USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1081 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 77 HIS : no HE2:sc= 0.356 K(o=0.76,f=-1.7) USER MOD Set 1.2: B 159 THR OG1 : rot -30:sc= 0.4 USER MOD Set 2.1: A 19 LYS NZ :NH3+ 171:sc= -0.172 (180deg=-0.399) USER MOD Set 2.2: A 92 SER OG : rot -177:sc= -1.47! USER MOD Single : A 1 LYS NZ :NH3+ -140:sc= -1.27 (180deg=-3.16!) USER MOD Single : A 5 THR OG1 : rot -49:sc= 0.582 USER MOD Single : A 7 ASN : amide:sc= -0.45 X(o=-0.45,f=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A -3 GLY N :NH3+ -110:sc= 0.196 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ -133:sc= -5.82! (180deg=-6.74!) USER MOD Single : A 23 SER OG : rot 180:sc= 0.277 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 20:sc= -1.2 USER MOD Single : A 42 GLN : amide:sc= -0.979 K(o=-0.98,f=-5.4!) USER MOD Single : A 44 LYS NZ :NH3+ 168:sc= 1.25 (180deg=0.805) USER MOD Single : A 45 SER OG : rot -6:sc= 0.677 USER MOD Single : A 57 LYS NZ :NH3+ 164:sc= -0.0258 (180deg=-0.262) USER MOD Single : A 58 MET CE :methyl 165:sc= -0.0838 (180deg=-0.728) USER MOD Single : A 60 THR OG1 : rot 180:sc= -1.03 USER MOD Single : A 66 SER OG : rot 137:sc= 1.12 USER MOD Single : A 68 ASN : amide:sc= -0.588! C(o=-0.59!,f=-6.8!) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.0177 USER MOD Single : A 71 CYS SG : rot 160:sc= 0.823 USER MOD Single : A 75 HIS : no HE2:sc= -1.32 K(o=-1.3,f=-3.2!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= -0.156 X(o=-0.16,f=-0.15) USER MOD Single : A 82 LYS NZ :NH3+ -169:sc=-0.00793 (180deg=-0.212) USER MOD Single : A 85 GLN : amide:sc= -0.217 X(o=-0.22,f=-0.56) USER MOD Single : A 86 SER OG : rot -26:sc= 0.0491 USER MOD Single : A 98 CYS SG : rot -78:sc= 0.212 USER MOD Single : A 101 TYR OH : rot 130:sc= 0.131 USER MOD Single : A 111 ASN : amide:sc= -1.41 K(o=-1.4,f=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 37:sc= 0.0203 USER MOD Single : A 123 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0664) USER MOD Single : B 152 SER OG : rot 180:sc= 0 USER MOD Single : B 153 SER OG : rot -150:sc= 0 USER MOD Single : B 155 THR OG1 : rot -22:sc= 0.816 USER MOD Single : B 160 GLN : amide:sc= 0.279 K(o=0.28,f=-0.5) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -3 113.079 19.572 -23.651 1.00 0.00 N ATOM 2 CA GLY A -3 112.762 19.857 -22.266 1.00 0.00 C ATOM 3 C GLY A -3 113.689 19.118 -21.383 1.00 0.00 C ATOM 4 O GLY A -3 114.485 18.328 -21.866 1.00 0.00 O ATOM 0 H1 GLY A -3 113.488 20.419 -24.095 1.00 0.00 H new ATOM 0 H2 GLY A -3 113.765 18.792 -23.697 1.00 0.00 H new ATOM 0 H3 GLY A -3 112.212 19.300 -24.157 1.00 0.00 H new ATOM 0 HA2 GLY A -3 112.840 20.928 -22.077 1.00 0.00 H new ATOM 0 HA3 GLY A -3 111.733 19.570 -22.051 1.00 0.00 H new ATOM 10 N ALA A -2 113.603 19.355 -20.113 1.00 0.00 N ATOM 11 CA ALA A -2 114.454 18.703 -19.171 1.00 0.00 C ATOM 12 C ALA A -2 113.864 17.350 -18.790 1.00 0.00 C ATOM 13 O ALA A -2 112.935 17.261 -17.977 1.00 0.00 O ATOM 14 CB ALA A -2 114.663 19.595 -17.957 1.00 0.00 C ATOM 0 H ALA A -2 112.938 20.008 -19.699 1.00 0.00 H new ATOM 0 HA ALA A -2 115.431 18.523 -19.619 1.00 0.00 H new ATOM 0 HB1 ALA A -2 115.314 19.091 -17.243 1.00 0.00 H new ATOM 0 HB2 ALA A -2 115.124 20.532 -18.269 1.00 0.00 H new ATOM 0 HB3 ALA A -2 113.701 19.803 -17.488 1.00 0.00 H new ATOM 20 N MET A -1 114.383 16.311 -19.390 1.00 0.00 N ATOM 21 CA MET A -1 113.922 14.960 -19.145 1.00 0.00 C ATOM 22 C MET A -1 115.106 14.075 -18.807 1.00 0.00 C ATOM 23 O MET A -1 116.232 14.361 -19.219 1.00 0.00 O ATOM 24 CB MET A -1 113.191 14.389 -20.377 1.00 0.00 C ATOM 25 CG MET A -1 111.922 15.130 -20.780 1.00 0.00 C ATOM 26 SD MET A -1 110.658 15.101 -19.495 1.00 0.00 S ATOM 27 CE MET A -1 109.325 15.988 -20.299 1.00 0.00 C ATOM 0 H MET A -1 115.143 16.374 -20.068 1.00 0.00 H new ATOM 0 HA MET A -1 113.222 14.984 -18.310 1.00 0.00 H new ATOM 0 HB2 MET A -1 113.879 14.394 -21.222 1.00 0.00 H new ATOM 0 HB3 MET A -1 112.937 13.348 -20.178 1.00 0.00 H new ATOM 0 HG2 MET A -1 112.170 16.165 -21.016 1.00 0.00 H new ATOM 0 HG3 MET A -1 111.519 14.684 -21.689 1.00 0.00 H new ATOM 0 HE1 MET A -1 108.471 16.051 -19.625 1.00 0.00 H new ATOM 0 HE2 MET A -1 109.660 16.993 -20.555 1.00 0.00 H new ATOM 0 HE3 MET A -1 109.032 15.460 -21.207 1.00 0.00 H new ATOM 37 N GLY A 0 114.865 13.026 -18.063 1.00 0.00 N ATOM 38 CA GLY A 0 115.918 12.097 -17.723 1.00 0.00 C ATOM 39 C GLY A 0 116.645 12.462 -16.441 1.00 0.00 C ATOM 40 O GLY A 0 117.789 12.031 -16.220 1.00 0.00 O ATOM 0 H GLY A 0 113.949 12.792 -17.680 1.00 0.00 H new ATOM 0 HA2 GLY A 0 115.494 11.098 -17.621 1.00 0.00 H new ATOM 0 HA3 GLY A 0 116.636 12.056 -18.542 1.00 0.00 H new ATOM 44 N LYS A 1 116.001 13.240 -15.597 1.00 0.00 N ATOM 45 CA LYS A 1 116.588 13.635 -14.326 1.00 0.00 C ATOM 46 C LYS A 1 116.144 12.703 -13.231 1.00 0.00 C ATOM 47 O LYS A 1 115.059 12.122 -13.322 1.00 0.00 O ATOM 48 CB LYS A 1 116.195 15.047 -13.941 1.00 0.00 C ATOM 49 CG LYS A 1 116.719 16.089 -14.877 1.00 0.00 C ATOM 50 CD LYS A 1 115.673 16.552 -15.866 1.00 0.00 C ATOM 51 CE LYS A 1 114.569 17.342 -15.168 1.00 0.00 C ATOM 52 NZ LYS A 1 113.436 16.537 -14.635 1.00 0.00 N ATOM 0 H LYS A 1 115.067 13.615 -15.765 1.00 0.00 H new ATOM 0 HA LYS A 1 117.670 13.589 -14.448 1.00 0.00 H new ATOM 0 HB2 LYS A 1 115.108 15.116 -13.905 1.00 0.00 H new ATOM 0 HB3 LYS A 1 116.561 15.256 -12.936 1.00 0.00 H new ATOM 0 HG2 LYS A 1 117.076 16.944 -14.302 1.00 0.00 H new ATOM 0 HG3 LYS A 1 117.576 15.689 -15.419 1.00 0.00 H new ATOM 0 HD2 LYS A 1 116.140 17.172 -16.631 1.00 0.00 H new ATOM 0 HD3 LYS A 1 115.242 15.690 -16.374 1.00 0.00 H new ATOM 0 HE2 LYS A 1 115.013 17.900 -14.344 1.00 0.00 H new ATOM 0 HE3 LYS A 1 114.171 18.074 -15.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 112.542 17.039 -14.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 113.412 15.613 -15.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 113.561 16.396 -13.612 1.00 0.00 H new ATOM 66 N PRO A 2 116.972 12.514 -12.191 1.00 0.00 N ATOM 67 CA PRO A 2 116.598 11.703 -11.052 1.00 0.00 C ATOM 68 C PRO A 2 115.472 12.355 -10.287 1.00 0.00 C ATOM 69 O PRO A 2 115.532 13.549 -9.906 1.00 0.00 O ATOM 70 CB PRO A 2 117.850 11.610 -10.206 1.00 0.00 C ATOM 71 CG PRO A 2 118.697 12.756 -10.627 1.00 0.00 C ATOM 72 CD PRO A 2 118.340 13.059 -12.056 1.00 0.00 C ATOM 0 HA PRO A 2 116.239 10.717 -11.347 1.00 0.00 H new ATOM 0 HB2 PRO A 2 117.612 11.667 -9.144 1.00 0.00 H new ATOM 0 HB3 PRO A 2 118.363 10.662 -10.367 1.00 0.00 H new ATOM 0 HG2 PRO A 2 118.517 13.623 -9.992 1.00 0.00 H new ATOM 0 HG3 PRO A 2 119.755 12.508 -10.537 1.00 0.00 H new ATOM 0 HD2 PRO A 2 118.368 14.130 -12.259 1.00 0.00 H new ATOM 0 HD3 PRO A 2 119.032 12.585 -12.752 1.00 0.00 H new ATOM 80 N PHE A 3 114.470 11.595 -10.075 1.00 0.00 N ATOM 81 CA PHE A 3 113.266 12.050 -9.497 1.00 0.00 C ATOM 82 C PHE A 3 113.178 11.679 -8.028 1.00 0.00 C ATOM 83 O PHE A 3 113.500 10.557 -7.632 1.00 0.00 O ATOM 84 CB PHE A 3 112.066 11.526 -10.305 1.00 0.00 C ATOM 85 CG PHE A 3 111.996 10.038 -10.463 1.00 0.00 C ATOM 86 CD1 PHE A 3 112.724 9.385 -11.441 1.00 0.00 C ATOM 87 CD2 PHE A 3 111.196 9.306 -9.635 1.00 0.00 C ATOM 88 CE1 PHE A 3 112.646 8.013 -11.577 1.00 0.00 C ATOM 89 CE2 PHE A 3 111.105 7.946 -9.755 1.00 0.00 C ATOM 90 CZ PHE A 3 111.831 7.290 -10.729 1.00 0.00 C ATOM 0 H PHE A 3 114.464 10.602 -10.307 1.00 0.00 H new ATOM 0 HA PHE A 3 113.247 13.139 -9.537 1.00 0.00 H new ATOM 0 HB2 PHE A 3 111.149 11.866 -9.823 1.00 0.00 H new ATOM 0 HB3 PHE A 3 112.092 11.978 -11.296 1.00 0.00 H new ATOM 0 HD1 PHE A 3 113.359 9.953 -12.104 1.00 0.00 H new ATOM 0 HD2 PHE A 3 110.624 9.810 -8.870 1.00 0.00 H new ATOM 0 HE1 PHE A 3 113.219 7.509 -12.342 1.00 0.00 H new ATOM 0 HE2 PHE A 3 110.466 7.386 -9.088 1.00 0.00 H new ATOM 0 HZ PHE A 3 111.762 6.217 -10.827 1.00 0.00 H new ATOM 100 N PHE A 4 112.843 12.651 -7.245 1.00 0.00 N ATOM 101 CA PHE A 4 112.638 12.513 -5.836 1.00 0.00 C ATOM 102 C PHE A 4 111.587 13.494 -5.401 1.00 0.00 C ATOM 103 O PHE A 4 111.652 14.670 -5.760 1.00 0.00 O ATOM 104 CB PHE A 4 113.920 12.779 -5.000 1.00 0.00 C ATOM 105 CG PHE A 4 113.621 12.914 -3.509 1.00 0.00 C ATOM 106 CD1 PHE A 4 113.234 14.143 -2.984 1.00 0.00 C ATOM 107 CD2 PHE A 4 113.638 11.827 -2.675 1.00 0.00 C ATOM 108 CE1 PHE A 4 112.871 14.277 -1.687 1.00 0.00 C ATOM 109 CE2 PHE A 4 113.287 11.953 -1.345 1.00 0.00 C ATOM 110 CZ PHE A 4 112.896 13.179 -0.851 1.00 0.00 C ATOM 0 H PHE A 4 112.698 13.603 -7.581 1.00 0.00 H new ATOM 0 HA PHE A 4 112.337 11.480 -5.660 1.00 0.00 H new ATOM 0 HB2 PHE A 4 114.627 11.964 -5.154 1.00 0.00 H new ATOM 0 HB3 PHE A 4 114.401 13.690 -5.356 1.00 0.00 H new ATOM 0 HD1 PHE A 4 113.223 15.011 -3.627 1.00 0.00 H new ATOM 0 HD2 PHE A 4 113.929 10.861 -3.062 1.00 0.00 H new ATOM 0 HE1 PHE A 4 112.563 15.240 -1.307 1.00 0.00 H new ATOM 0 HE2 PHE A 4 113.319 11.092 -0.693 1.00 0.00 H new ATOM 0 HZ PHE A 4 112.610 13.280 0.186 1.00 0.00 H new ATOM 120 N THR A 5 110.653 13.024 -4.654 1.00 0.00 N ATOM 121 CA THR A 5 109.716 13.849 -3.956 1.00 0.00 C ATOM 122 C THR A 5 108.912 12.992 -2.976 1.00 0.00 C ATOM 123 O THR A 5 107.729 13.229 -2.765 1.00 0.00 O ATOM 124 CB THR A 5 108.809 14.659 -4.940 1.00 0.00 C ATOM 125 OG1 THR A 5 107.897 15.528 -4.236 1.00 0.00 O ATOM 126 CG2 THR A 5 108.041 13.754 -5.891 1.00 0.00 C ATOM 0 H THR A 5 110.510 12.025 -4.503 1.00 0.00 H new ATOM 0 HA THR A 5 110.260 14.597 -3.380 1.00 0.00 H new ATOM 0 HB THR A 5 109.483 15.276 -5.534 1.00 0.00 H new ATOM 0 HG1 THR A 5 107.437 15.021 -3.535 1.00 0.00 H new ATOM 0 HG21 THR A 5 107.426 14.362 -6.554 1.00 0.00 H new ATOM 0 HG22 THR A 5 108.744 13.168 -6.483 1.00 0.00 H new ATOM 0 HG23 THR A 5 107.402 13.082 -5.318 1.00 0.00 H new ATOM 134 N ARG A 6 109.606 11.952 -2.396 1.00 0.00 N ATOM 135 CA ARG A 6 109.094 10.981 -1.348 1.00 0.00 C ATOM 136 C ARG A 6 107.794 10.289 -1.738 1.00 0.00 C ATOM 137 O ARG A 6 107.070 9.727 -0.905 1.00 0.00 O ATOM 138 CB ARG A 6 108.930 11.669 -0.026 1.00 0.00 C ATOM 139 CG ARG A 6 107.747 12.599 0.054 1.00 0.00 C ATOM 140 CD ARG A 6 107.803 13.368 1.279 1.00 0.00 C ATOM 141 NE ARG A 6 107.706 12.515 2.466 1.00 0.00 N ATOM 142 CZ ARG A 6 108.225 12.808 3.664 1.00 0.00 C ATOM 143 NH1 ARG A 6 108.715 14.027 3.907 1.00 0.00 N ATOM 144 NH2 ARG A 6 108.207 11.895 4.622 1.00 0.00 N ATOM 0 H ARG A 6 110.574 11.756 -2.652 1.00 0.00 H new ATOM 0 HA ARG A 6 109.851 10.201 -1.270 1.00 0.00 H new ATOM 0 HB2 ARG A 6 108.834 10.913 0.753 1.00 0.00 H new ATOM 0 HB3 ARG A 6 109.836 12.235 0.189 1.00 0.00 H new ATOM 0 HG2 ARG A 6 107.742 13.269 -0.806 1.00 0.00 H new ATOM 0 HG3 ARG A 6 106.820 12.026 0.017 1.00 0.00 H new ATOM 0 HD2 ARG A 6 108.736 13.931 1.312 1.00 0.00 H new ATOM 0 HD3 ARG A 6 106.992 14.096 1.288 1.00 0.00 H new ATOM 0 HE ARG A 6 107.205 11.631 2.372 1.00 0.00 H new ATOM 0 HH11 ARG A 6 108.695 14.740 3.177 1.00 0.00 H new ATOM 0 HH12 ARG A 6 109.109 14.245 4.822 1.00 0.00 H new ATOM 0 HH21 ARG A 6 107.800 10.977 4.444 1.00 0.00 H new ATOM 0 HH22 ARG A 6 108.600 12.109 5.538 1.00 0.00 H new ATOM 158 N ASN A 7 107.512 10.362 -2.961 1.00 0.00 N ATOM 159 CA ASN A 7 106.339 9.747 -3.564 1.00 0.00 C ATOM 160 C ASN A 7 106.593 8.312 -4.023 1.00 0.00 C ATOM 161 O ASN A 7 107.288 8.068 -5.014 1.00 0.00 O ATOM 162 CB ASN A 7 105.861 10.568 -4.775 1.00 0.00 C ATOM 163 CG ASN A 7 104.933 11.732 -4.452 1.00 0.00 C ATOM 164 OD1 ASN A 7 104.143 12.150 -5.299 1.00 0.00 O ATOM 165 ND2 ASN A 7 104.986 12.231 -3.256 1.00 0.00 N ATOM 0 H ASN A 7 108.093 10.865 -3.632 1.00 0.00 H new ATOM 0 HA ASN A 7 105.575 9.728 -2.787 1.00 0.00 H new ATOM 0 HB2 ASN A 7 106.736 10.957 -5.296 1.00 0.00 H new ATOM 0 HB3 ASN A 7 105.349 9.899 -5.467 1.00 0.00 H new ATOM 0 HD21 ASN A 7 104.361 12.993 -2.993 1.00 0.00 H new ATOM 0 HD22 ASN A 7 105.653 11.861 -2.578 1.00 0.00 H new ATOM 172 N PRO A 8 105.990 7.305 -3.344 1.00 0.00 N ATOM 173 CA PRO A 8 106.040 5.929 -3.829 1.00 0.00 C ATOM 174 C PRO A 8 105.454 5.872 -5.182 1.00 0.00 C ATOM 175 O PRO A 8 105.801 5.058 -6.012 1.00 0.00 O ATOM 176 CB PRO A 8 105.047 5.195 -2.988 1.00 0.00 C ATOM 177 CG PRO A 8 104.598 6.089 -1.896 1.00 0.00 C ATOM 178 CD PRO A 8 105.285 7.408 -2.048 1.00 0.00 C ATOM 0 HA PRO A 8 107.060 5.545 -3.809 1.00 0.00 H new ATOM 0 HB2 PRO A 8 104.197 4.882 -3.594 1.00 0.00 H new ATOM 0 HB3 PRO A 8 105.495 4.291 -2.576 1.00 0.00 H new ATOM 0 HG2 PRO A 8 103.516 6.219 -1.934 1.00 0.00 H new ATOM 0 HG3 PRO A 8 104.833 5.650 -0.926 1.00 0.00 H new ATOM 0 HD2 PRO A 8 104.570 8.231 -2.048 1.00 0.00 H new ATOM 0 HD3 PRO A 8 105.981 7.591 -1.230 1.00 0.00 H new ATOM 186 N SER A 9 104.517 6.738 -5.351 1.00 0.00 N ATOM 187 CA SER A 9 103.782 6.813 -6.494 1.00 0.00 C ATOM 188 C SER A 9 104.611 7.407 -7.682 1.00 0.00 C ATOM 189 O SER A 9 104.233 7.224 -8.842 1.00 0.00 O ATOM 190 CB SER A 9 102.528 7.606 -6.207 1.00 0.00 C ATOM 191 OG SER A 9 101.597 7.527 -7.274 1.00 0.00 O ATOM 0 H SER A 9 104.257 7.428 -4.646 1.00 0.00 H new ATOM 0 HA SER A 9 103.499 5.810 -6.814 1.00 0.00 H new ATOM 0 HB2 SER A 9 102.065 7.235 -5.293 1.00 0.00 H new ATOM 0 HB3 SER A 9 102.790 8.649 -6.031 1.00 0.00 H new ATOM 0 HG SER A 9 100.799 8.051 -7.051 1.00 0.00 H new ATOM 197 N GLU A 10 105.730 8.125 -7.390 1.00 0.00 N ATOM 198 CA GLU A 10 106.573 8.650 -8.471 1.00 0.00 C ATOM 199 C GLU A 10 107.433 7.515 -8.958 1.00 0.00 C ATOM 200 O GLU A 10 107.796 7.436 -10.140 1.00 0.00 O ATOM 201 CB GLU A 10 107.460 9.844 -8.028 1.00 0.00 C ATOM 202 CG GLU A 10 108.644 9.502 -7.127 1.00 0.00 C ATOM 203 CD GLU A 10 109.314 10.706 -6.573 1.00 0.00 C ATOM 204 OE1 GLU A 10 109.788 11.566 -7.375 1.00 0.00 O ATOM 205 OE2 GLU A 10 109.378 10.829 -5.317 1.00 0.00 O ATOM 0 H GLU A 10 106.051 8.342 -6.446 1.00 0.00 H new ATOM 0 HA GLU A 10 105.930 9.037 -9.261 1.00 0.00 H new ATOM 0 HB2 GLU A 10 107.840 10.339 -8.921 1.00 0.00 H new ATOM 0 HB3 GLU A 10 106.830 10.565 -7.508 1.00 0.00 H new ATOM 0 HG2 GLU A 10 108.300 8.874 -6.306 1.00 0.00 H new ATOM 0 HG3 GLU A 10 109.369 8.917 -7.694 1.00 0.00 H new ATOM 212 N LEU A 11 107.751 6.632 -8.017 1.00 0.00 N ATOM 213 CA LEU A 11 108.472 5.435 -8.298 1.00 0.00 C ATOM 214 C LEU A 11 107.637 4.572 -9.219 1.00 0.00 C ATOM 215 O LEU A 11 106.417 4.460 -9.058 1.00 0.00 O ATOM 216 CB LEU A 11 108.784 4.704 -7.000 1.00 0.00 C ATOM 217 CG LEU A 11 109.625 5.470 -5.978 1.00 0.00 C ATOM 218 CD1 LEU A 11 109.746 4.670 -4.709 1.00 0.00 C ATOM 219 CD2 LEU A 11 111.006 5.764 -6.533 1.00 0.00 C ATOM 0 H LEU A 11 107.505 6.745 -7.034 1.00 0.00 H new ATOM 0 HA LEU A 11 109.417 5.669 -8.787 1.00 0.00 H new ATOM 0 HB2 LEU A 11 107.841 4.426 -6.528 1.00 0.00 H new ATOM 0 HB3 LEU A 11 109.303 3.777 -7.245 1.00 0.00 H new ATOM 0 HG LEU A 11 109.128 6.416 -5.763 1.00 0.00 H new ATOM 0 HD11 LEU A 11 110.346 5.223 -3.986 1.00 0.00 H new ATOM 0 HD12 LEU A 11 108.753 4.492 -4.295 1.00 0.00 H new ATOM 0 HD13 LEU A 11 110.226 3.715 -4.925 1.00 0.00 H new ATOM 0 HD21 LEU A 11 111.588 6.309 -5.790 1.00 0.00 H new ATOM 0 HD22 LEU A 11 111.509 4.827 -6.772 1.00 0.00 H new ATOM 0 HD23 LEU A 11 110.914 6.367 -7.436 1.00 0.00 H new ATOM 231 N LYS A 12 108.283 4.006 -10.182 1.00 0.00 N ATOM 232 CA LYS A 12 107.610 3.244 -11.218 1.00 0.00 C ATOM 233 C LYS A 12 107.543 1.772 -10.874 1.00 0.00 C ATOM 234 O LYS A 12 108.143 1.314 -9.891 1.00 0.00 O ATOM 235 CB LYS A 12 108.305 3.445 -12.582 1.00 0.00 C ATOM 236 CG LYS A 12 109.694 2.821 -12.680 1.00 0.00 C ATOM 237 CD LYS A 12 109.710 1.423 -13.339 1.00 0.00 C ATOM 238 CE LYS A 12 109.193 1.452 -14.779 1.00 0.00 C ATOM 239 NZ LYS A 12 109.341 0.139 -15.452 1.00 0.00 N ATOM 0 H LYS A 12 109.297 4.050 -10.287 1.00 0.00 H new ATOM 0 HA LYS A 12 106.588 3.617 -11.286 1.00 0.00 H new ATOM 0 HB2 LYS A 12 107.674 3.022 -13.363 1.00 0.00 H new ATOM 0 HB3 LYS A 12 108.385 4.514 -12.781 1.00 0.00 H new ATOM 0 HG2 LYS A 12 110.341 3.488 -13.250 1.00 0.00 H new ATOM 0 HG3 LYS A 12 110.118 2.744 -11.679 1.00 0.00 H new ATOM 0 HD2 LYS A 12 110.727 1.031 -13.329 1.00 0.00 H new ATOM 0 HD3 LYS A 12 109.099 0.739 -12.750 1.00 0.00 H new ATOM 0 HE2 LYS A 12 108.143 1.743 -14.781 1.00 0.00 H new ATOM 0 HE3 LYS A 12 109.735 2.211 -15.