USER MOD reduce.3.24.130724 H: found=0, std=0, add=1025, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1026 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 100 ASN : amide:sc= -0.308 K(o=-5.4,f=-7.9) USER MOD Set 1.2: A 119 TYR OH : rot -124:sc= -5.05! USER MOD Set 2.1: A 115 GLN : amide:sc= -1.98 K(o=-1.1,f=-3.4!) USER MOD Set 2.2: A 117 TYR OH : rot 180:sc= 0.851 USER MOD Set 3.1: A 11 SER OG : rot 160:sc= -0.259 USER MOD Set 3.2: A 33 HIS : no HD1:sc= -2.46 K(o=-2.7,f=-6.8!) USER MOD Set 4.1: A 7 LYS NZ :NH3+ -133:sc= -0.335 (180deg=-0.0391) USER MOD Set 4.2: A 129 LYS NZ :NH3+ -174:sc= -1.79 (180deg=-1.9) USER MOD Single : A 1 ALA N :NH3+ 173:sc= 0 (180deg=-0.0559) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -2.26 X(o=-2.3,f=-2!) USER MOD Single : A 14 TYR OH : rot -90:sc= 0.506 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 MET CE :methyl 144:sc= -1.89 (180deg=-5.66!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl -118:sc= -3.75! (180deg=-7.09!) USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 LYS NZ :NH3+ -121:sc= -0.0209 (180deg=-1.95!) USER MOD Single : A 29 LYS NZ :NH3+ -133:sc= -1.12 (180deg=-3.14!) USER MOD Single : A 35 ASN : amide:sc= -0.958 K(o=-0.96,f=-3!) USER MOD Single : A 37 LYS NZ :NH3+ 146:sc= -2.73 (180deg=-5.59!) USER MOD Single : A 39 THR OG1 : rot 103:sc= 1.13 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= -1.97 X(o=-2,f=-2.1!) USER MOD Single : A 45 ASN : amide:sc= -0.203 K(o=-0.2,f=-4.1!) USER MOD Single : A 46 LYS NZ :NH3+ 147:sc= 0.14 (180deg=0) USER MOD Single : A 48 THR OG1 : rot -109:sc= 0.378 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 95:sc= 1.04 USER MOD Single : A 57 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 ASN : amide:sc= -0.465 X(o=-0.47,f=0) USER MOD Single : A 70 TYR OH : rot -48:sc= 1.06 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -115:sc= 0.137 (180deg=0) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= -0.889 K(o=-0.89,f=-2!) USER MOD Single : A 103 ASN :FLIP amide:sc= -0.21 F(o=-2.8!,f=-0.21) USER MOD Single : A 104 THR OG1 : rot 170:sc= -3.42 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 LYS NZ :NH3+ -132:sc= 0.503 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -3.266 -0.874 18.168 1.00 0.00 N ATOM 2 CA ALA A 1 -4.381 -1.640 17.553 1.00 0.00 C ATOM 3 C ALA A 1 -4.245 -1.680 16.035 1.00 0.00 C ATOM 4 O ALA A 1 -5.231 -1.536 15.310 1.00 0.00 O ATOM 5 CB ALA A 1 -5.719 -1.033 17.947 1.00 0.00 C ATOM 0 H1 ALA A 1 -3.443 -0.760 19.186 1.00 0.00 H new ATOM 0 H2 ALA A 1 -2.373 -1.388 18.027 1.00 0.00 H new ATOM 0 H3 ALA A 1 -3.200 0.063 17.721 1.00 0.00 H new ATOM 0 HA ALA A 1 -4.335 -2.664 17.925 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -6.527 -1.604 17.489 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -5.825 -1.059 19.031 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -5.765 0.000 17.603 1.00 0.00 H new ATOM 13 N PHE A 2 -3.020 -1.873 15.557 1.00 0.00 N ATOM 14 CA PHE A 2 -2.766 -1.928 14.123 1.00 0.00 C ATOM 15 C PHE A 2 -2.929 -3.349 13.593 1.00 0.00 C ATOM 16 O PHE A 2 -3.583 -3.569 12.574 1.00 0.00 O ATOM 17 CB PHE A 2 -1.366 -1.401 13.806 1.00 0.00 C ATOM 18 CG PHE A 2 -1.351 0.055 13.437 1.00 0.00 C ATOM 19 CD1 PHE A 2 -1.781 0.471 12.187 1.00 0.00 C ATOM 20 CD2 PHE A 2 -0.911 1.008 14.342 1.00 0.00 C ATOM 21 CE1 PHE A 2 -1.773 1.811 11.846 1.00 0.00 C ATOM 22 CE2 PHE A 2 -0.901 2.348 14.007 1.00 0.00 C ATOM 23 CZ PHE A 2 -1.333 2.750 12.758 1.00 0.00 C ATOM 0 H PHE A 2 -2.191 -1.993 16.139 1.00 0.00 H new ATOM 0 HA PHE A 2 -3.500 -1.293 13.627 1.00 0.00 H new ATOM 0 HB2 PHE A 2 -0.722 -1.556 14.671 1.00 0.00 H new ATOM 0 HB3 PHE A 2 -0.943 -1.981 12.986 1.00 0.00 H new ATOM 0 HD1 PHE A 2 -2.126 -0.260 11.471 1.00 0.00 H new ATOM 0 HD2 PHE A 2 -0.572 0.699 15.320 1.00 0.00 H new ATOM 0 HE1 PHE A 2 -2.110 2.123 10.868 1.00 0.00 H new ATOM 0 HE2 PHE A 2 -0.556 3.081 14.721 1.00 0.00 H new ATOM 0 HZ PHE A 2 -1.327 3.797 12.495 1.00 0.00 H new ATOM 33 N ASP A 3 -2.337 -4.313 14.292 1.00 0.00 N ATOM 34 CA ASP A 3 -2.425 -5.714 13.890 1.00 0.00 C ATOM 35 C ASP A 3 -3.882 -6.160 13.820 1.00 0.00 C ATOM 36 O ASP A 3 -4.560 -6.259 14.843 1.00 0.00 O ATOM 37 CB ASP A 3 -1.654 -6.599 14.871 1.00 0.00 C ATOM 38 CG ASP A 3 -0.285 -6.038 15.204 1.00 0.00 C ATOM 39 OD1 ASP A 3 0.576 -5.999 14.300 1.00 0.00 O ATOM 40 OD2 ASP A 3 -0.075 -5.636 16.368 1.00 0.00 O ATOM 0 H ASP A 3 -1.792 -4.150 15.139 1.00 0.00 H new ATOM 0 HA ASP A 3 -1.980 -5.815 12.900 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -2.232 -6.708 15.789 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -1.541 -7.596 14.445 1.00 0.00 H new ATOM 45 N SER A 4 -4.363 -6.418 12.606 1.00 0.00 N ATOM 46 CA SER A 4 -5.745 -6.841 12.402 1.00 0.00 C ATOM 47 C SER A 4 -6.081 -6.897 10.914 1.00 0.00 C ATOM 48 O SER A 4 -5.210 -6.721 10.063 1.00 0.00 O ATOM 49 CB SER A 4 -6.700 -5.870 13.104 1.00 0.00 C ATOM 50 OG SER A 4 -7.579 -6.558 13.978 1.00 0.00 O ATOM 0 H SER A 4 -3.815 -6.341 11.749 1.00 0.00 H new ATOM 0 HA SER A 4 -5.861 -7.838 12.826 1.00 0.00 H new ATOM 0 HB2 SER A 4 -6.126 -5.134 13.667 1.00 0.00 H new ATOM 0 HB3 SER A 4 -7.278 -5.322 12.360 1.00 0.00 H new ATOM 0 HG SER A 4 -8.176 -5.915 14.414 1.00 0.00 H new ATOM 56 N THR A 5 -7.357 -7.123 10.609 1.00 0.00 N ATOM 57 CA THR A 5 -7.812 -7.175 9.225 1.00 0.00 C ATOM 58 C THR A 5 -8.212 -5.782 8.765 1.00 0.00 C ATOM 59 O THR A 5 -9.093 -5.157 9.355 1.00 0.00 O ATOM 60 CB THR A 5 -8.997 -8.128 9.076 1.00 0.00 C ATOM 61 OG1 THR A 5 -8.673 -9.418 9.564 1.00 0.00 O ATOM 62 CG2 THR A 5 -9.453 -8.276 7.644 1.00 0.00 C ATOM 0 H THR A 5 -8.091 -7.272 11.301 1.00 0.00 H new ATOM 0 HA THR A 5 -6.994 -7.544 8.606 1.00 0.00 H new ATOM 0 HB THR A 5 -9.805 -7.685 9.658 1.00 0.00 H new ATOM 0 HG1 THR A 5 -9.446 -10.011 9.460 1.00 0.00 H new ATOM 0 HG21 THR A 5 -10.297 -8.965 7.600 1.00 0.00 H new ATOM 0 HG22 THR A 5 -9.758 -7.304 7.257 1.00 0.00 H new ATOM 0 HG23 THR A 5 -8.634 -8.667 7.040 1.00 0.00 H new ATOM 70 N TRP A 6 -7.551 -5.283 7.726 1.00 0.00 N ATOM 71 CA TRP A 6 -7.840 -3.950 7.225 1.00 0.00 C ATOM 72 C TRP A 6 -8.367 -3.999 5.800 1.00 0.00 C ATOM 73 O TRP A 6 -7.733 -4.549 4.902 1.00 0.00 O ATOM 74 CB TRP A 6 -6.587 -3.069 7.298 1.00 0.00 C ATOM 75 CG TRP A 6 -6.172 -2.736 8.695 1.00 0.00 C ATOM 76 CD1 TRP A 6 -6.250 -3.550 9.785 1.00 0.00 C ATOM 77 CD2 TRP A 6 -5.615 -1.502 9.155 1.00 0.00 C ATOM 78 NE1 TRP A 6 -5.791 -2.894 10.899 1.00 0.00 N ATOM 79 CE2 TRP A 6 -5.394 -1.635 10.538 1.00 0.00 C ATOM 80 CE3 TRP A 6 -5.285 -0.296 8.532 1.00 0.00 C ATOM 81 CZ2 TRP A 6 -4.861 -0.609 11.309 1.00 0.00 C ATOM 82 CZ3 TRP A 6 -4.753 0.724 9.299 1.00 0.00 C ATOM 83 CH2 TRP A 6 -4.547 0.562 10.675 1.00 0.00 C ATOM 0 H TRP A 6 -6.818 -5.779 7.220 1.00 0.00 H new ATOM 0 HA TRP A 6 -8.615 -3.516 7.856 1.00 0.00 H new ATOM 0 HB2 TRP A 6 -5.765 -3.578 6.795 1.00 0.00 H new ATOM 0 HB3 TRP A 6 -6.771 -2.144 6.752 1.00 0.00 H new ATOM 0 HD1 TRP A 6 -6.620 -4.565 9.774 1.00 0.00 H new ATOM 0 HE1 TRP A 6 -5.752 -3.281 11.842 1.00 0.00 H new ATOM 0 HE3 TRP A 6 -5.442 -0.163 7.472 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 -4.701 -0.732 12.370 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 -4.492 1.661 8.830 1.00 0.00 H new ATOM 0 HH2 TRP A 6 -4.132 1.378 11.247 1.00 0.00 H new ATOM 94 N LYS A 7 -9.532 -3.402 5.609 1.00 0.00 N ATOM 95 CA LYS A 7 -10.163 -3.349 4.297 1.00 0.00 C ATOM 96 C LYS A 7 -10.384 -1.907 3.860 1.00 0.00 C ATOM 97 O LYS A 7 -11.141 -1.155 4.470 1.00 0.00 O ATOM 98 CB LYS A 7 -11.487 -4.110 4.305 1.00 0.00 C ATOM 99 CG LYS A 7 -12.485 -3.558 5.303 1.00 0.00 C ATOM 100 CD LYS A 7 -13.887 -3.499 4.720 1.00 0.00 C ATOM 101 CE LYS A 7 -13.999 -2.422 3.654 1.00 0.00 C ATOM 102 NZ LYS A 7 -15.408 -2.217 3.216 1.00 0.00 N ATOM 0 H LYS A 7 -10.064 -2.944 6.349 1.00 0.00 H new ATOM 0 HA LYS A 7 -9.493 -3.826 3.581 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -11.924 -4.077 3.307 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -11.295 -5.158 4.534 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -12.488 -4.181 6.197 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -12.177 -2.559 5.612 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -14.145 -4.467 4.290 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -14.606 -3.302 5.516 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -13.600 -1.485 4.042 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -13.388 -2.697 2.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -15.448 -2.192 2.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -15.998 -2.999 3.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -15.763 -1.317 3.598 1.00 0.00 H new ATOM 116 N VAL A 8 -9.705 -1.533 2.796 1.00 0.00 N ATOM 117 CA VAL A 8 -9.799 -0.188 2.259 1.00 0.00 C ATOM 118 C VAL A 8 -11.229 0.138 1.824 1.00 0.00 C ATOM 119 O VAL A 8 -11.857 -0.632 1.098 1.00 0.00 O ATOM 120 CB VAL A 8 -8.823 -0.010 1.077 1.00 0.00 C ATOM 121 CG1 VAL A 8 -9.449 -0.462 -0.238 1.00 0.00 C ATOM 122 CG2 VAL A 8 -8.354 1.432 0.991 1.00 0.00 C ATOM 0 H VAL A 8 -9.075 -2.147 2.280 1.00 0.00 H new ATOM 0 HA VAL A 8 -9.523 0.508 3.051 1.00 0.00 H new ATOM 0 HB VAL A 8 -7.956 -0.645 1.258 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -8.734 -0.322 -1.048 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -9.718 -1.516 -0.169 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -10.343 0.129 -0.437 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -7.666 1.542 0.152 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -9.213 2.086 0.843 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -7.845 1.705 1.916 1.00 0.00 H new ATOM 132 N ASP A 9 -11.738 1.282 2.278 1.00 0.00 N ATOM 133 CA ASP A 9 -13.095 1.702 1.937 1.00 0.00 C ATOM 134 C ASP A 9 -13.117 2.430 0.594 1.00 0.00 C ATOM 135 O ASP A 9 -13.731 1.960 -0.363 1.00 0.00 O ATOM 136 CB ASP A 9 -13.675 2.591 3.048 1.00 0.00 C ATOM 137 CG ASP A 9 -14.762 3.532 2.556 1.00 0.00 C ATOM 138 OD1 ASP A 9 -15.693 3.058 1.873 1.00 0.00 O ATOM 139 OD2 ASP A 9 -14.680 4.742 2.856 1.00 0.00 O ATOM 0 H ASP A 9 -11.233 1.932 2.880 1.00 0.00 H new ATOM 0 HA ASP A 9 -13.718 0.812 1.847 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -14.082 1.957 3.836 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -12.871 3.177 3.493 1.00 0.00 H new ATOM 144 N ARG A 10 -12.444 3.575 0.527 1.00 0.00 N ATOM 145 CA ARG A 10 -12.394 4.351 -0.708 1.00 0.00 C ATOM 146 C ARG A 10 -10.956 4.683 -1.084 1.00 0.00 C ATOM 147 O ARG A 10 -10.032 4.469 -0.299 1.00 0.00 O ATOM 148 CB ARG A 10 -13.220 5.638 -0.586 1.00 0.00 C ATOM 149 CG ARG A 10 -13.139 6.309 0.776 1.00 0.00 C ATOM 150 CD ARG A 10 -14.408 7.087 1.084 1.00 0.00 C ATOM 151 NE ARG A 10 -14.243 7.972 2.234 1.00 0.00 N ATOM 152 CZ ARG A 10 -15.092 8.949 2.546 1.00 0.00 C ATOM 153 NH1 ARG A 10 -16.166 9.168 1.797 1.00 0.00 N ATOM 154 NH2 ARG A 10 -14.868 9.708 3.609 1.00 0.00 N ATOM 0 H ARG A 10 -11.929 3.984 1.307 1.00 0.00 H new ATOM 0 HA ARG A 10 -12.827 3.739 -1.499 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -12.885 6.344 -1.346 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -14.263 5.408 -0.803 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -12.976 5.555 1.546 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -12.282 6.982 0.802 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -14.693 7.676 0.212 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -15.223 6.389 1.278 1.00 0.00 H new ATOM 0 HE ARG A 10 -13.429 7.833 2.833 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -16.344 8.586 0.978 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -16.813 9.918 2.040 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -14.045 9.544 4.189 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -15.519 10.456 3.848 1.00 0.00 H new ATOM 168 N SER A 11 -10.772 5.199 -2.294 1.00 0.00 N ATOM 169 CA SER A 11 -9.443 5.550 -2.779 1.00 0.00 C ATOM 170 C SER A 11 -9.487 6.806 -3.644 1.00 0.00 C ATOM 171 O SER A 11 -10.556 7.244 -4.069 1.00 0.00 O ATOM 172 CB SER A 11 -8.852 4.385 -3.576 1.00 0.00 C ATOM 173 OG SER A 11 -9.637 4.101 -4.722 1.00 0.00 O ATOM 0 H SER A 11 -11.526 5.383 -2.956 1.00 0.00 H new ATOM 0 HA SER A 11 -8.809 5.754 -1.916 1.00 0.00 H new ATOM 0 HB2 SER A 11 -7.834 4.628 -3.880 1.00 0.00 H new ATOM 0 HB3 SER A 11 -8.793 3.500 -2.943 1.00 0.00 H new ATOM 0 HG SER A 11 -9.100 3.599 -5.370 1.00 0.00 H new ATOM 179 N GLU A 12 -8.316 7.379 -3.899 1.00 0.00 N ATOM 180 CA GLU A 12 -8.209 8.584 -4.713 1.00 0.00 C ATOM 181 C GLU A 12 -6.868 8.626 -5.438 1.00 0.00 C ATOM 182 O GLU A 12 -5.817 8.417 -4.830 1.00 0.00 O ATOM 183 CB GLU A 12 -8.372 9.831 -3.842 1.00 0.00 C ATOM 184 CG GLU A 12 -9.110 10.965 -4.535 1.00 0.00 C ATOM 185 CD GLU A 12 -10.552 11.084 -4.083 1.00 0.00 C ATOM 186 OE1 GLU A 12 -11.416 10.394 -4.664 1.00 0.00 O ATOM 187 OE2 GLU A 12 -10.818 11.867 -3.146 1.00 0.00 O ATOM 0 H GLU A 12 -7.424 7.026 -3.552 1.00 0.00 H new ATOM 0 HA GLU A 12 -9.006 8.565 -5.456 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -8.909 9.561 -2.933 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -7.386 10.183 -3.537 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -8.593 11.904 -4.338 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -9.083 10.806 -5.613 1.00 0.00 H new ATOM 194 N ASN A 13 -6.909 8.894 -6.740 1.00 0.00 N ATOM 195 CA ASN A 13 -5.703 8.961 -7.547 1.00 0.00 C ATOM 196 C ASN A 13 -4.973 7.615 -7.567 1.00 0.00 C ATOM 197 O ASN A 13 -3.823 7.515 -8.012 1.00 0.00 O ATOM 198 CB ASN A 13 -4.791 10.056 -7.011 1.00 0.00 C ATOM 199 CG ASN A 13 -4.952 11.372 -7.751 1.00 0.00 C ATOM 200 OD1 ASN A 13 -3.986 12.111 -7.939 1.00 0.00 O ATOM 201 ND2 ASN A 13 -6.176 11.676 -8.170 1.00 0.00 N ATOM 0 H ASN A 13 -7.771 9.069 -7.257 1.00 0.00 H new ATOM 0 HA ASN A 13 -5.985 9.197 -8.573 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -5.001 10.212 -5.953 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -3.754 9.727 -7.085 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -6.342 12.550 -8.668 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -6.949 11.035 -7.993 1.00 0.00 H new ATOM 208 N TYR A 14 -5.649 6.567 -7.106 1.00 0.00 N ATOM 209 CA TYR A 14 -5.056 5.242 -7.103 1.00 0.00 C ATOM 210 C TYR A 14 -4.609 4.889 -8.516 1.00 0.00 C ATOM 211 O TYR A 14 -3.483 4.443 -8.732 1.00 0.00 O ATOM 212 CB TYR A 14 -6.058 4.213 -6.577 1.00 0.00 C ATOM 213 CG TYR A 14 -5.415 3.036 -5.879 1.00 0.00 C ATOM 214 CD1 TYR A 14 -4.316 2.394 -6.432 1.00 0.00 C ATOM 215 CD2 TYR A 14 -5.911 2.564 -4.670 1.00 0.00 C ATOM 216 CE1 TYR A 14 -3.727 1.315 -5.801 1.00 0.00 C ATOM 217 CE2 TYR A 14 -5.327 1.486 -4.032 1.00 0.00 C ATOM 218 CZ TYR A 14 -4.236 0.865 -4.602 1.00 0.00 C ATOM 219 OH TYR A 14 -3.652 -0.209 -3.970 1.00 0.00 O ATOM 0 H TYR A 14 -6.598 6.612 -6.734 1.00 0.00 H new ATOM 0 HA TYR A 14 -4.188 5.233 -6.443 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -6.741 4.706 -5.884 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -6.658 3.846 -7.409 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -3.914 2.744 -7.372 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -6.767 3.047 -4.222 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -2.872 0.827 -6.245 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -5.723 1.132 -3.092 1.00 0.00 H new ATOM 0 HH TYR A 14 -4.081 -1.038 -4.270 1.00 0.00 H new ATOM 229 N ASP A 15 -5.495 5.135 -9.482 1.00 0.00 N ATOM 230 CA ASP A 15 -5.191 4.882 -10.887 1.00 0.00 C ATOM 231 C ASP A 15 -3.911 5.611 -11.279 1.00 0.00 C ATOM 232 O ASP A 15 -3.145 5.146 -12.122 1.00 0.00 O ATOM 233 CB ASP A 15 -6.346 5.354 -11.772 1.00 0.00 C ATOM 234 CG ASP A 15 -6.438 4.574 -13.068 1.00 0.00 C ATOM 235 OD1 ASP A 15 -5.388 4.101 -13.552 1.00 0.00 O ATOM 236 OD2 ASP A 15 -7.560 4.435 -13.599 1.00 0.00 O ATOM 0 H ASP A 15 -6.429 5.509 -9.315 1.00 0.00 H new ATOM 0 HA ASP A 15 -5.053 3.810 -11.029 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -7.283 5.255 -11.224 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -6.218 6.413 -11.997 1.00 0.00 H new ATOM 241 N LYS A 16 -3.684 6.755 -10.642 1.00 0.00 N ATOM 242 CA LYS A 16 -2.496 7.559 -10.893 1.00 0.00 C ATOM 243 C LYS A 16 -1.248 6.707 -10.758 1.00 0.00 C ATOM 244 O LYS A 16 -0.306 6.827 -11.541 1.00 0.00 O ATOM 245 CB LYS A 16 -2.445 8.724 -9.904 1.00 0.00 C ATOM 246 CG LYS A 16 -1.785 9.974 -10.449 1.00 0.00 C ATOM 247 CD LYS A 16 -2.796 11.081 -10.655 1.00 0.00 C ATOM 248 CE LYS A 16 -2.409 11.987 -11.813 1.00 0.00 C ATOM 249 NZ LYS A 16 -2.886 13.382 -11.611 1.00 0.00 N ATOM 0 H LYS A 16 -4.314 7.148 -9.942 1.00 0.00 H new ATOM 0 HA LYS A 16 -2.541 7.952 -11.909 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -3.461 8.969 -9.596 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -1.909 8.404 -9.010 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -1.010 10.309 -9.760 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -1.294 9.746 -11.395 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -3.778 10.647 -10.845 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -2.880 11.672 -9.743 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -1.325 11.987 -11.927 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -2.827 11.591 -12.