USER MOD reduce.3.24.130724 H: found=0, std=0, add=1096, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1096 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 15 TYR OH : rot -28:sc= -0.159 USER MOD Set 1.2: A 40 THR OG1 : rot 180:sc= -0.121 USER MOD Set 1.3: A 127 LYS NZ :NH3+ 168:sc= 0.676 (180deg=0.353) USER MOD Set 2.1: A 90 LYS NZ :NH3+ 162:sc= 0.991 (180deg=0.167) USER MOD Set 2.2: A 91 ASN : amide:sc= -0.39 K(o=0.6,f=-4.9!) USER MOD Set 3.1: A 32 SER OG : rot 93:sc= 0.713 USER MOD Set 3.2: A 37 HIS : no HD1:sc= -0.287 K(o=0.43,f=-6.6!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -163:sc= 1.23 (180deg=0.89) USER MOD Single : A 11 GLN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 THR OG1 : rot 180:sc=0.000847 USER MOD Single : A 21 ASN : amide:sc= 0.768 K(o=0.77,f=0) USER MOD Single : A 22 LYS NZ :NH3+ 154:sc= 2.37 (180deg=1.06!) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0.772 USER MOD Single : A 27 SER OG : rot 67:sc= 0.964 USER MOD Single : A 30 ASN : amide:sc=-0.00612 K(o=-0.0061,f=-9!) USER MOD Single : A 34 MET CE :methyl -156:sc= -0.162 (180deg=-0.616) USER MOD Single : A 39 MET CE :methyl -148:sc= -2.85! (180deg=-4.93!) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot -57:sc= 0.682 USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 48 ASN : amide:sc= 1.15 K(o=1.2,f=-0.057) USER MOD Single : A 52 GLN : amide:sc= 0.478 K(o=0.48,f=-0.54) USER MOD Single : A 59 SER OG : rot 180:sc= 0.011 USER MOD Single : A 60 TYR OH : rot 180:sc= 0.565 USER MOD Single : A 68 ASN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 70 LYS NZ :NH3+ -146:sc= 1.37 (180deg=0.918) USER MOD Single : A 72 GLN :FLIP amide:sc= -0.361 F(o=-0.9,f=-0.36) USER MOD Single : A 78 GLN : amide:sc= -0.202 X(o=-0.2,f=-0.2) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -0.0563 K(o=-0.056,f=-3.2!) USER MOD Single : A 89 HIS : no HE2:sc= -2.86! C(o=-2.9!,f=-6.5!) USER MOD Single : A 95 ASN :FLIP amide:sc=-0.00165 F(o=-0.95,f=-0.0016) USER MOD Single : A 96 SER OG : rot -130:sc= 1.24 USER MOD Single : A 97 GLN : amide:sc= 0.797 K(o=0.8,f=-0.11) USER MOD Single : A 100 ASN : amide:sc= 1.32 K(o=1.3,f=-7.7!) USER MOD Single : A 106 TYR OH : rot -112:sc= 1.7 USER MOD Single : A 107 ASN : amide:sc= -0.461 K(o=-0.46,f=-6.4!) USER MOD Single : A 108 GLN : amide:sc= -0.807 K(o=-0.81,f=-6.1!) USER MOD Single : A 110 LYS NZ :NH3+ 152:sc= -1.5! (180deg=-2.01!) USER MOD Single : A 114 ASN :FLIP amide:sc= 0 F(o=-0.81,f=0) USER MOD Single : A 119 ASN : amide:sc= 0.859 K(o=0.86,f=-0.4) USER MOD Single : A 123 SER OG : rot 80:sc= -0.314 USER MOD Single : A 131 THR OG1 : rot -38:sc= 0.617 USER MOD Single : A 132 THR OG1 : rot -70:sc= 0.982 USER MOD Single : A 134 ASN : amide:sc= 0 X(o=0,f=-0.00071) USER MOD Single : A 137 ASN : amide:sc= -0.112 K(o=-0.11,f=-1.2) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 17.182 62.284 -18.336 1.00 0.00 N ATOM 2 CA MET A 1 18.036 61.412 -17.500 1.00 0.00 C ATOM 3 C MET A 1 17.283 61.008 -16.244 1.00 0.00 C ATOM 4 O MET A 1 16.179 61.490 -15.998 1.00 0.00 O ATOM 5 CB MET A 1 19.336 62.136 -17.121 1.00 0.00 C ATOM 6 CG MET A 1 19.159 63.244 -16.088 1.00 0.00 C ATOM 7 SD MET A 1 18.025 64.539 -16.628 1.00 0.00 S ATOM 8 CE MET A 1 18.067 65.627 -15.206 1.00 0.00 C ATOM 0 H1 MET A 1 17.567 62.324 -19.301 1.00 0.00 H new ATOM 0 H2 MET A 1 16.216 61.900 -18.364 1.00 0.00 H new ATOM 0 H3 MET A 1 17.162 63.242 -17.931 1.00 0.00 H new ATOM 0 HA MET A 1 18.290 60.519 -18.071 1.00 0.00 H new ATOM 0 HB2 MET A 1 20.046 61.405 -16.734 1.00 0.00 H new ATOM 0 HB3 MET A 1 19.777 62.562 -18.022 1.00 0.00 H new ATOM 0 HG2 MET A 1 18.790 62.811 -15.158 1.00 0.00 H new ATOM 0 HG3 MET A 1 20.130 63.688 -15.869 1.00 0.00 H new ATOM 0 HE1 MET A 1 17.414 66.482 -15.382 1.00 0.00 H new ATOM 0 HE2 MET A 1 17.726 65.086 -14.324 1.00 0.00 H new ATOM 0 HE3 MET A 1 19.087 65.977 -15.045 1.00 0.00 H new ATOM 20 N VAL A 2 17.873 60.122 -15.456 1.00 0.00 N ATOM 21 CA VAL A 2 17.274 59.708 -14.200 1.00 0.00 C ATOM 22 C VAL A 2 18.348 59.552 -13.127 1.00 0.00 C ATOM 23 O VAL A 2 19.464 59.109 -13.410 1.00 0.00 O ATOM 24 CB VAL A 2 16.476 58.388 -14.351 1.00 0.00 C ATOM 25 CG1 VAL A 2 17.403 57.194 -14.530 1.00 0.00 C ATOM 26 CG2 VAL A 2 15.549 58.179 -13.162 1.00 0.00 C ATOM 0 H VAL A 2 18.766 59.677 -15.666 1.00 0.00 H new ATOM 0 HA VAL A 2 16.574 60.487 -13.898 1.00 0.00 H new ATOM 0 HB VAL A 2 15.867 58.471 -15.251 1.00 0.00 H new ATOM 0 HG11 VAL A 2 16.810 56.285 -14.633 1.00 0.00 H new ATOM 0 HG12 VAL A 2 18.009 57.335 -15.425 1.00 0.00 H new ATOM 0 HG13 VAL A 2 18.055 57.106 -13.661 1.00 0.00 H new ATOM 0 HG21 VAL A 2 14.999 57.247 -13.289 1.00 0.00 H new ATOM 0 HG22 VAL A 2 16.138 58.131 -12.246 1.00 0.00 H new ATOM 0 HG23 VAL A 2 14.846 59.009 -13.098 1.00 0.00 H new ATOM 36 N CYS A 3 18.010 59.945 -11.913 1.00 0.00 N ATOM 37 CA CYS A 3 18.909 59.823 -10.778 1.00 0.00 C ATOM 38 C CYS A 3 18.111 59.367 -9.564 1.00 0.00 C ATOM 39 O CYS A 3 16.880 59.453 -9.577 1.00 0.00 O ATOM 40 CB CYS A 3 19.590 61.168 -10.488 1.00 0.00 C ATOM 41 SG CYS A 3 20.582 61.823 -11.864 1.00 0.00 S ATOM 0 H CYS A 3 17.106 60.358 -11.685 1.00 0.00 H new ATOM 0 HA CYS A 3 19.684 59.091 -11.005 1.00 0.00 H new ATOM 0 HB2 CYS A 3 18.825 61.900 -10.228 1.00 0.00 H new ATOM 0 HB3 CYS A 3 20.233 61.055 -9.615 1.00 0.00 H new ATOM 46 N PRO A 4 18.779 58.848 -8.515 1.00 0.00 N ATOM 47 CA PRO A 4 18.105 58.490 -7.263 1.00 0.00 C ATOM 48 C PRO A 4 17.288 59.659 -6.725 1.00 0.00 C ATOM 49 O PRO A 4 17.712 60.811 -6.826 1.00 0.00 O ATOM 50 CB PRO A 4 19.262 58.153 -6.321 1.00 0.00 C ATOM 51 CG PRO A 4 20.369 57.728 -7.221 1.00 0.00 C ATOM 52 CD PRO A 4 20.225 58.558 -8.467 1.00 0.00 C ATOM 0 HA PRO A 4 17.399 57.669 -7.382 1.00 0.00 H new ATOM 0 HB2 PRO A 4 19.549 59.017 -5.721 1.00 0.00 H new ATOM 0 HB3 PRO A 4 18.989 57.359 -5.626 1.00 0.00 H new ATOM 0 HG2 PRO A 4 21.339 57.892 -6.752 1.00 0.00 H new ATOM 0 HG3 PRO A 4 20.301 56.664 -7.449 1.00 0.00 H new ATOM 0 HD2 PRO A 4 20.817 59.472 -8.413 1.00 0.00 H new ATOM 0 HD3 PRO A 4 20.556 58.016 -9.352 1.00 0.00 H new ATOM 60 N ILE A 5 16.119 59.364 -6.162 1.00 0.00 N ATOM 61 CA ILE A 5 15.192 60.408 -5.739 1.00 0.00 C ATOM 62 C ILE A 5 15.679 61.107 -4.472 1.00 0.00 C ATOM 63 O ILE A 5 15.262 60.785 -3.360 1.00 0.00 O ATOM 64 CB ILE A 5 13.764 59.857 -5.529 1.00 0.00 C ATOM 65 CG1 ILE A 5 13.313 59.086 -6.776 1.00 0.00 C ATOM 66 CG2 ILE A 5 12.795 60.997 -5.227 1.00 0.00 C ATOM 67 CD1 ILE A 5 11.924 58.492 -6.662 1.00 0.00 C ATOM 0 H ILE A 5 15.793 58.413 -5.989 1.00 0.00 H new ATOM 0 HA ILE A 5 15.156 61.141 -6.545 1.00 0.00 H new ATOM 0 HB ILE A 5 13.769 59.176 -4.678 1.00 0.00 H new ATOM 0 HG12 ILE A 5 13.341 59.756 -7.635 1.00 0.00 H new ATOM 0 HG13 ILE A 5 14.025 58.285 -6.973 1.00 0.00 H new ATOM 0 HG21 ILE A 5 11.793 60.594 -5.081 1.00 0.00 H new ATOM 0 HG22 ILE A 5 13.113 61.515 -4.322 1.00 0.00 H new ATOM 0 HG23 ILE A 5 12.786 61.698 -6.062 1.00 0.00 H new ATOM 0 HD11 ILE A 5 11.678 57.963 -7.583 1.00 0.00 H new ATOM 0 HD12 ILE A 5 11.894 57.795 -5.824 1.00 0.00 H new ATOM 0 HD13 ILE A 5 11.200 59.290 -6.497 1.00 0.00 H new ATOM 79 N ASP A 6 16.605 62.032 -4.683 1.00 0.00 N ATOM 80 CA ASP A 6 17.151 62.902 -3.646 1.00 0.00 C ATOM 81 C ASP A 6 18.237 63.758 -4.269 1.00 0.00 C ATOM 82 O ASP A 6 18.215 64.985 -4.160 1.00 0.00 O ATOM 83 CB ASP A 6 17.739 62.124 -2.465 1.00 0.00 C ATOM 84 CG ASP A 6 18.495 63.036 -1.512 1.00 0.00 C ATOM 85 OD1 ASP A 6 17.844 63.797 -0.758 1.00 0.00 O ATOM 86 OD2 ASP A 6 19.740 63.018 -1.536 1.00 0.00 O ATOM 0 H ASP A 6 17.009 62.204 -5.604 1.00 0.00 H new ATOM 0 HA ASP A 6 16.335 63.508 -3.252 1.00 0.00 H new ATOM 0 HB2 ASP A 6 16.937 61.619 -1.926 1.00 0.00 H new ATOM 0 HB3 ASP A 6 18.410 61.350 -2.837 1.00 0.00 H new ATOM 91 N TRP A 7 19.166 63.085 -4.952 1.00 0.00 N ATOM 92 CA TRP A 7 20.256 63.745 -5.666 1.00 0.00 C ATOM 93 C TRP A 7 19.738 64.973 -6.402 1.00 0.00 C ATOM 94 O TRP A 7 18.819 64.878 -7.216 1.00 0.00 O ATOM 95 CB TRP A 7 20.903 62.777 -6.664 1.00 0.00 C ATOM 96 CG TRP A 7 21.693 61.668 -6.030 1.00 0.00 C ATOM 97 CD1 TRP A 7 21.259 60.769 -5.098 1.00 0.00 C ATOM 98 CD2 TRP A 7 23.059 61.328 -6.303 1.00 0.00 C ATOM 99 NE1 TRP A 7 22.271 59.896 -4.772 1.00 0.00 N ATOM 100 CE2 TRP A 7 23.386 60.219 -5.498 1.00 0.00 C ATOM 101 CE3 TRP A 7 24.037 61.857 -7.148 1.00 0.00 C ATOM 102 CZ2 TRP A 7 24.650 59.630 -5.518 1.00 0.00 C ATOM 103 CZ3 TRP A 7 25.290 61.273 -7.165 1.00 0.00 C ATOM 104 CH2 TRP A 7 25.586 60.169 -6.356 1.00 0.00 C ATOM 0 H TRP A 7 19.182 62.068 -5.024 1.00 0.00 H new ATOM 0 HA TRP A 7 21.005 64.057 -4.938 1.00 0.00 H new ATOM 0 HB2 TRP A 7 20.122 62.340 -7.286 1.00 0.00 H new ATOM 0 HB3 TRP A 7 21.559 63.342 -7.326 1.00 0.00 H new ATOM 0 HD1 TRP A 7 20.264 60.747 -4.677 1.00 0.00 H new ATOM 0 HE1 TRP A 7 22.202 59.133 -4.099 1.00 0.00 H new ATOM 0 HE3 TRP A 7 23.818 62.707 -7.777 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 24.881 58.779 -4.894 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 26.054 61.675 -7.814 1.00 0.00 H new ATOM 0 HH2 TRP A 7 26.574 59.734 -6.395 1.00 0.00 H new ATOM 115 N ARG A 8 20.333 66.120 -6.114 1.00 0.00 N ATOM 116 CA ARG A 8 19.821 67.382 -6.614 1.00 0.00 C ATOM 117 C ARG A 8 20.085 67.485 -8.109 1.00 0.00 C ATOM 118 O ARG A 8 21.228 67.653 -8.537 1.00 0.00 O ATOM 119 CB ARG A 8 20.475 68.562 -5.884 1.00 0.00 C ATOM 120 CG ARG A 8 20.558 68.407 -4.366 1.00 0.00 C ATOM 121 CD ARG A 8 19.196 68.184 -3.719 1.00 0.00 C ATOM 122 NE ARG A 8 19.268 68.284 -2.252 1.00 0.00 N ATOM 123 CZ ARG A 8 18.962 67.286 -1.407 1.00 0.00 C ATOM 124 NH1 ARG A 8 18.562 66.116 -1.868 1.00 0.00 N ATOM 125 NH2 ARG A 8 19.061 67.466 -0.096 1.00 0.00 N ATOM 0 H ARG A 8 21.170 66.201 -5.537 1.00 0.00 H new ATOM 0 HA ARG A 8 18.747 67.419 -6.431 1.00 0.00 H new ATOM 0 HB2 ARG A 8 21.482 68.702 -6.277 1.00 0.00 H new ATOM 0 HB3 ARG A 8 19.915 69.469 -6.113 1.00 0.00 H new ATOM 0 HG2 ARG A 8 21.211 67.568 -4.126 1.00 0.00 H new ATOM 0 HG3 ARG A 8 21.016 69.299 -3.939 1.00 0.00 H new ATOM 0 HD2 ARG A 8 18.487 68.919 -4.100 1.00 0.00 H new ATOM 0 HD3 ARG A 8 18.817 67.201 -3.999 1.00 0.00 H new ATOM 0 HE ARG A 8 19.571 69.171 -1.850 1.00 0.00 H new ATOM 0 HH11 ARG A 8 18.483 65.964 -2.874 1.00 0.00 H new ATOM 0 HH12 ARG A 8 18.332 65.364 -1.219 1.00 0.00 H new ATOM 0 HH21 ARG A 8 19.370 68.365 0.273 1.00 0.00 H new ATOM 0 HH22 ARG A 8 18.828 66.705 0.542 1.00 0.00 H new ATOM 139 N ALA A 9 19.027 67.350 -8.893 1.00 0.00 N ATOM 140 CA ALA A 9 19.139 67.353 -10.341 1.00 0.00 C ATOM 141 C ALA A 9 19.260 68.769 -10.881 1.00 0.00 C ATOM 142 O ALA A 9 18.455 69.643 -10.560 1.00 0.00 O ATOM 143 CB ALA A 9 17.946 66.645 -10.966 1.00 0.00 C ATOM 0 H ALA A 9 18.075 67.236 -8.546 1.00 0.00 H new ATOM 0 HA ALA A 9 20.047 66.814 -10.610 1.00 0.00 H new ATOM 0 HB1 ALA A 9 18.044 66.656 -12.051 1.00 0.00 H new ATOM 0 HB2 ALA A 9 17.910 65.614 -10.615 1.00 0.00 H new ATOM 0 HB3 ALA A 9 17.028 67.158 -10.680 1.00 0.00 H new ATOM 149 N PHE A 10 20.273 68.983 -11.699 1.00 0.00 N ATOM 150 CA PHE A 10 20.511 70.275 -12.310 1.00 0.00 C ATOM 151 C PHE A 10 20.933 70.085 -13.763 1.00 0.00 C ATOM 152 O PHE A 10 22.078 69.719 -14.045 1.00 0.00 O ATOM 153 CB PHE A 10 21.590 71.029 -11.530 1.00 0.00 C ATOM 154 CG PHE A 10 21.882 72.411 -12.046 1.00 0.00 C ATOM 155 CD1 PHE A 10 21.065 73.477 -11.708 1.00 0.00 C ATOM 156 CD2 PHE A 10 22.980 72.644 -12.861 1.00 0.00 C ATOM 157 CE1 PHE A 10 21.334 74.749 -12.177 1.00 0.00 C ATOM 158 CE2 PHE A 10 23.254 73.913 -13.330 1.00 0.00 C ATOM 159 CZ PHE A 10 22.431 74.967 -12.988 1.00 0.00 C ATOM 0 H PHE A 10 20.952 68.267 -11.958 1.00 0.00 H new ATOM 0 HA PHE A 10 19.593 70.863 -12.286 1.00 0.00 H new ATOM 0 HB2 PHE A 10 21.282 71.102 -10.487 1.00 0.00 H new ATOM 0 HB3 PHE A 10 22.510 70.445 -11.551 1.00 0.00 H new ATOM 0 HD1 PHE A 10 20.208 73.313 -11.071 1.00 0.00 H new ATOM 0 HD2 PHE A 10 23.628 71.823 -13.132 1.00 0.00 H new ATOM 0 HE1 PHE A 10 20.687 75.572 -11.910 1.00 0.00 H new ATOM 0 HE2 PHE A 10 24.112 74.081 -13.964 1.00 0.00 H new ATOM 0 HZ PHE A 10 22.644 75.961 -13.354 1.00 0.00 H new ATOM 169 N GLN A 11 19.986 70.313 -14.668 1.00 0.00 N ATOM 170 CA GLN A 11 20.207 70.188 -16.111 1.00 0.00 C ATOM 171 C GLN A 11 20.619 68.768 -16.511 1.00 0.00 C ATOM 172 O GLN A 11 19.771 67.931 -16.805 1.00 0.00 O ATOM 173 CB GLN A 11 21.248 71.200 -16.603 1.00 0.00 C ATOM 174 CG GLN A 11 20.828 72.650 -16.410 1.00 0.00 C ATOM 175 CD GLN A 11 21.852 73.635 -16.939 1.00 0.00 C ATOM 176 OE1 GLN A 11 22.575 73.245 -17.976 1.00 0.00 O flip ATOM 177 NE2 GLN A 11 21.987 74.740 -16.424 1.00 0.00 N flip ATOM 0 H GLN A 11 19.036 70.592 -14.422 1.00 0.00 H new ATOM 0 HA GLN A 11 19.254 70.405 -16.593 1.00 0.00 H new ATOM 0 HB2 GLN A 11 22.186 71.029 -16.075 1.00 0.00 H new ATOM 0 HB3 GLN A 11 21.441 71.024 -17.661 1.00 0.00 H new ATOM 0 HG2 GLN A 11 19.876 72.818 -16.914 1.00 0.00 H new ATOM 0 HG3 GLN A 11 20.665 72.838 -15.349 1.00 0.00 H new ATOM 0 HE21 GLN A 11 21.410 75.004 -15.625 1.00 0.00 H new ATOM 0 HE22 GLN A 11 22.676 75.395 -16.795 1.00 0.00 H new ATOM 186 N SER A 12 21.919 68.500 -16.499 1.00 0.00 N ATOM 187 CA SER A 12 22.437 67.216 -16.951 1.00 0.00 C ATOM 188 C SER A 12 23.200 66.503 -15.837 1.00 0.00 C ATOM 189 O SER A 12 23.834 65.475 -16.069 1.00 0.00 O ATOM 190 CB SER A 12 23.366 67.429 -18.147 1.00 0.00 C ATOM 191 OG SER A 12 22.764 68.264 -19.123 1.00 0.00 O ATOM 0 H SER A 12 22.633 69.155 -16.181 1.00 0.00 H new ATOM 0 HA SER A 12 21.591 66.593 -17.241 1.00 0.00 H new ATOM 0 HB2 SER A 12 24.301 67.876 -17.809 1.00 0.00 H new ATOM 0 HB3 SER A 12 23.616 66.466 -18.593 1.00 0.00 H new ATOM 0 HG SER A 12 23.380 68.385 -19.875 1.00 0.00 H new ATOM 197 N ASN A 13 23.146 67.053 -14.632 1.00 0.00 N ATOM 198 CA ASN A 13 23.893 66.493 -13.514 1.00 0.00 C ATOM 199 C ASN A 13 23.000 66.314 -12.298 1.00 0.00 C ATOM 200 O ASN A 13 21.962 66.960 -12.178 1.00 0.00 O ATOM 201 CB ASN A 13 25.065 67.405 -13.139 1.00 0.00 C ATOM 202 CG ASN A 13 26.080 67.568 -14.255 1.00 0.00 C ATOM 203 OD1 ASN A 13 27.036 66.801 -14.362 1.00 0.00 O ATOM 204 ND2 ASN A 13 25.893 68.589 -15.079 1.00 0.00 N ATOM 0 H ASN A 13 22.596 67.881 -14.404 1.00 0.00 H new ATOM 0 HA ASN A 13 24.272 65.520 -13.827 1.00 0.00 H new ATOM 0 HB2 ASN A 13 24.679 68.386 -12.862 1.00 0.00 H new ATOM 0 HB3 ASN A 13 25.565 67.000 -12.259 1.00 0.00 H new ATOM 0 HD21 ASN A 13 26.555 68.762 -15.836 1.00 0.00 H new ATOM 0 HD22 ASN A 13 25.087 69.202 -14.957 1.00 0.00 H new ATOM 211 N CYS A 14 23.417 65.439 -11.401 1.00 0.00 N ATOM 212 CA CYS A 14 22.719 65.222 -10.143 1.00 0.00 C ATOM 213 C CYS A 14 23.729 65.242 -9.000 1.00 0.00 C ATOM 214 O CYS A 14 24.734 64.533 -9.042 1.00 0.00 O ATOM 215 CB CYS A 14 21.958 63.895 -10.172 1.00 0.00 C ATOM 216 SG CYS A 14 20.675 63.799 -11.458 1.00 0.00 S ATOM 0 H CYS A 14 24.247 64.859 -11.522 1.00 0.00 H new ATOM 0 HA CYS A 14 21.991 66.019 -9.991 1.00 0.00 H new ATOM 0 HB2 CYS A 14 22.670 63.084 -10.324 1.00 0.00 H new ATOM 0 HB3 CYS A 14 21.494 63.734 -9.199 1.00 0.00 H new ATOM 221 N TYR A 15 23.469 66.060 -7.988 1.00 0.00 N ATOM 222 CA TYR A 15 24.451 66.309 -6.936 1.00 0.00 C ATOM 223 C TYR A 15 23.978 65.804 -5.581 1.00 0.00 C ATOM 224 O TYR A 15 22.872 66.118 -5.142 1.00 0.00 O ATOM 225 CB TYR A 15 24.735 67.809 -6.846 1.00 0.00 C ATOM 226 CG TYR A 15 25.187 68.403 -8.154 1.00 0.00 C ATOM 227 CD1 TYR A 15 26.502 68.291 -8.565 1.00 0.00 C ATOM 228 CD2 TYR A 15 24.291 69.053 -8.991 1.00 0.00 C ATOM 229 CE1 TYR A 15 26.918 68.812 -9.771 1.00 0.00 C ATOM 230 CE2 TYR A 15 24.701 69.572 -10.202 1.00 0.00 C ATOM 231 CZ TYR A 15 26.016 69.451 -10.585 1.00 0.00 C ATOM 232 OH TYR A 15 26.426 69.952 -11.796 1.00 0.00 O ATOM 0 H TYR A 15 22.589 66.562 -7.872 1.00 0.00 H new ATOM 0 HA TYR A 15 25.359 65.765 -7.197 1.00 0.00 H new ATOM 0 HB2 TYR A 15 23.834 68.324 -6.512 1.00 0.00 H new ATOM 0 HB3 TYR A 15 25.501 67.983 -6.090 1.00 0.00 H new ATOM 0 HD1 TYR A 15 27.215 67.787 -7.930 1.00 0.00 H new ATOM 0 HD2 TYR A 15 23.259 69.154 -8.690 1.00 0.00 H new ATOM 0 HE1 TYR A 15 27.950 68.718 -10.075 1.00 0.00 H new ATOM 0 HE2 TYR A 15 23.992 70.071 -10.846 1.00 0.00 H new ATOM 0 HH TYR A 15 27.377 70.183 -11.749 1.00 0.00 H new ATOM 242 N PHE A 16 24.825 65.030 -4.921 1.00 0.00 N ATOM 243 CA PHE A 16 24.550 64.580 -3.565 1.00 0.00 C ATOM 244 C PHE A 16 25.660 65.041 -2.624 1.00 