -13.303 -10.655 1.00 0.00 C ATOM 1116 O ASP A 82 -2.826 -13.682 -11.026 1.00 0.00 O ATOM 1117 CB ASP A 82 -0.090 -15.155 -11.072 1.00 0.00 C ATOM 1118 CG ASP A 82 0.432 -15.920 -12.271 1.00 0.00 C ATOM 1119 OD1 ASP A 82 1.644 -15.841 -12.552 1.00 0.00 O ATOM 1120 OD2 ASP A 82 -0.373 -16.616 -12.939 1.00 0.00 O ATOM 0 H ASP A 82 1.334 -13.151 -10.493 1.00 0.00 H new ATOM 0 HA ASP A 82 -0.674 -13.654 -12.482 1.00 0.00 H new ATOM 0 HB2 ASP A 82 0.667 -15.154 -10.288 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -0.964 -15.668 -10.670 1.00 0.00 H new ATOM 1125 N THR A 83 -1.547 -12.508 -9.605 1.00 0.00 N ATOM 1126 CA THR A 83 -2.677 -12.051 -8.820 1.00 0.00 C ATOM 1127 C THR A 83 -3.427 -10.985 -9.602 1.00 0.00 C ATOM 1128 O THR A 83 -4.648 -11.033 -9.735 1.00 0.00 O ATOM 1129 CB THR A 83 -2.222 -11.466 -7.478 1.00 0.00 C ATOM 1130 OG1 THR A 83 -1.193 -12.284 -6.924 1.00 0.00 O ATOM 1131 CG2 THR A 83 -3.386 -11.402 -6.502 1.00 0.00 C ATOM 0 H THR A 83 -0.640 -12.170 -9.282 1.00 0.00 H new ATOM 0 HA THR A 83 -3.325 -12.904 -8.619 1.00 0.00 H new ATOM 0 HB THR A 83 -1.845 -10.458 -7.649 1.00 0.00 H new ATOM 0 HG1 THR A 83 -1.143 -13.128 -7.420 1.00 0.00 H new ATOM 0 HG21 THR A 83 -3.044 -10.984 -5.555 1.00 0.00 H new ATOM 0 HG22 THR A 83 -4.172 -10.770 -6.915 1.00 0.00 H new ATOM 0 HG23 THR A 83 -3.777 -12.406 -6.336 1.00 0.00 H new ATOM 1139 N MET A 84 -2.676 -10.035 -10.145 1.00 0.00 N ATOM 1140 CA MET A 84 -3.255 -8.988 -10.969 1.00 0.00 C ATOM 1141 C MET A 84 -3.742 -9.581 -12.281 1.00 0.00 C ATOM 1142 O MET A 84 -4.704 -9.101 -12.875 1.00 0.00 O ATOM 1143 CB MET A 84 -2.251 -7.856 -11.226 1.00 0.00 C ATOM 1144 CG MET A 84 -0.866 -8.329 -11.621 1.00 0.00 C ATOM 1145 SD MET A 84 0.134 -7.031 -12.355 1.00 0.00 S ATOM 1146 CE MET A 84 -0.640 -6.914 -13.964 1.00 0.00 C ATOM 0 H MET A 84 -1.665 -9.970 -10.028 1.00 0.00 H new ATOM 0 HA MET A 84 -4.101 -8.557 -10.434 1.00 0.00 H new ATOM 0 HB2 MET A 84 -2.641 -7.212 -12.014 1.00 0.00 H new ATOM 0 HB3 MET A 84 -2.171 -7.246 -10.326 1.00 0.00 H new ATOM 0 HG2 MET A 84 -0.356 -8.719 -10.740 1.00 0.00 H new ATOM 0 HG3 MET A 84 -0.957 -9.154 -12.328 1.00 0.00 H new ATOM 0 HE1 MET A 84 -0.094 -6.199 -14.579 1.00 0.00 H new ATOM 0 HE2 MET A 84 -0.627 -7.892 -14.446 1.00 0.00 H new ATOM 0 HE3 MET A 84 -1.671 -6.580 -13.848 1.00 0.00 H new ATOM 1156 N ARG A 85 -3.071 -10.645 -12.709 1.00 0.00 N ATOM 1157 CA ARG A 85 -3.450 -11.389 -13.900 1.00 0.00 C ATOM 1158 C ARG A 85 -4.854 -11.957 -13.717 1.00 0.00 C ATOM 1159 O ARG A 85 -5.698 -11.851 -14.600 1.00 0.00 O ATOM 1160 CB ARG A 85 -2.445 -12.524 -14.122 1.00 0.00 C ATOM 1161 CG ARG A 85 -2.710 -13.399 -15.330 1.00 0.00 C ATOM 1162 CD ARG A 85 -1.719 -14.555 -15.373 1.00 0.00 C ATOM 1163 NE ARG A 85 -1.972 -15.463 -16.489 1.00 0.00 N ATOM 1164 CZ ARG A 85 -1.812 -16.791 -16.435 1.00 0.00 C ATOM 1165 NH1 ARG A 85 -1.376 -17.375 -15.321 1.00 0.00 N ATOM 1166 NH2 ARG A 85 -2.080 -17.530 -17.500 1.00 0.00 N ATOM 0 H ARG A 85 -2.246 -11.015 -12.236 1.00 0.00 H new ATOM 0 HA ARG A 85 -3.446 -10.731 -14.769 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -1.449 -12.091 -14.219 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -2.433 -13.155 -13.233 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -3.728 -13.785 -15.291 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -2.628 -12.807 -16.241 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -0.706 -14.159 -15.452 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -1.772 -15.111 -14.437 1.00 0.00 H new ATOM 0 HE ARG A 85 -2.292 -15.058 -17.369 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -1.161 -16.810 -14.500 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -1.257 -18.388 -15.289 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -2.407 -17.087 -18.359 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -1.959 -18.542 -17.462 1.00 0.00 H new ATOM 1180 N ALA A 86 -5.089 -12.556 -12.549 1.00 0.00 N ATOM 1181 CA ALA A 86 -6.392 -13.113 -12.209 1.00 0.00 C ATOM 1182 C ALA A 86 -7.459 -12.023 -12.171 1.00 0.00 C ATOM 1183 O ALA A 86 -8.590 -12.236 -12.600 1.00 0.00 O ATOM 1184 CB ALA A 86 -6.327 -13.840 -10.876 1.00 0.00 C ATOM 0 H ALA A 86 -4.385 -12.667 -11.819 1.00 0.00 H new ATOM 0 HA ALA A 86 -6.667 -13.829 -12.983 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -7.308 -14.250 -10.637 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -5.601 -14.650 -10.939 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -6.025 -13.142 -10.095 1.00 0.00 H new ATOM 1190 N ILE A 87 -7.095 -10.855 -11.654 1.00 0.00 N ATOM 1191 CA ILE A 87 -8.021 -9.723 -11.597 1.00 0.00 C ATOM 1192 C ILE A 87 -8.361 -9.251 -13.009 1.00 0.00 C ATOM 1193 O ILE A 87 -9.511 -8.914 -13.309 1.00 0.00 O ATOM 1194 CB ILE A 87 -7.424 -8.545 -10.786 1.00 0.00 C ATOM 1195 CG1 ILE A 87 -7.086 -9.002 -9.363 1.00 0.00 C ATOM 1196 CG2 ILE A 87 -8.394 -7.365 -10.755 1.00 0.00 C ATOM 1197 CD1 ILE A 87 -6.409 -7.938 -8.529 1.00 0.00 C ATOM 0 H ILE A 87 -6.170 -10.664 -11.269 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.928 -10.060 -11.095 1.00 0.00 H new ATOM 0 HB ILE A 87 -6.507 -8.217 -11.274 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -8.003 -9.314 -8.863 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -6.438 -9.877 -9.416 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.956 -6.549 -10.181 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -8.590 -7.028 -11.773 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -9.329 -7.675 -10.289 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.200 -8.333 -7.535 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.474 -7.642 -9.006 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -7.064 -7.071 -8.445 1.00 0.00 H new ATOM 1209 N GLY A 88 -7.352 -9.251 -13.876 1.00 0.00 N ATOM 1210 CA GLY A 88 -7.543 -8.864 -15.263 1.00 0.00 C ATOM 1211 C GLY A 88 -8.322 -9.907 -16.051 1.00 0.00 C ATOM 1212 O GLY A 88 -8.616 -9.717 -17.230 1.00 0.00 O ATOM 0 H GLY A 88 -6.396 -9.515 -13.639 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -8.072 -7.912 -15.303 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -6.571 -8.709 -15.732 1.00 0.00 H new ATOM 1216 N LYS A 89 -8.659 -11.002 -15.390 1.00 0.00 N ATOM 1217 CA LYS A 89 -9.410 -12.075 -16.013 1.00 0.00 C ATOM 1218 C LYS A 89 -10.680 -12.362 -15.227 1.00 0.00 C ATOM 1219 O LYS A 89 -10.748 -13.325 -14.466 1.00 0.00 O ATOM 1220 CB LYS A 89 -8.572 -13.347 -16.123 1.00 0.00 C ATOM 1221 CG LYS A 89 -7.331 -13.216 -16.996 1.00 0.00 C ATOM 1222 CD LYS A 89 -6.589 -14.541 -17.099 1.00 0.00 C ATOM 1223 CE LYS A 89 -7.475 -15.615 -17.706 1.00 0.00 C ATOM 1224 NZ LYS A 89 -6.785 -16.916 -17.841 1.00 0.00 N ATOM 0 H LYS A 89 -8.421 -11.170 -14.413 1.00 0.00 H new ATOM 0 HA LYS A 89 -9.676 -11.751 -17.019 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -8.266 -13.652 -15.122 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -9.198 -14.145 -16.522 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -7.618 -12.878 -17.992 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -6.669 -12.457 -16.580 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -5.695 -14.415 -17.709 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -6.258 -14.854 -16.109 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -8.362 -15.742 -17.085 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -7.817 -15.286 -18.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -7.435 -17.612 -18.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -5.953 -16.806 -18.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -6.481 -17.247 -16.903 1.00 0.00 H new ATOM 1238 N LYS A 90 -11.674 -11.519 -15.395 1.00 0.00 N ATOM 1239 CA LYS A 90 -12.934 -11.692 -14.691 1.00 0.00 C ATOM 1240 C LYS A 90 -14.001 -12.242 -15.634 1.00 0.00 C ATOM 1241 O LYS A 90 -15.170 -12.371 -15.267 1.00 0.00 O ATOM 1242 CB LYS A 90 -13.384 -10.356 -14.090 1.00 0.00 C ATOM 1243 CG LYS A 90 -14.424 -10.480 -12.989 1.00 0.00 C ATOM 1244 CD LYS A 90 -14.761 -9.122 -12.394 1.00 0.00 C ATOM 1245 CE LYS A 90 -15.601 -9.263 -11.135 1.00 0.00 C ATOM 1246 NZ LYS A 90 -14.866 -9.969 -10.048 1.00 0.00 N ATOM 0 H LYS A 90 -11.639 -10.707 -16.011 1.00 0.00 H new ATOM 0 HA LYS A 90 -12.791 -12.410 -13.883 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -12.511 -9.839 -13.692 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -13.789 -9.731 -14.886 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -15.328 -10.939 -13.389 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -14.051 -11.140 -12.206 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -13.841 -8.586 -12.161 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -15.301 -8.525 -13.129 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -15.901 -8.275 -10.787 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -16.515 -9.809 -11.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -15.321 -9.769 -9.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -14.883 -10.994 -10.