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 108.978 0.205 -16.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 110.346 -0.128 -15.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 108.803 -0.581 -14.930 1.00 0.00 H new ATOM 253 N GLY A 13 106.843 1.040 -11.702 1.00 0.00 N ATOM 254 CA GLY A 13 106.750 -0.363 -11.535 1.00 0.00 C ATOM 255 C GLY A 13 105.467 -0.749 -10.874 1.00 0.00 C ATOM 256 O GLY A 13 104.377 -0.532 -11.422 1.00 0.00 O ATOM 0 H GLY A 13 106.329 1.409 -12.502 1.00 0.00 H new ATOM 0 HA2 GLY A 13 106.822 -0.852 -12.506 1.00 0.00 H new ATOM 0 HA3 GLY A 13 107.590 -0.716 -10.937 1.00 0.00 H new ATOM 260 N LYS A 14 105.580 -1.294 -9.711 1.00 0.00 N ATOM 261 CA LYS A 14 104.455 -1.727 -8.935 1.00 0.00 C ATOM 262 C LYS A 14 104.634 -1.344 -7.495 1.00 0.00 C ATOM 263 O LYS A 14 105.744 -1.308 -6.990 1.00 0.00 O ATOM 264 CB LYS A 14 104.175 -3.227 -9.090 1.00 0.00 C ATOM 265 CG LYS A 14 105.392 -4.129 -9.049 1.00 0.00 C ATOM 266 CD LYS A 14 105.814 -4.543 -10.454 1.00 0.00 C ATOM 267 CE LYS A 14 106.989 -5.498 -10.423 1.00 0.00 C ATOM 268 NZ LYS A 14 107.324 -6.013 -11.763 1.00 0.00 N ATOM 0 H LYS A 14 106.478 -1.458 -9.257 1.00 0.00 H new ATOM 0 HA LYS A 14 103.575 -1.214 -9.322 1.00 0.00 H new ATOM 0 HB2 LYS A 14 103.491 -3.534 -8.299 1.00 0.00 H new ATOM 0 HB3 LYS A 14 103.659 -3.386 -10.037 1.00 0.00 H new ATOM 0 HG2 LYS A 14 106.215 -3.612 -8.556 1.00 0.00 H new ATOM 0 HG3 LYS A 14 105.171 -5.016 -8.456 1.00 0.00 H new ATOM 0 HD2 LYS A 14 104.974 -5.015 -10.963 1.00 0.00 H new ATOM 0 HD3 LYS A 14 106.079 -3.657 -11.031 1.00 0.00 H new ATOM 0 HE2 LYS A 14 107.857 -4.990 -10.004 1.00 0.00 H new ATOM 0 HE3 LYS A 14 106.759 -6.333 -9.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 108.133 -6.662 -11.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 106.505 -6.521 -12.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 107.570 -5.219 -12.388 1.00 0.00 H new ATOM 282 N PHE A 15 103.546 -1.100 -6.852 1.00 0.00 N ATOM 283 CA PHE A 15 103.511 -0.597 -5.534 1.00 0.00 C ATOM 284 C PHE A 15 102.745 -1.603 -4.708 1.00 0.00 C ATOM 285 O PHE A 15 101.566 -1.858 -4.969 1.00 0.00 O ATOM 286 CB PHE A 15 102.789 0.756 -5.584 1.00 0.00 C ATOM 287 CG PHE A 15 102.761 1.556 -4.315 1.00 0.00 C ATOM 288 CD1 PHE A 15 103.583 1.247 -3.256 1.00 0.00 C ATOM 289 CD2 PHE A 15 101.913 2.639 -4.205 1.00 0.00 C ATOM 290 CE1 PHE A 15 103.559 1.996 -2.105 1.00 0.00 C ATOM 291 CE2 PHE A 15 101.881 3.402 -3.056 1.00 0.00 C ATOM 292 CZ PHE A 15 102.708 3.077 -2.000 1.00 0.00 C ATOM 0 H PHE A 15 102.620 -1.254 -7.252 1.00 0.00 H new ATOM 0 HA PHE A 15 104.500 -0.451 -5.099 1.00 0.00 H new ATOM 0 HB2 PHE A 15 103.259 1.363 -6.358 1.00 0.00 H new ATOM 0 HB3 PHE A 15 101.760 0.580 -5.897 1.00 0.00 H new ATOM 0 HD1 PHE A 15 104.255 0.405 -3.331 1.00 0.00 H new ATOM 0 HD2 PHE A 15 101.265 2.893 -5.031 1.00 0.00 H new ATOM 0 HE1 PHE A 15 104.207 1.738 -1.281 1.00 0.00 H new ATOM 0 HE2 PHE A 15 101.213 4.248 -2.983 1.00 0.00 H new ATOM 0 HZ PHE A 15 102.689 3.666 -1.095 1.00 0.00 H new ATOM 302 N ILE A 16 103.412 -2.199 -3.775 1.00 0.00 N ATOM 303 CA ILE A 16 102.846 -3.232 -2.963 1.00 0.00 C ATOM 304 C ILE A 16 103.184 -3.017 -1.542 1.00 0.00 C ATOM 305 O ILE A 16 104.196 -2.407 -1.218 1.00 0.00 O ATOM 306 CB ILE A 16 103.278 -4.671 -3.345 1.00 0.00 C ATOM 307 CG1 ILE A 16 104.820 -4.877 -3.322 1.00 0.00 C ATOM 308 CG2 ILE A 16 102.665 -5.087 -4.658 1.00 0.00 C ATOM 309 CD1 ILE A 16 105.583 -4.214 -4.480 1.00 0.00 C ATOM 0 H ILE A 16 104.382 -1.980 -3.550 1.00 0.00 H new ATOM 0 HA ILE A 16 101.773 -3.160 -3.139 1.00 0.00 H new ATOM 0 HB ILE A 16 102.889 -5.332 -2.570 1.00 0.00 H new ATOM 0 HG12 ILE A 16 105.209 -4.488 -2.381 1.00 0.00 H new ATOM 0 HG13 ILE A 16 105.028 -5.947 -3.335 1.00 0.00 H new ATOM 0 HG21 ILE A 16 102.984 -6.100 -4.904 1.00 0.00 H new ATOM 0 HG22 ILE A 16 101.578 -5.058 -4.578 1.00 0.00 H new ATOM 0 HG23 ILE A 16 102.989 -4.404 -5.443 1.00 0.00 H new ATOM 0 HD11 ILE A 16 106.649 -4.415 -4.375 1.00 0.00 H new ATOM 0 HD12 ILE A 16 105.229 -4.619 -5.428 1.00 0.00 H new ATOM 0 HD13 ILE A 16 105.413 -3.138 -4.459 1.00 0.00 H new ATOM 321 N HIS A 17 102.356 -3.501 -0.700 1.00 0.00 N ATOM 322 CA HIS A 17 102.558 -3.359 0.687 1.00 0.00 C ATOM 323 C HIS A 17 102.430 -4.723 1.366 1.00 0.00 C ATOM 324 O HIS A 17 101.461 -5.445 1.150 1.00 0.00 O ATOM 325 CB HIS A 17 101.590 -2.290 1.245 1.00 0.00 C ATOM 326 CG HIS A 17 100.110 -2.589 1.088 1.00 0.00 C ATOM 327 ND1 HIS A 17 99.330 -2.111 0.056 1.00 0.00 N ATOM 328 CD2 HIS A 17 99.281 -3.309 1.871 1.00 0.00 C ATOM 329 CE1 HIS A 17 98.084 -2.544 0.243 1.00 0.00 C ATOM 330 NE2 HIS A 17 97.996 -3.278 1.335 1.00 0.00 N ATOM 0 H HIS A 17 101.511 -4.012 -0.956 1.00 0.00 H new ATOM 0 HA HIS A 17 103.566 -3.003 0.899 1.00 0.00 H new ATOM 0 HB2 HIS A 17 101.803 -2.153 2.305 1.00 0.00 H new ATOM 0 HB3 HIS A 17 101.804 -1.342 0.752 1.00 0.00 H new ATOM 0 HD2 HIS A 17 99.569 -3.829 2.773 1.00 0.00 H new ATOM 0 HE1 HIS A 17 97.255 -2.323 -0.413 1.00 0.00 H new ATOM 0 HE2 HIS A 17 97.161 -3.729 1.709 1.00 0.00 H new ATOM 338 N THR A 18 103.449 -5.115 2.072 1.00 0.00 N ATOM 339 CA THR A 18 103.416 -6.374 2.784 1.00 0.00 C ATOM 340 C THR A 18 103.792 -6.200 4.274 1.00 0.00 C ATOM 341 O THR A 18 104.756 -5.525 4.612 1.00 0.00 O ATOM 342 CB THR A 18 104.324 -7.441 2.094 1.00 0.00 C ATOM 343 OG1 THR A 18 104.155 -8.729 2.702 1.00 0.00 O ATOM 344 CG2 THR A 18 105.793 -7.061 2.145 1.00 0.00 C ATOM 0 H THR A 18 104.316 -4.587 2.175 1.00 0.00 H new ATOM 0 HA THR A 18 102.389 -6.737 2.748 1.00 0.00 H new ATOM 0 HB THR A 18 104.013 -7.482 1.050 1.00 0.00 H new ATOM 0 HG1 THR A 18 104.732 -9.381 2.252 1.00 0.00 H new ATOM 0 HG21 THR A 18 106.386 -7.832 1.653 1.00 0.00 H new ATOM 0 HG22 THR A 18 105.941 -6.109 1.635 1.00 0.00 H new ATOM 0 HG23 THR A 18 106.109 -6.968 3.184 1.00 0.00 H new ATOM 352 N LYS A 19 103.008 -6.792 5.141 1.00 0.00 N ATOM 353 CA LYS A 19 103.260 -6.766 6.566 1.00 0.00 C ATOM 354 C LYS A 19 104.276 -7.825 6.908 1.00 0.00 C ATOM 355 O LYS A 19 104.127 -8.990 6.529 1.00 0.00 O ATOM 356 CB LYS A 19 101.920 -6.956 7.349 1.00 0.00 C ATOM 357 CG LYS A 19 101.978 -7.091 8.911 1.00 0.00 C ATOM 358 CD LYS A 19 102.458 -8.486 9.393 1.00 0.00 C ATOM 359 CE LYS A 19 102.213 -8.719 10.878 1.00 0.00 C ATOM 360 NZ LYS A 19 100.786 -8.614 11.247 1.00 0.00 N ATOM 0 H LYS A 19 102.170 -7.310 4.878 1.00 0.00 H new ATOM 0 HA LYS A 19 103.669 -5.800 6.861 1.00 0.00 H new ATOM 0 HB2 LYS A 19 101.275 -6.109 7.113 1.00 0.00 H new ATOM 0 HB3 LYS A 19 101.431 -7.848 6.957 1.00 0.00 H new ATOM 0 HG2 LYS A 19 102.646 -6.328 9.309 1.00 0.00 H new ATOM 0 HG3 LYS A 19 100.988 -6.894 9.322 1.00 0.00 H new ATOM 0 HD2 LYS A 19 101.945 -9.259 8.820 1.00 0.00 H new ATOM 0 HD3 LYS A 19 103.523 -8.589 9.185 1.00 0.00 H new ATOM 0 HE2 LYS A 19 102.582 -9.707 11.152 1.00 0.00 H new ATOM 0 HE3 LYS A 19 102.787 -7.993 11.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 100.657 -8.929 12.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 100.476 -7.625 11.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 100.219 -9.214 10.614 1.00 0.00 H new ATOM 374 N LEU A 20 105.298 -7.431 7.603 1.00 0.00 N ATOM 375 CA LEU A 20 106.303 -8.342 8.042 1.00 0.00 C ATOM 376 C LEU A 20 106.203 -8.464 9.509 1.00 0.00 C ATOM 377 O LEU A 20 106.175 -7.442 10.238 1.00 0.00 O ATOM 378 CB LEU A 20 107.697 -7.881 7.630 1.00 0.00 C ATOM 379 CG LEU A 20 108.346 -8.578 6.417 1.00 0.00 C ATOM 380 CD1 LEU A 20 107.386 -8.786 5.282 1.00 0.00 C ATOM 381 CD2 LEU A 20 109.529 -7.783 5.936 1.00 0.00 C ATOM 0 H LEU A 20 105.457 -6.463 7.882 1.00 0.00 H new ATOM 0 HA LEU A 20 106.143 -9.312 7.572 1.00 0.00 H new ATOM 0 HB2 LEU A 20 107.650 -6.813 7.419 1.00 0.00 H new ATOM 0 HB3 LEU A 20 108.360 -8.008 8.486 1.00 0.00 H new ATOM 0 HG LEU A 20 108.667 -9.563 6.756 1.00 0.00 H new ATOM 0 HD11 LEU A 20 107.899 -9.280 4.457 1.00 0.00 H new ATOM 0 HD12 LEU A 20 106.556 -9.407 5.617 1.00 0.00 H new ATOM 0 HD13 LEU A 20 107.005 -7.821 4.946 1.00 0.00 H new ATOM 0 HD21 LEU A 20 109.980 -8.284 5.079 1.00 0.00 H new ATOM 0 HD22 LEU A 20 109.202 -6.786 5.642 1.00 0.00 H new ATOM 0 HD23 LEU A 20 110.264 -7.703 6.737 1.00 0.00 H new ATOM 393 N ARG A 21 106.124 -9.664 9.960 1.00 0.00 N ATOM 394 CA ARG A 21 105.997 -9.911 11.326 1.00 0.00 C ATOM 395 C ARG A 21 107.382 -9.980 11.923 1.00 0.00 C ATOM 396 O ARG A 21 108.153 -10.887 11.601 1.00 0.00 O ATOM 397 CB ARG A 21 105.262 -11.213 11.586 1.00 0.00 C ATOM 398 CG ARG A 21 104.936 -11.426 13.046 1.00 0.00 C ATOM 399 CD ARG A 21 104.347 -12.792 13.285 1.00 0.00 C ATOM 400 NE ARG A 21 103.940 -12.967 14.690 1.00 0.00 N ATOM 401 CZ ARG A 21 104.012 -14.115 15.388 1.00 0.00 C ATOM 402 NH1 ARG A 21 104.565 -15.197 14.858 1.00 0.00 N ATOM 403 NH2 ARG A 21 103.549 -14.166 16.632 1.00 0.00 N ATOM 0 H ARG A 21 106.147 -10.500 9.376 1.00 0.00 H new ATOM 0 HA ARG A 21 105.418 -9.108 11.783 1.00 0.00 H new ATOM 0 HB2 ARG A 21 104.338 -11.224 11.008 1.00 0.00 H new ATOM 0 HB3 ARG A 21 105.870 -12.045 11.230 1.00 0.00 H new ATOM 0 HG2 ARG A 21 105.840 -11.309 13.643 1.00 0.00 H new ATOM 0 HG3 ARG A 21 104.233 -10.662 13.379 1.00 0.00 H new ATOM 0 HD2 ARG A 21 103.484 -12.936 12.635 1.00 0.00 H new ATOM 0 HD3 ARG A 21 105.078 -13.556 13.019 1.00 0.00 H new ATOM 0 HE ARG A 21 103.572 -12.148 15.175 1.00 0.00 H new ATOM 0 HH11 ARG A 21 104.942 -15.165 13.911 1.00 0.00 H new ATOM 0 HH12 ARG A 21 104.614 -16.061 15.397 1.00 0.00 H new ATOM 0 HH21 ARG A 21 103.139 -13.335 17.058 1.00 0.00 H new ATOM 0 HH22 ARG A 21 103.604 -15.036 17.161 1.00 0.00 H new ATOM 417 N LYS A 22 107.710 -8.958 12.675 1.00 0.00 N ATOM 418 CA LYS A 22 108.917 -8.827 13.430 1.00 0.00 C ATOM 419 C LYS A 22 109.305 -10.080 14.075 1.00 0.00 C ATOM 420 O LYS A 22 108.673 -10.500 15.069 1.00 0.00 O ATOM 421 CB LYS A 22 108.701 -7.797 14.506 1.00 0.00 C ATOM 422 CG LYS A 22 108.906 -6.336 14.157 1.00 0.00 C ATOM 423 CD LYS A 22 108.204 -5.795 12.926 1.00 0.00 C ATOM 424 CE LYS A 22 108.809 -6.379 11.698 1.00 0.00 C ATOM 425 NZ LYS A 22 110.294 -6.460 11.835 1.00 0.00 N ATOM 0 H LYS A 22 107.098 -8.149 12.778 1.00 0.00 H new ATOM 0 HA LYS A 22 109.710 -8.537 12.741 1.00 0.00 H new ATOM 0 HB2 LYS A 22 107.681 -7.910 14.874 1.00 0.00 H new ATOM 0 HB3 LYS A 22 109.368 -8.037 15.334 1.00 0.00 H new ATOM 0 HG2 LYS A 22 108.588 -5.740 15.012 1.00 0.00 H new ATOM 0 HG3 LYS A 22 109.976 -6.169 14.032 1.00 0.00 H new ATOM 0 HD2 LYS A 22 107.142 -6.035 12.968 1.00 0.00 H new ATOM 0 HD3 LYS A 22 108.284 -4.708 12.900 1.00 0.00 H new ATOM 0 HE2 LYS A 22 108.399 -7.373 11.521 1.00 0.00 H new ATOM 0 HE3 LYS A 22 108.550 -5.769 10.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 110.743 -6.089 10.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 110.598 -5.896 12.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 110.576 -7.451 11.973 1.00 0.00 H new ATOM 439 N SER A 23 110.351 -10.633 13.529 1.00 0.00 N ATOM 440 CA SER A 23 110.903 -11.850 13.950 1.00 0.00 C ATOM 441 C SER A 23 111.915 -11.531 15.077 1.00 0.00 C ATOM 442 O SER A 23 111.661 -10.617 15.873 1.00 0.00 O ATOM 443 CB SER A 23 111.528 -12.534 12.704 1.00 0.00 C ATOM 444 OG SER A 23 112.052 -13.824 13.003 1.00 0.00 O ATOM 0 H SER A 23 110.850 -10.214 12.745 1.00 0.00 H new ATOM 0 HA SER A 23 110.174 -12.548 14.362 1.00 0.00 H new ATOM 0 HB2 SER A 23 110.772 -12.623 11.923 1.00 0.00 H new ATOM 0 HB3 SER A 23 112.324 -11.904 12.307 1.00 0.00 H new ATOM 0 HG SER A 23 112.434 -14.218 12.191 1.00 0.00 H new ATOM 450 N SER A 24 113.015 -12.227 15.151 1.00 0.00 N ATOM 451 CA SER A 24 113.985 -12.040 16.214 1.00 0.00 C ATOM 452 C SER A 24 114.698 -10.654 16.161 1.00 0.00 C ATOM 453 O SER A 24 115.791 -10.510 15.622 1.00 0.00 O ATOM 454 CB SER A 24 114.972 -13.192 16.192 1.00 0.00 C ATOM 455 OG SER A 24 114.264 -14.428 16.219 1.00 0.00 O ATOM 0 H SER A 24 113.273 -12.946 14.475 1.00 0.00 H new ATOM 0 HA SER A 24 113.451 -12.041 17.164 1.00 0.00 H new ATOM 0 HB2 SER A 24 115.592 -13.136 15.297 1.00 0.00 H new ATOM 0 HB3 SER A 24 115.642 -13.126 17.049 1.00 0.00 H new ATOM 0 HG SER A 24 114.903 -15.171 16.203 1.00 0.00 H new ATOM 461 N ARG A 25 114.009 -9.649 16.718 1.00 0.00 N ATOM 462 CA ARG A 25 114.464 -8.251 16.883 1.00 0.00 C ATOM 463 C ARG A 25 114.685 -7.564 15.552 1.00 0.00 C ATOM 464 O ARG A 25 115.457 -6.609 15.458 1.00 0.00 O ATOM 465 CB ARG A 25 115.731 -8.078 17.760 1.00 0.00 C ATOM 466 CG ARG A 25 115.677 -8.631 19.179 1.00 0.00 C ATOM 467 CD ARG A 25 116.031 -10.111 19.213 1.00 0.00 C ATOM 468 NE ARG A 25 117.341 -10.393 18.599 1.00 0.00 N ATOM 469 CZ ARG A 25 117.869 -11.622 18.431 1.00 0.00 C ATOM 470 NH1 ARG A 25 117.228 -12.707 18.889 1.00 0.00 N ATOM 471 NH2 ARG A 25 119.036 -11.763 17.810 1.00 0.00 N ATOM 0 H ARG A 25 113.069 -9.791 17.087 1.00 0.00 H new ATOM 0 HA ARG A 25 113.641 -7.775 17.416 1.00 0.00 H new ATOM 0 HB2 ARG A 25 116.566 -8.552 17.244 1.00 0.00 H new ATOM 0 HB3 ARG A 25 115.957 -7.013 17.821 1.00 0.00 H new ATOM 0 HG2 ARG A 25 116.367 -8.076 19.814 1.00 0.00 H new ATOM 0 HG3 ARG A 25 114.678 -8.485 19.590 1.00 0.00 H new ATOM 0 HD2 ARG A 25 116.036 -10.456 20.247 1.00 0.00 H new ATOM 0 HD3 ARG A 25 115.260 -10.678 18.692 1.00 0.00 H new ATOM 0 HE ARG A 25 117.891 -9.597 18.276 1.00 0.00 H new ATOM 0 HH11 ARG A 25 116.334 -12.606 19.369 1.00 0.00 H new ATOM 0 HH12 ARG A 25 117.635 -13.633 18.757 1.00 0.00 H new ATOM 0 HH21 ARG A 25 119.531 -10.942 17.461 1.00 0.00 H new ATOM 0 HH22 ARG A 25 119.437 -12.692 17.682 1.00 0.00 H new ATOM 485 N GLY A 26 114.027 -8.032 14.527 1.00 0.00 N ATOM 486 CA GLY A 26 114.216 -7.418 13.260 1.00 0.00 C ATOM 487 C GLY A 26 113.493 -8.089 12.162 1.00 0.00 C ATOM 488 O GLY A 26 112.252 -8.371 12.261 1.00 0.00 O ATOM 0 H GLY A 26 113.374 -8.815 14.549 1.00 0.00 H new ATOM 0 HA2 GLY A 26 113.890 -6.380 13.317 1.00 0.00 H new ATOM 0 HA3 GLY A 26 115.281 -7.405 13.028 1.00 0.00 H new ATOM 492 N PHE A 27 114.216 -8.350 11.114 1.00 0.00 N ATOM 493 CA PHE A 27 113.649 -8.817 9.908 1.00 0.00 C ATOM 494 C PHE A 27 114.401 -10.004 9.297 1.00 0.00 C ATOM 495 O PHE A 27 114.135 -11.139 9.650 1.00 0.00 O ATOM 496 CB PHE A 27 113.612 -7.671 8.925 1.00 0.00 C ATOM 497 CG PHE A 27 112.665 -6.597 9.177 1.00 0.00 C ATOM 498 CD1 PHE A 27 111.335 -6.704 8.855 1.00 0.00 C ATOM 499 CD2 PHE A 27 113.133 -5.430 9.698 1.00 0.00 C ATOM 500 CE1 PHE A 27 110.502 -5.646 9.065 1.00 0.00 C ATOM 501 CE2 PHE A 27 112.324 -4.401 9.917 1.00 0.00 C ATOM 502 CZ PHE A 27 111.010 -4.486 9.608 1.00 0.00 C ATOM 0 H PHE A 27 115.230 -8.239 11.084 1.00 0.00 H new ATOM 0 HA PHE A 27 112.647 -9.181 10.134 1.00 0.00 H new ATOM 0 HB2 PHE A 27 114.610 -7.235 8.880 1.00 0.00 H new ATOM 0 HB3 PHE A 27 113.399 -8.082 7.938 1.00 0.00 H new ATOM 0 HD1 PHE A 27 110.950 -7.623 8.437 1.00 0.00 H new ATOM 0 HD2 PHE A 27 114.182 -5.340 9.938 1.00 0.00 H new ATOM 0 HE1 PHE A 27 109.455 -5.716 8.809 1.00 0.00 H new ATOM 0 HE2 PHE A 27 112.717 -3.490 10.344 