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -2.602 13.967 -12.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -3.923 13.386 -11.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -2.467 13.769 -10.741 1.00 0.00 H new ATOM 263 N PHE A 17 -1.252 5.846 -9.754 1.00 0.00 N ATOM 264 CA PHE A 17 -0.118 4.965 -9.507 1.00 0.00 C ATOM 265 C PHE A 17 -0.072 3.844 -10.538 1.00 0.00 C ATOM 266 O PHE A 17 0.989 3.286 -10.813 1.00 0.00 O ATOM 267 CB PHE A 17 -0.178 4.412 -8.078 1.00 0.00 C ATOM 268 CG PHE A 17 0.117 5.464 -7.051 1.00 0.00 C ATOM 269 CD1 PHE A 17 -0.319 6.765 -7.261 1.00 0.00 C ATOM 270 CD2 PHE A 17 0.842 5.175 -5.897 1.00 0.00 C ATOM 271 CE1 PHE A 17 -0.046 7.761 -6.360 1.00 0.00 C ATOM 272 CE2 PHE A 17 1.115 6.175 -4.984 1.00 0.00 C ATOM 273 CZ PHE A 17 0.673 7.469 -5.218 1.00 0.00 C ATOM 0 H PHE A 17 -2.025 5.737 -9.097 1.00 0.00 H new ATOM 0 HA PHE A 17 0.803 5.540 -9.607 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -1.167 3.994 -7.893 1.00 0.00 H new ATOM 0 HB3 PHE A 17 0.537 3.596 -7.976 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -0.884 6.997 -8.152 1.00 0.00 H new ATOM 0 HD2 PHE A 17 1.191 4.169 -5.716 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -0.391 8.768 -6.542 1.00 0.00 H new ATOM 0 HE2 PHE A 17 1.673 5.949 -4.087 1.00 0.00 H new ATOM 0 HZ PHE A 17 0.892 8.250 -4.505 1.00 0.00 H new ATOM 283 N MET A 18 -1.225 3.529 -11.116 1.00 0.00 N ATOM 284 CA MET A 18 -1.312 2.488 -12.127 1.00 0.00 C ATOM 285 C MET A 18 -0.660 2.927 -13.435 1.00 0.00 C ATOM 286 O MET A 18 -0.142 2.099 -14.185 1.00 0.00 O ATOM 287 CB MET A 18 -2.777 2.136 -12.394 1.00 0.00 C ATOM 288 CG MET A 18 -3.348 1.120 -11.427 1.00 0.00 C ATOM 289 SD MET A 18 -3.754 1.830 -9.823 1.00 0.00 S ATOM 290 CE MET A 18 -2.444 1.144 -8.811 1.00 0.00 C ATOM 0 H MET A 18 -2.113 3.982 -10.900 1.00 0.00 H new ATOM 0 HA MET A 18 -0.781 1.615 -11.748 1.00 0.00 H new ATOM 0 HB2 MET A 18 -3.374 3.046 -12.345 1.00 0.00 H new ATOM 0 HB3 MET A 18 -2.869 1.749 -13.409 1.00 0.00 H new ATOM 0 HG2 MET A 18 -4.245 0.678 -11.860 1.00 0.00 H new ATOM 0 HG3 MET A 18 -2.629 0.313 -11.290 1.00 0.00 H new ATOM 0 HE1 MET A 18 -2.138 1.878 -8.065 1.00 0.00 H new ATOM 0 HE2 MET A 18 -2.804 0.246 -8.310 1.00 0.00 H new ATOM 0 HE3 MET A 18 -1.592 0.891 -9.442 1.00 0.00 H new ATOM 300 N GLU A 19 -0.717 4.225 -13.726 1.00 0.00 N ATOM 301 CA GLU A 19 -0.161 4.741 -14.973 1.00 0.00 C ATOM 302 C GLU A 19 1.328 5.078 -14.876 1.00 0.00 C ATOM 303 O GLU A 19 2.142 4.524 -15.615 1.00 0.00 O ATOM 304 CB GLU A 19 -0.941 5.980 -15.414 1.00 0.00 C ATOM 305 CG GLU A 19 -2.450 5.809 -15.339 1.00 0.00 C ATOM 306 CD GLU A 19 -2.957 4.707 -16.248 1.00 0.00 C ATOM 307 OE1 GLU A 19 -3.009 3.542 -15.798 1.00 0.00 O ATOM 308 OE2 GLU A 19 -3.303 5.007 -17.410 1.00 0.00 O ATOM 0 H GLU A 19 -1.138 4.931 -13.122 1.00 0.00 H new ATOM 0 HA GLU A 19 -0.258 3.946 -15.712 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -0.648 6.824 -14.790 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -0.663 6.229 -16.438 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -2.736 5.588 -14.311 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -2.932 6.748 -15.609 1.00 0.00 H new ATOM 315 N LYS A 20 1.681 6.002 -13.989 1.00 0.00 N ATOM 316 CA LYS A 20 3.067 6.420 -13.835 1.00 0.00 C ATOM 317 C LYS A 20 3.989 5.246 -13.515 1.00 0.00 C ATOM 318 O LYS A 20 5.048 5.099 -14.124 1.00 0.00 O ATOM 319 CB LYS A 20 3.170 7.479 -12.747 1.00 0.00 C ATOM 320 CG LYS A 20 4.504 8.199 -12.734 1.00 0.00 C ATOM 321 CD LYS A 20 4.400 9.613 -13.282 1.00 0.00 C ATOM 322 CE LYS A 20 5.763 10.136 -13.696 1.00 0.00 C ATOM 323 NZ LYS A 20 6.149 9.672 -15.057 1.00 0.00 N ATOM 0 H LYS A 20 1.026 6.475 -13.367 1.00 0.00 H new ATOM 0 HA LYS A 20 3.393 6.839 -14.787 1.00 0.00 H new ATOM 0 HB2 LYS A 20 2.372 8.209 -12.884 1.00 0.00 H new ATOM 0 HB3 LYS A 20 3.009 7.010 -11.777 1.00 0.00 H new ATOM 0 HG2 LYS A 20 4.886 8.234 -11.714 1.00 0.00 H new ATOM 0 HG3 LYS A 20 5.225 7.634 -13.325 1.00 0.00 H new ATOM 0 HD2 LYS A 20 3.726 9.627 -14.138 1.00 0.00 H new ATOM 0 HD3 LYS A 20 3.969 10.269 -12.526 1.00 0.00 H new ATOM 0 HE2 LYS A 20 5.755 11.226 -13.673 1.00 0.00 H new ATOM 0 HE3 LYS A 20 6.512 9.807 -12.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 7.086 10.052 -15.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 6.182 8.633 -15.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 5.449 10.007 -15.749 1.00 0.00 H new ATOM 337 N MET A 21 3.591 4.414 -12.558 1.00 0.00 N ATOM 338 CA MET A 21 4.403 3.264 -12.172 1.00 0.00 C ATOM 339 C MET A 21 4.186 2.092 -13.123 1.00 0.00 C ATOM 340 O MET A 21 5.080 1.269 -13.321 1.00 0.00 O ATOM 341 CB MET A 21 4.085 2.838 -10.738 1.00 0.00 C ATOM 342 CG MET A 21 4.412 3.901 -9.701 1.00 0.00 C ATOM 343 SD MET A 21 3.131 4.069 -8.443 1.00 0.00 S ATOM 344 CE MET A 21 2.756 2.350 -8.104 1.00 0.00 C ATOM 0 H MET A 21 2.719 4.512 -12.039 1.00 0.00 H new ATOM 0 HA MET A 21 5.450 3.563 -12.229 1.00 0.00 H new ATOM 0 HB2 MET A 21 3.026 2.588 -10.668 1.00 0.00 H new ATOM 0 HB3 MET A 21 4.643 1.931 -10.505 1.00 0.00 H new ATOM 0 HG2 MET A 21 5.358 3.653 -9.219 1.00 0.00 H new ATOM 0 HG3 MET A 21 4.551 4.859 -10.201 1.00 0.00 H new ATOM 0 HE1 MET A 21 1.716 2.148 -8.358 1.00 0.00 H new ATOM 0 HE2 MET A 21 3.406 1.711 -8.701 1.00 0.00 H new ATOM 0 HE3 MET A 21 2.918 2.144 -7.046 1.00 0.00 H new ATOM 354 N GLY A 22 2.995 2.019 -13.708 1.00 0.00 N ATOM 355 CA GLY A 22 2.692 0.941 -14.628 1.00 0.00 C ATOM 356 C GLY A 22 2.122 -0.274 -13.924 1.00 0.00 C ATOM 357 O GLY A 22 2.656 -1.377 -14.042 1.00 0.00 O ATOM 0 H GLY A 22 2.237 2.685 -13.561 1.00 0.00 H new ATOM 0 HA2 GLY A 22 1.980 1.293 -15.374 1.00 0.00 H new ATOM 0 HA3 GLY A 22 3.599 0.657 -15.162 1.00 0.00 H new ATOM 361 N VAL A 23 1.031 -0.071 -13.195 1.00 0.00 N ATOM 362 CA VAL A 23 0.381 -1.161 -12.472 1.00 0.00 C ATOM 363 C VAL A 23 -0.793 -1.699 -13.285 1.00 0.00 C ATOM 364 O VAL A 23 -1.873 -1.109 -13.300 1.00 0.00 O ATOM 365 CB VAL A 23 -0.115 -0.704 -11.082 1.00 0.00 C ATOM 366 CG1 VAL A 23 -0.431 -1.898 -10.193 1.00 0.00 C ATOM 367 CG2 VAL A 23 0.911 0.205 -10.414 1.00 0.00 C ATOM 0 H VAL A 23 0.577 0.836 -13.088 1.00 0.00 H new ATOM 0 HA VAL A 23 1.119 -1.950 -12.326 1.00 0.00 H new ATOM 0 HB VAL A 23 -1.035 -0.137 -11.225 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -0.778 -1.546 -9.221 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -1.209 -2.503 -10.659 1.00 0.00 H new ATOM 0 HG13 VAL A 23 0.467 -2.501 -10.061 1.00 0.00 H new ATOM 0 HG21 VAL A 23 0.541 0.515 -9.437 1.00 0.00 H new ATOM 0 HG22 VAL A 23 1.850 -0.334 -10.292 1.00 0.00 H new ATOM 0 HG23 VAL A 23 1.076 1.085 -11.035 1.00 0.00 H new ATOM 377 N ASN A 24 -0.563 -2.810 -13.980 1.00 0.00 N ATOM 378 CA ASN A 24 -1.582 -3.420 -14.822 1.00 0.00 C ATOM 379 C ASN A 24 -2.903 -3.604 -14.086 1.00 0.00 C ATOM 380 O ASN A 24 -3.031 -3.283 -12.904 1.00 0.00 O ATOM 381 CB ASN A 24 -1.094 -4.767 -15.347 1.00 0.00 C ATOM 382 CG ASN A 24 -0.667 -4.704 -16.801 1.00 0.00 C ATOM 383 OD1 ASN A 24 -1.330 -5.256 -17.679 1.00 0.00 O ATOM 384 ND2 ASN A 24 0.446 -4.028 -17.062 1.00 0.00 N ATOM 0 H ASN A 24 0.328 -3.307 -13.974 1.00 0.00 H new ATOM 0 HA ASN A 24 -1.759 -2.741 -15.656 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -0.255 -5.108 -14.740 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -1.888 -5.506 -15.237 1.00 0.00 H new ATOM 0 HD21 ASN A 24 0.783 -3.951 -18.022 1.00 0.00 H new ATOM 0 HD22 ASN A 24 0.964 -3.586 -16.303 1.00 0.00 H new ATOM 391 N ILE A 25 -3.879 -4.129 -14.811 1.00 0.00 N ATOM 392 CA ILE A 25 -5.209 -4.370 -14.266 1.00 0.00 C ATOM 393 C ILE A 25 -5.287 -5.726 -13.583 1.00 0.00 C ATOM 394 O ILE A 25 -6.026 -5.906 -12.619 1.00 0.00 O ATOM 395 CB ILE A 25 -6.280 -4.303 -15.371 1.00 0.00 C ATOM 396 CG1 ILE A 25 -7.682 -4.412 -14.768 1.00 0.00 C ATOM 397 CG2 ILE A 25 -6.053 -5.399 -16.404 1.00 0.00 C ATOM 398 CD1 ILE A 25 -8.659 -3.403 -15.330 1.00 0.00 C ATOM 0 H ILE A 25 -3.774 -4.399 -15.789 1.00 0.00 H new ATOM 0 HA ILE A 25 -5.399 -3.588 -13.531 1.00 0.00 H new ATOM 0 HB ILE A 25 -6.197 -3.338 -15.872 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -8.068 -5.416 -14.943 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -7.616 -4.280 -13.688 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -6.819 -5.335 -17.176 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -5.070 -5.274 -16.857 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -6.107 -6.373 -15.919 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -9.632 -3.537 -14.858 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -8.295 -2.395 -15.131 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -8.754 -3.549 -16.406 1.00 0.00 H new ATOM 410 N VAL A 26 -4.525 -6.679 -14.101 1.00 0.00 N ATOM 411 CA VAL A 26 -4.504 -8.033 -13.556 1.00 0.00 C ATOM 412 C VAL A 26 -4.439 -8.031 -12.030 1.00 0.00 C ATOM 413 O VAL A 26 -5.299 -8.606 -11.363 1.00 0.00 O ATOM 414 CB VAL A 26 -3.313 -8.839 -14.107 1.00 0.00 C ATOM 415 CG1 VAL A 26 -3.414 -10.296 -13.684 1.00 0.00 C ATOM 416 CG2 VAL A 26 -3.244 -8.721 -15.622 1.00 0.00 C ATOM 0 H VAL A 26 -3.909 -6.540 -14.902 1.00 0.00 H new ATOM 0 HA VAL A 26 -5.436 -8.505 -13.868 1.00 0.00 H new ATOM 0 HB VAL A 26 -2.394 -8.426 -13.691 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -2.564 -10.850 -14.082 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -3.411 -10.360 -12.596 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -4.339 -10.724 -14.070 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -2.396 -9.297 -15.994 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -4.165 -9.107 -16.059 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -3.121 -7.674 -15.900 1.00 0.00 H new ATOM 426 N LYS A 27 -3.418 -7.381 -11.483 1.00 0.00 N ATOM 427 CA LYS A 27 -3.248 -7.308 -10.037 1.00 0.00 C ATOM 428 C LYS A 27 -4.030 -6.137 -9.452 1.00 0.00 C ATOM 429 O LYS A 27 -4.459 -6.177 -8.299 1.00 0.00 O ATOM 430 CB LYS A 27 -1.766 -7.177 -9.681 1.00 0.00 C ATOM 431 CG LYS A 27 -1.040 -8.511 -9.608 1.00 0.00 C ATOM 432 CD LYS A 27 -1.702 -9.452 -8.614 1.00 0.00 C ATOM 433 CE LYS A 27 -0.797 -10.623 -8.268 1.00 0.00 C ATOM 434 NZ LYS A 27 0.361 -10.201 -7.432 1.00 0.00 N ATOM 0 H LYS A 27 -2.697 -6.898 -12.018 1.00 0.00 H new ATOM 0 HA LYS A 27 -3.637 -8.230 -9.606 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -1.277 -6.546 -10.423 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -1.675 -6.669 -8.721 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -1.026 -8.974 -10.595 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -0.002 -8.346 -9.319 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -1.954 -8.905 -7.706 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -2.637 -9.825 -9.032 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -1.372 -11.381 -7.736 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -0.433 -11.084 -9.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 1.247 -10.437 -7.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 0.317 -9.175 -7.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 0.328 -10.697 -6.518 1.00 0.00 H new ATOM 448 N ARG A 28 -4.204 -5.092 -10.254 1.00 0.00 N ATOM 449 CA ARG A 28 -4.927 -3.904 -9.819 1.00 0.00 C ATOM 450 C ARG A 28 -6.432 -4.151 -9.742 1.00 0.00 C ATOM 451 O ARG A 28 -7.152 -3.417 -9.069 1.00 0.00 O ATOM 452 CB ARG A 28 -4.636 -2.744 -10.762 1.00 0.00 C ATOM 453 CG ARG A 28 -5.164 -1.428 -10.256 1.00 0.00 C ATOM 454 CD ARG A 28 -6.443 -1.043 -10.956 1.00 0.00 C ATOM 455 NE ARG A 28 -6.202 -0.485 -12.285 1.00 0.00 N ATOM 456 CZ ARG A 28 -7.068 0.291 -12.932 1.00 0.00 C ATOM 457 NH1 ARG A 28 -8.234 0.602 -12.379 1.00 0.00 N ATOM 458 NH2 ARG A 28 -6.769 0.757 -14.137 1.00 0.00 N ATOM 0 H ARG A 28 -3.853 -5.044 -11.211 1.00 0.00 H new ATOM 0 HA ARG A 28 -4.582 -3.655 -8.816 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -3.559 -2.664 -10.910 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -5.077 -2.956 -11.736 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -5.340 -1.494 -9.182 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -4.415 -0.651 -10.409 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -7.085 -1.920 -11.043 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -6.981 -0.314 -10.350 1.00 0.00 H new ATOM 0 HE ARG A 28 -5.318 -0.703 -12.744 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -8.470 0.246 -11.453 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -8.893 1.197 -12.880 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -5.875 0.521 -14.568 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -7.433 1.352 -14.633 1.00 0.00 H new ATOM 472 N LYS A 29 -6.906 -5.182 -10.438 1.00 0.00 N ATOM 473 CA LYS A 29 -8.327 -5.519 -10.451 1.00 0.00 C ATOM 474 C LYS A 29 -8.930 -5.451 -9.051 1.00 0.00 C ATOM 475 O LYS A 29 -9.981 -4.846 -8.845 1.00 0.00 O ATOM 476 CB LYS A 29 -8.531 -6.916 -11.035 1.00 0.00 C ATOM 477 CG LYS A 29 -8.847 -6.907 -12.520 1.00 0.00 C ATOM 478 CD LYS A 29 -8.075 -7.986 -13.258 1.00 0.00 C ATOM 479 CE LYS A 29 -8.650 -8.241 -14.642 1.00 0.00 C ATOM 480 NZ LYS A 29 -7.582 -8.427 -15.663 1.00 0.00 N ATOM 0 H LYS A 29 -6.324 -5.801 -11.002 1.00 0.00 H new ATOM 0 HA LYS A 29 -8.837 -4.786 -11.076 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -7.631 -7.508 -10.866 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -9.343 -7.410 -10.501 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -9.916 -7.058 -12.667 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -8.602 -5.931 -12.940 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -7.030 -7.690 -13.347 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -8.096 -8.909 -12.679 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -9.283 -9.128 -14.614 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -9.286 -7.404 -14.