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -13.880 -9.638 -10.024 1.00 0.00 H new TER 1260 LYS A 90 ATOM 1261 N ASN B 7 -14.739 16.513 -1.516 1.00 0.00 N ATOM 1262 CA ASN B 7 -15.389 16.520 -0.206 1.00 0.00 C ATOM 1263 C ASN B 7 -16.346 15.349 -0.066 1.00 0.00 C ATOM 1264 O ASN B 7 -16.482 14.763 1.007 1.00 0.00 O ATOM 1265 CB ASN B 7 -16.152 17.828 0.006 1.00 0.00 C ATOM 1266 CG ASN B 7 -15.292 19.044 -0.242 1.00 0.00 C ATOM 1267 OD1 ASN B 7 -15.265 19.582 -1.351 1.00 0.00 O ATOM 1268 ND2 ASN B 7 -14.570 19.472 0.772 1.00 0.00 N ATOM 0 HA ASN B 7 -14.610 16.429 0.551 1.00 0.00 H new ATOM 0 HB2 ASN B 7 -17.014 17.854 -0.660 1.00 0.00 H new ATOM 0 HB3 ASN B 7 -16.536 17.860 1.026 1.00 0.00 H new ATOM 0 HD21 ASN B 7 -13.957 20.279 0.657 1.00 0.00 H new ATOM 0 HD22 ASN B 7 -14.623 18.996 1.673 1.00 0.00 H new ATOM 1275 N GLY B 8 -17.009 15.017 -1.154 1.00 0.00 N ATOM 1276 CA GLY B 8 -17.953 13.922 -1.151 1.00 0.00 C ATOM 1277 C GLY B 8 -17.305 12.615 -1.528 1.00 0.00 C ATOM 1278 O GLY B 8 -17.557 12.074 -2.603 1.00 0.00 O ATOM 0 H GLY B 8 -16.911 15.491 -2.052 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -18.400 13.832 -0.161 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -18.762 14.139 -1.848 1.00 0.00 H new ATOM 1282 N LEU B 9 -16.467 12.115 -0.654 1.00 0.00 N ATOM 1283 CA LEU B 9 -15.759 10.883 -0.880 1.00 0.00 C ATOM 1284 C LEU B 9 -15.958 9.930 0.305 1.00 0.00 C ATOM 1285 O LEU B 9 -16.421 10.357 1.367 1.00 0.00 O ATOM 1286 CB LEU B 9 -14.265 11.183 -1.128 1.00 0.00 C ATOM 1287 CG LEU B 9 -13.760 12.572 -0.683 1.00 0.00 C ATOM 1288 CD1 LEU B 9 -13.785 12.720 0.830 1.00 0.00 C ATOM 1289 CD2 LEU B 9 -12.364 12.822 -1.216 1.00 0.00 C ATOM 0 H LEU B 9 -16.257 12.557 0.241 1.00 0.00 H new ATOM 0 HA LEU B 9 -16.157 10.389 -1.766 1.00 0.00 H new ATOM 0 HB2 LEU B 9 -13.675 10.424 -0.614 1.00 0.00 H new ATOM 0 HB3 LEU B 9 -14.067 11.073 -2.194 1.00 0.00 H new ATOM 0 HG LEU B 9 -14.437 13.319 -1.099 1.00 0.00 H new ATOM 0 HD11 LEU B 9 -13.423 13.711 1.105 1.00 0.00 H new ATOM 0 HD12 LEU B 9 -14.806 12.594 1.191 1.00 0.00 H new ATOM 0 HD13 LEU B 9 -13.145 11.962 1.280 1.00 0.00 H new ATOM 0 HD21 LEU B 9 -12.022 13.805 -0.894 1.00 0.00 H new ATOM 0 HD22 LEU B 9 -11.686 12.059 -0.833 1.00 0.00 H new ATOM 0 HD23 LEU B 9 -12.378 12.782 -2.305 1.00 0.00 H new ATOM 1301 N PRO B 10 -15.649 8.615 0.118 1.00 0.00 N ATOM 1302 CA PRO B 10 -15.777 7.585 1.174 1.00 0.00 C ATOM 1303 C PRO B 10 -15.219 8.036 2.537 1.00 0.00 C ATOM 1304 O PRO B 10 -14.360 8.906 2.604 1.00 0.00 O ATOM 1305 CB PRO B 10 -14.950 6.432 0.616 1.00 0.00 C ATOM 1306 CG PRO B 10 -15.092 6.552 -0.858 1.00 0.00 C ATOM 1307 CD PRO B 10 -15.172 8.027 -1.154 1.00 0.00 C ATOM 0 HA PRO B 10 -16.819 7.341 1.378 1.00 0.00 H new ATOM 0 HB2 PRO B 10 -13.906 6.508 0.922 1.00 0.00 H new ATOM 0 HB3 PRO B 10 -15.318 5.470 0.973 1.00 0.00 H new ATOM 0 HG2 PRO B 10 -14.243 6.098 -1.369 1.00 0.00 H new ATOM 0 HG3 PRO B 10 -15.987 6.036 -1.206 1.00 0.00 H new ATOM 0 HD2 PRO B 10 -14.202 8.431 -1.443 1.00 0.00 H new ATOM 0 HD3 PRO B 10 -15.860 8.234 -1.974 1.00 0.00 H new ATOM 1315 N SER B 11 -15.695 7.407 3.606 1.00 0.00 N ATOM 1316 CA SER B 11 -15.332 7.780 4.974 1.00 0.00 C ATOM 1317 C SER B 11 -13.815 7.792 5.205 1.00 0.00 C ATOM 1318 O SER B 11 -13.290 8.695 5.856 1.00 0.00 O ATOM 1319 CB SER B 11 -15.991 6.831 5.953 1.00 0.00 C ATOM 1320 OG SER B 11 -17.353 6.615 5.599 1.00 0.00 O ATOM 0 H SER B 11 -16.345 6.623 3.551 1.00 0.00 H new ATOM 0 HA SER B 11 -15.688 8.798 5.134 1.00 0.00 H new ATOM 0 HB2 SER B 11 -15.457 5.881 5.963 1.00 0.00 H new ATOM 0 HB3 SER B 11 -15.932 7.241 6.961 1.00 0.00 H new ATOM 0 HG SER B 11 -17.764 5.998 6.240 1.00 0.00 H new ATOM 1326 N GLU B 12 -13.116 6.796 4.664 1.00 0.00 N ATOM 1327 CA GLU B 12 -11.667 6.698 4.825 1.00 0.00 C ATOM 1328 C GLU B 12 -10.953 7.870 4.150 1.00 0.00 C ATOM 1329 O GLU B 12 -9.894 8.302 4.589 1.00 0.00 O ATOM 1330 CB GLU B 12 -11.125 5.351 4.297 1.00 0.00 C ATOM 1331 CG GLU B 12 -11.635 4.948 2.913 1.00 0.00 C ATOM 1332 CD GLU B 12 -12.972 4.227 2.966 1.00 0.00 C ATOM 1333 OE1 GLU B 12 -14.010 4.905 3.104 1.00 0.00 O ATOM 1334 OE2 GLU B 12 -12.981 2.987 2.879 1.00 0.00 O ATOM 0 H GLU B 12 -13.530 6.046 4.111 1.00 0.00 H new ATOM 0 HA GLU B 12 -11.459 6.744 5.894 1.00 0.00 H new ATOM 0 HB2 GLU B 12 -10.037 5.401 4.266 1.00 0.00 H new ATOM 0 HB3 GLU B 12 -11.388 4.567 5.007 1.00 0.00 H new ATOM 0 HG2 GLU B 12 -11.732 5.839 2.293 1.00 0.00 H new ATOM 0 HG3 GLU B 12 -10.899 4.304 2.433 1.00 0.00 H new ATOM 1341 N THR B 13 -11.538 8.371 3.085 1.00 0.00 N ATOM 1342 CA THR B 13 -10.985 9.513 2.380 1.00 0.00 C ATOM 1343 C THR B 13 -11.591 10.817 2.902 1.00 0.00 C ATOM 1344 O THR B 13 -11.129 11.910 2.574 1.00 0.00 O ATOM 1345 CB THR B 13 -11.259 9.396 0.866 1.00 0.00 C ATOM 1346 OG1 THR B 13 -12.654 9.227 0.633 1.00 0.00 O ATOM 1347 CG2 THR B 13 -10.529 8.214 0.275 1.00 0.00 C ATOM 0 H THR B 13 -12.402 8.005 2.684 1.00 0.00 H new ATOM 0 HA THR B 13 -9.909 9.524 2.554 1.00 0.00 H new ATOM 0 HB THR B 13 -10.906 10.312 0.393 1.00 0.00 H new ATOM 0 HG1 THR B 13 -13.149 9.423 1.456 1.00 0.00 H new ATOM 0 HG21 THR B 13 -10.739 8.154 -0.793 1.00 0.00 H new ATOM 0 HG22 THR B 13 -9.457 8.335 0.428 1.00 0.00 H new ATOM 0 HG23 THR B 13 -10.864 7.299 0.763 1.00 0.00 H new ATOM 1355 N TYR B 14 -12.608 10.675 3.738 1.00 0.00 N ATOM 1356 CA TYR B 14 -13.373 11.796 4.250 1.00 0.00 C ATOM 1357 C TYR B 14 -12.689 12.476 5.428 1.00 0.00 C ATOM 1358 O TYR B 14 -12.873 13.676 5.647 1.00 0.00 O ATOM 1359 CB TYR B 14 -14.775 11.313 4.648 1.00 0.00 C ATOM 1360 CG TYR B 14 -15.583 12.300 5.451 1.00 0.00 C ATOM 1361 CD1 TYR B 14 -16.347 13.276 4.832 1.00 0.00 C ATOM 1362 CD2 TYR B 14 -15.579 12.248 6.838 1.00 0.00 C ATOM 1363 CE1 TYR B 14 -17.086 14.174 5.572 1.00 0.00 C ATOM 1364 CE2 TYR B 14 -16.308 13.137 7.587 1.00 0.00 C ATOM 1365 CZ TYR B 14 -17.064 14.104 6.951 1.00 0.00 C ATOM 1366 OH TYR B 14 -17.806 14.999 7.692 1.00 0.00 O ATOM 0 H TYR B 14 -12.927 9.769 4.082 1.00 0.00 H new ATOM 0 HA TYR B 14 -13.447 12.542 3.459 1.00 0.00 H new ATOM 0 HB2 TYR B 14 -15.328 11.064 3.742 1.00 0.00 H new ATOM 0 HB3 TYR B 14 -14.676 10.393 5.224 1.00 0.00 H new ATOM 0 HD1 TYR B 14 -16.364 13.334 3.754 1.00 0.00 H new ATOM 0 HD2 TYR B 14 -14.990 11.493 7.338 1.00 0.00 H new ATOM 0 HE1 TYR B 14 -17.679 14.928 5.076 1.00 0.00 H new ATOM 0 HE2 TYR B 14 -16.291 13.082 8.665 1.00 0.00 H new ATOM 0 HH TYR B 14 -17.683 14.815 8.647 1.00 0.00 H new ATOM 1376 N ILE B 15 -11.897 11.741 6.185 1.00 0.00 N ATOM 1377 CA ILE B 15 -11.264 12.337 7.349 1.00 0.00 C ATOM 1378 C ILE B 15 -9.851 12.824 7.028 1.00 0.00 C ATOM 1379 O ILE B 15 -9.360 12.653 5.906 1.00 0.00 O ATOM 1380 CB ILE B 15 -11.265 11.416 8.614 1.00 0.00 C ATOM 1381 CG1 ILE B 15 -10.238 10.271 8.520 1.00 0.00 C ATOM 1382 CG2 ILE B 15 -12.659 10.865 8.878 1.00 0.00 C ATOM 1383 CD1 ILE B 15 -10.549 9.208 7.494 1.00 0.00 C ATOM 0 H ILE B 15 -11.680 10.758 6.024 1.00 0.00 H new ATOM 0 HA ILE B 15 -11.882 13.198 7.606 1.00 0.00 H new ATOM 0 HB ILE B 15 -10.964 12.040 9.455 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -9.262 10.699 8.292 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -10.157 9.796 9.498 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -12.637 10.227 9.762 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -13.351 11.691 9.043 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -12.989 10.282 8.018 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -9.766 8.449 7.507 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -11.507 8.745 7.729 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -10.598 9.661 6.504 1.00 0.00 H new ATOM 1395 N THR B 16 -9.213 13.436 8.003 1.00 0.00 N ATOM 1396 CA THR B 16 -7.905 14.023 7.805 1.00 0.00 C ATOM 1397 C THR B 16 -6.805 13.071 8.247 1.00 0.00 C ATOM 1398 O THR B 16 -7.071 12.007 8.814 1.00 0.00 O ATOM 1399 CB THR B 16 -7.772 15.334 8.606 1.00 0.00 C ATOM 1400 OG1 THR B 16 -7.996 15.072 10.001 1.00 0.00 O ATOM 1401 CG2 THR B 16 -8.769 16.371 8.118 1.00 0.00 C ATOM 0 H THR B 16 -9.583 13.540 8.948 1.00 0.00 H new ATOM 0 HA THR B 16 -7.799 14.227 6.740 1.00 0.00 H new ATOM 0 HB THR B 16 -6.765 15.726 8.460 1.00 0.00 H new ATOM 0 HG1 THR B 16 -7.909 15.906 10.508 1.00 0.00 H new ATOM 0 HG21 THR B 16 -8.655 17.286 8.699 1.00 0.00 H new ATOM 0 HG22 THR B 16 -8.586 16.584 7.065 1.00 0.00 H new ATOM 0 HG23 THR B 16 -9.782 15.987 8.240 1.00 0.00 H new ATOM 1409 N CYS B 17 -5.570 13.467 8.001 1.00 0.00 N ATOM 1410 CA CYS B 17 -4.413 12.677 8.383 1.00 0.00 C ATOM 1411 C CYS B 17 -4.277 12.635 9.898 1.00 0.00 C ATOM 1412 O CYS B 17 -3.689 11.714 10.451 1.00 0.00 O ATOM 1413 CB CYS B 17 -3.173 13.283 7.769 1.00 0.00 C ATOM 1414 SG CYS B 17 -3.515 14.135 6.204 1.00 0.00 S ATOM 0 H CYS B 17 -5.340 14.343 7.532 1.00 0.00 H new ATOM 0 HA CYS B 17 -4.539 11.657 8.020 1.00 0.00 H new ATOM 0 HB2 CYS B 17 -2.731 13.988 8.473 1.00 0.00 H new ATOM 0 HB3 CYS B 17 -2.436 12.498 7.598 1.00 0.00 H new ATOM 1419 N ALA B 18 -4.825 13.648 10.561 1.00 0.00 N ATOM 1420 CA ALA B 18 -4.812 13.698 12.010 1.00 0.00 C ATOM 1421 C ALA B 18 -5.651 12.559 12.574 1.00 0.00 C ATOM 1422 O ALA B 18 -5.186 11.776 13.408 1.00 0.00 O ATOM 1423 CB ALA B 18 -5.334 15.042 12.500 1.00 0.00 C ATOM 0 H ALA B 18 -5.282 14.443 10.114 1.00 0.00 H new ATOM 0 HA ALA B 18 -3.786 13.584 12.359 1.00 0.00 H new ATOM 0 HB1 ALA B 18 -5.318 15.063 13.590 1.00 0.00 H new ATOM 0 HB2 ALA B 18 -4.702 15.841 12.112 1.00 0.00 H new ATOM 0 HB3 ALA B 18 -6.356 15.185 12.150 1.00 0.00 H new ATOM 1429 N GLU B 19 -6.888 12.451 12.092 1.00 0.00 N ATOM 1430 CA GLU B 19 -7.797 11.396 12.521 1.00 0.00 C ATOM 1431 C GLU B 19 -7.288 10.030 12.070 1.00 0.00 C ATOM 1432 O GLU B 19 -7.593 9.003 12.688 1.00 0.00 O ATOM 1433 CB GLU B 19 -9.199 11.628 11.950 1.00 0.00 C ATOM 1434 CG GLU B 19 -9.723 13.046 12.121 1.00 0.00 C ATOM 1435 CD GLU B 19 -9.689 13.521 13.555 1.00 0.00 C ATOM 1436 OE1 GLU B 19 -10.584 13.142 14.332 1.00 0.00 O ATOM 1437 OE2 GLU B 19 -8.772 14.293 13.904 1.00 0.00 O ATOM 0 H GLU B 19 -7.283 13.087 11.400 1.00 0.00 H new ATOM 0 HA GLU B 19 -7.844 11.418 13.610 1.00 0.00 H new ATOM 0 HB2 GLU B 19 -9.190 11.383 10.888 1.00 0.00 H new ATOM 0 HB3 GLU B 19 -9.892 10.938 12.431 1.00 0.00 H new ATOM 0 HG2 GLU B 19 -9.130 13.723 11.506 1.00 0.00 H new ATOM 0 HG3 GLU B 19 -10.748 13.095 11.752 1.00 0.00 H new ATOM 1444 N ALA B 20 -6.509 10.022 10.987 1.00 0.00 N ATOM 1445 CA ALA B 20 -5.965 8.794 10.451 1.00 0.00 C ATOM 1446 C ALA B 20 -5.007 8.149 11.447 1.00 0.00 C ATOM 1447 O ALA B 20 -4.934 6.927 11.556 1.00 0.00 O ATOM 1448 CB ALA B 20 -5.264 9.050 9.126 1.00 0.00 C ATOM 0 H ALA B 20 -6.246 10.860 10.469 1.00 0.00 H new ATOM 0 HA ALA B 20 -6.791 8.105 10.274 1.00 0.00 H new ATOM 0 HB1 ALA B 20 -4.862 