1.00 0.00 H new ATOM 0 HZ PHE A 27 110.358 -3.644 9.787 1.00 0.00 H new ATOM 512 N GLY A 28 115.343 -9.731 8.434 1.00 0.00 N ATOM 513 CA GLY A 28 115.951 -10.769 7.641 1.00 0.00 C ATOM 514 C GLY A 28 115.979 -10.398 6.164 1.00 0.00 C ATOM 515 O GLY A 28 115.460 -11.125 5.312 1.00 0.00 O ATOM 0 H GLY A 28 115.708 -8.794 8.261 1.00 0.00 H new ATOM 0 HA2 GLY A 28 116.967 -10.948 7.992 1.00 0.00 H new ATOM 0 HA3 GLY A 28 115.399 -11.700 7.773 1.00 0.00 H new ATOM 519 N PHE A 29 116.516 -9.244 5.879 1.00 0.00 N ATOM 520 CA PHE A 29 116.757 -8.772 4.535 1.00 0.00 C ATOM 521 C PHE A 29 117.765 -7.646 4.614 1.00 0.00 C ATOM 522 O PHE A 29 117.792 -6.914 5.599 1.00 0.00 O ATOM 523 CB PHE A 29 115.464 -8.346 3.782 1.00 0.00 C ATOM 524 CG PHE A 29 114.672 -7.238 4.407 1.00 0.00 C ATOM 525 CD1 PHE A 29 115.056 -5.925 4.244 1.00 0.00 C ATOM 526 CD2 PHE A 29 113.539 -7.510 5.135 1.00 0.00 C ATOM 527 CE1 PHE A 29 114.328 -4.898 4.800 1.00 0.00 C ATOM 528 CE2 PHE A 29 112.802 -6.487 5.691 1.00 0.00 C ATOM 529 CZ PHE A 29 113.195 -5.180 5.525 1.00 0.00 C ATOM 0 H PHE A 29 116.809 -8.581 6.597 1.00 0.00 H new ATOM 0 HA PHE A 29 117.153 -9.596 3.941 1.00 0.00 H new ATOM 0 HB2 PHE A 29 115.739 -8.043 2.772 1.00 0.00 H new ATOM 0 HB3 PHE A 29 114.818 -9.219 3.688 1.00 0.00 H new ATOM 0 HD1 PHE A 29 115.943 -5.698 3.671 1.00 0.00 H new ATOM 0 HD2 PHE A 29 113.224 -8.534 5.273 1.00 0.00 H new ATOM 0 HE1 PHE A 29 114.646 -3.874 4.667 1.00 0.00 H new ATOM 0 HE2 PHE A 29 111.912 -6.713 6.260 1.00 0.00 H new ATOM 0 HZ PHE A 29 112.617 -4.379 5.962 1.00 0.00 H new ATOM 539 N THR A 30 118.605 -7.512 3.659 1.00 0.00 N ATOM 540 CA THR A 30 119.532 -6.433 3.702 1.00 0.00 C ATOM 541 C THR A 30 119.174 -5.412 2.693 1.00 0.00 C ATOM 542 O THR A 30 118.830 -5.718 1.528 1.00 0.00 O ATOM 543 CB THR A 30 120.985 -6.901 3.599 1.00 0.00 C ATOM 544 OG1 THR A 30 121.146 -7.750 2.462 1.00 0.00 O ATOM 545 CG2 THR A 30 121.364 -7.668 4.844 1.00 0.00 C ATOM 0 H THR A 30 118.676 -8.123 2.845 1.00 0.00 H new ATOM 0 HA THR A 30 119.461 -5.963 4.683 1.00 0.00 H new ATOM 0 HB THR A 30 121.628 -6.027 3.494 1.00 0.00 H new ATOM 0 HG1 THR A 30 120.409 -7.599 1.834 1.00 0.00 H new ATOM 0 HG21 THR A 30 122.400 -7.999 4.766 1.00 0.00 H new ATOM 0 HG22 THR A 30 121.254 -7.023 5.716 1.00 0.00 H new ATOM 0 HG23 THR A 30 120.712 -8.535 4.949 1.00 0.00 H new ATOM 553 N VAL A 31 119.242 -4.217 3.135 1.00 0.00 N ATOM 554 CA VAL A 31 118.779 -3.116 2.419 1.00 0.00 C ATOM 555 C VAL A 31 119.888 -2.085 2.222 1.00 0.00 C ATOM 556 O VAL A 31 120.710 -1.877 3.098 1.00 0.00 O ATOM 557 CB VAL A 31 117.511 -2.555 3.141 1.00 0.00 C ATOM 558 CG1 VAL A 31 117.699 -2.454 4.630 1.00 0.00 C ATOM 559 CG2 VAL A 31 117.135 -1.239 2.637 1.00 0.00 C ATOM 0 H VAL A 31 119.640 -3.979 4.044 1.00 0.00 H new ATOM 0 HA VAL A 31 118.484 -3.406 1.410 1.00 0.00 H new ATOM 0 HB VAL A 31 116.717 -3.270 2.927 1.00 0.00 H new ATOM 0 HG11 VAL A 31 116.791 -2.059 5.085 1.00 0.00 H new ATOM 0 HG12 VAL A 31 117.909 -3.443 5.038 1.00 0.00 H new ATOM 0 HG13 VAL A 31 118.533 -1.787 4.847 1.00 0.00 H new ATOM 0 HG21 VAL A 31 116.249 -0.886 3.166 1.00 0.00 H new ATOM 0 HG22 VAL A 31 117.956 -0.540 2.797 1.00 0.00 H new ATOM 0 HG23 VAL A 31 116.918 -1.306 1.571 1.00 0.00 H new ATOM 569 N VAL A 32 119.914 -1.508 1.049 1.00 0.00 N ATOM 570 CA VAL A 32 120.883 -0.542 0.640 1.00 0.00 C ATOM 571 C VAL A 32 120.220 0.711 0.196 1.00 0.00 C ATOM 572 O VAL A 32 119.251 0.683 -0.518 1.00 0.00 O ATOM 573 CB VAL A 32 121.801 -1.069 -0.485 1.00 0.00 C ATOM 574 CG1 VAL A 32 122.791 -2.045 0.088 1.00 0.00 C ATOM 575 CG2 VAL A 32 120.972 -1.737 -1.600 1.00 0.00 C ATOM 0 H VAL A 32 119.226 -1.713 0.324 1.00 0.00 H new ATOM 0 HA VAL A 32 121.506 -0.337 1.510 1.00 0.00 H new ATOM 0 HB VAL A 32 122.338 -0.228 -0.923 1.00 0.00 H new ATOM 0 HG11 VAL A 32 123.438 -2.416 -0.707 1.00 0.00 H new ATOM 0 HG12 VAL A 32 123.396 -1.547 0.846 1.00 0.00 H new ATOM 0 HG13 VAL A 32 122.258 -2.881 0.541 1.00 0.00 H new ATOM 0 HG21 VAL A 32 121.639 -2.101 -2.381 1.00 0.00 H new ATOM 0 HG22 VAL A 32 120.410 -2.574 -1.184 1.00 0.00 H new ATOM 0 HG23 VAL A 32 120.279 -1.010 -2.024 1.00 0.00 H new ATOM 585 N GLY A 33 120.713 1.790 0.651 1.00 0.00 N ATOM 586 CA GLY A 33 120.188 3.037 0.258 1.00 0.00 C ATOM 587 C GLY A 33 119.848 3.820 1.444 1.00 0.00 C ATOM 588 O GLY A 33 120.611 3.784 2.419 1.00 0.00 O ATOM 0 H GLY A 33 121.492 1.838 1.307 1.00 0.00 H new ATOM 0 HA2 GLY A 33 120.916 3.575 -0.349 1.00 0.00 H new ATOM 0 HA3 GLY A 33 119.302 2.892 -0.361 1.00 0.00 H new ATOM 592 N GLY A 34 118.718 4.523 1.341 1.00 0.00 N ATOM 593 CA GLY A 34 118.138 5.364 2.376 1.00 0.00 C ATOM 594 C GLY A 34 119.148 6.107 3.105 1.00 0.00 C ATOM 595 O GLY A 34 119.273 6.018 4.309 1.00 0.00 O ATOM 0 H GLY A 34 118.159 4.517 0.488 1.00 0.00 H new ATOM 0 HA2 GLY A 34 117.432 6.061 1.923 1.00 0.00 H new ATOM 0 HA3 GLY A 34 117.572 4.744 3.071 1.00 0.00 H new ATOM 599 N ASP A 35 119.893 6.818 2.383 1.00 0.00 N ATOM 600 CA ASP A 35 120.949 7.511 2.958 1.00 0.00 C ATOM 601 C ASP A 35 120.483 8.866 3.321 1.00 0.00 C ATOM 602 O ASP A 35 120.883 9.421 4.346 1.00 0.00 O ATOM 603 CB ASP A 35 122.131 7.536 2.006 1.00 0.00 C ATOM 604 CG ASP A 35 123.466 7.636 2.743 1.00 0.00 C ATOM 605 OD1 ASP A 35 123.818 8.723 3.288 1.00 0.00 O ATOM 606 OD2 ASP A 35 124.198 6.636 2.795 1.00 0.00 O ATOM 0 H ASP A 35 119.789 6.937 1.375 1.00 0.00 H new ATOM 0 HA ASP A 35 121.289 7.015 3.867 1.00 0.00 H new ATOM 0 HB2 ASP A 35 122.122 6.633 1.395 1.00 0.00 H new ATOM 0 HB3 ASP A 35 122.029 8.382 1.326 1.00 0.00 H new ATOM 611 N GLU A 36 119.553 9.381 2.544 1.00 0.00 N ATOM 612 CA GLU A 36 119.167 10.743 2.706 1.00 0.00 C ATOM 613 C GLU A 36 117.822 10.972 2.132 1.00 0.00 C ATOM 614 O GLU A 36 117.297 10.118 1.436 1.00 0.00 O ATOM 615 CB GLU A 36 120.273 11.628 2.105 1.00 0.00 C ATOM 616 CG GLU A 36 120.838 11.098 0.826 1.00 0.00 C ATOM 617 CD GLU A 36 122.042 11.889 0.382 1.00 0.00 C ATOM 618 OE1 GLU A 36 121.886 12.988 -0.196 1.00 0.00 O ATOM 619 OE2 GLU A 36 123.167 11.464 0.641 1.00 0.00 O ATOM 0 H GLU A 36 119.063 8.875 1.807 1.00 0.00 H new ATOM 0 HA GLU A 36 119.071 11.010 3.759 1.00 0.00 H new ATOM 0 HB2 GLU A 36 119.872 12.626 1.929 1.00 0.00 H new ATOM 0 HB3 GLU A 36 121.078 11.732 2.832 1.00 0.00 H new ATOM 0 HG2 GLU A 36 121.117 10.052 0.956 1.00 0.00 H new ATOM 0 HG3 GLU A 36 120.074 11.130 0.049 1.00 0.00 H new ATOM 626 N PRO A 37 117.218 12.119 2.422 1.00 0.00 N ATOM 627 CA PRO A 37 115.919 12.507 1.911 1.00 0.00 C ATOM 628 C PRO A 37 116.102 12.969 0.498 1.00 0.00 C ATOM 629 O PRO A 37 115.921 14.152 0.143 1.00 0.00 O ATOM 630 CB PRO A 37 115.542 13.666 2.813 1.00 0.00 C ATOM 631 CG PRO A 37 116.505 13.617 3.926 1.00 0.00 C ATOM 632 CD PRO A 37 117.741 13.165 3.261 1.00 0.00 C ATOM 0 HA PRO A 37 115.166 11.719 1.907 1.00 0.00 H new ATOM 0 HB2 PRO A 37 115.603 14.615 2.281 1.00 0.00 H new ATOM 0 HB3 PRO A 37 114.518 13.568 3.173 1.00 0.00 H new ATOM 0 HG2 PRO A 37 116.631 14.592 4.396 1.00 0.00 H new ATOM 0 HG3 PRO A 37 116.188 12.925 4.706 1.00 0.00 H new ATOM 0 HD2 PRO A 37 118.217 13.959 2.686 1.00 0.00 H new ATOM 0 HD3 PRO A 37 118.483 12.797 3.970 1.00 0.00 H new ATOM 640 N ASP A 38 116.500 12.022 -0.261 1.00 0.00 N ATOM 641 CA ASP A 38 116.914 12.138 -1.617 1.00 0.00 C ATOM 642 C ASP A 38 117.184 10.739 -2.149 1.00 0.00 C ATOM 643 O ASP A 38 116.694 10.356 -3.206 1.00 0.00 O ATOM 644 CB ASP A 38 118.196 12.971 -1.676 1.00 0.00 C ATOM 645 CG ASP A 38 118.830 12.978 -3.049 1.00 0.00 C ATOM 646 OD1 ASP A 38 118.460 13.839 -3.884 1.00 0.00 O ATOM 647 OD2 ASP A 38 119.718 12.156 -3.315 1.00 0.00 O ATOM 0 H ASP A 38 116.551 11.060 0.073 1.00 0.00 H new ATOM 0 HA ASP A 38 116.144 12.623 -2.217 1.00 0.00 H new ATOM 0 HB2 ASP A 38 117.972 13.996 -1.380 1.00 0.00 H new ATOM 0 HB3 ASP A 38 118.911 12.579 -0.953 1.00 0.00 H new ATOM 652 N GLU A 39 117.907 9.962 -1.366 1.00 0.00 N ATOM 653 CA GLU A 39 118.273 8.625 -1.749 1.00 0.00 C ATOM 654 C GLU A 39 117.447 7.640 -0.913 1.00 0.00 C ATOM 655 O GLU A 39 117.568 7.628 0.348 1.00 0.00 O ATOM 656 CB GLU A 39 119.759 8.419 -1.499 1.00 0.00 C ATOM 657 CG GLU A 39 120.341 7.202 -2.172 1.00 0.00 C ATOM 658 CD GLU A 39 120.359 7.329 -3.685 1.00 0.00 C ATOM 659 OE1 GLU A 39 121.248 8.027 -4.225 1.00 0.00 O ATOM 660 OE2 GLU A 39 119.508 6.736 -4.353 1.00 0.00 O ATOM 0 H GLU A 39 118.253 10.245 -0.449 1.00 0.00 H new ATOM 0 HA GLU A 39 118.073 8.460 -2.808 1.00 0.00 H new ATOM 0 HB2 GLU A 39 120.299 9.302 -1.842 1.00 0.00 H new ATOM 0 HB3 GLU A 39 119.927 8.340 -0.425 1.00 0.00 H new ATOM 0 HG2 GLU A 39 121.357 7.042 -1.812 1.00 0.00 H new ATOM 0 HG3 GLU A 39 119.761 6.323 -1.891 1.00 0.00 H new ATOM 667 N PHE A 40 116.664 6.821 -1.643 1.00 0.00 N ATOM 668 CA PHE A 40 115.634 5.848 -1.146 1.00 0.00 C ATOM 669 C PHE A 40 116.260 4.511 -0.754 1.00 0.00 C ATOM 670 O PHE A 40 117.409 4.247 -1.096 1.00 0.00 O ATOM 671 CB PHE A 40 114.608 5.551 -2.252 1.00 0.00 C ATOM 672 CG PHE A 40 113.946 6.734 -2.926 1.00 0.00 C ATOM 673 CD1 PHE A 40 113.339 7.731 -2.192 1.00 0.00 C ATOM 674 CD2 PHE A 40 113.913 6.818 -4.313 1.00 0.00 C ATOM 675 CE1 PHE A 40 112.705 8.786 -2.816 1.00 0.00 C ATOM 676 CE2 PHE A 40 113.276 7.878 -4.947 1.00 0.00 C ATOM 677 CZ PHE A 40 112.668 8.865 -4.196 1.00 0.00 C ATOM 0 H PHE A 40 116.727 6.810 -2.661 1.00 0.00 H new ATOM 0 HA PHE A 40 115.165 6.309 -0.277 1.00 0.00 H new ATOM 0 HB2 PHE A 40 115.104 4.960 -3.021 1.00 0.00 H new ATOM 0 HB3 PHE A 40 113.824 4.925 -1.825 1.00 0.00 H new ATOM 0 HD1 PHE A 40 113.360 7.686 -1.113 1.00 0.00 H new ATOM 0 HD2 PHE A 40 114.388 6.050 -4.905 1.00 0.00 H new ATOM 0 HE1 PHE A 40 112.234 9.556 -2.222 1.00 0.00 H new ATOM 0 HE2 PHE A 40 113.256 7.930 -6.026 1.00 0.00 H new ATOM 0 HZ PHE A 40 112.169 9.690 -4.682 1.00 0.00 H new ATOM 687 N LEU A 41 115.506 3.668 0.007 1.00 0.00 N ATOM 688 CA LEU A 41 116.041 2.376 0.414 1.00 0.00 C ATOM 689 C LEU A 41 115.698 1.318 -0.607 1.00 0.00 C ATOM 690 O LEU A 41 114.719 1.445 -1.291 1.00 0.00 O ATOM 691 CB LEU A 41 115.625 1.917 1.797 1.00 0.00 C ATOM 692 CG LEU A 41 116.120 2.705 2.999 1.00 0.00 C ATOM 693 CD1 LEU A 41 115.259 3.922 3.303 1.00 0.00 C ATOM 694 CD2 LEU A 41 116.237 1.808 4.195 1.00 0.00 C ATOM 0 H LEU A 41 114.560 3.867 0.332 1.00 0.00 H new ATOM 0 HA LEU A 41 117.120 2.521 0.467 1.00 0.00 H new ATOM 0 HB2 LEU A 41 114.536 1.909 1.831 1.00 0.00 H new ATOM 0 HB3 LEU A 41 115.955 0.885 1.918 1.00 0.00 H new ATOM 0 HG LEU A 41 117.108 3.090 2.748 1.00 0.00 H new ATOM 0 HD11 LEU A 41 115.661 4.445 4.171 1.00 0.00 H new ATOM 0 HD12 LEU A 41 115.260 4.592 2.443 1.00 0.00 H new ATOM 0 HD13 LEU A 41 114.238 3.602 3.513 1.00 0.00 H new ATOM 0 HD21 LEU A 41 116.592 2.385 5.049 1.00 0.00 H new ATOM 0 HD22 LEU A 41 115.261 1.381 4.426 1.00 0.00 H new ATOM 0 HD23 LEU A 41 116.943 1.005 3.980 1.00 0.00 H new ATOM 706 N GLN A 42 116.550 0.349 -0.774 1.00 0.00 N ATOM 707 CA GLN A 42 116.365 -0.697 -1.750 1.00 0.00 C ATOM 708 C GLN A 42 116.798 -2.029 -1.123 1.00 0.00 C ATOM 709 O GLN A 42 117.589 -2.037 -0.242 1.00 0.00 O ATOM 710 CB GLN A 42 117.272 -0.386 -2.901 1.00 0.00 C ATOM 711 CG GLN A 42 117.106 -1.248 -4.113 1.00 0.00 C ATOM 712 CD GLN A 42 118.405 -1.348 -4.892 1.00 0.00 C ATOM 713 OE1 GLN A 42 119.495 -1.265 -4.334 1.00 0.00 O ATOM 714 NE2 GLN A 42 118.326 -1.536 -6.156 1.00 0.00 N ATOM 0 H GLN A 42 117.408 0.257 -0.230 1.00 0.00 H new ATOM 0 HA GLN A 42 115.326 -0.763 -2.074 1.00 0.00 H new ATOM 0 HB2 GLN A 42 117.115 0.652 -3.193 1.00 0.00 H new ATOM 0 HB3 GLN A 42 118.304 -0.468 -2.559 1.00 0.00 H new ATOM 0 HG2 GLN A 42 116.780 -2.244 -3.813 1.00 0.00 H new ATOM 0 HG3 GLN A 42 116.325 -0.836 -4.752 1.00 0.00 H new ATOM 0 HE21 GLN A 42 117.413 -1.603 -6.606 1.00 0.00 H new ATOM 0 HE22 GLN A 42 119.176 -1.619 -6.713 1.00 0.00 H new ATOM 723 N ILE A 43 116.293 -3.123 -1.589 1.00 0.00 N ATOM 724 CA ILE A 43 116.644 -4.441 -1.012 1.00 0.00 C ATOM 725 C ILE A 43 117.683 -5.144 -1.866 1.00 0.00 C ATOM 726 O ILE A 43 117.441 -5.392 -3.041 1.00 0.00 O ATOM 727 CB ILE A 43 115.400 -5.367 -0.852 1.00 0.00 C ATOM 728 CG1 ILE A 43 114.319 -4.657 -0.042 1.00 0.00 C ATOM 729 CG2 ILE A 43 115.775 -6.707 -0.184 1.00 0.00 C ATOM 730 CD1 ILE A 43 114.779 -4.196 1.312 1.00 0.00 C ATOM 0 H ILE A 43 115.634 -3.163 -2.366 1.00 0.00 H new ATOM 0 HA ILE A 43 117.053 -4.246 -0.021 1.00 0.00 H new ATOM 0 HB ILE A 43 115.015 -5.588 -1.848 1.00 0.00 H new ATOM 0 HG12 ILE A 43 113.962 -3.796 -0.607 1.00 0.00 H new ATOM 0 HG13 ILE A 43 113.471 -5.330 0.083 1.00 0.00 H new ATOM 0 HG21 ILE A 43 114.884 -7.328 -0.088 1.00 0.00 H new ATOM 0 HG22 ILE A 43 116.514 -7.225 -0.796 1.00 0.00 H new ATOM 0 HG23 ILE A 43 116.192 -6.516 0.805 1.00 0.00 H new ATOM 0 HD11 ILE A 43 113.956 -3.701 1.827 1.00 0.00 H new ATOM 0 HD12 ILE A 43 115.108 -5.055 1.896 1.00 0.00 H new ATOM 0 HD13 ILE A 43 115.607 -3.497 1.196 1.00 0.00 H new ATOM 742 N LYS A 44 118.813 -5.506 -1.258 1.00 0.00 N ATOM 743 CA LYS A 44 119.912 -6.135 -1.993 1.00 0.00 C ATOM 744 C LYS A 44 119.967 -7.620 -1.763 1.00 0.00 C ATOM 745 O LYS A 44 120.561 -8.348 -2.559 1.00 0.00 O ATOM 746 CB LYS A 44 121.273 -5.541 -1.647 1.00 0.00 C ATOM 747 CG LYS A 44 121.746 -5.798 -0.205 1.00 0.00 C ATOM 748 CD LYS A 44 123.232 -5.505 -0.045 1.00 0.00 C ATOM 749 CE LYS A 44 123.729 -5.762 1.379 1.00 0.00 C ATOM 750 NZ LYS A 44 125.192 -5.537 1.504 1.00 0.00 N ATOM 0 H LYS A 44 118.992 -5.375 -0.262 1.00 0.00 H new ATOM 0 HA LYS A 44 119.699 -5.935 -3.043 1.00 0.00 H new ATOM 0 HB2 LYS A 44 122.015 -5.946 -2.335 1.00 0.00 H new ATOM 0 HB3 LYS A 44 121.237 -4.465 -1.815 1.00 0.00 H new ATOM 0 HG2 LYS A 44 121.175 -5.175 0.483 1.00 0.00 H new ATOM 0 HG3 LYS A 44 121.547 -6.835 0.065 1.00 0.00 H new ATOM 0 HD2 LYS A 44 123.798 -6.124 -0.741 1.00 0.00 H new ATOM 0 HD3 LYS A 44 123.425 -4.466 -0.312 1.00 0.00 H new ATOM 0 HE2 LYS A 44 123.200 -5.107 2.072 1.00 0.00 H new ATOM 0 HE3 LYS A 44 123.493 -6.787 1.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 125.456 -5.521 2.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 125.704 -6.305 1.