USER MOD reduce.3.24.130724 H: found=0, std=0, add=1256, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1262 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: A 79 MET CE :methyl -172:sc= -0.755 (180deg=-0.795) USER MOD Set 1.2: B 62 SER OG : rot 130:sc= 0 USER MOD Set 2.1: A 115 TYR OH : rot 20:sc= 1.87 USER MOD Set 2.2: A 119 LYS NZ :NH3+ -159:sc= 1.27 (180deg=0.152) USER MOD Set 3.1: A 99 MET CE :methyl 171:sc= -0.648 (180deg=-1.12) USER MOD Set 3.2: B 60 SER OG : rot -120:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 MET CE :methyl -155:sc= -0.148 (180deg=-1.02) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot -150:sc= -0.922 USER MOD Single : A 62 SER OG : rot 78:sc= 0.0862 USER MOD Single : A 64 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0636) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -2.55 K(o=-2.6,f=-0.32) USER MOD Single : A 74 MET CE :methyl 157:sc= -0.104 (180deg=-0.851) USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 52:sc= 1.16 USER MOD Single : A 101 SER OG : rot -37:sc= 0.985 USER MOD Single : A 104 ASN : amide:sc= -0.426 K(o=-0.43,f=-1) USER MOD Single : A 106 ASN : amide:sc= 0.329 K(o=0.33,f=-6.9!) USER MOD Single : A 118 SER OG : rot -177:sc= 2.44! USER MOD Single : A 123 LYS NZ :NH3+ 157:sc= -0.0449 (180deg=-0.44) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 THR OG1 : rot -98:sc= 1.27 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 51 SER OG : rot 180:sc= 0 USER MOD Single : B 52 MET CE :methyl 157:sc= -0.0173 (180deg=-0.249) USER MOD Single : B 55 SER OG : rot 180:sc= -0.166 USER MOD Single : B 56 THR OG1 : rot 39:sc= 0.233 USER MOD Single : B 57 LYS NZ :NH3+ 157:sc= -0.0801 (180deg=-0.625) USER MOD Single : B 58 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0595) USER MOD Single : B 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 72 SER OG : rot -45:sc= 1.17 USER MOD Single : B 73 ASN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : B 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 77 GLN : amide:sc= -1.48 K(o=-1.5,f=-0.84!) USER MOD Single : B 79 MET CE :methyl -174:sc= -1.21 (180deg=-1.24) USER MOD Single : B 85 THR OG1 : rot 180:sc= 0 USER MOD Single : B 87 SER OG : rot 150:sc= -1.13 USER MOD Single : B 99 MET CE :methyl -112:sc= -1.42 (180deg=-2.46) USER MOD Single : B 101 SER OG : rot 71:sc= 1.23 USER MOD Single : B 104 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 106 ASN : amide:sc= -2.83 K(o=-2.8,f=-4!) USER MOD Single : B 115 TYR OH : rot 30:sc= -0.0123 USER MOD Single : B 118 SER OG : rot -22:sc= -0.069 USER MOD Single : B 119 LYS NZ :NH3+ 164:sc= -0.0202 (180deg=-0.369) USER MOD Single : B 123 LYS NZ :NH3+ -156:sc= -0.0333 (180deg=-0.407) USER MOD Single : B 126 SER OG : rot 180:sc= 0 USER MOD Single : B 127 THR OG1 : rot 180:sc= 0 USER MOD Single : B 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 48 0.533 116.472 16.448 1.00 0.00 N ATOM 2 CA GLY A 48 0.351 116.337 14.975 1.00 0.00 C ATOM 3 C GLY A 48 -1.138 116.103 14.659 1.00 0.00 C ATOM 4 O GLY A 48 -1.996 116.638 15.367 1.00 0.00 O ATOM 0 HA2 GLY A 48 0.703 117.237 14.471 1.00 0.00 H new ATOM 0 HA3 GLY A 48 0.948 115.506 14.599 1.00 0.00 H new ATOM 10 N PRO A 49 -1.477 115.331 13.621 1.00 0.00 N ATOM 11 CA PRO A 49 -2.908 115.068 13.257 1.00 0.00 C ATOM 12 C PRO A 49 -3.726 114.557 14.442 1.00 0.00 C ATOM 13 O PRO A 49 -4.862 114.996 14.655 1.00 0.00 O ATOM 14 CB PRO A 49 -2.827 114.009 12.154 1.00 0.00 C ATOM 15 CG PRO A 49 -1.472 114.164 11.556 1.00 0.00 C ATOM 16 CD PRO A 49 -0.560 114.631 12.686 1.00 0.00 C ATOM 0 HA PRO A 49 -3.413 115.979 12.938 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -2.965 113.007 12.560 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -3.606 114.160 11.407 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -1.121 113.221 11.137 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -1.486 114.889 10.742 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -0.061 113.791 13.170 1.00 0.00 H new ATOM 0 HD3 PRO A 49 0.221 115.297 12.319 1.00 0.00 H new ATOM 24 N GLY A 50 -3.174 113.640 15.210 1.00 0.00 N ATOM 25 CA GLY A 50 -3.911 113.083 16.390 1.00 0.00 C ATOM 26 C GLY A 50 -3.097 113.302 17.660 1.00 0.00 C ATOM 27 O GLY A 50 -1.984 112.782 17.792 1.00 0.00 O ATOM 0 H GLY A 50 -2.241 113.254 15.067 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -4.884 113.566 16.483 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -4.096 112.019 16.245 1.00 0.00 H new ATOM 31 N SER A 51 -3.632 114.056 18.596 1.00 0.00 N ATOM 32 CA SER A 51 -2.908 114.323 19.878 1.00 0.00 C ATOM 33 C SER A 51 -3.802 113.911 21.053 1.00 0.00 C ATOM 34 O SER A 51 -4.508 114.743 21.638 1.00 0.00 O ATOM 35 CB SER A 51 -2.545 115.808 19.972 1.00 0.00 C ATOM 36 OG SER A 51 -2.151 116.274 18.688 1.00 0.00 O ATOM 0 H SER A 51 -4.547 114.500 18.523 1.00 0.00 H new ATOM 0 HA SER A 51 -1.986 113.743 19.910 1.00 0.00 H new ATOM 0 HB2 SER A 51 -3.398 116.381 20.334 1.00 0.00 H new ATOM 0 HB3 SER A 51 -1.737 115.953 20.689 1.00 0.00 H new ATOM 0 HG SER A 51 -1.919 117.225 18.742 1.00 0.00 H new ATOM 42 N MET A 52 -3.783 112.642 21.402 1.00 0.00 N ATOM 43 CA MET A 52 -4.623 112.141 22.536 1.00 0.00 C ATOM 44 C MET A 52 -4.148 110.740 22.921 1.00 0.00 C ATOM 45 O MET A 52 -3.707 110.516 24.053 1.00 0.00 O ATOM 46 CB MET A 52 -6.113 112.110 22.115 1.00 0.00 C ATOM 47 CG MET A 52 -6.944 113.078 22.974 1.00 0.00 C ATOM 48 SD MET A 52 -8.679 113.010 22.456 1.00 0.00 S ATOM 49 CE MET A 52 -8.478 113.801 20.838 1.00 0.00 C ATOM 0 H MET A 52 -3.216 111.929 20.944 1.00 0.00 H new ATOM 0 HA MET A 52 -4.523 112.806 23.394 1.00 0.00 H new ATOM 0 HB2 MET A 52 -6.204 112.381 21.063 1.00 0.00 H new ATOM 0 HB3 MET A 52 -6.504 111.098 22.219 1.00 0.00 H new ATOM 0 HG2 MET A 52 -6.857 112.812 24.027 1.00 0.00 H new ATOM 0 HG3 MET A 52 -6.562 114.093 22.869 1.00 0.00 H new ATOM 0 HE1 MET A 52 -9.420 114.259 20.537 1.00 0.00 H new ATOM 0 HE2 MET A 52 -7.706 114.568 20.901 1.00 0.00 H new ATOM 0 HE3 MET A 52 -8.186 113.053 20.101 1.00 0.00 H new ATOM 59 N ASP A 53 -4.221 109.803 22.000 1.00 0.00 N ATOM 60 CA ASP A 53 -3.769 108.406 22.286 1.00 0.00 C ATOM 61 C ASP A 53 -2.457 108.165 21.547 1.00 0.00 C ATOM 62 O ASP A 53 -2.348 107.300 20.667 1.00 0.00 O ATOM 63 CB ASP A 53 -4.836 107.400 21.846 1.00 0.00 C ATOM 64 CG ASP A 53 -5.190 107.624 20.380 1.00 0.00 C ATOM 65 OD1 ASP A 53 -6.066 108.432 20.119 1.00 0.00 O ATOM 66 OD2 ASP A 53 -4.578 106.986 19.538 1.00 0.00 O ATOM 0 H ASP A 53 -4.578 109.951 21.056 1.00 0.00 H new ATOM 0 HA ASP A 53 -3.615 108.274 23.357 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -4.470 106.383 21.989 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -5.727 107.508 22.465 1.00 0.00 H new ATOM 71 N ALA A 54 -1.469 108.940 21.893 1.00 0.00 N ATOM 72 CA ALA A 54 -0.134 108.837 21.248 1.00 0.00 C ATOM 73 C ALA A 54 0.473 107.447 21.466 1.00 0.00 C ATOM 74 O ALA A 54 1.278 107.000 20.648 1.00 0.00 O ATOM 75 CB ALA A 54 0.779 109.920 21.826 1.00 0.00 C ATOM 0 H ALA A 54 -1.534 109.658 22.614 1.00 0.00 H new ATOM 0 HA ALA A 54 -0.241 108.983 20.173 1.00 0.00 H new ATOM 0 HB1 ALA A 54 1.762 109.854 21.360 1.00 0.00 H new ATOM 0 HB2 ALA A 54 0.349 110.902 21.629 1.00 0.00 H new ATOM 0 HB3 ALA A 54 0.877 109.777 22.902 1.00 0.00 H new ATOM 81 N SER A 55 0.115 106.757 22.537 1.00 0.00 N ATOM 82 CA SER A 55 0.693 105.393 22.786 1.00 0.00 C ATOM 83 C SER A 55 0.090 104.399 21.792 1.00 0.00 C ATOM 84 O SER A 55 0.808 103.567 21.216 1.00 0.00 O ATOM 85 CB SER A 55 0.412 104.951 24.231 1.00 0.00 C ATOM 86 OG SER A 55 0.535 103.537 24.330 1.00 0.00 O ATOM 0 H SER A 55 -0.548 107.081 23.241 1.00 0.00 H new ATOM 0 HA SER A 55 1.773 105.426 22.646 1.00 0.00 H new ATOM 0 HB2 SER A 55 1.111 105.436 24.913 1.00 0.00 H new ATOM 0 HB3 SER A 55 -0.590 105.261 24.528 1.00 0.00 H new ATOM 0 HG SER A 55 0.357 103.257 25.252 1.00 0.00 H new ATOM 92 N THR A 56 -1.203 104.487 21.558 1.00 0.00 N ATOM 93 CA THR A 56 -1.871 103.574 20.584 1.00 0.00 C ATOM 94 C THR A 56 -1.370 103.923 19.187 1.00 0.00 C ATOM 95 O THR A 56 -1.006 103.042 18.394 1.00 0.00 O ATOM 96 CB THR A 56 -3.389 103.754 20.669 1.00 0.00 C ATOM 97 OG1 THR A 56 -3.795 103.664 22.027 1.00 0.00 O ATOM 98 CG2 THR A 56 -4.087 102.667 19.860 1.00 0.00 C ATOM 0 H THR A 56 -1.824 105.160 22.007 1.00 0.00 H new ATOM 0 HA THR A 56 -1.637 102.534 20.810 1.00 0.00 H new ATOM 0 HB THR A 56 -3.659 104.730 20.265 1.00 0.00 H new ATOM 0 HG1 THR A 56 -4.766 103.780 22.086 1.00 0.00 H new ATOM 0 HG21 THR A 56 -5.167 102.802 19.925 1.00 0.00 H new ATOM 0 HG22 THR A 56 -3.775 102.733 18.818 1.00 0.00 H new ATOM 0 HG23 THR A 56 -3.819 101.688 20.258 1.00 0.00 H new ATOM 106 N LYS A 57 -1.322 105.200 18.894 1.00 0.00 N ATOM 107 CA LYS A 57 -0.826 105.678 17.575 1.00 0.00 C ATOM 108 C LYS A 57 0.613 105.199 17.379 1.00 0.00 C ATOM 109 O LYS A 57 1.012 104.882 16.258 1.00 0.00 O ATOM 110 CB LYS A 57 -0.884 107.212 17.508 1.00 0.00 C ATOM 111 CG LYS A 57 -0.523 107.681 16.092 1.00 0.00 C ATOM 112 CD LYS A 57 -0.311 109.203 16.081 1.00 0.00 C ATOM 113 CE LYS A 57 -1.660 109.937 16.049 1.00 0.00 C ATOM 114 NZ LYS A 57 -2.055 110.185 14.634 1.00 0.00 N ATOM 0 H LYS A 57 -1.613 105.942 19.530 1.00 0.00 H new ATOM 0 HA LYS A 57 -1.457 105.275 16.783 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -1.882 107.560 17.773 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -0.193 107.644 18.232 1.00 0.00 H new ATOM 0 HG2 LYS A 57 0.382 107.177 15.753 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -1.318 107.411 15.397 1.00 0.00 H new ATOM 0 HD2 LYS A 57 0.252 109.504 16.965 1.00 0.00 H new ATOM 0 HD3 LYS A 57 0.284 109.486 15.213 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -2.422 109.342 16.552 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -1.586 110.881 16.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -2.968 110.682 14.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -1.331 110.769 14.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -2.142 109.277 14.134 1.00 0.00 H new ATOM 128 N LYS A 58 1.402 105.181 18.434 1.00 0.00 N ATOM 129 CA LYS A 58 2.835 104.764 18.318 1.00 0.00 C ATOM 130 C LYS A 58 2.928 103.323 17.811 1.00 0.00 C ATOM 131 O LYS A 58 3.741 103.041 16.923 1.00 0.00 O ATOM 132 CB LYS A 58 3.527 104.868 19.693 1.00 0.00 C ATOM 133 CG LYS A 58 5.010 105.256 19.536 1.00 0.00 C ATOM 134 CD LYS A 58 5.859 104.015 19.213 1.00 0.00 C ATOM 135 CE LYS A 58 6.085 103.154 20.475 1.00 0.00 C ATOM 136 NZ LYS A 58 7.549 103.014 20.723 1.00 0.00 N ATOM 0 H LYS A 58 1.108 105.440 19.376 1.00 0.00 H new ATOM 0 HA LYS A 58 3.333 105.426 17.610 1.00 0.00 H new ATOM 0 HB2 LYS A 58 3.016 105.610 20.306 1.00 0.00 H new ATOM 0 HB3 LYS A 58 3.450 103.915 20.216 1.00 0.00 H new ATOM 0 HG2 LYS A 58 5.117 105.994 18.741 1.00 0.00 H new ATOM 0 HG3 LYS A 58 5.370 105.721 20.454 1.00 0.00 H new ATOM 0 HD2 LYS A 58 5.362 103.420 18.447 1.00 0.00 H new ATOM 0 HD3 LYS A 58 6.820 104.325 18.803 1.00 0.00 H new ATOM 0 HE2 LYS A 58 5.602 103.616 21.336 1.00 0.00 H new ATOM 0 HE3 LYS A 58 5.631 102.171 20.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 7.703 102.434 21.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 7.997 102.555 19.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 7.969 103.955 20.865 1.00 0.00 H new ATOM 150 N LEU A 59 2.135 102.406 18.343 1.00 0.00 N ATOM 151 CA LEU A 59 2.231 100.983 17.864 1.00 0.00 C ATOM 152 C LEU A 59 1.903 100.943 16.374 1.00 0.00 C ATOM 153 O LEU A 59 2.641 100.331 15.584 1.00 0.00 O ATOM 154 CB LEU A 59 1.274 100.064 18.636 1.00 0.00 C ATOM 155 CG LEU A 59 1.617 98.594 18.328 1.00 0.00 C ATOM 156 CD1 LEU A 59 2.875 98.182 19.099 1.00 0.00 C ATOM 157 CD2 LEU A 59 0.455 97.688 18.749 1.00 0.00 C ATOM 0 H LEU A 59 1.442 102.579 19.071 1.00 0.00 H new ATOM 0 HA LEU A 59 3.245 100.622 18.038 1.00 0.00 H new ATOM 0 HB2 LEU A 59 1.356 100.252 19.707 1.00 0.00 H new ATOM 0 HB3 LEU A 59 0.243 100.275 18.354 1.00 0.00 H new ATOM 0 HG LEU A 59 1.792 98.491 17.257 1.00 0.00 H new ATOM 0 HD11 LEU A 59 3.113 97.142 18.878 1.00 0.00 H new ATOM 0 HD12 LEU A 59 3.709 98.817 18.800 1.00 0.00 H new ATOM 0 HD13 LEU A 59 2.699 98.294 20.169 1.00 0.00 H new ATOM 0 HD21 LEU A 59 0.704 96.650 18.528 1.00 0.00 H new ATOM 0 HD22 LEU A 59 0.276 97.799 19.819 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -0.443 97.970 18.200 1.00 0.00 H new ATOM 169 N SER A 60 0.842 101.605 15.967 1.00 0.00 N ATOM 170 CA SER A 60 0.479 101.644 14.517 1.00 0.00 C ATOM 171 C SER A 60 1.593 102.352 13.746 1.00 0.00 C ATOM 172 O SER A 60 1.925 101.960 12.626 1.00 0.00 O ATOM 173 CB SER A 60 -0.849 102.377 14.317 1.00 0.00 C ATOM 174 OG SER A 60 -1.883 101.419 14.149 1.00 0.00 O ATOM 0 H SER A 60 0.212 102.121 16.582 1.00 0.00 H new ATOM 0 HA SER A 60 0.364 100.626 14.145 1.00 0.00 H new ATOM 0 HB2 SER A 60 -1.061 103.014 15.176 1.00 0.00 H new ATOM 0 HB3 SER A 60 -0.793 103.028 13.444 1.00 0.00 H new ATOM 0 HG SER A 60 -2.586 101.793 13.577 1.00 0.00 H new ATOM 180 N GLU A 61 2.161 103.390 14.322 1.00 0.00 N ATOM 181 CA GLU A 61 3.252 104.157 13.644 1.00 0.00 C ATOM 182 C GLU A 61 4.453 103.242 13.417 1.00 0.00 C ATOM 183 O GLU A 61 5.136 103.361 12.398 1.00 0.00 O ATOM 184 CB GLU A 61 3.660 105.371 14.510 1.00 0.00 C ATOM 185 CG GLU A 61 3.172 106.683 13.875 1.00 0.00 C ATOM 186 CD GLU A 61 3.280 107.824 14.881 1.00 0.00 C ATOM 187 OE1 GLU A 61 2.719 107.696 15.956 1.00 0.00 O ATOM 188 OE2 GLU A 61 3.919 108.813 14.558 1.00 0.00 O ATOM 0 H GLU A 61 1.908 103.740 15.246 1.00 0.00 H new ATOM 0 HA GLU A 61 2.894 104.521 12.681 1.00 0.00 H new ATOM 0 HB2 GLU A 61 3.240 105.268 15.510 1.00 0.00 H new ATOM 0 HB3 GLU A 61 4.744 105.396 14.621 1.00 0.00 H new ATOM 0 HG2 GLU A 61 3.766 106.911 12.990 1.00 0.00 H new ATOM 0 HG3 GLU A 61 2.139 106.575 13.546 1.00 0.00 H new ATOM 195 N SER A 62 4.728 102.343 14.339 1.00 0.00 N ATOM 196 CA SER A 62 5.891 101.417 14.173 1.00 0.00 C ATOM 197 C SER A 62 5.658 100.572 12.925 1.00 0.00 C ATOM 198 O SER A 62 6.550 100.442 12.078 1.00 0.00 O ATOM 199 CB SER A 62 6.035 100.513 15.401 1.00 0.00 C ATOM 200 OG SER A 62 5.651 101.236 16.564 1.00 0.00 O ATOM 0 H SER A 62 4.194 102.214 15.199 1.00 0.00 H new ATOM 0 HA SER A 62 6.810 101.994 14.069 1.00 0.00 H new ATOM 0 HB2 SER A 62 5.413 99.625 15.288 1.00 0.00 H new ATOM 0 HB3 SER A 62 7.065 100.170 15.496 1.00 0.00 H new ATOM 0 HG SER A 62 4.673 101.280 16.614 1.00 0.00 H new ATOM 206 N LEU A 63 4.472 100.021 12.787 1.00 0.00 N ATOM 207 CA LEU A 63 4.143 99.198 11.577 1.00 0.00 C ATOM 208 C LEU A 63 4.141 100.115 10.352 1.00 0.00 C ATOM 209 O LEU A 63 4.668 99.762 9.287 1.00 0.00 O ATOM 210 CB LEU A 63 2.768 98.539 11.762 1.00 0.00 C ATOM 211 CG LEU A 63 2.909 97.254 12.619 1.00 0.00 C ATOM 212 CD1 LEU A 63 1.612 96.986 13.390 1.00 0.00 C ATOM 213 CD2 LEU A 63 3.210 96.052 11.716 1.00 0.00 C ATOM 0 H LEU A 63 3.715 100.107 13.465 1.00 0.00 H new ATOM 0 HA LEU A 63 4.884 98.411 11.438 1.00 0.00 H new ATOM 0 HB2 LEU A 63 2.083 99.236 12.246 1.00 0.00 H new ATOM 0 HB3 LEU A 63 2.339 98.293 10.790 1.00 0.00 H new ATOM 0 HG LEU A 63 3.728 97.398 13.324 1.00 0.00 H new ATOM 0 HD11 LEU A 63 1.724 96.081 13.988 1.00 0.00 H new ATOM 0 HD12 LEU A 63 1.398 97.830 14.046 1.00 0.00 H new ATOM 0 HD13 LEU A 63 0.790 96.856 12.686 1.00 0.00 H new ATOM 0 HD21 LEU A 63 3.307 95.154 12.326 1.00 0.00 H new ATOM 0 HD22 LEU A 63 2.396 95.920 11.003 1.00 0.00 H new ATOM 0 HD23 LEU A 63 4.141 96.227 11.176 1.00 0.00 H new ATOM 225 N LYS A 64 3.580 101.293 10.497 1.00 0.00 N ATOM 226 CA LYS A 64 3.544 102.278 9.373 1.00 0.00 C ATOM 227 C LYS A 64 4.979 102.597 8.961 1.00 0.00 C ATOM 228 O LYS A 64 5.267 102.795 7.776 1.00 0.00 O ATOM 229 CB LYS A 64 2.831 103.560 9.838 1.00 0.00 C ATOM 230 CG LYS A 64 2.388 104.414 8.632 1.00 0.00 C ATOM 231 CD LYS A 64 3.486 105.414 8.246 1.00 0.00 C ATOM 232 CE LYS A 64 2.936 106.394 7.206 1.00 0.00 C ATOM 233 NZ LYS A 64 3.924 107.487 6.982 1.00 0.00 N ATOM 0 H LYS A 64 3.140 101.616 11.359 1.00 0.00 H new ATOM 0 HA LYS A 64 3.002 101.863 8.524 1.00 0.00 H new ATOM 0 HB2 LYS A 64 1.962 103.299 10.442 1.00 0.00 H new ATOM 0 HB3 LYS A 64 3.498 104.141 10.474 1.00 0.00 H new ATOM 0 HG2 LYS A 64 2.164 103.767 7.784 1.00 0.00 H new ATOM 0 HG3 LYS A 64 1.470 104.949 8.876 1.00 0.00 H new ATOM 0 HD2 LYS A 64 3.827 105.956 9.128 1.00 0.00 H new ATOM 0 HD3 LYS A 64 4.350 104.885 7.843 1.00 0.00 H new ATOM 0 HE2 LYS A 64 2.736 105.873 6.270 1.00 0.00 H new ATOM 0 HE3 LYS A 64 1.989 106.810 7.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 3.633 108.056 6.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 3.968 108.094 7.