8.113 8.740 1.00 0.00 H new ATOM 0 HB2 ALA B 20 -5.977 9.461 8.411 1.00 0.00 H new ATOM 0 HB3 ALA B 20 -4.450 9.760 9.276 1.00 0.00 H new ATOM 1454 N ASN B 21 -4.315 8.983 12.207 1.00 0.00 N ATOM 1455 CA ASN B 21 -3.360 8.492 13.191 1.00 0.00 C ATOM 1456 C ASN B 21 -4.095 7.919 14.387 1.00 0.00 C ATOM 1457 O ASN B 21 -3.709 6.884 14.933 1.00 0.00 O ATOM 1458 CB ASN B 21 -2.379 9.581 13.634 1.00 0.00 C ATOM 1459 CG ASN B 21 -1.235 9.787 12.656 1.00 0.00 C ATOM 1460 OD1 ASN B 21 -1.405 9.680 11.441 1.00 0.00 O ATOM 1461 ND2 ASN B 21 -0.055 10.062 13.184 1.00 0.00 N ATOM 0 H ASN B 21 -4.395 9.999 12.163 1.00 0.00 H new ATOM 0 HA ASN B 21 -2.773 7.705 12.718 1.00 0.00 H new ATOM 0 HB2 ASN B 21 -2.919 10.520 13.755 1.00 0.00 H new ATOM 0 HB3 ASN B 21 -1.972 9.319 14.610 1.00 0.00 H new ATOM 0 HD21 ASN B 21 0.756 10.194 12.580 1.00 0.00 H new ATOM 0 HD22 ASN B 21 0.045 10.142 14.196 1.00 0.00 H new ATOM 1468 N GLU B 22 -5.162 8.596 14.792 1.00 0.00 N ATOM 1469 CA GLU B 22 -5.987 8.115 15.885 1.00 0.00 C ATOM 1470 C GLU B 22 -6.543 6.730 15.582 1.00 0.00 C ATOM 1471 O GLU B 22 -6.482 5.839 16.420 1.00 0.00 O ATOM 1472 CB GLU B 22 -7.113 9.084 16.205 1.00 0.00 C ATOM 1473 CG GLU B 22 -6.646 10.365 16.867 1.00 0.00 C ATOM 1474 CD GLU B 22 -7.785 11.138 17.471 1.00 0.00 C ATOM 1475 OE1 GLU B 22 -8.274 10.736 18.552 1.00 0.00 O ATOM 1476 OE2 GLU B 22 -8.210 12.144 16.876 1.00 0.00 O ATOM 0 H GLU B 22 -5.473 9.476 14.380 1.00 0.00 H new ATOM 0 HA GLU B 22 -5.348 8.044 16.766 1.00 0.00 H new ATOM 0 HB2 GLU B 22 -7.639 9.333 15.283 1.00 0.00 H new ATOM 0 HB3 GLU B 22 -7.831 8.589 16.858 1.00 0.00 H new ATOM 0 HG2 GLU B 22 -5.918 10.127 17.643 1.00 0.00 H new ATOM 0 HG3 GLU B 22 -6.136 10.987 16.132 1.00 0.00 H new ATOM 1483 N MET B 23 -7.090 6.548 14.385 1.00 0.00 N ATOM 1484 CA MET B 23 -7.597 5.238 13.986 1.00 0.00 C ATOM 1485 C MET B 23 -6.452 4.224 13.925 1.00 0.00 C ATOM 1486 O MET B 23 -6.610 3.080 14.333 1.00 0.00 O ATOM 1487 CB MET B 23 -8.325 5.315 12.638 1.00 0.00 C ATOM 1488 CG MET B 23 -8.990 4.007 12.224 1.00 0.00 C ATOM 1489 SD MET B 23 -10.032 4.172 10.756 1.00 0.00 S ATOM 1490 CE MET B 23 -8.819 4.576 9.503 1.00 0.00 C ATOM 0 H MET B 23 -7.194 7.279 13.682 1.00 0.00 H new ATOM 0 HA MET B 23 -8.317 4.908 14.735 1.00 0.00 H new ATOM 0 HB2 MET B 23 -9.083 6.097 12.689 1.00 0.00 H new ATOM 0 HB3 MET B 23 -7.613 5.610 11.867 1.00 0.00 H new ATOM 0 HG2 MET B 23 -8.220 3.260 12.033 1.00 0.00 H new ATOM 0 HG3 MET B 23 -9.595 3.637 13.052 1.00 0.00 H new ATOM 0 HE1 MET B 23 -9.293 4.567 8.521 1.00 0.00 H new ATOM 0 HE2 MET B 23 -8.409 5.567 9.699 1.00 0.00 H new ATOM 0 HE3 MET B 23 -8.015 3.840 9.524 1.00 0.00 H new ATOM 1500 N ALA B 24 -5.306 4.671 13.411 1.00 0.00 N ATOM 1501 CA ALA B 24 -4.084 3.855 13.333 1.00 0.00 C ATOM 1502 C ALA B 24 -3.735 3.199 14.675 1.00 0.00 C ATOM 1503 O ALA B 24 -3.103 2.147 14.706 1.00 0.00 O ATOM 1504 CB ALA B 24 -2.915 4.691 12.840 1.00 0.00 C ATOM 0 H ALA B 24 -5.194 5.612 13.034 1.00 0.00 H new ATOM 0 HA ALA B 24 -4.281 3.055 12.620 1.00 0.00 H new ATOM 0 HB1 ALA B 24 -2.020 4.071 12.789 1.00 0.00 H new ATOM 0 HB2 ALA B 24 -3.141 5.084 11.849 1.00 0.00 H new ATOM 0 HB3 ALA B 24 -2.744 5.519 13.528 1.00 0.00 H new ATOM 1510 N LYS B 25 -4.147 3.827 15.782 1.00 0.00 N ATOM 1511 CA LYS B 25 -3.915 3.268 17.125 1.00 0.00 C ATOM 1512 C LYS B 25 -4.583 1.895 17.269 1.00 0.00 C ATOM 1513 O LYS B 25 -4.209 1.098 18.132 1.00 0.00 O ATOM 1514 CB LYS B 25 -4.452 4.206 18.209 1.00 0.00 C ATOM 1515 CG LYS B 25 -3.827 5.592 18.218 1.00 0.00 C ATOM 1516 CD LYS B 25 -4.424 6.445 19.330 1.00 0.00 C ATOM 1517 CE LYS B 25 -3.859 7.858 19.329 1.00 0.00 C ATOM 1518 NZ LYS B 25 -2.377 7.869 19.431 1.00 0.00 N ATOM 0 H LYS B 25 -4.641 4.719 15.778 1.00 0.00 H new ATOM 0 HA LYS B 25 -2.838 3.157 17.250 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -5.529 4.309 18.080 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -4.291 3.743 19.183 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -2.749 5.509 18.355 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -3.989 6.076 17.255 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -5.507 6.487 19.213 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -4.225 5.976 20.294 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -4.163 8.368 18.415 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -4.283 8.418 20.163 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -2.049 8.839 19.614 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -2.078 7.249 20.211 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -1.965 7.526 18.540 1.00 0.00 H new ATOM 1532 N THR B 26 -5.567 1.633 16.429 1.00 0.00 N ATOM 1533 CA THR B 26 -6.275 0.368 16.442 1.00 0.00 C ATOM 1534 C THR B 26 -6.147 -0.333 15.083 1.00 0.00 C ATOM 1535 O THR B 26 -6.049 -1.561 15.007 1.00 0.00 O ATOM 1536 CB THR B 26 -7.772 0.572 16.772 1.00 0.00 C ATOM 1537 OG1 THR B 26 -7.906 1.366 17.966 1.00 0.00 O ATOM 1538 CG2 THR B 26 -8.461 -0.768 16.990 1.00 0.00 C ATOM 0 H THR B 26 -5.897 2.289 15.721 1.00 0.00 H new ATOM 0 HA THR B 26 -5.825 -0.254 17.216 1.00 0.00 H new ATOM 0 HB THR B 26 -8.240 1.083 15.931 1.00 0.00 H new ATOM 0 HG1 THR B 26 -8.856 1.493 18.169 1.00 0.00 H new ATOM 0 HG21 THR B 26 -9.513 -0.603 17.221 1.00 0.00 H new ATOM 0 HG22 THR B 26 -8.378 -1.371 16.086 1.00 0.00 H new ATOM 0 HG23 THR B 26 -7.985 -1.291 17.820 1.00 0.00 H new ATOM 1546 N ASP B 27 -6.120 0.459 14.019 1.00 0.00 N ATOM 1547 CA ASP B 27 -6.028 -0.065 12.670 1.00 0.00 C ATOM 1548 C ASP B 27 -4.923 0.637 11.902 1.00 0.00 C ATOM 1549 O ASP B 27 -5.185 1.484 11.042 1.00 0.00 O ATOM 1550 CB ASP B 27 -7.360 0.084 11.921 1.00 0.00 C ATOM 1551 CG ASP B 27 -8.497 -0.669 12.575 1.00 0.00 C ATOM 1552 OD1 ASP B 27 -8.510 -1.920 12.505 1.00 0.00 O ATOM 1553 OD2 ASP B 27 -9.389 -0.021 13.163 1.00 0.00 O ATOM 0 H ASP B 27 -6.161 1.477 14.070 1.00 0.00 H new ATOM 0 HA ASP B 27 -5.794 -1.127 12.743 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -7.620 1.141 11.861 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -7.237 -0.273 10.898 1.00 0.00 H new ATOM 1558 N SER B 28 -3.687 0.314 12.238 1.00 0.00 N ATOM 1559 CA SER B 28 -2.532 0.896 11.579 1.00 0.00 C ATOM 1560 C SER B 28 -2.436 0.422 10.130 1.00 0.00 C ATOM 1561 O SER B 28 -1.854 1.100 9.287 1.00 0.00 O ATOM 1562 CB SER B 28 -1.249 0.543 12.342 1.00 0.00 C ATOM 1563 OG SER B 28 -0.123 1.229 11.813 1.00 0.00 O ATOM 0 H SER B 28 -3.456 -0.356 12.972 1.00 0.00 H new ATOM 0 HA SER B 28 -2.651 1.979 11.576 1.00 0.00 H new ATOM 0 HB2 SER B 28 -1.369 0.797 13.395 1.00 0.00 H new ATOM 0 HB3 SER B 28 -1.078 -0.532 12.291 1.00 0.00 H new ATOM 0 HG SER B 28 0.678 0.984 12.322 1.00 0.00 H new ATOM 1569 N ALA B 29 -3.009 -0.738 9.852 1.00 0.00 N ATOM 1570 CA ALA B 29 -3.007 -1.276 8.505 1.00 0.00 C ATOM 1571 C ALA B 29 -3.895 -0.431 7.607 1.00 0.00 C ATOM 1572 O ALA B 29 -3.429 0.147 6.635 1.00 0.00 O ATOM 1573 CB ALA B 29 -3.469 -2.728 8.502 1.00 0.00 C ATOM 0 H ALA B 29 -3.480 -1.323 10.542 1.00 0.00 H new ATOM 0 HA ALA B 29 -1.988 -1.246 8.120 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -3.460 -3.111 7.481 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -2.798 -3.325 9.120 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -4.481 -2.789 8.903 1.00 0.00 H new ATOM 1579 N GLN B 30 -5.167 -0.328 7.990 1.00 0.00 N ATOM 1580 CA GLN B 30 -6.190 0.423 7.245 1.00 0.00 C ATOM 1581 C GLN B 30 -5.707 1.795 6.762 1.00 0.00 C ATOM 1582 O GLN B 30 -6.049 2.222 5.662 1.00 0.00 O ATOM 1583 CB GLN B 30 -7.440 0.599 8.112 1.00 0.00 C ATOM 1584 CG GLN B 30 -8.438 -0.557 8.047 1.00 0.00 C ATOM 1585 CD GLN B 30 -7.800 -1.931 8.186 1.00 0.00 C ATOM 1586 OE1 GLN B 30 -7.415 -2.514 7.071 1.00 0.00 O flip ATOM 1587 NE2 GLN B 30 -7.655 -2.453 9.289 1.00 0.00 N flip ATOM 0 H GLN B 30 -5.526 -0.768 8.837 1.00 0.00 H new ATOM 0 HA GLN B 30 -6.418 -0.164 6.355 1.00 0.00 H new ATOM 0 HB2 GLN B 30 -7.129 0.733 9.148 1.00 0.00 H new ATOM 0 HB3 GLN B 30 -7.948 1.515 7.810 1.00 0.00 H new ATOM 0 HG2 GLN B 30 -9.178 -0.430 8.837 1.00 0.00 H new ATOM 0 HG3 GLN B 30 -8.972 -0.510 7.098 1.00 0.00 H new ATOM 0 HE21 GLN B 30 -7.968 -1.966 10.129 1.00 0.00 H new ATOM 0 HE22 GLN B 30 -7.222 -3.373 9.365 1.00 0.00 H new ATOM 1596 N VAL B 31 -4.918 2.480 7.574 1.00 0.00 N ATOM 1597 CA VAL B 31 -4.446 3.806 7.205 1.00 0.00 C ATOM 1598 C VAL B 31 -3.228 3.739 6.282 1.00 0.00 C ATOM 1599 O VAL B 31 -3.098 4.538 5.363 1.00 0.00 O ATOM 1600 CB VAL B 31 -4.121 4.680 8.442 1.00 0.00 C ATOM 1601 CG1 VAL B 31 -5.352 4.845 9.306 1.00 0.00 C ATOM 1602 CG2 VAL B 31 -2.973 4.094 9.250 1.00 0.00 C ATOM 0 H VAL B 31 -4.594 2.146 8.482 1.00 0.00 H new ATOM 0 HA VAL B 31 -5.267 4.277 6.664 1.00 0.00 H new ATOM 0 HB VAL B 31 -3.807 5.662 8.087 1.00 0.00 H new ATOM 0 HG11 VAL B 31 -5.109 5.461 10.172 1.00 0.00 H new ATOM 0 HG12 VAL B 31 -6.141 5.326 8.728 1.00 0.00 H new ATOM 0 HG13 VAL B 31 -5.694 3.866 9.642 1.00 0.00 H new ATOM 0 HG21 VAL B 31 -2.771 4.732 10.111 1.00 0.00 H new ATOM 0 HG22 VAL B 31 -3.243 3.095 9.594 1.00 0.00 H new ATOM 0 HG23 VAL B 31 -2.082 4.034 8.625 1.00 0.00 H new ATOM 1612 N ALA B 32 -2.364 2.766 6.507 1.00 0.00 N ATOM 1613 CA ALA B 32 -1.149 2.637 5.725 1.00 0.00 C ATOM 1614 C ALA B 32 -1.453 2.090 4.344 1.00 0.00 C ATOM 1615 O ALA B 32 -0.869 2.524 3.357 1.00 0.00 O ATOM 1616 CB ALA B 32 -0.147 1.744 6.444 1.00 0.00 C ATOM 0 H ALA B 32 -2.482 2.053 7.226 1.00 0.00 H new ATOM 0 HA ALA B 32 -0.710 3.628 5.609 1.00 0.00 H new ATOM 0 HB1 ALA B 32 0.759 1.657 5.844 1.00 0.00 H new ATOM 0 HB2 ALA B 32 0.099 2.180 7.412 1.00 0.00 H new ATOM 0 HB3 ALA B 32 -0.581 0.755 6.591 1.00 0.00 H new ATOM 1622 N GLU B 33 -2.406 1.171 4.282 1.00 0.00 N ATOM 1623 CA GLU B 33 -2.773 0.518 3.042 1.00 0.00 C ATOM 1624 C GLU B 33 -3.265 1.524 2.027 1.00 0.00 C ATOM 1625 O GLU B 33 -2.941 1.437 0.861 1.00 0.00 O ATOM 1626 CB GLU B 33 -3.846 -0.535 3.298 1.00 0.00 