0.00 C ATOM 245 O PHE A 16 26.819 64.639 -2.770 1.00 0.00 O ATOM 246 CB PHE A 16 24.417 63.054 -3.527 1.00 0.00 C ATOM 247 CG PHE A 16 24.060 62.506 -2.174 1.00 0.00 C ATOM 248 CD1 PHE A 16 22.948 62.973 -1.495 1.00 0.00 C ATOM 249 CD2 PHE A 16 24.832 61.518 -1.588 1.00 0.00 C ATOM 250 CE1 PHE A 16 22.614 62.467 -0.253 1.00 0.00 C ATOM 251 CE2 PHE A 16 24.503 61.007 -0.347 1.00 0.00 C ATOM 252 CZ PHE A 16 23.392 61.482 0.321 1.00 0.00 C ATOM 0 H PHE A 16 25.711 64.699 -5.303 1.00 0.00 H new ATOM 0 HA PHE A 16 23.608 65.017 -3.235 1.00 0.00 H new ATOM 0 HB2 PHE A 16 23.656 62.748 -4.244 1.00 0.00 H new ATOM 0 HB3 PHE A 16 25.358 62.609 -3.851 1.00 0.00 H new ATOM 0 HD1 PHE A 16 22.334 63.742 -1.941 1.00 0.00 H new ATOM 0 HD2 PHE A 16 25.702 61.142 -2.107 1.00 0.00 H new ATOM 0 HE1 PHE A 16 21.745 62.842 0.268 1.00 0.00 H new ATOM 0 HE2 PHE A 16 25.114 60.237 0.100 1.00 0.00 H new ATOM 0 HZ PHE A 16 23.132 61.084 1.291 1.00 0.00 H new ATOM 262 N PRO A 17 25.326 65.921 -1.668 1.00 0.00 N ATOM 263 CA PRO A 17 26.265 66.414 -0.672 1.00 0.00 C ATOM 264 C PRO A 17 26.315 65.524 0.567 1.00 0.00 C ATOM 265 O PRO A 17 25.296 65.283 1.213 1.00 0.00 O ATOM 266 CB PRO A 17 25.706 67.801 -0.311 1.00 0.00 C ATOM 267 CG PRO A 17 24.358 67.905 -0.970 1.00 0.00 C ATOM 268 CD PRO A 17 24.011 66.536 -1.492 1.00 0.00 C ATOM 0 HA PRO A 17 27.287 66.435 -1.051 1.00 0.00 H new ATOM 0 HB2 PRO A 17 25.619 67.915 0.770 1.00 0.00 H new ATOM 0 HB3 PRO A 17 26.371 68.590 -0.662 1.00 0.00 H new ATOM 0 HG2 PRO A 17 23.607 68.247 -0.258 1.00 0.00 H new ATOM 0 HG3 PRO A 17 24.382 68.632 -1.782 1.00 0.00 H new ATOM 0 HD2 PRO A 17 23.393 65.978 -0.788 1.00 0.00 H new ATOM 0 HD3 PRO A 17 23.458 66.588 -2.430 1.00 0.00 H new ATOM 276 N LEU A 18 27.502 65.037 0.898 1.00 0.00 N ATOM 277 CA LEU A 18 27.677 64.212 2.080 1.00 0.00 C ATOM 278 C LEU A 18 28.461 64.981 3.134 1.00 0.00 C ATOM 279 O LEU A 18 29.418 65.691 2.815 1.00 0.00 O ATOM 280 CB LEU A 18 28.393 62.898 1.740 1.00 0.00 C ATOM 281 CG LEU A 18 27.720 62.042 0.661 1.00 0.00 C ATOM 282 CD1 LEU A 18 28.226 62.415 -0.724 1.00 0.00 C ATOM 283 CD2 LEU A 18 27.942 60.563 0.936 1.00 0.00 C ATOM 0 H LEU A 18 28.356 65.200 0.364 1.00 0.00 H new ATOM 0 HA LEU A 18 26.691 63.963 2.473 1.00 0.00 H new ATOM 0 HB2 LEU A 18 29.407 63.130 1.415 1.00 0.00 H new ATOM 0 HB3 LEU A 18 28.478 62.304 2.650 1.00 0.00 H new ATOM 0 HG LEU A 18 26.648 62.239 0.691 1.00 0.00 H new ATOM 0 HD11 LEU A 18 27.733 61.793 -1.471 1.00 0.00 H new ATOM 0 HD12 LEU A 18 28.005 63.464 -0.922 1.00 0.00 H new ATOM 0 HD13 LEU A 18 29.303 62.256 -0.773 1.00 0.00 H new ATOM 0 HD21 LEU A 18 27.457 59.972 0.159 1.00 0.00 H new ATOM 0 HD22 LEU A 18 29.011 60.350 0.940 1.00 0.00 H new ATOM 0 HD23 LEU A 18 27.517 60.306 1.906 1.00 0.00 H new ATOM 295 N THR A 19 28.048 64.843 4.385 1.00 0.00 N ATOM 296 CA THR A 19 28.656 65.581 5.480 1.00 0.00 C ATOM 297 C THR A 19 29.551 64.685 6.323 1.00 0.00 C ATOM 298 O THR A 19 29.939 65.048 7.434 1.00 0.00 O ATOM 299 CB THR A 19 27.574 66.204 6.379 1.00 0.00 C ATOM 300 OG1 THR A 19 26.607 65.206 6.739 1.00 0.00 O ATOM 301 CG2 THR A 19 26.880 67.358 5.673 1.00 0.00 C ATOM 0 H THR A 19 27.289 64.222 4.667 1.00 0.00 H new ATOM 0 HA THR A 19 29.265 66.371 5.040 1.00 0.00 H new ATOM 0 HB THR A 19 28.055 66.589 7.278 1.00 0.00 H new ATOM 0 HG1 THR A 19 25.921 65.607 7.313 1.00 0.00 H new ATOM 0 HG21 THR A 19 26.120 67.781 6.329 1.00 0.00 H new ATOM 0 HG22 THR A 19 27.613 68.126 5.424 1.00 0.00 H new ATOM 0 HG23 THR A 19 26.409 66.995 4.759 1.00 0.00 H new ATOM 309 N ASP A 20 29.883 63.521 5.789 1.00 0.00 N ATOM 310 CA ASP A 20 30.717 62.567 6.502 1.00 0.00 C ATOM 311 C ASP A 20 32.185 62.884 6.269 1.00 0.00 C ATOM 312 O ASP A 20 32.525 63.626 5.348 1.00 0.00 O ATOM 313 CB ASP A 20 30.401 61.132 6.061 1.00 0.00 C ATOM 314 CG ASP A 20 30.773 60.853 4.615 1.00 0.00 C ATOM 315 OD1 ASP A 20 30.452 61.680 3.739 1.00 0.00 O ATOM 316 OD2 ASP A 20 31.379 59.794 4.347 1.00 0.00 O ATOM 0 H ASP A 20 29.587 63.213 4.863 1.00 0.00 H new ATOM 0 HA ASP A 20 30.504 62.648 7.568 1.00 0.00 H new ATOM 0 HB2 ASP A 20 30.934 60.435 6.707 1.00 0.00 H new ATOM 0 HB3 ASP A 20 29.336 60.943 6.198 1.00 0.00 H new ATOM 321 N ASN A 21 33.047 62.349 7.119 1.00 0.00 N ATOM 322 CA ASN A 21 34.476 62.587 7.000 1.00 0.00 C ATOM 323 C ASN A 21 35.106 61.609 6.023 1.00 0.00 C ATOM 324 O ASN A 21 35.068 60.399 6.234 1.00 0.00 O ATOM 325 CB ASN A 21 35.166 62.477 8.364 1.00 0.00 C ATOM 326 CG ASN A 21 34.745 63.573 9.322 1.00 0.00 C ATOM 327 OD1 ASN A 21 33.799 63.413 10.091 1.00 0.00 O ATOM 328 ND2 ASN A 21 35.443 64.698 9.281 1.00 0.00 N ATOM 0 H ASN A 21 32.782 61.747 7.899 1.00 0.00 H new ATOM 0 HA ASN A 21 34.612 63.600 6.621 1.00 0.00 H new ATOM 0 HB2 ASN A 21 34.937 61.507 8.805 1.00 0.00 H new ATOM 0 HB3 ASN A 21 36.246 62.517 8.224 1.00 0.00 H new ATOM 0 HD21 ASN A 21 35.202 65.471 9.902 1.00 0.00 H new ATOM 0 HD22 ASN A 21 36.221 64.792 8.628 1.00 0.00 H new ATOM 335 N LYS A 22 35.672 62.149 4.953 1.00 0.00 N ATOM 336 CA LYS A 22 36.354 61.361 3.937 1.00 0.00 C ATOM 337 C LYS A 22 37.479 62.177 3.323 1.00 0.00 C ATOM 338 O LYS A 22 37.344 63.384 3.131 1.00 0.00 O ATOM 339 CB LYS A 22 35.392 60.930 2.830 1.00 0.00 C ATOM 340 CG LYS A 22 34.475 59.778 3.208 1.00 0.00 C ATOM 341 CD LYS A 22 35.228 58.458 3.237 1.00 0.00 C ATOM 342 CE LYS A 22 35.278 57.859 4.631 1.00 0.00 C ATOM 343 NZ LYS A 22 36.675 57.709 5.131 1.00 0.00 N ATOM 0 H LYS A 22 35.671 63.151 4.765 1.00 0.00 H new ATOM 0 HA LYS A 22 36.754 60.469 4.419 1.00 0.00 H new ATOM 0 HB2 LYS A 22 34.781 61.786 2.543 1.00 0.00 H new ATOM 0 HB3 LYS A 22 35.972 60.644 1.953 1.00 0.00 H new ATOM 0 HG2 LYS A 22 34.033 59.968 4.186 1.00 0.00 H new ATOM 0 HG3 LYS A 22 33.654 59.715 2.494 1.00 0.00 H new ATOM 0 HD2 LYS A 22 34.749 57.753 2.557 1.00 0.00 H new ATOM 0 HD3 LYS A 22 36.244 58.613 2.873 1.00 0.00 H new ATOM 0 HE2 LYS A 22 34.715 58.492 5.317 1.00 0.00 H new ATOM 0 HE3 LYS A 22 34.790 56.884 4.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 36.676 57.729 6.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 37.066 56.803 4.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 37.259 58.490 4.769 1.00 0.00 H new ATOM 357 N THR A 23 38.588 61.524 3.041 1.00 0.00 N ATOM 358 CA THR A 23 39.692 62.168 2.348 1.00 0.00 C ATOM 359 C THR A 23 39.318 62.372 0.889 1.00 0.00 C ATOM 360 O THR A 23 38.266 61.905 0.446 1.00 0.00 O ATOM 361 CB THR A 23 40.988 61.331 2.421 1.00 0.00 C ATOM 362 OG1 THR A 23 40.799 60.068 1.773 1.00 0.00 O ATOM 363 CG2 THR A 23 41.412 61.099 3.860 1.00 0.00 C ATOM 0 H THR A 23 38.752 60.546 3.280 1.00 0.00 H new ATOM 0 HA THR A 23 39.879 63.124 2.838 1.00 0.00 H new ATOM 0 HB THR A 23 41.773 61.890 1.912 1.00 0.00 H new ATOM 0 HG1 THR A 23 41.627 59.547 1.824 1.00 0.00 H new ATOM 0 HG21 THR A 23 42.327 60.507 3.879 1.00 0.00 H new ATOM 0 HG22 THR A 23 41.590 62.058 4.346 1.00 0.00 H new ATOM 0 HG23 THR A 23 40.623 60.565 4.390 1.00 0.00 H new ATOM 371 N TRP A 24 40.168 63.048 0.132 1.00 0.00 N ATOM 372 CA TRP A 24 39.903 63.243 -1.285 1.00 0.00 C ATOM 373 C TRP A 24 39.865 61.887 -1.987 1.00 0.00 C ATOM 374 O TRP A 24 39.014 61.635 -2.840 1.00 0.00 O ATOM 375 CB TRP A 24 40.963 64.146 -1.917 1.00 0.00 C ATOM 376 CG TRP A 24 40.535 64.708 -3.236 1.00 0.00 C ATOM 377 CD1 TRP A 24 39.785 65.827 -3.436 1.00 0.00 C ATOM 378 CD2 TRP A 24 40.820 64.179 -4.535 1.00 0.00 C ATOM 379 NE1 TRP A 24 39.582 66.027 -4.776 1.00 0.00 N ATOM 380 CE2 TRP A 24 40.208 65.031 -5.473 1.00 0.00 C ATOM 381 CE3 TRP A 24 41.533 63.068 -4.998 1.00 0.00 C ATOM 382 CZ2 TRP A 24 40.286 64.808 -6.842 1.00 0.00 C ATOM 383 CZ3 TRP A 24 41.611 62.848 -6.359 1.00 0.00 C ATOM 384 CH2 TRP A 24 40.990 63.715 -7.267 1.00 0.00 C ATOM 0 H TRP A 24 41.036 63.466 0.469 1.00 0.00 H new ATOM 0 HA TRP A 24 38.936 63.733 -1.400 1.00 0.00 H new ATOM 0 HB2 TRP A 24 41.189 64.965 -1.235 1.00 0.00 H new ATOM 0 HB3 TRP A 24 41.884 63.579 -2.051 1.00 0.00 H new ATOM 0 HD1 TRP A 24 39.405 66.465 -2.651 1.00 0.00 H new ATOM 0 HE1 TRP A 24 39.050 66.794 -5.187 1.00 0.00 H new ATOM 0 HE3 TRP A 24 42.014 62.395 -4.304 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 39.808 65.474 -7.545 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 42.159 61.994 -6.729 1.00 0.00 H new ATOM 0 HH2 TRP A 24 41.069 63.516 -8.326 1.00 0.00 H new ATOM 395 N ALA A 25 40.773 61.006 -1.583 1.00 0.00 N ATOM 396 CA ALA A 25 40.833 59.656 -2.126 1.00 0.00 C ATOM 397 C ALA A 25 39.626 58.839 -1.678 1.00 0.00 C ATOM 398 O ALA A 25 38.991 58.162 -2.481 1.00 0.00 O ATOM 399 CB ALA A 25 42.121 58.973 -1.692 1.00 0.00 C ATOM 0 H ALA A 25 41.481 61.205 -0.877 1.00 0.00 H new ATOM 0 HA ALA A 25 40.817 59.722 -3.214 1.00 0.00 H new ATOM 0 HB1 ALA A 25 42.155 57.964 -2.104 1.00 0.00 H new ATOM 0 HB2 ALA A 25 42.976 59.543 -2.057 1.00 0.00 H new ATOM 0 HB3 ALA A 25 42.157 58.922 -0.604 1.00 0.00 H new ATOM 405 N GLU A 26 39.319 58.918 -0.386 1.00 0.00 N ATOM 406 CA GLU A 26 38.187 58.198 0.192 1.00 0.00 C ATOM 407 C GLU A 26 36.868 58.634 -0.438 1.00 0.00 C ATOM 408 O GLU A 26 35.970 57.819 -0.651 1.00 0.00 O ATOM 409 CB GLU A 26 38.146 58.430 1.700 1.00 0.00 C ATOM 410 CG GLU A 26 39.153 57.602 2.477 1.00 0.00 C ATOM 411 CD GLU A 26 38.704 56.170 2.650 1.00 0.00 C ATOM 412 OE1 GLU A 26 37.877 55.916 3.550 1.00 0.00 O ATOM 413 OE2 GLU A 26 39.171 55.303 1.883 1.00 0.00 O ATOM 0 H GLU A 26 39.843 59.478 0.286 1.00 0.00 H new ATOM 0 HA GLU A 26 38.320 57.136 -0.013 1.00 0.00 H new ATOM 0 HB2 GLU A 26 38.327 59.486 1.900 1.00 0.00 H new ATOM 0 HB3 GLU A 26 37.144 58.203 2.066 1.00 0.00 H new ATOM 0 HG2 GLU A 26 40.112 57.620 1.959 1.00 0.00 H new ATOM 0 HG3 GLU A 26 39.311 58.052 3.457 1.00 0.00 H new ATOM 420 N SER A 27 36.759 59.921 -0.733 1.00 0.00 N ATOM 421 CA SER A 27 35.565 60.456 -1.369 1.00 0.00 C ATOM 422 C SER A 27 35.330 59.791 -2.721 1.00 0.00 C ATOM 423 O SER A 27 34.228 59.311 -2.998 1.00 0.00 O ATOM 424 CB SER A 27 35.685 61.971 -1.529 1.00 0.00 C ATOM 425 OG SER A 27 35.772 62.608 -0.267 1.00 0.00 O ATOM 0 H SER A 27 37.483 60.614 -0.542 1.00 0.00 H new ATOM 0 HA SER A 27 34.708 60.240 -0.731 1.00 0.00 H new ATOM 0 HB2 SER A 27 36.568 62.209 -2.122 1.00 0.00 H new ATOM 0 HB3 SER A 27 34.822 62.352 -2.074 1.00 0.00 H new ATOM 0 HG SER A 27 36.620 62.369 0.162 1.00 0.00 H new ATOM 431 N GLU A 28 36.372 59.735 -3.546 1.00 0.00 N ATOM 432 CA GLU A 28 36.270 59.105 -4.859 1.00 0.00 C ATOM 433 C GLU A 28 36.116 57.590 -4.740 1.00 0.00 C ATOM 434 O GLU A 28 35.643 56.941 -5.663 1.00 0.00 O ATOM 435 CB GLU A 28 37.485 59.432 -5.727 1.00 0.00 C ATOM 436 CG GLU A 28 37.303 60.667 -6.596 1.00 0.00 C ATOM 437 CD GLU A 28 36.170 60.517 -7.601 1.00 0.00 C ATOM 438 OE1 GLU A 28 35.989 59.413 -8.146 1.00 0.00 O ATOM 439 OE2 GLU A 28 35.469 61.513 -7.873 1.00 0.00 O ATOM 0 H GLU A 28 37.293 60.116 -3.330 1.00 0.00 H new ATOM 0 HA GLU A 28 35.378 59.510 -5.337 1.00 0.00 H new ATOM 0 HB2 GLU A 28 38.352 59.577 -5.083 1.00 0.00 H new ATOM 0 HB3 GLU A 28 37.703 58.577 -6.367 1.00 0.00 H new ATOM 0 HG2 GLU A 28 37.106 61.529 -5.958 1.00 0.00 H new ATOM 0 HG3 GLU A 28 38.231 60.871 -7.129 1.00 0.00 H new ATOM 446 N ARG A 29 36.537 57.030 -3.609 1.00 0.00 N ATOM 447 CA ARG A 29 36.383 55.597 -3.361 1.00 0.00 C ATOM 448 C ARG A 29 34.914 55.228 -3.198 1.00 0.00 C ATOM 449 O ARG A 29 34.472 54.181 -3.668 1.00 0.00 O ATOM 450 CB ARG A 29 37.161 55.167 -2.118 1.00 0.00 C ATOM 451 CG ARG A 29 38.654 55.025 -2.347 1.00 0.00 C ATOM 452 CD ARG A 29 39.364 54.591 -1.076 1.00 0.00 C ATOM 453 NE ARG A 29 40.769 54.258 -1.312 1.00 0.00 N ATOM 454 CZ ARG A 29 41.645 54.006 -0.337 1.00 0.00 C ATOM 455 NH1 ARG A 29 41.286 54.134 0.936 1.00 0.00 N ATOM 456 NH2 ARG A 29 42.890 53.646 -0.638 1.00 0.00 N ATOM 0 H ARG A 29 36.986 57.544 -2.851 1.00 0.00 H new ATOM 0 HA ARG A 29 36.786 55.071 -4.226 1.00 0.00 H new ATOM 0 HB2 ARG A 29 36.992 55.896 -1.325 1.00 0.00 H new ATOM 0 HB3 ARG A 29 36.765 54.215 -1.765 1.00 0.00 H new ATOM 0 HG2 ARG A 29 38.836 54.295 -3.136 1.00 0.00 H new ATOM 0 HG3 ARG A 29 39.064 55.975 -2.690 1.00 0.00 H new ATOM 0 HD2 ARG A 29 39.301 55.389 -0.336 1.00 0.00 H new ATOM 0 HD3 ARG A 29 38.853 53.725 -0.655 1.00 0.00 H new ATOM 0 HE ARG A 29 41.098 54.216 -2.277 1.00 0.00 H new ATOM 0 HH11 ARG A 29 40.337 54.426 1.172 1.00 0.00 H new ATOM 0 HH12 ARG A 29 41.959 53.940 1.678 1.00 0.00 H new ATOM 0 HH21 ARG A 29 43.175 53.563 -1.614 1.00 0.00 H new ATOM 0 HH22 ARG A 29 43.559 53.453 0.107 1.00 0.00 H new ATOM 470 N ASN A 30 34.165 56.082 -2.515 1.00 0.00 N ATOM 471 CA ASN A 30 32.735 55.861 -2.346 1.00 0.00 C ATOM 472 C ASN A 30 31.993 56.331 -3.597 1.00 0.00 C ATOM 473 O ASN A 30 30.906 55.847 -3.917 1.00 0.00 O ATOM 474 CB ASN A 30 32.221 56.589 -1.099 1.00 0.00 C ATOM 475 CG ASN A 30 30.769 56.266 -0.781 1.00 0.00 C ATOM 476 OD1 ASN A 30 30.040 57.112 -0.265 1.00 0.00 O ATOM 477 ND2 ASN A 30 30.341 55.046 -1.067 1.00 0.00 N ATOM 0 H ASN A 30 34.520 56.929 -2.071 1.00 0.00 H new ATOM 0 HA ASN A 30 32.552 54.795 -2.208 1.00 0.00 H new ATOM 0 HB2 ASN A 30 32.843 56.320 -0.245 1.00 0.00 H new ATOM 0 HB3 ASN A 30 32.325 57.664 -1.243 1.00 0.00 H new ATOM 0 HD21 ASN A 30 29.378 54.782 -0.859 1.00 0.00 H new ATOM 0 HD22 ASN A 30 30.974 54.371 -1.495 1.00 0.00 H new ATOM 484 N CYS A 31 32.599 57.274 -4.301 1.00 0.00 N ATOM 485 CA CYS A 31 32.103 57.715 -5.596 1.00 0.00 C ATOM 486 C CYS A 31 32.649 56.799 -6.691 1.00 0.00 C ATOM 487 O CYS A 31 33.323 55.815 -6.390 1.00 0.00 O ATOM 488 CB CYS A 31 32.474 59.178 -5.862 1.00 0.00 C ATOM 489 SG CYS A 31 31.617 60.360 -4.775 1.00 0.00 S ATOM 0 H CYS A 31 33.445 57.754 -3.993 1.00 0.00 H new ATOM 0 HA CYS A 31 31.015 57.655 -5.596 1.00 0.00 H new ATOM 0 HB2 CYS A 31 33.550 59.299 -5.738 1.00 0.00 H new ATOM 0 HB3 CYS A 31 32.243 59.419 -6.900 1.00 0.00 H new ATOM 494 N SER A 32 32.283 57.074 -7.942 1.00 0.00 N ATOM 495 CA SER A 32 32.698 56.262 -9.091 1.00 0.00 C ATOM 496 C SER A 32 31.960 54.923 -9.132 1.00 0.00 C ATOM 497 O SER A 32 31.471 54.515 -10.185 1.00 0.00 O ATOM 498 CB SER A 32 34.217 56.062 -9.116 1.00 0.00 C ATOM 499 OG SER A 32 34.881 57.275 -9.435 1.00 0.00 O ATOM 0 H SER A 32 31.690 57.866 -8.190 1.00 0.00 H new ATOM 0 HA SER A 32 32.423 56.812 -9.991 1.00 0.00 H new ATOM 0 HB2 SER A 32 34.557 55.701 -8.145 1.00 0.00 H new ATOM 0 HB3 SER A 32 34.475 55.297 -9.849 1.00 0.00 H new ATOM 0 HG SER A 32 35.122 57.743 -8.608 1.00 0.00 H new ATOM 505 N GLY A 33 31.857 54.257 -7.988 1.00 0.00 N ATOM 506 CA GLY A 33 31.079 53.035 -7.904 1.00 0.00 C ATOM 507 C GLY A 33 29.607 53.285 -8.179 1.00 0.00 C ATOM 508 O GLY A 33 28.875 52.380 -8.566 1.00 0.00 O ATOM 0 H GLY A 33 32.300 54.542 -7.115 1.00 0.00 H new ATOM 0 HA2 GLY A 33 31.464 52.309 -8.620 1.00 0.00 H new ATOM 0 HA3 GLY A 33 31.195 52.598 -6.912 1.00 0.00 H new ATOM 512 N MET A 34 29.182 54.529 -7.977 1.00 0.00 N ATOM 513 CA MET A 34 27.811 54.933 -8.270 1.00 0.00 C ATOM 514 C MET A 34 27.724 55.588 -9.646 1.00 0.00 C ATOM 515 O MET A 34 26.696 56.151 -10.010 1.00 0.00 O ATOM 516 CB MET A 34 27.297 55.911 -7.207 1.00 0.00 C ATOM 517 CG MET A 34 27.175 55.302 -5.819 1.00 0.00 C ATOM 518 SD MET A 34 26.573 56.475 -4.588 1.00 0.00 S ATOM 519 CE MET A 34 27.920 57.656 -4.555 1.00 0.00 C ATOM 0 H MET A 34 29.770 55.277 -7.610 1.00 0.00 H new ATOM 0 HA MET A 34 27.190 54.037 -8.262 1.00 0.00 H new ATOM 0 HB2 MET A 34 27.969 56.768 -7.160 1.00 0.00 H new ATOM 0 HB3 MET A 34 26.322 56.288 -7.515 1.00 0.00 H new ATOM 0 HG2 MET A 34 26.499 54.448 -5.861 1.00 0.00 H new ATOM 0 HG3 MET A 34 28.148 54.923 -5.507 1.00 0.00 H new ATOM 0 HE1 MET A 34 27.924 58.177 -3.597 1.00 0.00 H new ATOM 0 HE2 MET A 34 28.867 57.132 -4.687 1.00 0.00 H new ATOM 0 HE3 MET A 34 27.790 58.379 -5.360 1.00 0.00 H new ATOM 529 N GLY A 35 28.813 55.507 -10.408 1.00 0.00 N ATOM 530 CA GLY A 35 28.858 56.142 -11.715 1.00 0.00 C ATOM 531 C GLY A 35 28.960 57.651 -11.610 1.00 0.00 C ATOM 532 O GLY A 35 28.532 58.380 -12.503 1.00 0.00 O ATOM 0 H GLY A 35 29.665 55.013 -10.143 1.00 0.00 H new ATOM 0 HA2 GLY A 35 29.711 55.759 -12.275 1.00 0.00 H new ATOM 0 HA3 GLY A 35 27.963 55.877 -12.278 1.00 0.00 H new ATOM 536 N ALA A 36 29.546 58.116 -10.517 1.00 0.00 N ATOM 537 CA ALA A 36 29.625 59.539 -10.231 1.00 0.00 C ATOM 538 C ALA A 36 31.050 59.948 -9.882 1.00 0.00 C ATOM 539 O ALA A 36 31.928 59.101 -9.761 1.00 0.00 O ATOM 540 CB ALA A 36 