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -7.800 -7.852 -16.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -6.668 -8.129 -15.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -7.532 -9.430 -15.934 1.00 0.00 H new ATOM 494 N LEU A 30 -8.256 -6.078 -8.094 1.00 0.00 N ATOM 495 CA LEU A 30 -8.722 -6.090 -6.716 1.00 0.00 C ATOM 496 C LEU A 30 -7.946 -5.081 -5.877 1.00 0.00 C ATOM 497 O LEU A 30 -8.479 -4.496 -4.935 1.00 0.00 O ATOM 498 CB LEU A 30 -8.572 -7.493 -6.127 1.00 0.00 C ATOM 499 CG LEU A 30 -8.959 -8.636 -7.072 1.00 0.00 C ATOM 500 CD1 LEU A 30 -7.914 -9.744 -7.037 1.00 0.00 C ATOM 501 CD2 LEU A 30 -10.334 -9.181 -6.714 1.00 0.00 C ATOM 0 H LEU A 30 -7.384 -6.585 -8.249 1.00 0.00 H new ATOM 0 HA LEU A 30 -9.775 -5.809 -6.703 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -7.536 -7.632 -5.818 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -9.185 -7.561 -5.228 1.00 0.00 H new ATOM 0 HG LEU A 30 -8.999 -8.242 -8.087 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -8.210 -10.544 -7.715 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -6.949 -9.344 -7.347 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -7.835 -10.138 -6.024 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -10.593 -9.992 -7.395 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -10.321 -9.557 -5.691 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -11.074 -8.385 -6.799 1.00 0.00 H new ATOM 513 N ALA A 31 -6.684 -4.880 -6.235 1.00 0.00 N ATOM 514 CA ALA A 31 -5.823 -3.940 -5.528 1.00 0.00 C ATOM 515 C ALA A 31 -6.240 -2.494 -5.788 1.00 0.00 C ATOM 516 O ALA A 31 -5.786 -1.579 -5.101 1.00 0.00 O ATOM 517 CB ALA A 31 -4.372 -4.152 -5.933 1.00 0.00 C ATOM 0 H ALA A 31 -6.232 -5.358 -7.015 1.00 0.00 H new ATOM 0 HA ALA A 31 -5.927 -4.129 -4.460 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -3.738 -3.444 -5.399 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -4.070 -5.169 -5.685 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -4.267 -3.994 -7.006 1.00 0.00 H new ATOM 523 N ALA A 32 -7.088 -2.287 -6.794 1.00 0.00 N ATOM 524 CA ALA A 32 -7.536 -0.943 -7.146 1.00 0.00 C ATOM 525 C ALA A 32 -8.153 -0.216 -5.954 1.00 0.00 C ATOM 526 O ALA A 32 -7.823 0.941 -5.697 1.00 0.00 O ATOM 527 CB ALA A 32 -8.536 -1.004 -8.290 1.00 0.00 C ATOM 0 H ALA A 32 -7.476 -3.029 -7.376 1.00 0.00 H new ATOM 0 HA ALA A 32 -6.658 -0.379 -7.460 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -8.862 0.005 -8.542 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -8.066 -1.462 -9.160 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -9.398 -1.599 -7.988 1.00 0.00 H new ATOM 533 N HIS A 33 -9.044 -0.891 -5.225 1.00 0.00 N ATOM 534 CA HIS A 33 -9.695 -0.287 -4.058 1.00 0.00 C ATOM 535 C HIS A 33 -10.926 -1.086 -3.628 1.00 0.00 C ATOM 536 O HIS A 33 -11.083 -1.419 -2.454 1.00 0.00 O ATOM 537 CB HIS A 33 -10.088 1.174 -4.358 1.00 0.00 C ATOM 538 CG HIS A 33 -11.483 1.545 -3.947 1.00 0.00 C ATOM 539 ND1 HIS A 33 -12.434 1.995 -4.839 1.00 0.00 N ATOM 540 CD2 HIS A 33 -12.085 1.529 -2.735 1.00 0.00 C ATOM 541 CE1 HIS A 33 -13.560 2.240 -4.193 1.00 0.00 C ATOM 542 NE2 HIS A 33 -13.375 1.965 -2.915 1.00 0.00 N ATOM 0 H HIS A 33 -9.331 -1.850 -5.419 1.00 0.00 H new ATOM 0 HA HIS A 33 -8.980 -0.302 -3.235 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -9.386 1.836 -3.851 1.00 0.00 H new ATOM 0 HB3 HIS A 33 -9.979 1.353 -5.428 1.00 0.00 H new ATOM 0 HD2 HIS A 33 -11.635 1.229 -1.800 1.00 0.00 H new ATOM 0 HE1 HIS A 33 -14.476 2.603 -4.635 1.00 0.00 H new ATOM 0 HE2 HIS A 33 -14.076 2.061 -2.181 1.00 0.00 H new ATOM 551 N ASP A 34 -11.802 -1.367 -4.583 1.00 0.00 N ATOM 552 CA ASP A 34 -13.033 -2.100 -4.310 1.00 0.00 C ATOM 553 C ASP A 34 -12.759 -3.424 -3.606 1.00 0.00 C ATOM 554 O ASP A 34 -13.312 -3.695 -2.541 1.00 0.00 O ATOM 555 CB ASP A 34 -13.798 -2.352 -5.610 1.00 0.00 C ATOM 556 CG ASP A 34 -15.299 -2.250 -5.427 1.00 0.00 C ATOM 557 OD1 ASP A 34 -15.904 -3.219 -4.923 1.00 0.00 O ATOM 558 OD2 ASP A 34 -15.871 -1.199 -5.788 1.00 0.00 O ATOM 0 H ASP A 34 -11.683 -1.097 -5.559 1.00 0.00 H new ATOM 0 HA ASP A 34 -13.639 -1.486 -3.644 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -13.477 -1.632 -6.363 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -13.548 -3.343 -5.989 1.00 0.00 H new ATOM 563 N ASN A 35 -11.913 -4.252 -4.208 1.00 0.00 N ATOM 564 CA ASN A 35 -11.587 -5.546 -3.634 1.00 0.00 C ATOM 565 C ASN A 35 -10.164 -5.566 -3.087 1.00 0.00 C ATOM 566 O ASN A 35 -9.417 -6.519 -3.305 1.00 0.00 O ATOM 567 CB ASN A 35 -11.767 -6.655 -4.674 1.00 0.00 C ATOM 568 CG ASN A 35 -13.059 -6.515 -5.454 1.00 0.00 C ATOM 569 OD1 ASN A 35 -13.227 -5.580 -6.237 1.00 0.00 O ATOM 570 ND2 ASN A 35 -13.982 -7.447 -5.243 1.00 0.00 N ATOM 0 H ASN A 35 -11.443 -4.049 -5.090 1.00 0.00 H new ATOM 0 HA ASN A 35 -12.272 -5.724 -2.805 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -10.925 -6.640 -5.366 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -11.751 -7.623 -4.174 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -14.872 -7.405 -5.739 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -13.800 -8.205 -4.585 1.00 0.00 H new ATOM 577 N LEU A 36 -9.796 -4.510 -2.372 1.00 0.00 N ATOM 578 CA LEU A 36 -8.462 -4.412 -1.794 1.00 0.00 C ATOM 579 C LEU A 36 -8.496 -4.693 -0.296 1.00 0.00 C ATOM 580 O LEU A 36 -9.142 -3.976 0.469 1.00 0.00 O ATOM 581 CB LEU A 36 -7.870 -3.025 -2.053 1.00 0.00 C ATOM 582 CG LEU A 36 -6.472 -2.800 -1.473 1.00 0.00 C ATOM 583 CD1 LEU A 36 -5.657 -1.892 -2.381 1.00 0.00 C ATOM 584 CD2 LEU A 36 -6.565 -2.212 -0.073 1.00 0.00 C ATOM 0 H LEU A 36 -10.401 -3.712 -2.179 1.00 0.00 H new ATOM 0 HA LEU A 36 -7.831 -5.162 -2.271 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -7.832 -2.858 -3.129 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -8.544 -2.276 -1.638 1.00 0.00 H new ATOM 0 HG LEU A 36 -5.966 -3.764 -1.409 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -4.666 -1.743 -1.952 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -5.562 -2.352 -3.365 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -6.159 -0.929 -2.478 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -5.562 -2.058 0.325 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -7.089 -1.257 -0.113 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -7.111 -2.898 0.574 1.00 0.00 H new ATOM 596 N LYS A 37 -7.787 -5.738 0.116 1.00 0.00 N ATOM 597 CA LYS A 37 -7.722 -6.116 1.520 1.00 0.00 C ATOM 598 C LYS A 37 -6.301 -5.986 2.028 1.00 0.00 C ATOM 599 O LYS A 37 -5.392 -6.675 1.568 1.00 0.00 O ATOM 600 CB LYS A 37 -8.225 -7.546 1.720 1.00 0.00 C ATOM 601 CG LYS A 37 -7.970 -8.105 3.114 1.00 0.00 C ATOM 602 CD LYS A 37 -8.578 -7.225 4.195 1.00 0.00 C ATOM 603 CE LYS A 37 -9.940 -7.740 4.632 1.00 0.00 C ATOM 604 NZ LYS A 37 -9.906 -9.191 4.965 1.00 0.00 N ATOM 0 H LYS A 37 -7.248 -6.340 -0.506 1.00 0.00 H new ATOM 0 HA LYS A 37 -8.365 -5.444 2.088 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -9.296 -7.575 1.519 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -7.746 -8.194 0.987 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -8.388 -9.109 3.185 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -6.896 -8.194 3.279 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -7.909 -7.188 5.055 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -8.676 -6.205 3.823 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -10.279 -7.176 5.501 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -10.665 -7.567 3.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -10.570 -9.385 5.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -10.180 -9.746 4.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -8.944 -9.458 5.257 1.00 0.00 H new ATOM 618 N LEU A 38 -6.126 -5.095 2.978 1.00 0.00 N ATOM 619 CA LEU A 38 -4.830 -4.847 3.573 1.00 0.00 C ATOM 620 C LEU A 38 -4.806 -5.440 4.979 1.00 0.00 C ATOM 621 O LEU A 38 -5.526 -4.988 5.857 1.00 0.00 O ATOM 622 CB LEU A 38 -4.584 -3.329 3.585 1.00 0.00 C ATOM 623 CG LEU A 38 -3.120 -2.854 3.448 1.00 0.00 C ATOM 624 CD1 LEU A 38 -2.263 -3.869 2.700 1.00 0.00 C ATOM 625 CD2 LEU A 38 -3.059 -1.504 2.738 1.00 0.00 C ATOM 0 H LEU A 38 -6.878 -4.521 3.361 1.00 0.00 H new ATOM 0 HA LEU A 38 -4.033 -5.320 2.999 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -5.161 -2.886 2.773 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -4.984 -2.928 4.516 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.719 -2.751 4.456 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -1.241 -3.497 2.625 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -2.266 -4.816 3.240 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -2.668 -4.020 1.700 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -2.020 -1.185 2.651 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -3.495 -1.596 1.743 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.618 -0.765 3.312 1.00 0.00 H new ATOM 637 N THR A 39 -4.011 -6.483 5.179 1.00 0.00 N ATOM 638 CA THR A 39 -3.951 -7.143 6.481 1.00 0.00 C ATOM 639 C THR A 39 -2.743 -6.690 7.290 1.00 0.00 C ATOM 640 O THR A 39 -1.658 -6.485 6.748 1.00 0.00 O ATOM 641 CB THR A 39 -3.923 -8.663 6.307 1.00 0.00 C ATOM 642 OG1 THR A 39 -4.843 -9.070 5.310 1.00 0.00 O ATOM 643 CG2 THR A 39 -4.259 -9.415 7.576 1.00 0.00 C ATOM 0 H THR A 39 -3.404 -6.888 4.466 1.00 0.00 H new ATOM 0 HA THR A 39 -4.847 -6.859 7.032 1.00 0.00 H new ATOM 0 HB THR A 39 -2.899 -8.903 6.021 1.00 0.00 H new ATOM 0 HG1 THR A 39 -4.360 -9.270 4.481 1.00 0.00 H new ATOM 0 HG21 THR A 39 -4.221 -10.487 7.384 1.00 0.00 H new ATOM 0 HG22 THR A 39 -3.537 -9.160 8.352 1.00 0.00 H new ATOM 0 HG23 THR A 39 -5.261 -9.141 7.907 1.00 0.00 H new ATOM 651 N ILE A 40 -2.945 -6.546 8.598 1.00 0.00 N ATOM 652 CA ILE A 40 -1.882 -6.127 9.505 1.00 0.00 C ATOM 653 C ILE A 40 -1.657 -7.180 10.586 1.00 0.00 C ATOM 654 O ILE A 40 -2.611 -7.685 11.178 1.00 0.00 O ATOM 655 CB ILE A 40 -2.202 -4.775 10.185 1.00 0.00 C ATOM 656 CG1 ILE A 40 -3.172 -3.949 9.334 1.00 0.00 C ATOM 657 CG2 ILE A 40 -0.920 -3.997 10.441 1.00 0.00 C ATOM 658 CD1 ILE A 40 -2.594 -3.500 8.012 1.00 0.00 C ATOM 0 H ILE A 40 -3.841 -6.715 9.054 1.00 0.00 H new ATOM 0 HA ILE A 40 -0.981 -6.009 8.903 1.00 0.00 H new ATOM 0 HB ILE A 40 -2.684 -4.979 11.141 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -4.069 -4.539 9.146 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -3.481 -3.071 9.901 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -1.160 -3.048 10.920 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.266 -4.577 11.092 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -0.414 -3.808 9.494 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -3.340 -2.921 7.467 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -1.714 -2.882 8.191 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -2.311 -4.373 7.424 1.00 0.00 H new ATOM 670 N THR A 41 -0.395 -7.512 10.839 1.00 0.00 N ATOM 671 CA THR A 41 -0.061 -8.511 11.849 1.00 0.00 C ATOM 672 C THR A 41 1.176 -8.103 12.643 1.00 0.00 C ATOM 673 O THR A 41 2.030 -7.368 12.148 1.00 0.00 O ATOM 674 CB THR A 41 0.168 -9.872 11.190 1.00 0.00 C ATOM 675 OG1 THR A 41 -0.979 -10.278 10.465 1.00 0.00 O ATOM 676 CG2 THR A 41 0.498 -10.970 12.179 1.00 0.00 C ATOM 0 H THR A 41 0.410 -7.106 10.361 1.00 0.00 H new ATOM 0 HA THR A 41 -0.901 -8.582 12.540 1.00 0.00 H new ATOM 0 HB THR A 41 1.024 -9.731 10.530 1.00 0.00 H new ATOM 0 HG1 THR A 41 -0.812 -11.150 10.050 1.00 0.00 H new ATOM 0 HG21 THR A 41 0.648 -11.908 11.645 1.00 0.00 H new ATOM 0 HG22 THR A 41 1.408 -10.711 12.720 1.00 0.00 H new ATOM 0 HG23 THR A 41 -0.324 -11.083 12.885 1.00 0.00 H new ATOM 684 N GLN A 42 1.266 -8.592 13.876 1.00 0.00 N ATOM 685 CA GLN A 42 2.400 -8.287 14.741 1.00 0.00 C ATOM 686 C GLN A 42 3.525 -9.293 14.527 1.00 0.00 C ATOM 687 O GLN A 42 3.336 -10.497 14.702 1.00 0.00 O ATOM 688 CB GLN A 42 1.967 -8.294 16.209 1.00 0.00 C ATOM 689 CG GLN A 42 2.877 -7.482 17.116 1.00 0.00 C ATOM 690 CD GLN A 42 3.061 -6.057 16.632 1.00 0.00 C ATOM 691 OE1 GLN A 42 2.289 -5.164 16.983 1.00 0.00 O ATOM 692 NE2 GLN A 42 4.089 -5.836 15.820 1.00 0.00 N ATOM 0 H GLN A 42 0.566 -9.202 14.299 1.00 0.00 H new ATOM 0 HA GLN A 42 2.767 -7.293 14.484 1.00 0.00 H new ATOM 0 HB2 GLN A 42 0.952 -7.902 16.282 1.00 0.00 H new ATOM 0 HB3 GLN A 42 1.938 -9.324 16.565 1.00 0.00 H new ATOM 0 HG2 GLN A 42 2.462 -7.469 18.124 1.00 0.00 H new ATOM 0 HG3 GLN A 42 3.850 -7.969 17.179 1.00 0.00 H new ATOM 0 HE21 GLN A 42 4.704 -6.605 15.555 1.00 0.00 H new ATOM 0 HE22 GLN A 42 4.263 -4.897 15.462 1.00 0.00 H new ATOM 701 N GLU A 43 4.694 -8.794 14.143 1.00 0.00 N ATOM 702 CA GLU A 43 5.847 -9.651 13.900 1.00 0.00 C ATOM 703 C GLU A 43 7.125 -9.010 14.419 1.00 0.00 C ATOM 704 O GLU A 43 8.174 -9.060 13.774 1.00 0.00 O ATOM 705 CB GLU A 43 5.984 -9.934 12.414 1.00 0.00 C ATOM 706 CG GLU A 43 6.351 -11.373 12.096 1.00 0.00 C ATOM 707 CD GLU A 43 6.262 -11.685 10.615 1.00 0.00 C ATOM 708 OE1 GLU A 43 5.562 -10.943 9.893 1.00 0.00 O ATOM 709 OE2 GLU A 43 6.891 -12.671 10.177 1.00 0.00 O ATOM 0 H GLU A 43 4.868 -7.800 13.993 1.00 0.00 H new ATOM 0 HA GLU A 43 5.689 -10.587 14.435 1.00 0.00 H new ATOM 0 HB2 GLU A 43 5.044 -9.691 11.919 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.744 -9.274 11.996 1.00 0.00 H new ATOM 0 HG2 GLU A 43 7.365 -11.571 12.445 1.00 0.00 H new ATOM 0 HG3 GLU A 43 5.689 -12.043 12.645 1.00 0.00 H new ATOM 716 N GLY A 44 7.022 -8.411 15.584 1.00 0.00 N ATOM 717 CA GLY A 44 8.163 -7.763 16.194 1.00 0.00 C ATOM 718 C GLY A 44 8.396 -6.368 15.647 1.00 0.00 C ATOM 719 O GLY A 44 7.487 -5.537 15.660 1.00 0.00 O ATOM 0 H GLY A 44 6.161 -8.359 16.128 1.00 0.00 H new ATOM 0 HA2 GLY A 44 8.012 -7.707 17.272 1.00 0.00 H new ATOM 0 HA3 GLY A 44 9.054 -8.369 16.028 1.00 0.00 H new ATOM 723 N ASN A 45 9.605 -6.101 15.153 1.00 0.00 N ATOM 724 CA ASN A 45 9.916 -4.792 14.593 1.00 0.00 C ATOM 725 C ASN A 45 9.359 -4.661 13.182 1.00 0.00 C ATOM 726 O ASN A 45 9.544 -3.634 12.530 1.00 0.00 O ATOM 727 CB ASN A 45 11.428 -4.544 14.570 1.00 0.00 C ATOM 728 CG ASN A 45 12.223 -5.775 14.180 1.00 0.00 C ATOM 729 OD1 ASN A 45 11.678 -6.733 13.631 1.00 0.00 O ATOM 730 ND2 ASN A 45 13.521 -5.756 14.463 1.00 0.00 N ATOM 0 H ASN A 45 10.376 -6.768 15.130 1.00 0.00 H new ATOM 0 HA ASN A 45 9.448 -4.045 15.234 1.00 0.00 H new ATOM 0 HB2 ASN A 45 11.648 -3.739 13.869 1.00 0.00 H new ATOM 0 HB3 ASN A 45 11.751 -4.207 15.555 1.00 0.00 H new ATOM 0 HD21 ASN A 45 14.107 -6.556 14.224 1.00 0.00 H new ATOM 0 HD22 ASN A 45 13.932 -4.941 14.919 1.00 0.00 H new ATOM 737 N LYS A 46 8.680 -5.703 12.705 1.00 0.00 N ATOM 738 CA LYS A 46 8.115 -5.672 11.366 1.00 0.00 C ATOM 739 C LYS A 46 6.653 -6.089 11.365 1.00 0.00 C ATOM 740 O LYS A 46 6.185 -6.789 12.263 1.00 0.00 O ATOM 741 CB LYS A 46 8.936 -6.551 10.417 1.00 0.00 C ATOM 742 CG LYS A 46 8.489 -7.992 10.345 1.00 0.00 C ATOM 743 CD LYS A 46 9.563 -8.853 9.709 1.00 0.00 C ATOM 744 CE LYS A 46 9.034 -10.222 9.351 1.00 0.00 C ATOM 745 NZ LYS A 46 9.674 -11.298 10.156 1.00 0.00 N ATOM 0 H LYS A 46 8.512 -6.566 13.221 1.00 0.00 H new ATOM 0 HA LYS A 46 8.159 -4.643 11.010 1.00 0.00 H new ATOM 0 HB2 LYS A 46 8.892 -6.121 9.416 1.00 0.00 H new ATOM 0 HB3 LYS A 46 9.980 -6.524 10.730 1.00 0.00 H new ATOM 0 HG2 LYS A 46 8.266 -8.360 11.347 1.00 0.00 H new ATOM 0 HG3 LYS A 46 7.568 -8.064 9.767 1.00 0.00 H new ATOM 0 HD2 LYS A 46 9.941 -8.362 8.812 1.00 0.00 H new ATOM 0 HD3 LYS A 46 10.404 -8.954 10.395 1.00 0.00 H new ATOM 0 HE2 LYS A 46 7.956 -10.246 9.507 1.00 0.00 H new ATOM 0 HE3 LYS A 46 9.207 -10.411 8.