C ATOM 1627 CG GLU B 33 -3.409 -1.633 4.252 1.00 0.00 C ATOM 1628 CD GLU B 33 -4.564 -2.493 4.701 1.00 0.00 C ATOM 1629 OE1 GLU B 33 -5.579 -1.931 5.147 1.00 0.00 O ATOM 1630 OE2 GLU B 33 -4.469 -3.733 4.586 1.00 0.00 O ATOM 0 H GLU B 33 -2.944 0.860 5.091 1.00 0.00 H new ATOM 0 HA GLU B 33 -1.885 0.031 2.639 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -4.733 -0.047 3.702 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -4.135 -0.985 2.348 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -2.661 -2.258 3.765 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -2.932 -1.185 5.124 1.00 0.00 H new ATOM 1637 N ILE B 34 -4.012 2.504 2.480 1.00 0.00 N ATOM 1638 CA ILE B 34 -4.545 3.487 1.573 1.00 0.00 C ATOM 1639 C ILE B 34 -3.530 4.608 1.297 1.00 0.00 C ATOM 1640 O ILE B 34 -3.341 5.006 0.144 1.00 0.00 O ATOM 1641 CB ILE B 34 -5.906 4.060 2.051 1.00 0.00 C ATOM 1642 CG1 ILE B 34 -6.355 5.186 1.131 1.00 0.00 C ATOM 1643 CG2 ILE B 34 -5.829 4.540 3.495 1.00 0.00 C ATOM 1644 CD1 ILE B 34 -7.745 5.714 1.430 1.00 0.00 C ATOM 0 H ILE B 34 -4.261 2.639 3.460 1.00 0.00 H new ATOM 0 HA ILE B 34 -4.736 2.971 0.632 1.00 0.00 H new ATOM 0 HB ILE B 34 -6.644 3.259 2.010 1.00 0.00 H new ATOM 0 HG12 ILE B 34 -5.642 6.007 1.205 1.00 0.00 H new ATOM 0 HG13 ILE B 34 -6.327 4.832 0.101 1.00 0.00 H new ATOM 0 HG21 ILE B 34 -6.798 4.935 3.799 1.00 0.00 H new ATOM 0 HG22 ILE B 34 -5.558 3.705 4.142 1.00 0.00 H new ATOM 0 HG23 ILE B 34 -5.075 5.323 3.578 1.00 0.00 H new ATOM 0 HD11 ILE B 34 -7.989 6.513 0.730 1.00 0.00 H new ATOM 0 HD12 ILE B 34 -8.471 4.907 1.326 1.00 0.00 H new ATOM 0 HD13 ILE B 34 -7.776 6.101 2.448 1.00 0.00 H new ATOM 1656 N VAL B 35 -2.869 5.100 2.351 1.00 0.00 N ATOM 1657 CA VAL B 35 -1.858 6.148 2.206 1.00 0.00 C ATOM 1658 C VAL B 35 -0.726 5.715 1.267 1.00 0.00 C ATOM 1659 O VAL B 35 -0.300 6.478 0.403 1.00 0.00 O ATOM 1660 CB VAL B 35 -1.272 6.560 3.587 1.00 0.00 C ATOM 1661 CG1 VAL B 35 -0.023 7.413 3.429 1.00 0.00 C ATOM 1662 CG2 VAL B 35 -2.314 7.310 4.399 1.00 0.00 C ATOM 0 H VAL B 35 -3.017 4.789 3.311 1.00 0.00 H new ATOM 0 HA VAL B 35 -2.357 7.011 1.766 1.00 0.00 H new ATOM 0 HB VAL B 35 -0.993 5.648 4.115 1.00 0.00 H new ATOM 0 HG11 VAL B 35 0.360 7.683 4.413 1.00 0.00 H new ATOM 0 HG12 VAL B 35 0.736 6.850 2.886 1.00 0.00 H new ATOM 0 HG13 VAL B 35 -0.269 8.319 2.874 1.00 0.00 H new ATOM 0 HG21 VAL B 35 -1.890 7.592 5.363 1.00 0.00 H new ATOM 0 HG22 VAL B 35 -2.619 8.207 3.860 1.00 0.00 H new ATOM 0 HG23 VAL B 35 -3.182 6.670 4.558 1.00 0.00 H new ATOM 1672 N ALA B 36 -0.271 4.489 1.421 1.00 0.00 N ATOM 1673 CA ALA B 36 0.814 3.973 0.616 1.00 0.00 C ATOM 1674 C ALA B 36 0.345 3.626 -0.786 1.00 0.00 C ATOM 1675 O ALA B 36 0.999 3.979 -1.768 1.00 0.00 O ATOM 1676 CB ALA B 36 1.438 2.766 1.285 1.00 0.00 C ATOM 0 H ALA B 36 -0.640 3.827 2.103 1.00 0.00 H new ATOM 0 HA ALA B 36 1.570 4.754 0.528 1.00 0.00 H new ATOM 0 HB1 ALA B 36 2.253 2.389 0.668 1.00 0.00 H new ATOM 0 HB2 ALA B 36 1.826 3.052 2.263 1.00 0.00 H new ATOM 0 HB3 ALA B 36 0.685 1.988 1.407 1.00 0.00 H new ATOM 1682 N VAL B 37 -0.789 2.928 -0.883 1.00 0.00 N ATOM 1683 CA VAL B 37 -1.337 2.556 -2.185 1.00 0.00 C ATOM 1684 C VAL B 37 -1.569 3.776 -3.059 1.00 0.00 C ATOM 1685 O VAL B 37 -0.963 3.895 -4.117 1.00 0.00 O ATOM 1686 CB VAL B 37 -2.634 1.699 -2.069 1.00 0.00 C ATOM 1687 CG1 VAL B 37 -3.450 1.748 -3.356 1.00 0.00 C ATOM 1688 CG2 VAL B 37 -2.271 0.255 -1.751 1.00 0.00 C ATOM 0 H VAL B 37 -1.339 2.613 -0.084 1.00 0.00 H new ATOM 0 HA VAL B 37 -0.586 1.930 -2.666 1.00 0.00 H new ATOM 0 HB VAL B 37 -3.241 2.115 -1.264 1.00 0.00 H new ATOM 0 HG11 VAL B 37 -4.347 1.140 -3.241 1.00 0.00 H new ATOM 0 HG12 VAL B 37 -3.735 2.779 -3.567 1.00 0.00 H new ATOM 0 HG13 VAL B 37 -2.852 1.360 -4.181 1.00 0.00 H new ATOM 0 HG21 VAL B 37 -3.181 -0.340 -1.671 1.00 0.00 H new ATOM 0 HG22 VAL B 37 -1.644 -0.146 -2.547 1.00 0.00 H new ATOM 0 HG23 VAL B 37 -1.728 0.216 -0.807 1.00 0.00 H new ATOM 1698 N MET B 38 -2.417 4.698 -2.619 1.00 0.00 N ATOM 1699 CA MET B 38 -2.688 5.891 -3.388 1.00 0.00 C ATOM 1700 C MET B 38 -1.459 6.776 -3.477 1.00 0.00 C ATOM 1701 O MET B 38 -1.234 7.423 -4.487 1.00 0.00 O ATOM 1702 CB MET B 38 -3.835 6.658 -2.757 1.00 0.00 C ATOM 1703 CG MET B 38 -4.173 7.960 -3.457 1.00 0.00 C ATOM 1704 SD MET B 38 -5.542 8.820 -2.673 1.00 0.00 S ATOM 1705 CE MET B 38 -4.948 8.909 -0.986 1.00 0.00 C ATOM 0 H MET B 38 -2.924 4.637 -1.736 1.00 0.00 H new ATOM 0 HA MET B 38 -2.963 5.592 -4.399 1.00 0.00 H new ATOM 0 HB2 MET B 38 -4.721 6.023 -2.749 1.00 0.00 H new ATOM 0 HB3 MET B 38 -3.586 6.872 -1.718 1.00 0.00 H new ATOM 0 HG2 MET B 38 -3.295 8.606 -3.461 1.00 0.00 H new ATOM 0 HG3 MET B 38 -4.423 7.756 -4.498 1.00 0.00 H new ATOM 0 HE1 MET B 38 -5.134 9.906 -0.587 1.00 0.00 H new ATOM 0 HE2 MET B 38 -5.470 8.171 -0.377 1.00 0.00 H new ATOM 0 HE3 MET B 38 -3.878 8.704 -0.966 1.00 0.00 H new ATOM 1715 N GLY B 39 -0.672 6.801 -2.413 1.00 0.00 N ATOM 1716 CA GLY B 39 0.531 7.606 -2.406 1.00 0.00 C ATOM 1717 C GLY B 39 1.481 7.212 -3.513 1.00 0.00 C ATOM 1718 O GLY B 39 1.859 8.043 -4.341 1.00 0.00 O ATOM 0 H GLY B 39 -0.845 6.278 -1.554 1.00 0.00 H new ATOM 0 HA2 GLY B 39 0.265 8.657 -2.514 1.00 0.00 H new ATOM 0 HA3 GLY B 39 1.032 7.501 -1.444 1.00 0.00 H new ATOM 1722 N ASN B 40 1.842 5.939 -3.546 1.00 0.00 N ATOM 1723 CA ASN B 40 2.757 5.431 -4.557 1.00 0.00 C ATOM 1724 C ASN B 40 2.127 5.501 -5.952 1.00 0.00 C ATOM 1725 O ASN B 40 2.804 5.796 -6.938 1.00 0.00 O ATOM 1726 CB ASN B 40 3.201 3.995 -4.218 1.00 0.00 C ATOM 1727 CG ASN B 40 2.511 2.922 -5.041 1.00 0.00 C ATOM 1728 OD1 ASN B 40 2.964 2.561 -6.123 1.00 0.00 O ATOM 1729 ND2 ASN B 40 1.416 2.405 -4.530 1.00 0.00 N ATOM 0 H ASN B 40 1.515 5.237 -2.883 1.00 0.00 H new ATOM 0 HA ASN B 40 3.644 6.065 -4.562 1.00 0.00 H new ATOM 0 HB2 ASN B 40 4.278 3.915 -4.366 1.00 0.00 H new ATOM 0 HB3 ASN B 40 3.009 3.807 -3.162 1.00 0.00 H new ATOM 0 HD21 ASN B 40 0.911 1.677 -5.036 1.00 0.00 H new ATOM 0 HD22 ASN B 40 1.071 2.732 -3.627 1.00 0.00 H new ATOM 1736 N ALA B 41 0.824 5.251 -6.024 1.00 0.00 N ATOM 1737 CA ALA B 41 0.116 5.307 -7.290 1.00 0.00 C ATOM 1738 C ALA B 41 0.017 6.740 -7.805 1.00 0.00 C ATOM 1739 O ALA B 41 -0.025 6.977 -9.010 1.00 0.00 O ATOM 1740 CB ALA B 41 -1.269 4.684 -7.158 1.00 0.00 C ATOM 0 H ALA B 41 0.242 5.009 -5.222 1.00 0.00 H new ATOM 0 HA ALA B 41 0.686 4.730 -8.019 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -1.784 4.736 -8.117 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -1.172 3.642 -6.854 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -1.843 5.229 -6.408 1.00 0.00 H new ATOM 1746 N SER B 42 0.009 7.703 -6.888 1.00 0.00 N ATOM 1747 CA SER B 42 -0.094 9.096 -7.260 1.00 0.00 C ATOM 1748 C SER B 42 1.272 9.645 -7.648 1.00 0.00 C ATOM 1749 O SER B 42 1.393 10.389 -8.613 1.00 0.00 O ATOM 1750 CB SER B 42 -0.698 9.917 -6.112 1.00 0.00 C ATOM 1751 OG SER B 42 -0.892 11.269 -6.489 1.00 0.00 O ATOM 0 H SER B 42 0.073 7.536 -5.884 1.00 0.00 H new ATOM 0 HA SER B 42 -0.755 9.175 -8.123 1.00 0.00 H new ATOM 0 HB2 SER B 42 -1.651 9.481 -5.813 1.00 0.00 H new ATOM 0 HB3 SER B 42 -0.040 9.871 -5.244 1.00 0.00 H new ATOM 0 HG SER B 42 -1.487 11.706 -5.845 1.00 0.00 H new ATOM 1757 N VAL B 43 2.312 9.267 -6.910 1.00 0.00 N ATOM 1758 CA VAL B 43 3.649 9.734 -7.238 1.00 0.00 C ATOM 1759 C VAL B 43 4.084 9.186 -8.587 1.00 0.00 C ATOM 1760 O VAL B 43 4.734 9.879 -9.364 1.00 0.00 O ATOM 1761 CB VAL B 43 4.711 9.377 -6.160 1.00 0.00 C ATOM 1762 CG1 VAL B 43 4.440 10.101 -4.863 1.00 0.00 C ATOM 1763 CG2 VAL B 43 4.772 7.893 -5.926 1.00 0.00 C ATOM 0 H VAL B 43 2.255 8.652 -6.098 1.00 0.00 H new ATOM 0 HA VAL B 43 3.590 10.822 -7.275 1.00 0.00 H new ATOM 0 HB VAL B 43 5.679 9.704 -6.538 1.00 0.00 H new ATOM 0 HG11 VAL B 43 5.200 9.830 -4.130 1.00 0.00 H new ATOM 0 HG12 VAL B 43 4.468 11.177 -5.034 1.00 0.00 H new ATOM 0 HG13 VAL B 43 3.456 9.819 -4.487 1.00 0.00 H new ATOM 0 HG21 VAL B 43 5.524 7.675 -5.167 1.00 0.00 H new ATOM 0 HG22 VAL B 43 3.799 7.538 -5.586 1.00 0.00 H new ATOM 0 HG23 VAL B 43 5.038 7.389 -6.855 1.00 0.00 H new ATOM 1773 N ALA B 44 3.692 7.941 -8.889 1.00 0.00 N ATOM 1774 CA ALA B 44 4.047 7.311 -10.144 1.00 0.00 C ATOM 1775 C ALA B 44 3.390 7.995 -11.341 1.00 0.00 C ATOM 1776 O ALA B 44 3.820 7.817 -12.467 1.00 0.00 O ATOM 1777 CB ALA B 44 3.670 5.835 -10.107 1.00 0.00 C ATOM 0 H ALA B 44 3.127 7.358 -8.271 1.00 0.00 H new ATOM 0 HA ALA B 44 5.125 7.411 -10.269 1.00 0.00 H new ATOM 0 HB1 ALA B 44 3.939 5.367 -11.054 1.00 0.00 H new ATOM 0 HB2 ALA B 44 4.204 5.343 -9.294 1.00 0.00 H new ATOM 0 HB3 ALA B 44 2.596 5.738 -9.947 1.00 0.00 H new ATOM 1783 N SER B 45 2.375 8.801 -11.089 1.00 0.00 N ATOM 1784 CA SER B 45 1.674 9.483 -12.175 1.00 0.00 C ATOM 1785 C SER B 45 2.556 10.583 -12.768 1.00 0.00 C ATOM 1786 O SER B 45 2.349 11.019 -13.900 1.00 0.00 O ATOM 1787 CB SER B 45 0.335 10.074 -11.698 1.00 0.00 C ATOM 1788 OG SER B 45 0.531 11.208 -10.865 1.00 0.00 O ATOM 0 H SER B 45 2.017 9.002 -10.155 1.00 0.00 H new ATOM 0 HA SER B 45 1.458 8.745 -12.947 1.00 0.00 H new ATOM 0 HB2 SER B 45 -0.267 10.356 -12.562 1.00 0.00 H new ATOM 0 HB3 SER B 45 -0.225 9.314 -11.153 1.00 0.00 H new ATOM 0 HG SER B 45 1.191 10.995 -10.173 1.00 0.00 H new ATOM 1794 N ARG B 46 3.550 11.022 -11.995 1.00 0.00 N ATOM 1795 CA ARG B 46 4.445 12.084 -12.437 1.00 0.00 C ATOM 1796 C ARG B 46 5.874 11.579 -12.492 1.00 0.00 C ATOM 1797 O ARG B 46 6.770 12.264 -12.978 1.00 0.00 O ATOM 1798 CB ARG B 46 4.366 13.282 -11.481 1.00 0.00 C ATOM 1799 CG ARG B 46 3.004 13.968 -11.419 1.00 0.00 C ATOM 1800 CD ARG B 46 2.766 14.903 -12.604 1.00 0.00 C ATOM 1801 NE ARG B 46 2.624 14.193 -13.881 1.00 0.00 N ATOM 1802 CZ ARG B 46 1.516 14.204 -14.630 1.00 0.00 C ATOM 1803 NH1 ARG B 46 0.433 14.842 -14.207 1.00 0.00 N ATOM 1804 NH2 ARG B 46 1.493 13.566 -15.794 1.00 0.00 N ATOM 0 H ARG B 46 3.753 10.658 -11.064 1.00 0.00 H new ATOM 0 