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 4.862 107.076 6.802 1.00 0.00 H new ATOM 247 N ARG A 65 5.877 102.638 9.921 1.00 0.00 N ATOM 248 CA ARG A 65 7.306 102.934 9.628 1.00 0.00 C ATOM 249 C ARG A 65 7.936 101.756 8.886 1.00 0.00 C ATOM 250 O ARG A 65 8.845 101.958 8.084 1.00 0.00 O ATOM 251 CB ARG A 65 8.080 103.195 10.940 1.00 0.00 C ATOM 252 CG ARG A 65 9.157 104.299 10.740 1.00 0.00 C ATOM 253 CD ARG A 65 10.474 103.949 11.464 1.00 0.00 C ATOM 254 NE ARG A 65 10.611 104.761 12.721 1.00 0.00 N ATOM 255 CZ ARG A 65 11.794 105.104 13.213 1.00 0.00 C ATOM 256 NH1 ARG A 65 11.844 105.825 14.299 1.00 0.00 N ATOM 257 NH2 ARG A 65 12.921 104.722 12.651 1.00 0.00 N ATOM 0 H ARG A 65 5.670 102.476 10.906 1.00 0.00 H new ATOM 0 HA ARG A 65 7.358 103.826 9.004 1.00 0.00 H new ATOM 0 HB2 ARG A 65 7.385 103.498 11.723 1.00 0.00 H new ATOM 0 HB3 ARG A 65 8.556 102.274 11.275 1.00 0.00 H new ATOM 0 HG2 ARG A 65 9.351 104.430 9.675 1.00 0.00 H new ATOM 0 HG3 ARG A 65 8.777 105.250 11.114 1.00 0.00 H new ATOM 0 HD2 ARG A 65 10.492 102.886 11.706 1.00 0.00 H new ATOM 0 HD3 ARG A 65 11.321 104.141 10.805 1.00 0.00 H new ATOM 0 HE ARG A 65 9.767 105.058 13.211 1.00 0.00 H new ATOM 0 HH11 ARG A 65 10.981 106.117 14.758 1.00 0.00 H new ATOM 0 HH12 ARG A 65 12.746 106.097 14.690 1.00 0.00 H new ATOM 0 HH21 ARG A 65 12.902 104.144 11.811 1.00 0.00 H new ATOM 0 HH22 ARG A 65 13.814 105.004 13.056 1.00 0.00 H new ATOM 271 N ILE A 66 7.499 100.536 9.144 1.00 0.00 N ATOM 272 CA ILE A 66 8.113 99.357 8.450 1.00 0.00 C ATOM 273 C ILE A 66 7.872 99.486 6.939 1.00 0.00 C ATOM 274 O ILE A 66 8.794 99.269 6.142 1.00 0.00 O ATOM 275 CB ILE A 66 7.579 98.009 9.071 1.00 0.00 C ATOM 276 CG1 ILE A 66 8.744 96.997 9.265 1.00 0.00 C ATOM 277 CG2 ILE A 66 6.448 97.333 8.249 1.00 0.00 C ATOM 278 CD1 ILE A 66 9.410 96.616 7.924 1.00 0.00 C ATOM 0 H ILE A 66 6.750 100.312 9.800 1.00 0.00 H new ATOM 0 HA ILE A 66 9.192 99.338 8.602 1.00 0.00 H new ATOM 0 HB ILE A 66 7.146 98.287 10.032 1.00 0.00 H new ATOM 0 HG12 ILE A 66 9.491 97.428 9.931 1.00 0.00 H new ATOM 0 HG13 ILE A 66 8.366 96.097 9.750 1.00 0.00 H new ATOM 0 HG21 ILE A 66 6.138 96.413 8.745 1.00 0.00 H new ATOM 0 HG22 ILE A 66 5.597 98.010 8.176 1.00 0.00 H new ATOM 0 HG23 ILE A 66 6.814 97.101 7.249 1.00 0.00 H new ATOM 0 HD11 ILE A 66 10.218 95.908 8.107 1.00 0.00 H new ATOM 0 HD12 ILE A 66 8.670 96.160 7.267 1.00 0.00 H new ATOM 0 HD13 ILE A 66 9.813 97.511 7.451 1.00 0.00 H new ATOM 290 N GLY A 67 6.668 99.843 6.531 1.00 0.00 N ATOM 291 CA GLY A 67 6.383 99.994 5.067 1.00 0.00 C ATOM 292 C GLY A 67 7.146 101.196 4.505 1.00 0.00 C ATOM 293 O GLY A 67 7.796 101.095 3.453 1.00 0.00 O ATOM 0 H GLY A 67 5.878 100.034 7.148 1.00 0.00 H new ATOM 0 HA2 GLY A 67 6.674 99.088 4.536 1.00 0.00 H new ATOM 0 HA3 GLY A 67 5.313 100.126 4.908 1.00 0.00 H new ATOM 297 N ASP A 68 7.072 102.325 5.176 1.00 0.00 N ATOM 298 CA ASP A 68 7.776 103.557 4.693 1.00 0.00 C ATOM 299 C ASP A 68 9.291 103.343 4.723 1.00 0.00 C ATOM 300 O ASP A 68 10.012 103.864 3.865 1.00 0.00 O ATOM 301 CB ASP A 68 7.411 104.749 5.581 1.00 0.00 C ATOM 302 CG ASP A 68 6.062 105.320 5.159 1.00 0.00 C ATOM 303 OD1 ASP A 68 5.059 104.686 5.443 1.00 0.00 O ATOM 304 OD2 ASP A 68 6.050 106.381 4.558 1.00 0.00 O ATOM 0 H ASP A 68 6.550 102.445 6.044 1.00 0.00 H new ATOM 0 HA ASP A 68 7.463 103.760 3.669 1.00 0.00 H new ATOM 0 HB2 ASP A 68 7.373 104.437 6.625 1.00 0.00 H new ATOM 0 HB3 ASP A 68 8.180 105.518 5.506 1.00 0.00 H new ATOM 309 N GLU A 69 9.782 102.594 5.687 1.00 0.00 N ATOM 310 CA GLU A 69 11.254 102.337 5.786 1.00 0.00 C ATOM 311 C GLU A 69 11.704 101.561 4.558 1.00 0.00 C ATOM 312 O GLU A 69 12.772 101.842 4.003 1.00 0.00 O ATOM 313 CB GLU A 69 11.591 101.541 7.060 1.00 0.00 C ATOM 314 CG GLU A 69 11.830 102.495 8.252 1.00 0.00 C ATOM 315 CD GLU A 69 12.687 101.829 9.343 1.00 0.00 C ATOM 316 OE1 GLU A 69 13.007 100.653 9.215 1.00 0.00 O ATOM 317 OE2 GLU A 69 13.014 102.514 10.297 1.00 0.00 O ATOM 0 H GLU A 69 9.220 102.148 6.412 1.00 0.00 H new ATOM 0 HA GLU A 69 11.777 103.292 5.837 1.00 0.00 H new ATOM 0 HB2 GLU A 69 10.776 100.856 7.293 1.00 0.00 H new ATOM 0 HB3 GLU A 69 12.479 100.933 6.891 1.00 0.00 H new ATOM 0 HG2 GLU A 69 12.325 103.401 7.901 1.00 0.00 H new ATOM 0 HG3 GLU A 69 10.872 102.798 8.675 1.00 0.00 H new ATOM 324 N LEU A 70 10.912 100.605 4.110 1.00 0.00 N ATOM 325 CA LEU A 70 11.288 99.818 2.892 1.00 0.00 C ATOM 326 C LEU A 70 11.444 100.790 1.730 1.00 0.00 C ATOM 327 O LEU A 70 12.408 100.721 0.962 1.00 0.00 O ATOM 328 CB LEU A 70 10.192 98.795 2.553 1.00 0.00 C ATOM 329 CG LEU A 70 10.789 97.614 1.778 1.00 0.00 C ATOM 330 CD1 LEU A 70 9.759 96.482 1.705 1.00 0.00 C ATOM 331 CD2 LEU A 70 11.188 98.044 0.352 1.00 0.00 C ATOM 0 H LEU A 70 10.025 100.340 4.538 1.00 0.00 H new ATOM 0 HA LEU A 70 12.218 99.280 3.076 1.00 0.00 H new ATOM 0 HB2 LEU A 70 9.722 98.438 3.469 1.00 0.00 H new ATOM 0 HB3 LEU A 70 9.411 99.271 1.960 1.00 0.00 H new ATOM 0 HG LEU A 70 11.683 97.269 2.298 1.00 0.00 H new ATOM 0 HD11 LEU A 70 10.181 95.641 1.154 1.00 0.00 H new ATOM 0 HD12 LEU A 70 9.499 96.161 2.714 1.00 0.00 H new ATOM 0 HD13 LEU A 70 8.864 96.837 1.195 1.00 0.00 H new ATOM 0 HD21 LEU A 70 11.609 97.191 -0.181 1.00 0.00 H new ATOM 0 HD22 LEU A 70 10.307 98.404 -0.179 1.00 0.00 H new ATOM 0 HD23 LEU A 70 11.930 98.841 0.406 1.00 0.00 H new ATOM 343 N ASP A 71 10.519 101.708 1.613 1.00 0.00 N ATOM 344 CA ASP A 71 10.585 102.731 0.523 1.00 0.00 C ATOM 345 C ASP A 71 11.887 103.530 0.663 1.00 0.00 C ATOM 346 O ASP A 71 12.457 103.978 -0.338 1.00 0.00 O ATOM 347 CB ASP A 71 9.374 103.684 0.616 1.00 0.00 C ATOM 348 CG ASP A 71 8.299 103.358 -0.435 1.00 0.00 C ATOM 349 OD1 ASP A 71 7.195 103.854 -0.281 1.00 0.00 O ATOM 350 OD2 ASP A 71 8.588 102.639 -1.382 1.00 0.00 O ATOM 0 H ASP A 71 9.713 101.794 2.232 1.00 0.00 H new ATOM 0 HA ASP A 71 10.563 102.231 -0.445 1.00 0.00 H new ATOM 0 HB2 ASP A 71 8.938 103.619 1.613 1.00 0.00 H new ATOM 0 HB3 ASP A 71 9.711 104.712 0.482 1.00 0.00 H new ATOM 355 N SER A 72 12.355 103.728 1.880 1.00 0.00 N ATOM 356 CA SER A 72 13.614 104.512 2.105 1.00 0.00 C ATOM 357 C SER A 72 14.849 103.598 2.107 1.00 0.00 C ATOM 358 O SER A 72 15.976 104.094 2.208 1.00 0.00 O ATOM 359 CB SER A 72 13.528 105.255 3.440 1.00 0.00 C ATOM 360 OG SER A 72 12.874 106.503 3.243 1.00 0.00 O ATOM 0 H SER A 72 11.914 103.377 2.730 1.00 0.00 H new ATOM 0 HA SER A 72 13.718 105.226 1.288 1.00 0.00 H new ATOM 0 HB2 SER A 72 12.981 104.656 4.168 1.00 0.00 H new ATOM 0 HB3 SER A 72 14.527 105.415 3.845 1.00 0.00 H new ATOM 0 HG SER A 72 12.816 106.980 4.097 1.00 0.00 H new ATOM 366 N ASN A 73 14.672 102.292 2.004 1.00 0.00 N ATOM 367 CA ASN A 73 15.843 101.362 2.003 1.00 0.00 C ATOM 368 C ASN A 73 16.694 101.655 0.776 1.00 0.00 C ATOM 369 O ASN A 73 16.418 101.163 -0.321 1.00 0.00 O ATOM 370 CB ASN A 73 15.380 99.903 1.983 1.00 0.00 C ATOM 371 CG ASN A 73 15.163 99.403 3.407 1.00 0.00 C ATOM 372 OD1 ASN A 73 14.582 100.107 4.232 1.00 0.00 O ATOM 373 ND2 ASN A 73 15.599 98.220 3.747 1.00 0.00 N ATOM 0 H ASN A 73 13.763 101.837 1.921 1.00 0.00 H new ATOM 0 HA ASN A 73 16.427 101.516 2.911 1.00 0.00 H new ATOM 0 HB2 ASN A 73 14.455 99.815 1.413 1.00 0.00 H new ATOM 0 HB3 ASN A 73 16.124 99.284 1.481 1.00 0.00 H new ATOM 0 HD21 ASN A 73 15.458 97.878 4.698 1.00 0.00 H new ATOM 0 HD22 ASN A 73 16.080 97.638 3.062 1.00 0.00 H new ATOM 380 N MET A 74 17.713 102.458 0.949 1.00 0.00 N ATOM 381 CA MET A 74 18.612 102.834 -0.188 1.00 0.00 C ATOM 382 C MET A 74 19.133 101.580 -0.888 1.00 0.00 C ATOM 383 O MET A 74 19.249 101.557 -2.119 1.00 0.00 O ATOM 384 CB MET A 74 19.794 103.660 0.332 1.00 0.00 C ATOM 385 CG MET A 74 19.328 105.086 0.644 1.00 0.00 C ATOM 386 SD MET A 74 20.653 105.994 1.483 1.00 0.00 S ATOM 387 CE MET A 74 21.808 106.059 0.091 1.00 0.00 C ATOM 0 H MET A 74 17.965 102.876 1.844 1.00 0.00 H new ATOM 0 HA MET A 74 18.042 103.428 -0.902 1.00 0.00 H new ATOM 0 HB2 MET A 74 20.207 103.198 1.228 1.00 0.00 H new ATOM 0 HB3 MET A 74 20.591 103.682 -0.412 1.00 0.00 H new ATOM 0 HG2 MET A 74 19.051 105.598 -0.278 1.00 0.00 H new ATOM 0 HG3 MET A 74 18.438 105.058 1.273 1.00 0.00 H new ATOM 0 HE1 MET A 74 22.497 106.893 0.228 1.00 0.00 H new ATOM 0 HE2 MET A 74 22.372 105.127 0.042 1.00 0.00 H new ATOM 0 HE3 MET A 74 21.252 106.196 -0.837 1.00 0.00 H new ATOM 397 N GLU A 75 19.467 100.552 -0.141 1.00 0.00 N ATOM 398 CA GLU A 75 19.997 99.302 -0.772 1.00 0.00 C ATOM 399 C GLU A 75 18.904 98.611 -1.592 1.00 0.00 C ATOM 400 O GLU A 75 19.157 98.169 -2.718 1.00 0.00 O ATOM 401 CB GLU A 75 20.516 98.343 0.305 1.00 0.00 C ATOM 402 CG GLU A 75 21.714 98.969 1.030 1.00 0.00 C ATOM 403 CD GLU A 75 22.897 99.115 0.075 1.00 0.00 C ATOM 404 OE1 GLU A 75 23.314 98.113 -0.482 1.00 0.00 O ATOM 405 OE2 GLU A 75 23.365 100.230 -0.089 1.00 0.00 O ATOM 0 H GLU A 75 19.395 100.526 0.876 1.00 0.00 H new ATOM 0 HA GLU A 75 20.818 99.575 -1.435 1.00 0.00 H new ATOM 0 HB2 GLU A 75 19.723 98.121 1.019 1.00 0.00 H new ATOM 0 HB3 GLU A 75 20.809 97.397 -0.149 1.00 0.00 H new ATOM 0 HG2 GLU A 75 21.437 99.945 1.428 1.00 0.00 H new ATOM 0 HG3 GLU A 75 21.998 98.348 1.879 1.00 0.00 H new ATOM 412 N LEU A 76 17.710 98.488 -1.045 1.00 0.00 N ATOM 413 CA LEU A 76 16.599 97.795 -1.777 1.00 0.00 C ATOM 414 C LEU A 76 16.141 98.598 -2.990 1.00 0.00 C ATOM 415 O LEU A 76 15.951 98.030 -4.070 1.00 0.00 O ATOM 416 CB LEU A 76 15.406 97.564 -0.840 1.00 0.00 C ATOM 417 CG LEU A 76 15.732 96.455 0.169 1.00 0.00 C ATOM 418 CD1 LEU A 76 14.666 96.443 1.268 1.00 0.00 C ATOM 419 CD2 LEU A 76 15.734 95.096 -0.541 1.00 0.00 C ATOM 0 H LEU A 76 17.460 98.840 -0.121 1.00 0.00 H new ATOM 0 HA LEU A 76 16.985 96.836 -2.124 1.00 0.00 H new ATOM 0 HB2 LEU A 76 15.165 98.487 -0.312 1.00 0.00 H new ATOM 0 HB3 LEU A 76 14.526 97.290 -1.421 1.00 0.00 H new ATOM 0 HG LEU A 76 16.714 96.640 0.605 1.00 0.00 H new ATOM 0 HD11 LEU A 76 14.894 95.656 1.987 1.00 0.00 H new ATOM 0 HD12 LEU A 76 14.656 97.407 1.776 1.00 0.00 H new ATOM 0 HD13 LEU A 76 13.688 96.257 0.824 1.00 0.00 H new ATOM 0 HD21 LEU A 76 15.966 94.310 0.178 1.00 0.00 H new ATOM 0 HD22 LEU A 76 14.752 94.911 -0.976 1.00 0.00 H new ATOM 0 HD23 LEU A 76 16.486 95.099 -1.330 1.00 0.00 H new ATOM 431 N GLN A 77 15.952 99.888 -2.837 1.00 0.00 N ATOM 432 CA GLN A 77 15.484 100.730 -3.989 1.00 0.00 C ATOM 433 C GLN A 77 16.518 100.679 -5.111 1.00 0.00 C ATOM 434 O GLN A 77 16.157 100.661 -6.291 1.00 0.00 O ATOM 435 CB GLN A 77 15.206 102.187 -3.562 1.00 0.00 C ATOM 436 CG GLN A 77 16.420 102.821 -2.853 1.00 0.00 C ATOM 437 CD GLN A 77 16.703 104.207 -3.432 1.00 0.00 C ATOM 438 OE1 GLN A 77 17.397 104.330 -4.442 1.00 0.00 O ATOM 439 NE2 GLN A 77 16.200 105.263 -2.851 1.00 0.00 N ATOM 0 H GLN A 77 16.101 100.396 -1.965 1.00 0.00 H new ATOM 0 HA GLN A 77 14.540 100.322 -4.349 1.00 0.00 H new ATOM 0 HB2 GLN A 77 14.948 102.780 -4.440 1.00 0.00 H new ATOM 0 HB3 GLN A 77 14.343 102.212 -2.896 1.00 0.00 H new ATOM 0 HG2 GLN A 77 16.226 102.898 -1.783 1.00 0.00 H new ATOM 0 HG3 GLN A 77 17.295 102.183 -2.973 1.00 0.00 H new ATOM 0 HE21 GLN A 77 15.625 105.160 -2.015 1.00 0.00 H new ATOM 0 HE22 GLN A 77 16.382 106.191 -3.234 1.00 0.00 H new ATOM 448 N ARG A 78 17.788 100.659 -4.776 1.00 0.00 N ATOM 449 CA ARG A 78 18.851 100.606 -5.826 1.00 0.00 C ATOM 450 C ARG A 78 18.766 99.266 -6.562 1.00 0.00 C ATOM 451 O ARG A 78 18.963 99.206 -7.782 1.00 0.00 O ATOM 452 CB ARG A 78 20.238 100.762 -5.176 1.00 0.00 C ATOM 453 CG ARG A 78 21.200 101.494 -6.129 1.00 0.00 C ATOM 454 CD ARG A 78 20.892 102.998 -6.122 1.00 0.00 C ATOM 455 NE ARG A 78 22.067 103.778 -6.637 1.00 0.00 N ATOM 456 CZ ARG A 78 23.137 104.010 -5.890 1.00 0.00 C ATOM 457 NH1 ARG A 78 24.119 104.710 -6.387 1.00 0.00 N ATOM 458 NH2 ARG A 78 23.241 103.548 -4.662 1.00 0.00 N ATOM 0 H ARG A 78 18.133 100.677 -3.816 1.00 0.00 H new ATOM 0 HA ARG A 78 18.703 101.420 -6.536 1.00 0.00 H new ATOM 0 HB2 ARG A 78 20.148 101.318 -4.243 1.00 0.00 H new ATOM 0 HB3 ARG A 78 20.641 99.781 -4.925 1.00 0.00 H new ATOM 0 HG2 ARG A 78 22.232 101.323 -5.822 1.00 0.00 H new ATOM 0 HG3 ARG A 78 21.098 101.097 -7.139 1.00 0.00 H new ATOM 0 HD2 ARG A 78 20.016 103.199 -6.739 1.00 0.00 H new ATOM 0 HD3 ARG A 78 20.649 103.321 -5.110 1.00 0.00 H new ATOM 0 HE ARG A 78 22.041 104.140 -7.590 1.00 0.00 H new ATOM 0 HH11 ARG A 78 24.057 105.071 -7.339 1.00 0.00 H new ATOM 0 HH12 ARG A 78 24.949 104.896 -5.824 1.00 0.00 H new ATOM 0 HH21 ARG A 78 22.485 102.994 -4.260 1.00 0.00 H new ATOM 0 HH22 ARG A 78 24.078 103.744 -4.113 1.00 0.00 H new ATOM 472 N MET A 79 18.493 98.192 -5.844 1.00 0.00 N ATOM 473 CA MET A 79 18.413 96.841 -6.488 1.00 0.00 C ATOM 474 C MET A 79 17.269 96.795 -7.500 1.00 0.00 C ATOM 475 O MET A 79 17.464 96.331 -8.630 1.00 0.00 O ATOM 476 CB MET A 79 18.195 95.762 -5.418 1.00 0.00 C ATOM 477 CG MET A 79 19.508 95.465 -4.674 1.00 0.00 C ATOM 478 SD MET A 79 19.518 93.737 -4.129 1.00 0.00 S ATOM 479 CE MET A 79 18.174 93.857 -2.922 1.00 0.00 C ATOM 0 H MET A 79 18.323 98.198 -4.838 1.00 0.00 H new ATOM 0 HA MET A 79 19.352 96.652 -7.009 1.00 0.00 H new ATOM 0 HB2 MET A 79 17.436 96.093 -4.709 1.00 0.00 H new ATOM 0 HB3 MET A 79 17.820 94.851 -5.884 1.00 0.00 H new ATOM 0 HG2 MET A 79 20.359 95.656 -5.327 1.00 0.00 H new ATOM 0 HG3 MET A 79 19.610 96.129 -3.815 1.00 0.00 H new ATOM 0 HE1 MET A 79 18.106 92.926 -2.360 1.00 0.00 H new ATOM 0 HE2 MET A 79 18.373 94.681 -2.237 1.00 0.00 H new ATOM 0 HE3 MET A 79 17.233 94.037 -3.442 1.00 0.00 H new ATOM 489 N ILE A 80 16.091 97.261 -7.134 1.00 0.00 N ATOM 490 CA ILE A 80 14.933 97.243 -8.096 1.00 0.00 C ATOM 491 C ILE A 80 15.190 98.244 -9.211 1.00 0.00 C ATOM 492 O ILE A 80 14.899 97.963 -10.374 1.00 0.00 O ATOM 493 CB ILE A 80 13.575 97.558 -7.421 1.00 0.00 C ATOM 494 CG1 ILE A 80 13.711 98.675 -6.370 1.00 0.00 C ATOM 495 CG2 ILE A 80 13.022 96.288 -6.758 1.00 0.00 C ATOM 496 CD1 ILE A 80 12.327 99.233 -6.014 1.00 0.00 C ATOM 0 H ILE A 80 15.882 97.651 -6.215 1.00 0.00 H new ATOM 0 HA ILE A 80 14.862 96.230 -8.492 1.00 0.00 H new ATOM 0 HB ILE A 80 12.887 97.905 -8.192 1.00 0.00 H new ATOM 0 HG12 ILE A 80 14.196 98.286 -5.475 1.00 0.00 H new ATOM 0 HG13 ILE A 80 14.346 99.473 -6.756 1.00 0.00 H new ATOM 0 HG21 ILE A 80 12.066 96.512 -6.284 1.00 0.00 H new ATOM 0 HG22 ILE A 80 12.880 95.515 -7.514 1.00 0.00 H new ATOM 0 HG23 ILE A 80 13.727 95.934 -6.005 1.00 0.00 H new ATOM 0 HD11 ILE A 80 12.433 100.022 -5.270 1.00 0.00 H new ATOM 0 HD12 ILE A 80 11.857 99.639 -6.910 1.00 0.00 H new ATOM 0 HD13 ILE A 80 11.706 98.434 -5.609 1.00 0.00 H new ATOM 508 N ALA A 81 15.729 99.394 -8.888 1.00 0.00 N ATOM 509 CA ALA A 81 16.015 100.424 -9.939 1.00 0.00 C ATOM 510 C ALA A 81 17.065 99.890 -10.926 1.00 0.00 C ATOM 511 O ALA A 81 17.208 100.424 -12.031 1.00 0.00 O ATOM 512 CB ALA A 81 16.522 101.706 -9.282 1.00 0.00 C ATOM 0 H ALA A 81 15.985 99.666 -7.939 1.00 0.00 H new ATOM 0 HA ALA A 81 15.096 100.641 -10.484 1.00 0.00 H new ATOM 0 HB1 ALA A 81 16.728 102.451 -10.050 1.00 0.00 H new ATOM 0 HB2 ALA A 81 15.764 102.089 -8.599 1.00 0.00 H new ATOM 0 HB3 ALA A 81 17.436 101.494 -8.727 1.00 0.00 H new ATOM 518 N ALA A 82 17.796 98.861 -10.550 1.00 0.00 N ATOM 519 CA ALA A 82 18.845 98.278 -11.448 1.00 0.00 C ATOM 520 C ALA A 82 18.226 97.225 -12.390 1.00 0.00 C ATOM 521 O ALA A 82 18.950 96.379 -12.922 1.00 0.00 O ATOM 522 CB ALA A 82 19.936 97.625 -10.595 1.00 0.00 C ATOM 0 H ALA A 82 17.707 98.396 -9.646 1.00 0.00 H new ATOM 0 HA ALA A 82 19.276 99.076 -12.053 1.00 0.00 H new ATOM 0 HB1 ALA A 82 20.701 97.200 -11.245 1.00 0.00 H new ATOM 0 HB2 ALA A 82 20.388 98.375 -9.946 1.00 0.00 H new ATOM 0 HB3 ALA A 82 19.497 96.835 -9.986 1.00 0.00 H new ATOM 528 N VAL A 83 16.912 97.238 -12.589 1.00 0.00 N ATOM 529 CA VAL A 83 16.243 96.224 -13.486 1.00 0.00 C ATOM 530 C VAL A 83 16.577 96.489 -14.970 1.00 0.00 C ATOM 531 O VAL A 83 15.677 96.669 -15.800 1.00 0.00 O ATOM 532 CB VAL A 83 14.706 96.260 -13.294 1.00 0.00 C ATOM 533 CG1 VAL A 83 14.303 95.694 -11.914 1.00 0.00 C ATOM 534 CG2 VAL A 83 14.190 97.700 -13.464 1.00 0.00 C ATOM 0 H VAL A 83 16.276 97.913 -12.164 1.00 0.00 H new ATOM 0 HA VAL A 83 16.621 95.240 -13.210 1.00 0.00 H new ATOM 0 HB VAL A 83 14.248 95.629 -14.056 1.00 0.00 H new ATOM 0 HG11 VAL A 83 13.219 95.732 -11.808 1.00 0.00 H new ATOM 0 HG12 VAL A 83 14.640 94.661 -11.832 1.00 0.00 H new ATOM 0 HG13 VAL A 83 14.766 96.290 -11.127 1.00 0.00 H new ATOM 0 HG21 VAL A 83 13.109 97.718 -13.328 1.00 0.00 H new ATOM 0 HG22 VAL A 83 14.660 98.345 -12.721 1.00 0.00 H new ATOM 0 HG23 VAL A 83 14.436 98.059 -14.464 1.00 0.00 H new ATOM 544 N ASP A 84 17.845 96.484 -15.326 1.00 0.00 N ATOM 545 CA ASP A 84 18.259 96.706 -16.754 1.00 0.00 C ATOM 546 C ASP A 84 17.800 98.084 -17.233 1.00 0.00 C ATOM 547 O ASP A 84 16.776 98.613 -16.789 1.00 0.00 O ATOM 548 CB ASP A 84 17.669 95.609 -17.661 1.00 0.00 C ATOM 549 CG ASP A 84 18.763 94.958 -18.505 1.00 0.00 C ATOM 550 OD1 ASP A 84 18.613 94.932 -19.715 1.00 0.00 O ATOM 551 OD2 ASP A 84 19.733 94.493 -17.928 1.00 0.00 O ATOM 0 H ASP A 84 18.619 96.334 -14.679 1.00 0.00 H new ATOM 0 HA ASP A 84 19.347 96.659 -16.809 1.00 0.00 H new ATOM 0 HB2 ASP A 84 17.175 94.853 -17.051 1.00 0.00 H new ATOM 0 HB3 ASP A 84 16.908 96.039 -18.312 1.00 0.00 H new ATOM 556 N THR A 85 18.556 98.673 -18.124 1.00 0.00 N ATOM 557 CA THR A 85 18.211 100.030 -18.660 1.00 0.00 C ATOM 558 C THR A 85 17.391 99.930 -19.957 1.00 0.00 C ATOM 559 O THR A 85 16.523 100.772 -20.207 1.00 0.00 O ATOM 560 CB THR A 85 19.497 100.821 -18.923 1.00 0.00 C ATOM 561 OG1 THR A 85 20.337 100.077 -19.794 1.00 0.00 O ATOM 562 CG2 THR A 85 20.222 101.066 -17.598 1.00 0.00 C ATOM 0 H THR A 85 19.409 98.268 -18.509 1.00 0.00 H new ATOM 0 HA THR A 85 17.604 100.544 -17.915 1.00 0.00 H new ATOM 0 HB THR A 85 19.251 101.777 -19.384 1.00 0.00 H new ATOM 0 HG1 THR A 85 21.160 100.582 -19.965 1.00 0.00 H new ATOM 0 HG21 THR A 85 21.137 101.629 -17.783 1.00 0.00 H new ATOM 0 HG22 THR A 85 19.576 101.634 -16.929 1.00 0.00 H new ATOM 0 HG23 THR A 85 20.470 100.110 -17.137 1.00 0.00 H new ATOM 570 N ASP A 86 17.677 98.956 -20.802 1.00 0.00 N ATOM 571 CA ASP A 86 16.959 98.827 -22.113 1.00 0.00 C ATOM 572 C ASP A 86 15.468 98.511 -21.928 1.00 0.00 C ATOM 573 O ASP A 86 14.648 98.968 -22.733 1.00 0.00 O ATOM 574 CB ASP A 86 17.627 97.732 -22.970 1.00 0.00 C ATOM 575 CG ASP A 86 17.847 98.230 -24.398 1.00 0.00 C ATOM 576 OD1 ASP A 86 18.960 98.624 -24.701 1.00 0.00 O ATOM 577 OD2 ASP A 86 16.898 98.208 -25.164 1.00 0.00 O ATOM 0 H ASP A 86 18.384 98.241 -20.633 1.00 0.00 H new ATOM 0 HA ASP A 86 17.028 99.789 -22.622 1.00 0.00 H new ATOM 0 HB2 ASP A 86 18.581 97.447 -22.527 1.00 0.00 H new ATOM 0 HB3 ASP A 86 17.002 96.839 -22.982 1.00 0.00 H new ATOM 582 N SER A 87 15.092 97.741 -20.923 1.00 0.00 N ATOM 583 CA SER A 87 13.638 97.403 -20.744 1.00 0.00 C ATOM 584 C SER A 87 13.390 96.768 -19.357 1.00 0.00 C ATOM 585 O SER A 87 13.630 95.568 -19.189 1.00 0.00 O ATOM 586 CB SER A 87 13.202 96.423 -21.835 1.00 0.00 C ATOM 587 OG SER A 87 13.985 95.240 -21.742 1.00 0.00 O ATOM 0 H SER A 87 15.722 97.338 -20.229 1.00 0.00 H new ATOM 0 HA SER A 87 13.058 98.323 -20.817 1.00 0.00 H new ATOM 0 HB2 SER A 87 12.145 96.183 -21.723 1.00 0.00 H new ATOM 0 HB3 SER A 87 13.324 96.877 -22.818 1.00 0.00 H new ATOM 0 HG SER A 87 13.954 94.898 -20.824 1.00 0.00 H new ATOM 593 N PRO A 88 12.914 97.522 -18.358 1.00 0.00 N ATOM 594 CA PRO A 88 12.643 96.962 -16.991 1.00 0.00 C ATOM 595 C PRO A 88 11.529 95.913 -16.994 1.00 0.00 C ATOM 596 O PRO A 88 11.543 94.971 -16.194 1.00 0.00 O ATOM 597 CB PRO A 88 12.244 98.186 -16.159 1.00 0.00 