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 8.988 -12.061 10.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 10.494 -11.676 9.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 9.988 -10.909 11.068 1.00 0.00 H new ATOM 759 N PHE A 47 5.940 -5.628 10.351 1.00 0.00 N ATOM 760 CA PHE A 47 4.522 -5.913 10.209 1.00 0.00 C ATOM 761 C PHE A 47 4.248 -6.831 9.022 1.00 0.00 C ATOM 762 O PHE A 47 4.761 -6.617 7.926 1.00 0.00 O ATOM 763 CB PHE A 47 3.773 -4.601 10.026 1.00 0.00 C ATOM 764 CG PHE A 47 4.073 -3.597 11.098 1.00 0.00 C ATOM 765 CD1 PHE A 47 3.752 -3.853 12.421 1.00 0.00 C ATOM 766 CD2 PHE A 47 4.694 -2.401 10.782 1.00 0.00 C ATOM 767 CE1 PHE A 47 4.048 -2.931 13.407 1.00 0.00 C ATOM 768 CE2 PHE A 47 4.988 -1.477 11.763 1.00 0.00 C ATOM 769 CZ PHE A 47 4.665 -1.743 13.078 1.00 0.00 C ATOM 0 H PHE A 47 6.326 -5.048 9.606 1.00 0.00 H new ATOM 0 HA PHE A 47 4.181 -6.426 11.108 1.00 0.00 H new ATOM 0 HB2 PHE A 47 4.030 -4.175 9.056 1.00 0.00 H new ATOM 0 HB3 PHE A 47 2.701 -4.800 10.013 1.00 0.00 H new ATOM 0 HD1 PHE A 47 3.266 -4.781 12.684 1.00 0.00 H new ATOM 0 HD2 PHE A 47 4.951 -2.189 9.755 1.00 0.00 H new ATOM 0 HE1 PHE A 47 3.796 -3.141 14.436 1.00 0.00 H new ATOM 0 HE2 PHE A 47 5.470 -0.547 11.502 1.00 0.00 H new ATOM 0 HZ PHE A 47 4.895 -1.022 13.848 1.00 0.00 H new ATOM 779 N THR A 48 3.422 -7.847 9.246 1.00 0.00 N ATOM 780 CA THR A 48 3.068 -8.786 8.190 1.00 0.00 C ATOM 781 C THR A 48 1.859 -8.280 7.412 1.00 0.00 C ATOM 782 O THR A 48 0.783 -8.084 7.978 1.00 0.00 O ATOM 783 CB THR A 48 2.769 -10.167 8.778 1.00 0.00 C ATOM 784 OG1 THR A 48 3.164 -10.233 10.137 1.00 0.00 O ATOM 785 CG2 THR A 48 3.463 -11.293 8.044 1.00 0.00 C ATOM 0 H THR A 48 2.986 -8.041 10.148 1.00 0.00 H new ATOM 0 HA THR A 48 3.915 -8.870 7.510 1.00 0.00 H new ATOM 0 HB THR A 48 1.692 -10.296 8.674 1.00 0.00 H new ATOM 0 HG1 THR A 48 3.954 -10.807 10.221 1.00 0.00 H new ATOM 0 HG21 THR A 48 3.208 -12.244 8.512 1.00 0.00 H new ATOM 0 HG22 THR A 48 3.139 -11.303 7.003 1.00 0.00 H new ATOM 0 HG23 THR A 48 4.542 -11.145 8.087 1.00 0.00 H new ATOM 793 N VAL A 49 2.040 -8.069 6.114 1.00 0.00 N ATOM 794 CA VAL A 49 0.959 -7.584 5.262 1.00 0.00 C ATOM 795 C VAL A 49 0.466 -8.680 4.327 1.00 0.00 C ATOM 796 O VAL A 49 1.242 -9.270 3.577 1.00 0.00 O ATOM 797 CB VAL A 49 1.376 -6.355 4.418 1.00 0.00 C ATOM 798 CG1 VAL A 49 0.537 -5.142 4.791 1.00 0.00 C ATOM 799 CG2 VAL A 49 2.858 -6.050 4.581 1.00 0.00 C ATOM 0 H VAL A 49 2.923 -8.225 5.628 1.00 0.00 H new ATOM 0 HA VAL A 49 0.156 -7.282 5.935 1.00 0.00 H new ATOM 0 HB VAL A 49 1.197 -6.593 3.369 1.00 0.00 H new ATOM 0 HG11 VAL A 49 0.844 -4.288 4.188 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -0.516 -5.357 4.606 1.00 0.00 H new ATOM 0 HG13 VAL A 49 0.680 -4.911 5.847 1.00 0.00 H new ATOM 0 HG21 VAL A 49 3.120 -5.182 3.976 1.00 0.00 H new ATOM 0 HG22 VAL A 49 3.073 -5.840 5.629 1.00 0.00 H new ATOM 0 HG23 VAL A 49 3.444 -6.909 4.255 1.00 0.00 H new ATOM 809 N LYS A 50 -0.834 -8.941 4.378 1.00 0.00 N ATOM 810 CA LYS A 50 -1.442 -9.962 3.534 1.00 0.00 C ATOM 811 C LYS A 50 -2.551 -9.360 2.678 1.00 0.00 C ATOM 812 O LYS A 50 -3.559 -8.882 3.197 1.00 0.00 O ATOM 813 CB LYS A 50 -2.002 -11.097 4.394 1.00 0.00 C ATOM 814 CG LYS A 50 -1.700 -12.481 3.845 1.00 0.00 C ATOM 815 CD LYS A 50 -2.236 -13.572 4.757 1.00 0.00 C ATOM 816 CE LYS A 50 -2.183 -14.935 4.086 1.00 0.00 C ATOM 817 NZ LYS A 50 -2.861 -15.982 4.900 1.00 0.00 N ATOM 0 H LYS A 50 -1.488 -8.460 4.995 1.00 0.00 H new ATOM 0 HA LYS A 50 -0.673 -10.364 2.875 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -1.590 -11.016 5.400 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -3.082 -10.977 4.481 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -2.142 -12.585 2.854 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -0.623 -12.600 3.728 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -1.654 -13.596 5.678 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -3.264 -13.342 5.036 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -2.655 -14.875 3.105 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -1.143 -15.219 3.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -2.803 -16.896 4.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -2.395 -16.057 5.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -3.860 -15.724 5.035 1.00 0.00 H new ATOM 831 N GLU A 51 -2.359 -9.383 1.363 1.00 0.00 N ATOM 832 CA GLU A 51 -3.348 -8.836 0.443 1.00 0.00 C ATOM 833 C GLU A 51 -4.406 -9.878 0.103 1.00 0.00 C ATOM 834 O GLU A 51 -4.102 -10.922 -0.474 1.00 0.00 O ATOM 835 CB GLU A 51 -2.670 -8.337 -0.834 1.00 0.00 C ATOM 836 CG GLU A 51 -3.105 -6.941 -1.248 1.00 0.00 C ATOM 837 CD GLU A 51 -1.953 -6.100 -1.762 1.00 0.00 C ATOM 838 OE1 GLU A 51 -1.424 -6.418 -2.848 1.00 0.00 O ATOM 839 OE2 GLU A 51 -1.579 -5.124 -1.078 1.00 0.00 O ATOM 0 H GLU A 51 -1.531 -9.773 0.913 1.00 0.00 H new ATOM 0 HA GLU A 51 -3.838 -7.995 0.933 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -1.590 -8.344 -0.688 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -2.886 -9.032 -1.646 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -3.868 -7.017 -2.022 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -3.564 -6.440 -0.396 1.00 0.00 H new ATOM 846 N SER A 52 -5.650 -9.588 0.467 1.00 0.00 N ATOM 847 CA SER A 52 -6.755 -10.501 0.202 1.00 0.00 C ATOM 848 C SER A 52 -7.626 -9.989 -0.939 1.00 0.00 C ATOM 849 O SER A 52 -7.821 -8.782 -1.096 1.00 0.00 O ATOM 850 CB SER A 52 -7.603 -10.687 1.462 1.00 0.00 C ATOM 851 OG SER A 52 -8.057 -12.025 1.577 1.00 0.00 O ATOM 0 H SER A 52 -5.918 -8.728 0.946 1.00 0.00 H new ATOM 0 HA SER A 52 -6.334 -11.463 -0.092 1.00 0.00 H new ATOM 0 HB2 SER A 52 -7.017 -10.422 2.342 1.00 0.00 H new ATOM 0 HB3 SER A 52 -8.457 -10.011 1.433 1.00 0.00 H new ATOM 0 HG SER A 52 -8.595 -12.119 2.391 1.00 0.00 H new ATOM 857 N SER A 53 -8.145 -10.917 -1.735 1.00 0.00 N ATOM 858 CA SER A 53 -8.997 -10.569 -2.864 1.00 0.00 C ATOM 859 C SER A 53 -10.011 -11.674 -3.140 1.00 0.00 C ATOM 860 O SER A 53 -10.144 -12.616 -2.359 1.00 0.00 O ATOM 861 CB SER A 53 -8.149 -10.315 -4.111 1.00 0.00 C ATOM 862 OG SER A 53 -6.801 -10.046 -3.766 1.00 0.00 O ATOM 0 H SER A 53 -7.990 -11.918 -1.618 1.00 0.00 H new ATOM 0 HA SER A 53 -9.539 -9.658 -2.611 1.00 0.00 H new ATOM 0 HB2 SER A 53 -8.193 -11.184 -4.768 1.00 0.00 H new ATOM 0 HB3 SER A 53 -8.560 -9.473 -4.668 1.00 0.00 H new ATOM 0 HG SER A 53 -6.280 -10.875 -3.811 1.00 0.00 H new ATOM 868 N ALA A 54 -10.720 -11.554 -4.257 1.00 0.00 N ATOM 869 CA ALA A 54 -11.718 -12.545 -4.637 1.00 0.00 C ATOM 870 C ALA A 54 -11.055 -13.815 -5.159 1.00 0.00 C ATOM 871 O ALA A 54 -11.250 -14.900 -4.610 1.00 0.00 O ATOM 872 CB ALA A 54 -12.660 -11.970 -5.684 1.00 0.00 C ATOM 0 H ALA A 54 -10.622 -10.780 -4.914 1.00 0.00 H new ATOM 0 HA ALA A 54 -12.295 -12.805 -3.750 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -13.401 -12.721 -5.959 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -13.165 -11.094 -5.277 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -12.090 -11.682 -6.567 1.00 0.00 H new ATOM 878 N PHE A 55 -10.272 -13.674 -6.224 1.00 0.00 N ATOM 879 CA PHE A 55 -9.580 -14.811 -6.821 1.00 0.00 C ATOM 880 C PHE A 55 -8.064 -14.662 -6.701 1.00 0.00 C ATOM 881 O PHE A 55 -7.336 -15.654 -6.678 1.00 0.00 O ATOM 882 CB PHE A 55 -9.973 -14.956 -8.292 1.00 0.00 C ATOM 883 CG PHE A 55 -9.854 -13.679 -9.074 1.00 0.00 C ATOM 884 CD1 PHE A 55 -10.866 -12.733 -9.040 1.00 0.00 C ATOM 885 CD2 PHE A 55 -8.730 -13.424 -9.844 1.00 0.00 C ATOM 886 CE1 PHE A 55 -10.760 -11.557 -9.758 1.00 0.00 C ATOM 887 CE2 PHE A 55 -8.618 -12.251 -10.564 1.00 0.00 C ATOM 888 CZ PHE A 55 -9.634 -11.316 -10.521 1.00 0.00 C ATOM 0 H PHE A 55 -10.101 -12.784 -6.691 1.00 0.00 H new ATOM 0 HA PHE A 55 -9.879 -15.707 -6.278 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -9.343 -15.716 -8.755 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -11.001 -15.314 -8.351 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -11.748 -12.917 -8.445 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -7.932 -14.151 -9.881 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -11.556 -10.828 -9.723 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -7.737 -12.065 -11.160 1.00 0.00 H new ATOM 0 HZ PHE A 55 -9.548 -10.398 -11.083 1.00 0.00 H new ATOM 898 N ARG A 56 -7.595 -13.420 -6.628 1.00 0.00 N ATOM 899 CA ARG A 56 -6.166 -13.149 -6.513 1.00 0.00 C ATOM 900 C ARG A 56 -5.749 -13.028 -5.050 1.00 0.00 C ATOM 901 O ARG A 56 -6.538 -12.611 -4.202 1.00 0.00 O ATOM 902 CB ARG A 56 -5.807 -11.866 -7.265 1.00 0.00 C ATOM 903 CG ARG A 56 -4.470 -11.938 -7.986 1.00 0.00 C ATOM 904 CD ARG A 56 -4.649 -12.271 -9.459 1.00 0.00 C ATOM 905 NE ARG A 56 -3.464 -12.914 -10.022 1.00 0.00 N ATOM 906 CZ ARG A 56 -3.166 -14.200 -9.852 1.00 0.00 C ATOM 907 NH1 ARG A 56 -3.963 -14.984 -9.137 1.00 0.00 N ATOM 908 NH2 ARG A 56 -2.069 -14.704 -10.399 1.00 0.00 N ATOM 0 H ARG A 56 -8.183 -12.587 -6.646 1.00 0.00 H new ATOM 0 HA ARG A 56 -5.627 -13.986 -6.957 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -6.591 -11.649 -7.991 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -5.786 -11.035 -6.560 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -3.951 -10.985 -7.888 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -3.841 -12.694 -7.515 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -5.510 -12.928 -9.580 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -4.864 -11.358 -10.014 1.00 0.00 H new ATOM 0 HE ARG A 56 -2.827 -12.344 -10.578 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -4.809 -14.602 -8.714 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -3.730 -15.969 -9.010 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -1.453 -14.106 -10.950 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -1.841 -15.690 -10.269 1.00 0.00 H new ATOM 922 N ASN A 57 -4.505 -13.397 -4.762 1.00 0.00 N ATOM 923 CA ASN A 57 -3.984 -13.329 -3.402 1.00 0.00 C ATOM 924 C ASN A 57 -2.526 -12.880 -3.395 1.00 0.00 C ATOM 925 O ASN A 57 -1.720 -13.339 -4.205 1.00 0.00 O ATOM 926 CB ASN A 57 -4.113 -14.691 -2.717 1.00 0.00 C ATOM 927 CG ASN A 57 -3.840 -14.617 -1.227 1.00 0.00 C ATOM 928 OD1 ASN A 57 -4.666 -14.128 -0.457 1.00 0.00 O ATOM 929 ND2 ASN A 57 -2.676 -15.105 -0.814 1.00 0.00 N ATOM 0 H ASN A 57 -3.840 -13.746 -5.452 1.00 0.00 H new ATOM 0 HA ASN A 57 -4.572 -12.594 -2.852 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -5.117 -15.083 -2.881 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -3.417 -15.393 -3.177 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -2.437 -15.084 0.177 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -2.021 -15.501 -1.488 1.00 0.00 H new ATOM 936 N ILE A 58 -2.193 -11.983 -2.472 1.00 0.00 N ATOM 937 CA ILE A 58 -0.832 -11.473 -2.352 1.00 0.00 C ATOM 938 C ILE A 58 -0.435 -11.338 -0.887 1.00 0.00 C ATOM 939 O ILE A 58 -1.292 -11.301 -0.004 1.00 0.00 O ATOM 940 CB ILE A 58 -0.671 -10.104 -3.046 1.00 0.00 C ATOM 941 CG1 ILE A 58 -1.401 -10.092 -4.392 1.00 0.00 C ATOM 942 CG2 ILE A 58 0.803 -9.779 -3.235 1.00 0.00 C ATOM 943 CD1 ILE A 58 -2.796 -9.507 -4.322 1.00 0.00 C ATOM 0 H ILE A 58 -2.849 -11.594 -1.795 1.00 0.00 H new ATOM 0 HA ILE A 58 -0.179 -12.192 -2.846 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.117 -9.339 -2.410 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -0.812 -9.520 -5.110 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -1.463 -11.112 -4.771 1.00 0.00 H new ATOM 0 HG21 ILE A 58 0.902 -8.811 -3.726 1.00 0.00 H new ATOM 0 HG22 ILE A 58 1.296 -9.746 -2.263 1.00 0.00 H new ATOM 0 HG23 ILE A 58 1.269 -10.548 -3.852 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -3.251 -9.532 -5.312 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -3.402 -10.092 -3.630 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -2.741 -8.476 -3.974 1.00 0.00 H new ATOM 955 N GLU A 59 0.867 -11.269 -0.630 1.00 0.00 N ATOM 956 CA GLU A 59 1.364 -11.144 0.734 1.00 0.00 C ATOM 957 C GLU A 59 2.732 -10.469 0.763 1.00 0.00 C ATOM 958 O GLU A 59 3.423 -10.395 -0.253 1.00 0.00 O ATOM 959 CB GLU A 59 1.445 -12.523 1.392 1.00 0.00 C ATOM 960 CG GLU A 59 1.943 -12.484 2.827 1.00 0.00 C ATOM 961 CD GLU A 59 1.703 -13.788 3.563 1.00 0.00 C ATOM 962 OE1 GLU A 59 0.837 -14.570 3.118 1.00 0.00 O ATOM 963 OE2 GLU A 59 2.381 -14.027 4.584 1.00 0.00 O ATOM 0 H GLU A 59 1.594 -11.297 -1.345 1.00 0.00 H new ATOM 0 HA GLU A 59 0.666 -10.520 1.292 1.00 0.00 H new ATOM 0 HB2 GLU A 59 0.458 -12.985 1.371 1.00 0.00 H new ATOM 0 HB3 GLU A 59 2.107 -13.159 0.804 1.00 0.00 H new ATOM 0 HG2 GLU A 59 3.010 -12.259 2.832 1.00 0.00 H new ATOM 0 HG3 GLU A 59 1.444 -11.674 3.359 1.00 0.00 H new ATOM 970 N VAL A 60 3.111 -9.976 1.937 1.00 0.00 N ATOM 971 CA VAL A 60 4.391 -9.301 2.111 1.00 0.00 C ATOM 972 C VAL A 60 4.585 -8.873 3.564 1.00 0.00 C ATOM 973 O VAL A 60 3.639 -8.873 4.348 1.00 0.00 O ATOM 974 CB VAL A 60 4.496 -8.061 1.193 1.00 0.00 C ATOM 975 CG1 VAL A 60 3.484 -6.998 1.598 1.00 0.00 C ATOM 976 CG2 VAL A 60 5.906 -7.493 1.209 1.00 0.00 C ATOM 0 H VAL A 60 2.547 -10.032 2.785 1.00 0.00 H new ATOM 0 HA VAL A 60 5.173 -10.010 1.838 1.00 0.00 H new ATOM 0 HB VAL A 60 4.268 -8.377 0.175 1.00 0.00 H new ATOM 0 HG11 VAL A 60 3.578 -6.136 0.937 1.00 0.00 H new ATOM 0 HG12 VAL A 60 2.476 -7.407 1.521 1.00 0.00 H new ATOM 0 HG13 VAL A 60 3.672 -6.689 2.626 1.00 0.00 H new ATOM 0 HG21 VAL A 60 5.955 -6.622 0.556 1.00 0.00 H new ATOM 0 HG22 VAL A 60 6.169 -7.200 2.225 1.00 0.00 H new ATOM 0 HG23 VAL A 60 6.607 -8.250 0.857 1.00 0.00 H new ATOM 986 N VAL A 61 5.814 -8.514 3.916 1.00 0.00 N ATOM 987 CA VAL A 61 6.134 -8.081 5.269 1.00 0.00 C ATOM 988 C VAL A 61 7.050 -6.861 5.236 1.00 0.00 C ATOM 989 O VAL A 61 7.895 -6.743 4.348 1.00 0.00 O ATOM 990 CB VAL A 61 6.818 -9.212 6.058 1.00 0.00 C ATOM 991 CG1 VAL A 61 