HA ARG B 46 4.135 12.399 -13.434 1.00 0.00 H new ATOM 0 HB2 ARG B 46 4.633 12.946 -10.479 1.00 0.00 H new ATOM 0 HB3 ARG B 46 5.113 14.017 -11.781 1.00 0.00 H new ATOM 0 HG2 ARG B 46 2.220 13.211 -11.394 1.00 0.00 H new ATOM 0 HG3 ARG B 46 2.928 14.536 -10.491 1.00 0.00 H new ATOM 0 HD2 ARG B 46 1.866 15.490 -12.420 1.00 0.00 H new ATOM 0 HD3 ARG B 46 3.596 15.606 -12.677 1.00 0.00 H new ATOM 0 HE ARG B 46 3.423 13.656 -14.219 1.00 0.00 H new ATOM 0 HH11 ARG B 46 0.444 15.326 -13.309 1.00 0.00 H new ATOM 0 HH12 ARG B 46 -0.411 14.849 -14.780 1.00 0.00 H new ATOM 0 HH21 ARG B 46 2.321 13.066 -16.118 1.00 0.00 H new ATOM 0 HH22 ARG B 46 0.647 13.575 -16.364 1.00 0.00 H new ATOM 1818 N ASP B 47 6.073 10.382 -11.994 1.00 0.00 N ATOM 1819 CA ASP B 47 7.403 9.821 -11.881 1.00 0.00 C ATOM 1820 C ASP B 47 7.533 8.471 -12.622 1.00 0.00 C ATOM 1821 O ASP B 47 8.307 8.354 -13.568 1.00 0.00 O ATOM 1822 CB ASP B 47 7.734 9.679 -10.397 1.00 0.00 C ATOM 1823 CG ASP B 47 9.123 9.209 -10.138 1.00 0.00 C ATOM 1824 OD1 ASP B 47 10.051 10.048 -10.103 1.00 0.00 O ATOM 1825 OD2 ASP B 47 9.298 8.007 -9.945 1.00 0.00 O ATOM 0 H ASP B 47 5.327 9.773 -11.658 1.00 0.00 H new ATOM 0 HA ASP B 47 8.117 10.491 -12.360 1.00 0.00 H new ATOM 0 HB2 ASP B 47 7.588 10.642 -9.907 1.00 0.00 H new ATOM 0 HB3 ASP B 47 7.032 8.980 -9.942 1.00 0.00 H new ATOM 1830 N LEU B 48 6.767 7.465 -12.173 1.00 0.00 N ATOM 1831 CA LEU B 48 6.755 6.098 -12.775 1.00 0.00 C ATOM 1832 C LEU B 48 8.039 5.308 -12.504 1.00 0.00 C ATOM 1833 O LEU B 48 8.187 4.170 -12.957 1.00 0.00 O ATOM 1834 CB LEU B 48 6.443 6.125 -14.284 1.00 0.00 C ATOM 1835 CG LEU B 48 4.956 6.168 -14.663 1.00 0.00 C ATOM 1836 CD1 LEU B 48 4.794 6.330 -16.162 1.00 0.00 C ATOM 1837 CD2 LEU B 48 4.241 4.901 -14.187 1.00 0.00 C ATOM 0 H LEU B 48 6.132 7.564 -11.381 1.00 0.00 H new ATOM 0 HA LEU B 48 5.943 5.572 -12.272 1.00 0.00 H new ATOM 0 HB2 LEU B 48 6.934 6.994 -14.721 1.00 0.00 H new ATOM 0 HB3 LEU B 48 6.889 5.243 -14.743 1.00 0.00 H new ATOM 0 HG LEU B 48 4.503 7.027 -14.169 1.00 0.00 H new ATOM 0 HD11 LEU B 48 3.734 6.358 -16.412 1.00 0.00 H new ATOM 0 HD12 LEU B 48 5.267 7.259 -16.481 1.00 0.00 H new ATOM 0 HD13 LEU B 48 5.265 5.489 -16.672 1.00 0.00 H new ATOM 0 HD21 LEU B 48 3.188 4.951 -14.465 1.00 0.00 H new ATOM 0 HD22 LEU B 48 4.698 4.028 -14.653 1.00 0.00 H new ATOM 0 HD23 LEU B 48 4.326 4.820 -13.103 1.00 0.00 H new ATOM 1849 N LYS B 49 8.943 5.896 -11.755 1.00 0.00 N ATOM 1850 CA LYS B 49 10.185 5.243 -11.386 1.00 0.00 C ATOM 1851 C LYS B 49 10.319 5.255 -9.872 1.00 0.00 C ATOM 1852 O LYS B 49 11.414 5.196 -9.317 1.00 0.00 O ATOM 1853 CB LYS B 49 11.383 5.927 -12.076 1.00 0.00 C ATOM 1854 CG LYS B 49 11.352 7.442 -12.005 1.00 0.00 C ATOM 1855 CD LYS B 49 12.441 8.075 -12.846 1.00 0.00 C ATOM 1856 CE LYS B 49 12.307 9.590 -12.855 1.00 0.00 C ATOM 1857 NZ LYS B 49 13.331 10.232 -13.713 1.00 0.00 N ATOM 0 H LYS B 49 8.841 6.840 -11.383 1.00 0.00 H new ATOM 0 HA LYS B 49 10.175 4.207 -11.724 1.00 0.00 H new ATOM 0 HB2 LYS B 49 12.305 5.571 -11.617 1.00 0.00 H new ATOM 0 HB3 LYS B 49 11.409 5.623 -13.122 1.00 0.00 H new ATOM 0 HG2 LYS B 49 10.380 7.800 -12.343 1.00 0.00 H new ATOM 0 HG3 LYS B 49 11.466 7.758 -10.968 1.00 0.00 H new ATOM 0 HD2 LYS B 49 13.419 7.795 -12.454 1.00 0.00 H new ATOM 0 HD3 LYS B 49 12.386 7.695 -13.866 1.00 0.00 H new ATOM 0 HE2 LYS B 49 11.313 9.864 -13.209 1.00 0.00 H new ATOM 0 HE3 LYS B 49 12.398 9.968 -11.837 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 13.205 11.264 -13.691 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 14.279 9.992 -13.360 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 13.228 9.891 -14.690 1.00 0.00 H new ATOM 1871 N ILE B 50 9.167 5.321 -9.217 1.00 0.00 N ATOM 1872 CA ILE B 50 9.081 5.340 -7.774 1.00 0.00 C ATOM 1873 C ILE B 50 9.412 3.935 -7.210 1.00 0.00 C ATOM 1874 O ILE B 50 9.257 2.927 -7.909 1.00 0.00 O ATOM 1875 CB ILE B 50 7.648 5.795 -7.314 1.00 0.00 C ATOM 1876 CG1 ILE B 50 7.598 5.985 -5.793 1.00 0.00 C ATOM 1877 CG2 ILE B 50 6.596 4.791 -7.759 1.00 0.00 C ATOM 1878 CD1 ILE B 50 8.424 7.154 -5.295 1.00 0.00 C ATOM 0 H ILE B 50 8.261 5.363 -9.683 1.00 0.00 H new ATOM 0 HA ILE B 50 9.806 6.056 -7.386 1.00 0.00 H new ATOM 0 HB ILE B 50 7.431 6.753 -7.786 1.00 0.00 H new ATOM 0 HG12 ILE B 50 6.561 6.129 -5.488 1.00 0.00 H new ATOM 0 HG13 ILE B 50 7.949 5.073 -5.311 1.00 0.00 H new ATOM 0 HG21 ILE B 50 5.612 5.125 -7.430 1.00 0.00 H new ATOM 0 HG22 ILE B 50 6.607 4.710 -8.846 1.00 0.00 H new ATOM 0 HG23 ILE B 50 6.814 3.817 -7.320 1.00 0.00 H new ATOM 0 HD11 ILE B 50 8.339 7.224 -4.211 1.00 0.00 H new ATOM 0 HD12 ILE B 50 9.469 7.004 -5.568 1.00 0.00 H new ATOM 0 HD13 ILE B 50 8.060 8.076 -5.748 1.00 0.00 H new ATOM 1890 N GLU B 51 9.864 3.874 -5.964 1.00 0.00 N ATOM 1891 CA GLU B 51 10.245 2.604 -5.351 1.00 0.00 C ATOM 1892 C GLU B 51 9.248 2.219 -4.258 1.00 0.00 C ATOM 1893 O GLU B 51 8.811 3.068 -3.480 1.00 0.00 O ATOM 1894 CB GLU B 51 11.666 2.689 -4.781 1.00 0.00 C ATOM 1895 CG GLU B 51 12.202 1.364 -4.261 1.00 0.00 C ATOM 1896 CD GLU B 51 13.615 1.472 -3.746 1.00 0.00 C ATOM 1897 OE1 GLU B 51 13.799 1.932 -2.610 1.00 0.00 O ATOM 1898 OE2 GLU B 51 14.554 1.092 -4.479 1.00 0.00 O ATOM 0 H GLU B 51 9.976 4.686 -5.357 1.00 0.00 H new ATOM 0 HA GLU B 51 10.229 1.830 -6.118 1.00 0.00 H new ATOM 0 HB2 GLU B 51 12.336 3.062 -5.556 1.00 0.00 H new ATOM 0 HB3 GLU B 51 11.679 3.418 -3.971 1.00 0.00 H new ATOM 0 HG2 GLU B 51 11.555 1.003 -3.462 1.00 0.00 H new ATOM 0 HG3 GLU B 51 12.166 0.623 -5.060 1.00 0.00 H new ATOM 1905 N GLN B 52 8.897 0.940 -4.206 1.00 0.00 N ATOM 1906 CA GLN B 52 7.908 0.447 -3.251 1.00 0.00 C ATOM 1907 C GLN B 52 8.585 -0.183 -2.040 1.00 0.00 C ATOM 1908 O GLN B 52 9.028 -1.331 -2.095 1.00 0.00 O ATOM 1909 CB GLN B 52 6.989 -0.584 -3.918 1.00 0.00 C ATOM 1910 CG GLN B 52 6.522 -0.208 -5.326 1.00 0.00 C ATOM 1911 CD GLN B 52 5.958 1.196 -5.426 1.00 0.00 C ATOM 1912 OE1 GLN B 52 5.447 1.740 -4.463 1.00 0.00 O ATOM 1913 NE2 GLN B 52 6.043 1.781 -6.600 1.00 0.00 N ATOM 0 H GLN B 52 9.284 0.221 -4.817 1.00 0.00 H new ATOM 0 HA GLN B 52 7.314 1.298 -2.917 1.00 0.00 H new ATOM 0 HB2 GLN B 52 7.512 -1.539 -3.966 1.00 0.00 H new ATOM 0 HB3 GLN B 52 6.113 -0.732 -3.287 1.00 0.00 H new ATOM 0 HG2 GLN B 52 7.361 -0.303 -6.015 1.00 0.00 H new ATOM 0 HG3 GLN B 52 5.762 -0.919 -5.649 1.00 0.00 H new ATOM 0 HE21 GLN B 52 6.478 1.293 -7.383 1.00 0.00 H new ATOM 0 HE22 GLN B 52 5.674 2.723 -6.728 1.00 0.00 H new ATOM 1922 N SER B 53 8.692 0.579 -0.965 1.00 0.00 N ATOM 1923 CA SER B 53 9.285 0.082 0.264 1.00 0.00 C ATOM 1924 C SER B 53 8.441 0.493 1.483 1.00 0.00 C ATOM 1925 O SER B 53 7.953 1.625 1.552 1.00 0.00 O ATOM 1926 CB SER B 53 10.720 0.615 0.402 1.00 0.00 C ATOM 1927 OG SER B 53 11.319 0.202 1.620 1.00 0.00 O ATOM 0 H SER B 53 8.375 1.547 -0.919 1.00 0.00 H new ATOM 0 HA SER B 53 9.311 -1.007 0.223 1.00 0.00 H new ATOM 0 HB2 SER B 53 11.321 0.263 -0.437 1.00 0.00 H new ATOM 0 HB3 SER B 53 10.710 1.704 0.352 1.00 0.00 H new ATOM 0 HG SER B 53 12.231 0.557 1.673 1.00 0.00 H new ATOM 1933 N PRO B 54 8.273 -0.435 2.463 1.00 0.00 N ATOM 1934 CA PRO B 54 7.496 -0.193 3.704 1.00 0.00 C ATOM 1935 C PRO B 54 7.968 1.049 4.462 1.00 0.00 C ATOM 1936 O PRO B 54 7.176 1.737 5.110 1.00 0.00 O ATOM 1937 CB PRO B 54 7.777 -1.446 4.550 1.00 0.00 C ATOM 1938 CG PRO B 54 8.929 -2.129 3.888 1.00 0.00 C ATOM 1939 CD PRO B 54 8.826 -1.794 2.438 1.00 0.00 C ATOM 0 HA PRO B 54 6.442 -0.021 3.486 1.00 0.00 H new ATOM 0 HB2 PRO B 54 8.019 -1.178 5.579 1.00 0.00 H new ATOM 0 HB3 PRO B 54 6.904 -2.098 4.587 1.00 0.00 H new ATOM 0 HG2 PRO B 54 9.877 -1.785 4.302 1.00 0.00 H new ATOM 0 HG3 PRO B 54 8.886 -3.207 4.044 1.00 0.00 H new ATOM 0 HD2 PRO B 54 9.797 -1.828 1.944 1.00 0.00 H new ATOM 0 HD3 PRO B 54 8.174 -2.487 1.907 1.00 0.00 H new ATOM 1947 N GLU B 55 9.263 1.332 4.369 1.00 0.00 N ATOM 1948 CA GLU B 55 9.854 2.467 5.062 1.00 0.00 C ATOM 1949 C GLU B 55 9.351 3.782 4.477 1.00 0.00 C ATOM 1950 O GLU B 55 8.997 4.708 5.207 1.00 0.00 O ATOM 1951 CB GLU B 55 11.378 2.407 4.974 1.00 0.00 C ATOM 1952 CG GLU B 55 12.081 3.494 5.767 1.00 0.00 C ATOM 1953 CD GLU B 55 13.579 3.470 5.581 1.00 0.00 C ATOM 1954 OE1 GLU B 55 14.205 2.452 5.919 1.00 0.00 O ATOM 1955 OE2 GLU B 55 14.138 4.475 5.093 1.00 0.00 O ATOM 0 H GLU B 55 9.925 0.787 3.817 1.00 0.00 H new ATOM 0 HA GLU B 55 9.556 2.418 6.109 1.00 0.00 H new ATOM 0 HB2 GLU B 55 11.715 1.434 5.331 1.00 0.00 H new ATOM 0 HB3 GLU B 55 11.675 2.483 3.928 1.00 0.00 H new ATOM 0 HG2 GLU B 55 11.696 4.467 5.463 1.00 0.00 H new ATOM 0 HG3 GLU B 55 11.848 3.376 6.825 1.00 0.00 H new ATOM 1962 N LEU B 56 9.326 3.852 3.154 1.00 0.00 N ATOM 1963 CA LEU B 56 8.874 5.051 2.456 1.00 0.00 C ATOM 1964 C LEU B 56 7.431 5.384 2.804 1.00 0.00 C ATOM 1965 O LEU B 56 7.081 6.554 2.976 1.00 0.00 O ATOM 1966 CB LEU B 56 9.048 4.908 0.934 1.00 0.00 C ATOM 1967 CG LEU B 56 10.425 5.309 0.363 1.00 0.00 C ATOM 1968 CD1 LEU B 56 10.683 6.795 0.573 1.00 0.00 C ATOM 1969 CD2 LEU B 56 11.545 4.484 0.988 1.00 0.00 C ATOM 0 H LEU B 56 9.614 3.091 2.539 1.00 0.00 H new ATOM 0 HA LEU B 56 9.499 5.878 2.792 1.00 0.00 H new ATOM 0 HB2 LEU B 56 8.854 3.870 0.663 1.00 0.00 H new ATOM 0 HB3 LEU B 56 8.285 5.513 0.444 1.00 0.00 H new ATOM 0 HG LEU B 56 10.411 5.105 -0.708 1.00 0.00 H new ATOM 0 HD11 LEU B 56 11.659 7.056 0.163 1.00 0.00 H new ATOM 0 HD12 LEU B 56 9.910 7.374 0.067 1.00 0.00 H new ATOM 0 HD13 LEU B 56 10.665 7.020 1.639 1.00 0.00 H new ATOM 0 HD21 LEU B 56 12.502 4.790 0.565 1.00 0.00 H new ATOM 0 HD22 LEU B 56 11.557 4.644 2.066 1.00 0.00 H new ATOM 0 HD23 LEU B 56 11.378 3.427 0.780 1.00 0.00 H new ATOM 1981 N SER B 57 6.605 4.360 2.921 1.00 0.00 N ATOM 1982 CA SER B 57 5.217 4.542 3.293 1.00 0.00 C ATOM 1983 C SER B 57 5.125 5.130 4.703 1.00 0.00 C ATOM 1984 O SER B 57 4.484 6.159 4.922 1.00 0.00 O ATOM 1985 CB SER B 57 4.498 3.217 3.233 1.00 0.00 C ATOM 1986 