C ATOM 598 CG PRO A 88 11.744 99.181 -17.144 1.00 0.00 C ATOM 599 CD PRO A 88 12.571 98.968 -18.406 1.00 0.00 C ATOM 0 HA PRO A 88 13.513 96.439 -16.593 1.00 0.00 H new ATOM 0 HB2 PRO A 88 11.474 97.933 -15.430 1.00 0.00 H new ATOM 0 HB3 PRO A 88 13.095 98.577 -15.601 1.00 0.00 H new ATOM 0 HG2 PRO A 88 10.682 99.035 -17.343 1.00 0.00 H new ATOM 0 HG3 PRO A 88 11.861 100.197 -16.767 1.00 0.00 H new ATOM 0 HD2 PRO A 88 12.004 99.216 -19.303 1.00 0.00 H new ATOM 0 HD3 PRO A 88 13.465 99.592 -18.410 1.00 0.00 H new ATOM 607 N ARG A 89 10.559 96.077 -17.865 1.00 0.00 N ATOM 608 CA ARG A 89 9.405 95.122 -17.934 1.00 0.00 C ATOM 609 C ARG A 89 9.869 93.721 -18.324 1.00 0.00 C ATOM 610 O ARG A 89 9.173 92.740 -18.035 1.00 0.00 O ATOM 611 CB ARG A 89 8.384 95.609 -18.962 1.00 0.00 C ATOM 612 CG ARG A 89 7.716 96.887 -18.461 1.00 0.00 C ATOM 613 CD ARG A 89 6.554 97.234 -19.389 1.00 0.00 C ATOM 614 NE ARG A 89 5.914 98.526 -18.969 1.00 0.00 N ATOM 615 CZ ARG A 89 6.300 99.698 -19.454 1.00 0.00 C ATOM 616 NH1 ARG A 89 5.694 100.777 -19.045 1.00 0.00 N ATOM 617 NH2 ARG A 89 7.278 99.806 -20.326 1.00 0.00 N ATOM 0 H ARG A 89 10.518 96.842 -18.539 1.00 0.00 H new ATOM 0 HA ARG A 89 8.950 95.080 -16.944 1.00 0.00 H new ATOM 0 HB2 ARG A 89 8.876 95.795 -19.917 1.00 0.00 H new ATOM 0 HB3 ARG A 89 7.633 94.839 -19.135 1.00 0.00 H new ATOM 0 HG2 ARG A 89 7.356 96.749 -17.441 1.00 0.00 H new ATOM 0 HG3 ARG A 89 8.436 97.705 -18.437 1.00 0.00 H new ATOM 0 HD2 ARG A 89 6.912 97.315 -20.415 1.00 0.00 H new ATOM 0 HD3 ARG A 89 5.815 96.433 -19.372 1.00 0.00 H new ATOM 0 HE ARG A 89 5.156 98.501 -18.287 1.00 0.00 H new ATOM 0 HH11 ARG A 89 4.938 100.710 -18.364 1.00 0.00 H new ATOM 0 HH12 ARG A 89 5.976 101.688 -19.406 1.00 0.00 H new ATOM 0 HH21 ARG A 89 7.766 98.971 -20.651 1.00 0.00 H new ATOM 0 HH22 ARG A 89 7.548 100.724 -20.678 1.00 0.00 H new ATOM 631 N GLU A 90 10.995 93.596 -18.994 1.00 0.00 N ATOM 632 CA GLU A 90 11.468 92.242 -19.425 1.00 0.00 C ATOM 633 C GLU A 90 11.854 91.400 -18.209 1.00 0.00 C ATOM 634 O GLU A 90 11.474 90.223 -18.122 1.00 0.00 O ATOM 635 CB GLU A 90 12.673 92.379 -20.367 1.00 0.00 C ATOM 636 CG GLU A 90 12.943 91.047 -21.089 1.00 0.00 C ATOM 637 CD GLU A 90 13.516 91.316 -22.478 1.00 0.00 C ATOM 638 OE1 GLU A 90 14.528 90.721 -22.807 1.00 0.00 O ATOM 639 OE2 GLU A 90 12.933 92.116 -23.192 1.00 0.00 O ATOM 0 H GLU A 90 11.603 94.371 -19.259 1.00 0.00 H new ATOM 0 HA GLU A 90 10.656 91.744 -19.954 1.00 0.00 H new ATOM 0 HB2 GLU A 90 12.484 93.165 -21.098 1.00 0.00 H new ATOM 0 HB3 GLU A 90 13.554 92.678 -19.799 1.00 0.00 H new ATOM 0 HG2 GLU A 90 13.641 90.444 -20.509 1.00 0.00 H new ATOM 0 HG3 GLU A 90 12.019 90.474 -21.172 1.00 0.00 H new ATOM 646 N VAL A 91 12.580 91.967 -17.263 1.00 0.00 N ATOM 647 CA VAL A 91 12.974 91.183 -16.045 1.00 0.00 C ATOM 648 C VAL A 91 11.759 91.002 -15.136 1.00 0.00 C ATOM 649 O VAL A 91 11.611 89.961 -14.490 1.00 0.00 O ATOM 650 CB VAL A 91 14.136 91.853 -15.272 1.00 0.00 C ATOM 651 CG1 VAL A 91 15.321 92.091 -16.211 1.00 0.00 C ATOM 652 CG2 VAL A 91 13.706 93.198 -14.670 1.00 0.00 C ATOM 0 H VAL A 91 12.912 92.931 -17.284 1.00 0.00 H new ATOM 0 HA VAL A 91 13.332 90.208 -16.375 1.00 0.00 H new ATOM 0 HB VAL A 91 14.424 91.181 -14.463 1.00 0.00 H new ATOM 0 HG11 VAL A 91 16.134 92.563 -15.659 1.00 0.00 H new ATOM 0 HG12 VAL A 91 15.662 91.138 -16.615 1.00 0.00 H new ATOM 0 HG13 VAL A 91 15.012 92.742 -17.029 1.00 0.00 H new ATOM 0 HG21 VAL A 91 14.545 93.642 -14.134 1.00 0.00 H new ATOM 0 HG22 VAL A 91 13.389 93.869 -15.468 1.00 0.00 H new ATOM 0 HG23 VAL A 91 12.878 93.039 -13.980 1.00 0.00 H new ATOM 662 N PHE A 92 10.894 91.995 -15.078 1.00 0.00 N ATOM 663 CA PHE A 92 9.687 91.905 -14.213 1.00 0.00 C ATOM 664 C PHE A 92 8.741 90.862 -14.793 1.00 0.00 C ATOM 665 O PHE A 92 8.144 90.072 -14.053 1.00 0.00 O ATOM 666 CB PHE A 92 9.011 93.273 -14.129 1.00 0.00 C ATOM 667 CG PHE A 92 7.947 93.237 -13.063 1.00 0.00 C ATOM 668 CD1 PHE A 92 6.618 93.050 -13.426 1.00 0.00 C ATOM 669 CD2 PHE A 92 8.295 93.384 -11.716 1.00 0.00 C ATOM 670 CE1 PHE A 92 5.620 93.008 -12.444 1.00 0.00 C ATOM 671 CE2 PHE A 92 7.303 93.344 -10.731 1.00 0.00 C ATOM 672 CZ PHE A 92 5.964 93.155 -11.094 1.00 0.00 C ATOM 0 H PHE A 92 10.982 92.867 -15.601 1.00 0.00 H new ATOM 0 HA PHE A 92 9.968 91.604 -13.204 1.00 0.00 H new ATOM 0 HB2 PHE A 92 9.748 94.042 -13.898 1.00 0.00 H new ATOM 0 HB3 PHE A 92 8.570 93.533 -15.091 1.00 0.00 H new ATOM 0 HD1 PHE A 92 6.355 92.937 -14.467 1.00 0.00 H new ATOM 0 HD2 PHE A 92 9.328 93.528 -11.437 1.00 0.00 H new ATOM 0 HE1 PHE A 92 4.588 92.863 -12.727 1.00 0.00 H new ATOM 0 HE2 PHE A 92 7.570 93.459 -9.691 1.00 0.00 H new ATOM 0 HZ PHE A 92 5.197 93.123 -10.334 1.00 0.00 H new ATOM 682 N PHE A 93 8.614 90.832 -16.099 1.00 0.00 N ATOM 683 CA PHE A 93 7.732 89.828 -16.761 1.00 0.00 C ATOM 684 C PHE A 93 8.254 88.428 -16.431 1.00 0.00 C ATOM 685 O PHE A 93 7.469 87.487 -16.288 1.00 0.00 O ATOM 686 CB PHE A 93 7.728 90.058 -18.279 1.00 0.00 C ATOM 687 CG PHE A 93 6.713 89.150 -18.944 1.00 0.00 C ATOM 688 CD1 PHE A 93 5.344 89.395 -18.783 1.00 0.00 C ATOM 689 CD2 PHE A 93 7.143 88.067 -19.724 1.00 0.00 C ATOM 690 CE1 PHE A 93 4.406 88.558 -19.402 1.00 0.00 C ATOM 691 CE2 PHE A 93 6.205 87.232 -20.341 1.00 0.00 C ATOM 692 CZ PHE A 93 4.837 87.477 -20.181 1.00 0.00 C ATOM 0 H PHE A 93 9.090 91.469 -16.738 1.00 0.00 H new ATOM 0 HA PHE A 93 6.709 89.929 -16.399 1.00 0.00 H new ATOM 0 HB2 PHE A 93 7.492 91.100 -18.496 1.00 0.00 H new ATOM 0 HB3 PHE A 93 8.721 89.865 -18.686 1.00 0.00 H new ATOM 0 HD1 PHE A 93 5.011 90.228 -18.182 1.00 0.00 H new ATOM 0 HD2 PHE A 93 8.199 87.877 -19.849 1.00 0.00 H new ATOM 0 HE1 PHE A 93 3.350 88.747 -19.278 1.00 0.00 H new ATOM 0 HE2 PHE A 93 6.537 86.398 -20.941 1.00 0.00 H new ATOM 0 HZ PHE A 93 4.113 86.833 -20.658 1.00 0.00 H new ATOM 702 N ARG A 94 9.561 88.277 -16.308 1.00 0.00 N ATOM 703 CA ARG A 94 10.156 86.943 -15.985 1.00 0.00 C ATOM 704 C ARG A 94 9.764 86.517 -14.567 1.00 0.00 C ATOM 705 O ARG A 94 9.372 85.366 -14.354 1.00 0.00 O ATOM 706 CB ARG A 94 11.685 87.021 -16.093 1.00 0.00 C ATOM 707 CG ARG A 94 12.124 87.135 -17.572 1.00 0.00 C ATOM 708 CD ARG A 94 12.529 85.761 -18.124 1.00 0.00 C ATOM 709 NE ARG A 94 13.177 85.915 -19.470 1.00 0.00 N ATOM 710 CZ ARG A 94 12.481 85.888 -20.599 1.00 0.00 C ATOM 711 NH1 ARG A 94 13.112 86.024 -21.733 1.00 0.00 N ATOM 712 NH2 ARG A 94 11.175 85.730 -20.611 1.00 0.00 N ATOM 0 H ARG A 94 10.239 89.031 -16.420 1.00 0.00 H new ATOM 0 HA ARG A 94 9.776 86.207 -16.694 1.00 0.00 H new ATOM 0 HB2 ARG A 94 12.051 87.882 -15.533 1.00 0.00 H new ATOM 0 HB3 ARG A 94 12.132 86.134 -15.643 1.00 0.00 H new ATOM 0 HG2 ARG A 94 11.309 87.546 -18.168 1.00 0.00 H new ATOM 0 HG3 ARG A 94 12.961 87.828 -17.656 1.00 0.00 H new ATOM 0 HD2 ARG A 94 13.217 85.272 -17.434 1.00 0.00 H new ATOM 0 HD3 ARG A 94 11.651 85.120 -18.206 1.00 0.00 H new ATOM 0 HE ARG A 94 14.188 86.045 -19.518 1.00 0.00 H new ATOM 0 HH11 ARG A 94 14.124 86.149 -21.742 1.00 0.00 H new ATOM 0 HH12 ARG A 94 12.593 86.006 -22.611 1.00 0.00 H new ATOM 0 HH21 ARG A 94 10.666 85.624 -19.733 1.00 0.00 H new ATOM 0 HH22 ARG A 94 10.671 85.714 -21.498 1.00 0.00 H new ATOM 726 N VAL A 95 9.875 87.407 -13.596 1.00 0.00 N ATOM 727 CA VAL A 95 9.518 87.036 -12.176 1.00 0.00 C ATOM 728 C VAL A 95 8.031 86.710 -12.096 1.00 0.00 C ATOM 729 O VAL A 95 7.639 85.678 -11.531 1.00 0.00 O ATOM 730 CB VAL A 95 9.805 88.187 -11.191 1.00 0.00 C ATOM 731 CG1 VAL A 95 9.718 87.659 -9.757 1.00 0.00 C ATOM 732 CG2 VAL A 95 11.203 88.770 -11.411 1.00 0.00 C ATOM 0 H VAL A 95 10.195 88.367 -13.724 1.00 0.00 H new ATOM 0 HA VAL A 95 10.129 86.176 -11.901 1.00 0.00 H new ATOM 0 HB VAL A 95 9.066 88.970 -11.361 1.00 0.00 H new ATOM 0 HG11 VAL A 95 9.920 88.470 -9.058 1.00 0.00 H new ATOM 0 HG12 VAL A 95 8.719 87.264 -9.575 1.00 0.00 H new ATOM 0 HG13 VAL A 95 10.453 86.866 -9.616 1.00 0.00 H new ATOM 0 HG21 VAL A 95 11.375 89.579 -10.702 1.00 0.00 H new ATOM 0 HG22 VAL A 95 11.950 87.991 -11.261 1.00 0.00 H new ATOM 0 HG23 VAL A 95 11.280 89.156 -12.427 1.00 0.00 H new ATOM 742 N ALA A 96 7.203 87.568 -12.645 1.00 0.00 N ATOM 743 CA ALA A 96 5.726 87.335 -12.610 1.00 0.00 C ATOM 744 C ALA A 96 5.399 86.095 -13.443 1.00 0.00 C ATOM 745 O ALA A 96 4.502 85.322 -13.094 1.00 0.00 O ATOM 746 CB ALA A 96 4.984 88.566 -13.154 1.00 0.00 C ATOM 0 H ALA A 96 7.491 88.425 -13.118 1.00 0.00 H new ATOM 0 HA ALA A 96 5.402 87.172 -11.582 1.00 0.00 H new ATOM 0 HB1 ALA A 96 3.909 88.386 -13.124 1.00 0.00 H new ATOM 0 HB2 ALA A 96 5.223 89.435 -12.541 1.00 0.00 H new ATOM 0 HB3 ALA A 96 5.292 88.751 -14.183 1.00 0.00 H new ATOM 752 N ALA A 97 6.114 85.895 -14.529 1.00 0.00 N ATOM 753 CA ALA A 97 5.874 84.710 -15.404 1.00 0.00 C ATOM 754 C ALA A 97 6.150 83.431 -14.620 1.00 0.00 C ATOM 755 O ALA A 97 5.447 82.434 -14.790 1.00 0.00 O ATOM 756 CB ALA A 97 6.788 84.764 -16.631 1.00 0.00 C ATOM 0 H ALA A 97 6.861 86.513 -14.845 1.00 0.00 H new ATOM 0 HA ALA A 97 4.835 84.720 -15.735 1.00 0.00 H new ATOM 0 HB1 ALA A 97 6.603 83.894 -17.261 1.00 0.00 H new ATOM 0 HB2 ALA A 97 6.583 85.672 -17.198 1.00 0.00 H new ATOM 0 HB3 ALA A 97 7.829 84.764 -16.309 1.00 0.00 H new ATOM 762 N ASP A 98 7.162 83.440 -13.779 1.00 0.00 N ATOM 763 CA ASP A 98 7.502 82.223 -12.978 1.00 0.00 C ATOM 764 C ASP A 98 6.358 81.910 -12.016 1.00 0.00 C ATOM 765 O ASP A 98 5.928 80.756 -11.907 1.00 0.00 O ATOM 766 CB ASP A 98 8.792 82.451 -12.185 1.00 0.00 C ATOM 767 CG ASP A 98 10.008 82.134 -13.053 1.00 0.00 C ATOM 768 OD1 ASP A 98 10.949 82.910 -13.024 1.00 0.00 O ATOM 769 OD2 ASP A 98 9.982 81.118 -13.731 1.00 0.00 O ATOM 0 H ASP A 98 7.768 84.244 -13.615 1.00 0.00 H new ATOM 0 HA ASP A 98 7.651 81.383 -13.657 1.00 0.00 H new ATOM 0 HB2 ASP A 98 8.840 83.485 -11.843 1.00 0.00 H new ATOM 0 HB3 ASP A 98 8.797 81.821 -11.296 1.00 0.00 H new ATOM 774 N MET A 99 5.862 82.910 -11.319 1.00 0.00 N ATOM 775 CA MET A 99 4.741 82.683 -10.350 1.00 0.00 C ATOM 776 C MET A 99 3.479 82.292 -11.111 1.00 0.00 C ATOM 777 O MET A 99 2.753 81.384 -10.691 1.00 0.00 O ATOM 778 CB MET A 99 4.483 83.953 -9.525 1.00 0.00 C ATOM 779 CG MET A 99 5.418 83.999 -8.307 1.00 0.00 C ATOM 780 SD MET A 99 7.144 84.131 -8.861 1.00 0.00 S ATOM 781 CE MET A 99 7.619 85.583 -7.887 1.00 0.00 C ATOM 0 H MET A 99 6.187 83.875 -11.381 1.00 0.00 H new ATOM 0 HA MET A 99 5.018 81.877 -9.670 1.00 0.00 H new ATOM 0 HB2 MET A 99 4.640 84.835 -10.145 1.00 0.00 H new ATOM 0 HB3 MET A 99 3.444 83.975 -9.195 1.00 0.00 H new ATOM 0 HG2 MET A 99 5.164 84.849 -7.674 1.00 0.00 H new ATOM 0 HG3 MET A 99 5.288 83.101 -7.703 1.00 0.00 H new ATOM 0 HE1 MET A 99 8.696 85.735 -7.962 1.00 0.00 H new ATOM 0 HE2 MET A 99 7.100 86.463 -8.268 1.00 0.00 H new ATOM 0 HE3 MET A 99 7.347 85.426 -6.843 1.00 0.00 H new ATOM 791 N PHE A 100 3.207 82.950 -12.214 1.00 0.00 N ATOM 792 CA PHE A 100 1.986 82.622 -13.019 1.00 0.00 C ATOM 793 C PHE A 100 2.174 81.263 -13.709 1.00 0.00 C ATOM 794 O PHE A 100 1.193 80.555 -13.960 1.00 0.00 O ATOM 795 CB PHE A 100 1.725 83.729 -14.057 1.00 0.00 C ATOM 796 CG PHE A 100 0.425 83.464 -14.788 1.00 0.00 C ATOM 797 CD1 PHE A 100 0.432 82.713 -15.968 1.00 0.00 C ATOM 798 CD2 PHE A 100 -0.779 83.971 -14.287 1.00 0.00 C ATOM 799 CE1 PHE A 100 -0.765 82.467 -16.649 1.00 0.00 C ATOM 800 CE2 PHE A 100 -1.979 83.725 -14.968 1.00 0.00 C ATOM 801 CZ PHE A 100 -1.971 82.973 -16.149 1.00 0.00 C ATOM 0 H PHE A 100 3.781 83.703 -12.593 1.00 0.00 H new ATOM 0 HA PHE A 100 1.121 82.562 -12.358 1.00 0.00 H new ATOM 0 HB2 PHE A 100 1.681 84.699 -13.562 1.00 0.00 H new ATOM 0 HB3 PHE A 100 2.549 83.772 -14.769 1.00 0.00 H new ATOM 0 HD1 PHE A 100 1.362 82.323 -16.354 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -0.784 84.551 -13.376 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -0.759 81.887 -17.560 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -2.909 84.115 -14.582 1.00 0.00 H new ATOM 0 HZ PHE A 100 -2.895 82.783 -16.674 1.00 0.00 H new ATOM 811 N SER A 101 3.400 80.893 -14.029 1.00 0.00 N ATOM 812 CA SER A 101 3.648 79.584 -14.715 1.00 0.00 C ATOM 813 C SER A 101 3.322 78.419 -13.776 1.00 0.00 C ATOM 814 O SER A 101 2.712 77.434 -14.209 1.00 0.00 O ATOM 815 CB SER A 101 5.105 79.488 -15.169 1.00 0.00 C ATOM 816 OG SER A 101 5.953 79.443 -14.031 1.00 0.00 O ATOM 0 H SER A 101 4.237 81.445 -13.842 1.00 0.00 H new ATOM 0 HA SER A 101 2.999 79.528 -15.589 1.00 0.00 H new ATOM 0 HB2 SER A 101 5.249 78.596 -15.779 1.00 0.00 H new ATOM 0 HB3 SER A 101 5.360 80.345 -15.792 1.00 0.00 H new ATOM 0 HG SER A 101 5.598 80.035 -13.335 1.00 0.00 H new ATOM 822 N ASP A 102 3.704 78.498 -12.512 1.00 0.00 N ATOM 823 CA ASP A 102 3.408 77.379 -11.557 1.00 0.00 C ATOM 824 C ASP A 102 2.230 77.734 -10.638 1.00 0.00 C ATOM 825 O ASP A 102 1.803 76.894 -9.838 1.00 0.00 O ATOM 826 CB ASP A 102 4.641 77.079 -10.703 1.00 0.00 C ATOM 827 CG ASP A 102 5.726 76.431 -11.555 1.00 0.00 C ATOM 828 OD1 ASP A 102 6.186 75.364 -11.182 1.00 0.00 O ATOM 829 OD2 ASP A 102 6.082 77.010 -12.569 1.00 0.00 O ATOM 0 H ASP A 102 4.206 79.288 -12.107 1.00 0.00 H new ATOM 0 HA ASP A 102 3.142 76.499 -12.143 1.00 0.00 H new ATOM 0 HB2 ASP A 102 5.018 78.001 -10.260 1.00 0.00 H new ATOM 0 HB3 ASP A 102 4.370 76.417 -9.880 1.00 0.00 H new ATOM 834 N GLY A 103 1.690 78.937 -10.733 1.00 0.00 N ATOM 835 CA GLY A 103 0.528 79.315 -9.861 1.00 0.00 C ATOM 836 C GLY A 103 1.001 79.628 -8.437 1.00 0.00 C ATOM 837 O GLY A 103 0.213 79.526 -7.489 1.00 0.00 O ATOM 0 H GLY A 103 2.005 79.665 -11.374 1.00 0.00 H new ATOM 0 HA2 GLY A 103 0.019 80.183 -10.280 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -0.197 78.501 -9.839 1.00 0.00 H new ATOM 841 N ASN A 104 2.260 79.980 -8.259 1.00 0.00 N ATOM 842 CA ASN A 104 2.789 80.269 -6.887 1.00 0.00 C ATOM 843 C ASN A 104 2.214 81.587 -6.376 1.00 0.00 C ATOM 844 O ASN A 104 1.753 82.424 -7.160 1.00 0.00 O ATOM 845 CB ASN A 104 4.318 80.352 -6.919 1.00 0.00 C ATOM 846 CG ASN A 104 4.914 78.975 -7.198 1.00 0.00 C ATOM 847 OD1 ASN A 104 5.710 78.820 -8.125 1.00 0.00 O ATOM 848 ND2 ASN A 104 4.581 77.958 -6.449 1.00 0.00 N ATOM 0 H ASN A 104 2.942 80.079 -9.011 1.00 0.00 H new ATOM 0 HA ASN A 104 2.490 79.462 -6.218 1.00 0.00 H new ATOM 0 HB2 ASN A 104 4.635 81.056 -7.688 1.00 0.00 H new ATOM 0 HB3 ASN A 104 4.689 80.731 -5.967 1.00 0.00 H new ATOM 0 HD21 ASN A 104 4.980 77.037 -6.632 1.00 0.00 H new ATOM 0 HD22 ASN A 104 3.922 78.085 -5.681 1.00 0.00 H new ATOM 855 N PHE A 105 2.230 81.775 -5.074 1.00 0.00 N ATOM 856 CA PHE A 105 1.676 83.035 -4.465 1.00 0.00 C ATOM 857 C PHE A 105 2.211 83.216 -3.032 1.00 0.00 C ATOM 858 O PHE A 105 3.049 84.090 -2.805 1.00 0.00 O ATOM 859 CB PHE A 105 0.131 82.980 -4.465 1.00 0.00 C ATOM 860 CG PHE A 105 -0.457 84.347 -4.760 1.00 0.00 C ATOM 861 CD1 PHE A 105 -0.752 85.231 -3.713 1.00 0.00 C ATOM 862 CD2 PHE A 105 -0.710 84.726 -6.085 1.00 0.00 C ATOM 863 CE1 PHE A 105 -1.297 86.490 -3.991 1.00 0.00 C ATOM 864 CE2 PHE A 105 -1.254 85.986 -6.362 1.00 0.00 C ATOM 865 CZ PHE A 105 -1.547 86.868 -5.315 1.00 0.00 C ATOM 0 H PHE A 105 2.605 81.106 -4.402 1.00 0.00 H new ATOM 0 HA PHE A 105 1.997 83.890 -5.060 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -0.212 82.263 -5.211 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -0.225 82.627 -3.497 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -0.559 84.941 -2.691 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -0.485 84.046 -6.893 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -1.525 87.170 -3.183 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -1.448 86.278 -7.384 1.00 0.00 H new ATOM 0 HZ PHE A 105 -1.966 87.840 -5.529 1.00 0.00 H new ATOM 875 N ASN A 106 1.736 82.424 -2.066 1.00 0.00 N ATOM 876 CA ASN A 106 2.189 82.526 -0.623 1.00 0.00 C ATOM 877 C ASN A 106 1.388 83.617 0.076 1.00 0.00 C ATOM 878 O ASN A 106 0.704 84.409 -0.581 1.00 0.00 O ATOM 879 CB ASN A 106 3.698 82.804 -0.489 1.00 0.00 C ATOM 880 CG ASN A 106 4.233 82.207 0.809 1.00 0.00 C ATOM 881 OD1 ASN A 106 3.819 82.608 1.897 1.00 0.00 O ATOM 882 ND2 ASN A 106 5.137 81.267 0.759 1.00 0.00 N ATOM 0 H ASN A 106 1.038 81.698 -2.229 1.00 0.00 H new ATOM 0 HA ASN A 106 2.009 81.561 -0.150 1.00 0.00 H new ATOM 0 HB2 ASN A 106 4.230 82.378 -1.340 1.00 0.00 H new ATOM 0 HB3 ASN A 106 3.880 83.879 -0.505 1.00 0.00 H new ATOM 0 HD21 ASN A 106 5.501 80.864 1.622 1.00 0.00 H new ATOM 0 HD22 ASN A 106 5.479 80.936 -0.143 1.00 0.00 H new ATOM 889 N TRP A 107 1.435 83.655 1.392 1.00 0.00 N ATOM 890 CA TRP A 107 0.649 84.672 2.159 1.00 0.00 C ATOM 891 C TRP A 107 1.566 85.775 2.689 1.00 0.00 C ATOM 892 O TRP A 107 2.594 85.509 3.318 1.00 0.00 O ATOM 893 CB TRP A 107 -0.082 83.988 3.324 1.00 0.00 C ATOM 894 CG TRP A 107 -1.236 84.828 3.783 1.00 0.00 C ATOM 895 CD1 TRP A 107 -1.444 85.231 5.058 1.00 0.00 C ATOM 896 CD2 TRP A 107 -2.341 85.368 3.000 1.00 0.00 C ATOM 897 NE1 TRP A 107 -2.606 85.979 5.107 1.00 0.00 N ATOM 898 CE2 TRP A 107 -3.193 86.095 3.863 1.00 0.00 C ATOM 899 CE3 TRP A 107 -2.684 85.298 1.636 1.00 0.00 C ATOM 900 CZ2 TRP A 107 -4.344 86.731 3.392 1.00 0.00 C ATOM 901 CZ3 TRP A 107 -3.840 85.937 1.159 1.00 0.00 C ATOM 902 CH2 TRP A 107 -4.668 86.652 2.035 1.00 0.00 C ATOM 0 H TRP A 107 1.988 83.020 1.967 1.00 0.00 H new ATOM 0 HA TRP A 107 -0.082 85.127 1.491 1.00 0.00 H new ATOM 0 HB2 TRP A 107 -0.440 83.007 3.011 1.00 0.00 H new ATOM 0 HB3 TRP A 107 0.610 83.826 4.151 1.00 0.00 H new ATOM 0 HD1 TRP A 107 -0.806 85.005 5.900 1.00 0.00 H new ATOM 0 HE1 TRP A 107 -2.983 86.394 5.959 1.00 0.00 H new ATOM 0 HE3 TRP A 107 -2.054 84.749 0.952 1.00 0.00 H new ATOM 0 HZ2 TRP A 107 -4.979 87.280 4.072 1.00 0.00 H new ATOM 0 HZ3 TRP A 107 -4.093 85.877 0.111 1.00 0.00 H new ATOM 0 HH2 TRP A 107 -5.555 87.141 1.662 1.00 0.00 H new ATOM 913 N GLY A 108 1.189 87.004 2.443 1.00 0.00 N ATOM 914 CA GLY A 108 1.980 88.193 2.908 1.00 0.00 C ATOM 915 C GLY A 108 3.082 88.560 1.901 1.00 0.00 C ATOM 916 O GLY A 108 3.843 89.505 2.133 1.00 0.00 O ATOM 0 H GLY A 108 0.343 87.243 1.925 1.00 0.00 H new ATOM 0 HA2 GLY A 108 1.313 89.044 3.047 1.00 0.00 H new ATOM 0 HA3 GLY A 108 2.428 87.977 3.878 1.00 0.00 H