8.138 -9.599 5.408 1.00 0.00 C ATOM 992 CG2 VAL A 61 7.025 -8.807 7.508 1.00 0.00 C ATOM 0 H VAL A 61 6.609 -8.515 3.278 1.00 0.00 H new ATOM 0 HA VAL A 61 5.200 -7.818 5.765 1.00 0.00 H new ATOM 0 HB VAL A 61 6.165 -10.084 6.041 1.00 0.00 H new ATOM 0 HG11 VAL A 61 8.605 -10.400 5.981 1.00 0.00 H new ATOM 0 HG12 VAL A 61 7.955 -9.941 4.389 1.00 0.00 H new ATOM 0 HG13 VAL A 61 8.801 -8.734 5.387 1.00 0.00 H new ATOM 0 HG21 VAL A 61 7.510 -9.621 8.047 1.00 0.00 H new ATOM 0 HG22 VAL A 61 7.654 -7.918 7.551 1.00 0.00 H new ATOM 0 HG23 VAL A 61 6.060 -8.592 7.967 1.00 0.00 H new ATOM 1002 N PHE A 62 6.905 -5.960 6.208 1.00 0.00 N ATOM 1003 CA PHE A 62 7.762 -4.776 6.253 1.00 0.00 C ATOM 1004 C PHE A 62 8.236 -4.495 7.666 1.00 0.00 C ATOM 1005 O PHE A 62 7.452 -4.467 8.612 1.00 0.00 O ATOM 1006 CB PHE A 62 7.094 -3.526 5.649 1.00 0.00 C ATOM 1007 CG PHE A 62 5.588 -3.474 5.713 1.00 0.00 C ATOM 1008 CD1 PHE A 62 4.885 -4.081 6.737 1.00 0.00 C ATOM 1009 CD2 PHE A 62 4.879 -2.784 4.742 1.00 0.00 C ATOM 1010 CE1 PHE A 62 3.504 -4.007 6.789 1.00 0.00 C ATOM 1011 CE2 PHE A 62 3.501 -2.703 4.790 1.00 0.00 C ATOM 1012 CZ PHE A 62 2.813 -3.316 5.815 1.00 0.00 C ATOM 0 H PHE A 62 6.218 -6.024 6.959 1.00 0.00 H new ATOM 0 HA PHE A 62 8.627 -5.005 5.631 1.00 0.00 H new ATOM 0 HB2 PHE A 62 7.488 -2.647 6.160 1.00 0.00 H new ATOM 0 HB3 PHE A 62 7.395 -3.449 4.604 1.00 0.00 H new ATOM 0 HD1 PHE A 62 5.420 -4.619 7.505 1.00 0.00 H new ATOM 0 HD2 PHE A 62 5.412 -2.302 3.936 1.00 0.00 H new ATOM 0 HE1 PHE A 62 2.967 -4.490 7.592 1.00 0.00 H new ATOM 0 HE2 PHE A 62 2.964 -2.161 4.026 1.00 0.00 H new ATOM 0 HZ PHE A 62 1.735 -3.256 5.856 1.00 0.00 H new ATOM 1022 N GLU A 63 9.542 -4.305 7.791 1.00 0.00 N ATOM 1023 CA GLU A 63 10.168 -4.045 9.074 1.00 0.00 C ATOM 1024 C GLU A 63 10.581 -2.587 9.195 1.00 0.00 C ATOM 1025 O GLU A 63 11.090 -1.992 8.245 1.00 0.00 O ATOM 1026 CB GLU A 63 11.381 -4.959 9.234 1.00 0.00 C ATOM 1027 CG GLU A 63 11.860 -5.110 10.667 1.00 0.00 C ATOM 1028 CD GLU A 63 13.235 -4.513 10.892 1.00 0.00 C ATOM 1029 OE1 GLU A 63 13.363 -3.273 10.815 1.00 0.00 O ATOM 1030 OE2 GLU A 63 14.183 -5.285 11.146 1.00 0.00 O ATOM 0 H GLU A 63 10.194 -4.327 7.006 1.00 0.00 H new ATOM 0 HA GLU A 63 9.449 -4.251 9.867 1.00 0.00 H new ATOM 0 HB2 GLU A 63 11.134 -5.945 8.839 1.00 0.00 H new ATOM 0 HB3 GLU A 63 12.199 -4.569 8.628 1.00 0.00 H new ATOM 0 HG2 GLU A 63 11.146 -4.630 11.336 1.00 0.00 H new ATOM 0 HG3 GLU A 63 11.881 -6.168 10.929 1.00 0.00 H new ATOM 1037 N LEU A 64 10.356 -2.016 10.372 1.00 0.00 N ATOM 1038 CA LEU A 64 10.703 -0.627 10.619 1.00 0.00 C ATOM 1039 C LEU A 64 12.201 -0.415 10.436 1.00 0.00 C ATOM 1040 O LEU A 64 13.001 -0.769 11.301 1.00 0.00 O ATOM 1041 CB LEU A 64 10.274 -0.222 12.029 1.00 0.00 C ATOM 1042 CG LEU A 64 8.809 -0.511 12.382 1.00 0.00 C ATOM 1043 CD1 LEU A 64 8.432 0.191 13.678 1.00 0.00 C ATOM 1044 CD2 LEU A 64 7.878 -0.078 11.257 1.00 0.00 C ATOM 0 H LEU A 64 9.935 -2.495 11.168 1.00 0.00 H new ATOM 0 HA LEU A 64 10.176 0.000 9.900 1.00 0.00 H new ATOM 0 HB2 LEU A 64 10.911 -0.739 12.746 1.00 0.00 H new ATOM 0 HB3 LEU A 64 10.456 0.846 12.153 1.00 0.00 H new ATOM 0 HG LEU A 64 8.699 -1.587 12.517 1.00 0.00 H new ATOM 0 HD11 LEU A 64 7.390 -0.022 13.917 1.00 0.00 H new ATOM 0 HD12 LEU A 64 9.071 -0.168 14.485 1.00 0.00 H new ATOM 0 HD13 LEU A 64 8.565 1.267 13.561 1.00 0.00 H new ATOM 0 HD21 LEU A 64 6.846 -0.295 11.535 1.00 0.00 H new ATOM 0 HD22 LEU A 64 7.990 0.992 11.084 1.00 0.00 H new ATOM 0 HD23 LEU A 64 8.130 -0.621 10.346 1.00 0.00 H new ATOM 1056 N GLY A 65 12.571 0.150 9.293 1.00 0.00 N ATOM 1057 CA GLY A 65 13.971 0.385 8.997 1.00 0.00 C ATOM 1058 C GLY A 65 14.506 -0.584 7.960 1.00 0.00 C ATOM 1059 O GLY A 65 15.717 -0.720 7.790 1.00 0.00 O ATOM 0 H GLY A 65 11.924 0.450 8.564 1.00 0.00 H new ATOM 0 HA2 GLY A 65 14.099 1.406 8.638 1.00 0.00 H new ATOM 0 HA3 GLY A 65 14.555 0.294 9.913 1.00 0.00 H new ATOM 1063 N VAL A 66 13.594 -1.258 7.265 1.00 0.00 N ATOM 1064 CA VAL A 66 13.963 -2.218 6.236 1.00 0.00 C ATOM 1065 C VAL A 66 13.148 -1.990 4.974 1.00 0.00 C ATOM 1066 O VAL A 66 11.979 -1.608 5.031 1.00 0.00 O ATOM 1067 CB VAL A 66 13.771 -3.665 6.723 1.00 0.00 C ATOM 1068 CG1 VAL A 66 14.275 -4.654 5.684 1.00 0.00 C ATOM 1069 CG2 VAL A 66 14.480 -3.868 8.054 1.00 0.00 C ATOM 0 H VAL A 66 12.588 -1.154 7.399 1.00 0.00 H new ATOM 0 HA VAL A 66 15.019 -2.067 6.013 1.00 0.00 H new ATOM 0 HB VAL A 66 12.706 -3.846 6.868 1.00 0.00 H new ATOM 0 HG11 VAL A 66 14.130 -5.671 6.049 1.00 0.00 H new ATOM 0 HG12 VAL A 66 13.721 -4.519 4.755 1.00 0.00 H new ATOM 0 HG13 VAL A 66 15.336 -4.482 5.502 1.00 0.00 H new ATOM 0 HG21 VAL A 66 14.337 -4.895 8.389 1.00 0.00 H new ATOM 0 HG22 VAL A 66 15.545 -3.670 7.933 1.00 0.00 H new ATOM 0 HG23 VAL A 66 14.066 -3.184 8.795 1.00 0.00 H new ATOM 1079 N THR A 67 13.788 -2.206 3.839 1.00 0.00 N ATOM 1080 CA THR A 67 13.153 -2.009 2.548 1.00 0.00 C ATOM 1081 C THR A 67 11.890 -2.857 2.395 1.00 0.00 C ATOM 1082 O THR A 67 11.743 -3.907 3.021 1.00 0.00 O ATOM 1083 CB THR A 67 14.155 -2.327 1.436 1.00 0.00 C ATOM 1084 OG1 THR A 67 15.032 -1.233 1.230 1.00 0.00 O ATOM 1085 CG2 THR A 67 13.514 -2.654 0.100 1.00 0.00 C ATOM 0 H THR A 67 14.757 -2.521 3.785 1.00 0.00 H new ATOM 0 HA THR A 67 12.844 -0.966 2.476 1.00 0.00 H new ATOM 0 HB THR A 67 14.686 -3.213 1.783 1.00 0.00 H new ATOM 0 HG1 THR A 67 15.667 -1.453 0.517 1.00 0.00 H new ATOM 0 HG21 THR A 67 14.291 -2.867 -0.634 1.00 0.00 H new ATOM 0 HG22 THR A 67 12.869 -3.526 0.210 1.00 0.00 H new ATOM 0 HG23 THR A 67 12.921 -1.804 -0.237 1.00 0.00 H new ATOM 1093 N PHE A 68 10.993 -2.382 1.537 1.00 0.00 N ATOM 1094 CA PHE A 68 9.739 -3.063 1.249 1.00 0.00 C ATOM 1095 C PHE A 68 9.853 -3.782 -0.089 1.00 0.00 C ATOM 1096 O PHE A 68 10.698 -3.432 -0.913 1.00 0.00 O ATOM 1097 CB PHE A 68 8.594 -2.051 1.216 1.00 0.00 C ATOM 1098 CG PHE A 68 7.228 -2.629 1.477 1.00 0.00 C ATOM 1099 CD1 PHE A 68 7.059 -3.826 2.157 1.00 0.00 C ATOM 1100 CD2 PHE A 68 6.107 -1.956 1.037 1.00 0.00 C ATOM 1101 CE1 PHE A 68 5.793 -4.334 2.384 1.00 0.00 C ATOM 1102 CE2 PHE A 68 4.840 -2.455 1.258 1.00 0.00 C ATOM 1103 CZ PHE A 68 4.681 -3.648 1.932 1.00 0.00 C ATOM 0 H PHE A 68 11.117 -1.511 1.021 1.00 0.00 H new ATOM 0 HA PHE A 68 9.531 -3.795 2.030 1.00 0.00 H new ATOM 0 HB2 PHE A 68 8.792 -1.276 1.957 1.00 0.00 H new ATOM 0 HB3 PHE A 68 8.586 -1.565 0.240 1.00 0.00 H new ATOM 0 HD1 PHE A 68 7.924 -4.366 2.512 1.00 0.00 H new ATOM 0 HD2 PHE A 68 6.224 -1.021 0.510 1.00 0.00 H new ATOM 0 HE1 PHE A 68 5.673 -5.267 2.915 1.00 0.00 H new ATOM 0 HE2 PHE A 68 3.975 -1.913 0.904 1.00 0.00 H new ATOM 0 HZ PHE A 68 3.692 -4.045 2.106 1.00 0.00 H new ATOM 1113 N ASN A 69 9.019 -4.789 -0.304 1.00 0.00 N ATOM 1114 CA ASN A 69 9.067 -5.546 -1.551 1.00 0.00 C ATOM 1115 C ASN A 69 7.689 -5.685 -2.185 1.00 0.00 C ATOM 1116 O ASN A 69 6.783 -6.284 -1.606 1.00 0.00 O ATOM 1117 CB ASN A 69 9.664 -6.932 -1.302 1.00 0.00 C ATOM 1118 CG ASN A 69 11.177 -6.935 -1.396 1.00 0.00 C ATOM 1119 OD1 ASN A 69 11.754 -7.544 -2.297 1.00 0.00 O ATOM 1120 ND2 ASN A 69 11.829 -6.253 -0.461 1.00 0.00 N ATOM 0 H ASN A 69 8.308 -5.100 0.358 1.00 0.00 H new ATOM 0 HA ASN A 69 9.699 -4.993 -2.245 1.00 0.00 H new ATOM 0 HB2 ASN A 69 9.363 -7.282 -0.314 1.00 0.00 H new ATOM 0 HB3 ASN A 69 9.256 -7.636 -2.027 1.00 0.00 H new ATOM 0 HD21 ASN A 69 12.848 -6.220 -0.472 1.00 0.00 H new ATOM 0 HD22 ASN A 69 11.310 -5.763 0.268 1.00 0.00 H new ATOM 1127 N TYR A 70 7.546 -5.142 -3.390 1.00 0.00 N ATOM 1128 CA TYR A 70 6.286 -5.220 -4.118 1.00 0.00 C ATOM 1129 C TYR A 70 6.545 -5.495 -5.597 1.00 0.00 C ATOM 1130 O TYR A 70 6.001 -4.825 -6.474 1.00 0.00 O ATOM 1131 CB TYR A 70 5.483 -3.928 -3.941 1.00 0.00 C ATOM 1132 CG TYR A 70 4.244 -4.107 -3.093 1.00 0.00 C ATOM 1133 CD1 TYR A 70 3.338 -5.126 -3.361 1.00 0.00 C ATOM 1134 CD2 TYR A 70 3.980 -3.259 -2.025 1.00 0.00 C ATOM 1135 CE1 TYR A 70 2.205 -5.295 -2.588 1.00 0.00 C ATOM 1136 CE2 TYR A 70 2.849 -3.422 -1.247 1.00 0.00 C ATOM 1137 CZ TYR A 70 1.965 -4.441 -1.533 1.00 0.00 C ATOM 1138 OH TYR A 70 0.838 -4.606 -0.761 1.00 0.00 O ATOM 0 H TYR A 70 8.287 -4.644 -3.882 1.00 0.00 H new ATOM 0 HA TYR A 70 5.700 -6.044 -3.711 1.00 0.00 H new ATOM 0 HB2 TYR A 70 6.121 -3.171 -3.485 1.00 0.00 H new ATOM 0 HB3 TYR A 70 5.193 -3.551 -4.922 1.00 0.00 H new ATOM 0 HD1 TYR A 70 3.522 -5.797 -4.187 1.00 0.00 H new ATOM 0 HD2 TYR A 70 4.670 -2.459 -1.799 1.00 0.00 H new ATOM 0 HE1 TYR A 70 1.511 -6.092 -2.809 1.00 0.00 H new ATOM 0 HE2 TYR A 70 2.659 -2.755 -0.419 1.00 0.00 H new ATOM 0 HH TYR A 70 0.056 -4.714 -1.342 1.00 0.00 H new ATOM 1224 N GLU A 77 7.165 -3.268 -10.301 1.00 0.00 N ATOM 1225 CA GLU A 77 8.015 -3.597 -9.163 1.00 0.00 C ATOM 1226 C GLU A 77 8.528 -2.324 -8.498 1.00 0.00 C ATOM 1227 O GLU A 77 9.221 -1.523 -9.125 1.00 0.00 O ATOM 1228 CB GLU A 77 9.192 -4.467 -9.612 1.00 0.00 C ATOM 1229 CG GLU A 77 10.183 -4.778 -8.501 1.00 0.00 C ATOM 1230 CD GLU A 77 11.101 -5.935 -8.844 1.00 0.00 C ATOM 1231 OE1 GLU A 77 11.151 -6.323 -10.030 1.00 0.00 O ATOM 1232 OE2 GLU A 77 11.771 -6.453 -7.926 1.00 0.00 O ATOM 0 HA GLU A 77 7.422 -4.156 -8.439 1.00 0.00 H new ATOM 0 HB2 GLU A 77 8.807 -5.403 -10.015 1.00 0.00 H new ATOM 0 HB3 GLU A 77 9.716 -3.962 -10.423 1.00 0.00 H new ATOM 0 HG2 GLU A 77 10.783 -3.891 -8.296 1.00 0.00 H new ATOM 0 HG3 GLU A 77 9.637 -5.011 -7.587 1.00 0.00 H new ATOM 1239 N LEU A 78 8.179 -2.138 -7.228 1.00 0.00 N ATOM 1240 CA LEU A 78 8.604 -0.953 -6.493 1.00 0.00 C ATOM 1241 C LEU A 78 9.434 -1.325 -5.265 1.00 0.00 C ATOM 1242 O LEU A 78 9.104 -2.260 -4.530 1.00 0.00 O ATOM 1243 CB LEU A 78 7.387 -0.118 -6.085 1.00 0.00 C ATOM 1244 CG LEU A 78 7.039 1.024 -7.049 1.00 0.00 C ATOM 1245 CD1 LEU A 78 5.715 0.764 -7.747 1.00 0.00 C ATOM 1246 CD2 LEU A 78 6.983 2.354 -6.326 1.00 0.00 C ATOM 0 H LEU A 78 7.607 -2.789 -6.690 1.00 0.00 H new ATOM 0 HA LEU A 78 9.236 -0.358 -7.152 1.00 0.00 H new ATOM 0 HB2 LEU A 78 6.524 -0.778 -5.998 1.00 0.00 H new ATOM 0 HB3 LEU A 78 7.567 0.302 -5.096 1.00 0.00 H new ATOM 0 HG LEU A 78 7.830 1.067 -7.798 1.00 0.00 H new ATOM 0 HD11 LEU A 78 5.493 1.589 -8.424 1.00 0.00 H new ATOM 0 HD12 LEU A 78 5.779 -0.164 -8.315 1.00 0.00 H new ATOM 0 HD13 LEU A 78 4.922 0.681 -7.004 1.00 0.00 H new ATOM 0 HD21 LEU A 78 6.734 3.143 -7.035 1.00 0.00 H new ATOM 0 HD22 LEU A 78 6.222 2.313 -5.547 1.00 0.00 H new ATOM 0 HD23 LEU A 78 7.953 2.564 -5.875 1.00 0.00 H new ATOM 1258 N ARG A 79 10.514 -0.576 -5.059 1.00 0.00 N ATOM 1259 CA ARG A 79 11.417 -0.790 -3.932 1.00 0.00 C ATOM 1260 C ARG A 79 11.306 0.362 -2.947 1.00 0.00 C ATOM 1261 O ARG A 79 11.486 1.517 -3.324 1.00 0.00 O ATOM 1262 CB ARG A 79 12.854 -0.885 -4.433 1.00 0.00 C ATOM 1263 CG ARG A 79 13.794 -1.589 -3.469 1.00 0.00 C ATOM 1264 CD ARG A 79 14.998 -2.173 -4.190 1.00 0.00 C ATOM 1265 NE ARG A 79 15.990 -1.150 -4.514 1.00 0.00 N ATOM 1266 CZ ARG A 79 16.851 -0.646 -3.633 1.00 0.00 C ATOM 1267 NH1 ARG A 79 16.844 -1.067 -2.374 1.00 0.00 N ATOM 1268 NH2 ARG A 79 17.720 0.280 -4.011 1.00 0.00 N ATOM 0 H ARG A 79 10.787 0.195 -5.668 1.00 0.00 H new ATOM 0 HA ARG A 79 11.140 -1.719 -3.433 1.00 0.00 H new ATOM 0 HB2 ARG A 79 12.863 -1.414 -5.386 1.00 0.00 H new ATOM 0 HB3 ARG A 79 13.230 0.120 -4.623 1.00 0.00 H new ATOM 0 HG2 ARG A 79 14.131 -0.885 -2.708 1.00 0.00 H new ATOM 0 HG3 ARG A 79 13.257 -2.384 -2.952 1.00 0.00 H new ATOM 0 HD2 ARG A 79 15.458 -2.939 -3.566 1.00 0.00 H new ATOM 0 HD3 ARG A 79 14.669 -2.663 -5.107 1.00 0.00 H new ATOM 0 HE ARG A 79 16.025 -0.802 -5.472 1.00 0.00 H new ATOM 0 HH11 ARG A 79 16.177 -1.780 -2.078 1.00 0.00 H new ATOM 0 HH12 ARG A 79 17.506 -0.678 -1.702 1.00 0.00 H new ATOM 0 HH21 ARG A 79 17.729 0.607 -4.977 1.00 0.00 H new ATOM 0 HH22 ARG A 79 18.380 0.666 -3.336 1.00 0.00 H new ATOM 1282 N GLY A 80 11.003 0.065 -1.691 1.00 0.00 N ATOM 1283 CA GLY A 80 10.869 1.132 -0.725 1.00 0.00 C ATOM 1284 C GLY A 80 11.283 0.763 0.678 1.00 0.00 C ATOM 1285 O GLY A 80 12.059 -0.163 0.883 1.00 0.00 O ATOM 0 H GLY A 80 10.850 -0.877 -1.330 1.00 0.00 H new ATOM 0 HA2 GLY A 80 11.468 1.981 -1.055 1.00 0.00 H new ATOM 0 HA3 GLY A 80 9.830 1.462 -0.709 1.00 0.00 H new ATOM 1289 N THR A 81 10.749 1.507 1.643 1.00 0.00 N ATOM 1290 CA THR A 81 11.036 1.287 3.055 1.00 0.00 C ATOM 1291 C THR A 81 9.851 1.738 3.901 1.00 0.00 C ATOM 1292 O THR A 81 9.248 2.775 3.631 1.00 0.00 O ATOM 1293 CB THR A 81 12.293 2.050 3.475 1.00 0.00 C ATOM 1294 OG1 THR A 81 12.354 3.310 2.831 1.00 0.00 O ATOM 1295 CG2 THR A 81 13.575 1.312 3.164 1.00 0.00 C ATOM 0 H THR A 81 10.106 2.279 1.467 1.00 0.00 H new ATOM 0 HA THR A 81 11.208 0.222 3.212 1.00 0.00 H new ATOM 0 HB THR A 81 12.213 2.163 4.556 1.00 0.00 H new ATOM 0 HG1 THR A 81 13.164 3.783 3.114 1.00 0.00 H new ATOM 0 HG21 THR A 81 14.427 1.910 3.488 1.00 0.00 H new ATOM 0 HG22 THR A 81 13.581 0.357 3.689 1.00 0.00 H new ATOM 0 HG23 THR A 81 13.642 1.136 2.090 1.00 0.00 H new ATOM 1303 N TRP A 82 9.521 0.956 4.921 1.00 0.00 N ATOM 1304 CA TRP A 82 8.403 1.276 5.805 1.00 0.00 C ATOM 1305 C TRP A 82 8.913 1.654 7.192 1.00 0.00 C ATOM 1306 O TRP A 82 9.876 1.069 7.689 1.00 0.00 O ATOM 1307 CB TRP A 82 7.465 0.069 5.911 1.00 0.00 C ATOM 1308 CG TRP A 82 6.056 0.361 5.500 1.00 0.00 C ATOM 1309 CD1 TRP A 82 5.649 1.049 4.395 1.00 0.00 C ATOM 1310 CD2 TRP A 82 4.865 -0.033 6.190 1.00 0.00 C ATOM 1311 NE1 TRP A 82 4.277 1.111 4.356 1.00 0.00 N ATOM 1312 CE2 TRP A 82 3.773 0.453 5.448 1.00 0.00 C ATOM 1313 CE3 TRP A 82 4.617 -0.750 7.365 1.00 0.00 C ATOM 1314 CZ2 TRP A 82 2.453 0.244 5.841 1.00 0.00 C ATOM 1315 CZ3 TRP A 82 3.307 -0.957 7.754 1.00 0.00 C ATOM 1316 CH2 TRP A 82 2.240 -0.461 6.994 1.00 0.00 C ATOM 0 H TRP A 82 10.011 0.094 5.158 1.00 0.00 H new ATOM 0 HA TRP A 82 7.859 2.123 5.388 1.00 0.00 H new ATOM 0 HB2 TRP A 82 7.855 -0.738 5.290 1.00 0.00 H new ATOM 0 HB3 TRP A 82 7.466 -0.291 6.940 1.00 0.00 H new ATOM 0 HD1 TRP A 82 6.309 1.482 3.658 1.00 0.00 H new ATOM 0 HE1 TRP A 82 3.724 1.571 3.633 1.00 0.00 H new ATOM 0 HE3 TRP A 82 5.434 -1.135 7.957 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 1.628 0.625 5.257 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 3.103 -1.510 8.659 1.00 0.00 H new ATOM 0 HH2 TRP A 82 1.228 -0.639 7.325 1.00 0.00 H new ATOM 1327 N SER A 83 8.264 2.630 7.811 1.00 0.00 N ATOM 1328 CA SER A 83 8.652 3.081 9.139 1.00 0.00 C ATOM 1329 C SER A 83 7.461 3.686 9.869 1.00 0.00 C ATOM 1330 O SER A 83 6.612 4.335 9.260 1.00 0.00 O ATOM 1331 CB SER A 83 9.782 4.108 9.045 1.00 0.00 C ATOM 1332 OG SER A 83 11.021 3.541 9.432 1.00 0.00 O ATOM 0 H SER A 83 7.465 3.125 7.414 1.00 0.00 H new ATOM 0 HA SER A 83 9.005 2.217 9.702 1.00 0.00 H new ATOM 0 HB2 SER A 83 9.853 4.482 8.024 1.00 0.00 H new ATOM 0 HB3 SER A 83 9.555 4.962 9.683 1.00 0.00 H new ATOM 0 HG SER A 83 11.727 4.217 9.361 1.00 0.00 H new ATOM 1338 N LEU A 84 7.406 3.475 11.178 1.00 0.00 N ATOM 1339 CA LEU A 84 6.319 4.010 11.983 1.00 0.00 C ATOM 1340 C LEU A 84 6.822 5.115 12.898 1.00 0.00 C ATOM 1341 O LEU A 84 7.784 4.934 13.643 1.00 0.00 O ATOM 1342 CB LEU A 84 5.665 2.907 12.812 1.00 0.00 C ATOM 1343 CG LEU A 84 4.170 2.714 12.560 1.00 0.00 C ATOM 1344 CD1 LEU A 84 