OG SER B 57 4.781 2.548 2.019 1.00 0.00 O ATOM 0 H SER B 57 6.875 3.389 2.762 1.00 0.00 H new ATOM 0 HA SER B 57 4.746 5.234 2.595 1.00 0.00 H new ATOM 0 HB2 SER B 57 4.801 2.595 4.076 1.00 0.00 H new ATOM 0 HB3 SER B 57 3.424 3.376 3.324 1.00 0.00 H new ATOM 0 HG SER B 57 4.886 1.589 2.191 1.00 0.00 H new ATOM 1992 N ALA B 58 5.756 4.449 5.655 1.00 0.00 N ATOM 1993 CA ALA B 58 5.849 4.935 7.036 1.00 0.00 C ATOM 1994 C ALA B 58 6.268 6.416 7.098 1.00 0.00 C ATOM 1995 O ALA B 58 5.873 7.142 8.010 1.00 0.00 O ATOM 1996 CB ALA B 58 6.826 4.076 7.828 1.00 0.00 C ATOM 0 H ALA B 58 6.215 3.552 5.498 1.00 0.00 H new ATOM 0 HA ALA B 58 4.857 4.858 7.481 1.00 0.00 H new ATOM 0 HB1 ALA B 58 6.888 4.445 8.852 1.00 0.00 H new ATOM 0 HB2 ALA B 58 6.479 3.043 7.835 1.00 0.00 H new ATOM 0 HB3 ALA B 58 7.811 4.125 7.365 1.00 0.00 H new ATOM 2002 N LYS B 59 7.044 6.857 6.117 1.00 0.00 N ATOM 2003 CA LYS B 59 7.503 8.232 6.076 1.00 0.00 C ATOM 2004 C LYS B 59 6.463 9.153 5.404 1.00 0.00 C ATOM 2005 O LYS B 59 6.239 10.268 5.864 1.00 0.00 O ATOM 2006 CB LYS B 59 8.868 8.321 5.374 1.00 0.00 C ATOM 2007 CG LYS B 59 9.550 9.686 5.490 1.00 0.00 C ATOM 2008 CD LYS B 59 9.238 10.591 4.304 1.00 0.00 C ATOM 2009 CE LYS B 59 9.926 10.101 3.036 1.00 0.00 C ATOM 2010 NZ LYS B 59 11.398 10.017 3.204 1.00 0.00 N ATOM 0 H LYS B 59 7.367 6.280 5.341 1.00 0.00 H new ATOM 0 HA LYS B 59 7.625 8.580 7.102 1.00 0.00 H new ATOM 0 HB2 LYS B 59 9.528 7.562 5.793 1.00 0.00 H new ATOM 0 HB3 LYS B 59 8.737 8.083 4.319 1.00 0.00 H new ATOM 0 HG2 LYS B 59 9.228 10.173 6.410 1.00 0.00 H new ATOM 0 HG3 LYS B 59 10.628 9.546 5.563 1.00 0.00 H new ATOM 0 HD2 LYS B 59 8.160 10.626 4.145 1.00 0.00 H new ATOM 0 HD3 LYS B 59 9.561 11.608 4.525 1.00 0.00 H new ATOM 0 HE2 LYS B 59 9.535 9.120 2.766 1.00 0.00 H new ATOM 0 HE3 LYS B 59 9.692 10.775 2.212 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 11.855 10.016 2.270 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 11.732 10.836 3.752 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 11.640 9.141 3.709 1.00 0.00 H new ATOM 2024 N VAL B 60 5.825 8.678 4.325 1.00 0.00 N ATOM 2025 CA VAL B 60 4.803 9.482 3.610 1.00 0.00 C ATOM 2026 C VAL B 60 3.588 9.779 4.506 1.00 0.00 C ATOM 2027 O VAL B 60 2.850 10.714 4.257 1.00 0.00 O ATOM 2028 CB VAL B 60 4.336 8.824 2.268 1.00 0.00 C ATOM 2029 CG1 VAL B 60 3.495 7.589 2.514 1.00 0.00 C ATOM 2030 CG2 VAL B 60 3.567 9.824 1.403 1.00 0.00 C ATOM 0 H VAL B 60 5.990 7.754 3.926 1.00 0.00 H new ATOM 0 HA VAL B 60 5.291 10.423 3.357 1.00 0.00 H new ATOM 0 HB VAL B 60 5.234 8.519 1.731 1.00 0.00 H new ATOM 0 HG11 VAL B 60 3.190 7.161 1.559 1.00 0.00 H new ATOM 0 HG12 VAL B 60 4.079 6.856 3.071 1.00 0.00 H new ATOM 0 HG13 VAL B 60 2.610 7.860 3.089 1.00 0.00 H new ATOM 0 HG21 VAL B 60 3.255 9.340 0.478 1.00 0.00 H new ATOM 0 HG22 VAL B 60 2.688 10.173 1.945 1.00 0.00 H new ATOM 0 HG23 VAL B 60 4.210 10.673 1.170 1.00 0.00 H new ATOM 2040 N VAL B 61 3.417 8.990 5.561 1.00 0.00 N ATOM 2041 CA VAL B 61 2.304 9.210 6.488 1.00 0.00 C ATOM 2042 C VAL B 61 2.769 10.088 7.659 1.00 0.00 C ATOM 2043 O VAL B 61 2.023 10.926 8.162 1.00 0.00 O ATOM 2044 CB VAL B 61 1.647 7.883 6.993 1.00 0.00 C ATOM 2045 CG1 VAL B 61 2.640 7.003 7.728 1.00 0.00 C ATOM 2046 CG2 VAL B 61 0.423 8.177 7.868 1.00 0.00 C ATOM 0 H VAL B 61 4.022 8.203 5.797 1.00 0.00 H new ATOM 0 HA VAL B 61 1.521 9.730 5.936 1.00 0.00 H new ATOM 0 HB VAL B 61 1.315 7.331 6.114 1.00 0.00 H new ATOM 0 HG11 VAL B 61 2.142 6.092 8.061 1.00 0.00 H new ATOM 0 HG12 VAL B 61 3.461 6.744 7.059 1.00 0.00 H new ATOM 0 HG13 VAL B 61 3.032 7.540 8.592 1.00 0.00 H new ATOM 0 HG21 VAL B 61 -0.016 7.239 8.207 1.00 0.00 H new ATOM 0 HG22 VAL B 61 0.727 8.768 8.732 1.00 0.00 H new ATOM 0 HG23 VAL B 61 -0.313 8.734 7.288 1.00 0.00 H new ATOM 2056 N GLU B 62 4.016 9.884 8.063 1.00 0.00 N ATOM 2057 CA GLU B 62 4.641 10.711 9.092 1.00 0.00 C ATOM 2058 C GLU B 62 4.695 12.154 8.609 1.00 0.00 C ATOM 2059 O GLU B 62 4.305 13.088 9.316 1.00 0.00 O ATOM 2060 CB GLU B 62 6.053 10.219 9.404 1.00 0.00 C ATOM 2061 CG GLU B 62 6.754 11.045 10.468 1.00 0.00 C ATOM 2062 CD GLU B 62 8.208 10.687 10.623 1.00 0.00 C ATOM 2063 OE1 GLU B 62 8.519 9.784 11.427 1.00 0.00 O ATOM 2064 OE2 GLU B 62 9.053 11.321 9.952 1.00 0.00 O ATOM 0 H GLU B 62 4.619 9.149 7.693 1.00 0.00 H new ATOM 0 HA GLU B 62 4.048 10.645 10.004 1.00 0.00 H new ATOM 0 HB2 GLU B 62 6.004 9.181 9.733 1.00 0.00 H new ATOM 0 HB3 GLU B 62 6.647 10.236 8.490 1.00 0.00 H new ATOM 0 HG2 GLU B 62 6.670 12.102 10.214 1.00 0.00 H new ATOM 0 HG3 GLU B 62 6.247 10.905 11.423 1.00 0.00 H new ATOM 2071 N LYS B 63 5.171 12.311 7.386 1.00 0.00 N ATOM 2072 CA LYS B 63 5.262 13.601 6.735 1.00 0.00 C ATOM 2073 C LYS B 63 3.860 14.174 6.540 1.00 0.00 C ATOM 2074 O LYS B 63 3.611 15.353 6.791 1.00 0.00 O ATOM 2075 CB LYS B 63 5.948 13.418 5.381 1.00 0.00 C ATOM 2076 CG LYS B 63 6.250 14.698 4.649 1.00 0.00 C ATOM 2077 CD LYS B 63 6.819 14.411 3.267 1.00 0.00 C ATOM 2078 CE LYS B 63 7.298 15.677 2.576 1.00 0.00 C ATOM 2079 NZ LYS B 63 8.541 16.203 3.183 1.00 0.00 N ATOM 0 H LYS B 63 5.508 11.537 6.813 1.00 0.00 H new ATOM 0 HA LYS B 63 5.841 14.292 7.348 1.00 0.00 H new ATOM 0 HB2 LYS B 63 6.880 12.874 5.532 1.00 0.00 H new ATOM 0 HB3 LYS B 63 5.314 12.795 4.749 1.00 0.00 H new ATOM 0 HG2 LYS B 63 5.341 15.292 4.556 1.00 0.00 H new ATOM 0 HG3 LYS B 63 6.961 15.291 5.224 1.00 0.00 H new ATOM 0 HD2 LYS B 63 7.649 13.709 3.355 1.00 0.00 H new ATOM 0 HD3 LYS B 63 6.057 13.929 2.654 1.00 0.00 H new ATOM 0 HE2 LYS B 63 7.469 15.471 1.520 1.00 0.00 H new ATOM 0 HE3 LYS B 63 6.518 16.437 2.630 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 8.926 16.961 2.584 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 8.332 16.581 4.129 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 9.240 15.437 3.263 1.00 0.00 H new ATOM 2093 N LEU B 64 2.961 13.309 6.100 1.00 0.00 N ATOM 2094 CA LEU B 64 1.562 13.649 5.870 1.00 0.00 C ATOM 2095 C LEU B 64 0.931 14.243 7.130 1.00 0.00 C ATOM 2096 O LEU B 64 0.427 15.363 7.116 1.00 0.00 O ATOM 2097 CB LEU B 64 0.806 12.393 5.456 1.00 0.00 C ATOM 2098 CG LEU B 64 -0.651 12.560 5.094 1.00 0.00 C ATOM 2099 CD1 LEU B 64 -0.774 13.188 3.729 1.00 0.00 C ATOM 2100 CD2 LEU B 64 -1.364 11.221 5.140 1.00 0.00 C ATOM 0 H LEU B 64 3.183 12.336 5.889 1.00 0.00 H new ATOM 0 HA LEU B 64 1.506 14.396 5.078 1.00 0.00 H new ATOM 0 HB2 LEU B 64 1.320 11.954 4.601 1.00 0.00 H new ATOM 0 HB3 LEU B 64 0.872 11.673 6.271 1.00 0.00 H new ATOM 0 HG LEU B 64 -1.124 13.220 5.821 1.00 0.00 H new ATOM 0 HD11 LEU B 64 -1.828 13.305 3.476 1.00 0.00 H new ATOM 0 HD12 LEU B 64 -0.291 14.165 3.733 1.00 0.00 H new ATOM 0 HD13 LEU B 64 -0.292 12.549 2.990 1.00 0.00 H new ATOM 0 HD21 LEU B 64 -2.413 11.358 4.877 1.00 0.00 H new ATOM 0 HD22 LEU B 64 -0.898 10.536 4.431 1.00 0.00 H new ATOM 0 HD23 LEU B 64 -1.294 10.806 6.145 1.00 0.00 H new ATOM 2112 N ASN B 65 0.978 13.481 8.222 1.00 0.00 N ATOM 2113 CA ASN B 65 0.412 13.905 9.499 1.00 0.00 C ATOM 2114 C ASN B 65 0.985 15.233 9.943 1.00 0.00 C ATOM 2115 O ASN B 65 0.282 16.051 10.499 1.00 0.00 O ATOM 2116 CB ASN B 65 0.655 12.847 10.577 1.00 0.00 C ATOM 2117 CG ASN B 65 0.191 13.299 11.958 1.00 0.00 C ATOM 2118 OD1 ASN B 65 0.959 13.881 12.723 1.00 0.00 O ATOM 2119 ND2 ASN B 65 -1.059 13.024 12.282 1.00 0.00 N ATOM 0 H ASN B 65 1.408 12.556 8.245 1.00 0.00 H new ATOM 0 HA ASN B 65 -0.662 14.026 9.356 1.00 0.00 H new ATOM 0 HB2 ASN B 65 0.133 11.930 10.305 1.00 0.00 H new ATOM 0 HB3 ASN B 65 1.718 12.610 10.615 1.00 0.00 H new ATOM 0 HD21 ASN B 65 -1.421 13.296 13.196 1.00 0.00 H new ATOM 0 HD22 ASN B 65 -1.663 12.540 11.618 1.00 0.00 H new ATOM 2126 N GLN B 66 2.260 15.441 9.665 1.00 0.00 N ATOM 2127 CA GLN B 66 2.924 16.674 10.048 1.00 0.00 C ATOM 2128 C GLN B 66 2.246 17.859 9.371 1.00 0.00 C ATOM 2129 O GLN B 66 1.910 18.853 10.014 1.00 0.00 O ATOM 2130 CB GLN B 66 4.404 16.623 9.665 1.00 0.00 C ATOM 2131 CG GLN B 66 5.341 17.112 10.760 1.00 0.00 C ATOM 2132 CD GLN B 66 5.527 16.100 11.892 1.00 0.00 C ATOM 2133 OE1 GLN B 66 4.521 15.271 12.137 1.00 0.00 O flip ATOM 2134 NE2 GLN B 66 6.577 16.062 12.529 1.00 0.00 N flip ATOM 0 H GLN B 66 2.855 14.773 9.176 1.00 0.00 H new ATOM 0 HA GLN B 66 2.850 16.792 11.129 1.00 0.00 H new ATOM 0 HB2 GLN B 66 4.667 15.597 9.406 1.00 0.00 H new ATOM 0 HB3 GLN B 66 4.559 17.227 8.771 1.00 0.00 H new ATOM 0 HG2 GLN B 66 6.313 17.340 10.322 1.00 0.00 H new ATOM 0 HG3 GLN B 66 4.951 18.042 11.174 1.00 0.00 H new ATOM 0 HE21 GLN B 66 7.329 16.716 12.312 1.00 0.00 H new ATOM 0 HE22 GLN B 66 6.697 15.376 13.275 1.00 0.00 H new ATOM 2143 N VAL B 67 2.048 17.737 8.070 1.00 0.00 N ATOM 2144 CA VAL B 67 1.377 18.767 7.287 1.00 0.00 C ATOM 2145 C VAL B 67 -0.068 18.960 7.760 1.00 0.00 C ATOM 2146 O VAL B 67 -0.491 20.081 8.061 1.00 0.00 O ATOM 2147 CB VAL B 67 1.368 18.416 5.780 1.00 0.00 C ATOM 2148 CG1 VAL B 67 0.787 19.555 4.958 1.00 0.00 C ATOM 2149 CG2 VAL B 67 2.770 18.067 5.296 1.00 0.00 C ATOM 0 H VAL B 67 2.345 16.927 7.526 1.00 0.00 H new ATOM 0 HA VAL B 67 1.936 19.691 7.434 1.00 0.00 H new ATOM 0 HB VAL B 67 0.732 17.541 5.645 1.00 0.00 H new ATOM 0 HG11 VAL B 67 0.793 19.282 3.903 1.00 0.00 H new ATOM 0 HG12 VAL B 67 -0.237 19.749 5.277 1.00 0.00 H new ATOM 0 HG13 VAL B 67 1.388 20.452 5.104 1.00 0.00 H new ATOM 0 HG21 VAL B 67 2.738 17.824 4.234 1.00 0.00 H new ATOM 0 HG22 VAL B 67 3.432 18.919 5.454 1.00 0.00 H new ATOM 0 HG23 VAL B 67 3.144 17.208 5.854 1.00 0.00 H new ATOM 2159 N CYS B 68 -0.810 17.861 7.844 1.00 0.00 N ATOM 2160 CA CYS B 68 -2.223 17.890 8.237 1.00 0.00 C ATOM 2161 C CYS B 68 -2.413 18.264 9.707 1.00 0.00 C ATOM 2162 O CYS B 68 -3.533 18.497 10.149 1.00 0.00 O ATOM 2163 CB CYS B 68 -2.851 16.533 7.971 1.00 0.00 C ATOM 2164 SG CYS B 68 -2.452 15.860 6.331 1.00 0.00 S ATOM 0 H CYS B 68 -0.455 16.926 7.643 1.00 0.00 H new ATOM 0 HA CYS B 68 -2.713 18.660 7.640 