28.683 59.882 -9.088 1.00 0.00 C ATOM 0 H ALA A 36 29.977 57.522 -9.809 1.00 0.00 H new ATOM 0 HA ALA A 36 29.327 60.090 -11.123 1.00 0.00 H new ATOM 0 HB1 ALA A 36 28.743 60.949 -8.875 1.00 0.00 H new ATOM 0 HB2 ALA A 36 27.662 59.625 -9.369 1.00 0.00 H new ATOM 0 HB3 ALA A 36 28.968 59.318 -8.200 1.00 0.00 H new ATOM 546 N HIS A 37 31.272 61.243 -9.725 1.00 0.00 N ATOM 547 CA HIS A 37 32.572 61.764 -9.304 1.00 0.00 C ATOM 548 C HIS A 37 32.380 62.908 -8.326 1.00 0.00 C ATOM 549 O HIS A 37 31.266 63.396 -8.155 1.00 0.00 O ATOM 550 CB HIS A 37 33.395 62.276 -10.492 1.00 0.00 C ATOM 551 CG HIS A 37 34.185 61.230 -11.216 1.00 0.00 C ATOM 552 ND1 HIS A 37 35.021 60.335 -10.587 1.00 0.00 N ATOM 553 CD2 HIS A 37 34.293 60.973 -12.539 1.00 0.00 C ATOM 554 CE1 HIS A 37 35.611 59.578 -11.492 1.00 0.00 C ATOM 555 NE2 HIS A 37 35.189 59.944 -12.691 1.00 0.00 N ATOM 0 H HIS A 37 30.565 61.961 -9.883 1.00 0.00 H new ATOM 0 HA HIS A 37 33.110 60.941 -8.834 1.00 0.00 H new ATOM 0 HB2 HIS A 37 32.721 62.755 -11.201 1.00 0.00 H new ATOM 0 HB3 HIS A 37 34.081 63.044 -10.135 1.00 0.00 H new ATOM 0 HD2 HIS A 37 33.769 61.485 -13.333 1.00 0.00 H new ATOM 0 HE1 HIS A 37 36.321 58.790 -11.288 1.00 0.00 H new ATOM 0 HE2 HIS A 37 35.480 59.532 -13.578 1.00 0.00 H new ATOM 564 N LEU A 38 33.459 63.324 -7.685 1.00 0.00 N ATOM 565 CA LEU A 38 33.428 64.505 -6.832 1.00 0.00 C ATOM 566 C LEU A 38 33.061 65.741 -7.649 1.00 0.00 C ATOM 567 O LEU A 38 33.357 65.816 -8.844 1.00 0.00 O ATOM 568 CB LEU A 38 34.775 64.710 -6.131 1.00 0.00 C ATOM 569 CG LEU A 38 34.957 63.950 -4.810 1.00 0.00 C ATOM 570 CD1 LEU A 38 34.791 62.457 -5.002 1.00 0.00 C ATOM 571 CD2 LEU A 38 36.318 64.266 -4.209 1.00 0.00 C ATOM 0 H LEU A 38 34.368 62.864 -7.737 1.00 0.00 H new ATOM 0 HA LEU A 38 32.667 64.352 -6.067 1.00 0.00 H new ATOM 0 HB2 LEU A 38 35.569 64.410 -6.814 1.00 0.00 H new ATOM 0 HB3 LEU A 38 34.906 65.775 -5.938 1.00 0.00 H new ATOM 0 HG LEU A 38 34.180 64.280 -4.120 1.00 0.00 H new ATOM 0 HD11 LEU A 38 34.926 61.950 -4.047 1.00 0.00 H new ATOM 0 HD12 LEU A 38 33.792 62.248 -5.385 1.00 0.00 H new ATOM 0 HD13 LEU A 38 35.535 62.097 -5.713 1.00 0.00 H new ATOM 0 HD21 LEU A 38 36.437 63.722 -3.272 1.00 0.00 H new ATOM 0 HD22 LEU A 38 37.102 63.966 -4.905 1.00 0.00 H new ATOM 0 HD23 LEU A 38 36.392 65.337 -4.019 1.00 0.00 H new ATOM 583 N MET A 39 32.401 66.690 -6.993 1.00 0.00 N ATOM 584 CA MET A 39 31.894 67.899 -7.641 1.00 0.00 C ATOM 585 C MET A 39 32.955 68.616 -8.472 1.00 0.00 C ATOM 586 O MET A 39 33.839 69.290 -7.938 1.00 0.00 O ATOM 587 CB MET A 39 31.319 68.857 -6.595 1.00 0.00 C ATOM 588 CG MET A 39 30.817 70.172 -7.173 1.00 0.00 C ATOM 589 SD MET A 39 29.636 69.931 -8.511 1.00 0.00 S ATOM 590 CE MET A 39 29.226 71.625 -8.926 1.00 0.00 C ATOM 0 H MET A 39 32.201 66.644 -5.994 1.00 0.00 H new ATOM 0 HA MET A 39 31.109 67.582 -8.327 1.00 0.00 H new ATOM 0 HB2 MET A 39 30.498 68.362 -6.076 1.00 0.00 H new ATOM 0 HB3 MET A 39 32.086 69.068 -5.850 1.00 0.00 H new ATOM 0 HG2 MET A 39 30.350 70.758 -6.382 1.00 0.00 H new ATOM 0 HG3 MET A 39 31.664 70.751 -7.541 1.00 0.00 H new ATOM 0 HE1 MET A 39 28.193 71.676 -9.269 1.00 0.00 H new ATOM 0 HE2 MET A 39 29.347 72.255 -8.045 1.00 0.00 H new ATOM 0 HE3 MET A 39 29.888 71.976 -9.717 1.00 0.00 H new ATOM 600 N THR A 40 32.862 68.452 -9.781 1.00 0.00 N ATOM 601 CA THR A 40 33.691 69.195 -10.707 1.00 0.00 C ATOM 602 C THR A 40 32.955 70.439 -11.185 1.00 0.00 C ATOM 603 O THR A 40 32.146 70.373 -12.112 1.00 0.00 O ATOM 604 CB THR A 40 34.091 68.336 -11.920 1.00 0.00 C ATOM 605 OG1 THR A 40 32.951 67.615 -12.415 1.00 0.00 O ATOM 606 CG2 THR A 40 35.195 67.360 -11.554 1.00 0.00 C ATOM 0 H THR A 40 32.213 67.804 -10.227 1.00 0.00 H new ATOM 0 HA THR A 40 34.600 69.485 -10.179 1.00 0.00 H new ATOM 0 HB THR A 40 34.462 69.003 -12.698 1.00 0.00 H new ATOM 0 HG1 THR A 40 33.217 67.073 -13.187 1.00 0.00 H new ATOM 0 HG21 THR A 40 35.459 66.765 -12.428 1.00 0.00 H new ATOM 0 HG22 THR A 40 36.071 67.912 -11.213 1.00 0.00 H new ATOM 0 HG23 THR A 40 34.849 66.701 -10.758 1.00 0.00 H new ATOM 614 N ILE A 41 33.208 71.560 -10.521 1.00 0.00 N ATOM 615 CA ILE A 41 32.568 72.819 -10.880 1.00 0.00 C ATOM 616 C ILE A 41 33.049 73.283 -12.248 1.00 0.00 C ATOM 617 O ILE A 41 34.107 73.898 -12.374 1.00 0.00 O ATOM 618 CB ILE A 41 32.841 73.926 -9.835 1.00 0.00 C ATOM 619 CG1 ILE A 41 32.395 73.467 -8.444 1.00 0.00 C ATOM 620 CG2 ILE A 41 32.125 75.214 -10.223 1.00 0.00 C ATOM 621 CD1 ILE A 41 32.643 74.493 -7.358 1.00 0.00 C ATOM 0 H ILE A 41 33.851 71.623 -9.732 1.00 0.00 H new ATOM 0 HA ILE A 41 31.493 72.638 -10.907 1.00 0.00 H new ATOM 0 HB ILE A 41 33.913 74.121 -9.810 1.00 0.00 H new ATOM 0 HG12 ILE A 41 31.331 73.230 -8.472 1.00 0.00 H new ATOM 0 HG13 ILE A 41 32.920 72.546 -8.189 1.00 0.00 H new ATOM 0 HG21 ILE A 41 32.328 75.982 -9.477 1.00 0.00 H new ATOM 0 HG22 ILE A 41 32.483 75.550 -11.196 1.00 0.00 H new ATOM 0 HG23 ILE A 41 31.051 75.032 -10.274 1.00 0.00 H new ATOM 0 HD11 ILE A 41 32.302 74.099 -6.401 1.00 0.00 H new ATOM 0 HD12 ILE A 41 33.709 74.712 -7.301 1.00 0.00 H new ATOM 0 HD13 ILE A 41 32.096 75.407 -7.589 1.00 0.00 H new ATOM 633 N SER A 42 32.280 72.962 -13.271 1.00 0.00 N ATOM 634 CA SER A 42 32.639 73.326 -14.624 1.00 0.00 C ATOM 635 C SER A 42 32.003 74.659 -14.985 1.00 0.00 C ATOM 636 O SER A 42 32.522 75.414 -15.812 1.00 0.00 O ATOM 637 CB SER A 42 32.184 72.231 -15.590 1.00 0.00 C ATOM 638 OG SER A 42 32.606 70.954 -15.133 1.00 0.00 O ATOM 0 H SER A 42 31.402 72.449 -13.188 1.00 0.00 H new ATOM 0 HA SER A 42 33.722 73.428 -14.699 1.00 0.00 H new ATOM 0 HB2 SER A 42 31.098 72.249 -15.683 1.00 0.00 H new ATOM 0 HB3 SER A 42 32.593 72.421 -16.582 1.00 0.00 H new ATOM 0 HG SER A 42 32.305 70.265 -15.762 1.00 0.00 H new ATOM 644 N THR A 43 30.874 74.946 -14.351 1.00 0.00 N ATOM 645 CA THR A 43 30.159 76.178 -14.601 1.00 0.00 C ATOM 646 C THR A 43 29.910 76.970 -13.319 1.00 0.00 C ATOM 647 O THR A 43 29.729 76.416 -12.223 1.00 0.00 O ATOM 648 CB THR A 43 28.809 75.911 -15.299 1.00 0.00 C ATOM 649 OG1 THR A 43 28.027 75.001 -14.521 1.00 0.00 O ATOM 650 CG2 THR A 43 29.015 75.343 -16.696 1.00 0.00 C ATOM 0 H THR A 43 30.437 74.337 -13.659 1.00 0.00 H new ATOM 0 HA THR A 43 30.796 76.771 -15.257 1.00 0.00 H new ATOM 0 HB THR A 43 28.283 76.861 -15.388 1.00 0.00 H new ATOM 0 HG1 THR A 43 28.532 74.173 -14.380 1.00 0.00 H new ATOM 0 HG21 THR A 43 28.046 75.165 -17.163 1.00 0.00 H new ATOM 0 HG22 THR A 43 29.583 76.053 -17.297 1.00 0.00 H new ATOM 0 HG23 THR A 43 29.564 74.404 -16.630 1.00 0.00 H new ATOM 658 N GLU A 44 29.902 78.279 -13.487 1.00 0.00 N ATOM 659 CA GLU A 44 29.611 79.217 -12.418 1.00 0.00 C ATOM 660 C GLU A 44 28.213 78.974 -11.855 1.00 0.00 C ATOM 661 O GLU A 44 27.967 79.175 -10.666 1.00 0.00 O ATOM 662 CB GLU A 44 29.743 80.620 -12.994 1.00 0.00 C ATOM 663 CG GLU A 44 31.145 80.885 -13.515 1.00 0.00 C ATOM 664 CD GLU A 44 31.200 81.975 -14.558 1.00 0.00 C ATOM 665 OE1 GLU A 44 30.926 83.140 -14.224 1.00 0.00 O ATOM 666 OE2 GLU A 44 31.530 81.646 -15.724 1.00 0.00 O ATOM 0 H GLU A 44 30.100 78.727 -14.382 1.00 0.00 H new ATOM 0 HA GLU A 44 30.308 79.088 -11.590 1.00 0.00 H new ATOM 0 HB2 GLU A 44 29.024 80.750 -13.803 1.00 0.00 H new ATOM 0 HB3 GLU A 44 29.496 81.353 -12.226 1.00 0.00 H new ATOM 0 HG2 GLU A 44 31.790 81.159 -12.680 1.00 0.00 H new ATOM 0 HG3 GLU A 44 31.547 79.965 -13.940 1.00 0.00 H new ATOM 673 N ALA A 45 27.308 78.516 -12.716 1.00 0.00 N ATOM 674 CA ALA A 45 25.955 78.178 -12.297 1.00 0.00 C ATOM 675 C ALA A 45 25.975 77.026 -11.301 1.00 0.00 C ATOM 676 O ALA A 45 25.313 77.086 -10.266 1.00 0.00 O ATOM 677 CB ALA A 45 25.095 77.829 -13.500 1.00 0.00 C ATOM 0 H ALA A 45 27.490 78.371 -13.709 1.00 0.00 H new ATOM 0 HA ALA A 45 25.521 79.049 -11.806 1.00 0.00 H new ATOM 0 HB1 ALA A 45 24.088 77.579 -13.167 1.00 0.00 H new ATOM 0 HB2 ALA A 45 25.052 78.682 -14.177 1.00 0.00 H new ATOM 0 HB3 ALA A 45 25.527 76.975 -14.021 1.00 0.00 H new ATOM 683 N GLU A 46 26.750 75.986 -11.614 1.00 0.00 N ATOM 684 CA GLU A 46 26.938 74.860 -10.702 1.00 0.00 C ATOM 685 C GLU A 46 27.292 75.353 -9.312 1.00 0.00 C ATOM 686 O GLU A 46 26.615 75.025 -8.340 1.00 0.00 O ATOM 687 CB GLU A 46 28.055 73.945 -11.194 1.00 0.00 C ATOM 688 CG GLU A 46 27.619 72.915 -12.213 1.00 0.00 C ATOM 689 CD GLU A 46 28.798 72.170 -12.797 1.00 0.00 C ATOM 690 OE1 GLU A 46 29.449 72.716 -13.710 1.00 0.00 O ATOM 691 OE2 GLU A 46 29.089 71.050 -12.331 1.00 0.00 O ATOM 0 H GLU A 46 27.258 75.902 -12.495 1.00 0.00 H new ATOM 0 HA GLU A 46 26.001 74.305 -10.668 1.00 0.00 H new ATOM 0 HB2 GLU A 46 28.844 74.558 -11.630 1.00 0.00 H new ATOM 0 HB3 GLU A 46 28.489 73.429 -10.337 1.00 0.00 H new ATOM 0 HG2 GLU A 46 26.937 72.206 -11.744 1.00 0.00 H new ATOM 0 HG3 GLU A 46 27.067 73.407 -13.014 1.00 0.00 H new ATOM 698 N GLN A 47 28.350 76.157 -9.235 1.00 0.00 N ATOM 699 CA GLN A 47 28.800 76.703 -7.957 1.00 0.00 C ATOM 700 C GLN A 47 27.667 77.452 -7.251 1.00 0.00 C ATOM 701 O GLN A 47 27.340 77.157 -6.101 1.00 0.00 O ATOM 702 CB GLN A 47 29.994 77.638 -8.168 1.00 0.00 C ATOM 703 CG GLN A 47 30.485 78.305 -6.890 1.00 0.00 C ATOM 704 CD GLN A 47 31.661 79.228 -7.133 1.00 0.00 C ATOM 705 OE1 GLN A 47 31.809 79.789 -8.214 1.00 0.00 O ATOM 706 NE2 GLN A 47 32.498 79.404 -6.122 1.00 0.00 N ATOM 0 H GLN A 47 28.909 76.444 -10.038 1.00 0.00 H new ATOM 0 HA GLN A 47 29.108 75.870 -7.325 1.00 0.00 H new ATOM 0 HB2 GLN A 47 30.814 77.071 -8.609 1.00 0.00 H new ATOM 0 HB3 GLN A 47 29.717 78.410 -8.886 1.00 0.00 H new ATOM 0 HG2 GLN A 47 29.668 78.872 -6.443 1.00 0.00 H new ATOM 0 HG3 GLN A 47 30.772 77.538 -6.171 1.00 0.00 H new ATOM 0 HE21 GLN A 47 32.340 78.919 -5.239 1.00 0.00 H new ATOM 0 HE22 GLN A 47 33.301 80.025 -6.227 1.00 0.00 H new ATOM 715 N ASN A 48 27.051 78.386 -7.965 1.00 0.00 N ATOM 716 CA ASN A 48 26.019 79.255 -7.399 1.00 0.00 C ATOM 717 C ASN A 48 24.825 78.477 -6.850 1.00 0.00 C ATOM 718 O ASN A 48 24.224 78.878 -5.855 1.00 0.00 O ATOM 719 CB ASN A 48 25.534 80.253 -8.453 1.00 0.00 C ATOM 720 CG ASN A 48 26.385 81.506 -8.512 1.00 0.00 C ATOM 721 OD1 ASN A 48 26.116 82.484 -7.818 1.00 0.00 O ATOM 722 ND2 ASN A 48 27.415 81.491 -9.344 1.00 0.00 N ATOM 0 H ASN A 48 27.250 78.564 -8.949 1.00 0.00 H new ATOM 0 HA ASN A 48 26.478 79.782 -6.563 1.00 0.00 H new ATOM 0 HB2 ASN A 48 25.536 79.771 -9.431 1.00 0.00 H new ATOM 0 HB3 ASN A 48 24.502 80.530 -8.237 1.00 0.00 H new ATOM 0 HD21 ASN A 48 28.017 82.310 -9.425 1.00 0.00 H new ATOM 0 HD22 ASN A 48 27.606 80.660 -9.904 1.00 0.00 H new ATOM 729 N PHE A 49 24.475 77.373 -7.493 1.00 0.00 N ATOM 730 CA PHE A 49 23.315 76.597 -7.075 1.00 0.00 C ATOM 731 C PHE A 49 23.666 75.553 -6.016 1.00 0.00 C ATOM 732 O PHE A 49 22.893 75.333 -5.086 1.00 0.00 O ATOM 733 CB PHE A 49 22.644 75.934 -8.283 1.00 0.00 C ATOM 734 CG PHE A 49 21.829 76.891 -9.108 1.00 0.00 C ATOM 735 CD1 PHE A 49 20.511 77.159 -8.770 1.00 0.00 C ATOM 736 CD2 PHE A 49 22.374 77.524 -10.212 1.00 0.00 C ATOM 737 CE1 PHE A 49 19.755 78.039 -9.518 1.00 0.00 C ATOM 738 CE2 PHE A 49 21.623 78.408 -10.964 1.00 0.00 C ATOM 739 CZ PHE A 49 20.312 78.666 -10.616 1.00 0.00 C ATOM 0 H PHE A 49 24.972 76.996 -8.300 1.00 0.00 H new ATOM 0 HA PHE A 49 22.612 77.294 -6.619 1.00 0.00 H new ATOM 0 HB2 PHE A 49 23.410 75.483 -8.913 1.00 0.00 H new ATOM 0 HB3 PHE A 49 22.001 75.126 -7.935 1.00 0.00 H new ATOM 0 HD1 PHE A 49 20.071 76.674 -7.911 1.00 0.00 H new ATOM 0 HD2 PHE A 49 23.399 77.325 -10.489 1.00 0.00 H new ATOM 0 HE1 PHE A 49 18.729 78.237 -9.245 1.00 0.00 H new ATOM 0 HE2 PHE A 49 22.061 78.896 -11.822 1.00 0.00 H new ATOM 0 HZ PHE A 49 19.723 79.357 -11.201 1.00 0.00 H new ATOM 749 N ILE A 50 24.832 74.925 -6.130 1.00 0.00 N ATOM 750 CA ILE A 50 25.185 73.839 -5.219 1.00 0.00 C ATOM 751 C ILE A 50 25.455 74.364 -3.807 1.00 0.00 C ATOM 752 O ILE A 50 25.172 73.685 -2.817 1.00 0.00 O ATOM 753 CB ILE A 50 26.401 73.021 -5.728 1.00 0.00 C ATOM 754 CG1 ILE A 50 26.554 71.731 -4.918 1.00 0.00 C ATOM 755 CG2 ILE A 50 27.686 73.836 -5.661 1.00 0.00 C ATOM 756 CD1 ILE A 50 25.324 70.848 -4.951 1.00 0.00 C ATOM 0 H ILE A 50 25.539 75.144 -6.832 1.00 0.00 H new ATOM 0 HA ILE A 50 24.325 73.170 -5.184 1.00 0.00 H new ATOM 0 HB ILE A 50 26.216 72.767 -6.772 1.00 0.00 H new ATOM 0 HG12 ILE A 50 27.405 71.169 -5.302 1.00 0.00 H new ATOM 0 HG13 ILE A 50 26.781 71.986 -3.883 1.00 0.00 H new ATOM 0 HG21 ILE A 50 28.518 73.234 -6.025 1.00 0.00 H new ATOM 0 HG22 ILE A 50 27.585 74.727 -6.281 1.00 0.00 H new ATOM 0 HG23 ILE A 50 27.876 74.132 -4.629 1.00 0.00 H new ATOM 0 HD11 ILE A 50 25.503 69.952 -4.356 1.00 0.00 H new ATOM 0 HD12 ILE A 50 24.474 71.393 -4.540 1.00 0.00 H new ATOM 0 HD13 ILE A 50 25.108 70.563 -5.981 1.00 0.00 H new ATOM 768 N ILE A 51 25.952 75.593 -3.714 1.00 0.00 N ATOM 769 CA ILE A 51 26.271 76.189 -2.419 1.00 0.00 C ATOM 770 C ILE A 51 25.003 76.534 -1.639 1.00 0.00 C ATOM 771 O ILE A 51 25.064 76.951 -0.481 1.00 0.00 O ATOM 772 CB ILE A 51 27.134 77.455 -2.577 1.00 0.00 C ATOM 773 CG1 ILE A 51 26.393 78.511 -3.402 1.00 0.00 C ATOM 774 CG2 ILE A 51 28.467 77.096 -3.223 1.00 0.00 C ATOM 775 CD1 ILE A 51 27.144 79.817 -3.541 1.00 0.00 C ATOM 0 H ILE A 51 26.142 76.195 -4.515 1.00 0.00 H new ATOM 0 HA ILE A 51 26.839 75.444 -1.862 1.00 0.00 H new ATOM 0 HB ILE A 51 27.328 77.877 -1.591 1.00 0.00 H new ATOM 0 HG12 ILE A 51 26.196 78.109 -4.396 1.00 0.00 H new ATOM 0 HG13 ILE A 51 25.426 78.707 -2.939 1.00 0.00 H new ATOM 0 HG21 ILE A 51 29.073 77.996 -3.332 1.00 0.00 H new ATOM 0 HG22 ILE A 51 28.994 76.378 -2.595 1.00 0.00 H new ATOM 0 HG23 ILE A 51 28.289 76.657 -4.205 1.00 0.00 H new ATOM 0 HD11 ILE A 51 26.555 80.513 -4.138 1.00 0.00 H new ATOM 0 HD12 ILE A 51 27.318 80.243 -2.553 1.00 0.00 H new ATOM 0 HD13 ILE A 51 28.100 79.636 -4.032 1.00 0.00 H new ATOM 787 N GLN A 52 23.858 76.366 -2.285 1.00 0.00 N ATOM 788 CA GLN A 52 22.572 76.579 -1.641 1.00 0.00 C ATOM 789 C GLN A 52 22.114 75.297 -0.952 1.00 0.00 C ATOM 790 O GLN A 52 21.293 75.327 -0.040 1.00 0.00 O ATOM 791 CB GLN A 52 21.537 77.030 -2.672 1.00 0.00 C ATOM 792 CG GLN A 52 21.964 78.257 -3.455 1.00 0.00 C ATOM 793 CD GLN A 52 20.936 78.684 -4.480 1.00 0.00 C ATOM 794 OE1 GLN A 52 19.736 78.501 -4.292 1.00 0.00 O ATOM 795 NE2 GLN A 52 21.402 79.246 -5.579 1.00 0.00 N ATOM 0 H GLN A 52 23.795 76.081 -3.262 1.00 0.00 H new ATOM 0 HA GLN A 52 22.677 77.361 -0.889 1.00 0.00 H new ATOM 0 HB2 GLN A 52 21.347 76.212 -3.367 1.00 0.00 H new ATOM 0 HB3 GLN A 52 20.596 77.241 -2.164 1.00 0.00 H new ATOM 0 HG2 GLN A 52 22.144 79.080 -2.763 1.00 0.00 H new ATOM 0 HG3 GLN A 52 22.909 78.051 -3.958 1.00 0.00 H new ATOM 0 HE21 GLN A 52 22.406 79.380 -5.697 1.00 0.00 H new ATOM 0 HE22 GLN A 52 20.758 79.546 -6.311 1.00 0.00 H new ATOM 804 N PHE A 53 22.662 74.171 -1.401 1.00 0.00 N ATOM 805 CA PHE A 53 22.334 72.873 -0.828 1.00 0.00 C ATOM 806 C PHE A 53 23.348 72.486 0.239 1.00 0.00 C ATOM 807 O PHE A 53 23.060 71.673 1.117 1.00 0.00 O ATOM 808 CB PHE A 53 22.319 71.797 -1.915 1.00 0.00 C ATOM 809 CG PHE A 53 21.313 72.036 -3.002 1.00 0.00 C ATOM 810 CD1 PHE A 53 19.960 71.857 -2.765 1.00 0.00 C ATOM 811 CD2 PHE A 53 21.723 72.427 -4.265 1.00 0.00 C ATOM 812 CE1 PHE A 53 19.035 72.063 -3.769 1.00 0.00 C ATOM 813 CE2 PHE A 53 20.803 72.638 -5.272 1.00 0.00 C ATOM 814 CZ PHE A 53 19.457 72.455 -5.025 1.00 0.00 C ATOM 0 H PHE A 53 23.338 74.134 -2.164 1.00 0.00 H new ATOM 0 HA PHE A 53 21.345 72.948 -0.376 1.00 0.00 H new ATOM 0 HB2 PHE A 53 23.311 71.733 -2.361 1.00 0.00 H new ATOM 0 HB3 PHE A 53 22.115 70.831 -1.452 1.00 0.00 H new ATOM 0 HD1 PHE A 53 19.625 71.553 -1.784 1.00 0.00 H new ATOM 0 HD2 PHE A 53 22.775 72.569 -4.465 1.00 0.00 H new ATOM 0 HE1 PHE A 53 17.983 71.918 -3.573 1.00 0.00 H new ATOM 0 HE2 PHE A 53 21.136 72.946 -6.252 1.00 0.00 H new ATOM 0 HZ PHE A 53 18.735 72.618 -5.812 1.00 0.00 H new ATOM 824 N LEU A 54 24.538 73.057 0.135 1.00 0.00 N ATOM 825 CA LEU A 54 25.625 72.740 1.053 1.00 0.00 C ATOM 826 C LEU A 54 25.405 73.375 2.422 1.00 0.00 C ATOM 827 O LEU A 54 24.962 74.522 2.523 1.00 0.00 O ATOM 828 CB LEU A 54 26.955 73.221 0.475 1.00 0.00 C ATOM 829 CG LEU A 54 27.304 72.662 -0.902 1.00 0.00 C ATOM 830 CD1 LEU A 54 28.655 73.188 -1.358 1.00 0.00 C ATOM 831 CD2 LEU A 54 27.297 71.142 -0.881 1.00 0.00 C ATOM 0 H LEU A 54 24.778 73.745 -0.579 1.00 0.00 H new ATOM 0 HA LEU A 54 25.647 71.658 1.179 1.00 0.00 