new ATOM 920 N ARG A 109 3.149 87.877 0.776 1.00 0.00 N ATOM 921 CA ARG A 109 4.158 88.214 -0.282 1.00 0.00 C ATOM 922 C ARG A 109 3.524 89.200 -1.276 1.00 0.00 C ATOM 923 O ARG A 109 4.212 90.015 -1.900 1.00 0.00 O ATOM 924 CB ARG A 109 4.615 86.930 -0.991 1.00 0.00 C ATOM 925 CG ARG A 109 5.632 86.171 -0.097 1.00 0.00 C ATOM 926 CD ARG A 109 7.088 86.561 -0.425 1.00 0.00 C ATOM 927 NE ARG A 109 7.234 88.038 -0.688 1.00 0.00 N ATOM 928 CZ ARG A 109 7.415 88.527 -1.909 1.00 0.00 C ATOM 929 NH1 ARG A 109 7.611 89.806 -2.049 1.00 0.00 N ATOM 930 NH2 ARG A 109 7.381 87.771 -2.986 1.00 0.00 N ATOM 0 H ARG A 109 2.539 87.092 0.546 1.00 0.00 H new ATOM 0 HA ARG A 109 5.035 88.680 0.167 1.00 0.00 H new ATOM 0 HB2 ARG A 109 3.755 86.294 -1.201 1.00 0.00 H new ATOM 0 HB3 ARG A 109 5.072 87.176 -1.950 1.00 0.00 H new ATOM 0 HG2 ARG A 109 5.426 86.387 0.951 1.00 0.00 H new ATOM 0 HG3 ARG A 109 5.504 85.097 -0.233 1.00 0.00 H new ATOM 0 HD2 ARG A 109 7.735 86.275 0.404 1.00 0.00 H new ATOM 0 HD3 ARG A 109 7.424 86.003 -1.299 1.00 0.00 H new ATOM 0 HE ARG A 109 7.192 88.685 0.100 1.00 0.00 H new ATOM 0 HH11 ARG A 109 7.623 90.413 -1.229 1.00 0.00 H new ATOM 0 HH12 ARG A 109 7.752 90.202 -2.979 1.00 0.00 H new ATOM 0 HH21 ARG A 109 7.210 86.769 -2.901 1.00 0.00 H new ATOM 0 HH22 ARG A 109 7.525 88.187 -3.906 1.00 0.00 H new ATOM 944 N VAL A 110 2.218 89.132 -1.411 1.00 0.00 N ATOM 945 CA VAL A 110 1.459 90.029 -2.329 1.00 0.00 C ATOM 946 C VAL A 110 1.692 91.494 -1.933 1.00 0.00 C ATOM 947 O VAL A 110 1.737 92.373 -2.795 1.00 0.00 O ATOM 948 CB VAL A 110 -0.037 89.655 -2.293 1.00 0.00 C ATOM 949 CG1 VAL A 110 -0.626 89.887 -0.895 1.00 0.00 C ATOM 950 CG2 VAL A 110 -0.809 90.489 -3.319 1.00 0.00 C ATOM 0 H VAL A 110 1.634 88.468 -0.903 1.00 0.00 H new ATOM 0 HA VAL A 110 1.812 89.903 -3.353 1.00 0.00 H new ATOM 0 HB VAL A 110 -0.129 88.597 -2.538 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -1.682 89.616 -0.895 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.094 89.272 -0.169 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.521 90.938 -0.626 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -1.865 90.219 -3.287 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -0.698 91.548 -3.085 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -0.415 90.295 -4.316 1.00 0.00 H new ATOM 960 N VAL A 111 1.813 91.766 -0.653 1.00 0.00 N ATOM 961 CA VAL A 111 2.017 93.173 -0.172 1.00 0.00 C ATOM 962 C VAL A 111 3.251 93.773 -0.846 1.00 0.00 C ATOM 963 O VAL A 111 3.204 94.909 -1.325 1.00 0.00 O ATOM 964 CB VAL A 111 2.220 93.167 1.363 1.00 0.00 C ATOM 965 CG1 VAL A 111 2.435 94.600 1.888 1.00 0.00 C ATOM 966 CG2 VAL A 111 0.996 92.547 2.068 1.00 0.00 C ATOM 0 H VAL A 111 1.779 91.065 0.087 1.00 0.00 H new ATOM 0 HA VAL A 111 1.142 93.772 -0.423 1.00 0.00 H new ATOM 0 HB VAL A 111 3.104 92.568 1.581 1.00 0.00 H new ATOM 0 HG11 VAL A 111 2.576 94.574 2.969 1.00 0.00 H new ATOM 0 HG12 VAL A 111 3.318 95.031 1.417 1.00 0.00 H new ATOM 0 HG13 VAL A 111 1.563 95.209 1.650 1.00 0.00 H new ATOM 0 HG21 VAL A 111 1.156 92.551 3.146 1.00 0.00 H new ATOM 0 HG22 VAL A 111 0.106 93.130 1.831 1.00 0.00 H new ATOM 0 HG23 VAL A 111 0.860 91.521 1.725 1.00 0.00 H new ATOM 976 N ALA A 112 4.345 93.057 -0.863 1.00 0.00 N ATOM 977 CA ALA A 112 5.605 93.598 -1.469 1.00 0.00 C ATOM 978 C ALA A 112 5.505 93.689 -2.997 1.00 0.00 C ATOM 979 O ALA A 112 5.927 94.691 -3.585 1.00 0.00 O ATOM 980 CB ALA A 112 6.795 92.714 -1.075 1.00 0.00 C ATOM 0 H ALA A 112 4.423 92.114 -0.481 1.00 0.00 H new ATOM 0 HA ALA A 112 5.754 94.607 -1.084 1.00 0.00 H new ATOM 0 HB1 ALA A 112 7.707 93.113 -1.519 1.00 0.00 H new ATOM 0 HB2 ALA A 112 6.895 92.701 0.010 1.00 0.00 H new ATOM 0 HB3 ALA A 112 6.630 91.699 -1.436 1.00 0.00 H new ATOM 986 N LEU A 113 4.999 92.664 -3.649 1.00 0.00 N ATOM 987 CA LEU A 113 4.915 92.677 -5.151 1.00 0.00 C ATOM 988 C LEU A 113 3.832 93.622 -5.644 1.00 0.00 C ATOM 989 O LEU A 113 3.995 94.220 -6.711 1.00 0.00 O ATOM 990 CB LEU A 113 4.663 91.260 -5.691 1.00 0.00 C ATOM 991 CG LEU A 113 5.077 91.178 -7.174 1.00 0.00 C ATOM 992 CD1 LEU A 113 6.602 91.054 -7.282 1.00 0.00 C ATOM 993 CD2 LEU A 113 4.424 89.952 -7.827 1.00 0.00 C ATOM 0 H LEU A 113 4.640 91.818 -3.206 1.00 0.00 H new ATOM 0 HA LEU A 113 5.873 93.037 -5.527 1.00 0.00 H new ATOM 0 HB2 LEU A 113 5.228 90.534 -5.107 1.00 0.00 H new ATOM 0 HB3 LEU A 113 3.609 91.004 -5.585 1.00 0.00 H new ATOM 0 HG LEU A 113 4.748 92.083 -7.684 1.00 0.00 H new ATOM 0 HD11 LEU A 113 6.889 90.996 -8.332 1.00 0.00 H new ATOM 0 HD12 LEU A 113 7.071 91.925 -6.825 1.00 0.00 H new ATOM 0 HD13 LEU A 113 6.931 90.152 -6.766 1.00 0.00 H new ATOM 0 HD21 LEU A 113 4.719 89.898 -8.875 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.749 89.049 -7.311 1.00 0.00 H new ATOM 0 HD23 LEU A 113 3.340 90.038 -7.759 1.00 0.00 H new ATOM 1005 N PHE A 114 2.742 93.769 -4.931 1.00 0.00 N ATOM 1006 CA PHE A 114 1.668 94.690 -5.417 1.00 0.00 C ATOM 1007 C PHE A 114 2.149 96.128 -5.254 1.00 0.00 C ATOM 1008 O PHE A 114 2.039 96.931 -6.187 1.00 0.00 O ATOM 1009 CB PHE A 114 0.352 94.478 -4.641 1.00 0.00 C ATOM 1010 CG PHE A 114 -0.856 94.720 -5.548 1.00 0.00 C ATOM 1011 CD1 PHE A 114 -1.828 93.721 -5.700 1.00 0.00 C ATOM 1012 CD2 PHE A 114 -1.001 95.941 -6.236 1.00 0.00 C ATOM 1013 CE1 PHE A 114 -2.936 93.937 -6.530 1.00 0.00 C ATOM 1014 CE2 PHE A 114 -2.109 96.153 -7.065 1.00 0.00 C ATOM 1015 CZ PHE A 114 -3.075 95.153 -7.211 1.00 0.00 C ATOM 0 H PHE A 114 2.551 93.299 -4.046 1.00 0.00 H new ATOM 0 HA PHE A 114 1.466 94.477 -6.467 1.00 0.00 H new ATOM 0 HB2 PHE A 114 0.318 93.463 -4.244 1.00 0.00 H new ATOM 0 HB3 PHE A 114 0.314 95.155 -3.788 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -1.722 92.783 -5.176 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -0.256 96.715 -6.124 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -3.683 93.166 -6.645 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -2.218 97.089 -7.592 1.00 0.00 H new ATOM 0 HZ PHE A 114 -3.930 95.318 -7.850 1.00 0.00 H new ATOM 1025 N TYR A 115 2.686 96.467 -4.100 1.00 0.00 N ATOM 1026 CA TYR A 115 3.189 97.864 -3.877 1.00 0.00 C ATOM 1027 C TYR A 115 4.366 98.135 -4.845 1.00 0.00 C ATOM 1028 O TYR A 115 4.417 99.200 -5.471 1.00 0.00 O ATOM 1029 CB TYR A 115 3.559 98.041 -2.369 1.00 0.00 C ATOM 1030 CG TYR A 115 4.960 98.586 -2.144 1.00 0.00 C ATOM 1031 CD1 TYR A 115 5.180 99.968 -2.125 1.00 0.00 C ATOM 1032 CD2 TYR A 115 6.029 97.704 -1.957 1.00 0.00 C ATOM 1033 CE1 TYR A 115 6.471 100.467 -1.917 1.00 0.00 C ATOM 1034 CE2 TYR A 115 7.317 98.200 -1.751 1.00 0.00 C ATOM 1035 CZ TYR A 115 7.541 99.582 -1.730 1.00 0.00 C ATOM 1036 OH TYR A 115 8.812 100.073 -1.521 1.00 0.00 O ATOM 0 H TYR A 115 2.797 95.837 -3.306 1.00 0.00 H new ATOM 0 HA TYR A 115 2.423 98.607 -4.098 1.00 0.00 H new ATOM 0 HB2 TYR A 115 2.838 98.713 -1.904 1.00 0.00 H new ATOM 0 HB3 TYR A 115 3.468 97.078 -1.866 1.00 0.00 H new ATOM 0 HD1 TYR A 115 4.354 100.649 -2.271 1.00 0.00 H new ATOM 0 HD2 TYR A 115 5.858 96.638 -1.972 1.00 0.00 H new ATOM 0 HE1 TYR A 115 6.642 101.533 -1.901 1.00 0.00 H new ATOM 0 HE2 TYR A 115 8.142 97.517 -1.608 1.00 0.00 H new ATOM 0 HH TYR A 115 8.758 101.006 -1.226 1.00 0.00 H new ATOM 1046 N PHE A 116 5.290 97.200 -4.984 1.00 0.00 N ATOM 1047 CA PHE A 116 6.448 97.398 -5.913 1.00 0.00 C ATOM 1048 C PHE A 116 5.914 97.463 -7.343 1.00 0.00 C ATOM 1049 O PHE A 116 6.280 98.362 -8.108 1.00 0.00 O ATOM 1050 CB PHE A 116 7.467 96.239 -5.739 1.00 0.00 C ATOM 1051 CG PHE A 116 8.549 96.229 -6.829 1.00 0.00 C ATOM 1052 CD1 PHE A 116 8.907 95.013 -7.432 1.00 0.00 C ATOM 1053 CD2 PHE A 116 9.192 97.417 -7.229 1.00 0.00 C ATOM 1054 CE1 PHE A 116 9.895 94.984 -8.424 1.00 0.00 C ATOM 1055 CE2 PHE A 116 10.177 97.382 -8.223 1.00 0.00 C ATOM 1056 CZ PHE A 116 10.528 96.167 -8.820 1.00 0.00 C ATOM 0 H PHE A 116 5.286 96.308 -4.489 1.00 0.00 H new ATOM 0 HA PHE A 116 6.968 98.329 -5.686 1.00 0.00 H new ATOM 0 HB2 PHE A 116 7.943 96.323 -4.762 1.00 0.00 H new ATOM 0 HB3 PHE A 116 6.935 95.288 -5.753 1.00 0.00 H new ATOM 0 HD1 PHE A 116 8.419 94.098 -7.130 1.00 0.00 H new ATOM 0 HD2 PHE A 116 8.925 98.356 -6.768 1.00 0.00 H new ATOM 0 HE1 PHE A 116 10.169 94.046 -8.884 1.00 0.00 H new ATOM 0 HE2 PHE A 116 10.667 98.295 -8.529 1.00 0.00 H new ATOM 0 HZ PHE A 116 11.288 96.142 -9.587 1.00 0.00 H new ATOM 1066 N ALA A 117 5.056 96.540 -7.703 1.00 0.00 N ATOM 1067 CA ALA A 117 4.469 96.532 -9.080 1.00 0.00 C ATOM 1068 C ALA A 117 3.752 97.852 -9.318 1.00 0.00 C ATOM 1069 O ALA A 117 3.793 98.405 -10.423 1.00 0.00 O ATOM 1070 CB ALA A 117 3.464 95.386 -9.221 1.00 0.00 C ATOM 0 H ALA A 117 4.734 95.785 -7.097 1.00 0.00 H new ATOM 0 HA ALA A 117 5.268 96.397 -9.809 1.00 0.00 H new ATOM 0 HB1 ALA A 117 3.045 95.392 -10.227 1.00 0.00 H new ATOM 0 HB2 ALA A 117 3.968 94.436 -9.043 1.00 0.00 H new ATOM 0 HB3 ALA A 117 2.663 95.513 -8.493 1.00 0.00 H new ATOM 1076 N SER A 118 3.094 98.357 -8.300 1.00 0.00 N ATOM 1077 CA SER A 118 2.351 99.644 -8.430 1.00 0.00 C ATOM 1078 C SER A 118 3.338 100.795 -8.619 1.00 0.00 C ATOM 1079 O SER A 118 3.136 101.669 -9.469 1.00 0.00 O ATOM 1080 CB SER A 118 1.512 99.893 -7.179 1.00 0.00 C ATOM 1081 OG SER A 118 0.693 101.032 -7.393 1.00 0.00 O ATOM 0 H SER A 118 3.042 97.925 -7.377 1.00 0.00 H new ATOM 0 HA SER A 118 1.693 99.585 -9.297 1.00 0.00 H new ATOM 0 HB2 SER A 118 0.895 99.021 -6.959 1.00 0.00 H new ATOM 0 HB3 SER A 118 2.159 100.051 -6.316 1.00 0.00 H new ATOM 0 HG SER A 118 0.184 101.226 -6.579 1.00 0.00 H new ATOM 1087 N LYS A 119 4.391 100.817 -7.833 1.00 0.00 N ATOM 1088 CA LYS A 119 5.405 101.913 -7.929 1.00 0.00 C ATOM 1089 C LYS A 119 6.171 101.829 -9.247 1.00 0.00 C ATOM 1090 O LYS A 119 6.574 102.862 -9.795 1.00 0.00 O ATOM 1091 CB LYS A 119 6.402 101.813 -6.768 1.00 0.00 C ATOM 1092 CG LYS A 119 7.203 103.126 -6.649 1.00 0.00 C ATOM 1093 CD LYS A 119 8.567 102.856 -5.986 1.00 0.00 C ATOM 1094 CE LYS A 119 8.418 102.687 -4.460 1.00 0.00 C ATOM 1095 NZ LYS A 119 8.991 101.374 -4.050 1.00 0.00 N ATOM 0 H LYS A 119 4.591 100.113 -7.122 1.00 0.00 H new ATOM 0 HA LYS A 119 4.876 102.865 -7.882 1.00 0.00 H new ATOM 0 HB2 LYS A 119 5.871 101.615 -5.837 1.00 0.00 H new ATOM 0 HB3 LYS A 119 7.081 100.976 -6.931 1.00 0.00 H new ATOM 0 HG2 LYS A 119 7.350 103.562 -7.637 1.00 0.00 H new ATOM 0 HG3 LYS A 119 6.641 103.852 -6.061 1.00 0.00 H new ATOM 0 HD2 LYS A 119 9.011 101.957 -6.413 1.00 0.00 H new ATOM 0 HD3 LYS A 119 9.248 103.680 -6.199 1.00 0.00 H new ATOM 0 HE2 LYS A 119 8.930 103.498 -3.941 1.00 0.00 H new ATOM 0 HE3 LYS A 119 7.367 102.742 -4.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 8.594 101.094 -3.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 8.755 100.655 -4.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 10.025 101.456 -3.970 1.00 0.00 H new ATOM 1109 N LEU A 120 6.412 100.636 -9.746 1.00 0.00 N ATOM 1110 CA LEU A 120 7.194 100.489 -11.014 1.00 0.00 C ATOM 1111 C LEU A 120 6.375 100.953 -12.212 1.00 0.00 C ATOM 1112 O LEU A 120 6.911 101.631 -13.097 1.00 0.00 O ATOM 1113 CB LEU A 120 7.651 99.035 -11.198 1.00 0.00 C ATOM 1114 CG LEU A 120 8.710 98.957 -12.309 1.00 0.00 C ATOM 1115 CD1 LEU A 120 10.060 99.479 -11.788 1.00 0.00 C ATOM 1116 CD2 LEU A 120 8.877 97.500 -12.759 1.00 0.00 C ATOM 0 H LEU A 120 6.100 99.760 -9.328 1.00 0.00 H new ATOM 0 HA LEU A 120 8.079 101.121 -10.945 1.00 0.00 H new ATOM 0 HB2 LEU A 120 8.062 98.653 -10.264 1.00 0.00 H new ATOM 0 HB3 LEU A 120 6.798 98.406 -11.452 1.00 0.00 H new ATOM 0 HG LEU A 120 8.385 99.570 -13.150 1.00 0.00 H new ATOM 0 HD11 LEU A 120 10.804 99.420 -12.582 1.00 0.00 H new ATOM 0 HD12 LEU A 120 9.951 100.516 -11.470 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.383 98.872 -10.942 1.00 0.00 H new ATOM 0 HD21 LEU A 120 9.628 97.446 -13.547 1.00 0.00 H new ATOM 0 HD22 LEU A 120 9.195 96.892 -11.912 1.00 0.00 H new ATOM 0 HD23 LEU A 120 7.926 97.125 -13.138 1.00 0.00 H new ATOM 1128 N VAL A 121 5.104 100.617 -12.269 1.00 0.00 N ATOM 1129 CA VAL A 121 4.267 101.061 -13.430 1.00 0.00 C ATOM 1130 C VAL A 121 4.134 102.586 -13.393 1.00 0.00 C ATOM 1131 O VAL A 121 4.139 103.233 -14.447 1.00 0.00 O ATOM 1132 CB VAL A 121 2.892 100.374 -13.440 1.00 0.00 C ATOM 1133 CG1 VAL A 121 3.085 98.863 -13.583 1.00 0.00 C ATOM 1134 CG2 VAL A 121 2.138 100.655 -12.144 1.00 0.00 C ATOM 0 H VAL A 121 4.616 100.060 -11.568 1.00 0.00 H new ATOM 0 HA VAL A 121 4.761 100.766 -14.356 1.00 0.00 H new ATOM 0 HB VAL A 121 2.314 100.765 -14.277 1.00 0.00 H new ATOM 0 HG11 VAL A 121 2.112 98.371 -13.591 1.00 0.00 H new ATOM 0 HG12 VAL A 121 3.607 98.650 -14.516 1.00 0.00 H new ATOM 0 HG13 VAL A 121 3.673 98.490 -12.745 1.00 0.00 H new ATOM 0 HG21 VAL A 121 1.168 100.159 -12.173 1.00 0.00 H new ATOM 0 HG22 VAL A 121 2.714 100.277 -11.299 1.00 0.00 H new ATOM 0 HG23 VAL A 121 1.993 101.730 -12.033 1.00 0.00 H new ATOM 1144 N LEU A 122 4.052 103.177 -12.212 1.00 0.00 N ATOM 1145 CA LEU A 122 3.958 104.672 -12.114 1.00 0.00 C ATOM 1146 C LEU A 122 5.271 105.270 -12.621 1.00 0.00 C ATOM 1147 O LEU A 122 5.266 106.275 -13.343 1.00 0.00 O ATOM 1148 CB LEU A 122 3.704 105.110 -10.654 1.00 0.00 C ATOM 1149 CG LEU A 122 2.217 105.441 -10.433 1.00 0.00 C ATOM 1150 CD1 LEU A 122 1.398 104.152 -10.362 1.00 0.00 C ATOM 1151 CD2 LEU A 122 2.054 106.218 -9.123 1.00 0.00 C ATOM 0 H LEU A 122 4.047 102.686 -11.318 1.00 0.00 H new ATOM 0 HA LEU A 122 3.123 105.027 -12.718 1.00 0.00 H new ATOM 0 HB2 LEU A 122 4.009 104.316 -9.973 1.00 0.00 H new ATOM 0 HB3 LEU A 122 4.314 105.982 -10.420 1.00 0.00 H new ATOM 0 HG LEU A 122 1.861 106.047 -11.266 1.00 0.00 H new ATOM 0 HD11 LEU A 122 0.347 104.397 -10.205 1.00 0.00 H new ATOM 0 HD12 LEU A 122 1.507 103.600 -11.295 1.00 0.00 H new ATOM 0 HD13 LEU A 122 1.755 103.539 -9.534 1.00 0.00 H new ATOM 0 HD21 LEU A 122 1.001 106.452 -8.967 1.00 0.00 H new ATOM 0 HD22 LEU A 122 2.418 105.612 -8.293 1.00 0.00 H new ATOM 0 HD23 LEU A 122 2.627 107.144 -9.175 1.00 0.00 H new ATOM 1163 N LYS A 123 6.390 104.663 -12.275 1.00 0.00 N ATOM 1164 CA LYS A 123 7.719 105.171 -12.747 1.00 0.00 C ATOM 1165 C LYS A 123 7.704 105.181 -14.271 1.00 0.00 C ATOM 1166 O LYS A 123 8.086 106.171 -14.904 1.00 0.00 O ATOM 1167 CB LYS A 123 8.841 104.247 -12.243 1.00 0.00 C ATOM 1168 CG LYS A 123 10.186 104.992 -12.223 1.00 0.00 C ATOM 1169 CD LYS A 123 10.768 105.063 -13.639 1.00 0.00 C ATOM 1170 CE LYS A 123 12.233 105.503 -13.572 1.00 0.00 C ATOM 1171 NZ LYS A 123 13.069 104.411 -12.990 1.00 0.00 N ATOM 0 H LYS A 123 6.435 103.834 -11.683 1.00 0.00 H new ATOM 0 HA LYS A 123 7.899 106.175 -12.362 1.00 0.00 H new ATOM 0 HB2 LYS A 123 8.602 103.889 -11.242 1.00 0.00 H new ATOM 0 HB3 LYS A 123 8.914 103.370 -12.886 1.00 0.00 H new ATOM 0 HG2 LYS A 123 10.048 105.998 -11.827 1.00 0.00 H new ATOM 0 HG3 LYS A 123 10.884 104.481 -11.559 1.00 0.00 H new ATOM 0 HD2 LYS A 123 10.692 104.089 -14.123 1.00 0.00 H new ATOM 0 HD3 LYS A 123 10.194 105.765 -14.244 1.00 0.00 H new ATOM 0 HE2 LYS A 123 12.592 105.754 -14.570 1.00 0.00 H new ATOM 0 HE3 LYS A 123 12.323 106.404 -12.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 14.057 104.532 -13.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 13.017 104.450 -11.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 12.716 103.490 -13.320 1.00 0.00 H new ATOM 1185 N ALA A 124 7.236 104.108 -14.861 1.00 0.00 N ATOM 1186 CA ALA A 124 7.148 104.023 -16.350 1.00 0.00 C ATOM 1187 C ALA A 124 6.064 104.983 -16.860 1.00 0.00 C ATOM 1188 O ALA A 124 6.102 105.413 -18.018 1.00 0.00 O ATOM 1189 CB ALA A 124 6.818 102.592 -16.767 1.00 0.00 C ATOM 0 H ALA A 124 6.908 103.278 -14.367 1.00 0.00 H new ATOM 0 HA ALA A 124 8.107 104.306 -16.784 1.00 0.00 H new ATOM 0 HB1 ALA A 124 6.755 102.535 -17.854 1.00 0.00 H new ATOM 0 HB2 ALA A 124 7.600 101.920 -16.413 1.00 0.00 H new ATOM 0 HB3 ALA A 124 5.863 102.297 -16.332 1.00 0.00 H new ATOM 1195 N LEU A 125 5.111 105.332 -16.016 1.00 0.00 N ATOM 1196 CA LEU A 125 4.020 106.275 -16.420 1.00 0.00 C ATOM 1197 C LEU A 125 4.586 107.700 -16.511 1.00 0.00 C ATOM 1198 O LEU A 125 4.043 108.547 -17.228 1.00 0.00 O ATOM 1199 CB LEU A 125 2.884 106.214 -15.383 1.00 0.00 C ATOM 1200 CG LEU A 125 1.712 107.107 -15.814 1.00 0.00 C ATOM 1201 CD1 LEU A 125 0.942 106.442 -16.960 1.00 0.00 C ATOM 1202 CD2 LEU A 125 0.768 107.327 -14.625 1.00 0.00 C ATOM 0 H LEU A 125 5.047 104.997 -15.055 1.00 0.00 H new ATOM 0 HA LEU A 125 3.624 105.990 -17.395 1.00 0.00 H new ATOM 0 HB2 LEU A 125 2.542 105.185 -15.270 1.00 0.00 H new ATOM 0 HB3 LEU A 125 3.255 106.536 -14.410 1.00 0.00 H new ATOM 0 HG LEU A 125 2.102 108.067 -16.153 1.00 0.00 H new ATOM 0 HD11 LEU A 125 0.112 107.082 -17.260 1.00 0.00 H new ATOM 0 HD12 LEU A 125 1.610 106.292 -17.808 1.00 0.00 H new ATOM 0 HD13 LEU A 125 0.556 105.478 -16.628 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -0.063 107.961 -14.933 1.00 0.00 H new ATOM 0 HD22 LEU A 125 0.384 106.366 -14.283 1.00 0.00 H new ATOM 0 HD23 LEU A 125 1.312 107.810 -13.813 1.00 0.00 H new ATOM 1214 N SER A 126 5.663 107.973 -15.805 1.00 0.00 N ATOM 1215 CA SER A 126 6.288 109.331 -15.827 1.00 0.00 C ATOM 1216 C SER A 126 7.173 109.504 -17.076 1.00 0.00 C ATOM 1217 O SER A 126 8.117 110.304 -17.068 1.00 0.00 O ATOM 1218 CB SER A 126 7.122 109.539 -14.560 1.00 0.00 C ATOM 1219 OG SER A 126 6.278 110.007 -13.516 1.00 0.00 O ATOM 0 H SER A 126 6.139 107.298 -15.206 1.00 0.00 H new ATOM 0 HA SER A 126 5.495 110.078 -15.863 1.00 0.00 H new ATOM 0 HB2 SER A 126 7.599 108.604 -14.267 1.00 0.00 H new ATOM 0 HB3 SER A 126 7.919 110.258 -14.749 1.00 0.00 H new ATOM 0 HG SER A 126 6.807 110.140 -12.702 1.00 0.00 H new ATOM 1225 N THR A 127 6.883 108.789 -18.145 1.00 0.00 N ATOM 1226 CA THR A 127 7.680 108.907 -19.401 1.00 0.00 C ATOM 1227 C THR A 127 7.143 110.101 -20.180 1.00 0.00 C ATOM 1228 O THR A 127 6.689 109.990 -21.325 1.00 0.00 O ATOM 1229 CB THR A 127 7.571 107.612 -20.222 1.00 0.00 C ATOM 1230 OG1 THR A 127 6.248 107.103 -20.126 1.00 0.00 O ATOM 1231 CG2 THR A 127 8.558 106.578 -19.680 1.00 0.00 C ATOM 0 H THR A 127 6.114 108.120 -18.193 1.00 0.00 H new ATOM 0 HA THR A 127 8.736 109.059 -19.176 1.00 0.00 H new ATOM 0 HB THR A 127 7.805 107.822 -21.266 1.00 0.00 H new ATOM 0 HG1 THR A 127 6.218 106.395 -19.449 1.00 0.00 H new ATOM 0 HG21 THR A 127 8.480 105.660 -20.263 1.00 0.00 H new ATOM 0 HG22 THR A 127 9.573 106.970 -19.754 1.00 0.00 H new ATOM 0 HG23 THR A 127 8.326 106.366 -18.636 1.00 0.00 H new ATOM 1239 N LYS A 128 7.182 111.240 -19.540 1.00 0.00 N ATOM 1240 CA LYS A 128 6.685 112.531 -20.134 1.00 0.00 C ATOM 1241 C LYS A 128 7.032 112.631 -21.623 1.00 0.00 C ATOM 1242 O LYS A 128 6.173 112.975 -22.440 1.00 0.00 O ATOM 1243 CB LYS A 128 7.328 113.707 -19.388 1.00 0.00 C ATOM 1244 CG LYS A 128 6.612 115.024 -19.741 1.00 0.00 C ATOM 1245 CD LYS A 128 7.553 116.212 -19.483 1.00 0.00 C ATOM 1246 CE LYS A 128 7.689 116.467 -17.975 1.00 0.00 C ATOM 1247 NZ LYS A 128 6.525 117.264 -17.496 1.00 0.00 N ATOM 0 H LYS A 128 7.551 111.338 -18.594 1.00 0.00 H new ATOM 0 HA LYS A 128 5.600 112.559 -20.033 1.00 0.00 H new ATOM 0 HB2 LYS A 128 7.277 113.535 -18.313 1.00 0.00 H new ATOM 0 HB3 LYS A 128 8.384 113.778 -19.650 1.00 0.00 H new ATOM 0 HG2 LYS A 128 6.304 115.012 -20.786 1.00 0.00 H new ATOM 0 HG3 LYS A 128 5.707 115.128 -19.143 1.00 0.00 H new ATOM 0 HD2 LYS A 128 8.533 116.008 -19.914 1.00 0.00 H new ATOM 0 HD3 LYS A 128 7.167 117.104 -19.976 1.00 0.00 H new ATOM 0 HE2 LYS A 128 7.739 115.519 -17.439 1.00 0.00 H new ATOM 0 HE3 LYS A 128 8.617 117.000 -17.