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -2.517 15.831 8.735 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -3.933 16.617 8.067 1.00 0.00 H new ATOM 2169 N ALA B 69 -1.327 18.319 10.453 1.00 0.00 N ATOM 2170 CA ALA B 69 -1.399 18.695 11.857 1.00 0.00 C ATOM 2171 C ALA B 69 -1.394 20.204 11.981 1.00 0.00 C ATOM 2172 O ALA B 69 -1.794 20.760 13.002 1.00 0.00 O ATOM 2173 CB ALA B 69 -0.244 18.097 12.646 1.00 0.00 C ATOM 0 H ALA B 69 -0.387 18.110 10.116 1.00 0.00 H new ATOM 0 HA ALA B 69 -2.326 18.301 12.273 1.00 0.00 H new ATOM 0 HB1 ALA B 69 -0.324 18.395 13.691 1.00 0.00 H new ATOM 0 HB2 ALA B 69 -0.279 17.010 12.575 1.00 0.00 H new ATOM 0 HB3 ALA B 69 0.700 18.457 12.238 1.00 0.00 H new ATOM 2179 N LYS B 70 -0.941 20.863 10.930 1.00 0.00 N ATOM 2180 CA LYS B 70 -0.881 22.306 10.908 1.00 0.00 C ATOM 2181 C LYS B 70 -2.119 22.881 10.245 1.00 0.00 C ATOM 2182 O LYS B 70 -2.468 24.045 10.461 1.00 0.00 O ATOM 2183 CB LYS B 70 0.368 22.782 10.172 1.00 0.00 C ATOM 2184 CG LYS B 70 1.672 22.284 10.773 1.00 0.00 C ATOM 2185 CD LYS B 70 2.875 22.811 10.001 1.00 0.00 C ATOM 2186 CE LYS B 70 3.014 24.321 10.148 1.00 0.00 C ATOM 2187 NZ LYS B 70 4.119 24.857 9.317 1.00 0.00 N ATOM 0 H LYS B 70 -0.608 20.414 10.077 1.00 0.00 H new ATOM 0 HA LYS B 70 -0.837 22.657 11.939 1.00 0.00 H new ATOM 0 HB2 LYS B 70 0.311 22.455 9.134 1.00 0.00 H new ATOM 0 HB3 LYS B 70 0.378 23.872 10.163 1.00 0.00 H new ATOM 0 HG2 LYS B 70 1.739 22.600 11.814 1.00 0.00 H new ATOM 0 HG3 LYS B 70 1.684 21.194 10.769 1.00 0.00 H new ATOM 0 HD2 LYS B 70 3.781 22.324 10.361 1.00 0.00 H new ATOM 0 HD3 LYS B 70 2.773 22.555 8.946 1.00 0.00 H new ATOM 0 HE2 LYS B 70 2.078 24.801 9.862 1.00 0.00 H new ATOM 0 HE3 LYS B 70 3.193 24.569 11.194 1.00 0.00 H new ATOM 0 HZ1 LYS B 70 4.181 25.887 9.445 1.00 0.00 H new ATOM 0 HZ2 LYS B 70 5.016 24.418 9.607 1.00 0.00 H new ATOM 0 HZ3 LYS B 70 3.936 24.643 8.316 1.00 0.00 H new ATOM 2201 N ASP B 71 -2.798 22.060 9.453 1.00 0.00 N ATOM 2202 CA ASP B 71 -3.990 22.494 8.745 1.00 0.00 C ATOM 2203 C ASP B 71 -5.059 21.414 8.807 1.00 0.00 C ATOM 2204 O ASP B 71 -5.045 20.472 8.014 1.00 0.00 O ATOM 2205 CB ASP B 71 -3.680 22.830 7.277 1.00 0.00 C ATOM 2206 CG ASP B 71 -2.858 24.090 7.113 1.00 0.00 C ATOM 2207 OD1 ASP B 71 -3.452 25.190 7.049 1.00 0.00 O ATOM 2208 OD2 ASP B 71 -1.618 23.993 7.036 1.00 0.00 O ATOM 0 H ASP B 71 -2.540 21.087 9.286 1.00 0.00 H new ATOM 0 HA ASP B 71 -4.355 23.398 9.233 1.00 0.00 H new ATOM 0 HB2 ASP B 71 -3.146 21.994 6.825 1.00 0.00 H new ATOM 0 HB3 ASP B 71 -4.617 22.942 6.731 1.00 0.00 H new ATOM 2213 N PRO B 72 -5.993 21.528 9.764 1.00 0.00 N ATOM 2214 CA PRO B 72 -7.082 20.556 9.939 1.00 0.00 C ATOM 2215 C PRO B 72 -7.992 20.474 8.710 1.00 0.00 C ATOM 2216 O PRO B 72 -8.726 19.506 8.533 1.00 0.00 O ATOM 2217 CB PRO B 72 -7.865 21.103 11.144 1.00 0.00 C ATOM 2218 CG PRO B 72 -6.912 22.010 11.841 1.00 0.00 C ATOM 2219 CD PRO B 72 -6.052 22.601 10.766 1.00 0.00 C ATOM 0 HA PRO B 72 -6.701 19.545 10.084 1.00 0.00 H new ATOM 0 HB2 PRO B 72 -8.758 21.639 10.824 1.00 0.00 H new ATOM 0 HB3 PRO B 72 -8.195 20.297 11.800 1.00 0.00 H new ATOM 0 HG2 PRO B 72 -7.443 22.788 12.389 1.00 0.00 H new ATOM 0 HG3 PRO B 72 -6.310 21.462 12.567 1.00 0.00 H new ATOM 0 HD2 PRO B 72 -6.487 23.513 10.356 1.00 0.00 H new ATOM 0 HD3 PRO B 72 -5.061 22.860 11.139 1.00 0.00 H new ATOM 2227 N GLN B 73 -7.957 21.511 7.880 1.00 0.00 N ATOM 2228 CA GLN B 73 -8.748 21.550 6.648 1.00 0.00 C ATOM 2229 C GLN B 73 -8.196 20.606 5.570 1.00 0.00 C ATOM 2230 O GLN B 73 -8.797 20.458 4.508 1.00 0.00 O ATOM 2231 CB GLN B 73 -8.794 22.973 6.082 1.00 0.00 C ATOM 2232 CG GLN B 73 -7.430 23.510 5.665 1.00 0.00 C ATOM 2233 CD GLN B 73 -7.525 24.789 4.858 1.00 0.00 C ATOM 2234 OE1 GLN B 73 -7.620 24.757 3.629 1.00 0.00 O ATOM 2235 NE2 GLN B 73 -7.491 25.917 5.533 1.00 0.00 N ATOM 0 H GLN B 73 -7.387 22.342 8.037 1.00 0.00 H new ATOM 0 HA GLN B 73 -9.752 21.218 6.914 1.00 0.00 H new ATOM 0 HB2 GLN B 73 -9.461 22.990 5.220 1.00 0.00 H new ATOM 0 HB3 GLN B 73 -9.224 23.639 6.831 1.00 0.00 H new ATOM 0 HG2 GLN B 73 -6.828 23.691 6.555 1.00 0.00 H new ATOM 0 HG3 GLN B 73 -6.910 22.753 5.078 1.00 0.00 H new ATOM 0 HE21 GLN B 73 -7.412 25.901 6.550 1.00 0.00 H new ATOM 0 HE22 GLN B 73 -7.544 26.808 5.040 1.00 0.00 H new ATOM 2244 N MET B 74 -7.069 19.970 5.833 1.00 0.00 N ATOM 2245 CA MET B 74 -6.463 19.099 4.840 1.00 0.00 C ATOM 2246 C MET B 74 -6.937 17.667 4.996 1.00 0.00 C ATOM 2247 O MET B 74 -6.492 16.945 5.893 1.00 0.00 O ATOM 2248 CB MET B 74 -4.935 19.161 4.906 1.00 0.00 C ATOM 2249 CG MET B 74 -4.355 20.491 4.458 1.00 0.00 C ATOM 2250 SD MET B 74 -2.554 20.510 4.488 1.00 0.00 S ATOM 2251 CE MET B 74 -2.217 22.154 3.865 1.00 0.00 C ATOM 0 H MET B 74 -6.559 20.038 6.714 1.00 0.00 H new ATOM 0 HA MET B 74 -6.780 19.458 3.861 1.00 0.00 H new ATOM 0 HB2 MET B 74 -4.617 18.963 5.929 1.00 0.00 H new ATOM 0 HB3 MET B 74 -4.521 18.367 4.284 1.00 0.00 H new ATOM 0 HG2 MET B 74 -4.700 20.711 3.448 1.00 0.00 H new ATOM 0 HG3 MET B 74 -4.733 21.284 5.104 1.00 0.00 H new ATOM 0 HE1 MET B 74 -1.141 22.327 3.859 1.00 0.00 H new ATOM 0 HE2 MET B 74 -2.605 22.245 2.850 1.00 0.00 H new ATOM 0 HE3 MET B 74 -2.700 22.892 4.506 1.00 0.00 H new ATOM 2261 N LEU B 75 -7.859 17.262 4.131 1.00 0.00 N ATOM 2262 CA LEU B 75 -8.367 15.901 4.137 1.00 0.00 C ATOM 2263 C LEU B 75 -7.308 14.957 3.581 1.00 0.00 C ATOM 2264 O LEU B 75 -6.365 15.400 2.912 1.00 0.00 O ATOM 2265 CB LEU B 75 -9.655 15.798 3.309 1.00 0.00 C ATOM 2266 CG LEU B 75 -10.801 16.726 3.729 1.00 0.00 C ATOM 2267 CD1 LEU B 75 -12.007 16.524 2.828 1.00 0.00 C ATOM 2268 CD2 LEU B 75 -11.178 16.497 5.187 1.00 0.00 C ATOM 0 H LEU B 75 -8.270 17.861 3.415 1.00 0.00 H new ATOM 0 HA LEU B 75 -8.599 15.618 5.164 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -9.411 16.004 2.267 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -10.012 14.769 3.355 1.00 0.00 H new ATOM 0 HG LEU B 75 -10.460 17.756 3.625 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -12.811 17.191 3.141 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -11.732 16.746 1.797 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -12.345 15.490 2.899 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -11.993 17.167 5.462 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -11.496 15.463 5.322 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -10.315 16.697 5.822 1.00 0.00 H new ATOM 2280 N LEU B 76 -7.478 13.666 3.841 1.00 0.00 N ATOM 2281 CA LEU B 76 -6.516 12.641 3.420 1.00 0.00 C ATOM 2282 C LEU B 76 -6.152 12.755 1.934 1.00 0.00 C ATOM 2283 O LEU B 76 -4.974 12.840 1.586 1.00 0.00 O ATOM 2284 CB LEU B 76 -7.070 11.247 3.715 1.00 0.00 C ATOM 2285 CG LEU B 76 -6.117 10.083 3.437 1.00 0.00 C ATOM 2286 CD1 LEU B 76 -4.910 10.149 4.355 1.00 0.00 C ATOM 2287 CD2 LEU B 76 -6.833 8.753 3.592 1.00 0.00 C ATOM 0 H LEU B 76 -8.282 13.296 4.348 1.00 0.00 H new ATOM 0 HA LEU B 76 -5.602 12.804 3.992 1.00 0.00 H new ATOM 0 HB2 LEU B 76 -7.366 11.208 4.763 1.00 0.00 H new ATOM 0 HB3 LEU B 76 -7.974 11.102 3.123 1.00 0.00 H new ATOM 0 HG LEU B 76 -5.770 10.166 2.407 1.00 0.00 H new ATOM 0 HD11 LEU B 76 -4.244 9.313 4.142 1.00 0.00 H new ATOM 0 HD12 LEU B 76 -4.379 11.087 4.191 1.00 0.00 H new ATOM 0 HD13 LEU B 76 -5.239 10.095 5.393 1.00 0.00 H new ATOM 0 HD21 LEU B 76 -6.137 7.939 3.390 1.00 0.00 H new ATOM 0 HD22 LEU B 76 -7.213 8.661 4.609 1.00 0.00 H new ATOM 0 HD23 LEU B 76 -7.664 8.703 2.888 1.00 0.00 H new ATOM 2299 N ILE B 77 -7.165 12.769 1.073 1.00 0.00 N ATOM 2300 CA ILE B 77 -6.944 12.833 -0.376 1.00 0.00 C ATOM 2301 C ILE B 77 -6.124 14.058 -0.774 1.00 0.00 C ATOM 2302 O ILE B 77 -5.140 13.942 -1.513 1.00 0.00 O ATOM 2303 CB ILE B 77 -8.283 12.829 -1.161 1.00 0.00 C ATOM 2304 CG1 ILE B 77 -9.026 11.505 -0.950 1.00 0.00 C ATOM 2305 CG2 ILE B 77 -8.048 13.079 -2.651 1.00 0.00 C ATOM 2306 CD1 ILE B 77 -8.260 10.283 -1.418 1.00 0.00 C ATOM 0 H ILE B 77 -8.147 12.737 1.348 1.00 0.00 H new ATOM 0 HA ILE B 77 -6.380 11.938 -0.638 1.00 0.00 H new ATOM 0 HB ILE B 77 -8.901 13.640 -0.776 1.00 0.00 H new ATOM 0 HG12 ILE B 77 -9.254 11.394 0.110 1.00 0.00 H new ATOM 0 HG13 ILE B 77 -9.979 11.547 -1.478 1.00 0.00 H new ATOM 0 HG21 ILE B 77 -9.003 13.071 -3.176 1.00 0.00 H new ATOM 0 HG22 ILE B 77 -7.568 14.048 -2.786 1.00 0.00 H new ATOM 0 HG23 ILE B 77 -7.405 12.296 -3.054 1.00 0.00 H new ATOM 0 HD11 ILE B 77 -8.854 9.388 -1.233 1.00 0.00 H new ATOM 0 HD12 ILE B 77 -8.055 10.369 -2.485 1.00 0.00 H new ATOM 0 HD13 ILE B 77 -7.319 10.212 -0.872 1.00 0.00 H new ATOM 2318 N THR B 78 -6.509 15.221 -0.274 1.00 0.00 N ATOM 2319 CA THR B 78 -5.818 16.448 -0.618 1.00 0.00 C ATOM 2320 C THR B 78 -4.386 16.443 -0.094 1.00 0.00 C ATOM 2321 O THR B 78 -3.447 16.788 -0.810 1.00 0.00 O ATOM 2322 CB THR B 78 -6.578 17.678 -0.087 1.00 0.00 C ATOM 2323 OG1 THR B 78 -7.252 17.341 1.139 1.00 0.00 O ATOM 2324 CG2 THR B 78 -7.594 18.163 -1.109 1.00 0.00 C ATOM 0 H THR B 78 -7.293 15.339 0.368 1.00 0.00 H new ATOM 0 HA THR B 78 -5.782 16.508 -1.706 1.00 0.00 H new ATOM 0 HB THR B 78 -5.859 18.476 0.097 1.00 0.00 H new ATOM 0 HG1 THR B 78 -6.710 16.700 1.645 1.00 0.00 H new ATOM 0 HG21 THR B 78 -8.120 19.032 -0.715 1.00 0.00 H new ATOM 0 HG22 THR B 78 -7.081 18.437 -2.031 1.00 0.00 H new ATOM 0 HG23 THR B 78 -8.311 17.368 -1.315 1.00 0.00 H new ATOM 2332 N ALA B 79 -4.237 16.052 1.157 1.00 0.00 N ATOM 2333 CA ALA B 79 -2.940 15.964 1.794 1.00 0.00 C ATOM 2334 C ALA B 79 -1.970 15.060 1.022 1.00 0.00 C ATOM 2335 O ALA B 79 -0.841 15.462 0.737 1.00 0.00 O ATOM 2336 CB ALA B 79 -3.107 15.489 3.205 1.00 0.00 C ATOM 0 H ALA B 79 -5.015 15.786 1.761 1.00 0.00 H new ATOM 0 HA ALA B 79 -2.498 16.960 1.796 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -2.130 15.423 3.685 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -3.734 16.192 3.754 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -3.578 