H new ATOM 0 HB2 LEU A 54 26.934 74.309 0.413 1.00 0.00 H new ATOM 0 HB3 LEU A 54 27.752 72.956 1.170 1.00 0.00 H new ATOM 0 HG LEU A 54 26.547 72.994 -1.613 1.00 0.00 H new ATOM 0 HD11 LEU A 54 28.891 72.781 -2.341 1.00 0.00 H new ATOM 0 HD12 LEU A 54 28.622 74.276 -1.414 1.00 0.00 H new ATOM 0 HD13 LEU A 54 29.423 72.885 -0.646 1.00 0.00 H new ATOM 0 HD21 LEU A 54 27.548 70.763 -1.872 1.00 0.00 H new ATOM 0 HD22 LEU A 54 28.031 70.785 -0.159 1.00 0.00 H new ATOM 0 HD23 LEU A 54 26.306 70.787 -0.597 1.00 0.00 H new ATOM 843 N ASP A 55 25.725 72.627 3.473 1.00 0.00 N ATOM 844 CA ASP A 55 25.645 73.151 4.830 1.00 0.00 C ATOM 845 C ASP A 55 26.816 74.085 5.079 1.00 0.00 C ATOM 846 O ASP A 55 27.962 73.750 4.780 1.00 0.00 O ATOM 847 CB ASP A 55 25.650 72.025 5.862 1.00 0.00 C ATOM 848 CG ASP A 55 25.535 72.547 7.281 1.00 0.00 C ATOM 849 OD1 ASP A 55 26.564 72.953 7.856 1.00 0.00 O ATOM 850 OD2 ASP A 55 24.416 72.556 7.832 1.00 0.00 O ATOM 0 H ASP A 55 26.041 71.659 3.411 1.00 0.00 H new ATOM 0 HA ASP A 55 24.707 73.696 4.934 1.00 0.00 H new ATOM 0 HB2 ASP A 55 24.823 71.345 5.659 1.00 0.00 H new ATOM 0 HB3 ASP A 55 26.569 71.448 5.763 1.00 0.00 H new ATOM 855 N ARG A 56 26.530 75.240 5.656 1.00 0.00 N ATOM 856 CA ARG A 56 27.509 76.315 5.752 1.00 0.00 C ATOM 857 C ARG A 56 28.500 76.113 6.898 1.00 0.00 C ATOM 858 O ARG A 56 29.184 77.055 7.299 1.00 0.00 O ATOM 859 CB ARG A 56 26.794 77.657 5.908 1.00 0.00 C ATOM 860 CG ARG A 56 25.902 78.008 4.729 1.00 0.00 C ATOM 861 CD ARG A 56 25.339 79.415 4.851 1.00 0.00 C ATOM 862 NE ARG A 56 24.465 79.759 3.728 1.00 0.00 N ATOM 863 CZ ARG A 56 24.244 81.008 3.305 1.00 0.00 C ATOM 864 NH1 ARG A 56 24.853 82.038 3.892 1.00 0.00 N ATOM 865 NH2 ARG A 56 23.418 81.227 2.285 1.00 0.00 N ATOM 0 H ARG A 56 25.623 75.460 6.068 1.00 0.00 H new ATOM 0 HA ARG A 56 28.087 76.306 4.828 1.00 0.00 H new ATOM 0 HB2 ARG A 56 26.191 77.635 6.816 1.00 0.00 H new ATOM 0 HB3 ARG A 56 27.538 78.443 6.038 1.00 0.00 H new ATOM 0 HG2 ARG A 56 26.471 77.923 3.803 1.00 0.00 H new ATOM 0 HG3 ARG A 56 25.083 77.292 4.666 1.00 0.00 H new ATOM 0 HD2 ARG A 56 24.781 79.502 5.783 1.00 0.00 H new ATOM 0 HD3 ARG A 56 26.160 80.130 4.903 1.00 0.00 H new ATOM 0 HE ARG A 56 23.995 78.998 3.237 1.00 0.00 H new ATOM 0 HH11 ARG A 56 25.493 81.876 4.670 1.00 0.00 H new ATOM 0 HH12 ARG A 56 24.679 82.988 3.564 1.00 0.00 H new ATOM 0 HH21 ARG A 56 22.954 80.443 1.827 1.00 0.00 H new ATOM 0 HH22 ARG A 56 23.249 82.179 1.961 1.00 0.00 H new ATOM 879 N ARG A 57 28.588 74.900 7.422 1.00 0.00 N ATOM 880 CA ARG A 57 29.554 74.606 8.469 1.00 0.00 C ATOM 881 C ARG A 57 30.529 73.514 8.016 1.00 0.00 C ATOM 882 O ARG A 57 31.558 73.287 8.653 1.00 0.00 O ATOM 883 CB ARG A 57 28.826 74.202 9.762 1.00 0.00 C ATOM 884 CG ARG A 57 28.909 72.721 10.101 1.00 0.00 C ATOM 885 CD ARG A 57 27.814 72.312 11.071 1.00 0.00 C ATOM 886 NE ARG A 57 26.495 72.373 10.447 1.00 0.00 N ATOM 887 CZ ARG A 57 25.348 72.141 11.080 1.00 0.00 C ATOM 888 NH1 ARG A 57 25.344 71.859 12.380 1.00 0.00 N ATOM 889 NH2 ARG A 57 24.203 72.190 10.410 1.00 0.00 N ATOM 0 H ARG A 57 28.007 74.109 7.142 1.00 0.00 H new ATOM 0 HA ARG A 57 30.137 75.505 8.672 1.00 0.00 H new ATOM 0 HB2 ARG A 57 29.242 74.775 10.591 1.00 0.00 H new ATOM 0 HB3 ARG A 57 27.776 74.483 9.675 1.00 0.00 H new ATOM 0 HG2 ARG A 57 28.827 72.132 9.188 1.00 0.00 H new ATOM 0 HG3 ARG A 57 29.884 72.500 10.536 1.00 0.00 H new ATOM 0 HD2 ARG A 57 28.002 71.299 11.428 1.00 0.00 H new ATOM 0 HD3 ARG A 57 27.836 72.966 11.943 1.00 0.00 H new ATOM 0 HE ARG A 57 26.450 72.610 9.456 1.00 0.00 H new ATOM 0 HH11 ARG A 57 26.223 71.820 12.896 1.00 0.00 H new ATOM 0 HH12 ARG A 57 24.462 71.682 12.861 1.00 0.00 H new ATOM 0 HH21 ARG A 57 24.204 72.405 9.413 1.00 0.00 H new ATOM 0 HH22 ARG A 57 23.322 72.013 10.892 1.00 0.00 H new ATOM 903 N LEU A 58 30.210 72.847 6.908 1.00 0.00 N ATOM 904 CA LEU A 58 31.060 71.773 6.403 1.00 0.00 C ATOM 905 C LEU A 58 31.891 72.229 5.210 1.00 0.00 C ATOM 906 O LEU A 58 31.467 73.077 4.425 1.00 0.00 O ATOM 907 CB LEU A 58 30.235 70.543 5.995 1.00 0.00 C ATOM 908 CG LEU A 58 29.669 69.689 7.137 1.00 0.00 C ATOM 909 CD1 LEU A 58 30.710 69.478 8.227 1.00 0.00 C ATOM 910 CD2 LEU A 58 28.403 70.303 7.705 1.00 0.00 C ATOM 0 H LEU A 58 29.377 73.030 6.348 1.00 0.00 H new ATOM 0 HA LEU A 58 31.728 71.500 7.220 1.00 0.00 H new ATOM 0 HB2 LEU A 58 29.403 70.880 5.376 1.00 0.00 H new ATOM 0 HB3 LEU A 58 30.860 69.905 5.369 1.00 0.00 H new ATOM 0 HG LEU A 58 29.410 68.713 6.726 1.00 0.00 H new ATOM 0 HD11 LEU A 58 30.284 68.870 9.025 1.00 0.00 H new ATOM 0 HD12 LEU A 58 31.578 68.970 7.808 1.00 0.00 H new ATOM 0 HD13 LEU A 58 31.015 70.443 8.631 1.00 0.00 H new ATOM 0 HD21 LEU A 58 28.025 69.676 8.512 1.00 0.00 H new ATOM 0 HD22 LEU A 58 28.623 71.298 8.091 1.00 0.00 H new ATOM 0 HD23 LEU A 58 27.650 70.377 6.920 1.00 0.00 H new ATOM 922 N SER A 59 33.079 71.657 5.086 1.00 0.00 N ATOM 923 CA SER A 59 33.934 71.881 3.934 1.00 0.00 C ATOM 924 C SER A 59 33.817 70.700 2.974 1.00 0.00 C ATOM 925 O SER A 59 34.161 69.572 3.329 1.00 0.00 O ATOM 926 CB SER A 59 35.384 72.055 4.392 1.00 0.00 C ATOM 927 OG SER A 59 35.757 71.020 5.289 1.00 0.00 O ATOM 0 H SER A 59 33.476 71.025 5.781 1.00 0.00 H new ATOM 0 HA SER A 59 33.620 72.788 3.417 1.00 0.00 H new ATOM 0 HB2 SER A 59 36.047 72.049 3.527 1.00 0.00 H new ATOM 0 HB3 SER A 59 35.503 73.024 4.878 1.00 0.00 H new ATOM 0 HG SER A 59 36.687 71.149 5.568 1.00 0.00 H new ATOM 933 N TYR A 60 33.324 70.959 1.771 1.00 0.00 N ATOM 934 CA TYR A 60 33.054 69.895 0.811 1.00 0.00 C ATOM 935 C TYR A 60 34.159 69.793 -0.235 1.00 0.00 C ATOM 936 O TYR A 60 34.444 70.760 -0.941 1.00 0.00 O ATOM 937 CB TYR A 60 31.712 70.137 0.117 1.00 0.00 C ATOM 938 CG TYR A 60 30.518 70.126 1.050 1.00 0.00 C ATOM 939 CD1 TYR A 60 30.115 71.278 1.715 1.00 0.00 C ATOM 940 CD2 TYR A 60 29.787 68.962 1.254 1.00 0.00 C ATOM 941 CE1 TYR A 60 29.020 71.268 2.558 1.00 0.00 C ATOM 942 CE2 TYR A 60 28.688 68.947 2.092 1.00 0.00 C ATOM 943 CZ TYR A 60 28.310 70.100 2.741 1.00 0.00 C ATOM 944 OH TYR A 60 27.213 70.089 3.571 1.00 0.00 O ATOM 0 H TYR A 60 33.102 71.896 1.435 1.00 0.00 H new ATOM 0 HA TYR A 60 33.017 68.955 1.362 1.00 0.00 H new ATOM 0 HB2 TYR A 60 31.749 71.098 -0.396 1.00 0.00 H new ATOM 0 HB3 TYR A 60 31.568 69.373 -0.647 1.00 0.00 H new ATOM 0 HD1 TYR A 60 30.666 72.195 1.571 1.00 0.00 H new ATOM 0 HD2 TYR A 60 30.083 68.054 0.749 1.00 0.00 H new ATOM 0 HE1 TYR A 60 28.722 72.170 3.071 1.00 0.00 H new ATOM 0 HE2 TYR A 60 28.129 68.035 2.237 1.00 0.00 H new ATOM 0 HH TYR A 60 26.826 69.189 3.589 1.00 0.00 H new ATOM 954 N PHE A 61 34.778 68.618 -0.320 1.00 0.00 N ATOM 955 CA PHE A 61 35.816 68.353 -1.315 1.00 0.00 C ATOM 956 C PHE A 61 35.302 68.553 -2.734 1.00 0.00 C ATOM 957 O PHE A 61 34.187 68.142 -3.071 1.00 0.00 O ATOM 958 CB PHE A 61 36.355 66.927 -1.180 1.00 0.00 C ATOM 959 CG PHE A 61 37.492 66.793 -0.211 1.00 0.00 C ATOM 960 CD1 PHE A 61 38.753 67.261 -0.543 1.00 0.00 C ATOM 961 CD2 PHE A 61 37.305 66.193 1.019 1.00 0.00 C ATOM 962 CE1 PHE A 61 39.808 67.135 0.338 1.00 0.00 C ATOM 963 CE2 PHE A 61 38.357 66.065 1.904 1.00 0.00 C ATOM 964 CZ PHE A 61 39.609 66.536 1.562 1.00 0.00 C ATOM 0 H PHE A 61 34.577 67.828 0.293 1.00 0.00 H new ATOM 0 HA PHE A 61 36.618 69.067 -1.127 1.00 0.00 H new ATOM 0 HB2 PHE A 61 35.543 66.271 -0.865 1.00 0.00 H new ATOM 0 HB3 PHE A 61 36.683 66.580 -2.160 1.00 0.00 H new ATOM 0 HD1 PHE A 61 38.912 67.730 -1.503 1.00 0.00 H new ATOM 0 HD2 PHE A 61 36.328 65.821 1.291 1.00 0.00 H new ATOM 0 HE1 PHE A 61 40.786 67.505 0.068 1.00 0.00 H new ATOM 0 HE2 PHE A 61 38.200 65.596 2.864 1.00 0.00 H new ATOM 0 HZ PHE A 61 40.432 66.435 2.254 1.00 0.00 H new ATOM 974 N LEU A 62 36.125 69.186 -3.555 1.00 0.00 N ATOM 975 CA LEU A 62 35.811 69.377 -4.960 1.00 0.00 C ATOM 976 C LEU A 62 36.649 68.439 -5.810 1.00 0.00 C ATOM 977 O LEU A 62 37.716 67.988 -5.389 1.00 0.00 O ATOM 978 CB LEU A 62 36.071 70.826 -5.375 1.00 0.00 C ATOM 979 CG LEU A 62 35.211 71.866 -4.664 1.00 0.00 C ATOM 980 CD1 LEU A 62 35.586 73.265 -5.124 1.00 0.00 C ATOM 981 CD2 LEU A 62 33.736 71.596 -4.921 1.00 0.00 C ATOM 0 H LEU A 62 37.022 69.578 -3.268 1.00 0.00 H new ATOM 0 HA LEU A 62 34.755 69.154 -5.113 1.00 0.00 H new ATOM 0 HB2 LEU A 62 37.120 71.058 -5.192 1.00 0.00 H new ATOM 0 HB3 LEU A 62 35.908 70.915 -6.449 1.00 0.00 H new ATOM 0 HG LEU A 62 35.393 71.796 -3.592 1.00 0.00 H new ATOM 0 HD11 LEU A 62 34.964 73.997 -4.608 1.00 0.00 H new ATOM 0 HD12 LEU A 62 36.635 73.454 -4.895 1.00 0.00 H new ATOM 0 HD13 LEU A 62 35.429 73.349 -6.199 1.00 0.00 H new ATOM 0 HD21 LEU A 62 33.134 72.346 -4.408 1.00 0.00 H new ATOM 0 HD22 LEU A 62 33.539 71.643 -5.992 1.00 0.00 H new ATOM 0 HD23 LEU A 62 33.477 70.605 -4.548 1.00 0.00 H new ATOM 993 N GLY A 63 36.172 68.155 -7.008 1.00 0.00 N ATOM 994 CA GLY A 63 36.888 67.272 -7.901 1.00 0.00 C ATOM 995 C GLY A 63 38.039 67.965 -8.599 1.00 0.00 C ATOM 996 O GLY A 63 38.049 68.075 -9.818 1.00 0.00 O ATOM 0 H GLY A 63 35.296 68.522 -7.381 1.00 0.00 H new ATOM 0 HA2 GLY A 63 37.269 66.420 -7.337 1.00 0.00 H new ATOM 0 HA3 GLY A 63 36.199 66.878 -8.647 1.00 0.00 H new ATOM 1000 N LEU A 64 39.000 68.437 -7.820 1.00 0.00 N ATOM 1001 CA LEU A 64 40.187 69.088 -8.357 1.00 0.00 C ATOM 1002 C LEU A 64 41.423 68.453 -7.727 1.00 0.00 C ATOM 1003 O LEU A 64 41.462 68.244 -6.515 1.00 0.00 O ATOM 1004 CB LEU A 64 40.143 70.591 -8.063 1.00 0.00 C ATOM 1005 CG LEU A 64 41.150 71.443 -8.836 1.00 0.00 C ATOM 1006 CD1 LEU A 64 40.852 71.404 -10.326 1.00 0.00 C ATOM 1007 CD2 LEU A 64 41.134 72.875 -8.331 1.00 0.00 C ATOM 0 H LEU A 64 38.980 68.381 -6.802 1.00 0.00 H new ATOM 0 HA LEU A 64 40.224 68.957 -9.438 1.00 0.00 H new ATOM 0 HB2 LEU A 64 39.140 70.957 -8.282 1.00 0.00 H new ATOM 0 HB3 LEU A 64 40.311 70.740 -6.996 1.00 0.00 H new ATOM 0 HG LEU A 64 42.145 71.029 -8.673 1.00 0.00 H new ATOM 0 HD11 LEU A 64 41.580 72.016 -10.859 1.00 0.00 H new ATOM 0 HD12 LEU A 64 40.913 70.376 -10.682 1.00 0.00 H new ATOM 0 HD13 LEU A 64 39.850 71.792 -10.507 1.00 0.00 H new ATOM 0 HD21 LEU A 64 41.857 73.467 -8.892 1.00 0.00 H new ATOM 0 HD22 LEU A 64 40.138 73.297 -8.464 1.00 0.00 H new ATOM 0 HD23 LEU A 64 41.396 72.891 -7.273 1.00 0.00 H new ATOM 1019 N ARG A 65 42.424 68.138 -8.538 1.00 0.00 N ATOM 1020 CA ARG A 65 43.557 67.356 -8.064 1.00 0.00 C ATOM 1021 C ARG A 65 44.898 67.919 -8.528 1.00 0.00 C ATOM 1022 O ARG A 65 45.071 68.264 -9.702 1.00 0.00 O ATOM 1023 CB ARG A 65 43.452 65.922 -8.580 1.00 0.00 C ATOM 1024 CG ARG A 65 44.487 64.990 -7.973 1.00 0.00 C ATOM 1025 CD ARG A 65 44.734 63.773 -8.846 1.00 0.00 C ATOM 1026 NE ARG A 65 43.506 63.110 -9.276 1.00 0.00 N ATOM 1027 CZ ARG A 65 43.478 62.156 -10.207 1.00 0.00 C ATOM 1028 NH1 ARG A 65 44.604 61.768 -10.800 1.00 0.00 N ATOM 1029 NH2 ARG A 65 42.328 61.598 -10.562 1.00 0.00 N ATOM 0 H ARG A 65 42.475 68.410 -9.520 1.00 0.00 H new ATOM 0 HA ARG A 65 43.522 67.393 -6.975 1.00 0.00 H new ATOM 0 HB2 ARG A 65 42.455 65.537 -8.364 1.00 0.00 H new ATOM 0 HB3 ARG A 65 43.565 65.924 -9.664 1.00 0.00 H new ATOM 0 HG2 ARG A 65 45.423 65.530 -7.830 1.00 0.00 H new ATOM 0 HG3 ARG A 65 44.152 64.668 -6.987 1.00 0.00 H new ATOM 0 HD2 ARG A 65 45.302 64.075 -9.726 1.00 0.00 H new ATOM 0 HD3 ARG A 65 45.350 63.060 -8.298 1.00 0.00 H new ATOM 0 HE ARG A 65 42.626 63.391 -8.843 1.00 0.00 H new ATOM 0 HH11 ARG A 65 45.491 62.201 -10.543 1.00 0.00 H new ATOM 0 HH12 ARG A 65 44.580 61.038 -11.512 1.00 0.00 H new ATOM 0 HH21 ARG A 65 41.458 61.898 -10.122 1.00 0.00 H new ATOM 0 HH22 ARG A 65 42.314 60.869 -11.275 1.00 0.00 H new ATOM 1043 N ASP A 66 45.841 67.988 -7.602 1.00 0.00 N ATOM 1044 CA ASP A 66 47.243 68.181 -7.937 1.00 0.00 C ATOM 1045 C ASP A 66 48.070 67.184 -7.132 1.00 0.00 C ATOM 1046 O ASP A 66 48.468 67.455 -6.008 1.00 0.00 O ATOM 1047 CB ASP A 66 47.697 69.617 -7.655 1.00 0.00 C ATOM 1048 CG ASP A 66 49.071 69.915 -8.230 1.00 0.00 C ATOM 1049 OD1 ASP A 66 49.156 70.266 -9.425 1.00 0.00 O ATOM 1050 OD2 ASP A 66 50.073 69.792 -7.501 1.00 0.00 O ATOM 0 H ASP A 66 45.658 67.912 -6.601 1.00 0.00 H new ATOM 0 HA ASP A 66 47.385 68.010 -9.004 1.00 0.00 H new ATOM 0 HB2 ASP A 66 46.972 70.313 -8.076 1.00 0.00 H new ATOM 0 HB3 ASP A 66 47.713 69.785 -6.578 1.00 0.00 H new ATOM 1055 N GLU A 67 48.273 65.996 -7.688 1.00 0.00 N ATOM 1056 CA GLU A 67 48.930 64.924 -6.954 1.00 0.00 C ATOM 1057 C GLU A 67 50.450 65.070 -6.990 1.00 0.00 C ATOM 1058 O GLU A 67 51.034 65.335 -8.039 1.00 0.00 O ATOM 1059 CB GLU A 67 48.513 63.542 -7.493 1.00 0.00 C ATOM 1060 CG GLU A 67 48.886 63.278 -8.951 1.00 0.00 C ATOM 1061 CD GLU A 67 47.829 63.737 -9.939 1.00 0.00 C ATOM 1062 OE1 GLU A 67 47.666 64.960 -10.124 1.00 0.00 O ATOM 1063 OE2 GLU A 67 47.164 62.871 -10.548 1.00 0.00 O ATOM 0 H GLU A 67 47.994 65.752 -8.638 1.00 0.00 H new ATOM 0 HA GLU A 67 48.607 65.001 -5.916 1.00 0.00 H new ATOM 0 HB2 GLU A 67 48.971 62.773 -6.871 1.00 0.00 H new ATOM 0 HB3 GLU A 67 47.433 63.437 -7.385 1.00 0.00 H new ATOM 0 HG2 GLU A 67 49.825 63.784 -9.175 1.00 0.00 H new ATOM 0 HG3 GLU A 67 49.059 62.210 -9.086 1.00 0.00 H new ATOM 1070 N ASN A 68 51.067 64.907 -5.820 1.00 0.00 N ATOM 1071 CA ASN A 68 52.526 64.890 -5.670 1.00 0.00 C ATOM 1072 C ASN A 68 53.152 66.263 -5.899 1.00 0.00 C ATOM 1073 O ASN A 68 54.358 66.360 -6.117 1.00 0.00 O ATOM 1074 CB ASN A 68 53.149 63.860 -6.614 1.00 0.00 C ATOM 1075 CG ASN A 68 52.746 62.441 -6.266 1.00 0.00 C ATOM 1076 OD1 ASN A 68 52.620 62.081 -5.096 1.00 0.00 O ATOM 1077 ND2 ASN A 68 52.505 61.636 -7.284 1.00 0.00 N ATOM 0 H ASN A 68 50.566 64.782 -4.941 1.00 0.00 H new ATOM 0 HA ASN A 68 52.736 64.608 -4.638 1.00 0.00 H new ATOM 0 HB2 ASN A 68 52.847 64.080 -7.638 1.00 0.00 H new ATOM 0 HB3 ASN A 68 54.235 63.946 -6.576 1.00 0.00 H new ATOM 0 HD21 ASN A 68 52.202 60.677 -7.115 1.00 0.00 H new ATOM 0 HD22 ASN A 68 52.621 61.973 -8.240 1.00 0.00 H new ATOM 1084 N ALA A 69 52.332 67.314 -5.817 1.00 0.00 N ATOM 1085 CA ALA A 69 52.801 68.695 -5.964 1.00 0.00 C ATOM 1086 C ALA A 69 53.394 68.944 -7.347 1.00 0.00 C ATOM 1087 O ALA A 69 54.597 68.798 -7.563 1.00 0.00 O ATOM 1088 CB ALA A 69 53.810 69.060 -4.880 1.00 0.00 C ATOM 0 H ALA A 69 51.329 67.233 -5.648 1.00 0.00 H new ATOM 0 HA ALA A 69 51.929 69.339 -5.850 1.00 0.00 H new ATOM 0 HB1 ALA A 69 54.137 70.091 -5.019 1.00 0.00 H new ATOM 0 HB2 ALA A 69 53.345 68.956 -3.900 1.00 0.00 H new ATOM 0 HB3 ALA A 69 54.671 68.395 -4.945 1.00 0.00 H new ATOM 1094 N LYS A 70 52.539 69.310 -8.281 1.00 0.00 N ATOM 1095 CA LYS A 70 52.963 69.552 -9.650 1.00 0.00 C ATOM 1096 C LYS A 70 52.829 71.028 -9.994 1.00 0.00 C ATOM 1097 O LYS A 70 53.735 71.634 -10.563 1.00 0.00 O ATOM 1098 CB LYS A 70 52.096 68.752 -10.619 1.00 0.00 C ATOM 1099 CG LYS A 70 51.879 67.302 -10.228 1.00 0.00 C ATOM 1100 CD LYS A 70 50.652 66.736 -10.930 1.00 0.00 C ATOM 1101 CE LYS A 70 49.434 67.595 -10.640 1.00 0.00 C ATOM 1102 NZ LYS A 70 48.223 67.138 -11.363 1.00 0.00 N ATOM 0 H LYS A 70 51.542 69.447 -8.118 1.00 0.00 H new ATOM 0 HA LYS A 70 54.005 69.245 -9.739 1.00 0.00 H new ATOM 0 HB2 LYS A 70 51.125 69.240 -10.704 1.00 0.00 H new ATOM 0 HB3 LYS A 70 52.556 68.783 -11.607 1.00 0.00 H new ATOM 0 HG2 LYS A 70 52.758 66.714 -10.490 1.00 0.00 H new ATOM 0 HG3 LYS A 70 51.754 67.226 -9.148 1.00 0.00 H new ATOM 0 HD2 LYS A 70 50.827 66.693 -12.005 1.00 0.00 H new ATOM 0 HD3 LYS A 70 50.473 65.714 -10.595 1.00 0.00 H new ATOM 0 HE2 LYS A 70 49.236 67.587 -9.568 1.00 0.00 H new ATOM 0 HE3 LYS A 70 49.649 68.627 -10.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 47.640 67.961 -11.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 48.505 66.631 -12.