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 6.619 117.436 -16.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 6.497 118.174 -17.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 5.646 116.739 -17.680 1.00 0.00 H new TER 1261 LYS A 128 ATOM 1262 N GLY B 48 10.917 72.213 -4.362 1.00 0.00 N ATOM 1263 CA GLY B 48 12.140 71.375 -4.195 1.00 0.00 C ATOM 1264 C GLY B 48 13.306 72.009 -4.974 1.00 0.00 C ATOM 1265 O GLY B 48 13.237 73.194 -5.311 1.00 0.00 O ATOM 0 HA2 GLY B 48 12.396 71.293 -3.139 1.00 0.00 H new ATOM 0 HA3 GLY B 48 11.953 70.364 -4.557 1.00 0.00 H new ATOM 1271 N PRO B 49 14.374 71.264 -5.268 1.00 0.00 N ATOM 1272 CA PRO B 49 15.548 71.812 -6.019 1.00 0.00 C ATOM 1273 C PRO B 49 15.283 71.909 -7.520 1.00 0.00 C ATOM 1274 O PRO B 49 14.382 71.244 -8.044 1.00 0.00 O ATOM 1275 CB PRO B 49 16.661 70.809 -5.723 1.00 0.00 C ATOM 1276 CG PRO B 49 15.966 69.506 -5.513 1.00 0.00 C ATOM 1277 CD PRO B 49 14.591 69.833 -4.926 1.00 0.00 C ATOM 0 HA PRO B 49 15.791 72.830 -5.714 1.00 0.00 H new ATOM 0 HB2 PRO B 49 17.368 70.750 -6.550 1.00 0.00 H new ATOM 0 HB3 PRO B 49 17.229 71.100 -4.839 1.00 0.00 H new ATOM 0 HG2 PRO B 49 15.867 68.964 -6.453 1.00 0.00 H new ATOM 0 HG3 PRO B 49 16.535 68.868 -4.836 1.00 0.00 H new ATOM 0 HD2 PRO B 49 13.815 69.200 -5.355 1.00 0.00 H new ATOM 0 HD3 PRO B 49 14.571 69.675 -3.848 1.00 0.00 H new ATOM 1285 N GLY B 50 16.050 72.722 -8.216 1.00 0.00 N ATOM 1286 CA GLY B 50 15.865 72.884 -9.692 1.00 0.00 C ATOM 1287 C GLY B 50 16.557 74.163 -10.155 1.00 0.00 C ATOM 1288 O GLY B 50 16.466 75.199 -9.488 1.00 0.00 O ATOM 0 H GLY B 50 16.802 73.284 -7.817 1.00 0.00 H new ATOM 0 HA2 GLY B 50 16.279 72.023 -10.218 1.00 0.00 H new ATOM 0 HA3 GLY B 50 14.803 72.925 -9.934 1.00 0.00 H new ATOM 1292 N SER B 51 17.245 74.110 -11.276 1.00 0.00 N ATOM 1293 CA SER B 51 17.955 75.319 -11.799 1.00 0.00 C ATOM 1294 C SER B 51 17.080 76.012 -12.838 1.00 0.00 C ATOM 1295 O SER B 51 16.193 75.389 -13.429 1.00 0.00 O ATOM 1296 CB SER B 51 19.289 74.916 -12.432 1.00 0.00 C ATOM 1297 OG SER B 51 20.233 74.640 -11.405 1.00 0.00 O ATOM 0 H SER B 51 17.343 73.274 -11.852 1.00 0.00 H new ATOM 0 HA SER B 51 18.151 76.003 -10.973 1.00 0.00 H new ATOM 0 HB2 SER B 51 19.154 74.038 -13.063 1.00 0.00 H new ATOM 0 HB3 SER B 51 19.657 75.717 -13.074 1.00 0.00 H new ATOM 0 HG SER B 51 21.088 74.380 -11.808 1.00 0.00 H new ATOM 1303 N MET B 52 17.312 77.290 -13.067 1.00 0.00 N ATOM 1304 CA MET B 52 16.501 78.058 -14.067 1.00 0.00 C ATOM 1305 C MET B 52 17.109 79.474 -14.196 1.00 0.00 C ATOM 1306 O MET B 52 18.335 79.615 -14.144 1.00 0.00 O ATOM 1307 CB MET B 52 15.019 78.098 -13.605 1.00 0.00 C ATOM 1308 CG MET B 52 14.052 78.063 -14.813 1.00 0.00 C ATOM 1309 SD MET B 52 13.132 76.500 -14.822 1.00 0.00 S ATOM 1310 CE MET B 52 12.073 76.852 -13.398 1.00 0.00 C ATOM 0 H MET B 52 18.036 77.835 -12.598 1.00 0.00 H new ATOM 0 HA MET B 52 16.524 77.581 -15.047 1.00 0.00 H new ATOM 0 HB2 MET B 52 14.817 77.250 -12.950 1.00 0.00 H new ATOM 0 HB3 MET B 52 14.842 79.001 -13.021 1.00 0.00 H new ATOM 0 HG2 MET B 52 13.359 78.903 -14.760 1.00 0.00 H new ATOM 0 HG3 MET B 52 14.612 78.171 -15.742 1.00 0.00 H new ATOM 0 HE1 MET B 52 11.172 76.241 -13.454 1.00 0.00 H new ATOM 0 HE2 MET B 52 12.611 76.621 -12.479 1.00 0.00 H new ATOM 0 HE3 MET B 52 11.797 77.906 -13.402 1.00 0.00 H new ATOM 1320 N ASP B 53 16.299 80.518 -14.332 1.00 0.00 N ATOM 1321 CA ASP B 53 16.839 81.906 -14.425 1.00 0.00 C ATOM 1322 C ASP B 53 17.067 82.359 -12.995 1.00 0.00 C ATOM 1323 O ASP B 53 16.428 83.288 -12.483 1.00 0.00 O ATOM 1324 CB ASP B 53 15.852 82.824 -15.156 1.00 0.00 C ATOM 1325 CG ASP B 53 15.746 82.412 -16.620 1.00 0.00 C ATOM 1326 OD1 ASP B 53 16.315 83.099 -17.451 1.00 0.00 O ATOM 1327 OD2 ASP B 53 15.103 81.410 -16.887 1.00 0.00 O ATOM 0 H ASP B 53 15.282 80.453 -14.381 1.00 0.00 H new ATOM 0 HA ASP B 53 17.766 81.942 -14.997 1.00 0.00 H new ATOM 0 HB2 ASP B 53 14.872 82.769 -14.682 1.00 0.00 H new ATOM 0 HB3 ASP B 53 16.184 83.860 -15.084 1.00 0.00 H new ATOM 1332 N ALA B 54 17.943 81.657 -12.341 1.00 0.00 N ATOM 1333 CA ALA B 54 18.257 81.914 -10.919 1.00 0.00 C ATOM 1334 C ALA B 54 18.618 83.379 -10.678 1.00 0.00 C ATOM 1335 O ALA B 54 18.455 83.867 -9.557 1.00 0.00 O ATOM 1336 CB ALA B 54 19.394 80.990 -10.498 1.00 0.00 C ATOM 0 H ALA B 54 18.472 80.888 -12.752 1.00 0.00 H new ATOM 0 HA ALA B 54 17.374 81.709 -10.314 1.00 0.00 H new ATOM 0 HB1 ALA B 54 19.638 81.167 -9.451 1.00 0.00 H new ATOM 0 HB2 ALA B 54 19.087 79.952 -10.629 1.00 0.00 H new ATOM 0 HB3 ALA B 54 20.271 81.189 -11.114 1.00 0.00 H new ATOM 1342 N SER B 55 19.110 84.095 -11.677 1.00 0.00 N ATOM 1343 CA SER B 55 19.473 85.532 -11.454 1.00 0.00 C ATOM 1344 C SER B 55 18.195 86.337 -11.221 1.00 0.00 C ATOM 1345 O SER B 55 18.134 87.174 -10.308 1.00 0.00 O ATOM 1346 CB SER B 55 20.219 86.084 -12.669 1.00 0.00 C ATOM 1347 OG SER B 55 19.329 86.153 -13.775 1.00 0.00 O ATOM 0 H SER B 55 19.271 83.746 -12.622 1.00 0.00 H new ATOM 0 HA SER B 55 20.123 85.610 -10.583 1.00 0.00 H new ATOM 0 HB2 SER B 55 20.618 87.074 -12.446 1.00 0.00 H new ATOM 0 HB3 SER B 55 21.068 85.445 -12.910 1.00 0.00 H new ATOM 0 HG SER B 55 19.804 86.508 -14.555 1.00 0.00 H new ATOM 1353 N THR B 56 17.167 86.076 -12.002 1.00 0.00 N ATOM 1354 CA THR B 56 15.866 86.796 -11.825 1.00 0.00 C ATOM 1355 C THR B 56 15.185 86.261 -10.573 1.00 0.00 C ATOM 1356 O THR B 56 14.672 87.028 -9.752 1.00 0.00 O ATOM 1357 CB THR B 56 14.953 86.572 -13.044 1.00 0.00 C ATOM 1358 OG1 THR B 56 15.198 85.282 -13.585 1.00 0.00 O ATOM 1359 CG2 THR B 56 15.221 87.633 -14.120 1.00 0.00 C ATOM 0 H THR B 56 17.177 85.391 -12.757 1.00 0.00 H new ATOM 0 HA THR B 56 16.054 87.865 -11.729 1.00 0.00 H new ATOM 0 HB THR B 56 13.914 86.651 -12.723 1.00 0.00 H new ATOM 0 HG1 THR B 56 15.342 84.643 -12.856 1.00 0.00 H new ATOM 0 HG21 THR B 56 14.566 87.459 -14.974 1.00 0.00 H new ATOM 0 HG22 THR B 56 15.026 88.624 -13.710 1.00 0.00 H new ATOM 0 HG23 THR B 56 16.261 87.571 -14.441 1.00 0.00 H new ATOM 1367 N LYS B 57 15.176 84.957 -10.422 1.00 0.00 N ATOM 1368 CA LYS B 57 14.537 84.319 -9.236 1.00 0.00 C ATOM 1369 C LYS B 57 15.233 84.797 -7.967 1.00 0.00 C ATOM 1370 O LYS B 57 14.580 84.998 -6.944 1.00 0.00 O ATOM 1371 CB LYS B 57 14.647 82.789 -9.350 1.00 0.00 C ATOM 1372 CG LYS B 57 13.760 82.091 -8.295 1.00 0.00 C ATOM 1373 CD LYS B 57 14.559 81.817 -7.012 1.00 0.00 C ATOM 1374 CE LYS B 57 13.691 81.033 -6.024 1.00 0.00 C ATOM 1375 NZ LYS B 57 13.365 79.696 -6.597 1.00 0.00 N ATOM 0 H LYS B 57 15.592 84.302 -11.083 1.00 0.00 H new ATOM 0 HA LYS B 57 13.484 84.598 -9.195 1.00 0.00 H new ATOM 0 HB2 LYS B 57 14.348 82.473 -10.349 1.00 0.00 H new ATOM 0 HB3 LYS B 57 15.685 82.484 -9.217 1.00 0.00 H new ATOM 0 HG2 LYS B 57 12.897 82.717 -8.066 1.00 0.00 H new ATOM 0 HG3 LYS B 57 13.376 81.154 -8.698 1.00 0.00 H new ATOM 0 HD2 LYS B 57 15.461 81.252 -7.247 1.00 0.00 H new ATOM 0 HD3 LYS B 57 14.880 82.757 -6.563 1.00 0.00 H new ATOM 0 HE2 LYS B 57 14.217 80.915 -5.076 1.00 0.00 H new ATOM 0 HE3 LYS B 57 12.774 81.583 -5.814 1.00 0.00 H new ATOM 0 HZ1 LYS B 57 13.132 79.036 -5.828 1.00 0.00 H new ATOM 0 HZ2 LYS B 57 12.551 79.782 -7.238 1.00 0.00 H new ATOM 0 HZ3 LYS B 57 14.185 79.335 -7.125 1.00 0.00 H new ATOM 1389 N LYS B 58 16.538 84.964 -8.009 1.00 0.00 N ATOM 1390 CA LYS B 58 17.299 85.411 -6.798 1.00 0.00 C ATOM 1391 C LYS B 58 16.880 86.816 -6.384 1.00 0.00 C ATOM 1392 O LYS B 58 16.663 87.057 -5.190 1.00 0.00 O ATOM 1393 CB LYS B 58 18.814 85.372 -7.057 1.00 0.00 C ATOM 1394 CG LYS B 58 19.374 83.972 -6.760 1.00 0.00 C ATOM 1395 CD LYS B 58 19.425 83.749 -5.241 1.00 0.00 C ATOM 1396 CE LYS B 58 20.120 82.420 -4.935 1.00 0.00 C ATOM 1397 NZ LYS B 58 21.594 82.582 -5.089 1.00 0.00 N ATOM 0 H LYS B 58 17.111 84.808 -8.839 1.00 0.00 H new ATOM 0 HA LYS B 58 17.066 84.722 -5.986 1.00 0.00 H new ATOM 0 HB2 LYS B 58 19.019 85.640 -8.094 1.00 0.00 H new ATOM 0 HB3 LYS B 58 19.315 86.111 -6.432 1.00 0.00 H new ATOM 0 HG2 LYS B 58 18.748 83.212 -7.228 1.00 0.00 H new ATOM 0 HG3 LYS B 58 20.372 83.871 -7.186 1.00 0.00 H new ATOM 0 HD2 LYS B 58 19.960 84.569 -4.762 1.00 0.00 H new ATOM 0 HD3 LYS B 58 18.415 83.745 -4.831 1.00 0.00 H new ATOM 0 HE2 LYS B 58 19.883 82.099 -3.921 1.00 0.00 H new ATOM 0 HE3 LYS B 58 19.756 81.644 -5.609 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 22.077 81.745 -4.705 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 21.828 82.686 -6.097 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 21.906 83.429 -4.572 1.00 0.00 H new ATOM 1411 N LEU B 59 16.754 87.746 -7.314 1.00 0.00 N ATOM 1412 CA LEU B 59 16.337 89.135 -6.919 1.00 0.00 C ATOM 1413 C LEU B 59 14.957 89.037 -6.270 1.00 0.00 C ATOM 1414 O LEU B 59 14.702 89.641 -5.218 1.00 0.00 O ATOM 1415 CB LEU B 59 16.283 90.063 -8.140 1.00 0.00 C ATOM 1416 CG LEU B 59 16.041 91.512 -7.684 1.00 0.00 C ATOM 1417 CD1 LEU B 59 17.336 92.107 -7.120 1.00 0.00 C ATOM 1418 CD2 LEU B 59 15.582 92.361 -8.874 1.00 0.00 C ATOM 0 H LEU B 59 16.919 87.605 -8.311 1.00 0.00 H new ATOM 0 HA LEU B 59 17.063 89.556 -6.223 1.00 0.00 H new ATOM 0 HB2 LEU B 59 17.217 89.999 -8.698 1.00 0.00 H new ATOM 0 HB3 LEU B 59 15.487 89.746 -8.814 1.00 0.00 H new ATOM 0 HG LEU B 59 15.272 91.512 -6.912 1.00 0.00 H new ATOM 0 HD11 LEU B 59 17.156 93.133 -6.800 1.00 0.00 H new ATOM 0 HD12 LEU B 59 17.668 91.514 -6.268 1.00 0.00 H new ATOM 0 HD13 LEU B 59 18.107 92.098 -7.891 1.00 0.00 H new ATOM 0 HD21 LEU B 59 15.412 93.386 -8.545 1.00 0.00 H new ATOM 0 HD22 LEU B 59 16.351 92.350 -9.647 1.00 0.00 H new ATOM 0 HD23 LEU B 59 14.656 91.951 -9.278 1.00 0.00 H new ATOM 1430 N SER B 60 14.086 88.255 -6.861 1.00 0.00 N ATOM 1431 CA SER B 60 12.722 88.048 -6.296 1.00 0.00 C ATOM 1432 C SER B 60 12.851 87.339 -4.949 1.00 0.00 C ATOM 1433 O SER B 60 12.108 87.639 -4.014 1.00 0.00 O ATOM 1434 CB SER B 60 11.879 87.204 -7.250 1.00 0.00 C ATOM 1435 OG SER B 60 10.564 87.076 -6.726 1.00 0.00 O ATOM 0 H SER B 60 14.269 87.745 -7.725 1.00 0.00 H new ATOM 0 HA SER B 60 12.231 89.012 -6.162 1.00 0.00 H new ATOM 0 HB2 SER B 60 11.847 87.670 -8.235 1.00 0.00 H new ATOM 0 HB3 SER B 60 12.329 86.220 -7.378 1.00 0.00 H new ATOM 0 HG SER B 60 10.360 86.128 -6.581 1.00 0.00 H new ATOM 1441 N GLU B 61 13.772 86.400 -4.844 1.00 0.00 N ATOM 1442 CA GLU B 61 13.971 85.645 -3.571 1.00 0.00 C ATOM 1443 C GLU B 61 14.384 86.613 -2.470 1.00 0.00 C ATOM 1444 O GLU B 61 13.924 86.491 -1.332 1.00 0.00 O ATOM 1445 CB GLU B 61 15.052 84.573 -3.759 1.00 0.00 C ATOM 1446 CG GLU B 61 15.002 83.570 -2.601 1.00 0.00 C ATOM 1447 CD GLU B 61 15.634 84.176 -1.352 1.00 0.00 C ATOM 1448 OE1 GLU B 61 16.794 84.549 -1.421 1.00 0.00 O ATOM 1449 OE2 GLU B 61 14.949 84.261 -0.347 1.00 0.00 O ATOM 0 H GLU B 61 14.399 86.127 -5.601 1.00 0.00 H new ATOM 0 HA GLU B 61 13.038 85.155 -3.292 1.00 0.00 H new ATOM 0 HB2 GLU B 61 14.902 84.055 -4.706 1.00 0.00 H new ATOM 0 HB3 GLU B 61 16.036 85.041 -3.804 1.00 0.00 H new ATOM 0 HG2 GLU B 61 13.968 83.291 -2.396 1.00 0.00 H new ATOM 0 HG3 GLU B 61 15.529 82.657 -2.878 1.00 0.00 H new ATOM 1456 N SER B 62 15.233 87.571 -2.785 1.00 0.00 N ATOM 1457 CA SER B 62 15.677 88.566 -1.757 1.00 0.00 C ATOM 1458 C SER B 62 14.444 89.272 -1.204 1.00 0.00 C ATOM 1459 O SER B 62 14.276 89.386 0.017 1.00 0.00 O ATOM 1460 CB SER B 62 16.621 89.591 -2.389 1.00 0.00 C ATOM 1461 OG SER B 62 16.780 90.692 -1.503 1.00 0.00 O ATOM 0 H SER B 62 15.636 87.703 -3.713 1.00 0.00 H new ATOM 0 HA SER B 62 16.209 88.055 -0.954 1.00 0.00 H new ATOM 0 HB2 SER B 62 17.588 89.133 -2.595 1.00 0.00 H new ATOM 0 HB3 SER B 62 16.220 89.932 -3.343 1.00 0.00 H new ATOM 0 HG SER B 62 17.734 90.882 -1.385 1.00 0.00 H new ATOM 1467 N LEU B 63 13.565 89.715 -2.078 1.00 0.00 N ATOM 1468 CA LEU B 63 12.308 90.390 -1.623 1.00 0.00 C ATOM 1469 C LEU B 63 11.448 89.361 -0.888 1.00 0.00 C ATOM 1470 O LEU B 63 10.853 89.656 0.151 1.00 0.00 O ATOM 1471 CB LEU B 63 11.544 90.957 -2.826 1.00 0.00 C ATOM 1472 CG LEU B 63 12.188 92.279 -3.281 1.00 0.00 C ATOM 1473 CD1 LEU B 63 11.751 92.603 -4.713 1.00 0.00 C ATOM 1474 CD2 LEU B 63 11.748 93.417 -2.353 1.00 0.00 C ATOM 0 H LEU B 63 13.667 89.636 -3.090 1.00 0.00 H new ATOM 0 HA LEU B 63 12.551 91.217 -0.956 1.00 0.00 H new ATOM 0 HB2 LEU B 63 11.553 90.238 -3.645 1.00 0.00 H new ATOM 0 HB3 LEU B 63 10.500 91.124 -2.559 1.00 0.00 H new ATOM 0 HG LEU B 63 13.272 92.175 -3.244 1.00 0.00 H new ATOM 0 HD11 LEU B 63 12.210 93.540 -5.030 1.00 0.00 H new ATOM 0 HD12 LEU B 63 12.066 91.801 -5.380 1.00 0.00 H new ATOM 0 HD13 LEU B 63 10.666 92.700 -4.749 1.00 0.00 H new ATOM 0 HD21 LEU B 63 12.207 94.350 -2.679 1.00 0.00 H new ATOM 0 HD22 LEU B 63 10.663 93.515 -2.386 1.00 0.00 H new ATOM 0 HD23 LEU B 63 12.061 93.196 -1.333 1.00 0.00 H new ATOM 1486 N LYS B 64 11.394 88.157 -1.406 1.00 0.00 N ATOM 1487 CA LYS B 64 10.598 87.069 -0.760 1.00 0.00 C ATOM 1488 C LYS B 64 11.129 86.829 0.655 1.00 0.00 C ATOM 1489 O LYS B 64 10.362 86.488 1.562 1.00 0.00 O ATOM 1490 CB LYS B 64 10.720 85.781 -1.599 1.00 0.00 C ATOM 1491 CG LYS B 64 9.864 84.631 -1.001 1.00 0.00 C ATOM 1492 CD LYS B 64 10.766 83.555 -0.376 1.00 0.00 C ATOM 1493 CE LYS B 64 9.903 82.513 0.340 1.00 0.00 C ATOM 1494 NZ LYS B 64 10.781 81.587 1.113 1.00 0.00 N ATOM 0 H LYS B 64 11.875 87.880 -2.261 1.00 0.00 H new ATOM 0 HA LYS B 64 9.549 87.358 -0.704 1.00 0.00 H new ATOM 0 HB2 LYS B 64 10.401 85.980 -2.622 1.00 0.00 H new ATOM 0 HB3 LYS B 64 11.764 85.473 -1.645 1.00 0.00 H new ATOM 0 HG2 LYS B 64 9.187 85.029 -0.246 1.00 0.00 H new ATOM 0 HG3 LYS B 64 9.246 84.187 -1.781 1.00 0.00 H new ATOM 0 HD2 LYS B 64 11.366 83.075 -1.149 1.00 0.00 H new ATOM 0 HD3 LYS B 64 11.460 84.013 0.328 1.00 0.00 H new ATOM 0 HE2 LYS B 64 9.198 83.007 1.009 1.00 0.00 H new ATOM 0 HE3 LYS B 64 9.314 81.952 -0.386 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 10.195 80.879 1.600 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 11.436 81.107 0.464 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 11.324 82.129 1.815 1.00 0.00 H new ATOM 1508 N ARG B 65 12.418 86.997 0.852 1.00 0.00 N ATOM 1509 CA ARG B 65 13.030 86.784 2.195 1.00 0.00 C ATOM 1510 C ARG B 65 12.615 87.906 3.144 1.00 0.00 C ATOM 1511 O ARG B 65 12.438 87.665 4.341 1.00 0.00 O ATOM 1512 CB ARG B 65 14.556 86.748 2.072 1.00 0.00 C ATOM 1513 CG ARG B 65 15.168 86.172 3.352 1.00 0.00 C ATOM 1514 CD ARG B 65 16.693 86.151 3.224 1.00 0.00 C ATOM 1515 NE ARG B 65 17.296 85.298 4.302 1.00 0.00 N ATOM 1516 CZ ARG B 65 18.556 85.438 4.688 1.00 0.00 C ATOM 1517 NH1 ARG B 65 19.025 84.651 5.617 1.00 0.00 N ATOM 1518 NH2 ARG B 65 19.347 86.350 4.166 1.00 0.00 N ATOM 0 H ARG B 65 13.077 87.277 0.125 1.00 0.00 H new ATOM 0 HA ARG B 65 12.680 85.833 2.595 1.00 0.00 H new ATOM 0 HB2 ARG B 65 14.846 86.141 1.214 1.00 0.00 H new ATOM 0 HB3 ARG B 65 14.939 87.753 1.895 1.00 0.00 H new ATOM 0 HG2 ARG B 65 14.873 86.774 4.212 1.00 0.00 H new ATOM 0 HG3 ARG B 65 14.793 85.163 3.525 1.00 0.00 H new ATOM 0 HD2 ARG B 65 16.977 85.766 2.245 1.00 0.00 H new ATOM 0 HD3 ARG B 65 17.084 87.166 3.293 1.00 0.00 H new ATOM 0 HE ARG B 65 16.718 84.588 4.752 1.00 0.00 H new ATOM 0 HH11 ARG B 65 18.424 83.941 6.035 1.00 0.00 H new ATOM 0 HH12 ARG B 65 19.993 84.746 5.925 1.00 0.00 H new ATOM 0 HH21 ARG B 65 18.995 86.976 3.442 1.00 0.00 H new ATOM 0 HH22 ARG B 65 20.312 86.431 4.486 1.00 0.00 H new ATOM 1532 N ILE B 66 12.483 89.123 2.649 1.00 0.00 N ATOM 1533 CA ILE B 66 12.104 90.269 3.539 1.00 0.00 C ATOM 1534 C ILE B 66 10.663 90.077 4.032 1.00 0.00 C ATOM 1535 O ILE B 66 10.370 90.322 5.210 1.00 0.00 O ATOM 1536 CB ILE B 66 12.347 91.632 2.795 1.00 0.00 C ATOM 1537 CG1 ILE B 66 12.910 92.681 3.777 1.00 0.00 C ATOM 1538 CG2 ILE B 66 11.073 92.213 2.140 1.00 0.00 C ATOM 1539 CD1 ILE B 66 14.375 92.363 4.109 1.00 0.00 C ATOM 0 H ILE B 66 12.622 89.367 1.668 1.00 0.00 H new ATOM 0 HA ILE B 66 12.736 90.295 4.426 1.00 0.00 H new ATOM 0 HB ILE B 66 13.059 91.413 1.999 1.00 0.00 H new ATOM 0 HG12 ILE B 66 12.836 93.676 3.339 1.00 0.00 H new ATOM 0 HG13 ILE B 66 12.316 92.690 4.691 1.00 0.00 H new ATOM 0 HG21 ILE B 66 11.315 93.153 1.645 1.00 0.00 H new ATOM 0 HG22 ILE B 66 10.686 91.506 1.406 1.00 0.00 H new ATOM 0 HG23 ILE B 66 10.318 92.390 2.906 1.00 0.00 H new ATOM 0 HD11 ILE B 66 14.761 93.110 4.803 1.00 0.00 H new ATOM 0 HD12 ILE B 66 14.438 91.376 4.567 1.00 0.00 H new ATOM 0 HD13 ILE B 66 14.967 92.377 3.194 1.00 0.00 H new ATOM 1551 N GLY B 67 9.772 89.625 3.170 1.00 0.00 N ATOM 1552 CA GLY B 67 8.354 89.393 3.601 1.00 0.00 C ATOM 1553 C GLY B 67 8.359 88.289 4.649 1.00 0.00 C ATOM 1554 O GLY B 67 7.776 88.431 5.732 1.00 0.00 O ATOM 0 H GLY B 67 9.968 89.409 2.193 1.00 0.00 H new ATOM 0 HA2 GLY B 67 7.926 90.307 4.012 1.00 0.00 H new ATOM 0 HA3 GLY B 67 