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 125.442 -4.627 1.066 1.00 0.00 H new ATOM 764 N SER A 45 119.426 -8.078 -0.668 1.00 0.00 N ATOM 765 CA SER A 45 119.366 -9.489 -0.419 1.00 0.00 C ATOM 766 C SER A 45 118.184 -9.796 0.451 1.00 0.00 C ATOM 767 O SER A 45 117.995 -9.178 1.501 1.00 0.00 O ATOM 768 CB SER A 45 120.657 -9.991 0.256 1.00 0.00 C ATOM 769 OG SER A 45 121.805 -9.689 -0.533 1.00 0.00 O ATOM 0 H SER A 45 119.021 -7.495 0.064 1.00 0.00 H new ATOM 0 HA SER A 45 119.263 -10.002 -1.375 1.00 0.00 H new ATOM 0 HB2 SER A 45 120.758 -9.532 1.239 1.00 0.00 H new ATOM 0 HB3 SER A 45 120.593 -11.068 0.412 1.00 0.00 H new ATOM 0 HG SER A 45 121.522 -9.306 -1.390 1.00 0.00 H new ATOM 775 N LEU A 46 117.386 -10.698 0.005 1.00 0.00 N ATOM 776 CA LEU A 46 116.299 -11.189 0.732 1.00 0.00 C ATOM 777 C LEU A 46 116.871 -12.356 1.547 1.00 0.00 C ATOM 778 O LEU A 46 117.247 -13.389 0.985 1.00 0.00 O ATOM 779 CB LEU A 46 115.285 -11.635 -0.315 1.00 0.00 C ATOM 780 CG LEU A 46 113.844 -11.844 0.077 1.00 0.00 C ATOM 781 CD1 LEU A 46 113.688 -13.007 0.996 1.00 0.00 C ATOM 782 CD2 LEU A 46 113.254 -10.581 0.675 1.00 0.00 C ATOM 0 H LEU A 46 117.487 -11.124 -0.916 1.00 0.00 H new ATOM 0 HA LEU A 46 115.813 -10.486 1.409 1.00 0.00 H new ATOM 0 HB2 LEU A 46 115.300 -10.897 -1.117 1.00 0.00 H new ATOM 0 HB3 LEU A 46 115.646 -12.572 -0.738 1.00 0.00 H new ATOM 0 HG LEU A 46 113.286 -12.075 -0.830 1.00 0.00 H new ATOM 0 HD11 LEU A 46 112.636 -13.126 1.257 1.00 0.00 H new ATOM 0 HD12 LEU A 46 114.044 -13.911 0.502 1.00 0.00 H new ATOM 0 HD13 LEU A 46 114.269 -12.835 1.902 1.00 0.00 H new ATOM 0 HD21 LEU A 46 112.214 -10.759 0.949 1.00 0.00 H new ATOM 0 HD22 LEU A 46 113.820 -10.300 1.563 1.00 0.00 H new ATOM 0 HD23 LEU A 46 113.303 -9.775 -0.057 1.00 0.00 H new ATOM 794 N VAL A 47 117.001 -12.163 2.837 1.00 0.00 N ATOM 795 CA VAL A 47 117.655 -13.117 3.685 1.00 0.00 C ATOM 796 C VAL A 47 116.662 -14.188 4.139 1.00 0.00 C ATOM 797 O VAL A 47 115.520 -13.891 4.529 1.00 0.00 O ATOM 798 CB VAL A 47 118.301 -12.391 4.903 1.00 0.00 C ATOM 799 CG1 VAL A 47 118.998 -13.364 5.818 1.00 0.00 C ATOM 800 CG2 VAL A 47 119.279 -11.311 4.438 1.00 0.00 C ATOM 0 H VAL A 47 116.654 -11.337 3.325 1.00 0.00 H new ATOM 0 HA VAL A 47 118.449 -13.612 3.125 1.00 0.00 H new ATOM 0 HB VAL A 47 117.496 -11.916 5.463 1.00 0.00 H new ATOM 0 HG11 VAL A 47 119.437 -12.824 6.657 1.00 0.00 H new ATOM 0 HG12 VAL A 47 118.278 -14.092 6.192 1.00 0.00 H new ATOM 0 HG13 VAL A 47 119.784 -13.881 5.268 1.00 0.00 H new ATOM 0 HG21 VAL A 47 119.717 -10.818 5.306 1.00 0.00 H new ATOM 0 HG22 VAL A 47 120.070 -11.768 3.843 1.00 0.00 H new ATOM 0 HG23 VAL A 47 118.748 -10.576 3.833 1.00 0.00 H new ATOM 810 N LEU A 48 117.096 -15.426 4.058 1.00 0.00 N ATOM 811 CA LEU A 48 116.280 -16.551 4.410 1.00 0.00 C ATOM 812 C LEU A 48 116.003 -16.549 5.888 1.00 0.00 C ATOM 813 O LEU A 48 116.885 -16.200 6.695 1.00 0.00 O ATOM 814 CB LEU A 48 116.947 -17.851 3.969 1.00 0.00 C ATOM 815 CG LEU A 48 117.250 -17.954 2.470 1.00 0.00 C ATOM 816 CD1 LEU A 48 117.941 -19.267 2.149 1.00 0.00 C ATOM 817 CD2 LEU A 48 115.978 -17.794 1.634 1.00 0.00 C ATOM 0 H LEU A 48 118.034 -15.675 3.743 1.00 0.00 H new ATOM 0 HA LEU A 48 115.325 -16.475 3.889 1.00 0.00 H new ATOM 0 HB2 LEU A 48 117.880 -17.967 4.521 1.00 0.00 H new ATOM 0 HB3 LEU A 48 116.304 -18.684 4.251 1.00 0.00 H new ATOM 0 HG LEU A 48 117.925 -17.138 2.211 1.00 0.00 H new ATOM 0 HD11 LEU A 48 118.146 -19.318 1.080 1.00 0.00 H new ATOM 0 HD12 LEU A 48 118.878 -19.330 2.702 1.00 0.00 H new ATOM 0 HD13 LEU A 48 117.295 -20.097 2.435 1.00 0.00 H new ATOM 0 HD21 LEU A 48 116.226 -17.872 0.575 1.00 0.00 H new ATOM 0 HD22 LEU A 48 115.268 -18.577 1.899 1.00 0.00 H new ATOM 0 HD23 LEU A 48 115.533 -16.819 1.832 1.00 0.00 H new ATOM 829 N ASP A 49 114.767 -16.916 6.228 1.00 0.00 N ATOM 830 CA ASP A 49 114.231 -16.934 7.606 1.00 0.00 C ATOM 831 C ASP A 49 113.800 -15.528 8.047 1.00 0.00 C ATOM 832 O ASP A 49 113.381 -15.293 9.189 1.00 0.00 O ATOM 833 CB ASP A 49 115.184 -17.623 8.602 1.00 0.00 C ATOM 834 CG ASP A 49 114.575 -17.885 9.967 1.00 0.00 C ATOM 835 OD1 ASP A 49 113.583 -18.639 10.056 1.00 0.00 O ATOM 836 OD2 ASP A 49 115.118 -17.415 10.980 1.00 0.00 O ATOM 0 H ASP A 49 114.083 -17.220 5.536 1.00 0.00 H new ATOM 0 HA ASP A 49 113.333 -17.551 7.604 1.00 0.00 H new ATOM 0 HB2 ASP A 49 115.514 -18.571 8.176 1.00 0.00 H new ATOM 0 HB3 ASP A 49 116.072 -17.003 8.726 1.00 0.00 H new ATOM 841 N GLY A 50 113.876 -14.603 7.112 1.00 0.00 N ATOM 842 CA GLY A 50 113.374 -13.273 7.315 1.00 0.00 C ATOM 843 C GLY A 50 111.900 -13.255 7.085 1.00 0.00 C ATOM 844 O GLY A 50 111.438 -14.064 6.324 1.00 0.00 O ATOM 0 H GLY A 50 114.289 -14.759 6.192 1.00 0.00 H new ATOM 0 HA2 GLY A 50 113.598 -12.939 8.328 1.00 0.00 H new ATOM 0 HA3 GLY A 50 113.867 -12.579 6.634 1.00 0.00 H new ATOM 848 N PRO A 51 111.122 -12.281 7.586 1.00 0.00 N ATOM 849 CA PRO A 51 109.692 -12.371 7.499 1.00 0.00 C ATOM 850 C PRO A 51 109.244 -12.148 6.052 1.00 0.00 C ATOM 851 O PRO A 51 108.235 -12.660 5.615 1.00 0.00 O ATOM 852 CB PRO A 51 109.191 -11.338 8.533 1.00 0.00 C ATOM 853 CG PRO A 51 110.349 -10.457 8.858 1.00 0.00 C ATOM 854 CD PRO A 51 111.535 -10.958 8.069 1.00 0.00 C ATOM 0 HA PRO A 51 109.270 -13.347 7.739 1.00 0.00 H new ATOM 0 HB2 PRO A 51 108.364 -10.755 8.128 1.00 0.00 H new ATOM 0 HB3 PRO A 51 108.821 -11.836 9.429 1.00 0.00 H new ATOM 0 HG2 PRO A 51 110.127 -9.421 8.601 1.00 0.00 H new ATOM 0 HG3 PRO A 51 110.561 -10.481 9.927 1.00 0.00 H new ATOM 0 HD2 PRO A 51 111.772 -10.290 7.241 1.00 0.00 H new ATOM 0 HD3 PRO A 51 112.427 -11.023 8.692 1.00 0.00 H new ATOM 862 N ALA A 52 110.087 -11.433 5.311 1.00 0.00 N ATOM 863 CA ALA A 52 109.919 -11.201 3.889 1.00 0.00 C ATOM 864 C ALA A 52 110.035 -12.524 3.136 1.00 0.00 C ATOM 865 O ALA A 52 109.269 -12.813 2.239 1.00 0.00 O ATOM 866 CB ALA A 52 111.001 -10.249 3.404 1.00 0.00 C ATOM 0 H ALA A 52 110.922 -10.992 5.696 1.00 0.00 H new ATOM 0 HA ALA A 52 108.937 -10.766 3.706 1.00 0.00 H new ATOM 0 HB1 ALA A 52 110.878 -10.072 2.335 1.00 0.00 H new ATOM 0 HB2 ALA A 52 110.920 -9.303 3.940 1.00 0.00 H new ATOM 0 HB3 ALA A 52 111.981 -10.688 3.589 1.00 0.00 H new ATOM 872 N ALA A 53 111.000 -13.323 3.542 1.00 0.00 N ATOM 873 CA ALA A 53 111.261 -14.627 2.950 1.00 0.00 C ATOM 874 C ALA A 53 110.106 -15.538 3.205 1.00 0.00 C ATOM 875 O ALA A 53 109.569 -16.190 2.320 1.00 0.00 O ATOM 876 CB ALA A 53 112.508 -15.228 3.598 1.00 0.00 C ATOM 0 H ALA A 53 111.636 -13.085 4.303 1.00 0.00 H new ATOM 0 HA ALA A 53 111.408 -14.512 1.876 1.00 0.00 H new ATOM 0 HB1 ALA A 53 112.711 -16.205 3.160 1.00 0.00 H new ATOM 0 HB2 ALA A 53 113.360 -14.570 3.427 1.00 0.00 H new ATOM 0 HB3 ALA A 53 112.344 -15.338 4.670 1.00 0.00 H new ATOM 882 N LEU A 54 109.725 -15.516 4.413 1.00 0.00 N ATOM 883 CA LEU A 54 108.774 -16.380 4.971 1.00 0.00 C ATOM 884 C LEU A 54 107.370 -16.133 4.549 1.00 0.00 C ATOM 885 O LEU A 54 106.661 -17.056 4.180 1.00 0.00 O ATOM 886 CB LEU A 54 108.949 -16.275 6.381 1.00 0.00 C ATOM 887 CG LEU A 54 110.370 -16.624 6.756 1.00 0.00 C ATOM 888 CD1 LEU A 54 110.436 -16.591 8.127 1.00 0.00 C ATOM 889 CD2 LEU A 54 110.808 -17.988 6.226 1.00 0.00 C ATOM 0 H LEU A 54 110.095 -14.846 5.088 1.00 0.00 H new ATOM 0 HA LEU A 54 108.943 -17.394 4.607 1.00 0.00 H new ATOM 0 HB2 LEU A 54 108.716 -15.262 6.710 1.00 0.00 H new ATOM 0 HB3 LEU A 54 108.255 -16.943 6.892 1.00 0.00 H new ATOM 0 HG LEU A 54 111.052 -15.906 6.302 1.00 0.00 H new ATOM 0 HD11 LEU A 54 111.448 -16.838 8.449 1.00 0.00 H new ATOM 0 HD12 LEU A 54 110.176 -15.593 8.480 1.00 0.00 H new ATOM 0 HD13 LEU A 54 109.736 -17.316 8.543 1.00 0.00 H new ATOM 0 HD21 LEU A 54 111.837 -18.182 6.528 1.00 0.00 H new ATOM 0 HD22 LEU A 54 110.158 -18.762 6.633 1.00 0.00 H new ATOM 0 HD23 LEU A 54 110.742 -17.994 5.138 1.00 0.00 H new ATOM 901 N ASP A 55 106.963 -14.885 4.583 1.00 0.00 N ATOM 902 CA ASP A 55 105.622 -14.527 4.153 1.00 0.00 C ATOM 903 C ASP A 55 105.596 -14.565 2.650 1.00 0.00 C ATOM 904 O ASP A 55 104.567 -14.845 2.015 1.00 0.00 O ATOM 905 CB ASP A 55 105.247 -13.113 4.619 1.00 0.00 C ATOM 906 CG ASP A 55 103.751 -12.846 4.547 1.00 0.00 C ATOM 907 OD1 ASP A 55 103.209 -12.554 3.460 1.00 0.00 O ATOM 908 OD2 ASP A 55 103.072 -12.916 5.597 1.00 0.00 O ATOM 0 H ASP A 55 107.534 -14.102 4.901 1.00 0.00 H new ATOM 0 HA ASP A 55 104.908 -15.228 4.585 1.00 0.00 H new ATOM 0 HB2 ASP A 55 105.588 -12.971 5.645 1.00 0.00 H new ATOM 0 HB3 ASP A 55 105.772 -12.382 4.004 1.00 0.00 H new ATOM 913 N GLY A 56 106.769 -14.388 2.083 1.00 0.00 N ATOM 914 CA GLY A 56 106.896 -14.302 0.659 1.00 0.00 C ATOM 915 C GLY A 56 106.595 -12.898 0.198 1.00 0.00 C ATOM 916 O GLY A 56 106.736 -11.948 0.982 1.00 0.00 O ATOM 0 H GLY A 56 107.647 -14.301 2.595 1.00 0.00 H new ATOM 0 HA2 GLY A 56 107.905 -14.584 0.358 1.00 0.00 H new ATOM 0 HA3 GLY A 56 106.213 -15.005 0.182 1.00 0.00 H new ATOM 920 N LYS A 57 106.191 -12.764 -1.058 1.00 0.00 N ATOM 921 CA LYS A 57 105.768 -11.496 -1.672 1.00 0.00 C ATOM 922 C LYS A 57 106.935 -10.509 -1.891 1.00 0.00 C ATOM 923 O LYS A 57 107.197 -10.116 -3.015 1.00 0.00 O ATOM 924 CB LYS A 57 104.604 -10.863 -0.879 1.00 0.00 C ATOM 925 CG LYS A 57 103.939 -9.675 -1.545 1.00 0.00 C ATOM 926 CD LYS A 57 102.724 -9.220 -0.746 1.00 0.00 C ATOM 927 CE LYS A 57 101.979 -8.100 -1.447 1.00 0.00 C ATOM 928 NZ LYS A 57 101.393 -8.563 -2.719 1.00 0.00 N ATOM 0 H LYS A 57 106.144 -13.553 -1.703 1.00 0.00 H new ATOM 0 HA LYS A 57 105.401 -11.733 -2.671 1.00 0.00 H new ATOM 0 HB2 LYS A 57 103.849 -11.628 -0.700 1.00 0.00 H new ATOM 0 HB3 LYS A 57 104.978 -10.550 0.096 1.00 0.00 H new ATOM 0 HG2 LYS A 57 104.651 -8.855 -1.632 1.00 0.00 H new ATOM 0 HG3 LYS A 57 103.636 -9.942 -2.557 1.00 0.00 H new ATOM 0 HD2 LYS A 57 102.052 -10.064 -0.593 1.00 0.00 H new ATOM 0 HD3 LYS A 57 103.042 -8.884 0.241 1.00 0.00 H new ATOM 0 HE2 LYS A 57 101.190 -7.722 -0.797 1.00 0.00 H new ATOM 0 HE3 LYS A 57 102.660 -7.271 -1.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 100.677 -7.880 -3.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 102.141 -8.644 -3.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 100.947 -9.492 -2.578 1.00 0.00 H new ATOM 942 N MET A 58 107.615 -10.142 -0.827 1.00 0.00 N ATOM 943 CA MET A 58 108.745 -9.205 -0.867 1.00 0.00 C ATOM 944 C MET A 58 109.994 -9.944 -1.386 1.00 0.00 C ATOM 945 O MET A 58 110.243 -11.086 -0.990 1.00 0.00 O ATOM 946 CB MET A 58 108.931 -8.598 0.538 1.00 0.00 C ATOM 947 CG MET A 58 110.083 -7.648 0.709 1.00 0.00 C ATOM 948 SD MET A 58 110.164 -6.958 2.374 1.00 0.00 S ATOM 949 CE MET A 58 111.586 -5.901 2.195 1.00 0.00 C ATOM 0 H MET A 58 107.405 -10.485 0.110 1.00 0.00 H new ATOM 0 HA MET A 58 108.561 -8.379 -1.554 1.00 0.00 H new ATOM 0 HB2 MET A 58 108.014 -8.075 0.808 1.00 0.00 H new ATOM 0 HB3 MET A 58 109.053 -9.415 1.249 1.00 0.00 H new ATOM 0 HG2 MET A 58 111.015 -8.168 0.488 1.00 0.00 H new ATOM 0 HG3 MET A 58 109.992 -6.837 -0.013 1.00 0.00 H new ATOM 0 HE1 MET A 58 111.627 -5.201 3.030 1.00 0.00 H new ATOM 0 HE2 MET A 58 112.491 -6.508 2.185 1.00 0.00 H new ATOM 0 HE3 MET A 58 111.511 -5.346 1.260 1.00 0.00 H new ATOM 959 N GLU A 59 110.764 -9.301 -2.263 1.00 0.00 N ATOM 960 CA GLU A 59 111.852 -9.970 -3.017 1.00 0.00 C ATOM 961 C GLU A 59 112.933 -8.964 -3.368 1.00 0.00 C ATOM 962 O GLU A 59 112.625 -7.848 -3.754 1.00 0.00 O ATOM 963 CB GLU A 59 111.311 -10.469 -4.362 1.00 0.00 C ATOM 964 CG GLU A 59 110.217 -11.509 -4.315 1.00 0.00 C ATOM 965 CD GLU A 59 109.653 -11.772 -5.688 1.00 0.00 C ATOM 966 OE1 GLU A 59 110.331 -12.423 -6.509 1.00 0.00 O ATOM 967 OE2 GLU A 59 108.531 -11.301 -5.995 1.00 0.00 O ATOM 0 H GLU A 59 110.662 -8.309 -2.478 1.00 0.00 H new ATOM 0 HA GLU A 59 112.237 -10.781 -2.399 1.00 0.00 H new ATOM 0 HB2 GLU A 59 110.938 -9.609 -4.918 1.00 0.00 H new ATOM 0 HB3 GLU A 59 112.145 -10.879 -4.932 1.00 0.00 H new ATOM 0 HG2 GLU A 59 110.611 -12.436 -3.897 1.00 0.00 H new ATOM 0 HG3 GLU A 59 109.421 -11.173 -3.651 1.00 0.00 H new ATOM 974 N THR A 60 114.189 -9.414 -3.336 1.00 0.00 N ATOM 975 CA THR A 60 115.358 -8.599 -3.631 1.00 0.00 C ATOM 976 C THR A 60 115.136 -7.767 -4.900 1.00 0.00 C ATOM 977 O THR A 60 114.994 -8.320 -6.000 1.00 0.00 O ATOM 978 CB THR A 60 116.537 -9.518 -3.870 1.00 0.00 C ATOM 979 OG1 THR A 60 116.608 -10.485 -2.829 1.00 0.00 O ATOM 980 CG2 THR A 60 117.791 -8.738 -3.890 1.00 0.00 C ATOM 0 H THR A 60 114.422 -10.378 -3.098 1.00 0.00 H new ATOM 0 HA THR A 60 115.540 -7.929 -2.791 1.00 0.00 H new ATOM 0 HB THR A 60 116.405 -10.017 -4.830 1.00 0.00 H new ATOM 0 HG1 THR A 60 117.371 -11.080 -2.987 1.00 0.00 H new ATOM 0 HG21 THR A 60 118.633 -9.408 -4.063 1.00 0.00 H new ATOM 0 HG22 THR A 60 117.746 -7.998 -4.689 1.00 0.00 H new ATOM 0 HG23 THR A 60 117.920 -8.232 -2.933 1.00 0.00 H new ATOM 988 N GLY A 61 115.132 -6.473 -4.744 1.00 0.00 N ATOM 989 CA GLY A 61 114.793 -5.598 -5.831 1.00 0.00 C ATOM 990 C GLY A 61 113.689 -4.644 -5.409 1.00 0.00 C ATOM 991 O GLY A 61 113.338 -3.716 -6.136 1.00 0.00 O ATOM 0 H GLY A 61 115.361 -5.999 -3.870 1.00 0.00 H new ATOM 0 HA2 GLY A 61 115.672 -5.034 -6.142 1.00 0.00 H new ATOM 0 HA3 GLY A 61 114.469 -6.183 -6.692 1.00 0.00 H new ATOM 995 N ASP A 62 113.086 -4.921 -4.245 1.00 0.00 N ATOM 996 CA ASP A 62 112.081 -4.020 -3.665 1.00 0.00 C ATOM 997 C ASP A 62 112.755 -2.732 -3.328 1.00 0.00 C ATOM 998 O ASP A 62 113.929 -2.730 -2.949 1.00 0.00 O ATOM 999 CB ASP A 62 111.547 -4.492 -2.298 1.00 0.00 C ATOM 1000 CG ASP A 62 110.985 -5.869 -2.194 1.00 0.00 C ATOM 1001 OD1 ASP A 62 109.859 -6.119 -2.666 1.00 0.00 O ATOM 1002 OD2 ASP A 62 111.629 -6.702 -1.589 1.00 0.00 O ATOM 0 H ASP A 62 113.275 -5.756 -3.690 1.00 0.00 H new ATOM 0 HA ASP A 62 111.276 -3.963 -4.397 1.00 0.00 H new ATOM 0 HB2 ASP A 62 112.361 -4.410 -1.577 1.00 0.00 H new ATOM 0 HB3 ASP A 62 110.772 -3.792 -1.985 1.00 0.00 H new ATOM 1007 N VAL A 63 112.079 -1.645 -3.460 1.00 0.00 N ATOM 1008 CA VAL A 63 112.616 -0.456 -2.903 1.00 0.00 C ATOM 1009 C VAL A 63 111.794 -0.126 -1.672 1.00 0.00 C ATOM 1010 O VAL A 63 110.554 -0.210 -1.699 1.00 0.00 O ATOM 1011 CB VAL A 63 112.721 0.754 -3.889 1.00 0.00 C ATOM 1012 CG1 VAL A 63 113.302 0.341 -5.212 1.00 0.00 C ATOM 1013 CG2 VAL A 63 111.423 1.435 -4.102 1.00 0.00 C ATOM 0 H VAL A 63 111.180 -1.554 -3.934 1.00 0.00 H new ATOM 0 HA VAL A 63 113.658 -0.643 -2.645 1.00 0.00 H new ATOM 0 HB VAL A 63 113.395 1.466 -3.412 1.00 0.00 H new ATOM 0 HG11 VAL A 63 113.359 1.208 -5.871 1.00 0.00 H new ATOM 0 HG12 VAL A 63 114.302 -0.066 -5.059 1.00 0.00 H new ATOM 0 HG13 VAL A 63 112.667 -0.419 -5.667 1.00 0.00 H new ATOM 0 HG21 VAL A 63 111.557 2.266 -4.795 1.00 0.00 H new ATOM 0 HG22 VAL A 63 110.705 0.728 -4.518 1.00 0.00 H new ATOM 0 HG23 VAL A 63 111.050 1.813 -3.150 1.00 0.00 H new ATOM 1023 N ILE A 64 112.460 0.171 -0.601 1.00 0.00 N ATOM 1024 CA ILE A 64 111.811 0.466 0.614 1.00 0.00 C ATOM 1025 C ILE A 64 111.367 1.913 0.701 1.00 0.00 C ATOM 1026 O ILE A 64 112.223 2.900 0.604 1.00 0.00 O ATOM 1027 CB ILE A 64 112.540 -0.036 1.892 1.00 0.00 C ATOM 1028 CG1 ILE A 64 112.329 -1.543 2.044 1.00 0.00 C ATOM 1029 CG2 ILE A 64 112.090 0.702 3.143 1.00 0.00 C ATOM 1030 CD1 ILE A 64 112.731 -2.088 3.392 1.00 0.00 C ATOM 0 H ILE A 64 113.478 0.213 -0.556 1.00 0.00 H new ATOM 0 HA ILE A 64 110.903 -0.136 0.590 1.00 0.00 H new ATOM 0 HB ILE A 64 113.603 0.173 1.774 1.00 0.00 H new ATOM 0 HG12 ILE A 64 111.277 -1.771 1.871 1.00 0.00 H new ATOM 0 HG13 ILE A 64 112.899 -2.059 1.271 1.00 0.00 H new ATOM 0 HG21 ILE A 64 112.629 0.314 4.008 1.00 0.00 H new ATOM 0 HG22 ILE A 64 112.299 1.766 3.033 1.00 0.00 H new ATOM 0 HG23 ILE A 64 111.020 0.555 3.287 1.00 0.00 H new ATOM 0 HD11 ILE A 64 112.550 -3.163 3.419 1.00 0.00 H new ATOM 0 HD12 ILE A 64 113.790 -1.894 3.562 1.00 0.00 H new ATOM 0 HD13 ILE A 64 112.144 -1.602 4.171 1.00 0.00 H new ATOM 1042 N VAL A 65 110.020 2.002 0.846 1.00 0.00 N ATOM 1043 CA VAL A 65 109.223 3.206 0.896 1.00 0.00 C ATOM 1044 C VAL A 65 108.655 3.479 2.311 1.00 0.00 C ATOM 1045 O VAL A 65 108.794 4.581 2.837 1.00 0.00 O ATOM 1046 CB VAL A 65 108.027 3.088 -0.102 1.00 0.00 C ATOM 1047 CG1 VAL A 65 107.131 4.305 -0.058 1.00 0.00 C ATOM 1048 CG2 VAL A 65 108.498 2.813 -1.527 1.00 0.00 C ATOM 0 H VAL A 65 109.444 1.165 0.935 1.00 0.00 H new ATOM 0 HA VAL A 65 109.879 4.033 0.625 1.00 0.00 H new ATOM 0 HB VAL A 65 107.437 2.231 0.224 1.00 0.00 H new ATOM 0 HG11 VAL A 65 106.313 4.180 -0.767 1.00 0.00 H new ATOM 0 HG12 VAL A 65 106.725 4.422 0.947 1.00 0.00 H new ATOM 0 HG13 VAL A 65 107.708 5.191 -0.322 1.00 0.00 H new ATOM 0 HG21 VAL A 65 107.634 2.738 -2.188 1.00 0.00 H new ATOM 0 HG22 VAL A 65 109.141 3.627 -1.861 1.00 0.00 H new ATOM 0 HG23 VAL A 65 109.056 1.877 -1.552 1.00 0.00 H new ATOM 1058 N SER A 66 108.022 2.503 2.934 1.00 0.00 N ATOM 1059 CA SER A 66 107.394 2.778 4.227 1.00 0.00 C ATOM 1060 C SER A 66 107.459 1.602 5.159 1.00 0.00 C ATOM 1061 O SER A 66 107.611 0.458 4.727 1.00 0.00 O ATOM 1062 CB SER A 66 105.929 3.186 4.073 1.00 0.00 C ATOM 1063 OG SER A 66 105.759 