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 47.673 66.501 -10.751 1.00 0.00 H new ATOM 1116 N GLY A 71 51.675 71.588 -9.663 1.00 0.00 N ATOM 1117 CA GLY A 71 51.361 72.944 -10.060 1.00 0.00 C ATOM 1118 C GLY A 71 50.402 72.949 -11.232 1.00 0.00 C ATOM 1119 O GLY A 71 49.731 73.943 -11.504 1.00 0.00 O ATOM 0 H GLY A 71 50.946 71.123 -9.122 1.00 0.00 H new ATOM 0 HA2 GLY A 71 50.920 73.481 -9.220 1.00 0.00 H new ATOM 0 HA3 GLY A 71 52.276 73.471 -10.330 1.00 0.00 H new ATOM 1123 N GLN A 72 50.342 71.817 -11.920 1.00 0.00 N ATOM 1124 CA GLN A 72 49.418 71.628 -13.025 1.00 0.00 C ATOM 1125 C GLN A 72 48.147 70.948 -12.532 1.00 0.00 C ATOM 1126 O GLN A 72 48.008 69.719 -12.601 1.00 0.00 O ATOM 1127 CB GLN A 72 50.066 70.813 -14.152 1.00 0.00 C ATOM 1128 CG GLN A 72 51.040 69.750 -13.662 1.00 0.00 C ATOM 1129 CD GLN A 72 51.473 68.789 -14.752 1.00 0.00 C ATOM 1130 OE1 GLN A 72 51.861 67.586 -14.358 1.00 0.00 O flip ATOM 1131 NE2 GLN A 72 51.475 69.125 -15.933 1.00 0.00 N flip ATOM 0 H GLN A 72 50.931 71.007 -11.727 1.00 0.00 H new ATOM 0 HA GLN A 72 49.159 72.607 -13.429 1.00 0.00 H new ATOM 0 HB2 GLN A 72 49.282 70.332 -14.736 1.00 0.00 H new ATOM 0 HB3 GLN A 72 50.592 71.493 -14.823 1.00 0.00 H new ATOM 0 HG2 GLN A 72 51.921 70.238 -13.246 1.00 0.00 H new ATOM 0 HG3 GLN A 72 50.576 69.186 -12.853 1.00 0.00 H new ATOM 0 HE21 GLN A 72 51.169 70.061 -16.197 1.00 0.00 H new ATOM 0 HE22 GLN A 72 51.783 68.468 -16.650 1.00 0.00 H new ATOM 1140 N TRP A 73 47.239 71.755 -12.008 1.00 0.00 N ATOM 1141 CA TRP A 73 45.988 71.260 -11.459 1.00 0.00 C ATOM 1142 C TRP A 73 45.100 70.660 -12.544 1.00 0.00 C ATOM 1143 O TRP A 73 44.975 71.203 -13.641 1.00 0.00 O ATOM 1144 CB TRP A 73 45.237 72.384 -10.740 1.00 0.00 C ATOM 1145 CG TRP A 73 45.862 72.803 -9.442 1.00 0.00 C ATOM 1146 CD1 TRP A 73 46.973 73.583 -9.269 1.00 0.00 C ATOM 1147 CD2 TRP A 73 45.398 72.472 -8.128 1.00 0.00 C ATOM 1148 NE1 TRP A 73 47.225 73.750 -7.928 1.00 0.00 N ATOM 1149 CE2 TRP A 73 46.275 73.077 -7.209 1.00 0.00 C ATOM 1150 CE3 TRP A 73 44.328 71.719 -7.640 1.00 0.00 C ATOM 1151 CZ2 TRP A 73 46.110 72.955 -5.833 1.00 0.00 C ATOM 1152 CZ3 TRP A 73 44.165 71.598 -6.274 1.00 0.00 C ATOM 1153 CH2 TRP A 73 45.053 72.214 -5.384 1.00 0.00 C ATOM 0 H TRP A 73 47.348 72.768 -11.951 1.00 0.00 H new ATOM 0 HA TRP A 73 46.232 70.474 -10.744 1.00 0.00 H new ATOM 0 HB2 TRP A 73 45.180 73.249 -11.400 1.00 0.00 H new ATOM 0 HB3 TRP A 73 44.214 72.060 -10.551 1.00 0.00 H new ATOM 0 HD1 TRP A 73 47.564 74.005 -10.068 1.00 0.00 H new ATOM 0 HE1 TRP A 73 47.996 74.289 -7.533 1.00 0.00 H new ATOM 0 HE3 TRP A 73 43.639 71.239 -8.320 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 46.793 73.429 -5.144 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 43.340 71.019 -5.886 1.00 0.00 H new ATOM 0 HH2 TRP A 73 44.900 72.101 -4.321 1.00 0.00 H new ATOM 1164 N ARG A 74 44.500 69.527 -12.223 1.00 0.00 N ATOM 1165 CA ARG A 74 43.542 68.875 -13.103 1.00 0.00 C ATOM 1166 C ARG A 74 42.263 68.654 -12.321 1.00 0.00 C ATOM 1167 O ARG A 74 42.272 68.769 -11.099 1.00 0.00 O ATOM 1168 CB ARG A 74 44.063 67.514 -13.573 1.00 0.00 C ATOM 1169 CG ARG A 74 45.451 67.534 -14.186 1.00 0.00 C ATOM 1170 CD ARG A 74 45.918 66.117 -14.475 1.00 0.00 C ATOM 1171 NE ARG A 74 47.311 66.060 -14.917 1.00 0.00 N ATOM 1172 CZ ARG A 74 48.165 65.104 -14.545 1.00 0.00 C ATOM 1173 NH1 ARG A 74 47.785 64.169 -13.680 1.00 0.00 N ATOM 1174 NH2 ARG A 74 49.397 65.093 -15.031 1.00 0.00 N ATOM 0 H ARG A 74 44.662 69.032 -11.346 1.00 0.00 H new ATOM 0 HA ARG A 74 43.376 69.505 -13.977 1.00 0.00 H new ATOM 0 HB2 ARG A 74 44.067 66.831 -12.724 1.00 0.00 H new ATOM 0 HB3 ARG A 74 43.365 67.108 -14.305 1.00 0.00 H new ATOM 0 HG2 ARG A 74 45.441 68.116 -15.107 1.00 0.00 H new ATOM 0 HG3 ARG A 74 46.149 68.023 -13.507 1.00 0.00 H new ATOM 0 HD2 ARG A 74 45.801 65.510 -13.577 1.00 0.00 H new ATOM 0 HD3 ARG A 74 45.280 65.678 -15.242 1.00 0.00 H new ATOM 0 HE ARG A 74 47.648 66.791 -15.544 1.00 0.00 H new ATOM 0 HH11 ARG A 74 46.839 64.181 -13.299 1.00 0.00 H new ATOM 0 HH12 ARG A 74 48.439 63.440 -13.397 1.00 0.00 H new ATOM 0 HH21 ARG A 74 49.692 65.815 -15.689 1.00 0.00 H new ATOM 0 HH22 ARG A 74 50.051 64.363 -14.748 1.00 0.00 H new ATOM 1188 N TRP A 75 41.172 68.334 -12.993 1.00 0.00 N ATOM 1189 CA TRP A 75 39.972 67.937 -12.273 1.00 0.00 C ATOM 1190 C TRP A 75 40.082 66.464 -11.881 1.00 0.00 C ATOM 1191 O TRP A 75 41.067 65.803 -12.215 1.00 0.00 O ATOM 1192 CB TRP A 75 38.713 68.206 -13.101 1.00 0.00 C ATOM 1193 CG TRP A 75 38.488 69.668 -13.372 1.00 0.00 C ATOM 1194 CD1 TRP A 75 38.834 70.348 -14.499 1.00 0.00 C ATOM 1195 CD2 TRP A 75 37.881 70.633 -12.497 1.00 0.00 C ATOM 1196 NE1 TRP A 75 38.476 71.666 -14.392 1.00 0.00 N ATOM 1197 CE2 TRP A 75 37.891 71.870 -13.172 1.00 0.00 C ATOM 1198 CE3 TRP A 75 37.329 70.574 -11.216 1.00 0.00 C ATOM 1199 CZ2 TRP A 75 37.373 73.031 -12.607 1.00 0.00 C ATOM 1200 CZ3 TRP A 75 36.815 71.728 -10.656 1.00 0.00 C ATOM 1201 CH2 TRP A 75 36.841 72.942 -11.352 1.00 0.00 C ATOM 0 H TRP A 75 41.089 68.340 -14.010 1.00 0.00 H new ATOM 0 HA TRP A 75 39.885 68.536 -11.367 1.00 0.00 H new ATOM 0 HB2 TRP A 75 38.788 67.674 -14.049 1.00 0.00 H new ATOM 0 HB3 TRP A 75 37.847 67.802 -12.577 1.00 0.00 H new ATOM 0 HD1 TRP A 75 39.322 69.910 -15.357 1.00 0.00 H new ATOM 0 HE1 TRP A 75 38.622 72.380 -15.106 1.00 0.00 H new ATOM 0 HE3 TRP A 75 37.304 69.642 -10.672 1.00 0.00 H new ATOM 0 HZ2 TRP A 75 37.391 73.969 -13.142 1.00 0.00 H new ATOM 0 HZ3 TRP A 75 36.386 71.693 -9.665 1.00 0.00 H new ATOM 0 HH2 TRP A 75 36.432 73.827 -10.887 1.00 0.00 H new ATOM 1212 N VAL A 76 39.093 65.961 -11.152 1.00 0.00 N ATOM 1213 CA VAL A 76 39.129 64.588 -10.654 1.00 0.00 C ATOM 1214 C VAL A 76 39.140 63.579 -11.802 1.00 0.00 C ATOM 1215 O VAL A 76 39.772 62.525 -11.711 1.00 0.00 O ATOM 1216 CB VAL A 76 37.944 64.293 -9.704 1.00 0.00 C ATOM 1217 CG1 VAL A 76 36.607 64.413 -10.419 1.00 0.00 C ATOM 1218 CG2 VAL A 76 38.094 62.919 -9.080 1.00 0.00 C ATOM 0 H VAL A 76 38.256 66.482 -10.892 1.00 0.00 H new ATOM 0 HA VAL A 76 40.055 64.483 -10.089 1.00 0.00 H new ATOM 0 HB VAL A 76 37.961 65.042 -8.912 1.00 0.00 H new ATOM 0 HG11 VAL A 76 35.799 64.199 -9.719 1.00 0.00 H new ATOM 0 HG12 VAL A 76 36.492 65.425 -10.807 1.00 0.00 H new ATOM 0 HG13 VAL A 76 36.570 63.702 -11.244 1.00 0.00 H new ATOM 0 HG21 VAL A 76 37.252 62.728 -8.415 1.00 0.00 H new ATOM 0 HG22 VAL A 76 38.115 62.163 -9.865 1.00 0.00 H new ATOM 0 HG23 VAL A 76 39.023 62.877 -8.511 1.00 0.00 H new ATOM 1228 N ASP A 77 38.450 63.916 -12.879 1.00 0.00 N ATOM 1229 CA ASP A 77 38.419 63.076 -14.065 1.00 0.00 C ATOM 1230 C ASP A 77 39.256 63.747 -15.150 1.00 0.00 C ATOM 1231 O ASP A 77 39.970 64.712 -14.868 1.00 0.00 O ATOM 1232 CB ASP A 77 36.969 62.867 -14.526 1.00 0.00 C ATOM 1233 CG ASP A 77 36.805 61.665 -15.440 1.00 0.00 C ATOM 1234 OD1 ASP A 77 36.970 61.822 -16.669 1.00 0.00 O ATOM 1235 OD2 ASP A 77 36.504 60.565 -14.926 1.00 0.00 O ATOM 0 H ASP A 77 37.900 64.772 -12.956 1.00 0.00 H new ATOM 0 HA ASP A 77 38.836 62.093 -13.847 1.00 0.00 H new ATOM 0 HB2 ASP A 77 36.330 62.742 -13.652 1.00 0.00 H new ATOM 0 HB3 ASP A 77 36.626 63.762 -15.046 1.00 0.00 H new ATOM 1240 N GLN A 78 39.178 63.266 -16.380 1.00 0.00 N ATOM 1241 CA GLN A 78 39.949 63.852 -17.463 1.00 0.00 C ATOM 1242 C GLN A 78 39.292 65.148 -17.936 1.00 0.00 C ATOM 1243 O GLN A 78 38.638 65.193 -18.979 1.00 0.00 O ATOM 1244 CB GLN A 78 40.105 62.856 -18.619 1.00 0.00 C ATOM 1245 CG GLN A 78 40.967 63.363 -19.770 1.00 0.00 C ATOM 1246 CD GLN A 78 42.317 63.884 -19.316 1.00 0.00 C ATOM 1247 OE1 GLN A 78 43.277 63.130 -19.190 1.00 0.00 O ATOM 1248 NE2 GLN A 78 42.408 65.189 -19.096 1.00 0.00 N ATOM 0 H GLN A 78 38.592 62.476 -16.652 1.00 0.00 H new ATOM 0 HA GLN A 78 40.947 64.090 -17.094 1.00 0.00 H new ATOM 0 HB2 GLN A 78 40.540 61.934 -18.233 1.00 0.00 H new ATOM 0 HB3 GLN A 78 39.116 62.605 -19.004 1.00 0.00 H new ATOM 0 HG2 GLN A 78 41.118 62.556 -20.486 1.00 0.00 H new ATOM 0 HG3 GLN A 78 40.434 64.158 -20.293 1.00 0.00 H new ATOM 0 HE21 GLN A 78 41.588 65.784 -19.211 1.00 0.00 H new ATOM 0 HE22 GLN A 78 43.298 65.597 -18.812 1.00 0.00 H new ATOM 1257 N THR A 79 39.424 66.184 -17.124 1.00 0.00 N ATOM 1258 CA THR A 79 38.910 67.500 -17.458 1.00 0.00 C ATOM 1259 C THR A 79 39.987 68.563 -17.227 1.00 0.00 C ATOM 1260 O THR A 79 40.626 68.587 -16.167 1.00 0.00 O ATOM 1261 CB THR A 79 37.661 67.829 -16.613 1.00 0.00 C ATOM 1262 OG1 THR A 79 36.773 66.705 -16.602 1.00 0.00 O ATOM 1263 CG2 THR A 79 36.926 69.044 -17.167 1.00 0.00 C ATOM 0 H THR A 79 39.889 66.136 -16.218 1.00 0.00 H new ATOM 0 HA THR A 79 38.628 67.499 -18.511 1.00 0.00 H new ATOM 0 HB THR A 79 37.990 68.054 -15.599 1.00 0.00 H new ATOM 0 HG1 THR A 79 35.983 66.918 -16.063 1.00 0.00 H new ATOM 0 HG21 THR A 79 36.051 69.252 -16.551 1.00 0.00 H new ATOM 0 HG22 THR A 79 37.591 69.908 -17.156 1.00 0.00 H new ATOM 0 HG23 THR A 79 36.610 68.843 -18.191 1.00 0.00 H new ATOM 1271 N PRO A 80 40.233 69.422 -18.234 1.00 0.00 N ATOM 1272 CA PRO A 80 41.190 70.532 -18.130 1.00 0.00 C ATOM 1273 C PRO A 80 40.714 71.618 -17.169 1.00 0.00 C ATOM 1274 O PRO A 80 39.518 71.902 -17.075 1.00 0.00 O ATOM 1275 CB PRO A 80 41.273 71.079 -19.564 1.00 0.00 C ATOM 1276 CG PRO A 80 40.660 70.022 -20.421 1.00 0.00 C ATOM 1277 CD PRO A 80 39.619 69.367 -19.567 1.00 0.00 C ATOM 0 HA PRO A 80 42.151 70.202 -17.735 1.00 0.00 H new ATOM 0 HB2 PRO A 80 40.736 72.023 -19.657 1.00 0.00 H new ATOM 0 HB3 PRO A 80 42.306 71.271 -19.853 1.00 0.00 H new ATOM 0 HG2 PRO A 80 40.217 70.453 -21.319 1.00 0.00 H new ATOM 0 HG3 PRO A 80 41.408 69.301 -20.750 1.00 0.00 H new ATOM 0 HD2 PRO A 80 38.670 69.901 -19.600 1.00 0.00 H new ATOM 0 HD3 PRO A 80 39.420 68.343 -19.882 1.00 0.00 H new ATOM 1285 N PHE A 81 41.658 72.224 -16.462 1.00 0.00 N ATOM 1286 CA PHE A 81 41.346 73.228 -15.452 1.00 0.00 C ATOM 1287 C PHE A 81 40.819 74.512 -16.094 1.00 0.00 C ATOM 1288 O PHE A 81 41.264 74.903 -17.170 1.00 0.00 O ATOM 1289 CB PHE A 81 42.594 73.525 -14.613 1.00 0.00 C ATOM 1290 CG PHE A 81 42.351 74.477 -13.477 1.00 0.00 C ATOM 1291 CD1 PHE A 81 41.570 74.098 -12.399 1.00 0.00 C ATOM 1292 CD2 PHE A 81 42.899 75.749 -13.488 1.00 0.00 C ATOM 1293 CE1 PHE A 81 41.338 74.968 -11.353 1.00 0.00 C ATOM 1294 CE2 PHE A 81 42.671 76.624 -12.444 1.00 0.00 C ATOM 1295 CZ PHE A 81 41.890 76.233 -11.375 1.00 0.00 C ATOM 0 H PHE A 81 42.655 72.036 -16.570 1.00 0.00 H new ATOM 0 HA PHE A 81 40.563 72.833 -14.805 1.00 0.00 H new ATOM 0 HB2 PHE A 81 42.982 72.588 -14.213 1.00 0.00 H new ATOM 0 HB3 PHE A 81 43.366 73.938 -15.262 1.00 0.00 H new ATOM 0 HD1 PHE A 81 41.137 73.109 -12.376 1.00 0.00 H new ATOM 0 HD2 PHE A 81 43.511 76.060 -14.322 1.00 0.00 H new ATOM 0 HE1 PHE A 81 40.726 74.660 -10.519 1.00 0.00 H new ATOM 0 HE2 PHE A 81 43.103 77.613 -12.464 1.00 0.00 H new ATOM 0 HZ PHE A 81 41.711 76.916 -10.557 1.00 0.00 H new ATOM 1305 N ASN A 82 39.860 75.151 -15.428 1.00 0.00 N ATOM 1306 CA ASN A 82 39.299 76.416 -15.904 1.00 0.00 C ATOM 1307 C ASN A 82 40.246 77.573 -15.603 1.00 0.00 C ATOM 1308 O ASN A 82 40.417 77.953 -14.447 1.00 0.00 O ATOM 1309 CB ASN A 82 37.938 76.692 -15.252 1.00 0.00 C ATOM 1310 CG ASN A 82 36.786 75.971 -15.928 1.00 0.00 C ATOM 1311 OD1 ASN A 82 36.165 76.503 -16.851 1.00 0.00 O ATOM 1312 ND2 ASN A 82 36.473 74.773 -15.461 1.00 0.00 N ATOM 0 H ASN A 82 39.454 74.814 -14.555 1.00 0.00 H new ATOM 0 HA ASN A 82 39.166 76.332 -16.983 1.00 0.00 H new ATOM 0 HB2 ASN A 82 37.979 76.393 -14.204 1.00 0.00 H new ATOM 0 HB3 ASN A 82 37.746 77.765 -15.271 1.00 0.00 H new ATOM 0 HD21 ASN A 82 35.693 74.255 -15.866 1.00 0.00 H new ATOM 0 HD22 ASN A 82 37.012 74.367 -14.696 1.00 0.00 H new ATOM 1319 N PRO A 83 40.863 78.159 -16.642 1.00 0.00 N ATOM 1320 CA PRO A 83 41.844 79.241 -16.483 1.00 0.00 C ATOM 1321 C PRO A 83 41.218 80.536 -15.967 1.00 0.00 C ATOM 1322 O PRO A 83 41.698 81.126 -15.003 1.00 0.00 O ATOM 1323 CB PRO A 83 42.401 79.445 -17.901 1.00 0.00 C ATOM 1324 CG PRO A 83 41.955 78.251 -18.680 1.00 0.00 C ATOM 1325 CD PRO A 83 40.667 77.810 -18.055 1.00 0.00 C ATOM 0 HA PRO A 83 42.604 78.982 -15.746 1.00 0.00 H new ATOM 0 HB2 PRO A 83 42.021 80.366 -18.343 1.00 0.00 H new ATOM 0 HB3 PRO A 83 43.488 79.522 -17.888 1.00 0.00 H new ATOM 0 HG2 PRO A 83 41.813 78.501 -19.731 1.00 0.00 H new ATOM 0 HG3 PRO A 83 42.701 77.457 -18.639 1.00 0.00 H new ATOM 0 HD2 PRO A 83 39.809 78.327 -18.485 1.00 0.00 H new ATOM 0 HD3 PRO A 83 40.496 76.742 -18.189 1.00 0.00 H new ATOM 1333 N ARG A 84 40.138 80.972 -16.610 1.00 0.00 N ATOM 1334 CA ARG A 84 39.483 82.224 -16.237 1.00 0.00 C ATOM 1335 C ARG A 84 38.533 82.029 -15.059 1.00 0.00 C ATOM 1336 O ARG A 84 37.907 82.977 -14.594 1.00 0.00 O ATOM 1337 CB ARG A 84 38.728 82.813 -17.424 1.00 0.00 C ATOM 1338 CG ARG A 84 39.641 83.308 -18.531 1.00 0.00 C ATOM 1339 CD ARG A 84 38.907 84.264 -19.449 1.00 0.00 C ATOM 1340 NE ARG A 84 39.760 84.771 -20.527 1.00 0.00 N ATOM 1341 CZ ARG A 84 39.417 85.770 -21.345 1.00 0.00 C ATOM 1342 NH1 ARG A 84 38.235 86.368 -21.214 1.00 0.00 N ATOM 1343 NH2 ARG A 84 40.256 86.170 -22.295 1.00 0.00 N ATOM 0 H ARG A 84 39.699 80.480 -17.388 1.00 0.00 H new ATOM 0 HA ARG A 84 40.263 82.921 -15.932 1.00 0.00 H new ATOM 0 HB2 ARG A 84 38.055 82.057 -17.829 1.00 0.00 H new ATOM 0 HB3 ARG A 84 38.108 83.640 -17.077 1.00 0.00 H new ATOM 0 HG2 ARG A 84 40.508 83.807 -18.097 1.00 0.00 H new ATOM 0 HG3 ARG A 84 40.015 82.461 -19.106 1.00 0.00 H new ATOM 0 HD2 ARG A 84 38.044 83.758 -19.881 1.00 0.00 H new ATOM 0 HD3 ARG A 84 38.526 85.103 -18.866 1.00 0.00 H new ATOM 0 HE ARG A 84 40.672 84.334 -20.661 1.00 0.00 H new ATOM 0 HH11 ARG A 84 37.587 86.064 -20.487 1.00 0.00 H new ATOM 0 HH12 ARG A 84 37.977 87.130 -21.841 1.00 0.00 H new ATOM 0 HH21 ARG A 84 41.162 85.714 -22.400 1.00 0.00 H new ATOM 0 HH22 ARG A 84 39.993 86.933 -22.919 1.00 0.00 H new ATOM 1357 N ARG A 85 38.432 80.798 -14.579 1.00 0.00 N ATOM 1358 CA ARG A 85 37.575 80.492 -13.444 1.00 0.00 C ATOM 1359 C ARG A 85 38.344 79.708 -12.395 1.00 0.00 C ATOM 1360 O ARG A 85 38.031 78.553 -12.110 1.00 0.00 O ATOM 1361 CB ARG A 85 36.327 79.718 -13.880 1.00 0.00 C ATOM 1362 CG ARG A 85 35.285 80.578 -14.572 1.00 0.00 C ATOM 1363 CD ARG A 85 34.023 79.788 -14.870 1.00 0.00 C ATOM 1364 NE ARG A 85 34.226 78.782 -15.907 1.00 0.00 N ATOM 1365 CZ ARG A 85 33.520 78.734 -17.032 1.00 0.00 C ATOM 1366 NH1 ARG A 85 32.579 79.649 -17.274 1.00 0.00 N ATOM 1367 NH2 ARG A 85 33.757 77.773 -17.919 1.00 0.00 N ATOM 0 H ARG A 85 38.933 79.995 -14.958 1.00 0.00 H new ATOM 0 HA ARG A 85 37.248 81.436 -13.009 1.00 0.00 H new ATOM 0 HB2 ARG A 85 36.626 78.914 -14.552 1.00 0.00 H new ATOM 0 HB3 ARG A 85 35.876 79.251 -13.005 1.00 0.00 H new ATOM 0 HG2 ARG A 85 35.040 81.433 -13.942 1.00 0.00 H new ATOM 0 HG3 ARG A 85 35.696 80.974 -15.501 1.00 0.00 H new ATOM 0 HD2 ARG A 85 33.679 79.301 -13.958 1.00 0.00 H new ATOM 0 HD3 ARG A 85 33.235 80.473 -15.182 1.00 0.00 H new ATOM 0 HE ARG A 85 34.949 78.077 -15.761 1.00 0.00 H new ATOM 0 HH11 ARG A 85 32.400 80.388 -16.594 1.00 0.00 H new ATOM 0 HH12 ARG A 85 32.039 79.609 -18.138 1.00 0.00 H new ATOM 0 HH21 ARG A 85 34.478 77.076 -17.735 1.00 0.00 H new ATOM 0 HH22 ARG A 85 33.217 77.733 -18.784 1.00 0.00 H new ATOM 1381 N VAL A 86 39.371 80.340 -11.848 1.00 0.00 N ATOM 1382 CA VAL A 86 40.174 79.726 -10.802 1.00 0.00 C ATOM 1383 C VAL A 86 39.530 79.960 -9.433 1.00 0.00 C ATOM 1384 O VAL A 86 39.627 79.118 -8.544 1.00 0.00 O ATOM 1385 CB VAL A 86 41.623 80.270 -10.825 1.00 0.00 C ATOM 1386 CG1 VAL A 86 41.668 81.752 -10.479 1.00 0.00 C ATOM 1387 CG2 VAL A 86 42.519 79.466 -9.899 1.00 0.00 C ATOM 0 H VAL A 86 39.668 81.279 -12.112 1.00 0.00 H new ATOM 0 HA VAL A 86 40.216 78.653 -10.988 1.00 0.00 H new ATOM 0 HB VAL A 86 42.001 80.160 -11.841 1.00 0.00 H new ATOM 0 HG11 VAL A 86 42.700 82.100 -10.505 1.00 0.00 H new ATOM 0 HG12 VAL A 86 41.078 82.313 -11.204 1.00 0.00 H new ATOM 0 HG13 VAL A 86 41.258 81.905 -9.481 1.00 0.00 H new ATOM 0 HG21 VAL A 86 43.532 79.868 -9.933 1.00 0.00 H new ATOM 0 HG22 VAL A 86 42.138 79.528 -8.880 1.00 0.00 H new ATOM 0 HG23 VAL A 86 42.531 78.424 -10.219 1.00 0.00 H new ATOM 1397 N PHE A 87 38.866 81.112 -9.296 1.00 0.00 N ATOM 1398 CA PHE A 87 38.087 81.465 -8.102 1.00 0.00 C ATOM 1399 C PHE A 87 38.950 81.666 -6.853 1.00 0.00 C ATOM 1400 O PHE A 87 39.118 82.793 -6.388 1.00 0.00 O ATOM 1401 CB PHE A 87 37.000 80.419 -7.820 1.00 0.00 C ATOM 1402 CG PHE A 87 35.942 80.335 -8.886 1.00 0.00 C ATOM 1403 CD1 PHE A 87 35.105 81.410 -9.140 1.00 0.00 C ATOM 1404 CD2 PHE A 87 35.780 79.176 -9.628 1.00 0.00 C ATOM 1405 CE1 PHE A 87 34.128 81.331 -10.113 1.00 0.00 C ATOM 1406 CE2 PHE A 87 34.805 79.091 -10.602 1.00 0.00 C ATOM 1407 CZ PHE A 87 33.977 80.169 -10.846 1.00 0.00 C ATOM 0 H PHE A 87 38.853 81.833 -10.017 1.00 0.00 H new ATOM 0 HA PHE A 87 37.620 82.423 -8.328 1.00 0.00 H new ATOM 0 HB2 PHE A 87 37.470 79.442 -7.711 1.00 0.00 H new ATOM 0 HB3 PHE A 87 36.524 80.652 -6.867 1.00 0.00 H new ATOM 0 HD1 PHE A 87 35.218 82.320 -8.570 1.00 0.00 H new ATOM 0 HD2 