7.738 89.107 2.748 1.00 0.00 H new ATOM 1558 N ASP B 68 9.046 87.211 4.356 1.00 0.00 N ATOM 1559 CA ASP B 68 9.164 86.078 5.322 1.00 0.00 C ATOM 1560 C ASP B 68 9.872 86.592 6.585 1.00 0.00 C ATOM 1561 O ASP B 68 9.588 86.128 7.694 1.00 0.00 O ATOM 1562 CB ASP B 68 9.945 84.920 4.667 1.00 0.00 C ATOM 1563 CG ASP B 68 10.466 83.926 5.708 1.00 0.00 C ATOM 1564 OD1 ASP B 68 9.758 82.977 6.004 1.00 0.00 O ATOM 1565 OD2 ASP B 68 11.568 84.131 6.191 1.00 0.00 O ATOM 0 H ASP B 68 9.537 87.068 3.473 1.00 0.00 H new ATOM 0 HA ASP B 68 8.180 85.699 5.598 1.00 0.00 H new ATOM 0 HB2 ASP B 68 9.299 84.400 3.959 1.00 0.00 H new ATOM 0 HB3 ASP B 68 10.783 85.323 4.098 1.00 0.00 H new ATOM 1570 N GLU B 69 10.792 87.524 6.430 1.00 0.00 N ATOM 1571 CA GLU B 69 11.544 88.071 7.601 1.00 0.00 C ATOM 1572 C GLU B 69 10.560 88.669 8.599 1.00 0.00 C ATOM 1573 O GLU B 69 10.688 88.432 9.807 1.00 0.00 O ATOM 1574 CB GLU B 69 12.525 89.154 7.140 1.00 0.00 C ATOM 1575 CG GLU B 69 13.558 89.416 8.238 1.00 0.00 C ATOM 1576 CD GLU B 69 14.512 88.231 8.345 1.00 0.00 C ATOM 1577 OE1 GLU B 69 15.508 88.232 7.639 1.00 0.00 O ATOM 1578 OE2 GLU B 69 14.233 87.339 9.128 1.00 0.00 O ATOM 0 H GLU B 69 11.052 87.929 5.531 1.00 0.00 H new ATOM 0 HA GLU B 69 12.104 87.264 8.073 1.00 0.00 H new ATOM 0 HB2 GLU B 69 13.025 88.839 6.224 1.00 0.00 H new ATOM 0 HB3 GLU B 69 11.985 90.072 6.909 1.00 0.00 H new ATOM 0 HG2 GLU B 69 14.117 90.325 8.015 1.00 0.00 H new ATOM 0 HG3 GLU B 69 13.055 89.577 9.192 1.00 0.00 H new ATOM 1585 N LEU B 70 9.581 89.422 8.134 1.00 0.00 N ATOM 1586 CA LEU B 70 8.581 90.017 9.076 1.00 0.00 C ATOM 1587 C LEU B 70 7.814 88.879 9.734 1.00 0.00 C ATOM 1588 O LEU B 70 7.593 88.889 10.950 1.00 0.00 O ATOM 1589 CB LEU B 70 7.597 90.944 8.343 1.00 0.00 C ATOM 1590 CG LEU B 70 8.253 92.297 8.011 1.00 0.00 C ATOM 1591 CD1 LEU B 70 7.286 93.116 7.153 1.00 0.00 C ATOM 1592 CD2 LEU B 70 8.551 93.083 9.298 1.00 0.00 C ATOM 0 H LEU B 70 9.436 89.646 7.149 1.00 0.00 H new ATOM 0 HA LEU B 70 9.107 90.616 9.820 1.00 0.00 H new ATOM 0 HB2 LEU B 70 7.258 90.466 7.424 1.00 0.00 H new ATOM 0 HB3 LEU B 70 6.715 91.106 8.963 1.00 0.00 H new ATOM 0 HG LEU B 70 9.187 92.116 7.479 1.00 0.00 H new ATOM 0 HD11 LEU B 70 7.739 94.077 6.911 1.00 0.00 H new ATOM 0 HD12 LEU B 70 7.069 92.575 6.232 1.00 0.00 H new ATOM 0 HD13 LEU B 70 6.360 93.280 7.704 1.00 0.00 H new ATOM 0 HD21 LEU B 70 9.014 94.036 9.043 1.00 0.00 H new ATOM 0 HD22 LEU B 70 7.621 93.264 9.837 1.00 0.00 H new ATOM 0 HD23 LEU B 70 9.229 92.507 9.927 1.00 0.00 H new ATOM 1604 N ASP B 71 7.421 87.891 8.957 1.00 0.00 N ATOM 1605 CA ASP B 71 6.681 86.722 9.526 1.00 0.00 C ATOM 1606 C ASP B 71 7.582 86.011 10.539 1.00 0.00 C ATOM 1607 O ASP B 71 7.095 85.452 11.527 1.00 0.00 O ATOM 1608 CB ASP B 71 6.276 85.750 8.415 1.00 0.00 C ATOM 1609 CG ASP B 71 5.461 84.603 9.003 1.00 0.00 C ATOM 1610 OD1 ASP B 71 5.883 83.467 8.861 1.00 0.00 O ATOM 1611 OD2 ASP B 71 4.429 84.880 9.592 1.00 0.00 O ATOM 0 H ASP B 71 7.584 87.848 7.951 1.00 0.00 H new ATOM 0 HA ASP B 71 5.774 87.074 10.018 1.00 0.00 H new ATOM 0 HB2 ASP B 71 5.692 86.272 7.658 1.00 0.00 H new ATOM 0 HB3 ASP B 71 7.165 85.360 7.919 1.00 0.00 H new ATOM 1616 N SER B 72 8.880 86.023 10.310 1.00 0.00 N ATOM 1617 CA SER B 72 9.836 85.355 11.251 1.00 0.00 C ATOM 1618 C SER B 72 10.223 86.299 12.398 1.00 0.00 C ATOM 1619 O SER B 72 10.722 85.843 13.432 1.00 0.00 O ATOM 1620 CB SER B 72 11.093 84.929 10.493 1.00 0.00 C ATOM 1621 OG SER B 72 11.946 86.051 10.304 1.00 0.00 O ATOM 0 H SER B 72 9.317 86.471 9.505 1.00 0.00 H new ATOM 0 HA SER B 72 9.346 84.478 11.674 1.00 0.00 H new ATOM 0 HB2 SER B 72 11.618 84.152 11.048 1.00 0.00 H new ATOM 0 HB3 SER B 72 10.820 84.502 9.528 1.00 0.00 H new ATOM 0 HG SER B 72 11.415 86.819 10.007 1.00 0.00 H new ATOM 1627 N ASN B 73 10.017 87.591 12.234 1.00 0.00 N ATOM 1628 CA ASN B 73 10.375 88.577 13.299 1.00 0.00 C ATOM 1629 C ASN B 73 9.505 88.326 14.534 1.00 0.00 C ATOM 1630 O ASN B 73 8.446 88.943 14.705 1.00 0.00 O ATOM 1631 CB ASN B 73 10.169 90.010 12.780 1.00 0.00 C ATOM 1632 CG ASN B 73 11.490 90.590 12.284 1.00 0.00 C ATOM 1633 OD1 ASN B 73 11.703 90.714 11.078 1.00 0.00 O ATOM 1634 ND2 ASN B 73 12.394 90.957 13.150 1.00 0.00 N ATOM 0 H ASN B 73 9.610 88.003 11.394 1.00 0.00 H new ATOM 0 HA ASN B 73 11.424 88.456 13.570 1.00 0.00 H new ATOM 0 HB2 ASN B 73 9.438 90.009 11.971 1.00 0.00 H new ATOM 0 HB3 ASN B 73 9.765 90.637 13.575 1.00 0.00 H new ATOM 0 HD21 ASN B 73 13.280 91.348 12.828 1.00 0.00 H new ATOM 0 HD22 ASN B 73 12.215 90.853 14.149 1.00 0.00 H new ATOM 1641 N MET B 74 9.938 87.432 15.387 1.00 0.00 N ATOM 1642 CA MET B 74 9.167 87.104 16.627 1.00 0.00 C ATOM 1643 C MET B 74 8.982 88.357 17.484 1.00 0.00 C ATOM 1644 O MET B 74 7.976 88.480 18.188 1.00 0.00 O ATOM 1645 CB MET B 74 9.910 86.028 17.433 1.00 0.00 C ATOM 1646 CG MET B 74 9.003 85.444 18.541 1.00 0.00 C ATOM 1647 SD MET B 74 8.610 83.707 18.165 1.00 0.00 S ATOM 1648 CE MET B 74 9.160 82.970 19.726 1.00 0.00 C ATOM 0 H MET B 74 10.806 86.908 15.276 1.00 0.00 H new ATOM 0 HA MET B 74 8.186 86.726 16.340 1.00 0.00 H new ATOM 0 HB2 MET B 74 10.237 85.230 16.767 1.00 0.00 H new ATOM 0 HB3 MET B 74 10.807 86.457 17.880 1.00 0.00 H new ATOM 0 HG2 MET B 74 9.504 85.512 19.507 1.00 0.00 H new ATOM 0 HG3 MET B 74 8.085 86.026 18.616 1.00 0.00 H new ATOM 0 HE1 MET B 74 9.001 81.892 19.696 1.00 0.00 H new ATOM 0 HE2 MET B 74 10.220 83.176 19.872 1.00 0.00 H new ATOM 0 HE3 MET B 74 8.590 83.398 20.551 1.00 0.00 H new ATOM 1658 N GLU B 75 9.923 89.279 17.446 1.00 0.00 N ATOM 1659 CA GLU B 75 9.803 90.527 18.267 1.00 0.00 C ATOM 1660 C GLU B 75 8.623 91.356 17.758 1.00 0.00 C ATOM 1661 O GLU B 75 7.809 91.841 18.553 1.00 0.00 O ATOM 1662 CB GLU B 75 11.104 91.344 18.165 1.00 0.00 C ATOM 1663 CG GLU B 75 11.379 92.085 19.481 1.00 0.00 C ATOM 1664 CD GLU B 75 10.357 93.201 19.674 1.00 0.00 C ATOM 1665 OE1 GLU B 75 9.724 93.224 20.716 1.00 0.00 O ATOM 1666 OE2 GLU B 75 10.224 94.014 18.776 1.00 0.00 O ATOM 0 H GLU B 75 10.769 89.217 16.880 1.00 0.00 H new ATOM 0 HA GLU B 75 9.634 90.262 19.311 1.00 0.00 H new ATOM 0 HB2 GLU B 75 11.938 90.682 17.932 1.00 0.00 H new ATOM 0 HB3 GLU B 75 11.027 92.060 17.347 1.00 0.00 H new ATOM 0 HG2 GLU B 75 11.331 91.388 20.318 1.00 0.00 H new ATOM 0 HG3 GLU B 75 12.386 92.501 19.470 1.00 0.00 H new ATOM 1673 N LEU B 76 8.506 91.512 16.455 1.00 0.00 N ATOM 1674 CA LEU B 76 7.368 92.298 15.876 1.00 0.00 C ATOM 1675 C LEU B 76 6.067 91.553 16.151 1.00 0.00 C ATOM 1676 O LEU B 76 5.053 92.162 16.515 1.00 0.00 O ATOM 1677 CB LEU B 76 7.566 92.489 14.361 1.00 0.00 C ATOM 1678 CG LEU B 76 6.546 93.522 13.806 1.00 0.00 C ATOM 1679 CD1 LEU B 76 7.174 94.321 12.657 1.00 0.00 C ATOM 1680 CD2 LEU B 76 5.292 92.811 13.274 1.00 0.00 C ATOM 0 H LEU B 76 9.154 91.126 15.768 1.00 0.00 H new ATOM 0 HA LEU B 76 7.330 93.284 16.339 1.00 0.00 H new ATOM 0 HB2 LEU B 76 8.582 92.829 14.161 1.00 0.00 H new ATOM 0 HB3 LEU B 76 7.442 91.535 13.849 1.00 0.00 H new ATOM 0 HG LEU B 76 6.270 94.191 14.621 1.00 0.00 H new ATOM 0 HD11 LEU B 76 6.450 95.041 12.276 1.00 0.00 H new ATOM 0 HD12 LEU B 76 8.055 94.850 13.021 1.00 0.00 H new ATOM 0 HD13 LEU B 76 7.464 93.640 11.856 1.00 0.00 H new ATOM 0 HD21 LEU B 76 4.590 93.551 12.890 1.00 0.00 H new ATOM 0 HD22 LEU B 76 5.574 92.128 12.473 1.00 0.00 H new ATOM 0 HD23 LEU B 76 4.822 92.250 14.081 1.00 0.00 H new ATOM 1692 N GLN B 77 6.086 90.247 15.997 1.00 0.00 N ATOM 1693 CA GLN B 77 4.866 89.424 16.256 1.00 0.00 C ATOM 1694 C GLN B 77 4.504 89.520 17.736 1.00 0.00 C ATOM 1695 O GLN B 77 3.325 89.550 18.086 1.00 0.00 O ATOM 1696 CB GLN B 77 5.114 87.956 15.867 1.00 0.00 C ATOM 1697 CG GLN B 77 4.759 87.733 14.389 1.00 0.00 C ATOM 1698 CD GLN B 77 4.572 86.246 14.106 1.00 0.00 C ATOM 1699 OE1 GLN B 77 5.208 85.699 13.204 1.00 0.00 O ATOM 1700 NE2 GLN B 77 3.730 85.554 14.826 1.00 0.00 N ATOM 0 H GLN B 77 6.904 89.715 15.700 1.00 0.00 H new ATOM 0 HA GLN B 77 4.042 89.803 15.651 1.00 0.00 H new ATOM 0 HB2 GLN B 77 6.158 87.697 16.041 1.00 0.00 H new ATOM 0 HB3 GLN B 77 4.514 87.299 16.496 1.00 0.00 H new ATOM 0 HG2 GLN B 77 3.846 88.274 14.142 1.00 0.00 H new ATOM 0 HG3 GLN B 77 5.549 88.134 13.754 1.00 0.00 H new ATOM 0 HE21 GLN B 77 3.204 86.008 15.573 1.00 0.00 H new ATOM 0 HE22 GLN B 77 3.599 84.559 14.642 1.00 0.00 H new ATOM 1709 N ARG B 78 5.489 89.553 18.602 1.00 0.00 N ATOM 1710 CA ARG B 78 5.221 89.637 20.070 1.00 0.00 C ATOM 1711 C ARG B 78 4.462 90.928 20.390 1.00 0.00 C ATOM 1712 O ARG B 78 3.511 90.908 21.183 1.00 0.00 O ATOM 1713 CB ARG B 78 6.547 89.605 20.845 1.00 0.00 C ATOM 1714 CG ARG B 78 6.325 89.043 22.255 1.00 0.00 C ATOM 1715 CD ARG B 78 7.653 89.027 23.013 1.00 0.00 C ATOM 1716 NE ARG B 78 7.526 88.217 24.271 1.00 0.00 N ATOM 1717 CZ ARG B 78 6.846 88.653 25.322 1.00 0.00 C ATOM 1718 NH1 ARG B 78 6.779 87.904 26.389 1.00 0.00 N ATOM 1719 NH2 ARG B 78 6.235 89.819 25.321 1.00 0.00 N ATOM 0 H ARG B 78 6.477 89.525 18.350 1.00 0.00 H new ATOM 0 HA ARG B 78 4.612 88.784 20.369 1.00 0.00 H new ATOM 0 HB2 ARG B 78 7.273 88.992 20.312 1.00 0.00 H new ATOM 0 HB3 ARG B 78 6.964 90.610 20.908 1.00 0.00 H new ATOM 0 HG2 ARG B 78 5.596 89.652 22.790 1.00 0.00 H new ATOM 0 HG3 ARG B 78 5.916 88.034 22.196 1.00 0.00 H new ATOM 0 HD2 ARG B 78 8.436 88.608 22.380 1.00 0.00 H new ATOM 0 HD3 ARG B 78 7.952 90.046 23.257 1.00 0.00 H new ATOM 0 HE ARG B 78 7.977 87.303 24.318 1.00 0.00 H new ATOM 0 HH11 ARG B 78 7.246 86.997 26.406 1.00 0.00 H new ATOM 0 HH12 ARG B 78 6.260 88.225 27.206 1.00 0.00 H new ATOM 0 HH21 ARG B 78 6.277 90.416 24.495 1.00 0.00 H new ATOM 0 HH22 ARG B 78 5.720 90.126 26.146 1.00 0.00 H new ATOM 1733 N MET B 79 4.863 92.047 19.813 1.00 0.00 N ATOM 1734 CA MET B 79 4.166 93.343 20.109 1.00 0.00 C ATOM 1735 C MET B 79 2.704 93.264 19.679 1.00 0.00 C ATOM 1736 O MET B 79 1.808 93.629 20.449 1.00 0.00 O ATOM 1737 CB MET B 79 4.840 94.494 19.358 1.00 0.00 C ATOM 1738 CG MET B 79 6.235 94.748 19.929 1.00 0.00 C ATOM 1739 SD MET B 79 6.881 96.302 19.255 1.00 0.00 S ATOM 1740 CE MET B 79 7.120 95.737 17.552 1.00 0.00 C ATOM 0 H MET B 79 5.639 92.114 19.154 1.00 0.00 H new ATOM 0 HA MET B 79 4.225 93.524 21.182 1.00 0.00 H new ATOM 0 HB2 MET B 79 4.911 94.254 18.297 1.00 0.00 H new ATOM 0 HB3 MET B 79 4.235 95.397 19.441 1.00 0.00 H new ATOM 0 HG2 MET B 79 6.192 94.800 21.017 1.00 0.00 H new ATOM 0 HG3 MET B 79 6.901 93.923 19.675 1.00 0.00 H new ATOM 0 HE1 MET B 79 7.618 96.517 16.976 1.00 0.00 H new ATOM 0 HE2 MET B 79 7.735 94.837 17.550 1.00 0.00 H new ATOM 0 HE3 MET B 79 6.152 95.516 17.103 1.00 0.00 H new ATOM 1750 N ILE B 80 2.442 92.794 18.478 1.00 0.00 N ATOM 1751 CA ILE B 80 1.024 92.683 17.995 1.00 0.00 C ATOM 1752 C ILE B 80 0.297 91.590 18.770 1.00 0.00 C ATOM 1753 O ILE B 80 -0.888 91.719 19.077 1.00 0.00 O ATOM 1754 CB ILE B 80 0.958 92.399 16.485 1.00 0.00 C ATOM 1755 CG1 ILE B 80 1.850 91.199 16.106 1.00 0.00 C ATOM 1756 CG2 ILE B 80 1.423 93.647 15.725 1.00 0.00 C ATOM 1757 CD1 ILE B 80 1.540 90.726 14.675 1.00 0.00 C ATOM 0 H ILE B 80 3.149 92.483 17.812 1.00 0.00 H new ATOM 0 HA ILE B 80 0.533 93.640 18.171 1.00 0.00 H new ATOM 0 HB ILE B 80 -0.070 92.154 16.218 1.00 0.00 H new ATOM 0 HG12 ILE B 80 2.900 91.481 16.182 1.00 0.00 H new ATOM 0 HG13 ILE B 80 1.687 90.382 16.808 1.00 0.00 H new ATOM 0 HG21 ILE B 80 1.380 93.457 14.653 1.00 0.00 H new ATOM 0 HG22 ILE B 80 0.772 94.486 15.971 1.00 0.00 H new ATOM 0 HG23 ILE B 80 2.447 93.886 16.011 1.00 0.00 H new ATOM 0 HD11 ILE B 80 2.179 89.879 14.425 1.00 0.00 H new ATOM 0 HD12 ILE B 80 0.495 90.424 14.610 1.00 0.00 H new ATOM 0 HD13 ILE B 80 1.726 91.540 13.974 1.00 0.00 H new ATOM 1769 N ALA B 81 0.984 90.526 19.085 1.00 0.00 N ATOM 1770 CA ALA B 81 0.371 89.394 19.843 1.00 0.00 C ATOM 1771 C ALA B 81 0.208 89.760 21.325 1.00 0.00 C ATOM 1772 O ALA B 81 -0.396 88.995 22.085 1.00 0.00 O ATOM 1773 CB ALA B 81 1.250 88.153 19.701 1.00 0.00 C ATOM 0 H ALA B 81 1.966 90.390 18.844 1.00 0.00 H new ATOM 0 HA ALA B 81 -0.618 89.188 19.433 1.00 0.00 H new ATOM 0 HB1 ALA B 81 0.804 87.326 20.254 1.00 0.00 H new ATOM 0 HB2 ALA B 81 1.332 87.884 18.648 1.00 0.00 H new ATOM 0 HB3 ALA B 81 2.242 88.363 20.100 1.00 0.00 H new ATOM 1779 N ALA B 82 0.737 90.894 21.756 1.00 0.00 N ATOM 1780 CA ALA B 82 0.623 91.292 23.199 1.00 0.00 C ATOM 1781 C ALA B 82 -0.701 92.020 23.465 1.00 0.00 C ATOM 1782 O ALA B 82 -0.908 92.506 24.583 1.00 0.00 O ATOM 1783 CB ALA B 82 1.772 92.225 23.585 1.00 0.00 C ATOM 0 H ALA B 82 1.241 91.556 21.167 1.00 0.00 H new ATOM 0 HA ALA B 82 0.663 90.380 23.795 1.00 0.00 H new ATOM 0 HB1 ALA B 82 1.676 92.505 24.634 1.00 0.00 H new ATOM 0 HB2 ALA B 82 2.723 91.714 23.431 1.00 0.00 H new ATOM 0 HB3 ALA B 82 1.737 93.121 22.965 1.00 0.00 H new ATOM 1789 N VAL B 83 -1.605 92.108 22.495 1.00 0.00 N ATOM 1790 CA VAL B 83 -2.915 92.808 22.740 1.00 0.00 C ATOM 1791 C VAL B 83 -3.563 92.222 23.991 1.00 0.00 C ATOM 1792 O VAL B 83 -3.847 91.022 24.049 1.00 0.00 O ATOM 1793 CB VAL B 83 -3.872 92.658 21.543 1.00 0.00 C ATOM 1794 CG1 VAL B 83 -3.340 93.478 20.367 1.00 0.00 C ATOM 1795 CG2 VAL B 83 -3.991 91.189 21.123 1.00 0.00 C ATOM 0 H VAL B 83 -1.487 91.727 21.556 1.00 0.00 H new ATOM 0 HA VAL B 83 -2.717 93.871 22.875 1.00 0.00 H new ATOM 0 HB VAL B 83 -4.858 93.017 21.837 1.00 0.00 H new ATOM 0 HG11 VAL B 83 -4.014 93.375 19.517 1.00 0.00 H new ATOM 0 HG12 VAL B 83 -3.276 94.527 20.654 1.00 0.00 H new ATOM 0 HG13 VAL B 83 -2.349 93.117 20.090 1.00 0.00 H new ATOM 0 HG21 VAL B 83 -4.672 91.107 20.276 1.00 0.00 H new ATOM 0 HG22 VAL B 83 -3.009 90.812 20.837 1.00 0.00 H new ATOM 0 HG23 VAL B 83 -4.377 90.602 21.957 1.00 0.00 H new ATOM 1805 N ASP B 84 -3.773 93.049 24.994 1.00 0.00 N ATOM 1806 CA ASP B 84 -4.387 92.595 26.289 1.00 0.00 C ATOM 1807 C ASP B 84 -5.548 91.643 26.021 1.00 0.00 C ATOM 1808 O ASP B 84 -6.351 91.867 25.110 1.00 0.00 O ATOM 1809 CB ASP B 84 -4.888 93.805 27.081 1.00 0.00 C ATOM 1810 CG ASP B 84 -5.907 94.583 26.255 1.00 0.00 C ATOM 1811 OD1 ASP B 84 -7.051 94.648 26.674 1.00 0.00 O ATOM 1812 OD2 ASP B 84 -5.529 95.103 25.219 1.00 0.00 O ATOM 0 H ASP B 84 -3.539 94.041 24.968 1.00 0.00 H new ATOM 0 HA ASP B 84 -3.627 92.072 26.869 1.00 0.00 H new ATOM 0 HB2 ASP B 84 -5.341 93.476 28.016 1.00 0.00 H new ATOM 0 HB3 ASP B 84 -4.050 94.451 27.343 1.00 0.00 H new ATOM 1817 N THR B 85 -5.624 90.577 26.779 1.00 0.00 N ATOM 1818 CA THR B 85 -6.705 89.566 26.577 1.00 0.00 C ATOM 1819 C THR B 85 -8.077 90.145 26.936 1.00 0.00 C ATOM 1820 O THR B 85 -9.103 89.530 26.625 1.00 0.00 O ATOM 1821 CB THR B 85 -6.431 88.332 27.441 1.00 0.00 C ATOM 1822 OG1 THR B 85 -6.314 88.729 28.800 1.00 0.00 O ATOM 1823 CG2 THR B 85 -5.131 87.663 26.991 1.00 0.00 C ATOM 0 H THR B 85 -4.976 90.363 27.537 1.00 0.00 H new ATOM 0 HA THR B 85 -6.713 89.285 25.524 1.00 0.00 H new ATOM 0 HB THR B 85 -7.253 87.625 27.334 1.00 0.00 H new ATOM 0 HG1 THR B 85 -6.140 87.942 29.357 1.00 0.00 H new ATOM 0 HG21 THR B 85 -4.941 86.786 27.609 1.00 0.00 H new ATOM 0 HG22 THR B 85 -5.220 87.360 25.948 1.00 0.00 H new ATOM 0 HG23 THR B 85 -4.305 88.366 27.095 1.00 0.00 H new ATOM 1831 N ASP B 86 -8.125 91.295 27.580 1.00 0.00 N ATOM 1832 CA ASP B 86 -9.440 91.897 27.960 1.00 0.00 C ATOM 1833 C ASP B 86 -10.288 92.112 26.703 1.00 0.00 C ATOM 1834 O ASP B 86 -11.517 92.003 26.759 1.00 0.00 O ATOM 1835 CB ASP B 86 -9.231 93.224 28.701 1.00 0.00 C ATOM 1836 CG ASP B 86 -10.574 93.781 29.161 1.00 0.00 C ATOM 1837 OD1 ASP B 86 -11.213 93.138 29.976 1.00 0.00 O ATOM 1838 OD2 ASP B 86 -10.943 94.846 28.691 1.00 0.00 O ATOM 0 H ASP B 86 -7.307 91.838 27.856 1.00 0.00 H new ATOM 0 HA ASP B 86 -9.963 91.215 28.630 1.00 0.00 H new ATOM 0 HB2 ASP B 86 -8.578 93.071 29.560 1.00 0.00 H new ATOM 0 HB3 ASP B 86 -8.735 93.941 28.047 1.00 0.00 H new ATOM 1843 N SER B 87 -9.663 92.397 25.571 1.00 0.00 N ATOM 1844 CA SER B 87 -10.422 92.607 24.293 1.00 0.00 C ATOM 1845 C SER B 87 -9.421 92.893 23.148 1.00 0.00 C ATOM 1846 O SER B 87 -9.115 94.059 22.878 1.00 0.00 O ATOM 1847 CB SER B 87 -11.410 93.776 24.435 1.00 0.00 C ATOM 1848 OG SER B 87 -12.537 93.540 23.602 1.00 0.00 O ATOM 0 H SER B 87 -8.651 92.492 25.484 1.00 0.00 H new ATOM 0 HA SER B 87 -10.992 91.706 24.065 1.00 0.00 H new ATOM 0 HB2 SER B 87 -11.725 93.877 25.473 1.00 0.00 H new ATOM 0 HB3 SER B 87 -10.926 94.712 24.156 1.00 0.00 H new ATOM 0 HG SER B 87 -13.331 93.955 24.000 1.00 0.00 H new ATOM 1854 N PRO B 88 -8.894 91.868 22.469 1.00 0.00 N ATOM 1855 CA PRO B 88 -7.913 92.072 21.348 1.00 0.00 C ATOM 1856 C PRO B 88 -8.533 92.817 20.167 1.00 0.00 C ATOM 1857 O PRO B 88 -7.855 93.591 19.479 1.00 0.00 O ATOM 1858 CB PRO B 88 -7.504 90.650 20.943 1.00 0.00 C ATOM 1859 CG PRO B 88 -8.618 89.774 21.407 1.00 0.00 C ATOM 1860 CD PRO B 88 -9.162 90.422 22.675 1.00 0.00 C ATOM 0 HA PRO B 88 -7.068 92.686 21.659 1.00 0.00 H new ATOM 0 HB2 PRO B 88 -7.365 90.572 19.865 1.00 0.00 H new ATOM 0 HB3 PRO B 88 -6.560 90.365 21.407 1.00 0.00 H new ATOM 0 HG2 PRO B 88 -9.394 89.694 20.646 1.00 0.00 H new ATOM 0 HG3 PRO B 88 -8.262 88.763 21.607 1.00 0.00 H new ATOM 0 HD2 PRO B 88 -10.227 90.225 22.801 1.00 0.00 H new ATOM 0 HD3 PRO B 88 -8.660 90.044 23.566 1.00 0.00 H new ATOM 1868 N ARG B 89 -9.803 92.597 19.919 1.00 0.00 N ATOM 1869 CA ARG B 89 -10.491 93.282 18.782 1.00 0.00 C ATOM 1870 C ARG B 89 -10.619 94.778 19.076 1.00 0.00 C ATOM 1871 O ARG B 89 -10.578 95.598 18.154 1.00 0.00 O ATOM 1872 CB ARG B 89 -11.886 92.684 18.557 1.00 0.00 C ATOM 1873 CG ARG B 89 -11.787 91.375 17.755 1.00 0.00 C ATOM 1874 CD ARG B 89 -13.154 91.020 17.137 1.00 0.00 C ATOM 1875 NE ARG B 89 -13.654 89.715 17.689 1.00 0.00 N ATOM 1876 CZ ARG B 89 -14.946 89.415 17.720 1.00 0.00 C ATOM 1877 NH1 ARG B 89 -15.320 88.274 18.229 1.00 0.00 N ATOM 1878 NH2 ARG B 89 -15.863 90.233 17.249 1.00 0.00 N ATOM 0 H ARG B 89 -10.395 91.967 20.461 1.00 0.00 H new ATOM 0 HA ARG B 89 -9.895 93.137 17.881 1.00 0.00 H new ATOM 0 HB2 ARG B 89 -12.366 92.494 19.517 1.00 0.00 H new ATOM 0 HB3 ARG B 89 -12.513 93.398 18.023 1.00 0.00 H new ATOM 0 HG2 ARG B 89 -11.040 91.479 16.968 1.00 0.00 H new ATOM 0 HG3 ARG B 89 -11.454 90.567 18.406 1.00 0.00 H new