4.300 3.212 1.00 0.00 O ATOM 0 H SER A 66 107.926 1.548 2.590 1.00 0.00 H new ATOM 0 HA SER A 66 107.964 3.603 4.653 1.00 0.00 H new ATOM 0 HB2 SER A 66 105.360 2.342 3.685 1.00 0.00 H new ATOM 0 HB3 SER A 66 105.517 3.424 5.054 1.00 0.00 H new ATOM 0 HG SER A 66 104.997 4.140 2.617 1.00 0.00 H new ATOM 1069 N VAL A 67 107.327 1.906 6.428 1.00 0.00 N ATOM 1070 CA VAL A 67 107.280 0.947 7.487 1.00 0.00 C ATOM 1071 C VAL A 67 106.118 1.361 8.440 1.00 0.00 C ATOM 1072 O VAL A 67 106.278 2.132 9.382 1.00 0.00 O ATOM 1073 CB VAL A 67 108.693 0.806 8.178 1.00 0.00 C ATOM 1074 CG1 VAL A 67 109.248 2.117 8.651 1.00 0.00 C ATOM 1075 CG2 VAL A 67 108.684 -0.191 9.301 1.00 0.00 C ATOM 0 H VAL A 67 107.247 2.869 6.756 1.00 0.00 H new ATOM 0 HA VAL A 67 107.064 -0.057 7.122 1.00 0.00 H new ATOM 0 HB VAL A 67 109.356 0.432 7.397 1.00 0.00 H new ATOM 0 HG11 VAL A 67 110.220 1.954 9.117 1.00 0.00 H new ATOM 0 HG12 VAL A 67 109.361 2.792 7.802 1.00 0.00 H new ATOM 0 HG13 VAL A 67 108.567 2.559 9.378 1.00 0.00 H new ATOM 0 HG21 VAL A 67 109.679 -0.251 9.743 1.00 0.00 H new ATOM 0 HG22 VAL A 67 107.968 0.123 10.061 1.00 0.00 H new ATOM 0 HG23 VAL A 67 108.399 -1.170 8.916 1.00 0.00 H new ATOM 1085 N ASN A 68 104.935 0.874 8.073 1.00 0.00 N ATOM 1086 CA ASN A 68 103.614 1.205 8.643 1.00 0.00 C ATOM 1087 C ASN A 68 103.279 2.676 8.649 1.00 0.00 C ATOM 1088 O ASN A 68 102.749 3.197 7.669 1.00 0.00 O ATOM 1089 CB ASN A 68 103.136 0.415 9.931 1.00 0.00 C ATOM 1090 CG ASN A 68 103.933 0.568 11.245 1.00 0.00 C ATOM 1091 OD1 ASN A 68 104.572 1.585 11.516 1.00 0.00 O ATOM 1092 ND2 ASN A 68 103.840 -0.427 12.089 1.00 0.00 N ATOM 0 H ASN A 68 104.859 0.191 7.319 1.00 0.00 H new ATOM 0 HA ASN A 68 102.964 0.763 7.888 1.00 0.00 H new ATOM 0 HB2 ASN A 68 102.107 0.711 10.135 1.00 0.00 H new ATOM 0 HB3 ASN A 68 103.119 -0.645 9.679 1.00 0.00 H new ATOM 0 HD21 ASN A 68 104.303 -0.371 12.996 1.00 0.00 H new ATOM 0 HD22 ASN A 68 103.304 -1.259 11.840 1.00 0.00 H new ATOM 1099 N ASP A 69 103.614 3.327 9.690 1.00 0.00 N ATOM 1100 CA ASP A 69 103.338 4.738 9.860 1.00 0.00 C ATOM 1101 C ASP A 69 104.475 5.558 9.316 1.00 0.00 C ATOM 1102 O ASP A 69 104.275 6.617 8.685 1.00 0.00 O ATOM 1103 CB ASP A 69 103.179 5.050 11.348 1.00 0.00 C ATOM 1104 CG ASP A 69 102.932 6.517 11.631 1.00 0.00 C ATOM 1105 OD1 ASP A 69 101.755 6.949 11.601 1.00 0.00 O ATOM 1106 OD2 ASP A 69 103.914 7.268 11.903 1.00 0.00 O ATOM 0 H ASP A 69 104.101 2.905 10.481 1.00 0.00 H new ATOM 0 HA ASP A 69 102.422 4.983 9.323 1.00 0.00 H new ATOM 0 HB2 ASP A 69 102.350 4.466 11.748 1.00 0.00 H new ATOM 0 HB3 ASP A 69 104.078 4.732 11.877 1.00 0.00 H new ATOM 1111 N THR A 70 105.657 5.058 9.523 1.00 0.00 N ATOM 1112 CA THR A 70 106.844 5.771 9.222 1.00 0.00 C ATOM 1113 C THR A 70 107.154 5.751 7.733 1.00 0.00 C ATOM 1114 O THR A 70 107.195 4.689 7.085 1.00 0.00 O ATOM 1115 CB THR A 70 108.018 5.178 9.996 1.00 0.00 C ATOM 1116 OG1 THR A 70 107.538 4.645 11.253 1.00 0.00 O ATOM 1117 CG2 THR A 70 109.056 6.254 10.280 1.00 0.00 C ATOM 0 H THR A 70 105.817 4.129 9.912 1.00 0.00 H new ATOM 0 HA THR A 70 106.689 6.808 9.519 1.00 0.00 H new ATOM 0 HB THR A 70 108.473 4.387 9.400 1.00 0.00 H new ATOM 0 HG1 THR A 70 108.288 4.261 11.753 1.00 0.00 H new ATOM 0 HG21 THR A 70 109.889 5.819 10.833 1.00 0.00 H new ATOM 0 HG22 THR A 70 109.420 6.665 9.339 1.00 0.00 H new ATOM 0 HG23 THR A 70 108.603 7.049 10.872 1.00 0.00 H new ATOM 1125 N CYS A 71 107.360 6.919 7.213 1.00 0.00 N ATOM 1126 CA CYS A 71 107.749 7.112 5.864 1.00 0.00 C ATOM 1127 C CYS A 71 109.243 7.024 5.839 1.00 0.00 C ATOM 1128 O CYS A 71 109.952 7.972 6.177 1.00 0.00 O ATOM 1129 CB CYS A 71 107.269 8.472 5.406 1.00 0.00 C ATOM 1130 SG CYS A 71 107.575 8.842 3.665 1.00 0.00 S ATOM 0 H CYS A 71 107.257 7.788 7.737 1.00 0.00 H new ATOM 0 HA CYS A 71 107.319 6.367 5.195 1.00 0.00 H new ATOM 0 HB2 CYS A 71 106.198 8.545 5.595 1.00 0.00 H new ATOM 0 HB3 CYS A 71 107.753 9.236 6.015 1.00 0.00 H new ATOM 0 HG CYS A 71 106.781 9.796 3.278 1.00 0.00 H new ATOM 1136 N VAL A 72 109.718 5.874 5.513 1.00 0.00 N ATOM 1137 CA VAL A 72 111.115 5.622 5.514 1.00 0.00 C ATOM 1138 C VAL A 72 111.703 5.938 4.125 1.00 0.00 C ATOM 1139 O VAL A 72 112.900 5.834 3.898 1.00 0.00 O ATOM 1140 CB VAL A 72 111.401 4.166 5.999 1.00 0.00 C ATOM 1141 CG1 VAL A 72 110.847 3.136 5.071 1.00 0.00 C ATOM 1142 CG2 VAL A 72 112.856 3.920 6.281 1.00 0.00 C ATOM 0 H VAL A 72 109.145 5.077 5.236 1.00 0.00 H new ATOM 0 HA VAL A 72 111.617 6.281 6.222 1.00 0.00 H new ATOM 0 HB VAL A 72 110.873 4.065 6.947 1.00 0.00 H new ATOM 0 HG11 VAL A 72 111.074 2.141 5.455 1.00 0.00 H new ATOM 0 HG12 VAL A 72 109.767 3.258 4.995 1.00 0.00 H new ATOM 0 HG13 VAL A 72 111.296 3.256 4.085 1.00 0.00 H new ATOM 0 HG21 VAL A 72 112.993 2.891 6.614 1.00 0.00 H new ATOM 0 HG22 VAL A 72 113.436 4.088 5.373 1.00 0.00 H new ATOM 0 HG23 VAL A 72 113.196 4.602 7.060 1.00 0.00 H new ATOM 1152 N LEU A 73 110.842 6.349 3.202 1.00 0.00 N ATOM 1153 CA LEU A 73 111.291 6.767 1.909 1.00 0.00 C ATOM 1154 C LEU A 73 112.032 8.076 2.084 1.00 0.00 C ATOM 1155 O LEU A 73 111.440 9.106 2.435 1.00 0.00 O ATOM 1156 CB LEU A 73 110.103 6.939 0.951 1.00 0.00 C ATOM 1157 CG LEU A 73 110.469 6.994 -0.529 1.00 0.00 C ATOM 1158 CD1 LEU A 73 111.058 5.673 -0.965 1.00 0.00 C ATOM 1159 CD2 LEU A 73 109.268 7.312 -1.379 1.00 0.00 C ATOM 0 H LEU A 73 109.832 6.396 3.339 1.00 0.00 H new ATOM 0 HA LEU A 73 111.949 6.014 1.474 1.00 0.00 H new ATOM 0 HB2 LEU A 73 109.408 6.114 1.107 1.00 0.00 H new ATOM 0 HB3 LEU A 73 109.574 7.855 1.213 1.00 0.00 H new ATOM 0 HG LEU A 73 111.204 7.788 -0.662 1.00 0.00 H new ATOM 0 HD11 LEU A 73 111.316 5.721 -2.023 1.00 0.00 H new ATOM 0 HD12 LEU A 73 111.955 5.464 -0.382 1.00 0.00 H new ATOM 0 HD13 LEU A 73 110.328 4.879 -0.806 1.00 0.00 H new ATOM 0 HD21 LEU A 73 109.563 7.344 -2.428 1.00 0.00 H new ATOM 0 HD22 LEU A 73 108.509 6.543 -1.239 1.00 0.00 H new ATOM 0 HD23 LEU A 73 108.862 8.280 -1.087 1.00 0.00 H new ATOM 1171 N GLY A 74 113.320 8.028 1.861 1.00 0.00 N ATOM 1172 CA GLY A 74 114.130 9.186 2.057 1.00 0.00 C ATOM 1173 C GLY A 74 114.512 9.359 3.511 1.00 0.00 C ATOM 1174 O GLY A 74 114.714 10.478 3.977 1.00 0.00 O ATOM 0 H GLY A 74 113.823 7.199 1.545 1.00 0.00 H new ATOM 0 HA2 GLY A 74 115.032 9.107 1.450 1.00 0.00 H new ATOM 0 HA3 GLY A 74 113.592 10.070 1.714 1.00 0.00 H new ATOM 1178 N HIS A 75 114.571 8.268 4.238 1.00 0.00 N ATOM 1179 CA HIS A 75 114.990 8.306 5.604 1.00 0.00 C ATOM 1180 C HIS A 75 116.495 8.331 5.597 1.00 0.00 C ATOM 1181 O HIS A 75 117.104 7.836 4.661 1.00 0.00 O ATOM 1182 CB HIS A 75 114.504 7.051 6.315 1.00 0.00 C ATOM 1183 CG HIS A 75 113.773 7.303 7.583 1.00 0.00 C ATOM 1184 ND1 HIS A 75 112.534 7.916 7.670 1.00 0.00 N ATOM 1185 CD2 HIS A 75 114.122 6.994 8.828 1.00 0.00 C ATOM 1186 CE1 HIS A 75 112.187 7.956 8.951 1.00 0.00 C ATOM 1187 NE2 HIS A 75 113.122 7.408 9.708 1.00 0.00 N ATOM 0 H HIS A 75 114.330 7.338 3.895 1.00 0.00 H new ATOM 0 HA HIS A 75 114.585 9.177 6.119 1.00 0.00 H new ATOM 0 HB2 HIS A 75 113.853 6.496 5.640 1.00 0.00 H new ATOM 0 HB3 HIS A 75 115.362 6.413 6.526 1.00 0.00 H new ATOM 0 HD1 HIS A 75 111.985 8.274 6.888 1.00 0.00 H new ATOM 0 HD2 HIS A 75 115.038 6.499 9.114 1.00 0.00 H new ATOM 0 HE1 HIS A 75 111.266 8.379 9.324 1.00 0.00 H new ATOM 1195 N THR A 76 117.086 8.938 6.578 1.00 0.00 N ATOM 1196 CA THR A 76 118.513 8.964 6.666 1.00 0.00 C ATOM 1197 C THR A 76 119.003 7.594 7.165 1.00 0.00 C ATOM 1198 O THR A 76 118.323 7.014 8.014 1.00 0.00 O ATOM 1199 CB THR A 76 118.902 10.056 7.682 1.00 0.00 C ATOM 1200 OG1 THR A 76 118.339 11.322 7.283 1.00 0.00 O ATOM 1201 CG2 THR A 76 120.400 10.193 7.864 1.00 0.00 C ATOM 0 H THR A 76 116.601 9.424 7.332 1.00 0.00 H new ATOM 0 HA THR A 76 118.962 9.175 5.696 1.00 0.00 H new ATOM 0 HB THR A 76 118.494 9.749 8.645 1.00 0.00 H new ATOM 0 HG1 THR A 76 118.589 12.011 7.934 1.00 0.00 H new ATOM 0 HG21 THR A 76 120.608 10.978 8.591 1.00 0.00 H new ATOM 0 HG22 THR A 76 120.811 9.249 8.221 1.00 0.00 H new ATOM 0 HG23 THR A 76 120.860 10.451 6.910 1.00 0.00 H new ATOM 1209 N HIS A 77 120.128 7.087 6.663 1.00 0.00 N ATOM 1210 CA HIS A 77 120.643 5.750 7.037 1.00 0.00 C ATOM 1211 C HIS A 77 120.664 5.522 8.550 1.00 0.00 C ATOM 1212 O HIS A 77 120.122 4.528 9.050 1.00 0.00 O ATOM 1213 CB HIS A 77 122.042 5.507 6.432 1.00 0.00 C ATOM 1214 CG HIS A 77 122.540 4.108 6.639 1.00 0.00 C ATOM 1215 ND1 HIS A 77 123.556 3.760 7.507 1.00 0.00 N ATOM 1216 CD2 HIS A 77 122.117 2.954 6.079 1.00 0.00 C ATOM 1217 CE1 HIS A 77 123.703 2.434 7.450 1.00 0.00 C ATOM 1218 NE2 HIS A 77 122.855 1.896 6.598 1.00 0.00 N ATOM 0 H HIS A 77 120.713 7.580 5.988 1.00 0.00 H new ATOM 0 HA HIS A 77 119.946 5.024 6.618 1.00 0.00 H new ATOM 0 HB2 HIS A 77 122.011 5.720 5.364 1.00 0.00 H new ATOM 0 HB3 HIS A 77 122.750 6.207 6.876 1.00 0.00 H new ATOM 0 HD1 HIS A 77 124.097 4.401 8.088 1.00 0.00 H new ATOM 0 HD2 HIS A 77 121.330 2.867 5.344 1.00 0.00 H new ATOM 0 HE1 HIS A 77 124.424 1.875 8.028 1.00 0.00 H new ATOM 1226 N ALA A 78 121.202 6.474 9.265 1.00 0.00 N ATOM 1227 CA ALA A 78 121.319 6.388 10.706 1.00 0.00 C ATOM 1228 C ALA A 78 119.944 6.371 11.375 1.00 0.00 C ATOM 1229 O ALA A 78 119.761 5.789 12.451 1.00 0.00 O ATOM 1230 CB ALA A 78 122.158 7.533 11.230 1.00 0.00 C ATOM 0 H ALA A 78 121.574 7.336 8.868 1.00 0.00 H new ATOM 0 HA ALA A 78 121.815 5.449 10.952 1.00 0.00 H new ATOM 0 HB1 ALA A 78 122.239 7.458 12.314 1.00 0.00 H new ATOM 0 HB2 ALA A 78 123.153 7.487 10.788 1.00 0.00 H new ATOM 0 HB3 ALA A 78 121.687 8.480 10.966 1.00 0.00 H new ATOM 1236 N GLN A 79 118.984 6.987 10.730 1.00 0.00 N ATOM 1237 CA GLN A 79 117.647 7.058 11.250 1.00 0.00 C ATOM 1238 C GLN A 79 116.884 5.769 10.973 1.00 0.00 C ATOM 1239 O GLN A 79 116.224 5.217 11.864 1.00 0.00 O ATOM 1240 CB GLN A 79 116.913 8.240 10.664 1.00 0.00 C ATOM 1241 CG GLN A 79 117.501 9.596 11.033 1.00 0.00 C ATOM 1242 CD GLN A 79 117.690 9.785 12.526 1.00 0.00 C ATOM 1243 OE1 GLN A 79 116.784 10.231 13.241 1.00 0.00 O ATOM 1244 NE2 GLN A 79 118.874 9.526 12.991 1.00 0.00 N ATOM 0 H GLN A 79 119.111 7.452 9.831 1.00 0.00 H new ATOM 0 HA GLN A 79 117.712 7.189 12.330 1.00 0.00 H new ATOM 0 HB2 GLN A 79 116.906 8.145 9.578 1.00 0.00 H new ATOM 0 HB3 GLN A 79 115.875 8.207 10.994 1.00 0.00 H new ATOM 0 HG2 GLN A 79 118.463 9.714 10.535 1.00 0.00 H new ATOM 0 HG3 GLN A 79 116.848 10.382 10.655 1.00 0.00 H new ATOM 0 HE21 GLN A 79 119.596 9.159 12.371 1.00 0.00 H new ATOM 0 HE22 GLN A 79 119.082 9.690 13.976 1.00 0.00 H new ATOM 1253 N VAL A 80 116.982 5.289 9.742 1.00 0.00 N ATOM 1254 CA VAL A 80 116.331 4.052 9.363 1.00 0.00 C ATOM 1255 C VAL A 80 116.874 2.878 10.177 1.00 0.00 C ATOM 1256 O VAL A 80 116.098 2.084 10.725 1.00 0.00 O ATOM 1257 CB VAL A 80 116.359 3.765 7.815 1.00 0.00 C ATOM 1258 CG1 VAL A 80 117.769 3.739 7.260 1.00 0.00 C ATOM 1259 CG2 VAL A 80 115.660 2.447 7.537 1.00 0.00 C ATOM 0 H VAL A 80 117.506 5.740 8.992 1.00 0.00 H new ATOM 0 HA VAL A 80 115.275 4.176 9.605 1.00 0.00 H new ATOM 0 HB VAL A 80 115.836 4.579 7.313 1.00 0.00 H new ATOM 0 HG11 VAL A 80 117.735 3.538 6.189 1.00 0.00 H new ATOM 0 HG12 VAL A 80 118.246 4.704 7.433 1.00 0.00 H new ATOM 0 HG13 VAL A 80 118.342 2.957 7.758 1.00 0.00 H new ATOM 0 HG21 VAL A 80 115.677 2.245 6.466 1.00 0.00 H new ATOM 0 HG22 VAL A 80 116.173 1.644 8.066 1.00 0.00 H new ATOM 0 HG23 VAL A 80 114.627 2.504 7.879 1.00 0.00 H new ATOM 1269 N VAL A 81 118.196 2.827 10.338 1.00 0.00 N ATOM 1270 CA VAL A 81 118.821 1.765 11.127 1.00 0.00 C ATOM 1271 C VAL A 81 118.372 1.844 12.582 1.00 0.00 C ATOM 1272 O VAL A 81 118.152 0.829 13.217 1.00 0.00 O ATOM 1273 CB VAL A 81 120.393 1.705 10.997 1.00 0.00 C ATOM 1274 CG1 VAL A 81 121.072 2.930 11.563 1.00 0.00 C ATOM 1275 CG2 VAL A 81 120.965 0.451 11.642 1.00 0.00 C ATOM 0 H VAL A 81 118.849 3.500 9.938 1.00 0.00 H new ATOM 0 HA VAL A 81 118.472 0.823 10.703 1.00 0.00 H new ATOM 0 HB VAL A 81 120.600 1.675 9.927 1.00 0.00 H new ATOM 0 HG11 VAL A 81 122.152 2.834 11.447 1.00 0.00 H new ATOM 0 HG12 VAL A 81 120.727 3.816 11.030 1.00 0.00 H new ATOM 0 HG13 VAL A 81 120.828 3.025 12.621 1.00 0.00 H new ATOM 0 HG21 VAL A 81 122.049 0.447 11.531 1.00 0.00 H new ATOM 0 HG22 VAL A 81 120.708 0.437 12.701 1.00 0.00 H new ATOM 0 HG23 VAL A 81 120.548 -0.431 11.156 1.00 0.00 H new ATOM 1285 N LYS A 82 118.190 3.060 13.077 1.00 0.00 N ATOM 1286 CA LYS A 82 117.708 3.285 14.425 1.00 0.00 C ATOM 1287 C LYS A 82 116.350 2.584 14.644 1.00 0.00 C ATOM 1288 O LYS A 82 116.180 1.862 15.618 1.00 0.00 O ATOM 1289 CB LYS A 82 117.639 4.811 14.680 1.00 0.00 C ATOM 1290 CG LYS A 82 117.223 5.286 16.096 1.00 0.00 C ATOM 1291 CD LYS A 82 115.706 5.256 16.353 1.00 0.00 C ATOM 1292 CE LYS A 82 114.951 6.226 15.444 1.00 0.00 C ATOM 1293 NZ LYS A 82 113.507 6.279 15.762 1.00 0.00 N ATOM 0 H LYS A 82 118.373 3.916 12.553 1.00 0.00 H new ATOM 0 HA LYS A 82 118.395 2.848 15.150 1.00 0.00 H new ATOM 0 HB2 LYS A 82 118.620 5.233 14.459 1.00 0.00 H new ATOM 0 HB3 LYS A 82 116.939 5.240 13.963 1.00 0.00 H new ATOM 0 HG2 LYS A 82 117.718 4.658 16.837 1.00 0.00 H new ATOM 0 HG3 LYS A 82 117.585 6.303 16.247 1.00 0.00 H new ATOM 0 HD2 LYS A 82 115.332 4.245 16.194 1.00 0.00 H new ATOM 0 HD3 LYS A 82 115.510 5.509 17.395 1.00 0.00 H new ATOM 0 HE2 LYS A 82 115.380 7.223 15.543 1.00 0.00 H new ATOM 0 HE3 LYS A 82 115.082 5.924 14.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 113.005 6.798 15.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 113.130 5.312 15.