PHE A 87 36.424 78.329 -9.442 1.00 0.00 H new ATOM 0 HE1 PHE A 87 33.483 82.176 -10.301 1.00 0.00 H new ATOM 0 HE2 PHE A 87 34.690 78.182 -11.173 1.00 0.00 H new ATOM 0 HZ PHE A 87 33.214 80.104 -11.607 1.00 0.00 H new ATOM 1417 N TRP A 88 39.508 80.573 -6.339 1.00 0.00 N ATOM 1418 CA TRP A 88 40.129 80.553 -5.013 1.00 0.00 C ATOM 1419 C TRP A 88 39.157 81.074 -3.951 1.00 0.00 C ATOM 1420 O TRP A 88 37.939 81.033 -4.141 1.00 0.00 O ATOM 1421 CB TRP A 88 41.435 81.348 -5.008 1.00 0.00 C ATOM 1422 CG TRP A 88 42.537 80.662 -5.751 1.00 0.00 C ATOM 1423 CD1 TRP A 88 43.157 81.101 -6.880 1.00 0.00 C ATOM 1424 CD2 TRP A 88 43.138 79.402 -5.424 1.00 0.00 C ATOM 1425 NE1 TRP A 88 44.125 80.205 -7.266 1.00 0.00 N ATOM 1426 CE2 TRP A 88 44.128 79.150 -6.392 1.00 0.00 C ATOM 1427 CE3 TRP A 88 42.939 78.465 -4.405 1.00 0.00 C ATOM 1428 CZ2 TRP A 88 44.916 78.001 -6.371 1.00 0.00 C ATOM 1429 CZ3 TRP A 88 43.720 77.325 -4.387 1.00 0.00 C ATOM 1430 CH2 TRP A 88 44.698 77.102 -5.364 1.00 0.00 C ATOM 0 H TRP A 88 39.544 79.678 -6.826 1.00 0.00 H new ATOM 0 HA TRP A 88 40.371 79.519 -4.766 1.00 0.00 H new ATOM 0 HB2 TRP A 88 41.260 82.328 -5.452 1.00 0.00 H new ATOM 0 HB3 TRP A 88 41.748 81.516 -3.978 1.00 0.00 H new ATOM 0 HD1 TRP A 88 42.923 82.020 -7.397 1.00 0.00 H new ATOM 0 HE1 TRP A 88 44.741 80.309 -8.072 1.00 0.00 H new ATOM 0 HE3 TRP A 88 42.189 78.629 -3.646 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 45.672 77.827 -7.123 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 43.574 76.594 -3.606 1.00 0.00 H new ATOM 0 HH2 TRP A 88 45.292 76.201 -5.321 1.00 0.00 H new ATOM 1441 N HIS A 89 39.680 81.526 -2.816 1.00 0.00 N ATOM 1442 CA HIS A 89 38.828 82.020 -1.744 1.00 0.00 C ATOM 1443 C HIS A 89 38.767 83.550 -1.754 1.00 0.00 C ATOM 1444 O HIS A 89 37.801 84.150 -1.268 1.00 0.00 O ATOM 1445 CB HIS A 89 39.336 81.510 -0.392 1.00 0.00 C ATOM 1446 CG HIS A 89 38.270 81.455 0.654 1.00 0.00 C ATOM 1447 ND1 HIS A 89 38.141 82.394 1.650 1.00 0.00 N ATOM 1448 CD2 HIS A 89 37.251 80.582 0.827 1.00 0.00 C ATOM 1449 CE1 HIS A 89 37.079 82.108 2.386 1.00 0.00 C ATOM 1450 NE2 HIS A 89 36.524 81.010 1.907 1.00 0.00 N ATOM 0 H HIS A 89 40.680 81.560 -2.617 1.00 0.00 H new ATOM 0 HA HIS A 89 37.818 81.644 -1.905 1.00 0.00 H new ATOM 0 HB2 HIS A 89 39.760 80.514 -0.522 1.00 0.00 H new ATOM 0 HB3 HIS A 89 40.142 82.157 -0.046 1.00 0.00 H new ATOM 0 HD1 HIS A 89 38.766 83.187 1.798 1.00 0.00 H new ATOM 0 HD2 HIS A 89 37.048 79.709 0.225 1.00 0.00 H new ATOM 0 HE1 HIS A 89 36.726 82.676 3.234 1.00 0.00 H new ATOM 1459 N LYS A 90 39.800 84.161 -2.331 1.00 0.00 N ATOM 1460 CA LYS A 90 39.952 85.617 -2.412 1.00 0.00 C ATOM 1461 C LYS A 90 41.348 85.922 -2.937 1.00 0.00 C ATOM 1462 O LYS A 90 41.523 86.374 -4.063 1.00 0.00 O ATOM 1463 CB LYS A 90 39.732 86.282 -1.042 1.00 0.00 C ATOM 1464 CG LYS A 90 40.208 87.725 -0.958 1.00 0.00 C ATOM 1465 CD LYS A 90 39.865 88.364 0.383 1.00 0.00 C ATOM 1466 CE LYS A 90 40.386 87.560 1.574 1.00 0.00 C ATOM 1467 NZ LYS A 90 41.860 87.352 1.528 1.00 0.00 N ATOM 0 H LYS A 90 40.570 83.651 -2.764 1.00 0.00 H new ATOM 0 HA LYS A 90 39.198 86.022 -3.087 1.00 0.00 H new ATOM 0 HB2 LYS A 90 38.669 86.249 -0.802 1.00 0.00 H new ATOM 0 HB3 LYS A 90 40.249 85.697 -0.281 1.00 0.00 H new ATOM 0 HG2 LYS A 90 41.287 87.760 -1.111 1.00 0.00 H new ATOM 0 HG3 LYS A 90 39.753 88.304 -1.762 1.00 0.00 H new ATOM 0 HD2 LYS A 90 40.284 89.370 0.419 1.00 0.00 H new ATOM 0 HD3 LYS A 90 38.783 88.466 0.465 1.00 0.00 H new ATOM 0 HE2 LYS A 90 40.125 88.077 2.498 1.00 0.00 H new ATOM 0 HE3 LYS A 90 39.887 86.591 1.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 42.202 87.083 2.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 42.083 86.595 0.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 42.326 88.232 1.229 1.00 0.00 H new ATOM 1481 N ASN A 91 42.330 85.669 -2.094 1.00 0.00 N ATOM 1482 CA ASN A 91 43.721 85.629 -2.510 1.00 0.00 C ATOM 1483 C ASN A 91 44.412 84.486 -1.786 1.00 0.00 C ATOM 1484 O ASN A 91 45.633 84.366 -1.802 1.00 0.00 O ATOM 1485 CB ASN A 91 44.447 86.967 -2.272 1.00 0.00 C ATOM 1486 CG ASN A 91 44.329 87.513 -0.856 1.00 0.00 C ATOM 1487 OD1 ASN A 91 44.152 86.778 0.112 1.00 0.00 O ATOM 1488 ND2 ASN A 91 44.439 88.829 -0.728 1.00 0.00 N ATOM 0 H ASN A 91 42.187 85.485 -1.101 1.00 0.00 H new ATOM 0 HA ASN A 91 43.758 85.461 -3.586 1.00 0.00 H new ATOM 0 HB2 ASN A 91 45.503 86.839 -2.510 1.00 0.00 H new ATOM 0 HB3 ASN A 91 44.051 87.708 -2.966 1.00 0.00 H new ATOM 0 HD21 ASN A 91 44.377 89.259 0.195 1.00 0.00 H new ATOM 0 HD22 ASN A 91 44.586 89.411 -1.553 1.00 0.00 H new ATOM 1495 N GLU A 92 43.589 83.648 -1.156 1.00 0.00 N ATOM 1496 CA GLU A 92 44.048 82.446 -0.482 1.00 0.00 C ATOM 1497 C GLU A 92 44.289 81.351 -1.519 1.00 0.00 C ATOM 1498 O GLU A 92 43.338 80.781 -2.059 1.00 0.00 O ATOM 1499 CB GLU A 92 43.007 81.975 0.551 1.00 0.00 C ATOM 1500 CG GLU A 92 42.639 83.012 1.616 1.00 0.00 C ATOM 1501 CD GLU A 92 41.577 84.008 1.166 1.00 0.00 C ATOM 1502 OE1 GLU A 92 41.924 84.985 0.473 1.00 0.00 O ATOM 1503 OE2 GLU A 92 40.387 83.830 1.515 1.00 0.00 O ATOM 0 H GLU A 92 42.580 83.790 -1.102 1.00 0.00 H new ATOM 0 HA GLU A 92 44.977 82.664 0.044 1.00 0.00 H new ATOM 0 HB2 GLU A 92 42.100 81.681 0.023 1.00 0.00 H new ATOM 0 HB3 GLU A 92 43.389 81.084 1.049 1.00 0.00 H new ATOM 0 HG2 GLU A 92 42.283 82.494 2.506 1.00 0.00 H new ATOM 0 HG3 GLU A 92 43.537 83.558 1.903 1.00 0.00 H new ATOM 1510 N PRO A 93 45.563 81.069 -1.832 1.00 0.00 N ATOM 1511 CA PRO A 93 45.949 80.169 -2.902 1.00 0.00 C ATOM 1512 C PRO A 93 46.356 78.782 -2.409 1.00 0.00 C ATOM 1513 O PRO A 93 45.883 78.314 -1.374 1.00 0.00 O ATOM 1514 CB PRO A 93 47.159 80.906 -3.471 1.00 0.00 C ATOM 1515 CG PRO A 93 47.792 81.587 -2.288 1.00 0.00 C ATOM 1516 CD PRO A 93 46.755 81.622 -1.183 1.00 0.00 C ATOM 0 HA PRO A 93 45.139 79.970 -3.604 1.00 0.00 H new ATOM 0 HB2 PRO A 93 47.854 80.215 -3.947 1.00 0.00 H new ATOM 0 HB3 PRO A 93 46.860 81.630 -4.229 1.00 0.00 H new ATOM 0 HG2 PRO A 93 48.682 81.047 -1.964 1.00 0.00 H new ATOM 0 HG3 PRO A 93 48.110 82.596 -2.550 1.00 0.00 H new ATOM 0 HD2 PRO A 93 47.060 81.025 -0.324 1.00 0.00 H new ATOM 0 HD3 PRO A 93 46.584 82.636 -0.822 1.00 0.00 H new ATOM 1524 N ASP A 94 47.230 78.142 -3.181 1.00 0.00 N ATOM 1525 CA ASP A 94 47.772 76.826 -2.849 1.00 0.00 C ATOM 1526 C ASP A 94 48.532 76.884 -1.525 1.00 0.00 C ATOM 1527 O ASP A 94 49.280 77.833 -1.272 1.00 0.00 O ATOM 1528 CB ASP A 94 48.702 76.369 -3.981 1.00 0.00 C ATOM 1529 CG ASP A 94 49.271 74.977 -3.780 1.00 0.00 C ATOM 1530 OD1 ASP A 94 50.328 74.854 -3.131 1.00 0.00 O ATOM 1531 OD2 ASP A 94 48.675 74.015 -4.307 1.00 0.00 O ATOM 0 H ASP A 94 47.584 78.523 -4.059 1.00 0.00 H new ATOM 0 HA ASP A 94 46.956 76.112 -2.740 1.00 0.00 H new ATOM 0 HB2 ASP A 94 48.153 76.395 -4.922 1.00 0.00 H new ATOM 0 HB3 ASP A 94 49.525 77.078 -4.072 1.00 0.00 H new ATOM 1536 N ASN A 95 48.318 75.890 -0.677 1.00 0.00 N ATOM 1537 CA ASN A 95 48.944 75.867 0.638 1.00 0.00 C ATOM 1538 C ASN A 95 49.519 74.487 0.945 1.00 0.00 C ATOM 1539 O ASN A 95 50.589 74.365 1.549 1.00 0.00 O ATOM 1540 CB ASN A 95 47.926 76.258 1.714 1.00 0.00 C ATOM 1541 CG ASN A 95 48.542 76.372 3.100 1.00 0.00 C ATOM 1542 OD1 ASN A 95 49.793 76.803 3.167 1.00 0.00 O flip ATOM 1543 ND2 ASN A 95 47.892 76.091 4.106 1.00 0.00 N flip ATOM 0 H ASN A 95 47.717 75.090 -0.874 1.00 0.00 H new ATOM 0 HA ASN A 95 49.761 76.588 0.637 1.00 0.00 H new ATOM 0 HB2 ASN A 95 47.469 77.211 1.446 1.00 0.00 H new ATOM 0 HB3 ASN A 95 47.127 75.517 1.737 1.00 0.00 H new ATOM 0 HD21 ASN A 95 46.931 75.762 4.017 1.00 0.00 H new ATOM 0 HD22 ASN A 95 48.314 76.187 5.029 1.00 0.00 H new ATOM 1550 N SER A 96 48.808 73.455 0.528 1.00 0.00 N ATOM 1551 CA SER A 96 49.218 72.088 0.783 1.00 0.00 C ATOM 1552 C SER A 96 50.193 71.622 -0.295 1.00 0.00 C ATOM 1553 O SER A 96 50.164 72.106 -1.419 1.00 0.00 O ATOM 1554 CB SER A 96 47.985 71.178 0.826 1.00 0.00 C ATOM 1555 OG SER A 96 48.321 69.862 1.239 1.00 0.00 O ATOM 0 H SER A 96 47.936 73.541 0.006 1.00 0.00 H new ATOM 0 HA SER A 96 49.724 72.038 1.747 1.00 0.00 H new ATOM 0 HB2 SER A 96 47.246 71.597 1.509 1.00 0.00 H new ATOM 0 HB3 SER A 96 47.523 71.144 -0.161 1.00 0.00 H new ATOM 0 HG SER A 96 47.942 69.214 0.608 1.00 0.00 H new ATOM 1561 N GLN A 97 51.066 70.691 0.057 1.00 0.00 N ATOM 1562 CA GLN A 97 52.030 70.156 -0.892 1.00 0.00 C ATOM 1563 C GLN A 97 51.947 68.639 -0.927 1.00 0.00 C ATOM 1564 O GLN A 97 51.877 67.987 0.115 1.00 0.00 O ATOM 1565 CB GLN A 97 53.448 70.604 -0.532 1.00 0.00 C ATOM 1566 CG GLN A 97 53.692 72.089 -0.745 1.00 0.00 C ATOM 1567 CD GLN A 97 53.657 72.486 -2.211 1.00 0.00 C ATOM 1568 OE1 GLN A 97 54.678 72.447 -2.896 1.00 0.00 O ATOM 1569 NE2 GLN A 97 52.489 72.875 -2.700 1.00 0.00 N ATOM 0 H GLN A 97 51.127 70.290 0.993 1.00 0.00 H new ATOM 0 HA GLN A 97 51.790 70.543 -1.882 1.00 0.00 H new ATOM 0 HB2 GLN A 97 53.643 70.359 0.512 1.00 0.00 H new ATOM 0 HB3 GLN A 97 54.161 70.038 -1.131 1.00 0.00 H new ATOM 0 HG2 GLN A 97 52.938 72.658 -0.201 1.00 0.00 H new ATOM 0 HG3 GLN A 97 54.661 72.358 -0.323 1.00 0.00 H new ATOM 0 HE21 GLN A 97 51.665 72.893 -2.099 1.00 0.00 H new ATOM 0 HE22 GLN A 97 52.414 73.156 -3.678 1.00 0.00 H new ATOM 1578 N GLY A 98 51.932 68.085 -2.129 1.00 0.00 N ATOM 1579 CA GLY A 98 51.828 66.648 -2.284 1.00 0.00 C ATOM 1580 C GLY A 98 50.385 66.224 -2.402 1.00 0.00 C ATOM 1581 O GLY A 98 49.962 65.691 -3.427 1.00 0.00 O ATOM 0 H GLY A 98 51.990 68.606 -3.004 1.00 0.00 H new ATOM 0 HA2 GLY A 98 52.378 66.333 -3.171 1.00 0.00 H new ATOM 0 HA3 GLY A 98 52.289 66.151 -1.430 1.00 0.00 H new ATOM 1585 N GLU A 99 49.629 66.464 -1.345 1.00 0.00 N ATOM 1586 CA GLU A 99 48.194 66.269 -1.374 1.00 0.00 C ATOM 1587 C GLU A 99 47.484 67.602 -1.243 1.00 0.00 C ATOM 1588 O GLU A 99 46.975 67.943 -0.175 1.00 0.00 O ATOM 1589 CB GLU A 99 47.737 65.333 -0.264 1.00 0.00 C ATOM 1590 CG GLU A 99 48.097 63.885 -0.496 1.00 0.00 C ATOM 1591 CD GLU A 99 47.462 62.985 0.537 1.00 0.00 C ATOM 1592 OE1 GLU A 99 48.084 62.763 1.594 1.00 0.00 O ATOM 1593 OE2 GLU A 99 46.321 62.533 0.308 1.00 0.00 O ATOM 0 H GLU A 99 49.990 66.797 -0.451 1.00 0.00 H new ATOM 0 HA GLU A 99 47.940 65.812 -2.330 1.00 0.00 H new ATOM 0 HB2 GLU A 99 48.178 65.660 0.678 1.00 0.00 H new ATOM 0 HB3 GLU A 99 46.656 65.415 -0.155 1.00 0.00 H new ATOM 0 HG2 GLU A 99 47.772 63.583 -1.492 1.00 0.00 H new ATOM 0 HG3 GLU A 99 49.180 63.769 -0.465 1.00 0.00 H new ATOM 1600 N ASN A 100 47.499 68.368 -2.314 1.00 0.00 N ATOM 1601 CA ASN A 100 46.807 69.641 -2.355 1.00 0.00 C ATOM 1602 C ASN A 100 45.554 69.533 -3.211 1.00 0.00 C ATOM 1603 O ASN A 100 45.598 69.092 -4.364 1.00 0.00 O ATOM 1604 CB ASN A 100 47.728 70.777 -2.848 1.00 0.00 C ATOM 1605 CG ASN A 100 48.657 70.394 -3.996 1.00 0.00 C ATOM 1606 OD1 ASN A 100 49.107 69.252 -4.111 1.00 0.00 O ATOM 1607 ND2 ASN A 100 48.994 71.363 -4.829 1.00 0.00 N ATOM 0 H ASN A 100 47.988 68.128 -3.176 1.00 0.00 H new ATOM 0 HA ASN A 100 46.509 69.895 -1.338 1.00 0.00 H new ATOM 0 HB2 ASN A 100 47.109 71.616 -3.165 1.00 0.00 H new ATOM 0 HB3 ASN A 100 48.333 71.125 -2.010 1.00 0.00 H new ATOM 0 HD21 ASN A 100 49.643 71.176 -5.593 1.00 0.00 H new ATOM 0 HD22 ASN A 100 48.605 72.298 -4.708 1.00 0.00 H new ATOM 1614 N CYS A 101 44.432 69.901 -2.616 1.00 0.00 N ATOM 1615 CA CYS A 101 43.137 69.823 -3.268 1.00 0.00 C ATOM 1616 C CYS A 101 42.159 70.786 -2.601 1.00 0.00 C ATOM 1617 O CYS A 101 42.111 70.891 -1.374 1.00 0.00 O ATOM 1618 CB CYS A 101 42.606 68.382 -3.242 1.00 0.00 C ATOM 1619 SG CYS A 101 42.836 67.511 -1.659 1.00 0.00 S ATOM 0 H CYS A 101 44.394 70.264 -1.663 1.00 0.00 H new ATOM 0 HA CYS A 101 43.247 70.116 -4.312 1.00 0.00 H new ATOM 0 HB2 CYS A 101 41.543 68.397 -3.481 1.00 0.00 H new ATOM 0 HB3 CYS A 101 43.101 67.813 -4.029 1.00 0.00 H new ATOM 1624 N VAL A 102 41.390 71.499 -3.412 1.00 0.00 N ATOM 1625 CA VAL A 102 40.522 72.551 -2.902 1.00 0.00 C ATOM 1626 C VAL A 102 39.146 72.021 -2.507 1.00 0.00 C ATOM 1627 O VAL A 102 38.631 71.066 -3.096 1.00 0.00 O ATOM 1628 CB VAL A 102 40.347 73.694 -3.926 1.00 0.00 C ATOM 1629 CG1 VAL A 102 41.693 74.308 -4.281 1.00 0.00 C ATOM 1630 CG2 VAL A 102 39.631 73.204 -5.177 1.00 0.00 C ATOM 0 H VAL A 102 41.349 71.369 -4.423 1.00 0.00 H new ATOM 0 HA VAL A 102 41.016 72.940 -2.012 1.00 0.00 H new ATOM 0 HB VAL A 102 39.729 74.465 -3.467 1.00 0.00 H new ATOM 0 HG11 VAL A 102 41.547 75.111 -5.004 1.00 0.00 H new ATOM 0 HG12 VAL A 102 42.158 74.710 -3.381 1.00 0.00 H new ATOM 0 HG13 VAL A 102 42.339 73.544 -4.713 1.00 0.00 H new ATOM 0 HG21 VAL A 102 39.521 74.029 -5.880 1.00 0.00 H new ATOM 0 HG22 VAL A 102 40.213 72.407 -5.640 1.00 0.00 H new ATOM 0 HG23 VAL A 102 38.646 72.824 -4.907 1.00 0.00 H new ATOM 1640 N VAL A 103 38.569 72.647 -1.490 1.00 0.00 N ATOM 1641 CA VAL A 103 37.216 72.340 -1.055 1.00 0.00 C ATOM 1642 C VAL A 103 36.366 73.602 -1.057 1.00 0.00 C ATOM 1643 O VAL A 103 36.897 74.713 -1.023 1.00 0.00 O ATOM 1644 CB VAL A 103 37.191 71.725 0.367 1.00 0.00 C ATOM 1645 CG1 VAL A 103 38.028 70.465 0.425 1.00 0.00 C ATOM 1646 CG2 VAL A 103 37.666 72.724 1.415 1.00 0.00 C ATOM 0 H VAL A 103 39.025 73.379 -0.946 1.00 0.00 H new ATOM 0 HA VAL A 103 36.812 71.609 -1.756 1.00 0.00 H new ATOM 0 HB VAL A 103 36.156 71.466 0.592 1.00 0.00 H new ATOM 0 HG11 VAL A 103 37.995 70.052 1.433 1.00 0.00 H new ATOM 0 HG12 VAL A 103 37.633 69.733 -0.280 1.00 0.00 H new ATOM 0 HG13 VAL A 103 39.060 70.701 0.164 1.00 0.00 H new ATOM 0 HG21 VAL A 103 37.636 72.259 2.401 1.00 0.00 H new ATOM 0 HG22 VAL A 103 38.688 73.030 1.189 1.00 0.00 H new ATOM 0 HG23 VAL A 103 37.015 73.598 1.406 1.00 0.00 H new ATOM 1656 N LEU A 104 35.055 73.433 -1.115 1.00 0.00 N ATOM 1657 CA LEU A 104 34.144 74.550 -0.933 1.00 0.00 C ATOM 1658 C LEU A 104 33.921 74.770 0.548 1.00 0.00 C ATOM 1659 O LEU A 104 33.394 73.898 1.242 1.00 0.00 O ATOM 1660 CB LEU A 104 32.801 74.303 -1.631 1.00 0.00 C ATOM 1661 CG LEU A 104 32.800 74.501 -3.146 1.00 0.00 C ATOM 1662 CD1 LEU A 104 31.424 74.199 -3.716 1.00 0.00 C ATOM 1663 CD2 LEU A 104 33.216 75.922 -3.499 1.00 0.00 C ATOM 0 H LEU A 104 34.600 72.536 -1.286 1.00 0.00 H new ATOM 0 HA LEU A 104 34.591 75.436 -1.383 1.00 0.00 H new ATOM 0 HB2 LEU A 104 32.482 73.283 -1.415 1.00 0.00 H new ATOM 0 HB3 LEU A 104 32.057 74.969 -1.195 1.00 0.00 H new ATOM 0 HG LEU A 104 33.520 73.811 -3.585 1.00 0.00 H new ATOM 0 HD11 LEU A 104 31.438 74.344 -4.796 1.00 0.00 H new ATOM 0 HD12 LEU A 104 31.156 73.166 -3.492 1.00 0.00 H new ATOM 0 HD13 LEU A 104 30.690 74.869 -3.269 1.00 0.00 H new ATOM 0 HD21 LEU A 104 33.210 76.045 -4.582 1.00 0.00 H new ATOM 0 HD22 LEU A 104 32.517 76.628 -3.050 1.00 0.00 H new ATOM 0 HD23 LEU A 104 34.219 76.113 -3.118 1.00 0.00 H new ATOM 1675 N VAL A 105 34.350 75.917 1.038 1.00 0.00 N ATOM 1676 CA VAL A 105 34.213 76.225 2.447 1.00 0.00 C ATOM 1677 C VAL A 105 33.493 77.554 2.640 1.00 0.00 C ATOM 1678 O VAL A 105 33.690 78.507 1.866 1.00 0.00 O ATOM 1679 CB VAL A 105 35.588 76.256 3.158 1.00 0.00 C ATOM 1680 CG1 VAL A 105 36.438 77.411 2.657 1.00 0.00 C ATOM 1681 CG2 VAL A 105 35.420 76.325 4.669 1.00 0.00 C ATOM 0 H VAL A 105 34.795 76.648 0.483 1.00 0.00 H new ATOM 0 HA VAL A 105 33.617 75.432 2.898 1.00 0.00 H new ATOM 0 HB VAL A 105 36.106 75.328 2.917 1.00 0.00 H new ATOM 0 HG11 VAL A 105 37.398 77.408 3.174 1.00 0.00 H new ATOM 0 HG12 VAL A 105 36.603 77.303 1.585 1.00 0.00 H new ATOM 0 HG13 VAL A 105 35.924 78.352 2.852 1.00 0.00 H new ATOM 0 HG21 VAL A 105 36.401 76.346 5.144 1.00 0.00 H new ATOM 0 HG22 VAL A 105 34.870 77.228 4.933 1.00 0.00 H new ATOM 0 HG23 VAL A 105 34.868 75.451 5.014 1.00 0.00 H new ATOM 1691 N TYR A 106 32.643 77.597 3.655 1.00 0.00 N ATOM 1692 CA TYR A 106 31.932 78.805 4.021 1.00 0.00 C ATOM 1693 C TYR A 106 32.743 79.576 5.054 1.00 0.00 C ATOM 1694 O TYR A 106 32.721 79.263 6.241 1.00 0.00 O ATOM 1695 CB TYR A 106 30.552 78.447 4.578 1.00 0.00 C ATOM 1696 CG TYR A 106 29.642 79.631 4.831 1.00 0.00 C ATOM 1697 CD1 TYR A 106 28.897 80.187 3.801 1.00 0.00 C ATOM 1698 CD2 TYR A 106 29.507 80.172 6.105 1.00 0.00 C ATOM 1699 CE1 TYR A 106 28.049 81.249 4.029 1.00 0.00 C ATOM 1700 CE2 TYR A 106 28.651 81.230 6.343 1.00 0.00 C ATOM 1701 CZ TYR A 106 27.926 81.767 5.301 1.00 0.00 C ATOM 1702 OH TYR A 106 27.056 82.806 5.530 1.00 0.00 O ATOM 0 H TYR A 106 32.429 76.794 4.246 1.00 0.00 H new ATOM 0 HA TYR A 106 