ATOM 0 HD2 ARG B 89 -13.873 91.811 17.349 1.00 0.00 H new ATOM 0 HD3 ARG B 89 -13.064 90.953 16.053 1.00 0.00 H new ATOM 0 HE ARG B 89 -12.980 89.040 18.051 1.00 0.00 H new ATOM 0 HH11 ARG B 89 -14.623 87.626 18.596 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -16.310 88.029 18.260 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -15.589 91.128 16.845 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -16.848 89.972 17.288 1.00 0.00 H new ATOM 1892 N GLU B 90 -10.791 95.143 20.328 1.00 0.00 N ATOM 1893 CA GLU B 90 -10.944 96.586 20.693 1.00 0.00 C ATOM 1894 C GLU B 90 -9.672 97.359 20.348 1.00 0.00 C ATOM 1895 O GLU B 90 -9.752 98.459 19.792 1.00 0.00 O ATOM 1896 CB GLU B 90 -11.242 96.725 22.186 1.00 0.00 C ATOM 1897 CG GLU B 90 -12.635 96.163 22.481 1.00 0.00 C ATOM 1898 CD GLU B 90 -13.701 97.116 21.953 1.00 0.00 C ATOM 1899 OE1 GLU B 90 -14.096 98.001 22.694 1.00 0.00 O ATOM 1900 OE2 GLU B 90 -14.104 96.952 20.813 1.00 0.00 O ATOM 0 H GLU B 90 -10.832 94.496 21.116 1.00 0.00 H new ATOM 0 HA GLU B 90 -11.776 96.999 20.123 1.00 0.00 H new ATOM 0 HB2 GLU B 90 -10.492 96.191 22.769 1.00 0.00 H new ATOM 0 HB3 GLU B 90 -11.190 97.773 22.482 1.00 0.00 H new ATOM 0 HG2 GLU B 90 -12.748 95.184 22.016 1.00 0.00 H new ATOM 0 HG3 GLU B 90 -12.760 96.022 23.555 1.00 0.00 H new ATOM 1907 N VAL B 91 -8.508 96.819 20.659 1.00 0.00 N ATOM 1908 CA VAL B 91 -7.234 97.547 20.341 1.00 0.00 C ATOM 1909 C VAL B 91 -7.015 97.569 18.828 1.00 0.00 C ATOM 1910 O VAL B 91 -6.497 98.555 18.294 1.00 0.00 O ATOM 1911 CB VAL B 91 -6.013 96.927 21.052 1.00 0.00 C ATOM 1912 CG1 VAL B 91 -6.132 97.126 22.563 1.00 0.00 C ATOM 1913 CG2 VAL B 91 -5.904 95.428 20.769 1.00 0.00 C ATOM 0 H VAL B 91 -8.389 95.914 21.115 1.00 0.00 H new ATOM 0 HA VAL B 91 -7.335 98.567 20.712 1.00 0.00 H new ATOM 0 HB VAL B 91 -5.123 97.427 20.670 1.00 0.00 H new ATOM 0 HG11 VAL B 91 -5.266 96.685 23.057 1.00 0.00 H new ATOM 0 HG12 VAL B 91 -6.175 98.192 22.787 1.00 0.00 H new ATOM 0 HG13 VAL B 91 -7.040 96.643 22.923 1.00 0.00 H new ATOM 0 HG21 VAL B 91 -5.033 95.023 21.285 1.00 0.00 H new ATOM 0 HG22 VAL B 91 -6.803 94.924 21.124 1.00 0.00 H new ATOM 0 HG23 VAL B 91 -5.798 95.267 19.696 1.00 0.00 H new ATOM 1923 N PHE B 92 -7.412 96.525 18.123 1.00 0.00 N ATOM 1924 CA PHE B 92 -7.236 96.502 16.635 1.00 0.00 C ATOM 1925 C PHE B 92 -8.182 97.530 16.018 1.00 0.00 C ATOM 1926 O PHE B 92 -7.793 98.295 15.129 1.00 0.00 O ATOM 1927 CB PHE B 92 -7.533 95.100 16.082 1.00 0.00 C ATOM 1928 CG PHE B 92 -7.216 95.054 14.600 1.00 0.00 C ATOM 1929 CD1 PHE B 92 -6.010 94.501 14.151 1.00 0.00 C ATOM 1930 CD2 PHE B 92 -8.133 95.571 13.677 1.00 0.00 C ATOM 1931 CE1 PHE B 92 -5.723 94.465 12.782 1.00 0.00 C ATOM 1932 CE2 PHE B 92 -7.845 95.534 12.308 1.00 0.00 C ATOM 1933 CZ PHE B 92 -6.641 94.982 11.860 1.00 0.00 C ATOM 0 H PHE B 92 -7.849 95.692 18.518 1.00 0.00 H new ATOM 0 HA PHE B 92 -6.205 96.750 16.381 1.00 0.00 H new ATOM 0 HB2 PHE B 92 -6.939 94.356 16.613 1.00 0.00 H new ATOM 0 HB3 PHE B 92 -8.581 94.849 16.247 1.00 0.00 H new ATOM 0 HD1 PHE B 92 -5.301 94.102 14.862 1.00 0.00 H new ATOM 0 HD2 PHE B 92 -9.063 95.999 14.022 1.00 0.00 H new ATOM 0 HE1 PHE B 92 -4.793 94.038 12.436 1.00 0.00 H new ATOM 0 HE2 PHE B 92 -8.553 95.932 11.597 1.00 0.00 H new ATOM 0 HZ PHE B 92 -6.419 94.954 10.803 1.00 0.00 H new ATOM 1943 N PHE B 93 -9.410 97.555 16.477 1.00 0.00 N ATOM 1944 CA PHE B 93 -10.416 98.524 15.945 1.00 0.00 C ATOM 1945 C PHE B 93 -9.997 99.947 16.316 1.00 0.00 C ATOM 1946 O PHE B 93 -10.256 100.891 15.562 1.00 0.00 O ATOM 1947 CB PHE B 93 -11.803 98.219 16.549 1.00 0.00 C ATOM 1948 CG PHE B 93 -12.614 97.322 15.628 1.00 0.00 C ATOM 1949 CD1 PHE B 93 -12.190 96.010 15.368 1.00 0.00 C ATOM 1950 CD2 PHE B 93 -13.794 97.802 15.041 1.00 0.00 C ATOM 1951 CE1 PHE B 93 -12.945 95.184 14.524 1.00 0.00 C ATOM 1952 CE2 PHE B 93 -14.546 96.975 14.198 1.00 0.00 C ATOM 1953 CZ PHE B 93 -14.122 95.666 13.940 1.00 0.00 C ATOM 0 H PHE B 93 -9.761 96.936 17.208 1.00 0.00 H new ATOM 0 HA PHE B 93 -10.469 98.431 14.860 1.00 0.00 H new ATOM 0 HB2 PHE B 93 -11.683 97.736 17.519 1.00 0.00 H new ATOM 0 HB3 PHE B 93 -12.341 99.151 16.721 1.00 0.00 H new ATOM 0 HD1 PHE B 93 -11.282 95.637 15.818 1.00 0.00 H new ATOM 0 HD2 PHE B 93 -14.123 98.811 15.240 1.00 0.00 H new ATOM 0 HE1 PHE B 93 -12.618 94.174 14.324 1.00 0.00 H new ATOM 0 HE2 PHE B 93 -15.454 97.347 13.746 1.00 0.00 H new ATOM 0 HZ PHE B 93 -14.703 95.028 13.290 1.00 0.00 H new ATOM 1963 N ARG B 94 -9.378 100.121 17.467 1.00 0.00 N ATOM 1964 CA ARG B 94 -8.960 101.482 17.914 1.00 0.00 C ATOM 1965 C ARG B 94 -7.900 102.059 16.979 1.00 0.00 C ATOM 1966 O ARG B 94 -7.991 103.231 16.600 1.00 0.00 O ATOM 1967 CB ARG B 94 -8.404 101.426 19.348 1.00 0.00 C ATOM 1968 CG ARG B 94 -9.554 101.447 20.393 1.00 0.00 C ATOM 1969 CD ARG B 94 -9.309 102.536 21.447 1.00 0.00 C ATOM 1970 NE ARG B 94 -10.420 102.544 22.458 1.00 0.00 N ATOM 1971 CZ ARG B 94 -10.252 103.028 23.682 1.00 0.00 C ATOM 1972 NH1 ARG B 94 -11.251 102.993 24.521 1.00 0.00 N ATOM 1973 NH2 ARG B 94 -9.109 103.550 24.073 1.00 0.00 N ATOM 0 H ARG B 94 -9.146 99.368 18.115 1.00 0.00 H new ATOM 0 HA ARG B 94 -9.838 102.128 17.892 1.00 0.00 H new ATOM 0 HB2 ARG B 94 -7.808 100.522 19.476 1.00 0.00 H new ATOM 0 HB3 ARG B 94 -7.739 102.273 19.517 1.00 0.00 H new ATOM 0 HG2 ARG B 94 -10.505 101.627 19.891 1.00 0.00 H new ATOM 0 HG3 ARG B 94 -9.629 100.474 20.879 1.00 0.00 H new ATOM 0 HD2 ARG B 94 -8.356 102.361 21.946 1.00 0.00 H new ATOM 0 HD3 ARG B 94 -9.241 103.511 20.964 1.00 0.00 H new ATOM 0 HE ARG B 94 -11.330 102.166 22.196 1.00 0.00 H new ATOM 0 HH11 ARG B 94 -12.146 102.597 24.232 1.00 0.00 H new ATOM 0 HH12 ARG B 94 -11.137 103.361 25.465 1.00 0.00 H new ATOM 0 HH21 ARG B 94 -8.320 103.591 23.428 1.00 0.00 H new ATOM 0 HH22 ARG B 94 -9.012 103.914 25.021 1.00 0.00 H new ATOM 1987 N VAL B 95 -6.888 101.287 16.619 1.00 0.00 N ATOM 1988 CA VAL B 95 -5.811 101.839 15.725 1.00 0.00 C ATOM 1989 C VAL B 95 -6.359 102.035 14.299 1.00 0.00 C ATOM 1990 O VAL B 95 -6.054 103.047 13.655 1.00 0.00 O ATOM 1991 CB VAL B 95 -4.496 100.983 15.755 1.00 0.00 C ATOM 1992 CG1 VAL B 95 -4.212 100.439 17.172 1.00 0.00 C ATOM 1993 CG2 VAL B 95 -4.530 99.799 14.771 1.00 0.00 C ATOM 0 H VAL B 95 -6.765 100.315 16.902 1.00 0.00 H new ATOM 0 HA VAL B 95 -5.520 102.815 16.114 1.00 0.00 H new ATOM 0 HB VAL B 95 -3.699 101.661 15.449 1.00 0.00 H new ATOM 0 HG11 VAL B 95 -3.295 99.851 17.159 1.00 0.00 H new ATOM 0 HG12 VAL B 95 -4.099 101.272 17.866 1.00 0.00 H new ATOM 0 HG13 VAL B 95 -5.042 99.810 17.493 1.00 0.00 H new ATOM 0 HG21 VAL B 95 -3.594 99.244 14.837 1.00 0.00 H new ATOM 0 HG22 VAL B 95 -5.361 99.140 15.023 1.00 0.00 H new ATOM 0 HG23 VAL B 95 -4.659 100.173 13.756 1.00 0.00 H new ATOM 2003 N ALA B 96 -7.161 101.109 13.799 1.00 0.00 N ATOM 2004 CA ALA B 96 -7.730 101.263 12.414 1.00 0.00 C ATOM 2005 C ALA B 96 -8.680 102.458 12.396 1.00 0.00 C ATOM 2006 O ALA B 96 -8.633 103.287 11.481 1.00 0.00 O ATOM 2007 CB ALA B 96 -8.501 100.004 11.984 1.00 0.00 C ATOM 0 H ALA B 96 -7.442 100.260 14.289 1.00 0.00 H new ATOM 0 HA ALA B 96 -6.905 101.416 11.718 1.00 0.00 H new ATOM 0 HB1 ALA B 96 -8.900 100.147 10.980 1.00 0.00 H new ATOM 0 HB2 ALA B 96 -7.829 99.146 11.989 1.00 0.00 H new ATOM 0 HB3 ALA B 96 -9.322 99.825 12.678 1.00 0.00 H new ATOM 2013 N ALA B 97 -9.547 102.546 13.380 1.00 0.00 N ATOM 2014 CA ALA B 97 -10.535 103.670 13.441 1.00 0.00 C ATOM 2015 C ALA B 97 -9.808 105.004 13.566 1.00 0.00 C ATOM 2016 O ALA B 97 -10.242 106.001 12.987 1.00 0.00 O ATOM 2017 CB ALA B 97 -11.472 103.485 14.636 1.00 0.00 C ATOM 0 H ALA B 97 -9.611 101.880 14.150 1.00 0.00 H new ATOM 0 HA ALA B 97 -11.121 103.666 12.522 1.00 0.00 H new ATOM 0 HB1 ALA B 97 -12.186 104.308 14.670 1.00 0.00 H new ATOM 0 HB2 ALA B 97 -12.010 102.542 14.534 1.00 0.00 H new ATOM 0 HB3 ALA B 97 -10.889 103.472 15.557 1.00 0.00 H new ATOM 2023 N ASP B 98 -8.731 105.046 14.317 1.00 0.00 N ATOM 2024 CA ASP B 98 -7.971 106.324 14.497 1.00 0.00 C ATOM 2025 C ASP B 98 -7.402 106.779 13.153 1.00 0.00 C ATOM 2026 O ASP B 98 -7.503 107.960 12.792 1.00 0.00 O ATOM 2027 CB ASP B 98 -6.831 106.121 15.503 1.00 0.00 C ATOM 2028 CG ASP B 98 -6.590 107.404 16.291 1.00 0.00 C ATOM 2029 OD1 ASP B 98 -5.904 108.273 15.777 1.00 0.00 O ATOM 2030 OD2 ASP B 98 -7.095 107.500 17.397 1.00 0.00 O ATOM 0 H ASP B 98 -8.345 104.244 14.815 1.00 0.00 H new ATOM 0 HA ASP B 98 -8.647 107.089 14.879 1.00 0.00 H new ATOM 0 HB2 ASP B 98 -7.079 105.308 16.185 1.00 0.00 H new ATOM 0 HB3 ASP B 98 -5.921 105.831 14.978 1.00 0.00 H new ATOM 2035 N MET B 99 -6.809 105.866 12.413 1.00 0.00 N ATOM 2036 CA MET B 99 -6.217 106.220 11.086 1.00 0.00 C ATOM 2037 C MET B 99 -7.318 106.746 10.173 1.00 0.00 C ATOM 2038 O MET B 99 -7.120 107.732 9.455 1.00 0.00 O ATOM 2039 CB MET B 99 -5.557 104.988 10.456 1.00 0.00 C ATOM 2040 CG MET B 99 -4.764 105.403 9.214 1.00 0.00 C ATOM 2041 SD MET B 99 -4.307 103.926 8.270 1.00 0.00 S ATOM 2042 CE MET B 99 -5.740 103.898 7.165 1.00 0.00 C ATOM 0 H MET B 99 -6.711 104.886 12.677 1.00 0.00 H new ATOM 0 HA MET B 99 -5.456 106.989 11.222 1.00 0.00 H new ATOM 0 HB2 MET B 99 -4.895 104.509 11.178 1.00 0.00 H new ATOM 0 HB3 MET B 99 -6.317 104.255 10.185 1.00 0.00 H new ATOM 0 HG2 MET B 99 -5.361 106.073 8.595 1.00 0.00 H new ATOM 0 HG3 MET B 99 -3.869 105.952 9.507 1.00 0.00 H new ATOM 0 HE1 MET B 99 -6.361 103.032 7.396 1.00 0.00 H new ATOM 0 HE2 MET B 99 -6.323 104.809 7.302 1.00 0.00 H new ATOM 0 HE3 MET B 99 -5.401 103.836 6.131 1.00 0.00 H new ATOM 2052 N PHE B 100 -8.467 106.112 10.186 1.00 0.00 N ATOM 2053 CA PHE B 100 -9.602 106.569 9.322 1.00 0.00 C ATOM 2054 C PHE B 100 -10.255 107.812 9.940 1.00 0.00 C ATOM 2055 O PHE B 100 -10.884 108.604 9.232 1.00 0.00 O ATOM 2056 CB PHE B 100 -10.643 105.453 9.180 1.00 0.00 C ATOM 2057 CG PHE B 100 -11.602 105.793 8.062 1.00 0.00 C ATOM 2058 CD1 PHE B 100 -12.784 106.486 8.347 1.00 0.00 C ATOM 2059 CD2 PHE B 100 -11.311 105.416 6.745 1.00 0.00 C ATOM 2060 CE1 PHE B 100 -13.675 106.805 7.316 1.00 0.00 C ATOM 2061 CE2 PHE B 100 -12.203 105.735 5.713 1.00 0.00 C ATOM 2062 CZ PHE B 100 -13.386 106.430 5.999 1.00 0.00 C ATOM 0 H PHE B 100 -8.668 105.294 10.761 1.00 0.00 H new ATOM 0 HA PHE B 100 -9.215 106.817 8.334 1.00 0.00 H new ATOM 0 HB2 PHE B 100 -10.148 104.504 8.972 1.00 0.00 H new ATOM 0 HB3 PHE B 100 -11.188 105.330 10.116 1.00 0.00 H new ATOM 0 HD1 PHE B 100 -13.009 106.775 9.363 1.00 0.00 H new ATOM 0 HD2 PHE B 100 -10.400 104.880 6.525 1.00 0.00 H new ATOM 0 HE1 PHE B 100 -14.586 107.341 7.537 1.00 0.00 H new ATOM 0 HE2 PHE B 100 -11.979 105.445 4.697 1.00 0.00 H new ATOM 0 HZ PHE B 100 -14.074 106.676 5.204 1.00 0.00 H new ATOM 2072 N SER B 101 -10.132 107.987 11.244 1.00 0.00 N ATOM 2073 CA SER B 101 -10.753 109.163 11.929 1.00 0.00 C ATOM 2074 C SER B 101 -10.151 110.475 11.419 1.00 0.00 C ATOM 2075 O SER B 101 -10.892 111.443 11.210 1.00 0.00 O ATOM 2076 CB SER B 101 -10.575 109.057 13.449 1.00 0.00 C ATOM 2077 OG SER B 101 -11.448 108.054 13.952 1.00 0.00 O ATOM 0 H SER B 101 -9.622 107.356 11.862 1.00 0.00 H new ATOM 0 HA SER B 101 -11.818 109.161 11.699 1.00 0.00 H new ATOM 0 HB2 SER B 101 -9.541 108.810 13.690 1.00 0.00 H new ATOM 0 HB3 SER B 101 -10.792 110.015 13.921 1.00 0.00 H new ATOM 0 HG SER B 101 -11.130 107.171 13.669 1.00 0.00 H new ATOM 2083 N ASP B 102 -8.843 110.550 11.215 1.00 0.00 N ATOM 2084 CA ASP B 102 -8.234 111.834 10.720 1.00 0.00 C ATOM 2085 C ASP B 102 -8.249 111.900 9.186 1.00 0.00 C ATOM 2086 O ASP B 102 -7.868 112.923 8.607 1.00 0.00 O ATOM 2087 CB ASP B 102 -6.790 111.972 11.210 1.00 0.00 C ATOM 2088 CG ASP B 102 -6.009 110.671 11.011 1.00 0.00 C ATOM 2089 OD1 ASP B 102 -5.186 110.366 11.859 1.00 0.00 O ATOM 2090 OD2 ASP B 102 -6.237 110.004 10.015 1.00 0.00 O ATOM 0 H ASP B 102 -8.184 109.787 11.369 1.00 0.00 H new ATOM 0 HA ASP B 102 -8.835 112.652 11.118 1.00 0.00 H new ATOM 0 HB2 ASP B 102 -6.297 112.781 10.671 1.00 0.00 H new ATOM 0 HB3 ASP B 102 -6.786 112.243 12.266 1.00 0.00 H new ATOM 2095 N GLY B 103 -8.694 110.856 8.528 1.00 0.00 N ATOM 2096 CA GLY B 103 -8.762 110.857 7.029 1.00 0.00 C ATOM 2097 C GLY B 103 -7.375 110.649 6.415 1.00 0.00 C ATOM 2098 O GLY B 103 -7.173 110.961 5.236 1.00 0.00 O ATOM 0 H GLY B 103 -9.016 109.994 8.969 1.00 0.00 H new ATOM 0 HA2 GLY B 103 -9.435 110.068 6.692 1.00 0.00 H new ATOM 0 HA3 GLY B 103 -9.179 111.802 6.681 1.00 0.00 H new ATOM 2102 N ASN B 104 -6.422 110.140 7.172 1.00 0.00 N ATOM 2103 CA ASN B 104 -5.047 109.921 6.622 1.00 0.00 C ATOM 2104 C ASN B 104 -4.969 108.522 6.014 1.00 0.00 C ATOM 2105 O ASN B 104 -5.737 107.631 6.390 1.00 0.00 O ATOM 2106 CB ASN B 104 -3.993 110.082 7.734 1.00 0.00 C ATOM 2107 CG ASN B 104 -2.884 111.033 7.284 1.00 0.00 C ATOM 2108 OD1 ASN B 104 -1.782 110.593 6.957 1.00 0.00 O ATOM 2109 ND2 ASN B 104 -3.116 112.316 7.246 1.00 0.00 N ATOM 0 H ASN B 104 -6.543 109.868 8.148 1.00 0.00 H new ATOM 0 HA ASN B 104 -4.842 110.663 5.851 1.00 0.00 H new ATOM 0 HB2 ASN B 104 -4.465 110.466 8.638 1.00 0.00 H new ATOM 0 HB3 ASN B 104 -3.568 109.110 7.984 1.00 0.00 H new ATOM 0 HD21 ASN B 104 -2.383 112.958 6.945 1.00 0.00 H new ATOM 0 HD22 ASN B 104 -4.030 112.677 7.518 1.00 0.00 H new ATOM 2116 N PHE B 105 -4.062 108.320 5.084 1.00 0.00 N ATOM 2117 CA PHE B 105 -3.908 106.999 4.432 1.00 0.00 C ATOM 2118 C PHE B 105 -2.524 106.963 3.776 1.00 0.00 C ATOM 2119 O PHE B 105 -1.692 107.847 4.006 1.00 0.00 O ATOM 2120 CB PHE B 105 -5.032 106.805 3.379 1.00 0.00 C ATOM 2121 CG PHE B 105 -5.839 105.553 3.668 1.00 0.00 C ATOM 2122 CD1 PHE B 105 -5.448 104.326 3.116 1.00 0.00 C ATOM 2123 CD2 PHE B 105 -6.972 105.621 4.487 1.00 0.00 C ATOM 2124 CE1 PHE B 105 -6.190 103.170 3.382 1.00 0.00 C ATOM 2125 CE2 PHE B 105 -7.714 104.465 4.753 1.00 0.00 C ATOM 2126 CZ PHE B 105 -7.324 103.239 4.200 1.00 0.00 C ATOM 0 H PHE B 105 -3.415 109.035 4.751 1.00 0.00 H new ATOM 0 HA PHE B 105 -3.990 106.190 5.157 1.00 0.00 H new ATOM 0 HB2 PHE B 105 -5.690 107.674 3.380 1.00 0.00 H new ATOM 0 HB3 PHE B 105 -4.594 106.738 2.383 1.00 0.00 H new ATOM 0 HD1 PHE B 105 -4.573 104.272 2.485 1.00 0.00 H new ATOM 0 HD2 PHE B 105 -7.274 106.566 4.914 1.00 0.00 H new ATOM 0 HE1 PHE B 105 -5.888 102.225 2.956 1.00 0.00 H new ATOM 0 HE2 PHE B 105 -8.588 104.518 5.385 1.00 0.00 H new ATOM 0 HZ PHE B 105 -7.898 102.347 4.404 1.00 0.00 H new ATOM 2136 N ASN B 106 -2.281 105.965 2.976 1.00 0.00 N ATOM 2137 CA ASN B 106 -0.969 105.820 2.274 1.00 0.00 C ATOM 2138 C ASN B 106 -1.172 104.928 1.054 1.00 0.00 C ATOM 2139 O ASN B 106 -2.226 104.297 0.914 1.00 0.00 O ATOM 2140 CB ASN B 106 0.062 105.178 3.206 1.00 0.00 C ATOM 2141 CG ASN B 106 0.406 106.127 4.350 1.00 0.00 C ATOM 2142 OD1 ASN B 106 -0.322 106.197 5.339 1.00 0.00 O ATOM 2143 ND2 ASN B 106 1.472 106.874 4.265 1.00 0.00 N ATOM 0 H ASN B 106 -2.951 105.224 2.772 1.00 0.00 H new ATOM 0 HA ASN B 106 -0.604 106.802 1.973 1.00 0.00 H new ATOM 0 HB2 ASN B 106 -0.331 104.243 3.606 1.00 0.00 H new ATOM 0 HB3 ASN B 106 0.964 104.931 2.646 1.00 0.00 H new ATOM 0 HD21 ASN B 106 1.704 107.519 5.020 1.00 0.00 H new ATOM 0 HD22 ASN B 106 2.073 106.813 3.443 1.00 0.00 H new ATOM 2150 N TRP B 107 -0.190 104.848 0.179 1.00 0.00 N ATOM 2151 CA TRP B 107 -0.323 103.978 -1.032 1.00 0.00 C ATOM 2152 C TRP B 107 0.492 102.699 -0.819 1.00 0.00 C ATOM 2153 O TRP B 107 1.639 102.741 -0.368 1.00 0.00 O ATOM 2154 CB TRP B 107 0.145 104.726 -2.296 1.00 0.00 C ATOM 2155 CG TRP B 107 -0.002 103.838 -3.499 1.00 0.00 C ATOM 2156 CD1 TRP B 107 0.992 103.548 -4.369 1.00 0.00 C ATOM 2157 CD2 TRP B 107 -1.178 103.109 -3.962 1.00 0.00 C ATOM 2158 NE1 TRP B 107 0.504 102.687 -5.334 1.00 0.00 N ATOM 2159 CE2 TRP B 107 -0.829 102.388 -5.128 1.00 0.00 C ATOM 2160 CE3 TRP B 107 -2.501 103.004 -3.489 1.00 0.00 C ATOM 2161 CZ2 TRP B 107 -1.760 101.591 -5.800 1.00 0.00 C ATOM 2162 CZ3 TRP B 107 -3.437 102.202 -4.164 1.00 0.00 C ATOM 2163 CH2 TRP B 107 -3.066 101.497 -5.315 1.00 0.00 C ATOM 0 H TRP B 107 0.695 105.349 0.255 1.00 0.00 H new ATOM 0 HA TRP B 107 -1.371 103.716 -1.177 1.00 0.00 H new ATOM 0 HB2 TRP B 107 -0.442 105.635 -2.430 1.00 0.00 H new ATOM 0 HB3 TRP B 107 1.185 105.032 -2.184 1.00 0.00 H new ATOM 0 HD1 TRP B 107 2.002 103.927 -4.318 1.00 0.00 H new ATOM 0 HE1 TRP B 107 1.061 102.317 -6.105 1.00 0.00 H new ATOM 0 HE3 TRP B 107 -2.798 103.543 -2.602 1.00 0.00 H new ATOM 0 HZ2 TRP B 107 -1.471 101.051 -6.689 1.00 0.00 H new ATOM 0 HZ3 TRP B 107 -4.448 102.129 -3.793 1.00 0.00 H new ATOM 0 HH2 TRP B 107 -3.790 100.881 -5.828 1.00 0.00 H new ATOM 2174 N GLY B 108 -0.101 101.573 -1.141 1.00 0.00 N ATOM 2175 CA GLY B 108 0.583 100.248 -0.980 1.00 0.00 C ATOM 2176 C GLY B 108 0.789 99.910 0.503 1.00 0.00 C ATOM 2177 O GLY B 108 1.377 98.872 0.823 1.00 0.00 O ATOM 0 H GLY B 108 -1.048 101.515 -1.516 1.00 0.00 H new ATOM 0 HA2 GLY B 108 -0.012 99.468 -1.455 1.00 0.00 H new ATOM 0 HA3 GLY B 108 1.547 100.268 -1.489 1.00 0.00 H new ATOM 2181 N ARG B 109 0.295 100.734 1.407 1.00 0.00 N ATOM 2182 CA ARG B 109 0.424 100.440 2.870 1.00 0.00 C ATOM 2183 C ARG B 109 -0.817 99.665 3.330 1.00 0.00 C ATOM 2184 O ARG B 109 -0.749 98.865 4.267 1.00 0.00 O ATOM 2185 CB ARG B 109 0.577 101.757 3.665 1.00 0.00 C ATOM 2186 CG ARG B 109 1.766 101.678 4.665 1.00 0.00 C ATOM 2187 CD ARG B 109 1.286 101.351 6.095 1.00 0.00 C ATOM 2188 NE ARG B 109 1.763 99.991 6.516 1.00 0.00 N ATOM 2189 CZ ARG B 109 1.500 99.500 7.721 1.00 0.00 C ATOM 2190 NH1 ARG B 109 1.977 98.332 8.050 1.00 0.00 N ATOM 2191 NH2 ARG B 109 0.764 100.157 8.593 1.00 0.00 N ATOM 0 H ARG B 109 -0.194 101.602 1.188 1.00 0.00 H new ATOM 0 HA ARG B 109 1.312 99.835 3.051 1.00 0.00 H new ATOM 0 HB2 ARG B 109 0.734 102.585 2.974 1.00 0.00 H new ATOM 0 HB3 ARG B 109 -0.345 101.966 4.208 1.00 0.00 H new ATOM 0 HG2 ARG B 109 2.470 100.915 4.334 1.00 0.00 H new ATOM 0 HG3 ARG B 109 2.302 102.627 4.669 1.00 0.00 H new ATOM 0 HD2 ARG B 109 1.658 102.104 6.790 1.00 0.00 H new ATOM 0 HD3 ARG B 109 0.197 101.389 6.136 1.00 0.00 H new ATOM 0 HE ARG B 109 2.304 99.429 5.858 1.00 0.00 H new ATOM 0 HH11 ARG B 109 2.545 97.807 7.385 1.00 0.00 H new ATOM 0 HH12 ARG B 109 1.782 97.943 