14.506 3.205 1.00 0.00 H new ATOM 2342 N ILE B 80 -2.404 13.838 0.693 1.00 0.00 N ATOM 2343 CA ILE B 80 -1.575 12.911 -0.083 1.00 0.00 C ATOM 2344 C ILE B 80 -1.135 13.563 -1.397 1.00 0.00 C ATOM 2345 O ILE B 80 0.028 13.469 -1.782 1.00 0.00 O ATOM 2346 CB ILE B 80 -2.324 11.577 -0.381 1.00 0.00 C ATOM 2347 CG1 ILE B 80 -2.640 10.829 0.927 1.00 0.00 C ATOM 2348 CG2 ILE B 80 -1.502 10.684 -1.318 1.00 0.00 C ATOM 2349 CD1 ILE B 80 -1.441 10.144 1.556 1.00 0.00 C ATOM 0 H ILE B 80 -3.320 13.470 0.951 1.00 0.00 H new ATOM 0 HA ILE B 80 -0.697 12.677 0.519 1.00 0.00 H new ATOM 0 HB ILE B 80 -3.262 11.823 -0.878 1.00 0.00 H new ATOM 0 HG12 ILE B 80 -3.059 11.535 1.644 1.00 0.00 H new ATOM 0 HG13 ILE B 80 -3.409 10.082 0.729 1.00 0.00 H new ATOM 0 HG21 ILE B 80 -2.047 9.760 -1.510 1.00 0.00 H new ATOM 0 HG22 ILE B 80 -1.329 11.206 -2.259 1.00 0.00 H new ATOM 0 HG23 ILE B 80 -0.545 10.451 -0.852 1.00 0.00 H new ATOM 0 HD11 ILE B 80 -1.749 9.641 2.473 1.00 0.00 H new ATOM 0 HD12 ILE B 80 -1.033 9.412 0.859 1.00 0.00 H new ATOM 0 HD13 ILE B 80 -0.678 10.887 1.789 1.00 0.00 H new ATOM 2361 N ASP B 81 -2.069 14.260 -2.053 1.00 0.00 N ATOM 2362 CA ASP B 81 -1.796 14.957 -3.323 1.00 0.00 C ATOM 2363 C ASP B 81 -0.716 16.035 -3.147 1.00 0.00 C ATOM 2364 O ASP B 81 0.037 16.336 -4.064 1.00 0.00 O ATOM 2365 CB ASP B 81 -3.092 15.580 -3.873 1.00 0.00 C ATOM 2366 CG ASP B 81 -2.884 16.397 -5.141 1.00 0.00 C ATOM 2367 OD1 ASP B 81 -2.692 15.797 -6.223 1.00 0.00 O ATOM 2368 OD2 ASP B 81 -2.941 17.648 -5.064 1.00 0.00 O ATOM 0 H ASP B 81 -3.030 14.359 -1.725 1.00 0.00 H new ATOM 0 HA ASP B 81 -1.422 14.225 -4.038 1.00 0.00 H new ATOM 0 HB2 ASP B 81 -3.810 14.785 -4.076 1.00 0.00 H new ATOM 0 HB3 ASP B 81 -3.532 16.219 -3.107 1.00 0.00 H new ATOM 2373 N ASP B 82 -0.652 16.615 -1.976 1.00 0.00 N ATOM 2374 CA ASP B 82 0.357 17.633 -1.686 1.00 0.00 C ATOM 2375 C ASP B 82 1.667 16.990 -1.223 1.00 0.00 C ATOM 2376 O ASP B 82 2.751 17.534 -1.434 1.00 0.00 O ATOM 2377 CB ASP B 82 -0.142 18.640 -0.647 1.00 0.00 C ATOM 2378 CG ASP B 82 0.741 19.879 -0.582 1.00 0.00 C ATOM 2379 OD1 ASP B 82 0.553 20.795 -1.421 1.00 0.00 O ATOM 2380 OD2 ASP B 82 1.624 19.948 0.293 1.00 0.00 O ATOM 0 H ASP B 82 -1.281 16.408 -1.200 1.00 0.00 H new ATOM 0 HA ASP B 82 0.547 18.175 -2.612 1.00 0.00 H new ATOM 0 HB2 ASP B 82 -1.163 18.935 -0.889 1.00 0.00 H new ATOM 0 HB3 ASP B 82 -0.172 18.164 0.333 1.00 0.00 H new ATOM 2385 N THR B 83 1.567 15.815 -0.619 1.00 0.00 N ATOM 2386 CA THR B 83 2.733 15.120 -0.127 1.00 0.00 C ATOM 2387 C THR B 83 3.485 14.496 -1.292 1.00 0.00 C ATOM 2388 O THR B 83 4.712 14.546 -1.351 1.00 0.00 O ATOM 2389 CB THR B 83 2.342 14.036 0.896 1.00 0.00 C ATOM 2390 OG1 THR B 83 1.562 14.628 1.939 1.00 0.00 O ATOM 2391 CG2 THR B 83 3.580 13.399 1.507 1.00 0.00 C ATOM 0 H THR B 83 0.685 15.327 -0.461 1.00 0.00 H new ATOM 0 HA THR B 83 3.378 15.840 0.377 1.00 0.00 H new ATOM 0 HB THR B 83 1.766 13.267 0.382 1.00 0.00 H new ATOM 0 HG1 THR B 83 0.696 14.911 1.579 1.00 0.00 H new ATOM 0 HG21 THR B 83 3.280 12.637 2.226 1.00 0.00 H new ATOM 0 HG22 THR B 83 4.179 12.940 0.720 1.00 0.00 H new ATOM 0 HG23 THR B 83 4.170 14.163 2.013 1.00 0.00 H new ATOM 2399 N MET B 84 2.734 13.931 -2.234 1.00 0.00 N ATOM 2400 CA MET B 84 3.324 13.379 -3.443 1.00 0.00 C ATOM 2401 C MET B 84 3.892 14.510 -4.291 1.00 0.00 C ATOM 2402 O MET B 84 4.803 14.316 -5.091 1.00 0.00 O ATOM 2403 CB MET B 84 2.292 12.531 -4.228 1.00 0.00 C ATOM 2404 CG MET B 84 0.997 13.245 -4.615 1.00 0.00 C ATOM 2405 SD MET B 84 1.195 14.460 -5.930 1.00 0.00 S ATOM 2406 CE MET B 84 1.912 13.451 -7.193 1.00 0.00 C ATOM 0 H MET B 84 1.719 13.845 -2.181 1.00 0.00 H new ATOM 0 HA MET B 84 4.140 12.708 -3.172 1.00 0.00 H new ATOM 0 HB2 MET B 84 2.768 12.165 -5.138 1.00 0.00 H new ATOM 0 HB3 MET B 84 2.037 11.657 -3.628 1.00 0.00 H new ATOM 0 HG2 MET B 84 0.264 12.502 -4.929 1.00 0.00 H new ATOM 0 HG3 MET B 84 0.591 13.741 -3.734 1.00 0.00 H new ATOM 0 HE1 MET B 84 1.539 13.767 -8.167 1.00 0.00 H new ATOM 0 HE2 MET B 84 2.997 13.554 -7.169 1.00 0.00 H new ATOM 0 HE3 MET B 84 1.643 12.409 -7.022 1.00 0.00 H new ATOM 2416 N ARG B 85 3.342 15.696 -4.075 1.00 0.00 N ATOM 2417 CA ARG B 85 3.796 16.908 -4.727 1.00 0.00 C ATOM 2418 C ARG B 85 5.181 17.266 -4.208 1.00 0.00 C ATOM 2419 O ARG B 85 6.071 17.647 -4.970 1.00 0.00 O ATOM 2420 CB ARG B 85 2.810 18.036 -4.429 1.00 0.00 C ATOM 2421 CG ARG B 85 3.272 19.414 -4.844 1.00 0.00 C ATOM 2422 CD ARG B 85 2.359 20.482 -4.270 1.00 0.00 C ATOM 2423 NE ARG B 85 2.819 21.826 -4.590 1.00 0.00 N ATOM 2424 CZ ARG B 85 2.754 22.872 -3.759 1.00 0.00 C ATOM 2425 NH1 ARG B 85 2.225 22.741 -2.539 1.00 0.00 N ATOM 2426 NH2 ARG B 85 3.213 24.051 -4.156 1.00 0.00 N ATOM 0 H ARG B 85 2.561 15.842 -3.436 1.00 0.00 H new ATOM 0 HA ARG B 85 3.849 16.758 -5.805 1.00 0.00 H new ATOM 0 HB2 ARG B 85 1.868 17.818 -4.933 1.00 0.00 H new ATOM 0 HB3 ARG B 85 2.604 18.045 -3.359 1.00 0.00 H new ATOM 0 HG2 ARG B 85 4.293 19.579 -4.501 1.00 0.00 H new ATOM 0 HG3 ARG B 85 3.285 19.486 -5.932 1.00 0.00 H new ATOM 0 HD2 ARG B 85 1.350 20.343 -4.658 1.00 0.00 H new ATOM 0 HD3 ARG B 85 2.303 20.367 -3.188 1.00 0.00 H new ATOM 0 HE ARG B 85 3.220 21.981 -5.515 1.00 0.00 H new ATOM 0 HH11 ARG B 85 1.866 21.837 -2.233 1.00 0.00 H new ATOM 0 HH12 ARG B 85 2.180 23.545 -1.913 1.00 0.00 H new ATOM 0 HH21 ARG B 85 3.612 24.155 -5.089 1.00 0.00 H new ATOM 0 HH22 ARG B 85 3.167 24.854 -3.528 1.00 0.00 H new ATOM 2440 N ALA B 86 5.356 17.123 -2.898 1.00 0.00 N ATOM 2441 CA ALA B 86 6.628 17.387 -2.256 1.00 0.00 C ATOM 2442 C ALA B 86 7.691 16.411 -2.739 1.00 0.00 C ATOM 2443 O ALA B 86 8.861 16.770 -2.870 1.00 0.00 O ATOM 2444 CB ALA B 86 6.484 17.316 -0.744 1.00 0.00 C ATOM 0 H ALA B 86 4.620 16.822 -2.259 1.00 0.00 H new ATOM 0 HA ALA B 86 6.945 18.394 -2.527 1.00 0.00 H new ATOM 0 HB1 ALA B 86 7.448 17.517 -0.277 1.00 0.00 H new ATOM 0 HB2 ALA B 86 5.759 18.059 -0.412 1.00 0.00 H new ATOM 0 HB3 ALA B 86 6.142 16.322 -0.457 1.00 0.00 H new ATOM 2450 N ILE B 87 7.285 15.168 -3.023 1.00 0.00 N ATOM 2451 CA ILE B 87 8.216 14.144 -3.529 1.00 0.00 C ATOM 2452 C ILE B 87 8.553 14.416 -5.002 1.00 0.00 C ATOM 2453 O ILE B 87 9.425 13.778 -5.594 1.00 0.00 O ATOM 2454 CB ILE B 87 7.609 12.724 -3.387 1.00 0.00 C ATOM 2455 CG1 ILE B 87 7.097 12.506 -1.968 1.00 0.00 C ATOM 2456 CG2 ILE B 87 8.642 11.650 -3.740 1.00 0.00 C ATOM 2457 CD1 ILE B 87 6.387 11.190 -1.788 1.00 0.00 C ATOM 0 H ILE B 87 6.324 14.845 -2.913 1.00 0.00 H new ATOM 0 HA ILE B 87 9.128 14.193 -2.934 1.00 0.00 H new ATOM 0 HB ILE B 87 6.774 12.642 -4.083 1.00 0.00 H new ATOM 0 HG12 ILE B 87 7.936 12.556 -1.274 1.00 0.00 H new ATOM 0 HG13 ILE B 87 6.417 13.317 -1.705 1.00 0.00 H new ATOM 0 HG21 ILE B 87 8.192 10.663 -3.633 1.00 0.00 H new ATOM 0 HG22 ILE B 87 8.973 11.788 -4.769 1.00 0.00 H new ATOM 0 HG23 ILE B 87 9.497 11.734 -3.070 1.00 0.00 H new ATOM 0 HD11 ILE B 87 6.048 11.098 -0.756 1.00 0.00 H new ATOM 0 HD12 ILE B 87 5.528 11.145 -2.458 1.00 0.00 H new ATOM 0 HD13 ILE B 87 7.070 10.373 -2.020 1.00 0.00 H new ATOM 2469 N GLY B 88 7.891 15.402 -5.564 1.00 0.00 N ATOM 2470 CA GLY B 88 8.126 15.762 -6.936 1.00 0.00 C ATOM 2471 C GLY B 88 9.164 16.852 -7.009 1.00 0.00 C ATOM 2472 O GLY B 88 9.469 17.380 -8.076 1.00 0.00 O ATOM 0 H GLY B 88 7.187 15.966 -5.089 1.00 0.00 H new ATOM 0 HA2 GLY B 88 8.461 14.890 -7.498 1.00 0.00 H new ATOM 0 HA3 GLY B 88 7.198 16.100 -7.397 1.00 0.00 H new ATOM 2476 N LYS B 89 9.714 17.170 -5.849 1.00 0.00 N ATOM 2477 CA LYS B 89 10.707 18.218 -5.718 1.00 0.00 C ATOM 2478 C LYS B 89 11.989 17.650 -5.120 1.00 0.00 C ATOM 2479 O LYS B 89 12.082 17.448 -3.903 1.00 0.00 O ATOM 2480 CB LYS B 89 10.172 19.346 -4.821 1.00 0.00 C ATOM 2481 CG LYS B 89 8.826 19.915 -5.263 1.00 0.00 C ATOM 2482 CD LYS B 89 8.237 20.849 -4.209 1.00 0.00 C ATOM 2483 CE LYS B 89 9.030 22.146 -4.088 1.00 0.00 C ATOM 2484 NZ LYS B 89 8.843 23.023 -5.270 1.00 0.00 N ATOM 0 H LYS B 89 9.482 16.706 -4.971 1.00 0.00 H new ATOM 0 HA LYS B 89 10.922 18.622 -6.707 1.00 0.00 H new ATOM 0 HB2 LYS B 89 10.078 18.970 -3.802 1.00 0.00 H new ATOM 0 HB3 LYS B 89 10.904 20.153 -4.797 1.00 0.00 H new ATOM 0 HG2 LYS B 89 8.950 20.456 -6.201 1.00 0.00 H new ATOM 0 HG3 LYS B 89 8.131 19.098 -5.455 1.00 0.00 H new ATOM 0 HD2 LYS B 89 7.203 21.079 -4.466 1.00 0.00 H new ATOM 0 HD3 LYS B 89 8.221 20.342 -3.244 1.00 0.00 H new ATOM 0 HE2 LYS B 89 8.720 22.678 -3.189 1.00 0.00 H new ATOM 0 HE3 LYS B 89 10.089 21.914 -3.972 1.00 0.00 H new ATOM 0 HZ1 LYS B 89 9.257 23.958 -5.078 1.00 0.00 H new ATOM 0 HZ2 LYS B 89 9.314 22.599 -6.095 1.00 0.00 H new ATOM 0 HZ3 LYS B 89 7.827 23.128 -5.467 1.00 0.00 H new ATOM 2498 N LYS B 90 12.966 17.372 -5.969 1.00 0.00 N ATOM 2499 CA LYS B 90 14.237 16.838 -5.505 1.00 0.00 C ATOM 2500 C LYS B 90 15.099 17.952 -4.941 1.00 0.00 C ATOM 2501 O LYS B 90 15.523 17.902 -3.784 1.00 0.00 O ATOM 2502 CB LYS B 90 14.980 16.111 -6.630 1.00 0.00 C ATOM 2503 CG LYS B 90 14.324 14.810 -7.064 1.00 0.00 C ATOM 2504 CD LYS B 90 15.176 14.083 -8.098 1.00 0.00 C ATOM 2505 CE LYS B 90 14.599 12.719 -8.437 1.00 0.00 C ATOM 2506 NZ LYS B 90 15.467 11.970 -9.380 1.00 0.00 N ATOM 0 H LYS B 90 12.904 17.506 -6.978 1.00 0.00 H new ATOM 0 HA LYS B 90 14.030 16.114 -4.717 1.00 0.00 H new ATOM 0 HB2 LYS B 90 15.053 16.775 -7.492 1.00 0.00 H new ATOM 0 HB3 LYS B 90 15.998 15.901 -6.303 1.00 0.00 H new ATOM 0 HG2 LYS B 90 14.174 14.168 -6.196 1.00 0.00 H new ATOM 0 HG3 LYS B 90 13.339 15.018 -7.481 1.00 0.00 H new ATOM 0 HD2 LYS B 90 15.244 14.686 -9.004 1.00 0.00 H new ATOM 0 HD3 LYS B 90 16.190 13.965 -7.717 1.00 0.00 H new ATOM 0 HE2 LYS B 90 14.473 12.140 -7.522 1.00 0.00 H new ATOM 0 HE3 LYS B 90 13.609 12.842 -8.875 1.00 0.00 H new ATOM 0 HZ1 LYS B 90 15.039 11.045 -9.586 1.00 0.00 H new ATOM 0 HZ2 LYS B 90 15.567 12.510 -10.263 1.00 0.00 H new ATOM 0 HZ3 LYS B 90 16.404 11.830 -8.952 1.00 0.00 H new TER 2520 LYS B 90