31.796 79.432 3.140 1.00 0.00 H new ATOM 0 HB2 TYR A 106 30.059 77.770 3.880 1.00 0.00 H new ATOM 0 HB3 TYR A 106 30.683 77.901 5.512 1.00 0.00 H new ATOM 0 HD1 TYR A 106 28.983 79.781 2.804 1.00 0.00 H new ATOM 0 HD2 TYR A 106 30.080 79.758 6.921 1.00 0.00 H new ATOM 0 HE1 TYR A 106 27.482 81.674 3.214 1.00 0.00 H new ATOM 0 HE2 TYR A 106 28.551 81.634 7.340 1.00 0.00 H new ATOM 0 HH TYR A 106 27.563 83.615 5.751 1.00 0.00 H new ATOM 1712 N ASN A 107 33.487 80.561 4.586 1.00 0.00 N ATOM 1713 CA ASN A 107 34.327 81.367 5.460 1.00 0.00 C ATOM 1714 C ASN A 107 34.268 82.808 4.988 1.00 0.00 C ATOM 1715 O ASN A 107 34.394 83.065 3.791 1.00 0.00 O ATOM 1716 CB ASN A 107 35.772 80.844 5.449 1.00 0.00 C ATOM 1717 CG ASN A 107 36.649 81.466 6.528 1.00 0.00 C ATOM 1718 OD1 ASN A 107 36.454 82.609 6.933 1.00 0.00 O ATOM 1719 ND2 ASN A 107 37.627 80.709 7.003 1.00 0.00 N ATOM 0 H ASN A 107 33.528 80.825 3.602 1.00 0.00 H new ATOM 0 HA ASN A 107 33.965 81.305 6.486 1.00 0.00 H new ATOM 0 HB2 ASN A 107 35.760 79.762 5.580 1.00 0.00 H new ATOM 0 HB3 ASN A 107 36.215 81.042 4.473 1.00 0.00 H new ATOM 0 HD21 ASN A 107 38.246 81.071 7.728 1.00 0.00 H new ATOM 0 HD22 ASN A 107 37.761 79.764 6.644 1.00 0.00 H new ATOM 1726 N GLN A 108 34.066 83.731 5.928 1.00 0.00 N ATOM 1727 CA GLN A 108 33.806 85.137 5.612 1.00 0.00 C ATOM 1728 C GLN A 108 32.463 85.254 4.901 1.00 0.00 C ATOM 1729 O GLN A 108 32.267 86.117 4.046 1.00 0.00 O ATOM 1730 CB GLN A 108 34.934 85.746 4.763 1.00 0.00 C ATOM 1731 CG GLN A 108 36.283 85.754 5.467 1.00 0.00 C ATOM 1732 CD GLN A 108 37.382 86.403 4.645 1.00 0.00 C ATOM 1733 OE1 GLN A 108 37.369 86.369 3.410 1.00 0.00 O ATOM 1734 NE2 GLN A 108 38.346 87.000 5.327 1.00 0.00 N ATOM 0 H GLN A 108 34.078 83.527 6.927 1.00 0.00 H new ATOM 0 HA GLN A 108 33.771 85.702 6.543 1.00 0.00 H new ATOM 0 HB2 GLN A 108 35.021 85.185 3.832 1.00 0.00 H new ATOM 0 HB3 GLN A 108 34.666 86.768 4.495 1.00 0.00 H new ATOM 0 HG2 GLN A 108 36.187 86.282 6.416 1.00 0.00 H new ATOM 0 HG3 GLN A 108 36.570 84.729 5.701 1.00 0.00 H new ATOM 0 HE21 GLN A 108 38.321 87.006 6.347 1.00 0.00 H new ATOM 0 HE22 GLN A 108 39.114 87.454 4.833 1.00 0.00 H new ATOM 1743 N ASP A 109 31.556 84.347 5.275 1.00 0.00 N ATOM 1744 CA ASP A 109 30.183 84.315 4.765 1.00 0.00 C ATOM 1745 C ASP A 109 30.129 84.134 3.256 1.00 0.00 C ATOM 1746 O ASP A 109 29.144 84.489 2.608 1.00 0.00 O ATOM 1747 CB ASP A 109 29.413 85.565 5.189 1.00 0.00 C ATOM 1748 CG ASP A 109 29.022 85.509 6.650 1.00 0.00 C ATOM 1749 OD1 ASP A 109 28.094 84.737 6.981 1.00 0.00 O ATOM 1750 OD2 ASP A 109 29.656 86.208 7.467 1.00 0.00 O ATOM 0 H ASP A 109 31.757 83.607 5.947 1.00 0.00 H new ATOM 0 HA ASP A 109 29.702 83.443 5.208 1.00 0.00 H new ATOM 0 HB2 ASP A 109 30.025 86.449 5.009 1.00 0.00 H new ATOM 0 HB3 ASP A 109 28.518 85.667 4.576 1.00 0.00 H new ATOM 1755 N LYS A 110 31.172 83.538 2.701 1.00 0.00 N ATOM 1756 CA LYS A 110 31.209 83.267 1.277 1.00 0.00 C ATOM 1757 C LYS A 110 31.657 81.840 1.005 1.00 0.00 C ATOM 1758 O LYS A 110 32.533 81.302 1.691 1.00 0.00 O ATOM 1759 CB LYS A 110 32.134 84.249 0.563 1.00 0.00 C ATOM 1760 CG LYS A 110 33.551 84.218 1.088 1.00 0.00 C ATOM 1761 CD LYS A 110 34.436 85.227 0.390 1.00 0.00 C ATOM 1762 CE LYS A 110 35.805 85.272 1.035 1.00 0.00 C ATOM 1763 NZ LYS A 110 36.730 86.176 0.313 1.00 0.00 N ATOM 0 H LYS A 110 32.000 83.235 3.214 1.00 0.00 H new ATOM 0 HA LYS A 110 30.198 83.392 0.890 1.00 0.00 H new ATOM 0 HB2 LYS A 110 32.143 84.021 -0.503 1.00 0.00 H new ATOM 0 HB3 LYS A 110 31.735 85.258 0.670 1.00 0.00 H new ATOM 0 HG2 LYS A 110 33.545 84.420 2.159 1.00 0.00 H new ATOM 0 HG3 LYS A 110 33.965 83.219 0.955 1.00 0.00 H new ATOM 0 HD2 LYS A 110 34.533 84.966 -0.664 1.00 0.00 H new ATOM 0 HD3 LYS A 110 33.975 86.214 0.433 1.00 0.00 H new ATOM 0 HE2 LYS A 110 35.708 85.603 2.069 1.00 0.00 H new ATOM 0 HE3 LYS A 110 36.227 84.267 1.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 37.436 86.553 0.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 37.212 85.648 -0.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 36.192 86.963 -0.103 1.00 0.00 H new ATOM 1777 N TRP A 111 31.035 81.236 0.008 1.00 0.00 N ATOM 1778 CA TRP A 111 31.412 79.912 -0.452 1.00 0.00 C ATOM 1779 C TRP A 111 32.489 80.025 -1.509 1.00 0.00 C ATOM 1780 O TRP A 111 32.233 80.499 -2.617 1.00 0.00 O ATOM 1781 CB TRP A 111 30.210 79.182 -1.043 1.00 0.00 C ATOM 1782 CG TRP A 111 29.274 78.612 -0.028 1.00 0.00 C ATOM 1783 CD1 TRP A 111 28.068 79.119 0.360 1.00 0.00 C ATOM 1784 CD2 TRP A 111 29.464 77.408 0.718 1.00 0.00 C ATOM 1785 NE1 TRP A 111 27.492 78.297 1.296 1.00 0.00 N ATOM 1786 CE2 TRP A 111 28.334 77.241 1.536 1.00 0.00 C ATOM 1787 CE3 TRP A 111 30.484 76.454 0.772 1.00 0.00 C ATOM 1788 CZ2 TRP A 111 28.195 76.158 2.397 1.00 0.00 C ATOM 1789 CZ3 TRP A 111 30.345 75.379 1.628 1.00 0.00 C ATOM 1790 CH2 TRP A 111 29.209 75.240 2.429 1.00 0.00 C ATOM 0 H TRP A 111 30.256 81.649 -0.505 1.00 0.00 H new ATOM 0 HA TRP A 111 31.785 79.347 0.402 1.00 0.00 H new ATOM 0 HB2 TRP A 111 29.658 79.873 -1.681 1.00 0.00 H new ATOM 0 HB3 TRP A 111 30.569 78.375 -1.682 1.00 0.00 H new ATOM 0 HD1 TRP A 111 27.631 80.033 -0.014 1.00 0.00 H new ATOM 0 HE1 TRP A 111 26.586 78.447 1.740 1.00 0.00 H new ATOM 0 HE3 TRP A 111 31.365 76.556 0.156 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 27.318 76.046 3.018 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 31.126 74.635 1.679 1.00 0.00 H new ATOM 0 HH2 TRP A 111 29.129 74.389 3.089 1.00 0.00 H new ATOM 1801 N ALA A 112 33.693 79.602 -1.178 1.00 0.00 N ATOM 1802 CA ALA A 112 34.790 79.701 -2.120 1.00 0.00 C ATOM 1803 C ALA A 112 35.782 78.567 -1.925 1.00 0.00 C ATOM 1804 O ALA A 112 35.698 77.819 -0.948 1.00 0.00 O ATOM 1805 CB ALA A 112 35.473 81.051 -1.993 1.00 0.00 C ATOM 0 H ALA A 112 33.935 79.192 -0.276 1.00 0.00 H new ATOM 0 HA ALA A 112 34.385 79.614 -3.128 1.00 0.00 H new ATOM 0 HB1 ALA A 112 36.295 81.111 -2.706 1.00 0.00 H new ATOM 0 HB2 ALA A 112 34.754 81.844 -2.200 1.00 0.00 H new ATOM 0 HB3 ALA A 112 35.861 81.169 -0.981 1.00 0.00 H new ATOM 1811 N TRP A 113 36.720 78.458 -2.856 1.00 0.00 N ATOM 1812 CA TRP A 113 37.686 77.368 -2.860 1.00 0.00 C ATOM 1813 C TRP A 113 38.727 77.566 -1.768 1.00 0.00 C ATOM 1814 O TRP A 113 39.250 78.662 -1.589 1.00 0.00 O ATOM 1815 CB TRP A 113 38.396 77.280 -4.218 1.00 0.00 C ATOM 1816 CG TRP A 113 37.497 76.966 -5.380 1.00 0.00 C ATOM 1817 CD1 TRP A 113 36.133 77.045 -5.425 1.00 0.00 C ATOM 1818 CD2 TRP A 113 37.915 76.531 -6.678 1.00 0.00 C ATOM 1819 NE1 TRP A 113 35.681 76.683 -6.671 1.00 0.00 N ATOM 1820 CE2 TRP A 113 36.756 76.364 -7.458 1.00 0.00 C ATOM 1821 CE3 TRP A 113 39.160 76.267 -7.255 1.00 0.00 C ATOM 1822 CZ2 TRP A 113 36.808 75.945 -8.786 1.00 0.00 C ATOM 1823 CZ3 TRP A 113 39.209 75.852 -8.571 1.00 0.00 C ATOM 1824 CH2 TRP A 113 38.041 75.696 -9.325 1.00 0.00 C ATOM 0 H TRP A 113 36.833 79.118 -3.625 1.00 0.00 H new ATOM 0 HA TRP A 113 37.141 76.442 -2.675 1.00 0.00 H new ATOM 0 HB2 TRP A 113 38.899 78.228 -4.411 1.00 0.00 H new ATOM 0 HB3 TRP A 113 39.170 76.515 -4.159 1.00 0.00 H new ATOM 0 HD1 TRP A 113 35.503 77.348 -4.602 1.00 0.00 H new ATOM 0 HE1 TRP A 113 34.704 76.656 -6.963 1.00 0.00 H new ATOM 0 HE3 TRP A 113 40.068 76.385 -6.682 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 35.907 75.821 -9.369 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 40.166 75.644 -9.026 1.00 0.00 H new ATOM 0 HH2 TRP A 113 38.114 75.373 -10.353 1.00 0.00 H new ATOM 1835 N ASN A 114 39.012 76.506 -1.034 1.00 0.00 N ATOM 1836 CA ASN A 114 40.064 76.533 -0.031 1.00 0.00 C ATOM 1837 C ASN A 114 40.917 75.286 -0.167 1.00 0.00 C ATOM 1838 O ASN A 114 40.396 74.172 -0.121 1.00 0.00 O ATOM 1839 CB ASN A 114 39.470 76.595 1.377 1.00 0.00 C ATOM 1840 CG ASN A 114 40.501 76.944 2.433 1.00 0.00 C ATOM 1841 OD1 ASN A 114 41.192 75.941 2.950 1.00 0.00 O flip ATOM 1842 ND2 ASN A 114 40.674 78.111 2.777 1.00 0.00 N flip ATOM 0 H ASN A 114 38.528 75.612 -1.113 1.00 0.00 H new ATOM 0 HA ASN A 114 40.675 77.422 -0.188 1.00 0.00 H new ATOM 0 HB2 ASN A 114 38.670 77.336 1.397 1.00 0.00 H new ATOM 0 HB3 ASN A 114 39.019 75.633 1.619 1.00 0.00 H new ATOM 0 HD21 ASN A 114 40.120 78.855 2.353 1.00 0.00 H new ATOM 0 HD22 ASN A 114 41.372 78.336 3.486 1.00 0.00 H new ATOM 1849 N ASP A 115 42.213 75.468 -0.346 1.00 0.00 N ATOM 1850 CA ASP A 115 43.116 74.340 -0.514 1.00 0.00 C ATOM 1851 C ASP A 115 43.404 73.671 0.823 1.00 0.00 C ATOM 1852 O ASP A 115 43.702 74.340 1.813 1.00 0.00 O ATOM 1853 CB ASP A 115 44.422 74.786 -1.168 1.00 0.00 C ATOM 1854 CG ASP A 115 45.424 73.655 -1.249 1.00 0.00 C ATOM 1855 OD1 ASP A 115 45.073 72.591 -1.793 1.00 0.00 O ATOM 1856 OD2 ASP A 115 46.550 73.823 -0.744 1.00 0.00 O ATOM 0 H ASP A 115 42.664 76.382 -0.379 1.00 0.00 H new ATOM 0 HA ASP A 115 42.628 73.616 -1.166 1.00 0.00 H new ATOM 0 HB2 ASP A 115 44.217 75.162 -2.170 1.00 0.00 H new ATOM 0 HB3 ASP A 115 44.850 75.611 -0.599 1.00 0.00 H new ATOM 1861 N VAL A 116 43.286 72.351 0.849 1.00 0.00 N ATOM 1862 CA VAL A 116 43.537 71.573 2.054 1.00 0.00 C ATOM 1863 C VAL A 116 44.261 70.278 1.707 1.00 0.00 C ATOM 1864 O VAL A 116 44.234 69.836 0.558 1.00 0.00 O ATOM 1865 CB VAL A 116 42.229 71.223 2.810 1.00 0.00 C ATOM 1866 CG1 VAL A 116 41.581 72.466 3.399 1.00 0.00 C ATOM 1867 CG2 VAL A 116 41.254 70.496 1.895 1.00 0.00 C ATOM 0 H VAL A 116 43.015 71.792 0.040 1.00 0.00 H new ATOM 0 HA VAL A 116 44.156 72.192 2.704 1.00 0.00 H new ATOM 0 HB VAL A 116 42.491 70.559 3.634 1.00 0.00 H new ATOM 0 HG11 VAL A 116 40.667 72.186 3.922 1.00 0.00 H new ATOM 0 HG12 VAL A 116 42.270 72.938 4.099 1.00 0.00 H new ATOM 0 HG13 VAL A 116 41.341 73.166 2.598 1.00 0.00 H new ATOM 0 HG21 VAL A 116 40.344 70.261 2.447 1.00 0.00 H new ATOM 0 HG22 VAL A 116 41.009 71.133 1.045 1.00 0.00 H new ATOM 0 HG23 VAL A 116 41.710 69.573 1.537 1.00 0.00 H new ATOM 1877 N PRO A 117 44.942 69.665 2.689 1.00 0.00 N ATOM 1878 CA PRO A 117 45.548 68.345 2.514 1.00 0.00 C ATOM 1879 C PRO A 117 44.498 67.302 2.152 1.00 0.00 C ATOM 1880 O PRO A 117 43.480 67.178 2.830 1.00 0.00 O ATOM 1881 CB PRO A 117 46.170 68.035 3.883 1.00 0.00 C ATOM 1882 CG PRO A 117 45.527 68.989 4.834 1.00 0.00 C ATOM 1883 CD PRO A 117 45.184 70.210 4.032 1.00 0.00 C ATOM 0 HA PRO A 117 46.278 68.328 1.705 1.00 0.00 H new ATOM 0 HB2 PRO A 117 45.982 67.002 4.175 1.00 0.00 H new ATOM 0 HB3 PRO A 117 47.252 68.169 3.863 1.00 0.00 H new ATOM 0 HG2 PRO A 117 44.633 68.552 5.280 1.00 0.00 H new ATOM 0 HG3 PRO A 117 46.202 69.238 5.653 1.00 0.00 H new ATOM 0 HD2 PRO A 117 44.304 70.718 4.426 1.00 0.00 H new ATOM 0 HD3 PRO A 117 45.998 70.935 4.033 1.00 0.00 H new ATOM 1891 N CYS A 118 44.746 66.554 1.086 1.00 0.00 N ATOM 1892 CA CYS A 118 43.790 65.557 0.608 1.00 0.00 C ATOM 1893 C CYS A 118 43.611 64.416 1.612 1.00 0.00 C ATOM 1894 O CYS A 118 42.630 63.674 1.542 1.00 0.00 O ATOM 1895 CB CYS A 118 44.226 65.001 -0.748 1.00 0.00 C ATOM 1896 SG CYS A 118 44.364 66.251 -2.059 1.00 0.00 S ATOM 0 H CYS A 118 45.601 66.616 0.533 1.00 0.00 H new ATOM 0 HA CYS A 118 42.828 66.057 0.495 1.00 0.00 H new ATOM 0 HB2 CYS A 118 45.190 64.506 -0.632 1.00 0.00 H new ATOM 0 HB3 CYS A 118 43.512 64.239 -1.062 1.00 0.00 H new ATOM 1901 N ASN A 119 44.552 64.288 2.546 1.00 0.00 N ATOM 1902 CA ASN A 119 44.469 63.267 3.591 1.00 0.00 C ATOM 1903 C ASN A 119 43.578 63.725 4.743 1.00 0.00 C ATOM 1904 O ASN A 119 43.353 62.983 5.698 1.00 0.00 O ATOM 1905 CB ASN A 119 45.858 62.903 4.129 1.00 0.00 C ATOM 1906 CG ASN A 119 46.692 64.119 4.489 1.00 0.00 C ATOM 1907 OD1 ASN A 119 46.517 64.725 5.546 1.00 0.00 O ATOM 1908 ND2 ASN A 119 47.636 64.459 3.627 1.00 0.00 N ATOM 0 H ASN A 119 45.382 64.879 2.601 1.00 0.00 H new ATOM 0 HA ASN A 119 44.027 62.381 3.135 1.00 0.00 H new ATOM 0 HB2 ASN A 119 45.746 62.272 5.011 1.00 0.00 H new ATOM 0 HB3 ASN A 119 46.388 62.314 3.381 1.00 0.00 H new ATOM 0 HD21 ASN A 119 48.250 65.248 3.828 1.00 0.00 H new ATOM 0 HD22 ASN A 119 47.750 63.932 2.761 1.00 0.00 H new ATOM 1915 N PHE A 120 43.073 64.945 4.653 1.00 0.00 N ATOM 1916 CA PHE A 120 42.160 65.464 5.660 1.00 0.00 C ATOM 1917 C PHE A 120 40.743 64.999 5.355 1.00 0.00 C ATOM 1918 O PHE A 120 40.186 65.351 4.320 1.00 0.00 O ATOM 1919 CB PHE A 120 42.221 66.996 5.690 1.00 0.00 C ATOM 1920 CG PHE A 120 41.287 67.632 6.682 1.00 0.00 C ATOM 1921 CD1 PHE A 120 41.547 67.567 8.042 1.00 0.00 C ATOM 1922 CD2 PHE A 120 40.150 68.299 6.252 1.00 0.00 C ATOM 1923 CE1 PHE A 120 40.689 68.154 8.953 1.00 0.00 C ATOM 1924 CE2 PHE A 120 39.291 68.889 7.158 1.00 0.00 C ATOM 1925 CZ PHE A 120 39.560 68.816 8.511 1.00 0.00 C ATOM 0 H PHE A 120 43.279 65.594 3.894 1.00 0.00 H new ATOM 0 HA PHE A 120 42.456 65.086 6.639 1.00 0.00 H new ATOM 0 HB2 PHE A 120 43.241 67.303 5.920 1.00 0.00 H new ATOM 0 HB3 PHE A 120 41.990 67.377 4.695 1.00 0.00 H new ATOM 0 HD1 PHE A 120 42.429 67.052 8.393 1.00 0.00 H new ATOM 0 HD2 PHE A 120 39.934 68.358 5.196 1.00 0.00 H new ATOM 0 HE1 PHE A 120 40.901 68.095 10.010 1.00 0.00 H new ATOM 0 HE2 PHE A 120 38.410 69.407 6.809 1.00 0.00 H new ATOM 0 HZ PHE A 120 38.889 69.276 9.222 1.00 0.00 H new ATOM 1935 N GLU A 121 40.171 64.191 6.236 1.00 0.00 N ATOM 1936 CA GLU A 121 38.806 63.720 6.042 1.00 0.00 C ATOM 1937 C GLU A 121 37.810 64.845 6.284 1.00 0.00 C ATOM 1938 O GLU A 121 37.612 65.297 7.414 1.00 0.00 O ATOM 1939 CB GLU A 121 38.488 62.534 6.949 1.00 0.00 C ATOM 1940 CG GLU A 121 39.332 61.310 6.658 1.00 0.00 C ATOM 1941 CD GLU A 121 38.515 60.089 6.264 1.00 0.00 C ATOM 1942 OE1 GLU A 121 37.862 59.493 7.138 1.00 0.00 O ATOM 1943 OE2 GLU A 121 38.524 59.719 5.067 1.00 0.00 O ATOM 0 H GLU A 121 40.624 63.850 7.084 1.00 0.00 H new ATOM 0 HA GLU A 121 38.719 63.387 5.008 1.00 0.00 H new ATOM 0 HB2 GLU A 121 38.637 62.830 7.987 1.00 0.00 H new ATOM 0 HB3 GLU A 121 37.435 62.274 6.839 1.00 0.00 H new ATOM 0 HG2 GLU A 121 40.032 61.543 5.856 1.00 0.00 H new ATOM 0 HG3 GLU A 121 39.926 61.070 7.540 1.00 0.00 H new ATOM 1950 N ALA A 122 37.186 65.274 5.208 1.00 0.00 N ATOM 1951 CA ALA A 122 36.207 66.346 5.247 1.00 0.00 C ATOM 1952 C ALA A 122 34.949 65.912 4.511 1.00 0.00 C ATOM 1953 O ALA A 122 34.832 64.753 4.121 1.00 0.00 O ATOM 1954 CB ALA A 122 36.781 67.613 4.629 1.00 0.00 C ATOM 0 H ALA A 122 37.342 64.889 4.276 1.00 0.00 H new ATOM 0 HA ALA A 122 35.953 66.562 6.285 1.00 0.00 H new ATOM 0 HB1 ALA A 122 36.035 68.406 4.666 1.00 0.00 H new ATOM 0 HB2 ALA A 122 37.666 67.921 5.186 1.00 0.00 H new ATOM 0 HB3 ALA A 122 37.054 67.420 3.592 1.00 0.00 H new ATOM 1960 N SER A 123 34.020 66.837 4.316 1.00 0.00 N ATOM 1961 CA SER A 123 32.781 66.531 3.624 1.00 0.00 C ATOM 1962 C SER A 123 33.019 66.487 2.117 1.00 0.00 C ATOM 1963 O SER A 123 34.081 66.888 1.639 1.00 0.00 O ATOM 1964 CB SER A 123 31.720 67.566 3.984 1.00 0.00 C ATOM 1965 OG SER A 123 31.541 67.622 5.390 1.00 0.00 O ATOM 0 H SER A 123 34.103 67.805 4.628 1.00 0.00 H new ATOM 0 HA SER A 123 32.423 65.550 3.937 1.00 0.00 H new ATOM 0 HB2 SER A 123 32.017 68.546 3.609 1.00 0.00 H new ATOM 0 HB3 SER A 123 30.777 67.312 3.501 1.00 0.00 H new ATOM 0 HG SER A 123 32.256 68.160 5.790 1.00 0.00 H new ATOM 1971 N ARG A 124 32.039 66.014 1.367 1.00 0.00 N ATOM 1972 CA ARG A 124 32.238 65.753 -0.050 1.00 0.00 C ATOM 1973 C ARG A 124 30.947 65.907 -0.843 1.00 0.00 C ATOM 1974 O ARG A 124 29.853 65.687 -0.325 1.00 0.00 O ATOM 1975 CB ARG A 124 32.786 64.339 -0.221 1.00 0.00 C ATOM 1976 CG ARG A 124 32.017 63.314 0.592 1.00 0.00 C ATOM 1977 CD ARG A 124 32.607 61.927 0.458 1.00 0.00 C ATOM 1978 NE ARG A 124 31.955 60.981 1.354 1.00 0.00 N ATOM 1979 CZ ARG A 124 31.369 59.861 0.957 1.00 0.00 C ATOM 1980 NH1 ARG A 124 31.281 59.574 -0.336 1.00 0.00 N ATOM 1981 NH2 ARG A 124 30.856 59.034 1.854 1.00 0.00 N ATOM 0 H ARG A 124 31.102 65.803 1.712 1.00 0.00 H new ATOM 0 HA ARG A 124 32.947 66.485 -0.437 1.00 0.00 H new ATOM 0 HB2 ARG A 124 32.749 64.064 -1.275 1.00 0.00 H new ATOM 0 HB3 ARG A 124 33.835 64.321 0.076 1.00 0.00 H new ATOM 0 HG2 ARG A 124 32.018 63.609 1.641 1.00 0.00 H new ATOM 0 HG3 ARG A 124 30.977 63.299 0.266 1.00 0.00 H new ATOM 0 HD2 ARG A 124 32.504 61.585 -0.572 1.00 0.00 H new ATOM 0 HD3 ARG A 124 33.674 61.962 0.677 1.00 0.00 H new ATOM 0 HE ARG A 124 31.949 61.195 2.351 1.00 0.00 H new ATOM 0 HH11 ARG A 124 31.665 60.217 -1.028 1.00 0.00 H new ATOM 0 HH12 ARG A 124 30.829 58.711 -0.637 1.00 