3.829 1.236 12.476 1.00 0.00 C ATOM 1345 CD2 LEU A 84 3.353 3.391 13.651 1.00 0.00 C ATOM 0 H LEU A 84 8.099 2.940 11.702 1.00 0.00 H new ATOM 0 HA LEU A 84 5.574 4.427 11.305 1.00 0.00 H new ATOM 0 HB2 LEU A 84 6.177 1.967 12.608 1.00 0.00 H new ATOM 0 HB3 LEU A 84 5.815 3.129 13.869 1.00 0.00 H new ATOM 0 HG LEU A 84 3.920 3.178 11.606 1.00 0.00 H new ATOM 0 HD11 LEU A 84 2.760 1.119 12.296 1.00 0.00 H new ATOM 0 HD12 LEU A 84 4.387 0.780 11.658 1.00 0.00 H new ATOM 0 HD13 LEU A 84 4.095 0.747 13.413 1.00 0.00 H new ATOM 0 HD21 LEU A 84 2.291 3.243 13.455 1.00 0.00 H new ATOM 0 HD22 LEU A 84 3.607 2.957 14.618 1.00 0.00 H new ATOM 0 HD23 LEU A 84 3.575 4.458 13.662 1.00 0.00 H new ATOM 1357 N GLU A 85 6.157 6.257 12.836 1.00 0.00 N ATOM 1358 CA GLU A 85 6.524 7.398 13.659 1.00 0.00 C ATOM 1359 C GLU A 85 5.423 7.695 14.669 1.00 0.00 C ATOM 1360 O GLU A 85 4.461 8.400 14.364 1.00 0.00 O ATOM 1361 CB GLU A 85 6.778 8.625 12.780 1.00 0.00 C ATOM 1362 CG GLU A 85 8.201 8.711 12.251 1.00 0.00 C ATOM 1363 CD GLU A 85 8.773 10.112 12.341 1.00 0.00 C ATOM 1364 OE1 GLU A 85 9.376 10.440 13.384 1.00 0.00 O ATOM 1365 OE2 GLU A 85 8.618 10.880 11.369 1.00 0.00 O ATOM 0 H GLU A 85 5.358 6.419 12.223 1.00 0.00 H new ATOM 0 HA GLU A 85 7.440 7.158 14.199 1.00 0.00 H new ATOM 0 HB2 GLU A 85 6.087 8.607 11.938 1.00 0.00 H new ATOM 0 HB3 GLU A 85 6.558 9.525 13.354 1.00 0.00 H new ATOM 0 HG2 GLU A 85 8.836 8.027 12.814 1.00 0.00 H new ATOM 0 HG3 GLU A 85 8.219 8.381 11.212 1.00 0.00 H new ATOM 1372 N GLY A 86 5.563 7.142 15.868 1.00 0.00 N ATOM 1373 CA GLY A 86 4.562 7.351 16.896 1.00 0.00 C ATOM 1374 C GLY A 86 3.261 6.655 16.568 1.00 0.00 C ATOM 1375 O GLY A 86 3.136 5.442 16.739 1.00 0.00 O ATOM 0 H GLY A 86 6.349 6.555 16.146 1.00 0.00 H new ATOM 0 HA2 GLY A 86 4.940 6.983 17.850 1.00 0.00 H new ATOM 0 HA3 GLY A 86 4.382 8.419 17.015 1.00 0.00 H new ATOM 1379 N ASN A 87 2.292 7.422 16.091 1.00 0.00 N ATOM 1380 CA ASN A 87 0.992 6.873 15.732 1.00 0.00 C ATOM 1381 C ASN A 87 0.736 7.002 14.231 1.00 0.00 C ATOM 1382 O ASN A 87 -0.411 6.979 13.787 1.00 0.00 O ATOM 1383 CB ASN A 87 -0.117 7.582 16.512 1.00 0.00 C ATOM 1384 CG ASN A 87 0.147 7.600 18.005 1.00 0.00 C ATOM 1385 OD1 ASN A 87 0.060 6.571 18.675 1.00 0.00 O ATOM 1386 ND2 ASN A 87 0.473 8.774 18.533 1.00 0.00 N ATOM 0 H ASN A 87 2.381 8.427 15.943 1.00 0.00 H new ATOM 0 HA ASN A 87 0.992 5.814 15.991 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -0.214 8.606 16.151 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -1.068 7.085 16.320 1.00 0.00 H new ATOM 0 HD21 ASN A 87 0.663 8.849 19.532 1.00 0.00 H new ATOM 0 HD22 ASN A 87 0.533 9.601 17.939 1.00 0.00 H new ATOM 1393 N LYS A 88 1.808 7.146 13.453 1.00 0.00 N ATOM 1394 CA LYS A 88 1.684 7.288 12.006 1.00 0.00 C ATOM 1395 C LYS A 88 2.517 6.243 11.265 1.00 0.00 C ATOM 1396 O LYS A 88 3.583 5.838 11.727 1.00 0.00 O ATOM 1397 CB LYS A 88 2.110 8.692 11.575 1.00 0.00 C ATOM 1398 CG LYS A 88 1.279 9.799 12.204 1.00 0.00 C ATOM 1399 CD LYS A 88 2.131 11.009 12.551 1.00 0.00 C ATOM 1400 CE LYS A 88 3.129 10.691 13.653 1.00 0.00 C ATOM 1401 NZ LYS A 88 3.337 11.849 14.565 1.00 0.00 N ATOM 0 H LYS A 88 2.767 7.167 13.800 1.00 0.00 H new ATOM 0 HA LYS A 88 0.637 7.130 11.747 1.00 0.00 H new ATOM 0 HB2 LYS A 88 3.157 8.842 11.837 1.00 0.00 H new ATOM 0 HB3 LYS A 88 2.039 8.767 10.490 1.00 0.00 H new ATOM 0 HG2 LYS A 88 0.487 10.096 11.516 1.00 0.00 H new ATOM 0 HG3 LYS A 88 0.794 9.424 13.105 1.00 0.00 H new ATOM 0 HD2 LYS A 88 2.664 11.347 11.662 1.00 0.00 H new ATOM 0 HD3 LYS A 88 1.487 11.830 12.868 1.00 0.00 H new ATOM 0 HE2 LYS A 88 2.775 9.835 14.228 1.00 0.00 H new ATOM 0 HE3 LYS A 88 4.082 10.404 13.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 4.024 11.591 15.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 3.699 12.658 14.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 2.433 12.108 15.010 1.00 0.00 H new ATOM 1415 N LEU A 89 2.016 5.821 10.107 1.00 0.00 N ATOM 1416 CA LEU A 89 2.698 4.830 9.278 1.00 0.00 C ATOM 1417 C LEU A 89 3.289 5.490 8.038 1.00 0.00 C ATOM 1418 O LEU A 89 2.586 6.193 7.312 1.00 0.00 O ATOM 1419 CB LEU A 89 1.710 3.743 8.846 1.00 0.00 C ATOM 1420 CG LEU A 89 1.502 2.602 9.839 1.00 0.00 C ATOM 1421 CD1 LEU A 89 2.655 1.616 9.765 1.00 0.00 C ATOM 1422 CD2 LEU A 89 1.335 3.141 11.252 1.00 0.00 C ATOM 0 H LEU A 89 1.133 6.153 9.719 1.00 0.00 H new ATOM 0 HA LEU A 89 3.502 4.385 9.864 1.00 0.00 H new ATOM 0 HB2 LEU A 89 0.745 4.212 8.652 1.00 0.00 H new ATOM 0 HB3 LEU A 89 2.054 3.320 7.902 1.00 0.00 H new ATOM 0 HG LEU A 89 0.586 2.075 9.571 1.00 0.00 H new ATOM 0 HD11 LEU A 89 2.490 0.809 10.479 1.00 0.00 H new ATOM 0 HD12 LEU A 89 2.716 1.202 8.758 1.00 0.00 H new ATOM 0 HD13 LEU A 89 3.587 2.128 10.004 1.00 0.00 H new ATOM 0 HD21 LEU A 89 1.188 2.311 11.943 1.00 0.00 H new ATOM 0 HD22 LEU A 89 2.228 3.697 11.537 1.00 0.00 H new ATOM 0 HD23 LEU A 89 0.469 3.802 11.289 1.00 0.00 H new ATOM 1434 N ILE A 90 4.576 5.270 7.792 1.00 0.00 N ATOM 1435 CA ILE A 90 5.223 5.862 6.627 1.00 0.00 C ATOM 1436 C ILE A 90 5.988 4.834 5.800 1.00 0.00 C ATOM 1437 O ILE A 90 6.704 3.988 6.331 1.00 0.00 O ATOM 1438 CB ILE A 90 6.190 7.009 6.998 1.00 0.00 C ATOM 1439 CG1 ILE A 90 6.058 7.396 8.475 1.00 0.00 C ATOM 1440 CG2 ILE A 90 5.933 8.212 6.098 1.00 0.00 C ATOM 1441 CD1 ILE A 90 4.720 8.004 8.832 1.00 0.00 C ATOM 0 H ILE A 90 5.184 4.695 8.374 1.00 0.00 H new ATOM 0 HA ILE A 90 4.404 6.267 6.032 1.00 0.00 H new ATOM 0 HB ILE A 90 7.211 6.661 6.843 1.00 0.00 H new ATOM 0 HG12 ILE A 90 6.218 6.509 9.088 1.00 0.00 H new ATOM 0 HG13 ILE A 90 6.847 8.105 8.727 1.00 0.00 H new ATOM 0 HG21 ILE A 90 6.617 9.018 6.364 1.00 0.00 H new ATOM 0 HG22 ILE A 90 6.092 7.929 5.058 1.00 0.00 H new ATOM 0 HG23 ILE A 90 4.905 8.551 6.228 1.00 0.00 H new ATOM 0 HD11 ILE A 90 4.704 8.251 9.894 1.00 0.00 H new ATOM 0 HD12 ILE A 90 4.564 8.910 8.246 1.00 0.00 H new ATOM 0 HD13 ILE A 90 3.926 7.290 8.614 1.00 0.00 H new ATOM 1453 N GLY A 91 5.839 4.949 4.490 1.00 0.00 N ATOM 1454 CA GLY A 91 6.515 4.076 3.557 1.00 0.00 C ATOM 1455 C GLY A 91 6.950 4.851 2.329 1.00 0.00 C ATOM 1456 O GLY A 91 6.343 5.866 1.999 1.00 0.00 O ATOM 0 H GLY A 91 5.245 5.651 4.048 1.00 0.00 H new ATOM 0 HA2 GLY A 91 7.383 3.624 4.036 1.00 0.00 H new ATOM 0 HA3 GLY A 91 5.852 3.262 3.265 1.00 0.00 H new ATOM 1460 N LYS A 92 8.001 4.401 1.659 1.00 0.00 N ATOM 1461 CA LYS A 92 8.488 5.100 0.478 1.00 0.00 C ATOM 1462 C LYS A 92 9.062 4.122 -0.540 1.00 0.00 C ATOM 1463 O LYS A 92 10.041 3.445 -0.256 1.00 0.00 O ATOM 1464 CB LYS A 92 9.560 6.114 0.879 1.00 0.00 C ATOM 1465 CG LYS A 92 9.011 7.336 1.603 1.00 0.00 C ATOM 1466 CD LYS A 92 9.527 7.427 3.033 1.00 0.00 C ATOM 1467 CE LYS A 92 9.166 6.191 3.842 1.00 0.00 C ATOM 1468 NZ LYS A 92 9.908 6.137 5.132 1.00 0.00 N ATOM 0 H LYS A 92 8.528 3.564 1.909 1.00 0.00 H new ATOM 0 HA LYS A 92 7.647 5.619 0.019 1.00 0.00 H new ATOM 0 HB2 LYS A 92 10.291 5.621 1.520 1.00 0.00 H new ATOM 0 HB3 LYS A 92 10.090 6.441 -0.016 1.00 0.00 H new ATOM 0 HG2 LYS A 92 9.291 8.237 1.058 1.00 0.00 H new ATOM 0 HG3 LYS A 92 7.922 7.294 1.612 1.00 0.00 H new ATOM 0 HD2 LYS A 92 10.610 7.551 3.022 1.00 0.00 H new ATOM 0 HD3 LYS A 92 9.110 8.311 3.515 1.00 0.00 H new ATOM 0 HE2 LYS A 92 8.094 6.186 4.039 1.00 0.00 H new ATOM 0 HE3 LYS A 92 9.387 5.297 3.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 9.634 5.280 5.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 10.931 6.116 4.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 9.678 6.977 5.700 1.00 0.00 H new ATOM 1482 N PHE A 93 8.451 4.058 -1.727 1.00 0.00 N ATOM 1483 CA PHE A 93 8.913 3.151 -2.780 1.00 0.00 C ATOM 1484 C PHE A 93 9.725 3.872 -3.848 1.00 0.00 C ATOM 1485 O PHE A 93 9.815 5.099 -3.871 1.00 0.00 O ATOM 1486 CB PHE A 93 7.749 2.468 -3.498 1.00 0.00 C ATOM 1487 CG PHE A 93 6.898 1.563 -2.660 1.00 0.00 C ATOM 1488 CD1 PHE A 93 5.812 2.052 -1.945 1.00 0.00 C ATOM 1489 CD2 PHE A 93 7.164 0.205 -2.623 1.00 0.00 C ATOM 1490 CE1 PHE A 93 5.020 1.203 -1.205 1.00 0.00 C ATOM 1491 CE2 PHE A 93 6.367 -0.648 -1.888 1.00 0.00 C ATOM 1492 CZ PHE A 93 5.294 -0.146 -1.178 1.00 0.00 C ATOM 0 H PHE A 93 7.639 4.621 -1.981 1.00 0.00 H new ATOM 0 HA PHE A 93 9.532 2.416 -2.266 1.00 0.00 H new ATOM 0 HB2 PHE A 93 7.110 3.240 -3.927 1.00 0.00 H new ATOM 0 HB3 PHE A 93 8.151 1.889 -4.329 1.00 0.00 H new ATOM 0 HD1 PHE A 93 5.587 3.108 -1.970 1.00 0.00 H new ATOM 0 HD2 PHE A 93 8.004 -0.191 -3.175 1.00 0.00 H new ATOM 0 HE1 PHE A 93 4.184 1.595 -0.646 1.00 0.00 H new ATOM 0 HE2 PHE A 93 6.582 -1.706 -1.868 1.00 0.00 H new ATOM 0 HZ PHE A 93 4.669 -0.812 -0.601 1.00 0.00 H new ATOM 1502 N LYS A 94 10.292 3.075 -4.750 1.00 0.00 N ATOM 1503 CA LYS A 94 11.077 3.588 -5.862 1.00 0.00 C ATOM 1504 C LYS A 94 11.136 2.562 -6.987 1.00 0.00 C ATOM 1505 O LYS A 94 11.420 1.388 -6.750 1.00 0.00 O ATOM 1506 CB LYS A 94 12.490 3.961 -5.417 1.00 0.00 C ATOM 1507 CG LYS A 94 12.653 5.440 -5.138 1.00 0.00 C ATOM 1508 CD LYS A 94 14.060 5.894 -5.442 1.00 0.00 C ATOM 1509 CE LYS A 94 14.070 7.172 -6.244 1.00 0.00 C ATOM 1510 NZ LYS A 94 15.452 7.666 -6.493 1.00 0.00 N ATOM 0 H LYS A 94 10.219 2.058 -4.728 1.00 0.00 H new ATOM 0 HA LYS A 94 10.588 4.490 -6.228 1.00 0.00 H new ATOM 0 HB2 LYS A 94 12.742 3.398 -4.519 1.00 0.00 H new ATOM 0 HB3 LYS A 94 13.199 3.663 -6.190 1.00 0.00 H new ATOM 0 HG2 LYS A 94 11.945 6.008 -5.741 1.00 0.00 H new ATOM 0 HG3 LYS A 94 12.418 5.645 -4.094 1.00 0.00 H new ATOM 0 HD2 LYS A 94 14.604 6.045 -4.509 1.00 0.00 H new ATOM 0 HD3 LYS A 94 14.584 5.113 -5.994 1.00 0.00 H new ATOM 0 HE2 LYS A 94 13.568 7.005 -7.197 1.00 0.00 H new ATOM 0 HE3 LYS A 94 13.502 7.937 -5.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 15.588 8.576 -6.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 16.139 6.975 -6.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 15.596 7.793 -7.515 1.00 0.00 H new ATOM 1524 N ARG A 95 10.867 3.004 -8.211 1.00 0.00 N ATOM 1525 CA ARG A 95 10.894 2.105 -9.357 1.00 0.00 C ATOM 1526 C ARG A 95 12.319 1.746 -9.733 1.00 0.00 C ATOM 1527 O ARG A 95 13.222 2.584 -9.686 1.00 0.00 O ATOM 1528 CB ARG A 95 10.191 2.725 -10.566 1.00 0.00 C ATOM 1529 CG ARG A 95 8.859 2.066 -10.894 1.00 0.00 C ATOM 1530 CD ARG A 95 8.144 2.755 -12.050 1.00 0.00 C ATOM 1531 NE ARG A 95 9.074 3.341 -13.016 1.00 0.00 N ATOM 1532 CZ ARG A 95 8.787 4.391 -13.784 1.00 0.00 C ATOM 1533 NH1 ARG A 95 7.594 4.968 -13.716 1.00 0.00 N ATOM 1534 NH2 ARG A 95 9.695 4.862 -14.627 1.00 0.00 N ATOM 0 H ARG A 95 10.630 3.971 -8.433 1.00 0.00 H new ATOM 0 HA ARG A 95 10.362 1.199 -9.067 1.00 0.00 H new ATOM 0 HB2 ARG A 95 10.026 3.786 -10.377 1.00 0.00 H new ATOM 0 HB3 ARG A 95 10.847 2.654 -11.434 1.00 0.00 H new ATOM 0 HG2 ARG A 95 9.026 1.019 -11.145 1.00 0.00 H new ATOM 0 HG3 ARG A 95 8.220 2.084 -10.011 1.00 0.00 H new ATOM 0 HD2 ARG A 95 7.504 2.034 -12.558 1.00 0.00 H new ATOM 0 HD3 ARG A 95 7.494 3.536 -11.657 1.00 0.00 H new ATOM 0 HE ARG A 95 9.998 2.920 -13.107 1.00 0.00 H new ATOM 0 HH11 ARG A 95 6.889 4.608 -13.072 1.00 0.00 H new ATOM 0 HH12 ARG A 95 7.382 5.772 -14.307 1.00 0.00 H new ATOM 0 HH21 ARG A 95 10.613 4.421 -14.687 1.00 0.00 H new ATOM 0 HH22 ARG A 95 9.476 5.666 -15.215 1.00 0.00 H new ATOM 1548 N THR A 96 12.500 0.494 -10.118 1.00 0.00 N ATOM 1549 CA THR A 96 13.800 -0.010 -10.525 1.00 0.00 C ATOM 1550 C THR A 96 14.182 0.539 -11.901 1.00 0.00 C ATOM 1551 O THR A 96 15.347 0.497 -12.296 1.00 0.00 O ATOM 1552 CB THR A 96 13.761 -1.539 -10.535 1.00 0.00 C ATOM 1553 OG1 THR A 96 14.278 -2.058 -9.323 1.00 0.00 O ATOM 1554 CG2 THR A 96 14.533 -2.180 -11.672 1.00 0.00 C ATOM 0 H THR A 96 11.753 -0.199 -10.157 1.00 0.00 H new ATOM 0 HA THR A 96 14.559 0.322 -9.817 1.00 0.00 H new ATOM 0 HB THR A 96 12.707 -1.785 -10.667 1.00 0.00 H new ATOM 0 HG1 THR A 96 14.244 -3.037 -9.346 1.00 0.00 H new ATOM 0 HG21 THR A 96 14.451 -3.265 -11.601 1.00 0.00 H new ATOM 0 HG22 THR A 96 14.122 -1.846 -12.625 1.00 0.00 H new ATOM 0 HG23 THR A 96 15.582 -1.890 -11.608 1.00 0.00 H new ATOM 1562 N ASP A 97 13.188 1.052 -12.625 1.00 0.00 N ATOM 1563 CA ASP A 97 13.409 1.609 -13.956 1.00 0.00 C ATOM 1564 C ASP A 97 14.602 2.563 -13.965 1.00 0.00 C ATOM 1565 O ASP A 97 15.558 2.366 -14.715 1.00 0.00 O ATOM 1566 CB ASP A 97 12.146 2.333 -14.435 1.00 0.00 C ATOM 1567 CG ASP A 97 12.341 3.029 -15.769 1.00 0.00 C ATOM 1568 OD1 ASP A 97 12.755 4.208 -15.768 1.00 0.00 O ATOM 1569 OD2 ASP A 97 12.081 2.396 -16.813 1.00 0.00 O ATOM 0 H ASP A 97 12.219 1.093 -12.309 1.00 0.00 H new ATOM 0 HA ASP A 97 13.632 0.788 -14.637 1.00 0.00 H new ATOM 0 HB2 ASP A 97 11.331 1.615 -14.520 1.00 0.00 H new ATOM 0 HB3 ASP A 97 11.847 3.067 -13.687 1.00 0.00 H new ATOM 1574 N ASN A 98 14.541 3.597 -13.132 1.00 0.00 N ATOM 1575 CA ASN A 98 15.622 4.574 -13.056 1.00 0.00 C ATOM 1576 C ASN A 98 15.644 5.277 -11.702 1.00 0.00 C ATOM 1577 O ASN A 98 16.142 6.397 -11.584 1.00 0.00 O ATOM 1578 CB ASN A 98 15.481 5.607 -14.175 1.00 0.00 C ATOM 1579 CG ASN A 98 16.210 5.194 -15.439 1.00 0.00 C ATOM 1580 OD1 ASN A 98 15.719 4.371 -16.212 1.00 0.00 O ATOM 1581 ND2 ASN A 98 17.389 5.765 -15.656 1.00 0.00 N ATOM 0 H ASN A 98 13.759 3.780 -12.503 1.00 0.00 H new ATOM 0 HA ASN A 98 16.563 4.038 -13.175 1.00 0.00 H new ATOM 0 HB2 ASN A 98 14.424 5.753 -14.400 1.00 0.00 H new ATOM 0 HB3 ASN A 98 15.870 6.566 -13.832 1.00 0.00 H new ATOM 0 HD21 ASN A 98 17.925 5.526 -16.490 1.00 0.00 H new ATOM 0 HD22 ASN A 98 17.758 6.442 -14.989 1.00 0.00 H new ATOM 1588 N GLY A 99 15.100 4.619 -10.683 1.00 0.00 N ATOM 1589 CA GLY A 99 15.069 5.204 -9.360 1.00 0.00 C ATOM 1590 C GLY A 99 14.085 6.348 -9.266 1.00 0.00 C ATOM 1591 O GLY A 99 14.460 7.515 -9.375 1.00 0.00 O ATOM 0 H GLY A 99 14.681 3.692 -10.752 1.00 0.00 H new ATOM 0 HA2 GLY A 99 14.804 4.438 -8.632 1.00 0.00 H new ATOM 0 HA3 GLY A 99 16.065 5.561 -9.099 1.00 0.00 H new ATOM 1595 N ASN A 100 12.822 6.004 -9.058 1.00 0.00 N ATOM 1596 CA ASN A 100 11.759 6.995 -8.938 1.00 0.00 C ATOM 1597 C ASN A 100 11.202 7.002 -7.521 1.00 0.00 C ATOM 1598 O ASN A 100 10.548 6.056 -7.098 1.00 0.00 O ATOM 1599 CB ASN A 100 10.657 6.664 -9.910 1.00 0.00 C ATOM 1600 CG ASN A 100 11.098 6.768 -11.357 1.00 0.00 C ATOM 1601 OD1 ASN A 100 10.978 5.814 -12.125 1.00 0.00 O ATOM 1602 ND2 ASN A 100 11.612 7.933 -11.736 1.00 0.00 N ATOM 0 H ASN A 100 12.506 5.038 -8.968 1.00 0.00 H new ATOM 0 HA ASN A 100 12.165 7.981 -9.162 1.00 0.00 H new ATOM 0 HB2 ASN A 100 10.299 5.653 -9.716 1.00 0.00 H new ATOM 0 HB3 ASN A 100 9.816 7.337 -9.742 1.00 0.00 H new ATOM 0 HD21 ASN A 100 11.926 8.063 -12.698 1.00 0.00 H new ATOM 0 HD22 ASN A 100 11.693 8.697 -11.065 1.00 0.00 H new ATOM 1609 N GLU A 101 11.489 8.069 -6.800 1.00 0.00 N ATOM 1610 CA GLU A 101 11.069 8.223 -5.411 1.00 0.00 C ATOM 1611 C GLU A 101 9.559 8.182 -5.268 1.00 0.00 C ATOM 1612 O GLU A 101 8.811 8.680 -6.117 1.00 0.00 O ATOM 1613 CB GLU A 101 11.608 9.529 -4.828 1.00 0.00 C ATOM 1614 CG GLU A 101 11.446 10.702 -5.765 1.00 0.00 C ATOM 1615 CD GLU A 101 12.750 11.430 -6.029 1.00 0.00 C ATOM 1616 OE1 GLU A 101 13.809 10.768 -6.036 1.00 0.00 O ATOM 1617 OE2 GLU A 101 12.712 12.663 -6.228 1.00 0.00 O ATOM 0 H GLU