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 113.369 6.765 16.671 1.00 0.00 H new ATOM 1307 N ILE A 83 115.422 2.743 13.701 1.00 0.00 N ATOM 1308 CA ILE A 83 114.076 2.187 13.866 1.00 0.00 C ATOM 1309 C ILE A 83 114.132 0.690 13.713 1.00 0.00 C ATOM 1310 O ILE A 83 113.695 -0.079 14.580 1.00 0.00 O ATOM 1311 CB ILE A 83 113.090 2.737 12.804 1.00 0.00 C ATOM 1312 CG1 ILE A 83 113.046 4.260 12.843 1.00 0.00 C ATOM 1313 CG2 ILE A 83 111.683 2.154 13.018 1.00 0.00 C ATOM 1314 CD1 ILE A 83 112.144 4.858 11.797 1.00 0.00 C ATOM 0 H ILE A 83 115.572 3.245 12.826 1.00 0.00 H new ATOM 0 HA ILE A 83 113.724 2.473 14.857 1.00 0.00 H new ATOM 0 HB ILE A 83 113.446 2.430 11.821 1.00 0.00 H new ATOM 0 HG12 ILE A 83 112.710 4.581 13.829 1.00 0.00 H new ATOM 0 HG13 ILE A 83 114.055 4.649 12.708 1.00 0.00 H new ATOM 0 HG21 ILE A 83 111.005 2.552 12.263 1.00 0.00 H new ATOM 0 HG22 ILE A 83 111.722 1.068 12.934 1.00 0.00 H new ATOM 0 HG23 ILE A 83 111.323 2.428 14.009 1.00 0.00 H new ATOM 0 HD11 ILE A 83 112.160 5.945 11.881 1.00 0.00 H new ATOM 0 HD12 ILE A 83 112.492 4.566 10.806 1.00 0.00 H new ATOM 0 HD13 ILE A 83 111.126 4.497 11.945 1.00 0.00 H new ATOM 1326 N PHE A 84 114.748 0.303 12.639 1.00 0.00 N ATOM 1327 CA PHE A 84 114.842 -1.054 12.226 1.00 0.00 C ATOM 1328 C PHE A 84 115.587 -1.940 13.217 1.00 0.00 C ATOM 1329 O PHE A 84 115.211 -3.093 13.418 1.00 0.00 O ATOM 1330 CB PHE A 84 115.423 -1.111 10.827 1.00 0.00 C ATOM 1331 CG PHE A 84 114.396 -0.894 9.731 1.00 0.00 C ATOM 1332 CD1 PHE A 84 113.733 0.316 9.596 1.00 0.00 C ATOM 1333 CD2 PHE A 84 114.093 -1.906 8.841 1.00 0.00 C ATOM 1334 CE1 PHE A 84 112.793 0.501 8.601 1.00 0.00 C ATOM 1335 CE2 PHE A 84 113.158 -1.726 7.847 1.00 0.00 C ATOM 1336 CZ PHE A 84 112.508 -0.525 7.727 1.00 0.00 C ATOM 0 H PHE A 84 115.215 0.952 12.006 1.00 0.00 H new ATOM 0 HA PHE A 84 113.836 -1.473 12.204 1.00 0.00 H new ATOM 0 HB2 PHE A 84 116.204 -0.356 10.736 1.00 0.00 H new ATOM 0 HB3 PHE A 84 115.899 -2.080 10.680 1.00 0.00 H new ATOM 0 HD1 PHE A 84 113.954 1.124 10.277 1.00 0.00 H new ATOM 0 HD2 PHE A 84 114.599 -2.856 8.927 1.00 0.00 H new ATOM 0 HE1 PHE A 84 112.282 1.448 8.508 1.00 0.00 H new ATOM 0 HE2 PHE A 84 112.936 -2.531 7.162 1.00 0.00 H new ATOM 0 HZ PHE A 84 111.773 -0.383 6.948 1.00 0.00 H new ATOM 1346 N GLN A 85 116.610 -1.408 13.851 1.00 0.00 N ATOM 1347 CA GLN A 85 117.344 -2.170 14.844 1.00 0.00 C ATOM 1348 C GLN A 85 116.680 -2.098 16.213 1.00 0.00 C ATOM 1349 O GLN A 85 116.926 -2.952 17.065 1.00 0.00 O ATOM 1350 CB GLN A 85 118.811 -1.738 14.942 1.00 0.00 C ATOM 1351 CG GLN A 85 119.630 -2.004 13.692 1.00 0.00 C ATOM 1352 CD GLN A 85 119.620 -3.454 13.281 1.00 0.00 C ATOM 1353 OE1 GLN A 85 118.784 -3.880 12.503 1.00 0.00 O ATOM 1354 NE2 GLN A 85 120.527 -4.213 13.808 1.00 0.00 N ATOM 0 H GLN A 85 116.952 -0.459 13.700 1.00 0.00 H new ATOM 0 HA GLN A 85 117.325 -3.206 14.506 1.00 0.00 H new ATOM 0 HB2 GLN A 85 118.849 -0.672 15.166 1.00 0.00 H new ATOM 0 HB3 GLN A 85 119.274 -2.256 15.782 1.00 0.00 H new ATOM 0 HG2 GLN A 85 119.242 -1.397 12.874 1.00 0.00 H new ATOM 0 HG3 GLN A 85 120.659 -1.687 13.864 1.00 0.00 H new ATOM 0 HE21 GLN A 85 121.209 -3.818 14.455 1.00 0.00 H new ATOM 0 HE22 GLN A 85 120.559 -5.206 13.576 1.00 0.00 H new ATOM 1363 N SER A 86 115.839 -1.093 16.426 1.00 0.00 N ATOM 1364 CA SER A 86 115.137 -0.949 17.694 1.00 0.00 C ATOM 1365 C SER A 86 113.913 -1.882 17.722 1.00 0.00 C ATOM 1366 O SER A 86 113.292 -2.087 18.775 1.00 0.00 O ATOM 1367 CB SER A 86 114.720 0.522 17.915 1.00 0.00 C ATOM 1368 OG SER A 86 114.215 0.753 19.229 1.00 0.00 O ATOM 0 H SER A 86 115.628 -0.369 15.740 1.00 0.00 H new ATOM 0 HA SER A 86 115.805 -1.232 18.507 1.00 0.00 H new ATOM 0 HB2 SER A 86 115.578 1.170 17.740 1.00 0.00 H new ATOM 0 HB3 SER A 86 113.960 0.795 17.183 1.00 0.00 H new ATOM 0 HG SER A 86 113.849 -0.081 19.590 1.00 0.00 H new ATOM 1374 N ILE A 87 113.567 -2.411 16.553 1.00 0.00 N ATOM 1375 CA ILE A 87 112.494 -3.361 16.386 1.00 0.00 C ATOM 1376 C ILE A 87 112.531 -4.554 17.399 1.00 0.00 C ATOM 1377 O ILE A 87 113.588 -5.147 17.657 1.00 0.00 O ATOM 1378 CB ILE A 87 112.406 -3.865 14.910 1.00 0.00 C ATOM 1379 CG1 ILE A 87 111.704 -2.833 14.022 1.00 0.00 C ATOM 1380 CG2 ILE A 87 111.766 -5.215 14.774 1.00 0.00 C ATOM 1381 CD1 ILE A 87 111.160 -3.419 12.729 1.00 0.00 C ATOM 0 H ILE A 87 114.041 -2.180 15.680 1.00 0.00 H new ATOM 0 HA ILE A 87 111.581 -2.814 16.620 1.00 0.00 H new ATOM 0 HB ILE A 87 113.434 -3.985 14.569 1.00 0.00 H new ATOM 0 HG12 ILE A 87 110.884 -2.382 14.581 1.00 0.00 H new ATOM 0 HG13 ILE A 87 112.405 -2.033 13.783 1.00 0.00 H new ATOM 0 HG21 ILE A 87 111.739 -5.501 13.722 1.00 0.00 H new ATOM 0 HG22 ILE A 87 112.344 -5.950 15.335 1.00 0.00 H new ATOM 0 HG23 ILE A 87 110.750 -5.177 15.166 1.00 0.00 H new ATOM 0 HD11 ILE A 87 110.676 -2.633 12.149 1.00 0.00 H new ATOM 0 HD12 ILE A 87 111.979 -3.845 12.150 1.00 0.00 H new ATOM 0 HD13 ILE A 87 110.434 -4.199 12.960 1.00 0.00 H new ATOM 1393 N PRO A 88 111.360 -4.882 17.996 1.00 0.00 N ATOM 1394 CA PRO A 88 111.203 -5.977 18.957 1.00 0.00 C ATOM 1395 C PRO A 88 110.607 -7.252 18.304 1.00 0.00 C ATOM 1396 O PRO A 88 110.003 -7.206 17.230 1.00 0.00 O ATOM 1397 CB PRO A 88 110.188 -5.368 19.927 1.00 0.00 C ATOM 1398 CG PRO A 88 109.333 -4.446 19.093 1.00 0.00 C ATOM 1399 CD PRO A 88 110.072 -4.198 17.792 1.00 0.00 C ATOM 0 HA PRO A 88 112.145 -6.301 19.400 1.00 0.00 H new ATOM 0 HB2 PRO A 88 109.584 -6.142 20.400 1.00 0.00 H new ATOM 0 HB3 PRO A 88 110.689 -4.822 20.727 1.00 0.00 H new ATOM 0 HG2 PRO A 88 108.358 -4.895 18.902 1.00 0.00 H new ATOM 0 HG3 PRO A 88 109.155 -3.508 19.618 1.00 0.00 H new ATOM 0 HD2 PRO A 88 109.531 -4.606 16.938 1.00 0.00 H new ATOM 0 HD3 PRO A 88 110.208 -3.133 17.604 1.00 0.00 H new ATOM 1407 N ILE A 89 110.850 -8.380 18.933 1.00 0.00 N ATOM 1408 CA ILE A 89 110.336 -9.682 18.495 1.00 0.00 C ATOM 1409 C ILE A 89 108.810 -9.749 18.686 1.00 0.00 C ATOM 1410 O ILE A 89 108.295 -9.228 19.672 1.00 0.00 O ATOM 1411 CB ILE A 89 110.950 -10.809 19.355 1.00 0.00 C ATOM 1412 CG1 ILE A 89 112.453 -10.624 19.488 1.00 0.00 C ATOM 1413 CG2 ILE A 89 110.636 -12.179 18.756 1.00 0.00 C ATOM 1414 CD1 ILE A 89 113.105 -11.598 20.419 1.00 0.00 C ATOM 0 H ILE A 89 111.418 -8.432 19.778 1.00 0.00 H new ATOM 0 HA ILE A 89 110.597 -9.805 17.444 1.00 0.00 H new ATOM 0 HB ILE A 89 110.505 -10.757 20.349 1.00 0.00 H new ATOM 0 HG12 ILE A 89 112.909 -10.718 18.502 1.00 0.00 H new ATOM 0 HG13 ILE A 89 112.655 -9.612 19.838 1.00 0.00 H new ATOM 0 HG21 ILE A 89 111.078 -12.958 19.378 1.00 0.00 H new ATOM 0 HG22 ILE A 89 109.556 -12.318 18.713 1.00 0.00 H new ATOM 0 HG23 ILE A 89 111.050 -12.240 17.750 1.00 0.00 H new ATOM 0 HD11 ILE A 89 114.176 -11.401 20.460 1.00 0.00 H new ATOM 0 HD12 ILE A 89 112.678 -11.490 21.416 1.00 0.00 H new ATOM 0 HD13 ILE A 89 112.936 -12.613 20.060 1.00 0.00 H new ATOM 1426 N GLY A 90 108.097 -10.388 17.765 1.00 0.00 N ATOM 1427 CA GLY A 90 106.672 -10.577 17.972 1.00 0.00 C ATOM 1428 C GLY A 90 105.870 -9.402 17.499 1.00 0.00 C ATOM 1429 O GLY A 90 104.704 -9.249 17.856 1.00 0.00 O ATOM 0 H GLY A 90 108.469 -10.772 16.896 1.00 0.00 H new ATOM 0 HA2 GLY A 90 106.346 -11.473 17.444 1.00 0.00 H new ATOM 0 HA3 GLY A 90 106.479 -10.743 19.032 1.00 0.00 H new ATOM 1433 N ALA A 91 106.495 -8.542 16.756 1.00 0.00 N ATOM 1434 CA ALA A 91 105.845 -7.274 16.397 1.00 0.00 C ATOM 1435 C ALA A 91 105.475 -7.233 14.902 1.00 0.00 C ATOM 1436 O ALA A 91 105.536 -8.244 14.217 1.00 0.00 O ATOM 1437 CB ALA A 91 106.712 -6.095 16.836 1.00 0.00 C ATOM 0 H ALA A 91 107.435 -8.670 16.382 1.00 0.00 H new ATOM 0 HA ALA A 91 104.901 -7.195 16.935 1.00 0.00 H new ATOM 0 HB1 ALA A 91 106.220 -5.161 16.565 1.00 0.00 H new ATOM 0 HB2 ALA A 91 106.854 -6.130 17.916 1.00 0.00 H new ATOM 0 HB3 ALA A 91 107.681 -6.152 16.341 1.00 0.00 H new ATOM 1443 N SER A 92 105.070 -6.086 14.411 1.00 0.00 N ATOM 1444 CA SER A 92 104.547 -5.970 13.061 1.00 0.00 C ATOM 1445 C SER A 92 104.818 -4.611 12.456 1.00 0.00 C ATOM 1446 O SER A 92 104.891 -3.618 13.185 1.00 0.00 O ATOM 1447 CB SER A 92 103.060 -6.235 13.112 1.00 0.00 C ATOM 1448 OG SER A 92 102.424 -5.967 11.883 1.00 0.00 O ATOM 0 H SER A 92 105.091 -5.208 14.929 1.00 0.00 H new ATOM 0 HA SER A 92 105.050 -6.698 12.424 1.00 0.00 H new ATOM 0 HB2 SER A 92 102.888 -7.276 13.387 1.00 0.00 H new ATOM 0 HB3 SER A 92 102.611 -5.620 13.892 1.00 0.00 H new ATOM 0 HG SER A 92 101.459 -6.108 11.977 1.00 0.00 H new ATOM 1454 N VAL A 93 104.985 -4.594 11.129 1.00 0.00 N ATOM 1455 CA VAL A 93 105.070 -3.379 10.310 1.00 0.00 C ATOM 1456 C VAL A 93 104.657 -3.680 8.898 1.00 0.00 C ATOM 1457 O VAL A 93 104.889 -4.783 8.395 1.00 0.00 O ATOM 1458 CB VAL A 93 106.453 -2.671 10.275 1.00 0.00 C ATOM 1459 CG1 VAL A 93 106.754 -1.942 11.554 1.00 0.00 C ATOM 1460 CG2 VAL A 93 107.536 -3.645 9.992 1.00 0.00 C ATOM 0 H VAL A 93 105.067 -5.449 10.579 1.00 0.00 H new ATOM 0 HA VAL A 93 104.392 -2.682 10.803 1.00 0.00 H new ATOM 0 HB VAL A 93 106.406 -1.935 9.473 1.00 0.00 H new ATOM 0 HG11 VAL A 93 107.731 -1.464 11.479 1.00 0.00 H new ATOM 0 HG12 VAL A 93 105.991 -1.183 11.728 1.00 0.00 H new ATOM 0 HG13 VAL A 93 106.758 -2.649 12.383 1.00 0.00 H new ATOM 0 HG21 VAL A 93 108.495 -3.127 9.972 1.00 0.00 H new ATOM 0 HG22 VAL A 93 107.552 -4.408 10.770 1.00 0.00 H new ATOM 0 HG23 VAL A 93 107.358 -4.116 9.025 1.00 0.00 H new ATOM 1470 N ASP A 94 104.040 -2.718 8.287 1.00 0.00 N ATOM 1471 CA ASP A 94 103.602 -2.796 6.923 1.00 0.00 C ATOM 1472 C ASP A 94 104.644 -2.162 6.046 1.00 0.00 C ATOM 1473 O ASP A 94 104.793 -0.950 6.034 1.00 0.00 O ATOM 1474 CB ASP A 94 102.291 -2.027 6.759 1.00 0.00 C ATOM 1475 CG ASP A 94 101.117 -2.653 7.465 1.00 0.00 C ATOM 1476 OD1 ASP A 94 100.899 -2.375 8.671 1.00 0.00 O ATOM 1477 OD2 ASP A 94 100.373 -3.421 6.831 1.00 0.00 O ATOM 0 H ASP A 94 103.819 -1.828 8.734 1.00 0.00 H new ATOM 0 HA ASP A 94 103.451 -3.840 6.646 1.00 0.00 H new ATOM 0 HB2 ASP A 94 102.428 -1.013 7.134 1.00 0.00 H new ATOM 0 HB3 ASP A 94 102.061 -1.945 5.697 1.00 0.00 H new ATOM 1482 N LEU A 95 105.349 -2.945 5.323 1.00 0.00 N ATOM 1483 CA LEU A 95 106.389 -2.426 4.463 1.00 0.00 C ATOM 1484 C LEU A 95 105.842 -2.160 3.100 1.00 0.00 C ATOM 1485 O LEU A 95 105.303 -3.056 2.441 1.00 0.00 O ATOM 1486 CB LEU A 95 107.623 -3.351 4.343 1.00 0.00 C ATOM 1487 CG LEU A 95 108.434 -3.652 5.613 1.00 0.00 C ATOM 1488 CD1 LEU A 95 108.813 -2.387 6.363 1.00 0.00 C ATOM 1489 CD2 LEU A 95 107.703 -4.608 6.509 1.00 0.00 C ATOM 0 H LEU A 95 105.238 -3.959 5.296 1.00 0.00 H new ATOM 0 HA LEU A 95 106.730 -1.503 4.932 1.00 0.00 H new ATOM 0 HB2 LEU A 95 107.287 -4.302 3.930 1.00 0.00 H new ATOM 0 HB3 LEU A 95 108.301 -2.908 3.613 1.00 0.00 H new ATOM 0 HG LEU A 95 109.361 -4.127 5.292 1.00 0.00 H new ATOM 0 HD11 LEU A 95 109.385 -2.649 7.253 1.00 0.00 H new ATOM 0 HD12 LEU A 95 109.417 -1.749 5.718 1.00 0.00 H new ATOM 0 HD13 LEU A 95 107.909 -1.854 6.657 1.00 0.00 H new ATOM 0 HD21 LEU A 95 108.301 -4.802 7.399 1.00 0.00 H new ATOM 0 HD22 LEU A 95 106.747 -4.174 6.802 1.00 0.00 H new ATOM 0 HD23 LEU A 95 107.529 -5.544 5.978 1.00 0.00 H new ATOM 1501 N GLU A 96 105.940 -0.942 2.691 1.00 0.00 N ATOM 1502 CA GLU A 96 105.526 -0.568 1.381 1.00 0.00 C ATOM 1503 C GLU A 96 106.745 -0.581 0.489 1.00 0.00 C ATOM 1504 O GLU A 96 107.757 0.090 0.795 1.00 0.00 O ATOM 1505 CB GLU A 96 104.880 0.807 1.372 1.00 0.00 C ATOM 1506 CG GLU A 96 103.667 0.948 2.279 1.00 0.00 C ATOM 1507 CD GLU A 96 103.017 2.308 2.159 1.00 0.00 C ATOM 1508 OE1 GLU A 96 103.722 3.299 1.926 1.00 0.00 O ATOM 1509 OE2 GLU A 96 101.783 2.402 2.276 1.00 0.00 O ATOM 0 H GLU A 96 106.309 -0.176 3.255 1.00 0.00 H new ATOM 0 HA GLU A 96 104.777 -1.274 1.021 1.00 0.00 H new ATOM 0 HB2 GLU A 96 105.625 1.545 1.668 1.00 0.00 H new ATOM 0 HB3 GLU A 96 104.583 1.047 0.351 1.00 0.00 H new ATOM 0 HG2 GLU A 96 102.938 0.176 2.031 1.00 0.00 H new ATOM 0 HG3 GLU A 96 103.968 0.781 3.313 1.00 0.00 H new ATOM 1516 N LEU A 97 106.678 -1.363 -0.555 1.00 0.00 N ATOM 1517 CA LEU A 97 107.758 -1.504 -1.490 1.00 0.00 C ATOM 1518 C LEU A 97 107.327 -1.008 -2.842 1.00 0.00 C ATOM 1519 O LEU A 97 106.137 -1.062 -3.187 1.00 0.00 O ATOM 1520 CB LEU A 97 108.163 -2.981 -1.707 1.00 0.00 C ATOM 1521 CG LEU A 97 108.602 -3.849 -0.523 1.00 0.00 C ATOM 1522 CD1 LEU A 97 109.552 -3.133 0.410 1.00 0.00 C ATOM 1523 CD2 LEU A 97 107.442 -4.498 0.206 1.00 0.00 C ATOM 0 H LEU A 97 105.859 -1.927 -0.782 1.00 0.00 H new ATOM 0 HA LEU A 97 108.592 -0.939 -1.073 1.00 0.00 H new ATOM 0 HB2 LEU A 97 107.316 -3.481 -2.176 1.00 0.00 H new ATOM 0 HB3 LEU A 97 108.978 -2.988 -2.431 1.00 0.00 H new ATOM 0 HG LEU A 97 109.170 -4.670 -0.960 1.00 0.00 H new ATOM 0 HD11 LEU A 97 109.828 -3.798 1.229 1.00 0.00 H new ATOM 0 HD12 LEU A 97 110.448 -2.840 -0.137 1.00 0.00 H new ATOM 0 HD13 LEU A 97 109.066 -2.244 0.812 1.00 0.00 H new ATOM 0 HD21 LEU A 97 107.822 -5.098 1.033 1.00 0.00 H new ATOM 0 HD22 LEU A 97 106.778 -3.725 0.594 1.00 0.00 H new ATOM 0 HD23 LEU A 97 106.891 -5.138 -0.484 1.00 0.00 H new ATOM 1535 N CYS A 98 108.263 -0.540 -3.603 1.00 0.00 N ATOM 1536 CA CYS A 98 108.008 -0.278 -4.975 1.00 0.00 C ATOM 1537 C CYS A 98 108.923 -1.176 -5.765 1.00 0.00 C ATOM 1538 O CYS A 98 110.145 -1.062 -5.706 1.00 0.00 O ATOM 1539 CB CYS A 98 108.148 1.201 -5.349 1.00 0.00 C ATOM 1540 SG CYS A 98 107.354 1.641 -6.919 1.00 0.00 S ATOM 0 H CYS A 98 109.212 -0.332 -3.293 1.00 0.00 H new ATOM 0 HA CYS A 98 106.966 -0.497 -5.209 1.00 0.00 H new ATOM 0 HB2 CYS A 98 107.718 1.809 -4.553 1.00 0.00 H new ATOM 0 HB3 CYS A 98 109.207 1.453 -5.406 1.00 0.00 H new ATOM 0 HG CYS A 98 108.108 1.262 -7.908 1.00 0.00 H new ATOM 1546 N ARG A 99 108.335 -2.118 -6.424 1.00 0.00 N ATOM 1547 CA ARG A 99 109.058 -3.113 -7.144 1.00 0.00 C ATOM 1548 C ARG A 99 109.051 -2.721 -8.617 1.00 0.00 C ATOM 1549 O ARG A 99 108.175 -1.980 -9.051 1.00 0.00 O ATOM 1550 CB ARG A 99 108.378 -4.469 -6.944 1.00 0.00 C ATOM 1551 CG ARG A 99 109.163 -5.653 -7.449 1.00 0.00 C ATOM 1552 CD ARG A 99 110.258 -6.065 -6.475 1.00 0.00 C ATOM 1553 NE ARG A 99 109.693 -6.612 -5.263 1.00 0.00 N ATOM 1554 CZ ARG A 99 109.078 -7.778 -5.126 1.00 0.00 C ATOM 1555 NH1 ARG A 99 108.974 -8.637 -6.139 1.00 0.00 N ATOM 1556 NH2 ARG A 99 108.608 -8.080 -3.957 1.00 0.00 N ATOM 0 H ARG A 99 107.322 -2.220 -6.478 1.00 0.00 H new ATOM 0 HA ARG A 99 110.086 -3.187 -6.789 1.00 0.00 H new ATOM 0 HB2 ARG A 99 108.183 -4.608 -5.881 1.00 0.00 H new ATOM 0 HB3 ARG A 99 107.411 -4.452 -7.446 1.00 0.00 H new ATOM 0 HG2 ARG A 99 108.488 -6.493 -7.613 1.00 0.00 H new ATOM 0 HG3 ARG A 99 109.608 -5.409 -8.414 1.00 0.00 H new ATOM 0 HD2 ARG A 99 110.907 -6.804 -6.944 1.00 0.00 H new ATOM 0 HD3 ARG A 99 110.879 -5.202 -6.234 1.00 0.00 H new ATOM 0 HE ARG A 99 109.776 -6.040 -4.423 1.00 0.00 H new ATOM 0 HH11 ARG A 99 109.373 -8.404 -7.048 1.00 0.00 H new ATOM 0 HH12 ARG A 99 108.495 -9.528 -6.005 1.00 0.00 H new ATOM 0 HH21 ARG A 99 108.717 -7.429 -3.180 1.00 0.00 H new ATOM 0 HH22 ARG A 99 108.129 -8.969 -3.814 1.00 0.00 H new ATOM 1570 N GLY A 100 109.989 -3.220 -9.371 1.00 0.00 N ATOM 1571 CA GLY A 100 110.099 -2.854 -10.766 1.00 0.00 C ATOM 1572 C GLY A 100 111.491 -2.395 -11.036 1.00 0.00 C ATOM 1573 O GLY A 100 111.933 -2.293 -12.172 1.00 0.00 O ATOM 0 H GLY A 100 110.693 -3.883 -9.048 1.00 0.00 H new ATOM 0 HA2 GLY A 100 109.853 -3.706 -11.400 1.00 0.00 H new ATOM 0 HA3 GLY A 100 109.388 -2.063 -11.005 1.00 0.00 H new ATOM 1577 N TYR A 101 112.173 -2.120 -9.962 1.00 0.00 N ATOM 1578 CA TYR A 101 113.539 -1.732 -9.986 1.00 0.00 C ATOM 1579 C TYR A 101 114.380 -2.962 -9.773 1.00 0.00 C ATOM 1580 O TYR A 101 114.131 -3.727 -8.852 1.00 0.00 O ATOM 1581 CB TYR A 101 113.819 -0.724 -8.871 1.00 0.00 C ATOM 1582 CG TYR A 101 113.091 0.588 -9.031 1.00 0.00 C ATOM 1583 CD1 TYR A 101 111.805 0.769 -8.531 1.00 0.00 C ATOM 1584 CD2 TYR A 101 113.691 1.642 -9.685 1.00 0.00 C ATOM 1585 CE1 TYR A 101 111.150 1.971 -8.687 1.00 0.00 C ATOM 1586 CE2 TYR A 101 113.045 2.839 -9.841 1.00 0.00 C ATOM 1587 CZ TYR A 101 111.779 3.003 -9.344 1.00 0.00 C ATOM 1588 OH TYR A 101 111.135 4.205 -9.519 1.00 0.00 O ATOM 0 H TYR A 101 111.776 -2.163 -9.023 1.00 0.00 H new ATOM 0 HA TYR A 101 113.776 -1.267 -10.943 1.00 0.00 H new ATOM 0 HB2 TYR A 101 113.540 -1.168 -7.916 1.00 0.00 H new ATOM 0 HB3 TYR A 101 114.891 -0.530 -8.831 1.00 0.00 H new ATOM 0 HD1 TYR A 101 111.314 -0.043 -8.014 1.00 0.00 H new ATOM 0 HD2 TYR A 101 114.688 1.522 -10.082 1.00 0.00 H new ATOM 0 HE1 TYR A 101 110.151 2.102 -8.297 1.00 0.00 H new ATOM 0 HE2 TYR A 101 113.533 3.653 -10.356 1.00 0.00 H new ATOM 0 HH TYR A 101 111.721 4.935 -9.229 1.00 0.00 H new ATOM 1598 N PRO A 102 115.310 -3.232 -10.658 1.00 0.00 N ATOM 1599 CA PRO A 102 116.232 -4.329 -10.483 1.00 0.00 C ATOM 1600 C PRO A 102 117.418 -3.874 -9.639 1.00 0.00 C ATOM 1601 O PRO A 102 117.420 -2.763 -9.085 1.00 0.00 O ATOM 1602 CB PRO A 102 116.680 -4.608 -11.920 1.00 0.00 C ATOM 1603 CG PRO A 102 116.635 -3.282 -12.595 1.00 0.00 C ATOM 1604 CD PRO A 102 115.529 -2.513 -11.928 1.00 0.00 C ATOM 0 HA PRO A 102 115.804 -5.197 -9.981 1.00 0.00 H new ATOM 0 HB2 PRO A 102 117.684 -5.032 -11.946 1.00 0.00 H new ATOM 0 HB3 PRO A 102 116.019 -5.324 -12.409 1.00 0.00 H new ATOM 0 HG2 PRO A 102 117.587 -2.761 -12.495 1.00 0.00 H new ATOM 0 HG3 PRO A 102 116.443 -3.394 -13.662 1.00 0.00 H new ATOM 0 HD2 PRO A 102 115.813 -1.475 -11.755 1.00 0.00 H new ATOM 0 HD3 PRO A 102 114.627 -2.499 -12.540 1.00 0.00 H new ATOM 1612 N LEU A 103 118.400 -4.714 -9.534 1.00 0.00 N ATOM 1613 CA LEU A 103 119.630 -4.382 -8.866 1.00 0.00 C ATOM 1614 C LEU A 103 120.696 -4.209 -9.953 1.00 0.00 C ATOM 1615 O LEU A 103 121.416 -5.162 -10.270 1.00 0.00 O ATOM 1616 CB LEU A 103 120.022 -5.518 -7.887 1.00 0.00 C ATOM 1617 CG LEU A 103 120.015 -5.214 -6.381 1.00 0.00 C ATOM 1618 CD1 LEU A 103 121.005 -4.115 -6.016 1.00 0.00 C ATOM 1619 CD2 LEU A 103 118.617 -4.868 -5.916 1.00 0.00 C ATOM 0 H LEU A 103 118.375 -5.661 -9.912 1.00 0.00 H new ATOM 0 HA LEU A 103 119.529 -3.467 -8.283 1.00 0.00 H new ATOM 0 HB2 LEU A 103 119.346 -6.355 -8.061 1.00 0.00 H new ATOM 0 HB3 LEU A 103 121.023 -5.856 -8.154 1.00 0.00 H new ATOM 0 HG LEU A 103 120.338 -6.116 -5.861 1.00 0.00 H new ATOM 0 HD11 LEU A 103 120.967 -3.933 -4.942 1.00 0.00 H new ATOM 0 HD12 LEU A 103 122.012 -4.425 -6.296 1.00 0.00 H new ATOM 0 HD13 LEU A 103 120.746 -3.200 -6.549 1.00 0.00 H new ATOM 0 HD21 LEU A 103 118.631 -4.656 -4.847 1.00 0.00 H new ATOM 0 HD22 LEU A 103 118.261 -3.990 -6.456 1.00 0.00 H new ATOM 0 HD23 LEU A 103 117.951 -5.708 -6.110 1.00 0.00 H new ATOM 1631 N PRO A 104 120.791 -3.002 -10.585 1.00 0.00 N ATOM 1632 CA PRO A 104 121.723 -2.770 -11.694 1.00 0.00 C ATOM 1633 C PRO A 104 123.145 -2.820 -11.196 1.00 0.00 C ATOM 1634 O PRO A 104 123.983 -3.566 -11.705 1.00 0.00 O ATOM 1635 CB PRO A 104 121.376 -1.346 -12.181 1.00 0.00 C ATOM 1636 CG PRO A 104 120.069 -1.019 -11.540 1.00 0.00 C ATOM 1637 CD PRO A 104 120.044 -1.777 -10.251 1.00 0.00 C ATOM 0 HA PRO A 104 121.638 -3.518 -12.483 1.00 0.00 H new ATOM 0 HB2 PRO A 104 122.146 -0.632 -11.890 1.00 0.00 H new ATOM 0 HB3 PRO A 104 121.301 -1.309 -13.268 1.00 0.00 H new ATOM 0 HG2 PRO A 104 119.977 0.053 -11.365 1.00 0.00 H new ATOM 0 HG3 PRO A 104 119.236 -1.310 -12.180 1.00 0.00 H new ATOM 0 HD2 PRO A 104 120.519 -1.220 -9.444 1.00 0.00 H new ATOM 0 HD3 PRO A 104 119.026 -1.998 -9.930 1.00 0.00 H new ATOM 1645 N PHE A 105 123.396 -2.051 -10.183 1.00 0.00 N ATOM 1646 CA PHE A 105 124.665 -2.014 -9.565 1.00 0.00 C ATOM 1647 C PHE A 105 124.515 -2.756 -8.266 1.00 0.00 C ATOM 1648 O PHE A 105 123.693 -2.361 -7.415 1.00 0.00 O ATOM 1649 CB PHE A 105 125.059 -0.556 -9.282 1.00 0.00 C ATOM 1650 CG PHE A 105 124.983 0.354 -10.482 1.00 0.00 C ATOM 1651 CD1 PHE A 105 125.973 0.340 -11.447 1.00 0.00 C ATOM 1652 CD2 PHE A 105 123.915 1.230 -10.634 1.00 0.00 C ATOM 1653 CE1 PHE A 105 125.903 1.180 -12.542 1.00 0.00 C ATOM 1654 CE2 PHE A 105 123.840 2.069 -11.728 1.00 0.00 C ATOM 1655 CZ PHE A 105 124.835 2.044 -12.682 1.00 0.00 C ATOM 0 H PHE A 105 122.708 -1.426 -9.763 1.00 0.00 H new ATOM 0 HA PHE A 105 125.434 -2.458 -10.197 1.00 0.00 H new ATOM 0 HB2 PHE A 105 124.409 -0.162 -8.501 1.00 0.00 H new ATOM 0 HB3 PHE A 105 126.076 -0.537 -8.890 1.00 0.00 H new ATOM 0 HD1 PHE A 105 126.810 -0.335 -11.344 1.00 0.00 H new ATOM 0 HD2 PHE A 105 123.135 1.255 -9.888 1.00 0.00 H new ATOM 0 HE1 PHE A 105 126.684 1.161 -13.288 1.00 0.00 H new ATOM 0 HE2 PHE A 105 123.004 2.744 -11.836 1.00 0.00 H new ATOM 0 HZ PHE A 105 124.779 2.700 -13.538 1.00 0.00 H new ATOM 1665 N ASP A 106 125.270 -3.806 -8.088 1.00 0.00 N ATOM 1666 CA ASP A 106 125.176 -4.579 -6.867 1.00 0.00 C ATOM 1667 C ASP A 106 125.922 -3.887 -5.809 1.00 0.00 C ATOM 1668 O ASP A 106 126.904 -3.226 -6.075 1.00 0.00 O ATOM 1669 CB ASP A 106 125.744 -5.983 -6.994 1.00 0.00 C ATOM 1670 CG ASP A 106 124.980 -6.875 -7.924 1.00 0.00 C ATOM 1671 OD1 ASP A 106 124.042 -7.561 -7.463 1.00 0.00 O ATOM 1672 OD2 ASP A 106 125.317 -6.929 -9.117 1.00 0.00 O ATOM 0 H ASP A 106 125.953 -4.149 -8.763 1.00 0.00 H new ATOM 0 HA ASP A 106 124.115 -4.670 -6.636 1.00 0.00 H new ATOM 0 HB2 ASP A 106 126.775 -5.915 -7.340 1.00 0.00 H new ATOM 0 HB3 ASP A 106 125.769 -6.443 -6.006 1.00 0.00 H new ATOM 1677 N PRO A 107 125.481 -4.019 -4.580 1.00 0.00 N ATOM 1678 CA PRO A 107 126.108 -3.412 -3.436 1.00 0.00 C ATOM 1679 C PRO A 107 127.065 -4.424 -2.851 1.00 0.00 C ATOM 1680 O PRO A 107 127.596 -4.277 -1.756 1.00 0.00 O ATOM 1681 CB PRO A 107 124.887 -3.174 -2.522 1.00 0.00 C ATOM 1682 CG PRO A 107 123.727 -3.707 -3.313 1.00 0.00 C ATOM 1683 CD PRO A 107 124.328 -4.753 -4.130 1.00 0.00 C ATOM 0 HA PRO A 107 126.683 -2.503 -3.615 1.00 0.00 H new ATOM 0 HB2 PRO A 107 124.994 -3.695 -1.571 1.00 0.00 H new ATOM 0 HB3 PRO A 107 124.761 -2.116 -2.293 1.00 0.00 H new ATOM 0 HG2 PRO A 107 122.946 -4.103 -2.664 1.00 0.00 H new ATOM 0 HG3 PRO A 107 123.269 -2.931 -3.927 1.00 0.00 H new ATOM 0 HD2 PRO A 107 124.588 -5.643 -3.557 1.00 0.00 H new ATOM 0 HD3 PRO A 107 123.684 -5.077 -4.948 1.00 0.00 H new ATOM 1691 N ASP A 108 127.216 -5.485 -3.630 1.00 0.00 N ATOM 1692 CA ASP A 108 128.100 -6.550 -3.374 1.00 0.00 C ATOM 1693 C ASP A 108 129.470 -6.071 -3.795 1.00 0.00 C ATOM 1694 O ASP A 108 130.498 -6.419 -3.217 1.00 0.00 O ATOM 1695 CB ASP A 108 127.686 -7.758 -4.203 1.00 0.00 C ATOM 1696 CG ASP A 108 128.504 -8.990 -3.917 1.00 0.00 C ATOM 1697 OD1 ASP A 108 128.260 -9.644 -2.883 1.00 0.00 O ATOM 1698 OD2 ASP A 108 129.357 -9.364 -4.745 1.00 0.00 O ATOM 0 H ASP A 108 126.687 -5.607 -4.494 1.00 0.00 H new ATOM 0 HA ASP A 108 128.093 -6.843 -2.324 1.00 0.00 H new ATOM 0 HB2 ASP A 108 126.635 -7.977 -4.013 1.00 0.00 H new ATOM 0 HB3 ASP A 108 127.774 -7.510 -5.261 1.00 0.00 H new ATOM 1703 N ASP A 109 129.422 -5.219 -4.815 1.00 0.00 N ATOM 1704 CA ASP A 109 130.547 -4.514 -5.364 1.00 0.00 C ATOM 1705 C ASP A 109 130.982 -3.496 -4.308 1.00 0.00 C ATOM 1706 O ASP A 109 130.124 -2.965 -3.590 1.00 0.00 O ATOM 1707 CB ASP A 109 130.073 -3.812 -6.660 1.00 0.00 C ATOM 1708 CG ASP A 109 131.132 -3.004 -7.379 1.00 0.00 C ATOM 1709 OD1 ASP A 109 132.001 -3.596 -8.060 1.00 0.00 O ATOM 1710 OD2 ASP A 109 131.093 -1.749 -7.314 1.00 0.00 O ATOM 0 H ASP A 109 128.549 -5.000 -5.295 1.00 0.00 H new ATOM 0 HA ASP A 109 131.384 -5.167 -5.609 1.00 0.00 H new ATOM 0 HB2 ASP A 109 129.689 -4.568 -7.344 1.00 0.00 H new ATOM 0 HB3 ASP A 109 129.241 -3.153 -6.414 1.00 0.00 H new ATOM 1715 N PRO A 110 132.298 -3.276 -4.149 1.00 0.00 N ATOM 1716 CA PRO A 110 132.884 -2.383 -3.126 1.00 0.00 C ATOM 1717 C PRO A 110 132.317 -0.959 -3.031 1.00 0.00 C ATOM 1718 O PRO A 110 131.435 -0.532 -3.783 1.00 0.00 O ATOM 1719 CB PRO A 110 134.336 -2.270 -3.565 1.00 0.00 C ATOM 1720 CG PRO A 110 134.620 -3.553 -4.230 1.00 0.00 C ATOM 1721 CD PRO A 110 133.355 -3.932 -4.939 1.00 0.00 C ATOM 0 HA PRO A 110 132.682 -2.809 -2.143 1.00 0.00 H new ATOM 0 HB2 PRO A 110 134.481 -1.430 -4.244 1.00 0.00 H new ATOM 0 HB3 PRO A 110 134.997 -2.109 -2.713 1.00 0.00 H new ATOM 0 HG2 PRO A 110 135.448 -3.455 -4.932 1.00 0.00 H new ATOM 0 HG3 PRO A 110 134.906 -4.315 -3.505 1.00 0.00 H new ATOM 0 HD2 PRO A 110 133.356 -3.584 -5.972 1.00 0.00 H new ATOM 0 HD3 PRO A 110 133.221 -5.013 -4.967 1.00 0.00 H new ATOM 1729 N ASN A 111 132.883 -0.243 -2.066 1.00 0.00 N ATOM 1730 CA ASN A 111 132.658 1.154 -1.780 1.00 0.00 C ATOM 1731 C ASN A 111 131.411 1.434 -0.958 1.00 0.00 C ATOM 1732 O ASN A 111 131.439 2.295 -0.069 1.00 0.00 O ATOM 1733 CB ASN A 111 132.734 2.077 -3.001 1.00 0.00 C ATOM 1734 CG ASN A 111 134.117 2.222 -3.653 1.00 0.00 C ATOM 1735 OD1 ASN A 111 134.425 3.255 -4.237 1.00 0.00 O ATOM 1736 ND2 ASN A 111 134.952 1.223 -3.560 1.00 0.00 N ATOM 0 H ASN A 111 133.556 -0.660 -1.423 1.00 0.00 H new ATOM 0 HA ASN A 111 133.511 1.405 -1.150 1.00 0.00 H new ATOM 0 HB2 ASN A 111 132.037 1.709 -3.754 1.00 0.00 H new ATOM 0 HB3 ASN A 111 132.389 3.067 -2.704 1.00 0.00 H new ATOM 0 HD21 ASN A 111 135.880 1.293 -3.977 1.00 0.00 H new ATOM 0 HD22 ASN A 111 134.677 0.372 -3.070 1.00 0.00 H new ATOM 1743 N THR A 112 130.339 0.690 -1.233 1.00 0.00 N ATOM 1744 CA THR A 112 129.033 0.847 -0.590 1.00 0.00 C ATOM 1745 C THR A 112 128.366 2.161 -0.999 1.00 0.00 C ATOM 1746 O THR A 112 127.424 2.194 -1.810 1.00 0.00 O ATOM 1747 CB THR A 112 129.124 0.690 0.956 1.00 0.00 C ATOM 1748 OG1 THR A 112 129.759 -0.567 1.272 1.00 0.00 O ATOM 1749 CG2 THR A 112 127.745 0.724 1.604 1.00 0.00 C ATOM 0 H THR A 112 130.355 -0.058 -1.927 1.00 0.00 H new ATOM 0 HA THR A 112 128.394 0.039 -0.946 1.00 0.00 H new ATOM 0 HB THR A 112 129.708 1.524 1.345 1.00 0.00 H new ATOM 0 HG1 THR A 112 129.819 -0.668 2.245 1.00 0.00 H new ATOM 0 HG21 THR A 112 127.847 0.612 2.683 1.00 0.00 H new ATOM 0 HG22 THR A 112 127.262 1.676 1.382 1.00 0.00 H new ATOM 0 HG23 THR A 112 127.138 -0.091 1.210 1.00 0.00 H new ATOM 1757 N SER A 113 128.880 3.182 -0.470 1.00 0.00 N ATOM 1758 CA SER A 113 128.516 4.522 -0.740 1.00 0.00 C ATOM 1759 C SER A 113 129.111 4.907 -2.086 1.00 0.00 C ATOM 1760 O SER A 113 130.314 5.156 -2.192 1.00 0.00 O ATOM 1761 CB SER A 113 129.116 5.381 0.347 1.00 0.00 C ATOM 1762 OG SER A 113 128.661 4.984 1.634 1.00 0.00 O ATOM 0 H SER A 113 129.628 3.112 0.220 1.00 0.00 H new ATOM 0 HA SER A 113 127.434 4.652 -0.767 1.00 0.00 H new ATOM 0 HB2 SER A 113 130.203 5.314 0.307 1.00 0.00 H new ATOM 0 HB3 SER A 113 128.855 6.425 0.173 1.00 0.00 H new ATOM 0 HG SER A 113 129.068 5.558 2.316 1.00 0.00 H new ATOM 1768 N LEU A 114 128.300 4.928 -3.113 1.00 0.00 N ATOM 1769 CA LEU A 114 128.826 5.157 -4.434 1.00 0.00 C ATOM 1770 C LEU A 114 128.684 6.580 -4.838 1.00 0.00 C ATOM 1771 O LEU A 114 127.625 7.006 -5.253 1.00 0.00 O ATOM 1772 CB LEU A 114 128.084 4.298 -5.426 1.00 0.00 C ATOM 1773 CG LEU A 114 128.023 2.833 -5.091 1.00 0.00 C ATOM 1774 CD1 LEU A 114 127.343 2.091 -6.199 1.00 0.00 C ATOM 1775 CD2 LEU A 114 129.411 2.298 -4.807 1.00 0.00 C ATOM 0 H LEU A 114 127.290 4.792 -3.063 1.00 0.00 H new ATOM 0 HA LEU A 114 129.886 4.903 -4.420 1.00 0.00 H new ATOM 0 HB2 LEU A 114 127.065 4.675 -5.518 1.00 0.00 H new ATOM 0 HB3 LEU A 114 128.555 4.411 -6.403 1.00 0.00 H new ATOM 0 HG LEU A 114 127.435 2.687 -4.185 1.00 0.00 H new ATOM 0 HD11 LEU A 114 127.300 1.030 -5.954 1.00 0.00 H new ATOM 0 HD12 LEU A 114 126.331 2.475 -6.327 1.00 0.00 H new ATOM 0 HD13 LEU A 114 127.902 2.227 -7.125 1.00 0.00 H new ATOM 0 HD21 LEU A 114 129.350 1.237 -4.566 1.00 0.00 H new ATOM 0 HD22 LEU A 114 130.041 2.435 -5.686 1.00 0.00 H new ATOM 0 HD23 LEU A 114 129.843 2.837 -3.964 1.00 0.00 H new ATOM 1787 N VAL A 115 129.764 7.277 -4.790 1.00 0.00 N ATOM 1788 CA VAL A 115 129.801 8.646 -5.178 1.00 0.00 C ATOM 1789 C VAL A 115 130.466 8.749 -6.528 1.00 0.00 C ATOM 1790 O VAL A 115 131.665 8.470 -6.672 1.00 0.00 O ATOM 1791 CB VAL A 115 130.549 9.522 -4.140 1.00 0.00 C ATOM 1792 CG1 VAL A 115 130.586 10.982 -4.578 1.00 0.00 C ATOM 1793 CG2 VAL A 115 129.886 9.401 -2.776 1.00 0.00 C ATOM 0 H VAL A 115 130.661 6.908 -4.475 1.00 0.00 H new ATOM 0 HA VAL A 115 128.779 9.020 -5.232 1.00 0.00 H new ATOM 0 HB VAL A 115 131.576 9.162 -4.071 1.00 0.00 H new ATOM 0 HG11 VAL A 115 131.117 11.573 -3.831 1.00 0.00 H new ATOM 0 HG12 VAL A 115 131.100 11.062 -5.536 1.00 0.00 H new ATOM 0 HG13 VAL A 115 129.568 11.357 -4.681 1.00 0.00 H new ATOM 0 HG21 VAL A 115 130.420 10.021 -2.056 1.00 0.00 H new ATOM 0 HG22 VAL A 115 128.850 9.734 -2.844 1.00 0.00 H new ATOM 0 HG23 VAL A 115 129.912 8.361 -2.450 1.00 0.00 H new ATOM 1803 N THR A 116 129.703 9.114 -7.506 1.00 0.00 N ATOM 1804 CA THR A 116 130.207 9.248 -8.826 1.00 0.00 C ATOM 1805 C THR A 116 130.652 10.693 -9.005 1.00 0.00 C ATOM 1806 O THR A 116 130.127 11.613 -8.338 1.00 0.00 O ATOM 1807 CB THR A 116 129.112 8.871 -9.884 1.00 0.00 C ATOM 1808 OG1 THR A 116 129.681 8.782 -11.203 1.00 0.00 O ATOM 1809 CG2 THR A 116 127.987 9.897 -9.904 1.00 0.00 C ATOM 0 H THR A 116 128.710 9.327 -7.408 1.00 0.00 H new ATOM 0 HA THR A 116 131.047 8.570 -8.978 1.00 0.00 H new ATOM 0 HB THR A 116 128.708 7.901 -9.594 1.00 0.00 H new ATOM 0 HG1 THR A 116 128.981 8.544 -11.846 1.00 0.00 H new ATOM 0 HG21 THR A 116 127.244 9.608 -10.647 1.00 0.00 H new ATOM 0 HG22 THR A 116 127.518 9.942 -8.921 1.00 0.00 H new ATOM 0 HG23 THR A 116 128.392 10.876 -10.158 1.00 0.00 H new ATOM 1817 N SER A 117 131.612 10.901 -9.832 1.00 0.00 N ATOM 1818 CA SER A 117 132.041 12.211 -10.112 1.00 0.00 C ATOM 1819 C SER A 117 131.322 12.691 -11.353 1.00 0.00 C ATOM 1820 O SER A 117 131.362 12.030 -12.416 1.00 0.00 O ATOM 1821 CB SER A 117 133.568 12.258 -10.245 1.00 0.00 C ATOM 1822 OG SER A 117 134.047 11.206 -11.076 1.00 0.00 O ATOM 0 H SER A 117 132.117 10.167 -10.329 1.00 0.00 H new ATOM 0 HA SER A 117 131.792 12.886 -9.293 1.00 0.00 H new ATOM 0 HB2 SER A 117 133.870 13.219 -10.661 1.00 0.00 H new ATOM 0 HB3 SER A 117 134.024 12.181 -9.258 1.00 0.00 H new ATOM 0 HG SER A 117 133.419 11.061 -11.814 1.00 0.00 H new ATOM 1828 N VAL A 118 130.629 13.782 -11.220 1.00 0.00 N ATOM 1829 CA VAL A 118 129.886 14.329 -12.306 1.00 0.00 C ATOM 1830 C VAL A 118 130.767 15.331 -12.999 1.00 0.00 C ATOM 1831 O VAL A 118 130.945 16.460 -12.534 1.00 0.00 O ATOM 1832 CB VAL A 118 128.591 15.026 -11.802 1.00 0.00 C ATOM 1833 CG1 VAL A 118 127.769 15.570 -12.963 1.00 0.00 C ATOM 1834 CG2 VAL A 118 127.759 14.067 -10.963 1.00 0.00 C ATOM 0 H VAL A 118 130.565 14.316 -10.353 1.00 0.00 H new ATOM 0 HA VAL A 118 129.587 13.533 -12.987 1.00 0.00 H new ATOM 0 HB VAL A 118 128.887 15.868 -11.177 1.00 0.00 H new ATOM 0 HG11 VAL A 118 126.870 16.051 -12.578 1.00 0.00 H new ATOM 0 HG12 VAL A 118 128.361 16.298 -13.518 1.00 0.00 H new ATOM 0 HG13 VAL A 118 127.487 14.751 -13.624 1.00 0.00 H new ATOM 0 HG21 VAL A 118 126.857 14.573 -10.619 1.00 0.00 H new ATOM 0 HG22 VAL A 118 127.483 13.202 -11.566 1.00 0.00 H new ATOM 0 HG23 VAL A 118 128.341 13.738 -10.102 1.00 0.00 H new ATOM 1844 N ALA A 119 131.333 14.907 -14.084 1.00 0.00 N ATOM 1845 CA ALA A 119 132.206 15.723 -14.846 1.00 0.00 C ATOM 1846 C ALA A 119 131.832 15.608 -16.294 1.00 0.00 C ATOM 1847 O ALA A 119 132.379 14.815 -17.025 1.00 0.00 O ATOM 1848 CB ALA A 119 133.659 15.311 -14.618 1.00 0.00 C ATOM 0 H ALA A 119 131.196 13.971 -14.466 1.00 0.00 H new ATOM 0 HA ALA A 119 132.109 16.762 -14.532 1.00 0.00 H new ATOM 0 HB1 ALA A 119 134.315 15.948 -15.211 1.00 0.00 H new ATOM 0 HB2 ALA A 119 133.906 15.418 -13.562 1.00 0.00 H new ATOM 0 HB3 ALA A 119 133.794 14.272 -14.918 1.00 0.00 H new ATOM 1854 N ILE A 120 130.831 16.328 -16.675 1.00 0.00 N ATOM 1855 CA ILE A 120 130.417 16.385 -18.064 1.00 0.00 C ATOM 1856 C ILE A 120 130.933 17.707 -18.631 1.00 0.00 C ATOM 1857 O ILE A 120 131.116 17.886 -19.830 1.00 0.00 O ATOM 1858 CB ILE A 120 128.835 16.269 -18.236 1.00 0.00 C ATOM 1859 CG1 ILE A 120 128.292 14.869 -17.848 1.00 0.00 C ATOM 1860 CG2 ILE A 120 128.382 16.600 -19.653 1.00 0.00 C ATOM 1861 CD1 ILE A 120 128.331 14.526 -16.374 1.00 0.00 C ATOM 0 H ILE A 120 130.268 16.898 -16.044 1.00 0.00 H new ATOM 0 HA ILE A 120 130.833 15.535 -18.605 1.00 0.00 H new ATOM 0 HB ILE A 120 128.421 17.006 -17.548 1.00 0.00 H new ATOM 0 HG12 ILE A 120 127.260 14.794 -18.191 1.00 0.00 H new ATOM 0 HG13 ILE A 120 128.864 14.116 -18.391 1.00 0.00 H new ATOM 0 HG21 ILE A 120 127.298 16.507 -19.720 1.00 0.00 H new ATOM 0 HG22 ILE A 120 128.674 17.621 -19.899 1.00 0.00 H new ATOM 0 HG23 ILE A 120 128.849 15.909 -20.355 1.00 0.00 H new ATOM 0 HD11 ILE A 120 127.927 13.525 -16.223 1.00 0.00 H new ATOM 0 HD12 ILE A 120 129.361 14.559 -16.020 1.00 0.00 H new ATOM 0 HD13 ILE A 120 127.733 15.247 -15.817 1.00 0.00 H new ATOM 1873 N LEU A 121 131.253 18.588 -17.726 1.00 0.00 N ATOM 1874 CA LEU A 121 131.690 19.928 -18.043 1.00 0.00 C ATOM 1875 C LEU A 121 133.041 20.164 -17.420 1.00 0.00 C ATOM 1876 O LEU A 121 133.383 19.513 -16.419 1.00 0.00 O ATOM 1877 CB LEU A 121 130.705 21.014 -17.514 1.00 0.00 C ATOM 1878 CG LEU A 121 129.271 21.072 -18.098 1.00 0.00 C ATOM 1879 CD1 LEU A 121 128.389 19.939 -17.601 1.00 0.00 C ATOM 1880 CD2 LEU A 121 128.629 22.415 -17.807 1.00 0.00 C ATOM 0 H LEU A 121 131.218 18.396 -16.725 1.00 0.00 H new ATOM 0 HA LEU A 121 131.732 