0.00 H new ATOM 0 HH21 ARG A 124 30.913 59.260 2.847 1.00 0.00 H new ATOM 0 HH22 ARG A 124 30.404 58.171 1.552 1.00 0.00 H new ATOM 1995 N ILE A 125 31.086 66.295 -2.101 1.00 0.00 N ATOM 1996 CA ILE A 125 29.957 66.363 -3.014 1.00 0.00 C ATOM 1997 C ILE A 125 30.156 65.350 -4.128 1.00 0.00 C ATOM 1998 O ILE A 125 31.160 65.400 -4.834 1.00 0.00 O ATOM 1999 CB ILE A 125 29.809 67.762 -3.648 1.00 0.00 C ATOM 2000 CG1 ILE A 125 29.846 68.849 -2.576 1.00 0.00 C ATOM 2001 CG2 ILE A 125 28.510 67.846 -4.444 1.00 0.00 C ATOM 2002 CD1 ILE A 125 29.900 70.251 -3.142 1.00 0.00 C ATOM 0 H ILE A 125 31.977 66.569 -2.515 1.00 0.00 H new ATOM 0 HA ILE A 125 29.055 66.149 -2.441 1.00 0.00 H new ATOM 0 HB ILE A 125 30.647 67.922 -4.326 1.00 0.00 H new ATOM 0 HG12 ILE A 125 28.964 68.755 -1.943 1.00 0.00 H new ATOM 0 HG13 ILE A 125 30.715 68.689 -1.937 1.00 0.00 H new ATOM 0 HG21 ILE A 125 28.418 68.838 -4.886 1.00 0.00 H new ATOM 0 HG22 ILE A 125 28.519 67.096 -5.235 1.00 0.00 H new ATOM 0 HG23 ILE A 125 27.664 67.664 -3.781 1.00 0.00 H new ATOM 0 HD11 ILE A 125 29.924 70.972 -2.325 1.00 0.00 H new ATOM 0 HD12 ILE A 125 30.797 70.363 -3.752 1.00 0.00 H new ATOM 0 HD13 ILE A 125 29.018 70.429 -3.757 1.00 0.00 H new ATOM 2014 N CYS A 126 29.224 64.430 -4.276 1.00 0.00 N ATOM 2015 CA CYS A 126 29.316 63.439 -5.332 1.00 0.00 C ATOM 2016 C CYS A 126 28.278 63.749 -6.403 1.00 0.00 C ATOM 2017 O CYS A 126 27.082 63.833 -6.116 1.00 0.00 O ATOM 2018 CB CYS A 126 29.118 62.031 -4.764 1.00 0.00 C ATOM 2019 SG CYS A 126 29.885 60.710 -5.755 1.00 0.00 S ATOM 0 H CYS A 126 28.398 64.347 -3.683 1.00 0.00 H new ATOM 0 HA CYS A 126 30.308 63.477 -5.781 1.00 0.00 H new ATOM 0 HB2 CYS A 126 29.529 61.998 -3.755 1.00 0.00 H new ATOM 0 HB3 CYS A 126 28.050 61.833 -4.680 1.00 0.00 H new ATOM 2024 N LYS A 127 28.740 63.956 -7.626 1.00 0.00 N ATOM 2025 CA LYS A 127 27.864 64.336 -8.718 1.00 0.00 C ATOM 2026 C LYS A 127 27.824 63.254 -9.789 1.00 0.00 C ATOM 2027 O LYS A 127 28.865 62.801 -10.274 1.00 0.00 O ATOM 2028 CB LYS A 127 28.313 65.671 -9.332 1.00 0.00 C ATOM 2029 CG LYS A 127 29.693 65.644 -9.977 1.00 0.00 C ATOM 2030 CD LYS A 127 30.013 66.958 -10.676 1.00 0.00 C ATOM 2031 CE LYS A 127 29.093 67.201 -11.863 1.00 0.00 C ATOM 2032 NZ LYS A 127 29.391 68.485 -12.555 1.00 0.00 N ATOM 0 H LYS A 127 29.722 63.866 -7.886 1.00 0.00 H new ATOM 0 HA LYS A 127 26.859 64.456 -8.314 1.00 0.00 H new ATOM 0 HB2 LYS A 127 27.582 65.974 -10.082 1.00 0.00 H new ATOM 0 HB3 LYS A 127 28.306 66.434 -8.553 1.00 0.00 H new ATOM 0 HG2 LYS A 127 30.447 65.444 -9.216 1.00 0.00 H new ATOM 0 HG3 LYS A 127 29.742 64.827 -10.697 1.00 0.00 H new ATOM 0 HD2 LYS A 127 29.918 67.780 -9.967 1.00 0.00 H new ATOM 0 HD3 LYS A 127 31.049 66.948 -11.014 1.00 0.00 H new ATOM 0 HE2 LYS A 127 29.192 66.378 -12.571 1.00 0.00 H new ATOM 0 HE3 LYS A 127 28.058 67.206 -11.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 28.887 68.514 -13.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 29.080 69.280 -11.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 30.414 68.559 -12.724 1.00 0.00 H new ATOM 2046 N ILE A 128 26.625 62.829 -10.145 1.00 0.00 N ATOM 2047 CA ILE A 128 26.457 61.882 -11.233 1.00 0.00 C ATOM 2048 C ILE A 128 25.948 62.618 -12.467 1.00 0.00 C ATOM 2049 O ILE A 128 25.073 63.482 -12.367 1.00 0.00 O ATOM 2050 CB ILE A 128 25.494 60.716 -10.860 1.00 0.00 C ATOM 2051 CG1 ILE A 128 25.566 59.604 -11.909 1.00 0.00 C ATOM 2052 CG2 ILE A 128 24.056 61.200 -10.719 1.00 0.00 C ATOM 2053 CD1 ILE A 128 24.716 58.396 -11.577 1.00 0.00 C ATOM 0 H ILE A 128 25.756 63.123 -9.699 1.00 0.00 H new ATOM 0 HA ILE A 128 27.428 61.433 -11.441 1.00 0.00 H new ATOM 0 HB ILE A 128 25.816 60.323 -9.896 1.00 0.00 H new ATOM 0 HG12 ILE A 128 25.251 60.005 -12.872 1.00 0.00 H new ATOM 0 HG13 ILE A 128 26.603 59.288 -12.019 1.00 0.00 H new ATOM 0 HG21 ILE A 128 23.413 60.359 -10.458 1.00 0.00 H new ATOM 0 HG22 ILE A 128 24.002 61.955 -9.935 1.00 0.00 H new ATOM 0 HG23 ILE A 128 23.723 61.632 -11.663 1.00 0.00 H new ATOM 0 HD11 ILE A 128 24.819 57.651 -12.366 1.00 0.00 H new ATOM 0 HD12 ILE A 128 25.045 57.969 -10.630 1.00 0.00 H new ATOM 0 HD13 ILE A 128 23.672 58.697 -11.496 1.00 0.00 H new ATOM 2065 N PRO A 129 26.536 62.349 -13.636 1.00 0.00 N ATOM 2066 CA PRO A 129 26.043 62.895 -14.894 1.00 0.00 C ATOM 2067 C PRO A 129 24.794 62.157 -15.355 1.00 0.00 C ATOM 2068 O PRO A 129 24.445 61.112 -14.800 1.00 0.00 O ATOM 2069 CB PRO A 129 27.204 62.660 -15.860 1.00 0.00 C ATOM 2070 CG PRO A 129 27.905 61.461 -15.321 1.00 0.00 C ATOM 2071 CD PRO A 129 27.735 61.508 -13.825 1.00 0.00 C ATOM 0 HA PRO A 129 25.756 63.944 -14.820 1.00 0.00 H new ATOM 0 HB2 PRO A 129 26.846 62.487 -16.875 1.00 0.00 H new ATOM 0 HB3 PRO A 129 27.868 63.523 -15.899 1.00 0.00 H new ATOM 0 HG2 PRO A 129 27.480 60.545 -15.732 1.00 0.00 H new ATOM 0 HG3 PRO A 129 28.960 61.473 -15.593 1.00 0.00 H new ATOM 0 HD2 PRO A 129 27.595 60.511 -13.406 1.00 0.00 H new ATOM 0 HD3 PRO A 129 28.608 61.940 -13.336 1.00 0.00 H new ATOM 2079 N GLY A 130 24.106 62.717 -16.341 1.00 0.00 N ATOM 2080 CA GLY A 130 22.968 62.039 -16.936 1.00 0.00 C ATOM 2081 C GLY A 130 23.383 60.804 -17.721 1.00 0.00 C ATOM 2082 O GLY A 130 23.126 60.698 -18.919 1.00 0.00 O ATOM 0 H GLY A 130 24.315 63.631 -16.741 1.00 0.00 H new ATOM 0 HA2 GLY A 130 22.268 61.751 -16.152 1.00 0.00 H new ATOM 0 HA3 GLY A 130 22.441 62.728 -17.597 1.00 0.00 H new ATOM 2086 N THR A 131 23.993 59.856 -17.025 1.00 0.00 N ATOM 2087 CA THR A 131 24.544 58.660 -17.639 1.00 0.00 C ATOM 2088 C THR A 131 23.443 57.659 -17.992 1.00 0.00 C ATOM 2089 O THR A 131 23.715 56.519 -18.374 1.00 0.00 O ATOM 2090 CB THR A 131 25.588 58.005 -16.702 1.00 0.00 C ATOM 2091 OG1 THR A 131 26.231 56.904 -17.356 1.00 0.00 O ATOM 2092 CG2 THR A 131 24.941 57.531 -15.406 1.00 0.00 C ATOM 0 H THR A 131 24.120 59.896 -16.014 1.00 0.00 H new ATOM 0 HA THR A 131 25.038 58.956 -18.565 1.00 0.00 H new ATOM 0 HB THR A 131 26.336 58.760 -16.459 1.00 0.00 H new ATOM 0 HG1 THR A 131 25.575 56.415 -17.895 1.00 0.00 H new ATOM 0 HG21 THR A 131 25.697 57.075 -14.767 1.00 0.00 H new ATOM 0 HG22 THR A 131 24.495 58.381 -14.890 1.00 0.00 H new ATOM 0 HG23 THR A 131 24.167 56.797 -15.633 1.00 0.00 H new ATOM 2100 N THR A 132 22.199 58.104 -17.894 1.00 0.00 N ATOM 2101 CA THR A 132 21.056 57.284 -18.249 1.00 0.00 C ATOM 2102 C THR A 132 21.035 57.014 -19.752 1.00 0.00 C ATOM 2103 O THR A 132 20.383 56.084 -20.223 1.00 0.00 O ATOM 2104 CB THR A 132 19.750 57.973 -17.826 1.00 0.00 C ATOM 2105 OG1 THR A 132 19.950 58.654 -16.576 1.00 0.00 O ATOM 2106 CG2 THR A 132 18.630 56.960 -17.671 1.00 0.00 C ATOM 0 H THR A 132 21.957 59.039 -17.568 1.00 0.00 H new ATOM 0 HA THR A 132 21.142 56.334 -17.722 1.00 0.00 H new ATOM 0 HB THR A 132 19.470 58.687 -18.600 1.00 0.00 H new ATOM 0 HG1 THR A 132 20.055 57.995 -15.858 1.00 0.00 H new ATOM 0 HG21 THR A 132 17.716 57.472 -17.371 1.00 0.00 H new ATOM 0 HG22 THR A 132 18.466 56.451 -18.621 1.00 0.00 H new ATOM 0 HG23 THR A 132 18.903 56.229 -16.910 1.00 0.00 H new ATOM 2114 N LEU A 133 21.766 57.835 -20.495 1.00 0.00 N ATOM 2115 CA LEU A 133 21.890 57.664 -21.936 1.00 0.00 C ATOM 2116 C LEU A 133 22.779 56.465 -22.249 1.00 0.00 C ATOM 2117 O LEU A 133 22.564 55.753 -23.227 1.00 0.00 O ATOM 2118 CB LEU A 133 22.462 58.929 -22.581 1.00 0.00 C ATOM 2119 CG LEU A 133 21.481 60.100 -22.747 1.00 0.00 C ATOM 2120 CD1 LEU A 133 20.913 60.556 -21.412 1.00 0.00 C ATOM 2121 CD2 LEU A 133 22.173 61.259 -23.438 1.00 0.00 C ATOM 0 H LEU A 133 22.284 58.630 -20.121 1.00 0.00 H new ATOM 0 HA LEU A 133 20.897 57.485 -22.349 1.00 0.00 H new ATOM 0 HB2 LEU A 133 23.306 59.270 -21.981 1.00 0.00 H new ATOM 0 HB3 LEU A 133 22.854 58.667 -23.564 1.00 0.00 H new ATOM 0 HG LEU A 133 20.649 59.752 -23.359 1.00 0.00 H new ATOM 0 HD11 LEU A 133 20.224 61.385 -21.574 1.00 0.00 H new ATOM 0 HD12 LEU A 133 20.381 59.729 -20.941 1.00 0.00 H new ATOM 0 HD13 LEU A 133 21.726 60.881 -20.763 1.00 0.00 H new ATOM 0 HD21 LEU A 133 21.472 62.086 -23.552 1.00 0.00 H new ATOM 0 HD22 LEU A 133 23.023 61.585 -22.839 1.00 0.00 H new ATOM 0 HD23 LEU A 133 22.522 60.941 -24.420 1.00 0.00 H new ATOM 2133 N ASN A 134 23.781 56.251 -21.406 1.00 0.00 N ATOM 2134 CA ASN A 134 24.645 55.084 -21.527 1.00 0.00 C ATOM 2135 C ASN A 134 23.921 53.862 -20.980 1.00 0.00 C ATOM 2136 O ASN A 134 23.999 52.766 -21.536 1.00 0.00 O ATOM 2137 CB ASN A 134 25.959 55.310 -20.769 1.00 0.00 C ATOM 2138 CG ASN A 134 26.924 54.147 -20.906 1.00 0.00 C ATOM 2139 OD1 ASN A 134 26.919 53.220 -20.095 1.00 0.00 O ATOM 2140 ND2 ASN A 134 27.763 54.188 -21.928 1.00 0.00 N ATOM 0 H ASN A 134 24.016 56.871 -20.631 1.00 0.00 H new ATOM 0 HA ASN A 134 24.883 54.921 -22.578 1.00 0.00 H new ATOM 0 HB2 ASN A 134 26.436 56.217 -21.140 1.00 0.00 H new ATOM 0 HB3 ASN A 134 25.741 55.473 -19.714 1.00 0.00 H new ATOM 0 HD21 ASN A 134 28.437 53.434 -22.065 1.00 0.00 H new ATOM 0 HD22 ASN A 134 27.736 54.973 -22.579 1.00 0.00 H new ATOM 2147 N ALA A 135 23.182 54.076 -19.900 1.00 0.00 N ATOM 2148 CA ALA A 135 22.394 53.023 -19.271 1.00 0.00 C ATOM 2149 C ALA A 135 21.026 52.891 -19.938 1.00 0.00 C ATOM 2150 O ALA A 135 20.045 52.507 -19.297 1.00 0.00 O ATOM 2151 CB ALA A 135 22.236 53.317 -17.787 1.00 0.00 C ATOM 0 H ALA A 135 23.111 54.981 -19.436 1.00 0.00 H new ATOM 0 HA ALA A 135 22.918 52.075 -19.394 1.00 0.00 H new ATOM 0 HB1 ALA A 135 21.646 52.528 -17.320 1.00 0.00 H new ATOM 0 HB2 ALA A 135 23.219 53.361 -17.318 1.00 0.00 H new ATOM 0 HB3 ALA A 135 21.729 54.273 -17.657 1.00 0.00 H new ATOM 2157 N GLU A 136 20.976 53.184 -21.234 1.00 0.00 N ATOM 2158 CA GLU A 136 19.733 53.111 -21.998 1.00 0.00 C ATOM 2159 C GLU A 136 19.166 51.695 -21.972 1.00 0.00 C ATOM 2160 O GLU A 136 17.952 51.503 -21.934 1.00 0.00 O ATOM 2161 CB GLU A 136 19.971 53.539 -23.449 1.00 0.00 C ATOM 2162 CG GLU A 136 20.943 52.637 -24.193 1.00 0.00 C ATOM 2163 CD GLU A 136 20.972 52.893 -25.682 1.00 0.00 C ATOM 2164 OE1 GLU A 136 19.904 52.816 -26.325 1.00 0.00 O ATOM 2165 OE2 GLU A 136 22.066 53.129 -26.226 1.00 0.00 O ATOM 0 H GLU A 136 21.786 53.476 -21.780 1.00 0.00 H new ATOM 0 HA GLU A 136 19.015 53.789 -21.537 1.00 0.00 H new ATOM 0 HB2 GLU A 136 19.018 53.549 -23.978 1.00 0.00 H new ATOM 0 HB3 GLU A 136 20.353 54.560 -23.461 1.00 0.00 H new ATOM 0 HG2 GLU A 136 21.944 52.779 -23.787 1.00 0.00 H new ATOM 0 HG3 GLU A 136 20.672 51.596 -24.015 1.00 0.00 H new ATOM 2172 N ASN A 137 20.058 50.712 -21.978 1.00 0.00 N ATOM 2173 CA ASN A 137 19.662 49.311 -21.999 1.00 0.00 C ATOM 2174 C ASN A 137 19.113 48.891 -20.644 1.00 0.00 C ATOM 2175 O ASN A 137 18.263 48.009 -20.553 1.00 0.00 O ATOM 2176 CB ASN A 137 20.852 48.428 -22.384 1.00 0.00 C ATOM 2177 CG ASN A 137 21.418 48.775 -23.748 1.00 0.00 C ATOM 2178 OD1 ASN A 137 20.695 49.219 -24.639 1.00 0.00 O ATOM 2179 ND2 ASN A 137 22.717 48.581 -23.921 1.00 0.00 N ATOM 0 H ASN A 137 21.067 50.862 -21.969 1.00 0.00 H new ATOM 0 HA ASN A 137 18.877 49.186 -22.745 1.00 0.00 H new ATOM 0 HB2 ASN A 137 21.635 48.532 -21.633 1.00 0.00 H new ATOM 0 HB3 ASN A 137 20.541 47.383 -22.379 1.00 0.00 H new ATOM 0 HD21 ASN A 137 23.151 48.802 -24.817 1.00 0.00 H new ATOM 0 HD22 ASN A 137 23.283 48.211 -23.158 1.00 0.00 H new ATOM 2186 N LEU A 138 19.589 49.544 -19.595 1.00 0.00 N ATOM 2187 CA LEU A 138 19.084 49.298 -18.256 1.00 0.00 C ATOM 2188 C LEU A 138 17.658 49.826 -18.172 1.00 0.00 C ATOM 2189 O LEU A 138 16.754 49.143 -17.696 1.00 0.00 O ATOM 2190 CB LEU A 138 19.993 49.976 -17.220 1.00 0.00 C ATOM 2191 CG LEU A 138 19.751 49.595 -15.751 1.00 0.00 C ATOM 2192 CD1 LEU A 138 20.976 49.923 -14.914 1.00 0.00 C ATOM 2193 CD2 LEU A 138 18.536 50.316 -15.183 1.00 0.00 C ATOM 0 H LEU A 138 20.325 50.249 -19.647 1.00 0.00 H new ATOM 0 HA LEU A 138 19.080 48.229 -18.041 1.00 0.00 H new ATOM 0 HB2 LEU A 138 21.028 49.743 -17.468 1.00 0.00 H new ATOM 0 HB3 LEU A 138 19.877 51.055 -17.317 1.00 0.00 H new ATOM 0 HG LEU A 138 19.561 48.522 -15.714 1.00 0.00 H new ATOM 0 HD11 LEU A 138 20.791 49.648 -13.875 1.00 0.00 H new ATOM 0 HD12 LEU A 138 21.834 49.365 -15.290 1.00 0.00 H new ATOM 0 HD13 LEU A 138 21.183 50.991 -14.975 1.00 0.00 H new ATOM 0 HD21 LEU A 138 18.393 50.024 -14.143 1.00 0.00 H new ATOM 0 HD22 LEU A 138 18.693 51.393 -15.239 1.00 0.00 H new ATOM 0 HD23 LEU A 138 17.651 50.048 -15.760 1.00 0.00 H new ATOM 2205 N TYR A 139 17.469 51.036 -18.681 1.00 0.00 N ATOM 2206 CA TYR A 139 16.150 51.661 -18.743 1.00 0.00 C ATOM 2207 C TYR A 139 15.253 50.921 -19.741 1.00 0.00 C ATOM 2208 O TYR A 139 14.032 51.035 -19.705 1.00 0.00 O ATOM 2209 CB TYR A 139 16.295 53.138 -19.135 1.00 0.00 C ATOM 2210 CG TYR A 139 14.998 53.919 -19.121 1.00 0.00 C ATOM 2211 CD1 TYR A 139 14.402 54.293 -17.924 1.00 0.00 C ATOM 2212 CD2 TYR A 139 14.373 54.281 -20.307 1.00 0.00 C ATOM 2213 CE1 TYR A 139 13.218 55.006 -17.909 1.00 0.00 C ATOM 2214 CE2 TYR A 139 13.190 54.994 -20.301 1.00 0.00 C ATOM 2215 CZ TYR A 139 12.617 55.355 -19.101 1.00 0.00 C ATOM 2216 OH TYR A 139 11.437 56.065 -19.094 1.00 0.00 O ATOM 0 H TYR A 139 18.220 51.612 -19.061 1.00 0.00 H new ATOM 0 HA TYR A 139 15.682 51.602 -17.760 1.00 0.00 H new ATOM 0 HB2 TYR A 139 16.999 53.615 -18.453 1.00 0.00 H new ATOM 0 HB3 TYR A 139 16.729 53.195 -20.133 1.00 0.00 H new ATOM 0 HD1 TYR A 139 14.871 54.022 -16.990 1.00 0.00 H new ATOM 0 HD2 TYR A 139 14.819 54.000 -21.250 1.00 0.00 H new ATOM 0 HE1 TYR A 139 12.766 55.288 -16.970 1.00 0.00 H new ATOM 0 HE2 TYR A 139 12.716 55.267 -21.232 1.00 0.00 H new ATOM 0 HH TYR A 139 11.149 56.230 -20.016 1.00 0.00 H new ATOM 2226 N PHE A 140 15.872 50.174 -20.649 1.00 0.00 N ATOM 2227 CA PHE A 140 15.126 49.337 -21.578 1.00 0.00 C ATOM 2228 C PHE A 140 14.530 48.146 -20.833 1.00 0.00 C ATOM 2229 O PHE A 140 13.403 47.726 -21.102 1.00 0.00 O ATOM 2230 CB PHE A 140 16.029 48.856 -22.721 1.00 0.00 C ATOM 2231 CG PHE A 140 15.324 47.981 -23.719 1.00 0.00 C ATOM 2232 CD1 PHE A 140 14.440 48.527 -24.637 1.00 0.00 C ATOM 2233 CD2 PHE A 140 15.545 46.612 -23.739 1.00 0.00 C ATOM 2234 CE1 PHE A 140 13.790 47.723 -25.555 1.00 0.00 C ATOM 2235 CE2 PHE A 140 14.897 45.805 -24.655 1.00 0.00 C ATOM 2236 CZ PHE A 140 14.018 46.362 -25.564 1.00 0.00 C ATOM 0 H PHE A 140 16.885 50.132 -20.760 1.00 0.00 H new ATOM 0 HA PHE A 140 14.318 49.927 -22.011 1.00 0.00 H new ATOM 0 HB2 PHE A 140 16.440 49.723 -23.238 1.00 0.00 H new ATOM 0 HB3 PHE A 140 16.871 48.307 -22.300 1.00 0.00 H new ATOM 0 HD1 PHE A 140 14.257 49.591 -24.635 1.00 0.00 H new ATOM 0 HD2 PHE A 140 16.231 46.172 -23.031 1.00 0.00 H new ATOM 0 HE1 PHE A 140 13.104 48.160 -26.265 1.00 0.00 H new ATOM 0 HE2 PHE A 140 15.077 44.740 -24.660 1.00 0.00 H new ATOM 0 HZ PHE A 140 13.510 45.733 -26.280 1.00 0.00 H new ATOM 2246 N GLN A 141 15.300 47.611 -19.894 1.00 0.00 N ATOM 2247 CA GLN A 141 14.846 46.513 -19.050 1.00 0.00 C ATOM 2248 C GLN A 141 13.848 47.019 -18.020 1.00 0.00 C ATOM 2249 O GLN A 141 12.856 46.355 -17.713 1.00 0.00 O ATOM 2250 CB GLN A 141 16.034 45.878 -18.327 1.00 0.00 C ATOM 2251 CG GLN A 141 17.080 45.293 -19.260 1.00 0.00 C ATOM 2252 CD GLN A 141 18.280 44.741 -18.517 1.00 0.00 C ATOM 2253 OE1 GLN A 141 18.165 44.274 -17.384 1.00 0.00 O ATOM 2254 NE2 GLN A 141 19.443 44.799 -19.145 1.00 0.00 N ATOM 0 H GLN A 141 16.251 47.923 -19.697 1.00 0.00 H new ATOM 0 HA GLN A 141 14.366 45.768 -19.684 1.00 0.00 H new ATOM 0 HB2 GLN A 141 16.506 46.630 -17.694 1.00 0.00 H new ATOM 0 HB3 GLN A 141 15.668 45.091 -17.668 1.00 0.00 H new ATOM 0 HG2 GLN A 141 16.628 44.499 -19.854 1.00 0.00 H new ATOM 0 HG3 GLN A 141 17.411 46.063 -19.957 1.00 0.00 H new ATOM 0 HE21 GLN A 141 19.496 45.194 -20.084 1.00 0.00 H new ATOM 0 HE22 GLN A 141 20.286 44.449 -18.690 1.00 0.00 H new ATOM 2263 N SER A 142 14.141 48.189 -17.483 1.00 0.00 N ATOM 2264 CA SER A 142 13.313 48.813 -16.477 1.00 0.00 C ATOM 2265 C SER A 142 12.346 49.809 -17.119 1.00 0.00 C ATOM 2266 O SER A 142 11.334 49.364 -17.700 1.00 0.00 O ATOM 2267 CB SER A 142 14.222 49.509 -15.470 1.00 0.00 C ATOM 2268 OG SER A 142 15.132 48.587 -14.893 1.00 0.00 O ATOM 0 H SER A 142 14.966 48.733 -17.736 1.00 0.00 H new ATOM 0 HA SER A 142 12.713 48.058 -15.968 1.00 0.00 H new ATOM 0 HB2 SER A 142 14.772 50.310 -15.963 1.00 0.00 H new ATOM 0 HB3 SER A 142 13.620 49.971 -14.688 1.00 0.00 H new ATOM 0 HG SER A 142 15.707 49.053 -14.251 1.00 0.00 H new TER 2274 SER A 142