A 101 12.023 8.861 -7.159 1.00 0.00 H new ATOM 0 HA GLU A 101 11.483 7.381 -4.856 1.00 0.00 H new ATOM 0 HB2 GLU A 101 11.092 9.744 -3.892 1.00 0.00 H new ATOM 0 HB3 GLU A 101 12.664 9.405 -4.588 1.00 0.00 H new ATOM 0 HG2 GLU A 101 11.034 10.351 -6.711 1.00 0.00 H new ATOM 0 HG3 GLU A 101 10.724 11.401 -5.343 1.00 0.00 H new ATOM 1624 N LEU A 102 9.133 7.567 -4.178 1.00 0.00 N ATOM 1625 CA LEU A 102 7.727 7.411 -3.868 1.00 0.00 C ATOM 1626 C LEU A 102 7.516 7.533 -2.362 1.00 0.00 C ATOM 1627 O LEU A 102 8.176 6.848 -1.584 1.00 0.00 O ATOM 1628 CB LEU A 102 7.271 6.047 -4.380 1.00 0.00 C ATOM 1629 CG LEU A 102 5.754 5.835 -4.485 1.00 0.00 C ATOM 1630 CD1 LEU A 102 5.417 4.951 -5.676 1.00 0.00 C ATOM 1631 CD2 LEU A 102 5.206 5.219 -3.211 1.00 0.00 C ATOM 0 H LEU A 102 9.758 7.161 -3.482 1.00 0.00 H new ATOM 0 HA LEU A 102 7.138 8.190 -4.351 1.00 0.00 H new ATOM 0 HB2 LEU A 102 7.708 5.887 -5.366 1.00 0.00 H new ATOM 0 HB3 LEU A 102 7.679 5.280 -3.722 1.00 0.00 H new ATOM 0 HG LEU A 102 5.288 6.810 -4.628 1.00 0.00 H new ATOM 0 HD11 LEU A 102 4.337 4.813 -5.733 1.00 0.00 H new ATOM 0 HD12 LEU A 102 5.771 5.424 -6.592 1.00 0.00 H new ATOM 0 HD13 LEU A 102 5.901 3.981 -5.558 1.00 0.00 H new ATOM 0 HD21 LEU A 102 4.130 5.078 -3.309 1.00 0.00 H new ATOM 0 HD22 LEU A 102 5.684 4.255 -3.038 1.00 0.00 H new ATOM 0 HD23 LEU A 102 5.410 5.881 -2.370 1.00 0.00 H new ATOM 1643 N ASN A 103 6.617 8.422 -1.952 1.00 0.00 N ATOM 1644 CA ASN A 103 6.353 8.637 -0.534 1.00 0.00 C ATOM 1645 C ASN A 103 4.981 8.110 -0.139 1.00 0.00 C ATOM 1646 O ASN A 103 4.056 8.081 -0.949 1.00 0.00 O ATOM 1647 CB ASN A 103 6.450 10.125 -0.192 1.00 0.00 C ATOM 1648 CG ASN A 103 7.741 10.752 -0.685 1.00 0.00 C ATOM 1649 OD1 ASN A 103 7.851 10.931 -1.997 1.00 0.00 O flip ATOM 1650 ND2 ASN A 103 8.630 11.072 0.104 1.00 0.00 N flip ATOM 0 H ASN A 103 6.061 9.003 -2.579 1.00 0.00 H new ATOM 0 HA ASN A 103 7.108 8.087 0.028 1.00 0.00 H new ATOM 0 HB2 ASN A 103 5.603 10.652 -0.632 1.00 0.00 H new ATOM 0 HB3 ASN A 103 6.378 10.252 0.888 1.00 0.00 H new ATOM 0 HD21 ASN A 103 8.504 10.917 1.104 1.00 0.00 H new ATOM 0 HD22 ASN A 103 9.492 11.492 -0.242 1.00 0.00 H new ATOM 1657 N THR A 104 4.862 7.701 1.118 1.00 0.00 N ATOM 1658 CA THR A 104 3.605 7.179 1.639 1.00 0.00 C ATOM 1659 C THR A 104 3.427 7.545 3.106 1.00 0.00 C ATOM 1660 O THR A 104 4.211 7.134 3.960 1.00 0.00 O ATOM 1661 CB THR A 104 3.531 5.658 1.460 1.00 0.00 C ATOM 1662 OG1 THR A 104 4.140 4.990 2.551 1.00 0.00 O ATOM 1663 CG2 THR A 104 4.194 5.164 0.190 1.00 0.00 C ATOM 0 H THR A 104 5.623 7.721 1.797 1.00 0.00 H new ATOM 0 HA THR A 104 2.795 7.636 1.071 1.00 0.00 H new ATOM 0 HB THR A 104 2.466 5.432 1.403 1.00 0.00 H new ATOM 0 HG1 THR A 104 3.943 4.031 2.499 1.00 0.00 H new ATOM 0 HG21 THR A 104 4.103 4.079 0.130 1.00 0.00 H new ATOM 0 HG22 THR A 104 3.708 5.617 -0.674 1.00 0.00 H new ATOM 0 HG23 THR A 104 5.249 5.439 0.199 1.00 0.00 H new ATOM 1671 N VAL A 105 2.387 8.321 3.390 1.00 0.00 N ATOM 1672 CA VAL A 105 2.097 8.746 4.753 1.00 0.00 C ATOM 1673 C VAL A 105 0.643 8.470 5.111 1.00 0.00 C ATOM 1674 O VAL A 105 -0.271 9.062 4.535 1.00 0.00 O ATOM 1675 CB VAL A 105 2.382 10.248 4.947 1.00 0.00 C ATOM 1676 CG1 VAL A 105 2.379 10.605 6.425 1.00 0.00 C ATOM 1677 CG2 VAL A 105 3.704 10.633 4.300 1.00 0.00 C ATOM 0 H VAL A 105 1.730 8.669 2.692 1.00 0.00 H new ATOM 0 HA VAL A 105 2.750 8.172 5.410 1.00 0.00 H new ATOM 0 HB VAL A 105 1.589 10.814 4.458 1.00 0.00 H new ATOM 0 HG11 VAL A 105 2.582 11.669 6.543 1.00 0.00 H new ATOM 0 HG12 VAL A 105 1.404 10.372 6.854 1.00 0.00 H new ATOM 0 HG13 VAL A 105 3.149 10.030 6.940 1.00 0.00 H new ATOM 0 HG21 VAL A 105 3.886 11.697 4.449 1.00 0.00 H new ATOM 0 HG22 VAL A 105 4.512 10.060 4.755 1.00 0.00 H new ATOM 0 HG23 VAL A 105 3.663 10.418 3.232 1.00 0.00 H new ATOM 1687 N ARG A 106 0.432 7.570 6.064 1.00 0.00 N ATOM 1688 CA ARG A 106 -0.915 7.221 6.496 1.00 0.00 C ATOM 1689 C ARG A 106 -1.029 7.275 8.017 1.00 0.00 C ATOM 1690 O ARG A 106 -0.369 6.517 8.727 1.00 0.00 O ATOM 1691 CB ARG A 106 -1.295 5.829 5.984 1.00 0.00 C ATOM 1692 CG ARG A 106 -0.551 4.697 6.675 1.00 0.00 C ATOM 1693 CD ARG A 106 -0.760 3.371 5.962 1.00 0.00 C ATOM 1694 NE ARG A 106 -0.644 2.235 6.874 1.00 0.00 N ATOM 1695 CZ ARG A 106 -1.140 1.026 6.620 1.00 0.00 C ATOM 1696 NH1 ARG A 106 -1.780 0.789 5.481 1.00 0.00 N ATOM 1697 NH2 ARG A 106 -0.996 0.051 7.506 1.00 0.00 N ATOM 0 H ARG A 106 1.175 7.070 6.551 1.00 0.00 H new ATOM 0 HA ARG A 106 -1.607 7.951 6.075 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -2.367 5.683 6.119 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -1.099 5.780 4.913 1.00 0.00 H new ATOM 0 HG2 ARG A 106 0.514 4.928 6.709 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -0.892 4.613 7.707 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -1.745 3.362 5.495 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -0.027 3.270 5.162 1.00 0.00 H new ATOM 0 HE ARG A 106 -0.154 2.377 7.757 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -1.894 1.535 4.795 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -2.158 -0.139 5.292 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -0.505 0.227 8.383 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -1.376 -0.875 7.311 1.00 0.00 H new ATOM 1711 N GLU A 107 -1.869 8.179 8.508 1.00 0.00 N ATOM 1712 CA GLU A 107 -2.070 8.336 9.944 1.00 0.00 C ATOM 1713 C GLU A 107 -3.467 7.881 10.350 1.00 0.00 C ATOM 1714 O GLU A 107 -4.377 7.827 9.523 1.00 0.00 O ATOM 1715 CB GLU A 107 -1.861 9.795 10.352 1.00 0.00 C ATOM 1716 CG GLU A 107 -2.854 10.753 9.713 1.00 0.00 C ATOM 1717 CD GLU A 107 -2.444 12.205 9.865 1.00 0.00 C ATOM 1718 OE1 GLU A 107 -1.311 12.547 9.464 1.00 0.00 O ATOM 1719 OE2 GLU A 107 -3.254 13.000 10.385 1.00 0.00 O ATOM 0 H GLU A 107 -2.422 8.815 7.933 1.00 0.00 H new ATOM 0 HA GLU A 107 -1.339 7.712 10.458 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -1.938 9.875 11.436 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -0.850 10.098 10.081 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -2.952 10.516 8.654 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -3.836 10.607 10.164 1.00 0.00 H new ATOM 1726 N ILE A 108 -3.631 7.556 11.628 1.00 0.00 N ATOM 1727 CA ILE A 108 -4.920 7.110 12.138 1.00 0.00 C ATOM 1728 C ILE A 108 -5.876 8.283 12.304 1.00 0.00 C ATOM 1729 O ILE A 108 -6.045 8.808 13.405 1.00 0.00 O ATOM 1730 CB ILE A 108 -4.779 6.388 13.495 1.00 0.00 C ATOM 1731 CG1 ILE A 108 -3.799 5.215 13.380 1.00 0.00 C ATOM 1732 CG2 ILE A 108 -6.142 5.912 13.993 1.00 0.00 C ATOM 1733 CD1 ILE A 108 -4.402 3.970 12.763 1.00 0.00 C ATOM 0 H ILE A 108 -2.889 7.593 12.327 1.00 0.00 H new ATOM 0 HA ILE A 108 -5.321 6.410 11.405 1.00 0.00 H new ATOM 0 HB ILE A 108 -4.380 7.094 14.223 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -2.943 5.527 12.782 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -3.422 4.970 14.373 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -6.023 5.405 14.951 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -6.804 6.769 14.116 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -6.573 5.221 13.268 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -3.647 3.185 12.716 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -5.240 3.631 13.372 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -4.753 4.196 11.756 1.00 0.00 H new ATOM 1745 N ILE A 109 -6.512 8.683 11.211 1.00 0.00 N ATOM 1746 CA ILE A 109 -7.460 9.781 11.252 1.00 0.00 C ATOM 1747 C ILE A 109 -8.769 9.308 11.871 1.00 0.00 C ATOM 1748 O ILE A 109 -9.391 8.364 11.382 1.00 0.00 O ATOM 1749 CB ILE A 109 -7.717 10.362 9.845 1.00 0.00 C ATOM 1750 CG1 ILE A 109 -8.187 11.813 9.950 1.00 0.00 C ATOM 1751 CG2 ILE A 109 -8.733 9.521 9.092 1.00 0.00 C ATOM 1752 CD1 ILE A 109 -7.110 12.761 10.430 1.00 0.00 C ATOM 0 H ILE A 109 -6.387 8.263 10.290 1.00 0.00 H new ATOM 0 HA ILE A 109 -7.032 10.575 11.865 1.00 0.00 H new ATOM 0 HB ILE A 109 -6.782 10.340 9.286 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -8.543 12.143 8.974 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -9.036 11.864 10.632 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -8.898 9.949 8.103 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -8.357 8.503 8.988 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -9.673 9.506 9.643 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -7.512 13.773 10.481 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -6.771 12.455 11.420 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -6.270 12.739 9.736 1.00 0.00 H new ATOM 1764 N GLY A 110 -9.176 9.942 12.962 1.00 0.00 N ATOM 1765 CA GLY A 110 -10.399 9.532 13.618 1.00 0.00 C ATOM 1766 C GLY A 110 -10.402 8.050 13.920 1.00 0.00 C ATOM 1767 O GLY A 110 -9.483 7.531 14.553 1.00 0.00 O ATOM 0 H GLY A 110 -8.688 10.723 13.400 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -10.520 10.093 14.545 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -11.251 9.776 12.984 1.00 0.00 H new ATOM 1771 N ASP A 111 -11.428 7.373 13.443 1.00 0.00 N ATOM 1772 CA ASP A 111 -11.558 5.934 13.632 1.00 0.00 C ATOM 1773 C ASP A 111 -11.171 5.189 12.354 1.00 0.00 C ATOM 1774 O ASP A 111 -11.503 4.016 12.183 1.00 0.00 O ATOM 1775 CB ASP A 111 -12.990 5.576 14.033 1.00 0.00 C ATOM 1776 CG ASP A 111 -13.068 4.267 14.794 1.00 0.00 C ATOM 1777 OD1 ASP A 111 -12.889 3.203 14.164 1.00 0.00 O ATOM 1778 OD2 ASP A 111 -13.308 4.305 16.019 1.00 0.00 O ATOM 0 H ASP A 111 -12.192 7.797 12.917 1.00 0.00 H new ATOM 0 HA ASP A 111 -10.882 5.631 14.432 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -13.403 6.376 14.648 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -13.609 5.510 13.138 1.00 0.00 H new ATOM 1783 N GLU A 112 -10.476 5.885 11.453 1.00 0.00 N ATOM 1784 CA GLU A 112 -10.054 5.301 10.186 1.00 0.00 C ATOM 1785 C GLU A 112 -8.629 5.717 9.843 1.00 0.00 C ATOM 1786 O GLU A 112 -8.003 6.484 10.575 1.00 0.00 O ATOM 1787 CB GLU A 112 -11.000 5.739 9.070 1.00 0.00 C ATOM 1788 CG GLU A 112 -12.396 5.159 9.201 1.00 0.00 C ATOM 1789 CD GLU A 112 -13.053 4.905 7.859 1.00 0.00 C ATOM 1790 OE1 GLU A 112 -13.012 5.808 6.997 1.00 0.00 O ATOM 1791 OE2 GLU A 112 -13.611 3.803 7.669 1.00 0.00 O ATOM 0 H GLU A 112 -10.194 6.857 11.581 1.00 0.00 H new ATOM 0 HA GLU A 112 -10.084 4.216 10.284 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -11.066 6.827 9.066 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -10.579 5.441 8.110 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -12.345 4.224 9.759 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -13.016 5.843 9.781 1.00 0.00 H new ATOM 1798 N LEU A 113 -8.122 5.216 8.721 1.00 0.00 N ATOM 1799 CA LEU A 113 -6.768 5.555 8.286 1.00 0.00 C ATOM 1800 C LEU A 113 -6.797 6.363 6.996 1.00 0.00 C ATOM 1801 O LEU A 113 -7.436 5.975 6.019 1.00 0.00 O ATOM 1802 CB LEU A 113 -5.919 4.295 8.079 1.00 0.00 C ATOM 1803 CG LEU A 113 -4.421 4.472 8.333 1.00 0.00 C ATOM 1804 CD1 LEU A 113 -4.097 4.249 9.798 1.00 0.00 C ATOM 1805 CD2 LEU A 113 -3.619 3.522 7.455 1.00 0.00 C ATOM 0 H LEU A 113 -8.622 4.579 8.100 1.00 0.00 H new ATOM 0 HA LEU A 113 -6.317 6.157 9.075 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -6.293 3.511 8.738 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -6.059 3.945 7.056 1.00 0.00 H new ATOM 0 HG LEU A 113 -4.146 5.495 8.076 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -3.027 4.379 9.958 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -4.645 4.969 10.406 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -4.386 3.238 10.085 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -2.555 3.660 7.647 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -3.898 2.493 7.682 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -3.828 3.732 6.406 1.00 0.00 H new ATOM 1817 N VAL A 114 -6.083 7.480 6.999 1.00 0.00 N ATOM 1818 CA VAL A 114 -6.003 8.342 5.824 1.00 0.00 C ATOM 1819 C VAL A 114 -4.617 8.235 5.203 1.00 0.00 C ATOM 1820 O VAL A 114 -3.634 8.711 5.769 1.00 0.00 O ATOM 1821 CB VAL A 114 -6.300 9.815 6.175 1.00 0.00 C ATOM 1822 CG1 VAL A 114 -5.313 10.337 7.209 1.00 0.00 C ATOM 1823 CG2 VAL A 114 -6.277 10.680 4.923 1.00 0.00 C ATOM 0 H VAL A 114 -5.550 7.812 7.802 1.00 0.00 H new ATOM 0 HA VAL A 114 -6.758 8.008 5.113 1.00 0.00 H new ATOM 0 HB VAL A 114 -7.299 9.865 6.608 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -5.544 11.377 7.439 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -5.387 9.739 8.117 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -4.300 10.269 6.812 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -6.489 11.715 5.192 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -5.293 10.620 4.457 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -7.033 10.325 4.222 1.00 0.00 H new ATOM 1833 N GLN A 115 -4.541 7.580 4.051 1.00 0.00 N ATOM 1834 CA GLN A 115 -3.267 7.379 3.373 1.00 0.00 C ATOM 1835 C GLN A 115 -3.065 8.356 2.220 1.00 0.00 C ATOM 1836 O GLN A 115 -3.991 8.657 1.469 1.00 0.00 O ATOM 1837 CB GLN A 115 -3.175 5.945 2.853 1.00 0.00 C ATOM 1838 CG GLN A 115 -3.619 4.898 3.862 1.00 0.00 C ATOM 1839 CD GLN A 115 -4.557 3.869 3.262 1.00 0.00 C ATOM 1840 OE1 GLN A 115 -5.753 3.857 3.553 1.00 0.00 O ATOM 1841 NE2 GLN A 115 -4.017 2.997 2.419 1.00 0.00 N ATOM 0 H GLN A 115 -5.345 7.180 3.568 1.00 0.00 H new ATOM 0 HA GLN A 115 -2.479 7.564 4.103 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -3.787 5.854 1.955 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -2.145 5.740 2.559 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -2.741 4.393 4.265 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -4.114 5.392 4.698 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -3.021 3.043 2.206 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -4.599 2.281 1.984 1.00 0.00 H new ATOM 1850 N THR A 116 -1.829 8.828 2.085 1.00 0.00 N ATOM 1851 CA THR A 116 -1.453 9.754 1.023 1.00 0.00 C ATOM 1852 C THR A 116 -0.104 9.347 0.448 1.00 0.00 C ATOM 1853 O THR A 116 0.922 9.446 1.121 1.00 0.00 O ATOM 1854 CB THR A 116 -1.387 11.185 1.554 1.00 0.00 C ATOM 1855 OG1 THR A 116 -2.229 11.342 2.683 1.00 0.00 O ATOM 1856 CG2 THR A 116 -1.792 12.224 0.531 1.00 0.00 C ATOM 0 H THR A 116 -1.061 8.579 2.708 1.00 0.00 H new ATOM 0 HA THR A 116 -2.208 9.715 0.238 1.00 0.00 H new ATOM 0 HB THR A 116 -0.341 11.346 1.816 1.00 0.00 H new ATOM 0 HG1 THR A 116 -2.171 12.264 3.009 1.00 0.00 H new ATOM 0 HG21 THR A 116 -1.722 13.217 0.974 1.00 0.00 H new ATOM 0 HG22 THR A 116 -1.128 12.164 -0.331 1.00 0.00 H new ATOM 0 HG23 THR A 116 -2.818 12.040 0.212 1.00 0.00 H new ATOM 1864 N TYR A 117 -0.109 8.880 -0.794 1.00 0.00 N ATOM 1865 CA TYR A 117 1.116 8.449 -1.446 1.00 0.00 C ATOM 1866 C TYR A 117 1.477 9.403 -2.575 1.00 0.00 C ATOM 1867 O TYR A 117 0.609 10.092 -3.106 1.00 0.00 O ATOM 1868 CB TYR A 117 0.947 7.036 -2.012 1.00 0.00 C ATOM 1869 CG TYR A 117 0.347 6.033 -1.050 1.00 0.00 C ATOM 1870 CD1 TYR A 117 -0.969 6.149 -0.615 1.00 0.00 C ATOM 1871 CD2 TYR A 117 1.095 4.959 -0.588 1.00 0.00 C ATOM 1872 CE1 TYR A 117 -1.516 5.224 0.253 1.00 0.00 C ATOM 1873 CE2 TYR A 117 0.554 4.031 0.280 1.00 0.00 C ATOM 1874 