8.973 1.00 0.00 H new ATOM 0 HH21 ARG B 109 0.378 101.070 8.350 1.00 0.00 H new ATOM 0 HH22 ARG B 109 0.579 99.753 9.511 1.00 0.00 H new ATOM 2205 N VAL B 110 -1.944 99.898 2.683 1.00 0.00 N ATOM 2206 CA VAL B 110 -3.211 99.202 3.052 1.00 0.00 C ATOM 2207 C VAL B 110 -3.009 97.690 2.919 1.00 0.00 C ATOM 2208 O VAL B 110 -3.508 96.920 3.748 1.00 0.00 O ATOM 2209 CB VAL B 110 -4.361 99.702 2.150 1.00 0.00 C ATOM 2210 CG1 VAL B 110 -4.072 99.389 0.675 1.00 0.00 C ATOM 2211 CG2 VAL B 110 -5.682 99.041 2.563 1.00 0.00 C ATOM 0 H VAL B 110 -2.031 100.552 1.905 1.00 0.00 H new ATOM 0 HA VAL B 110 -3.477 99.424 4.085 1.00 0.00 H new ATOM 0 HB VAL B 110 -4.442 100.782 2.271 1.00 0.00 H new ATOM 0 HG11 VAL B 110 -4.895 99.750 0.058 1.00 0.00 H new ATOM 0 HG12 VAL B 110 -3.148 99.883 0.373 1.00 0.00 H new ATOM 0 HG13 VAL B 110 -3.967 98.312 0.545 1.00 0.00 H new ATOM 0 HG21 VAL B 110 -6.485 99.401 1.920 1.00 0.00 H new ATOM 0 HG22 VAL B 110 -5.594 97.959 2.463 1.00 0.00 H new ATOM 0 HG23 VAL B 110 -5.906 99.293 3.600 1.00 0.00 H new ATOM 2221 N VAL B 111 -2.288 97.255 1.905 1.00 0.00 N ATOM 2222 CA VAL B 111 -2.048 95.786 1.721 1.00 0.00 C ATOM 2223 C VAL B 111 -1.273 95.279 2.940 1.00 0.00 C ATOM 2224 O VAL B 111 -1.538 94.179 3.435 1.00 0.00 O ATOM 2225 CB VAL B 111 -1.253 95.462 0.430 1.00 0.00 C ATOM 2226 CG1 VAL B 111 -1.479 93.991 0.058 1.00 0.00 C ATOM 2227 CG2 VAL B 111 -1.709 96.334 -0.753 1.00 0.00 C ATOM 0 H VAL B 111 -1.858 97.854 1.200 1.00 0.00 H new ATOM 0 HA VAL B 111 -3.015 95.292 1.624 1.00 0.00 H new ATOM 0 HB VAL B 111 -0.200 95.664 0.627 1.00 0.00 H new ATOM 0 HG11 VAL B 111 -0.923 93.756 -0.849 1.00 0.00 H new ATOM 0 HG12 VAL B 111 -1.133 93.353 0.871 1.00 0.00 H new ATOM 0 HG13 VAL B 111 -2.542 93.818 -0.113 1.00 0.00 H new ATOM 0 HG21 VAL B 111 -1.129 96.077 -1.639 1.00 0.00 H new ATOM 0 HG22 VAL B 111 -2.767 96.158 -0.948 1.00 0.00 H new ATOM 0 HG23 VAL B 111 -1.555 97.385 -0.511 1.00 0.00 H new ATOM 2237 N ALA B 112 -0.334 96.067 3.440 1.00 0.00 N ATOM 2238 CA ALA B 112 0.457 95.650 4.643 1.00 0.00 C ATOM 2239 C ALA B 112 -0.511 95.455 5.809 1.00 0.00 C ATOM 2240 O ALA B 112 -0.387 94.489 6.571 1.00 0.00 O ATOM 2241 CB ALA B 112 1.511 96.711 4.995 1.00 0.00 C ATOM 0 H ALA B 112 -0.087 96.981 3.061 1.00 0.00 H new ATOM 0 HA ALA B 112 0.983 94.719 4.433 1.00 0.00 H new ATOM 0 HB1 ALA B 112 2.074 96.388 5.871 1.00 0.00 H new ATOM 0 HB2 ALA B 112 2.192 96.841 4.154 1.00 0.00 H new ATOM 0 HB3 ALA B 112 1.016 97.658 5.210 1.00 0.00 H new ATOM 2247 N LEU B 113 -1.487 96.332 5.942 1.00 0.00 N ATOM 2248 CA LEU B 113 -2.499 96.189 7.039 1.00 0.00 C ATOM 2249 C LEU B 113 -3.293 94.919 6.790 1.00 0.00 C ATOM 2250 O LEU B 113 -3.630 94.206 7.735 1.00 0.00 O ATOM 2251 CB LEU B 113 -3.438 97.408 7.077 1.00 0.00 C ATOM 2252 CG LEU B 113 -4.077 97.540 8.471 1.00 0.00 C ATOM 2253 CD1 LEU B 113 -3.057 98.121 9.457 1.00 0.00 C ATOM 2254 CD2 LEU B 113 -5.294 98.473 8.396 1.00 0.00 C ATOM 0 H LEU B 113 -1.623 97.140 5.335 1.00 0.00 H new ATOM 0 HA LEU B 113 -1.992 96.133 8.002 1.00 0.00 H new ATOM 0 HB2 LEU B 113 -2.881 98.314 6.836 1.00 0.00 H new ATOM 0 HB3 LEU B 113 -4.216 97.302 6.321 1.00 0.00 H new ATOM 0 HG LEU B 113 -4.392 96.554 8.812 1.00 0.00 H new ATOM 0 HD11 LEU B 113 -3.514 98.212 10.442 1.00 0.00 H new ATOM 0 HD12 LEU B 113 -2.193 97.460 9.518 1.00 0.00 H new ATOM 0 HD13 LEU B 113 -2.738 99.105 9.113 1.00 0.00 H new ATOM 0 HD21 LEU B 113 -5.744 98.564 9.385 1.00 0.00 H new ATOM 0 HD22 LEU B 113 -4.977 99.457 8.049 1.00 0.00 H new ATOM 0 HD23 LEU B 113 -6.026 98.061 7.701 1.00 0.00 H new ATOM 2266 N PHE B 114 -3.562 94.603 5.543 1.00 0.00 N ATOM 2267 CA PHE B 114 -4.296 93.343 5.230 1.00 0.00 C ATOM 2268 C PHE B 114 -3.426 92.169 5.691 1.00 0.00 C ATOM 2269 O PHE B 114 -3.945 91.156 6.148 1.00 0.00 O ATOM 2270 CB PHE B 114 -4.577 93.245 3.711 1.00 0.00 C ATOM 2271 CG PHE B 114 -6.068 93.380 3.422 1.00 0.00 C ATOM 2272 CD1 PHE B 114 -6.545 94.455 2.658 1.00 0.00 C ATOM 2273 CD2 PHE B 114 -6.967 92.423 3.916 1.00 0.00 C ATOM 2274 CE1 PHE B 114 -7.915 94.571 2.389 1.00 0.00 C ATOM 2275 CE2 PHE B 114 -8.335 92.541 3.648 1.00 0.00 C ATOM 2276 CZ PHE B 114 -8.809 93.613 2.885 1.00 0.00 C ATOM 0 H PHE B 114 -3.303 95.166 4.733 1.00 0.00 H new ATOM 0 HA PHE B 114 -5.257 93.326 5.745 1.00 0.00 H new ATOM 0 HB2 PHE B 114 -4.029 94.026 3.185 1.00 0.00 H new ATOM 0 HB3 PHE B 114 -4.214 92.290 3.331 1.00 0.00 H new ATOM 0 HD1 PHE B 114 -5.856 95.194 2.277 1.00 0.00 H new ATOM 0 HD2 PHE B 114 -6.602 91.594 4.504 1.00 0.00 H new ATOM 0 HE1 PHE B 114 -8.282 95.398 1.800 1.00 0.00 H new ATOM 0 HE2 PHE B 114 -9.025 91.804 4.031 1.00 0.00 H new ATOM 0 HZ PHE B 114 -9.865 93.702 2.678 1.00 0.00 H new ATOM 2286 N TYR B 115 -2.118 92.297 5.579 1.00 0.00 N ATOM 2287 CA TYR B 115 -1.187 91.206 6.009 1.00 0.00 C ATOM 2288 C TYR B 115 -1.287 91.005 7.541 1.00 0.00 C ATOM 2289 O TYR B 115 -1.354 89.861 8.004 1.00 0.00 O ATOM 2290 CB TYR B 115 0.249 91.565 5.518 1.00 0.00 C ATOM 2291 CG TYR B 115 1.352 91.161 6.492 1.00 0.00 C ATOM 2292 CD1 TYR B 115 1.551 89.814 6.817 1.00 0.00 C ATOM 2293 CD2 TYR B 115 2.173 92.144 7.056 1.00 0.00 C ATOM 2294 CE1 TYR B 115 2.573 89.454 7.707 1.00 0.00 C ATOM 2295 CE2 TYR B 115 3.190 91.788 7.942 1.00 0.00 C ATOM 2296 CZ TYR B 115 3.393 90.442 8.270 1.00 0.00 C ATOM 2297 OH TYR B 115 4.402 90.089 9.143 1.00 0.00 O ATOM 0 H TYR B 115 -1.655 93.124 5.202 1.00 0.00 H new ATOM 0 HA TYR B 115 -1.458 90.249 5.562 1.00 0.00 H new ATOM 0 HB2 TYR B 115 0.427 91.078 4.559 1.00 0.00 H new ATOM 0 HB3 TYR B 115 0.306 92.640 5.345 1.00 0.00 H new ATOM 0 HD1 TYR B 115 0.919 89.054 6.383 1.00 0.00 H new ATOM 0 HD2 TYR B 115 2.019 93.183 6.804 1.00 0.00 H new ATOM 0 HE1 TYR B 115 2.729 88.415 7.959 1.00 0.00 H new ATOM 0 HE2 TYR B 115 3.821 92.550 8.375 1.00 0.00 H new ATOM 0 HH TYR B 115 4.731 89.194 8.918 1.00 0.00 H new ATOM 2307 N PHE B 116 -1.307 92.069 8.326 1.00 0.00 N ATOM 2308 CA PHE B 116 -1.411 91.915 9.816 1.00 0.00 C ATOM 2309 C PHE B 116 -2.848 91.511 10.169 1.00 0.00 C ATOM 2310 O PHE B 116 -3.065 90.566 10.934 1.00 0.00 O ATOM 2311 CB PHE B 116 -0.996 93.246 10.509 1.00 0.00 C ATOM 2312 CG PHE B 116 -1.466 93.328 11.968 1.00 0.00 C ATOM 2313 CD1 PHE B 116 -2.137 94.475 12.416 1.00 0.00 C ATOM 2314 CD2 PHE B 116 -1.238 92.264 12.861 1.00 0.00 C ATOM 2315 CE1 PHE B 116 -2.576 94.561 13.743 1.00 0.00 C ATOM 2316 CE2 PHE B 116 -1.680 92.353 14.186 1.00 0.00 C ATOM 2317 CZ PHE B 116 -2.348 93.500 14.626 1.00 0.00 C ATOM 0 H PHE B 116 -1.256 93.033 7.995 1.00 0.00 H new ATOM 0 HA PHE B 116 -0.737 91.136 10.172 1.00 0.00 H new ATOM 0 HB2 PHE B 116 0.089 93.345 10.475 1.00 0.00 H new ATOM 0 HB3 PHE B 116 -1.410 94.086 9.951 1.00 0.00 H new ATOM 0 HD1 PHE B 116 -2.316 95.294 11.736 1.00 0.00 H new ATOM 0 HD2 PHE B 116 -0.721 91.378 12.523 1.00 0.00 H new ATOM 0 HE1 PHE B 116 -3.091 95.447 14.085 1.00 0.00 H new ATOM 0 HE2 PHE B 116 -1.505 91.535 14.869 1.00 0.00 H new ATOM 0 HZ PHE B 116 -2.688 93.567 15.649 1.00 0.00 H new ATOM 2327 N ALA B 117 -3.817 92.208 9.627 1.00 0.00 N ATOM 2328 CA ALA B 117 -5.249 91.888 9.911 1.00 0.00 C ATOM 2329 C ALA B 117 -5.545 90.461 9.465 1.00 0.00 C ATOM 2330 O ALA B 117 -6.314 89.747 10.116 1.00 0.00 O ATOM 2331 CB ALA B 117 -6.168 92.857 9.165 1.00 0.00 C ATOM 0 H ALA B 117 -3.674 92.994 8.993 1.00 0.00 H new ATOM 0 HA ALA B 117 -5.429 91.986 10.982 1.00 0.00 H new ATOM 0 HB1 ALA B 117 -7.208 92.612 9.381 1.00 0.00 H new ATOM 0 HB2 ALA B 117 -5.961 93.877 9.489 1.00 0.00 H new ATOM 0 HB3 ALA B 117 -5.991 92.774 8.093 1.00 0.00 H new ATOM 2337 N SER B 118 -4.952 90.039 8.370 1.00 0.00 N ATOM 2338 CA SER B 118 -5.190 88.648 7.860 1.00 0.00 C ATOM 2339 C SER B 118 -4.591 87.638 8.834 1.00 0.00 C ATOM 2340 O SER B 118 -5.191 86.592 9.105 1.00 0.00 O ATOM 2341 CB SER B 118 -4.551 88.453 6.483 1.00 0.00 C ATOM 2342 OG SER B 118 -3.155 88.701 6.575 1.00 0.00 O ATOM 0 H SER B 118 -4.312 90.599 7.807 1.00 0.00 H new ATOM 0 HA SER B 118 -6.266 88.495 7.773 1.00 0.00 H new ATOM 0 HB2 SER B 118 -4.729 87.438 6.127 1.00 0.00 H new ATOM 0 HB3 SER B 118 -5.005 89.129 5.759 1.00 0.00 H new ATOM 0 HG SER B 118 -2.974 89.265 7.355 1.00 0.00 H new ATOM 2348 N LYS B 119 -3.413 87.923 9.345 1.00 0.00 N ATOM 2349 CA LYS B 119 -2.732 86.983 10.291 1.00 0.00 C ATOM 2350 C LYS B 119 -3.463 86.936 11.633 1.00 0.00 C ATOM 2351 O LYS B 119 -3.537 85.869 12.254 1.00 0.00 O ATOM 2352 CB LYS B 119 -1.278 87.418 10.508 1.00 0.00 C ATOM 2353 CG LYS B 119 -0.517 86.310 11.242 1.00 0.00 C ATOM 2354 CD LYS B 119 0.973 86.656 11.306 1.00 0.00 C ATOM 2355 CE LYS B 119 1.704 85.608 12.149 1.00 0.00 C ATOM 2356 NZ LYS B 119 1.617 84.278 11.480 1.00 0.00 N ATOM 0 H LYS B 119 -2.891 88.776 9.143 1.00 0.00 H new ATOM 0 HA LYS B 119 -2.750 85.985 9.852 1.00 0.00 H new ATOM 0 HB2 LYS B 119 -0.803 87.627 9.549 1.00 0.00 H new ATOM 0 HB3 LYS B 119 -1.246 88.341 11.087 1.00 0.00 H new ATOM 0 HG2 LYS B 119 -0.915 86.189 12.250 1.00 0.00 H new ATOM 0 HG3 LYS B 119 -0.657 85.359 10.728 1.00 0.00 H new ATOM 0 HD2 LYS B 119 1.394 86.688 10.301 1.00 0.00 H new ATOM 0 HD3 LYS B 119 1.109 87.647 11.740 1.00 0.00 H new ATOM 0 HE2 LYS B 119 2.748 85.894 12.278 1.00 0.00 H new ATOM 0 HE3 LYS B 119 1.263 85.555 13.144 1.00 0.00 H new ATOM 0 HZ1 LYS B 119 2.323 83.635 11.892 1.00 0.00 H new ATOM 0 HZ2 LYS B 119 0.665 83.882 11.618 1.00 0.00 H new ATOM 0 HZ3 LYS B 119 1.802 84.388 10.463 1.00 0.00 H new ATOM 2370 N LEU B 120 -3.968 88.054 12.108 1.00 0.00 N ATOM 2371 CA LEU B 120 -4.659 88.064 13.439 1.00 0.00 C ATOM 2372 C LEU B 120 -5.980 87.296 13.366 1.00 0.00 C ATOM 2373 O LEU B 120 -6.296 86.526 14.280 1.00 0.00 O ATOM 2374 CB LEU B 120 -4.914 89.512 13.885 1.00 0.00 C ATOM 2375 CG LEU B 120 -5.439 89.537 15.329 1.00 0.00 C ATOM 2376 CD1 LEU B 120 -4.302 89.229 16.309 1.00 0.00 C ATOM 2377 CD2 LEU B 120 -6.009 90.922 15.642 1.00 0.00 C ATOM 0 H LEU B 120 -3.931 88.956 11.633 1.00 0.00 H new ATOM 0 HA LEU B 120 -4.015 87.573 14.169 1.00 0.00 H new ATOM 0 HB2 LEU B 120 -3.992 90.090 13.815 1.00 0.00 H new ATOM 0 HB3 LEU B 120 -5.637 89.984 13.219 1.00 0.00 H new ATOM 0 HG LEU B 120 -6.219 88.783 15.434 1.00 0.00 H new ATOM 0 HD11 LEU B 120 -4.685 89.249 17.329 1.00 0.00 H new ATOM 0 HD12 LEU B 120 -3.894 88.241 16.094 1.00 0.00 H new ATOM 0 HD13 LEU B 120 -3.516 89.977 16.202 1.00 0.00 H new ATOM 0 HD21 LEU B 120 -6.381 90.939 16.666 1.00 0.00 H new ATOM 0 HD22 LEU B 120 -5.226 91.672 15.528 1.00 0.00 H new ATOM 0 HD23 LEU B 120 -6.826 91.143 14.955 1.00 0.00 H new ATOM 2389 N VAL B 121 -6.751 87.479 12.316 1.00 0.00 N ATOM 2390 CA VAL B 121 -8.054 86.748 12.196 1.00 0.00 C ATOM 2391 C VAL B 121 -7.794 85.257 11.956 1.00 0.00 C ATOM 2392 O VAL B 121 -8.537 84.406 12.457 1.00 0.00 O ATOM 2393 CB VAL B 121 -8.934 87.348 11.085 1.00 0.00 C ATOM 2394 CG1 VAL B 121 -9.254 88.807 11.428 1.00 0.00 C ATOM 2395 CG2 VAL B 121 -8.209 87.295 9.738 1.00 0.00 C ATOM 0 H VAL B 121 -6.533 88.103 11.539 1.00 0.00 H new ATOM 0 HA VAL B 121 -8.602 86.860 13.132 1.00 0.00 H new ATOM 0 HB VAL B 121 -9.854 86.768 11.013 1.00 0.00 H new ATOM 0 HG11 VAL B 121 -9.877 89.237 10.644 1.00 0.00 H new ATOM 0 HG12 VAL B 121 -9.786 88.849 12.378 1.00 0.00 H new ATOM 0 HG13 VAL B 121 -8.327 89.374 11.506 1.00 0.00 H new ATOM 0 HG21 VAL B 121 -8.846 87.723 8.965 1.00 0.00 H new ATOM 0 HG22 VAL B 121 -7.282 87.865 9.801 1.00 0.00 H new ATOM 0 HG23 VAL B 121 -7.982 86.259 9.488 1.00 0.00 H new ATOM 2405 N LEU B 122 -6.762 84.926 11.203 1.00 0.00 N ATOM 2406 CA LEU B 122 -6.443 83.491 10.924 1.00 0.00 C ATOM 2407 C LEU B 122 -5.974 82.815 12.208 1.00 0.00 C ATOM 2408 O LEU B 122 -6.367 81.681 12.501 1.00 0.00 O ATOM 2409 CB LEU B 122 -5.353 83.383 9.845 1.00 0.00 C ATOM 2410 CG LEU B 122 -5.951 83.663 8.456 1.00 0.00 C ATOM 2411 CD1 LEU B 122 -4.819 83.878 7.446 1.00 0.00 C ATOM 2412 CD2 LEU B 122 -6.804 82.470 8.003 1.00 0.00 C ATOM 0 H LEU B 122 -6.127 85.597 10.770 1.00 0.00 H new ATOM 0 HA LEU B 122 -7.341 82.993 10.559 1.00 0.00 H new ATOM 0 HB2 LEU B 122 -4.553 84.093 10.054 1.00 0.00 H new ATOM 0 HB3 LEU B 122 -4.910 82.387 9.864 1.00 0.00 H new ATOM 0 HG LEU B 122 -6.574 84.556 8.512 1.00 0.00 H new ATOM 0 HD11 LEU B 122 -5.243 84.076 6.461 1.00 0.00 H new ATOM 0 HD12 LEU B 122 -4.210 84.727 7.757 1.00 0.00 H new ATOM 0 HD13 LEU B 122 -4.198 82.984 7.400 1.00 0.00 H new ATOM 0 HD21 LEU B 122 -7.224 82.676 7.018 1.00 0.00 H new ATOM 0 HD22 LEU B 122 -6.182 81.576 7.952 1.00 0.00 H new ATOM 0 HD23 LEU B 122 -7.613 82.309 8.716 1.00 0.00 H new ATOM 2424 N LYS B 123 -5.141 83.488 12.971 1.00 0.00 N ATOM 2425 CA LYS B 123 -4.621 82.906 14.248 1.00 0.00 C ATOM 2426 C LYS B 123 -5.788 82.690 15.204 1.00 0.00 C ATOM 2427 O LYS B 123 -5.899 81.636 15.839 1.00 0.00 O ATOM 2428 CB LYS B 123 -3.599 83.872 14.885 1.00 0.00 C ATOM 2429 CG LYS B 123 -2.387 83.097 15.438 1.00 0.00 C ATOM 2430 CD LYS B 123 -1.635 83.948 16.481 1.00 0.00 C ATOM 2431 CE LYS B 123 -2.290 83.822 17.872 1.00 0.00 C ATOM 2432 NZ LYS B 123 -3.060 85.061 18.172 1.00 0.00 N ATOM 0 H LYS B 123 -4.798 84.425 12.759 1.00 0.00 H new ATOM 0 HA LYS B 123 -4.129 81.955 14.045 1.00 0.00 H new ATOM 0 HB2 LYS B 123 -3.265 84.597 14.143 1.00 0.00 H new ATOM 0 HB3 LYS B 123 -4.075 84.434 15.689 1.00 0.00 H new ATOM 0 HG2 LYS B 123 -2.720 82.164 15.893 1.00 0.00 H new ATOM 0 HG3 LYS B 123 -1.714 82.832 14.623 1.00 0.00 H new ATOM 0 HD2 LYS B 123 -0.594 83.628 16.535 1.00 0.00 H new ATOM 0 HD3 LYS B 123 -1.632 84.993 16.170 1.00 0.00 H new ATOM 0 HE2 LYS B 123 -2.951 82.955 17.898 1.00 0.00 H new ATOM 0 HE3 LYS B 123 -1.526 83.663 18.633 1.00 0.00 H new ATOM 0 HZ1 LYS B 123 -3.155 85.170 19.202 1.00 0.00 H new ATOM 0 HZ2 LYS B 123 -2.559 85.884 17.781 1.00 0.00 H new ATOM 0 HZ3 LYS B 123 -4.005 84.995 17.742 1.00 0.00 H new ATOM 2446 N ALA B 124 -6.647 83.673 15.316 1.00 0.00 N ATOM 2447 CA ALA B 124 -7.822 83.571 16.231 1.00 0.00 C ATOM 2448 C ALA B 124 -8.724 82.417 15.788 1.00 0.00 C ATOM 2449 O ALA B 124 -9.342 81.754 16.628 1.00 0.00 O ATOM 2450 CB ALA B 124 -8.601 84.887 16.217 1.00 0.00 C ATOM 0 H ALA B 124 -6.581 84.553 14.804 1.00 0.00 H new ATOM 0 HA ALA B 124 -7.475 83.377 17.246 1.00 0.00 H new ATOM 0 HB1 ALA B 124 -9.458 84.810 16.886 1.00 0.00 H new ATOM 0 HB2 ALA B 124 -7.953 85.697 16.550 1.00 0.00 H new ATOM 0 HB3 ALA B 124 -8.948 85.094 15.205 1.00 0.00 H new ATOM 2456 N LEU B 125 -8.803 82.159 14.498 1.00 0.00 N ATOM 2457 CA LEU B 125 -9.656 81.037 13.989 1.00 0.00 C ATOM 2458 C LEU B 125 -8.936 79.698 14.238 1.00 0.00 C ATOM 2459 O LEU B 125 -9.587 78.652 14.343 1.00 0.00 O ATOM 2460 CB LEU B 125 -9.937 81.267 12.482 1.00 0.00 C ATOM 2461 CG LEU B 125 -10.359 79.951 11.761 1.00 0.00 C ATOM 2462 CD1 LEU B 125 -11.414 80.242 10.690 1.00 0.00 C ATOM 2463 CD2 LEU B 125 -9.130 79.299 11.108 1.00 0.00 C ATOM 0 H LEU B 125 -8.309 82.682 13.775 1.00 0.00 H new ATOM 0 HA LEU B 125 -10.610 81.006 14.514 1.00 0.00 H new ATOM 0 HB2 LEU B 125 -10.725 82.011 12.369 1.00 0.00 H new ATOM 0 HB3 LEU B 125 -9.045 81.673 12.004 1.00 0.00 H new ATOM 0 HG LEU B 125 -10.784 79.271 12.499 1.00 0.00 H new ATOM 0 HD11 LEU B 125 -11.697 79.312 10.196 1.00 0.00 H new ATOM 0 HD12 LEU B 125 -12.293 80.688 11.156 1.00 0.00 H new ATOM 0 HD13 LEU B 125 -11.004 80.933 9.954 1.00 0.00 H new ATOM 0 HD21 LEU B 125 -9.430 78.380 10.605 1.00 0.00 H new ATOM 0 HD22 LEU B 125 -8.697 79.986 10.381 1.00 0.00 H new ATOM 0 HD23 LEU B 125 -8.390 79.069 11.874 1.00 0.00 H new ATOM 2475 N SER B 126 -7.629 79.716 14.344 1.00 0.00 N ATOM 2476 CA SER B 126 -6.858 78.460 14.595 1.00 0.00 C ATOM 2477 C SER B 126 -6.816 78.166 16.104 1.00 0.00 C ATOM 2478 O SER B 126 -5.888 77.505 16.586 1.00 0.00 O ATOM 2479 CB SER B 126 -5.436 78.604 14.032 1.00 0.00 C ATOM 2480 OG SER B 126 -5.301 77.779 12.882 1.00 0.00 O ATOM 0 H SER B 126 -7.058 80.558 14.266 1.00 0.00 H new ATOM 0 HA SER B 126 -7.349 77.626 14.093 1.00 0.00 H new ATOM 0 HB2 SER B 126 -5.239 79.644 13.773 1.00 0.00 H new ATOM 0 HB3 SER B 126 -4.703 78.319 14.787 1.00 0.00 H new ATOM 0 HG SER B 126 -4.395 77.870 12.519 1.00 0.00 H new ATOM 2486 N THR B 127 -7.795 78.637 16.852 1.00 0.00 N ATOM 2487 CA THR B 127 -7.821 78.391 18.328 1.00 0.00 C ATOM 2488 C THR B 127 -9.194 78.780 18.877 1.00 0.00 C ATOM 2489 O THR B 127 -9.381 79.857 19.458 1.00 0.00 O ATOM 2490 CB THR B 127 -6.705 79.194 19.024 1.00 0.00 C ATOM 2491 OG1 THR B 127 -6.805 79.010 20.428 1.00 0.00 O ATOM 2492 CG2 THR B 127 -6.812 80.699 18.701 1.00 0.00 C ATOM 0 H THR B 127 -8.579 79.184 16.496 1.00 0.00 H new ATOM 0 HA THR B 127 -7.645 77.334 18.525 1.00 0.00 H new ATOM 0 HB THR B 127 -5.744 78.833 18.659 1.00 0.00 H new ATOM 0 HG1 THR B 127 -6.096 79.518 20.876 1.00 0.00 H new ATOM 0 HG21 THR B 127 -6.011 81.238 19.207 1.00 0.00 H new ATOM 0 HG22 THR B 127 -6.726 80.847 17.625 1.00 0.00 H new ATOM 0 HG23 THR B 127 -7.775 81.077 19.043 1.00 0.00 H new ATOM 2500 N LYS B 128 -10.159 77.913 18.695 1.00 0.00 N ATOM 2501 CA LYS B 128 -11.549 78.179 19.182 1.00 0.00 C ATOM 2502 C LYS B 128 -11.510 78.506 20.679 1.00 0.00 C ATOM 2503 O LYS B 128 -12.185 79.436 21.135 1.00 0.00 O ATOM 2504 CB LYS B 128 -12.450 76.944 18.890 1.00 0.00 C ATOM 2505 CG LYS B 128 -13.808 76.994 19.642 1.00 0.00 C ATOM 2506 CD LYS B 128 -14.612 78.240 19.245 1.00 0.00 C ATOM 2507 CE LYS B 128 -15.221 78.047 17.855 1.00 0.00 C ATOM 2508 NZ LYS B 128 -15.895 79.306 17.430 1.00 0.00 N ATOM 0 H LYS B 128 -10.041 77.017 18.222 1.00 0.00 H new ATOM 0 HA LYS B 128 -11.973 79.036 18.658 1.00 0.00 H new ATOM 0 HB2 LYS B 128 -12.636 76.882 17.818 1.00 0.00 H new ATOM 0 HB3 LYS B 128 -11.917 76.037 19.174 1.00 0.00 H new ATOM 0 HG2 LYS B 128 -14.385 76.097 19.417 1.00 0.00 H new ATOM 0 HG3 LYS B 128 -13.632 76.998 20.718 1.00 0.00 H new ATOM 0 HD2 LYS B 128 -15.401 78.422 19.975 1.00 0.00 H new ATOM 0 HD3 LYS B 128 -13.965 79.117 19.249 1.00 0.00 H new ATOM 0 HE2 LYS B 128 -14.444 77.778 17.140 1.00 0.00 H new ATOM 0 HE3 LYS B 128 -15.937 77.226 17.871 1.00 0.00 H new ATOM 0 HZ1 LYS B 128 -16.309 79.176 16.485 1.00 0.00 H new ATOM 0 HZ2 LYS B 128 -16.647 79.543 18.108 1.00 0.00 H new ATOM 0 HZ3 LYS B 128 -15.200 80.079 17.400 1.00 0.00 H new TER 2522 LYS B 128