20.011 -19.129 1.00 0.00 H new ATOM 0 HB2 LEU A 121 130.617 20.882 -16.436 1.00 0.00 H new ATOM 0 HB3 LEU A 121 131.168 21.987 -17.679 1.00 0.00 H new ATOM 0 HG LEU A 121 129.365 20.949 -19.177 1.00 0.00 H new ATOM 0 HD11 LEU A 121 127.397 20.030 -18.042 1.00 0.00 H new ATOM 0 HD12 LEU A 121 128.828 18.983 -17.888 1.00 0.00 H new ATOM 0 HD13 LEU A 121 128.309 19.990 -16.515 1.00 0.00 H new ATOM 0 HD21 LEU A 121 127.623 22.436 -18.225 1.00 0.00 H new ATOM 0 HD22 LEU A 121 128.577 22.567 -16.729 1.00 0.00 H new ATOM 0 HD23 LEU A 121 129.225 23.209 -18.257 1.00 0.00 H new ATOM 1892 N ASP A 122 133.832 21.047 -18.050 1.00 0.00 N ATOM 1893 CA ASP A 122 135.159 21.507 -17.542 1.00 0.00 C ATOM 1894 C ASP A 122 136.237 20.425 -17.668 1.00 0.00 C ATOM 1895 O ASP A 122 137.415 20.621 -17.346 1.00 0.00 O ATOM 1896 CB ASP A 122 135.025 22.064 -16.103 1.00 0.00 C ATOM 1897 CG ASP A 122 136.316 22.558 -15.486 1.00 0.00 C ATOM 1898 OD1 ASP A 122 136.716 23.721 -15.750 1.00 0.00 O ATOM 1899 OD2 ASP A 122 136.947 21.816 -14.713 1.00 0.00 O ATOM 0 H ASP A 122 133.575 21.475 -18.940 1.00 0.00 H new ATOM 0 HA ASP A 122 135.499 22.326 -18.176 1.00 0.00 H new ATOM 0 HB2 ASP A 122 134.307 22.884 -16.112 1.00 0.00 H new ATOM 0 HB3 ASP A 122 134.610 21.284 -15.465 1.00 0.00 H new ATOM 1904 N LYS A 123 135.836 19.346 -18.224 1.00 0.00 N ATOM 1905 CA LYS A 123 136.627 18.167 -18.366 1.00 0.00 C ATOM 1906 C LYS A 123 137.528 18.256 -19.603 1.00 0.00 C ATOM 1907 O LYS A 123 137.202 17.740 -20.672 1.00 0.00 O ATOM 1908 CB LYS A 123 135.654 17.022 -18.457 1.00 0.00 C ATOM 1909 CG LYS A 123 136.231 15.638 -18.437 1.00 0.00 C ATOM 1910 CD LYS A 123 135.098 14.655 -18.304 1.00 0.00 C ATOM 1911 CE LYS A 123 134.187 14.619 -19.536 1.00 0.00 C ATOM 1912 NZ LYS A 123 134.874 14.129 -20.737 1.00 0.00 N ATOM 0 H LYS A 123 134.899 19.248 -18.616 1.00 0.00 H new ATOM 0 HA LYS A 123 137.302 18.031 -17.521 1.00 0.00 H new ATOM 0 HB2 LYS A 123 134.950 17.108 -17.629 1.00 0.00 H new ATOM 0 HB3 LYS A 123 135.080 17.137 -19.376 1.00 0.00 H new ATOM 0 HG2 LYS A 123 136.793 15.448 -19.351 1.00 0.00 H new ATOM 0 HG3 LYS A 123 136.928 15.529 -17.606 1.00 0.00 H new ATOM 0 HD2 LYS A 123 135.507 13.659 -18.132 1.00 0.00 H new ATOM 0 HD3 LYS A 123 134.504 14.911 -17.427 1.00 0.00 H new ATOM 0 HE2 LYS A 123 133.328 13.981 -19.329 1.00 0.00 H new ATOM 0 HE3 LYS A 123 133.801 15.621 -19.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 134.183 13.997 -21.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 135.591 14.821 -21.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 135.336 13.221 -20.527 1.00 0.00 H new ATOM 1926 N GLU A 124 138.633 18.932 -19.446 1.00 0.00 N ATOM 1927 CA GLU A 124 139.587 19.104 -20.509 1.00 0.00 C ATOM 1928 C GLU A 124 140.717 18.092 -20.365 1.00 0.00 C ATOM 1929 O GLU A 124 141.422 18.076 -19.331 1.00 0.00 O ATOM 1930 CB GLU A 124 140.137 20.529 -20.503 1.00 0.00 C ATOM 1931 CG GLU A 124 139.076 21.599 -20.727 1.00 0.00 C ATOM 1932 CD GLU A 124 138.410 21.507 -22.087 1.00 0.00 C ATOM 1933 OE1 GLU A 124 137.504 20.684 -22.270 1.00 0.00 O ATOM 1934 OE2 GLU A 124 138.754 22.289 -22.987 1.00 0.00 O ATOM 0 H GLU A 124 138.899 19.383 -18.571 1.00 0.00 H new ATOM 0 HA GLU A 124 139.087 18.934 -21.463 1.00 0.00 H new ATOM 0 HB2 GLU A 124 140.630 20.714 -19.549 1.00 0.00 H new ATOM 0 HB3 GLU A 124 140.898 20.618 -21.278 1.00 0.00 H new ATOM 0 HG2 GLU A 124 138.315 21.515 -19.951 1.00 0.00 H new ATOM 0 HG3 GLU A 124 139.533 22.583 -20.620 1.00 0.00 H new ATOM 1941 N PRO A 125 140.882 17.202 -21.349 1.00 0.00 N ATOM 1942 CA PRO A 125 141.952 16.241 -21.351 1.00 0.00 C ATOM 1943 C PRO A 125 143.198 16.785 -22.095 1.00 0.00 C ATOM 1944 O PRO A 125 144.107 16.002 -22.397 1.00 0.00 O ATOM 1945 CB PRO A 125 141.336 15.058 -22.098 1.00 0.00 C ATOM 1946 CG PRO A 125 140.363 15.667 -23.060 1.00 0.00 C ATOM 1947 CD PRO A 125 140.011 17.040 -22.529 1.00 0.00 C ATOM 1948 OXT PRO A 125 143.252 17.997 -22.364 1.00 0.00 O ATOM 0 HA PRO A 125 142.306 15.988 -20.352 1.00 0.00 H new ATOM 0 HB2 PRO A 125 142.099 14.482 -22.621 1.00 0.00 H new ATOM 0 HB3 PRO A 125 140.836 14.375 -21.411 1.00 0.00 H new ATOM 0 HG2 PRO A 125 140.800 15.740 -24.056 1.00 0.00 H new ATOM 0 HG3 PRO A 125 139.470 15.048 -23.148 1.00 0.00 H new ATOM 0 HD2 PRO A 125 140.198 17.815 -23.272 1.00 0.00 H new ATOM 0 HD3 PRO A 125 138.957 17.105 -22.259 1.00 0.00 H new TER 1956 PRO A 125 ATOM 1957 N ARG B 151 118.189 6.067 -10.800 1.00 0.00 N ATOM 1958 CA ARG B 151 118.623 4.662 -10.936 1.00 0.00 C ATOM 1959 C ARG B 151 119.985 4.435 -10.332 1.00 0.00 C ATOM 1960 O ARG B 151 120.204 3.437 -9.644 1.00 0.00 O ATOM 1961 CB ARG B 151 118.603 4.213 -12.400 1.00 0.00 C ATOM 1962 CG ARG B 151 117.216 4.000 -12.957 1.00 0.00 C ATOM 1963 CD ARG B 151 116.560 2.787 -12.320 1.00 0.00 C ATOM 1964 NE ARG B 151 115.193 2.618 -12.771 1.00 0.00 N ATOM 1965 CZ ARG B 151 114.665 1.497 -13.245 1.00 0.00 C ATOM 1966 NH1 ARG B 151 115.412 0.425 -13.441 1.00 0.00 N ATOM 1967 NH2 ARG B 151 113.394 1.467 -13.556 1.00 0.00 N ATOM 0 HA ARG B 151 117.908 4.054 -10.381 1.00 0.00 H new ATOM 0 HB2 ARG B 151 119.116 4.960 -13.006 1.00 0.00 H new ATOM 0 HB3 ARG B 151 119.167 3.285 -12.493 1.00 0.00 H new ATOM 0 HG2 ARG B 151 116.607 4.886 -12.776 1.00 0.00 H new ATOM 0 HG3 ARG B 151 117.270 3.865 -14.037 1.00 0.00 H new ATOM 0 HD2 ARG B 151 117.136 1.893 -12.561 1.00 0.00 H new ATOM 0 HD3 ARG B 151 116.575 2.893 -11.235 1.00 0.00 H new ATOM 0 HE ARG B 151 114.583 3.434 -12.719 1.00 0.00 H new ATOM 0 HH11 ARG B 151 116.409 0.452 -13.227 1.00 0.00 H new ATOM 0 HH12 ARG B 151 114.992 -0.430 -13.806 1.00 0.00 H new ATOM 0 HH21 ARG B 151 112.819 2.301 -13.433 1.00 0.00 H new ATOM 0 HH22 ARG B 151 112.978 0.610 -13.921 1.00 0.00 H new ATOM 1983 N SER B 152 120.895 5.324 -10.592 1.00 0.00 N ATOM 1984 CA SER B 152 122.206 5.216 -10.057 1.00 0.00 C ATOM 1985 C SER B 152 122.244 5.914 -8.702 1.00 0.00 C ATOM 1986 O SER B 152 122.114 7.138 -8.628 1.00 0.00 O ATOM 1987 CB SER B 152 123.184 5.868 -11.024 1.00 0.00 C ATOM 1988 OG SER B 152 122.989 5.372 -12.352 1.00 0.00 O ATOM 0 H SER B 152 120.744 6.142 -11.182 1.00 0.00 H new ATOM 0 HA SER B 152 122.484 4.171 -9.923 1.00 0.00 H new ATOM 0 HB2 SER B 152 123.049 6.950 -11.011 1.00 0.00 H new ATOM 0 HB3 SER B 152 124.207 5.670 -10.703 1.00 0.00 H new ATOM 0 HG SER B 152 123.626 5.804 -12.959 1.00 0.00 H new ATOM 1994 N SER B 153 122.353 5.133 -7.647 1.00 0.00 N ATOM 1995 CA SER B 153 122.453 5.651 -6.311 1.00 0.00 C ATOM 1996 C SER B 153 123.663 6.568 -6.212 1.00 0.00 C ATOM 1997 O SER B 153 124.779 6.201 -6.634 1.00 0.00 O ATOM 1998 CB SER B 153 122.577 4.494 -5.332 1.00 0.00 C ATOM 1999 OG SER B 153 121.486 3.600 -5.476 1.00 0.00 O ATOM 0 H SER B 153 122.374 4.115 -7.700 1.00 0.00 H new ATOM 0 HA SER B 153 121.559 6.225 -6.066 1.00 0.00 H new ATOM 0 HB2 SER B 153 123.514 3.964 -5.504 1.00 0.00 H new ATOM 0 HB3 SER B 153 122.609 4.876 -4.312 1.00 0.00 H new ATOM 0 HG SER B 153 121.298 3.172 -4.615 1.00 0.00 H new ATOM 2005 N ARG B 154 123.444 7.750 -5.692 1.00 0.00 N ATOM 2006 CA ARG B 154 124.484 8.735 -5.576 1.00 0.00 C ATOM 2007 C ARG B 154 125.261 8.507 -4.317 1.00 0.00 C ATOM 2008 O ARG B 154 126.329 9.087 -4.118 1.00 0.00 O ATOM 2009 CB ARG B 154 123.934 10.154 -5.668 1.00 0.00 C ATOM 2010 CG ARG B 154 123.309 10.472 -7.023 1.00 0.00 C ATOM 2011 CD ARG B 154 124.289 10.193 -8.160 1.00 0.00 C ATOM 2012 NE ARG B 154 123.757 10.571 -9.471 1.00 0.00 N ATOM 2013 CZ ARG B 154 124.044 9.951 -10.626 1.00 0.00 C ATOM 2014 NH1 ARG B 154 124.778 8.835 -10.634 1.00 0.00 N ATOM 2015 NH2 ARG B 154 123.585 10.428 -11.769 1.00 0.00 N ATOM 0 H ARG B 154 122.537 8.054 -5.337 1.00 0.00 H new ATOM 0 HA ARG B 154 125.165 8.623 -6.419 1.00 0.00 H new ATOM 0 HB2 ARG B 154 123.186 10.298 -4.888 1.00 0.00 H new ATOM 0 HB3 ARG B 154 124.739 10.862 -5.472 1.00 0.00 H new ATOM 0 HG2 ARG B 154 122.408 9.874 -7.161 1.00 0.00 H new ATOM 0 HG3 ARG B 154 123.004 11.518 -7.050 1.00 0.00 H new ATOM 0 HD2 ARG B 154 125.215 10.738 -7.978 1.00 0.00 H new ATOM 0 HD3 ARG B 154 124.539 9.132 -8.166 1.00 0.00 H new ATOM 0 HE ARG B 154 123.120 11.366 -9.509 1.00 0.00 H new ATOM 0 HH11 ARG B 154 125.126 8.447 -9.757 1.00 0.00 H new ATOM 0 HH12 ARG B 154 124.991 8.371 -11.517 1.00 0.00 H new ATOM 0 HH21 ARG B 154 123.010 11.271 -11.776 1.00 0.00 H new ATOM 0 HH22 ARG B 154 123.805 9.954 -12.645 1.00 0.00 H new ATOM 2029 N THR B 155 124.692 7.695 -3.468 1.00 0.00 N ATOM 2030 CA THR B 155 125.292 7.127 -2.293 1.00 0.00 C ATOM 2031 C THR B 155 124.269 6.073 -1.862 1.00 0.00 C ATOM 2032 O THR B 155 123.199 6.034 -2.447 1.00 0.00 O ATOM 2033 CB THR B 155 125.480 8.153 -1.116 1.00 0.00 C ATOM 2034 OG1 THR B 155 126.018 9.400 -1.580 1.00 0.00 O ATOM 2035 CG2 THR B 155 126.465 7.587 -0.127 1.00 0.00 C ATOM 0 H THR B 155 123.726 7.391 -3.589 1.00 0.00 H new ATOM 0 HA THR B 155 126.293 6.755 -2.512 1.00 0.00 H new ATOM 0 HB THR B 155 124.501 8.325 -0.669 1.00 0.00 H new ATOM 0 HG1 THR B 155 126.484 9.259 -2.431 1.00 0.00 H new ATOM 0 HG21 THR B 155 126.602 8.291 0.693 1.00 0.00 H new ATOM 0 HG22 THR B 155 126.086 6.643 0.265 1.00 0.00 H new ATOM 0 HG23 THR B 155 127.421 7.416 -0.622 1.00 0.00 H new ATOM 2043 N ARG B 156 124.599 5.216 -0.921 1.00 0.00 N ATOM 2044 CA ARG B 156 123.688 4.218 -0.385 1.00 0.00 C ATOM 2045 C ARG B 156 124.435 3.458 0.662 1.00 0.00 C ATOM 2046 O ARG B 156 125.633 3.249 0.512 1.00 0.00 O ATOM 2047 CB ARG B 156 123.182 3.232 -1.475 1.00 0.00 C ATOM 2048 CG ARG B 156 124.276 2.461 -2.176 1.00 0.00 C ATOM 2049 CD ARG B 156 123.728 1.513 -3.210 1.00 0.00 C ATOM 2050 NE ARG B 156 124.812 0.768 -3.840 1.00 0.00 N ATOM 2051 CZ ARG B 156 124.683 -0.086 -4.860 1.00 0.00 C ATOM 2052 NH1 ARG B 156 123.483 -0.341 -5.396 1.00 0.00 N ATOM 2053 NH2 ARG B 156 125.761 -0.686 -5.336 1.00 0.00 N ATOM 0 H ARG B 156 125.526 5.190 -0.496 1.00 0.00 H new ATOM 0 HA ARG B 156 122.809 4.719 0.020 1.00 0.00 H new ATOM 0 HB2 ARG B 156 122.493 2.524 -1.015 1.00 0.00 H new ATOM 0 HB3 ARG B 156 122.615 3.792 -2.219 1.00 0.00 H new ATOM 0 HG2 ARG B 156 124.963 3.160 -2.653 1.00 0.00 H new ATOM 0 HG3 ARG B 156 124.852 1.900 -1.440 1.00 0.00 H new ATOM 0 HD2 ARG B 156 123.026 0.822 -2.744 1.00 0.00 H new ATOM 0 HD3 ARG B 156 123.173 2.069 -3.965 1.00 0.00 H new ATOM 0 HE ARG B 156 125.751 0.911 -3.470 1.00 0.00 H new ATOM 0 HH11 ARG B 156 122.651 0.119 -5.026 1.00 0.00 H new ATOM 0 HH12 ARG B 156 123.401 -0.995 -6.174 1.00 0.00 H new ATOM 0 HH21 ARG B 156 126.675 -0.494 -4.925 1.00 0.00 H new ATOM 0 HH22 ARG B 156 125.679 -1.340 -6.114 1.00 0.00 H new ATOM 2067 N ARG B 157 123.786 3.100 1.728 1.00 0.00 N ATOM 2068 CA ARG B 157 124.428 2.292 2.733 1.00 0.00 C ATOM 2069 C ARG B 157 123.570 1.135 3.122 1.00 0.00 C ATOM 2070 O ARG B 157 122.380 1.120 2.824 1.00 0.00 O ATOM 2071 CB ARG B 157 124.927 3.118 3.907 1.00 0.00 C ATOM 2072 CG ARG B 157 126.280 3.743 3.619 1.00 0.00 C ATOM 2073 CD ARG B 157 126.724 4.682 4.694 1.00 0.00 C ATOM 2074 NE ARG B 157 125.984 5.936 4.668 1.00 0.00 N ATOM 2075 CZ ARG B 157 126.194 6.943 5.498 1.00 0.00 C ATOM 2076 NH1 ARG B 157 127.048 6.805 6.506 1.00 0.00 N ATOM 2077 NH2 ARG B 157 125.551 8.075 5.324 1.00 0.00 N ATOM 0 H ARG B 157 122.818 3.350 1.929 1.00 0.00 H new ATOM 0 HA ARG B 157 125.330 1.863 2.296 1.00 0.00 H new ATOM 0 HB2 ARG B 157 124.205 3.902 4.133 1.00 0.00 H new ATOM 0 HB3 ARG B 157 124.999 2.486 4.792 1.00 0.00 H new ATOM 0 HG2 ARG B 157 127.023 2.954 3.503 1.00 0.00 H new ATOM 0 HG3 ARG B 157 126.233 4.279 2.671 1.00 0.00 H new ATOM 0 HD2 ARG B 157 126.595 4.206 5.666 1.00 0.00 H new ATOM 0 HD3 ARG B 157 127.788 4.887 4.578 1.00 0.00 H new ATOM 0 HE ARG B 157 125.255 6.044 3.963 1.00 0.00 H new ATOM 0 HH11 ARG B 157 127.541 5.922 6.639 1.00 0.00 H new ATOM 0 HH12 ARG B 157 127.210 7.582 7.147 1.00 0.00 H new ATOM 0 HH21 ARG B 157 124.893 8.174 4.551 1.00 0.00 H new ATOM 0 HH22 ARG B 157 125.710 8.855 5.962 1.00 0.00 H new ATOM 2091 N GLU B 158 124.177 0.146 3.725 1.00 0.00 N ATOM 2092 CA GLU B 158 123.503 -1.087 3.987 1.00 0.00 C ATOM 2093 C GLU B 158 123.054 -1.239 5.427 1.00 0.00 C ATOM 2094 O GLU B 158 123.866 -1.347 6.348 1.00 0.00 O ATOM 2095 CB GLU B 158 124.358 -2.288 3.535 1.00 0.00 C ATOM 2096 CG GLU B 158 125.733 -2.389 4.189 1.00 0.00 C ATOM 2097 CD GLU B 158 126.513 -3.565 3.677 1.00 0.00 C ATOM 2098 OE1 GLU B 158 126.116 -4.717 3.944 1.00 0.00 O ATOM 2099 OE2 GLU B 158 127.525 -3.366 2.987 1.00 0.00 O ATOM 0 H GLU B 158 125.145 0.177 4.044 1.00 0.00 H new ATOM 0 HA GLU B 158 122.589 -1.066 3.394 1.00 0.00 H new ATOM 0 HB2 GLU B 158 123.806 -3.205 3.743 1.00 0.00 H new ATOM 0 HB3 GLU B 158 124.490 -2.233 2.454 1.00 0.00 H new ATOM 0 HG2 GLU B 158 126.293 -1.473 4.000 1.00 0.00 H new ATOM 0 HG3 GLU B 158 125.616 -2.474 5.269 1.00 0.00 H new ATOM 2106 N THR B 159 121.777 -1.233 5.609 1.00 0.00 N ATOM 2107 CA THR B 159 121.190 -1.523 6.870 1.00 0.00 C ATOM 2108 C THR B 159 120.897 -3.031 6.833 1.00 0.00 C ATOM 2109 O THR B 159 120.288 -3.534 5.879 1.00 0.00 O ATOM 2110 CB THR B 159 119.883 -0.708 7.054 1.00 0.00 C ATOM 2111 OG1 THR B 159 120.124 0.652 6.691 1.00 0.00 O ATOM 2112 CG2 THR B 159 119.400 -0.737 8.502 1.00 0.00 C ATOM 0 H THR B 159 121.102 -1.023 4.873 1.00 0.00 H new ATOM 0 HA THR B 159 121.841 -1.258 7.703 1.00 0.00 H new ATOM 0 HB THR B 159 119.118 -1.157 6.420 1.00 0.00 H new ATOM 0 HG1 THR B 159 121.061 0.877 6.869 1.00 0.00 H new ATOM 0 HG21 THR B 159 118.483 -0.155 8.591 1.00 0.00 H new ATOM 0 HG22 THR B 159 119.207 -1.767 8.801 1.00 0.00 H new ATOM 0 HG23 THR B 159 120.165 -0.309 9.149 1.00 0.00 H new ATOM 2120 N GLN B 160 121.403 -3.758 7.777 1.00 0.00 N ATOM 2121 CA GLN B 160 121.227 -5.194 7.770 1.00 0.00 C ATOM 2122 C GLN B 160 120.229 -5.593 8.816 1.00 0.00 C ATOM 2123 O GLN B 160 120.550 -5.680 10.009 1.00 0.00 O ATOM 2124 CB GLN B 160 122.545 -5.889 7.989 1.00 0.00 C ATOM 2125 CG GLN B 160 123.564 -5.652 6.886 1.00 0.00 C ATOM 2126 CD GLN B 160 124.950 -6.065 7.308 1.00 0.00 C ATOM 2127 OE1 GLN B 160 125.117 -6.951 8.140 1.00 0.00 O ATOM 2128 NE2 GLN B 160 125.947 -5.478 6.715 1.00 0.00 N ATOM 0 H GLN B 160 121.941 -3.393 8.564 1.00 0.00 H new ATOM 0 HA GLN B 160 120.846 -5.499 6.795 1.00 0.00 H new ATOM 0 HB2 GLN B 160 122.967 -5.554 8.936 1.00 0.00 H new ATOM 0 HB3 GLN B 160 122.367 -6.961 8.080 1.00 0.00 H new ATOM 0 HG2 GLN B 160 123.273 -6.210 5.996 1.00 0.00 H new ATOM 0 HG3 GLN B 160 123.566 -4.597 6.613 1.00 0.00 H new ATOM 0 HE21 GLN B 160 125.772 -4.745 6.028 1.00 0.00 H new ATOM 0 HE22 GLN B 160 126.905 -5.751 6.937 1.00 0.00 H new ATOM 2137 N VAL B 161 119.041 -5.866 8.385 1.00 0.00 N ATOM 2138 CA VAL B 161 117.963 -6.094 9.287 1.00 0.00 C ATOM 2139 C VAL B 161 117.486 -7.528 9.200 1.00 0.00 C ATOM 2140 O VAL B 161 116.965 -8.065 10.194 1.00 0.00 O ATOM 2141 CB VAL B 161 116.800 -5.092 9.052 1.00 0.00 C ATOM 2142 CG1 VAL B 161 117.303 -3.679 9.143 1.00 0.00 C ATOM 2143 CG2 VAL B 161 116.138 -5.289 7.712 1.00 0.00 C ATOM 2144 OXT VAL B 161 117.687 -8.156 8.153 1.00 0.00 O ATOM 0 H VAL B 161 118.792 -5.937 7.398 1.00 0.00 H new ATOM 0 HA VAL B 161 118.332 -5.923 10.299 1.00 0.00 H new ATOM 0 HB VAL B 161 116.060 -5.281 9.830 1.00 0.00 H new ATOM 0 HG11 VAL B 161 116.477 -2.987 8.976 1.00 0.00 H new ATOM 0 HG12 VAL B 161 117.727 -3.507 10.132 1.00 0.00 H new ATOM 0 HG13 VAL B 161 118.071 -3.517 8.386 1.00 0.00 H new ATOM 0 HG21 VAL B 161 115.332 -4.565 7.595 1.00 0.00 H new ATOM 0 HG22 VAL B 161 116.872 -5.146 6.919 1.00 0.00 H new ATOM 0 HG23 VAL B 161 115.731 -6.298 7.652 1.00 0.00 H new TER 2154 VAL B 161