CZ TYR A 117 -0.751 4.168 0.697 1.00 0.00 C ATOM 1875 OH TYR A 117 -1.295 3.246 1.562 1.00 0.00 O ATOM 0 H TYR A 117 -0.948 8.791 -1.368 1.00 0.00 H new ATOM 0 HA TYR A 117 1.916 8.448 -0.706 1.00 0.00 H new ATOM 0 HB2 TYR A 117 0.317 7.089 -2.900 1.00 0.00 H new ATOM 0 HB3 TYR A 117 1.922 6.670 -2.335 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -1.573 6.975 -0.961 1.00 0.00 H new ATOM 0 HD2 TYR A 117 2.119 4.847 -0.913 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -2.539 5.328 0.582 1.00 0.00 H new ATOM 0 HE2 TYR A 117 1.151 3.202 0.630 1.00 0.00 H new ATOM 0 HH TYR A 117 -0.625 2.564 1.778 1.00 0.00 H new ATOM 1885 N VAL A 118 2.751 9.428 -2.954 1.00 0.00 N ATOM 1886 CA VAL A 118 3.199 10.286 -4.036 1.00 0.00 C ATOM 1887 C VAL A 118 4.389 9.667 -4.773 1.00 0.00 C ATOM 1888 O VAL A 118 5.317 9.159 -4.149 1.00 0.00 O ATOM 1889 CB VAL A 118 3.582 11.691 -3.531 1.00 0.00 C ATOM 1890 CG1 VAL A 118 4.831 11.640 -2.665 1.00 0.00 C ATOM 1891 CG2 VAL A 118 3.781 12.630 -4.708 1.00 0.00 C ATOM 0 H VAL A 118 3.486 8.865 -2.527 1.00 0.00 H new ATOM 0 HA VAL A 118 2.361 10.384 -4.727 1.00 0.00 H new ATOM 0 HB VAL A 118 2.767 12.069 -2.914 1.00 0.00 H new ATOM 0 HG11 VAL A 118 5.078 12.645 -2.323 1.00 0.00 H new ATOM 0 HG12 VAL A 118 4.650 10.997 -1.803 1.00 0.00 H new ATOM 0 HG13 VAL A 118 5.661 11.241 -3.247 1.00 0.00 H new ATOM 0 HG21 VAL A 118 4.051 13.620 -4.342 1.00 0.00 H new ATOM 0 HG22 VAL A 118 4.578 12.249 -5.347 1.00 0.00 H new ATOM 0 HG23 VAL A 118 2.857 12.695 -5.282 1.00 0.00 H new ATOM 1901 N TYR A 119 4.348 9.711 -6.103 1.00 0.00 N ATOM 1902 CA TYR A 119 5.416 9.154 -6.930 1.00 0.00 C ATOM 1903 C TYR A 119 5.602 9.983 -8.194 1.00 0.00 C ATOM 1904 O TYR A 119 4.698 10.071 -9.021 1.00 0.00 O ATOM 1905 CB TYR A 119 5.093 7.704 -7.287 1.00 0.00 C ATOM 1906 CG TYR A 119 5.976 7.108 -8.358 1.00 0.00 C ATOM 1907 CD1 TYR A 119 7.157 6.469 -8.027 1.00 0.00 C ATOM 1908 CD2 TYR A 119 5.624 7.179 -9.696 1.00 0.00 C ATOM 1909 CE1 TYR A 119 7.966 5.916 -8.993 1.00 0.00 C ATOM 1910 CE2 TYR A 119 6.429 6.629 -10.676 1.00 0.00 C ATOM 1911 CZ TYR A 119 7.600 5.997 -10.318 1.00 0.00 C ATOM 1912 OH TYR A 119 8.410 5.452 -11.287 1.00 0.00 O ATOM 0 H TYR A 119 3.583 10.129 -6.633 1.00 0.00 H new ATOM 0 HA TYR A 119 6.348 9.181 -6.365 1.00 0.00 H new ATOM 0 HB2 TYR A 119 5.175 7.095 -6.387 1.00 0.00 H new ATOM 0 HB3 TYR A 119 4.056 7.647 -7.617 1.00 0.00 H new ATOM 0 HD1 TYR A 119 7.450 6.403 -6.990 1.00 0.00 H new ATOM 0 HD2 TYR A 119 4.706 7.672 -9.978 1.00 0.00 H new ATOM 0 HE1 TYR A 119 8.884 5.421 -8.713 1.00 0.00 H new ATOM 0 HE2 TYR A 119 6.142 6.694 -11.715 1.00 0.00 H new ATOM 0 HH TYR A 119 8.642 6.141 -11.945 1.00 0.00 H new ATOM 1922 N GLU A 120 6.783 10.588 -8.331 1.00 0.00 N ATOM 1923 CA GLU A 120 7.113 11.429 -9.491 1.00 0.00 C ATOM 1924 C GLU A 120 5.862 11.964 -10.192 1.00 0.00 C ATOM 1925 O GLU A 120 5.348 11.341 -11.120 1.00 0.00 O ATOM 1926 CB GLU A 120 7.957 10.643 -10.491 1.00 0.00 C ATOM 1927 CG GLU A 120 8.882 9.634 -9.840 1.00 0.00 C ATOM 1928 CD GLU A 120 9.803 10.263 -8.813 1.00 0.00 C ATOM 1929 OE1 GLU A 120 9.296 10.956 -7.906 1.00 0.00 O ATOM 1930 OE2 GLU A 120 11.031 10.064 -8.917 1.00 0.00 O ATOM 0 H GLU A 120 7.536 10.512 -7.647 1.00 0.00 H new ATOM 0 HA GLU A 120 7.679 12.282 -9.116 1.00 0.00 H new ATOM 0 HB2 GLU A 120 7.295 10.123 -11.184 1.00 0.00 H new ATOM 0 HB3 GLU A 120 8.551 11.341 -11.081 1.00 0.00 H new ATOM 0 HG2 GLU A 120 8.286 8.857 -9.361 1.00 0.00 H new ATOM 0 HG3 GLU A 120 9.481 9.147 -10.609 1.00 0.00 H new ATOM 1937 N GLY A 121 5.384 13.123 -9.748 1.00 0.00 N ATOM 1938 CA GLY A 121 4.206 13.722 -10.354 1.00 0.00 C ATOM 1939 C GLY A 121 2.905 13.015 -10.002 1.00 0.00 C ATOM 1940 O GLY A 121 1.826 13.486 -10.360 1.00 0.00 O ATOM 0 H GLY A 121 5.790 13.658 -8.980 1.00 0.00 H new ATOM 0 HA2 GLY A 121 4.138 14.764 -10.041 1.00 0.00 H new ATOM 0 HA3 GLY A 121 4.327 13.722 -11.437 1.00 0.00 H new ATOM 1944 N VAL A 122 3.002 11.885 -9.314 1.00 0.00 N ATOM 1945 CA VAL A 122 1.823 11.116 -8.932 1.00 0.00 C ATOM 1946 C VAL A 122 1.546 11.237 -7.441 1.00 0.00 C ATOM 1947 O VAL A 122 2.468 11.326 -6.638 1.00 0.00 O ATOM 1948 CB VAL A 122 2.004 9.628 -9.296 1.00 0.00 C ATOM 1949 CG1 VAL A 122 0.717 8.849 -9.115 1.00 0.00 C ATOM 1950 CG2 VAL A 122 2.508 9.496 -10.718 1.00 0.00 C ATOM 0 H VAL A 122 3.886 11.479 -9.008 1.00 0.00 H new ATOM 0 HA VAL A 122 0.975 11.524 -9.482 1.00 0.00 H new ATOM 0 HB VAL A 122 2.743 9.204 -8.616 1.00 0.00 H new ATOM 0 HG11 VAL A 122 0.883 7.805 -9.381 1.00 0.00 H new ATOM 0 HG12 VAL A 122 0.397 8.912 -8.075 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -0.056 9.269 -9.759 1.00 0.00 H new ATOM 0 HG21 VAL A 122 2.632 8.441 -10.964 1.00 0.00 H new ATOM 0 HG22 VAL A 122 1.789 9.946 -11.402 1.00 0.00 H new ATOM 0 HG23 VAL A 122 3.467 10.006 -10.813 1.00 0.00 H new ATOM 1960 N GLU A 123 0.271 11.233 -7.078 1.00 0.00 N ATOM 1961 CA GLU A 123 -0.125 11.330 -5.686 1.00 0.00 C ATOM 1962 C GLU A 123 -1.509 10.731 -5.489 1.00 0.00 C ATOM 1963 O GLU A 123 -2.494 11.227 -6.037 1.00 0.00 O ATOM 1964 CB GLU A 123 -0.103 12.782 -5.217 1.00 0.00 C ATOM 1965 CG GLU A 123 0.316 12.930 -3.767 1.00 0.00 C ATOM 1966 CD GLU A 123 0.956 14.273 -3.476 1.00 0.00 C ATOM 1967 OE1 GLU A 123 1.607 14.831 -4.385 1.00 0.00 O ATOM 1968 OE2 GLU A 123 0.808 14.767 -2.338 1.00 0.00 O ATOM 0 H GLU A 123 -0.507 11.163 -7.734 1.00 0.00 H new ATOM 0 HA GLU A 123 0.590 10.767 -5.086 1.00 0.00 H new ATOM 0 HB2 GLU A 123 0.581 13.351 -5.847 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -1.094 13.216 -5.349 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -0.556 12.802 -3.126 1.00 0.00 H new ATOM 0 HG3 GLU A 123 1.018 12.135 -3.513 1.00 0.00 H new ATOM 1975 N ALA A 124 -1.579 9.654 -4.715 1.00 0.00 N ATOM 1976 CA ALA A 124 -2.846 8.985 -4.466 1.00 0.00 C ATOM 1977 C ALA A 124 -3.182 8.953 -2.982 1.00 0.00 C ATOM 1978 O ALA A 124 -2.335 8.650 -2.145 1.00 0.00 O ATOM 1979 CB ALA A 124 -2.822 7.572 -5.042 1.00 0.00 C ATOM 0 H ALA A 124 -0.776 9.229 -4.252 1.00 0.00 H new ATOM 0 HA ALA A 124 -3.628 9.556 -4.966 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -3.777 7.084 -4.848 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -2.651 7.620 -6.117 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -2.021 7.001 -4.573 1.00 0.00 H new ATOM 1985 N LYS A 125 -4.437 9.256 -2.673 1.00 0.00 N ATOM 1986 CA LYS A 125 -4.916 9.252 -1.299 1.00 0.00 C ATOM 1987 C LYS A 125 -5.848 8.067 -1.106 1.00 0.00 C ATOM 1988 O LYS A 125 -6.678 7.779 -1.967 1.00 0.00 O ATOM 1989 CB LYS A 125 -5.646 10.560 -0.980 1.00 0.00 C ATOM 1990 CG LYS A 125 -4.935 11.416 0.055 1.00 0.00 C ATOM 1991 CD LYS A 125 -4.842 12.868 -0.390 1.00 0.00 C ATOM 1992 CE LYS A 125 -4.011 13.011 -1.655 1.00 0.00 C ATOM 1993 NZ LYS A 125 -4.561 14.053 -2.566 1.00 0.00 N ATOM 0 H LYS A 125 -5.145 9.509 -3.362 1.00 0.00 H new ATOM 0 HA LYS A 125 -4.068 9.166 -0.620 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -5.761 11.136 -1.898 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -6.649 10.329 -0.621 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -5.468 11.359 1.004 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -3.933 11.023 0.228 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -5.844 13.261 -0.565 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -4.400 13.466 0.407 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -2.985 13.266 -1.389 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -3.976 12.055 -2.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -3.966 14.120 -3.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -5.531 13.797 -2.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -4.571 14.971 -2.078 1.00 0.00 H new ATOM 2007 N ARG A 126 -5.692 7.358 0.001 1.00 0.00 N ATOM 2008 CA ARG A 126 -6.512 6.184 0.251 1.00 0.00 C ATOM 2009 C ARG A 126 -7.122 6.183 1.649 1.00 0.00 C ATOM 2010 O ARG A 126 -6.413 6.081 2.650 1.00 0.00 O ATOM 2011 CB ARG A 126 -5.666 4.927 0.049 1.00 0.00 C ATOM 2012 CG ARG A 126 -6.422 3.630 0.289 1.00 0.00 C ATOM 2013 CD ARG A 126 -6.035 2.563 -0.723 1.00 0.00 C ATOM 2014 NE ARG A 126 -5.101 1.588 -0.161 1.00 0.00 N ATOM 2015 CZ ARG A 126 -3.900 1.317 -0.673 1.00 0.00 C ATOM 2016 NH1 ARG A 126 -3.471 1.941 -1.764 1.00 0.00 N ATOM 2017 NH2 ARG A 126 -3.123 0.415 -0.088 1.00 0.00 N ATOM 0 H ARG A 126 -5.014 7.571 0.732 1.00 0.00 H new ATOM 0 HA ARG A 126 -7.341 6.202 -0.456 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -5.274 4.925 -0.968 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -4.809 4.966 0.721 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -6.216 3.269 1.297 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -7.494 3.817 0.230 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -6.932 2.049 -1.068 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -5.584 3.037 -1.595 1.00 0.00 H new ATOM 0 HE ARG A 126 -5.387 1.082 0.677 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -4.062 2.636 -2.220 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -2.550 1.725 -2.146 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -3.445 -0.069 0.750 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -2.204 0.205 -0.477 1.00 0.00 H new ATOM 2031 N ILE A 127 -8.449 6.256 1.700 1.00 0.00 N ATOM 2032 CA ILE A 127 -9.170 6.220 2.963 1.00 0.00 C ATOM 2033 C ILE A 127 -9.335 4.772 3.395 1.00 0.00 C ATOM 2034 O ILE A 127 -9.667 3.908 2.581 1.00 0.00 O ATOM 2035 CB ILE A 127 -10.562 6.874 2.864 1.00 0.00 C ATOM 2036 CG1 ILE A 127 -10.455 8.312 2.348 1.00 0.00 C ATOM 2037 CG2 ILE A 127 -11.256 6.846 4.221 1.00 0.00 C ATOM 2038 CD1 ILE A 127 -10.103 8.411 0.879 1.00 0.00 C ATOM 0 H ILE A 127 -9.046 6.341 0.877 1.00 0.00 H new ATOM 0 HA ILE A 127 -8.590 6.786 3.692 1.00 0.00 H new ATOM 0 HB ILE A 127 -11.158 6.302 2.153 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -11.404 8.821 2.520 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -9.700 8.841 2.929 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -12.238 7.311 4.137 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -11.370 5.813 4.550 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -10.656 7.394 4.948 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -10.046 9.460 0.588 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -9.140 7.932 0.703 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -10.870 7.912 0.287 1.00 0.00 H new ATOM 2050 N PHE A 128 -9.075 4.500 4.661 1.00 0.00 N ATOM 2051 CA PHE A 128 -9.165 3.141 5.167 1.00 0.00 C ATOM 2052 C PHE A 128 -10.375 2.921 6.068 1.00 0.00 C ATOM 2053 O PHE A 128 -10.803 3.815 6.794 1.00 0.00 O ATOM 2054 CB PHE A 128 -7.900 2.799 5.944 1.00 0.00 C ATOM 2055 CG PHE A 128 -8.032 1.547 6.750 1.00 0.00 C ATOM 2056 CD1 PHE A 128 -8.199 0.332 6.122 1.00 0.00 C ATOM 2057 CD2 PHE A 128 -8.020 1.587 8.133 1.00 0.00 C ATOM 2058 CE1 PHE A 128 -8.350 -0.817 6.849 1.00 0.00 C ATOM 2059 CE2 PHE A 128 -8.165 0.427 8.871 1.00 0.00 C ATOM 2060 CZ PHE A 128 -8.331 -0.776 8.225 1.00 0.00 C ATOM 0 H PHE A 128 -8.802 5.196 5.354 1.00 0.00 H new ATOM 0 HA PHE A 128 -9.278 2.489 4.301 1.00 0.00 H new ATOM 0 HB2 PHE A 128 -7.070 2.690 5.246 1.00 0.00 H new ATOM 0 HB3 PHE A 128 -7.652 3.628 6.607 1.00 0.00 H new ATOM 0 HD1 PHE A 128 -8.211 0.286 5.043 1.00 0.00 H new ATOM 0 HD2 PHE A 128 -7.896 2.532 8.640 1.00 0.00 H new ATOM 0 HE1 PHE A 128 -8.485 -1.761 6.341 1.00 0.00 H new ATOM 0 HE2 PHE A 128 -8.148 0.465 9.950 1.00 0.00 H new ATOM 0 HZ PHE A 128 -8.446 -1.686 8.796 1.00 0.00 H new ATOM 2070 N LYS A 129 -10.882 1.692 6.033 1.00 0.00 N ATOM 2071 CA LYS A 129 -12.010 1.281 6.855 1.00 0.00 C ATOM 2072 C LYS A 129 -11.783 -0.145 7.322 1.00 0.00 C ATOM 2073 O LYS A 129 -10.999 -0.880 6.730 1.00 0.00 O ATOM 2074 CB LYS A 129 -13.318 1.389 6.073 1.00 0.00 C ATOM 2075 CG LYS A 129 -14.538 0.841 6.794 1.00 0.00 C ATOM 2076 CD LYS A 129 -14.872 -0.569 6.338 1.00 0.00 C ATOM 2077 CE LYS A 129 -16.246 -0.999 6.827 1.00 0.00 C ATOM 2078 NZ LYS A 129 -16.577 -2.389 6.406 1.00 0.00 N ATOM 0 H LYS A 129 -10.519 0.953 5.431 1.00 0.00 H new ATOM 0 HA LYS A 129 -12.087 1.940 7.720 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -13.496 2.437 5.833 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -13.204 0.860 5.127 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -14.357 0.843 7.869 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -15.392 1.494 6.613 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -14.840 -0.618 5.250 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -14.118 -1.262 6.711 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -16.282 -0.931 7.914 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -17.000 -0.313 6.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -17.559 -2.607 6.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -16.469 -2.474 5.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -15.934 -3.057 6.878 1.00 0.00 H new ATOM 2092 N LYS A 130 -12.446 -0.533 8.389 1.00 0.00 N ATOM 2093 CA LYS A 130 -12.272 -1.882 8.916 1.00 0.00 C ATOM 2094 C LYS A 130 -13.489 -2.757 8.660 1.00 0.00 C ATOM 2095 O LYS A 130 -14.622 -2.280 8.617 1.00 0.00 O ATOM 2096 CB LYS A 130 -11.959 -1.853 10.407 1.00 0.00 C ATOM 2097 CG LYS A 130 -10.985 -0.757 10.807 1.00 0.00 C ATOM 2098 CD LYS A 130 -10.521 -0.922 12.246 1.00 0.00 C ATOM 2099 CE LYS A 130 -9.624 -2.139 12.409 1.00 0.00 C ATOM 2100 NZ LYS A 130 -8.192 -1.758 12.552 1.00 0.00 N ATOM 0 H LYS A 130 -13.103 0.051 8.907 1.00 0.00 H new ATOM 0 HA LYS A 130 -11.426 -2.318 8.384 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -12.888 -1.721 10.961 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -11.547 -2.818 10.701 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -10.122 -0.775 10.141 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -11.461 0.216 10.686 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -9.983 -0.028 12.560 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -11.388 -1.018 12.900 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -9.938 -2.707 13.285 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -9.741 -2.794 11.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -7.613 -2.339 11.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -8.074 -0.754 12.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -7.887 -1.915 13.534 1.00 0.00 H new ATOM 2114 N ASP A 131 -13.231 -4.047 8.495 1.00 0.00 N ATOM 2115 CA ASP A 131 -14.283 -5.020 8.243 1.00 0.00 C ATOM 2116 C ASP A 131 -15.162 -5.207 9.476 1.00 0.00 C ATOM 2117 O ASP A 131 -14.607 -5.470 10.563 1.00 0.35 O ATOM 2118 CB ASP A 131 -13.664 -6.356 7.834 1.00 0.00 C ATOM 2119 CG ASP A 131 -14.576 -7.168 6.936 1.00 0.00 C ATOM 2120 OD1 ASP A 131 -15.549 -7.756 7.455 1.00 0.00 O ATOM 2121 OD2 ASP A 131 -14.319 -7.216 5.715 1.00 0.00 O ATOM 2122 OXT ASP A 131 -16.399 -5.088 9.344 1.00 0.35 O ATOM 0 H ASP A 131 -12.293 -4.446 8.532 1.00 0.00 H new ATOM 0 HA ASP A 131 -14.910 -4.648 7.433 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -12.721 -6.173 7.319 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -13.432 -6.934 8.728 1.00 0.00 H new