USER MOD reduce.3.24.130724 H: found=0, std=0, add=640, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 641 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 135 THR OG1 : rot -98:sc= 0.959 USER MOD Set 1.2: A 139 GLN :FLIP amide:sc= 0.231 F(o=0.31,f=1.6) USER MOD Set 1.3: A 145 THR OG1 : rot 161:sc= 0.383 USER MOD Single : A 104 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= -0.548 K(o=-0.55,f=-1.8) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 GLN :FLIP amide:sc= -1.63 F(o=-2.6,f=-1.6) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 126 HIS :FLIP no HD1:sc= -0.921 F(o=-1.7,f=-0.92) USER MOD Single : A 127 ASN : amide:sc= -0.0702 X(o=-0.07,f=-0.31) USER MOD Single : A 128 THR OG1 : rot 180:sc=-0.000275 USER MOD Single : A 134 LYS NZ :NH3+ -173:sc= 1.26 (180deg=1.16) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD Single : A 149 LYS NZ :NH3+ 167:sc= -0.0613 (180deg=-0.267) USER MOD Single : A 151 THR OG1 : rot 180:sc= -0.0509 USER MOD Single : A 156 ASN : amide:sc= -1.24 K(o=-1.2,f=-3.4!) USER MOD Single : A 159 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 162 LYS NZ :NH3+ -177:sc= 0.965 (180deg=0.956) USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 170 SER OG : rot 180:sc= 0 USER MOD Single : A 173 THR OG1 : rot 68:sc= 0.319 USER MOD Single : A 176 ASN : amide:sc= 0.0807 K(o=0.081,f=-0.51) USER MOD Single : A 177 MET CE :methyl 172:sc= -1.76 (180deg=-1.88!) USER MOD Single : A 179 ASN : amide:sc= -0.182 X(o=-0.18,f=-0.0027) USER MOD Single : A 181 SER OG : rot 151:sc= 1.86 USER MOD Single : A 184 SER OG : rot 180:sc= 0 USER MOD Single : A 185 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 104 -10.098 -16.610 8.101 1.00 0.00 N ATOM 2 CA MET A 104 -9.635 -15.638 7.085 1.00 0.00 C ATOM 3 C MET A 104 -9.717 -16.252 5.694 1.00 0.00 C ATOM 4 O MET A 104 -9.384 -17.421 5.500 1.00 0.00 O ATOM 5 CB MET A 104 -8.196 -15.179 7.378 1.00 0.00 C ATOM 6 CG MET A 104 -7.141 -16.272 7.259 1.00 0.00 C ATOM 7 SD MET A 104 -7.303 -17.551 8.522 1.00 0.00 S ATOM 8 CE MET A 104 -5.979 -18.662 8.049 1.00 0.00 C ATOM 0 HA MET A 104 -10.287 -14.765 7.127 1.00 0.00 H new ATOM 0 HB2 MET A 104 -7.941 -14.371 6.693 1.00 0.00 H new ATOM 0 HB3 MET A 104 -8.159 -14.766 8.386 1.00 0.00 H new ATOM 0 HG2 MET A 104 -7.212 -16.732 6.273 1.00 0.00 H new ATOM 0 HG3 MET A 104 -6.151 -15.822 7.330 1.00 0.00 H new ATOM 0 HE1 MET A 104 -5.950 -19.507 8.737 1.00 0.00 H new ATOM 0 HE2 MET A 104 -6.153 -19.025 7.036 1.00 0.00 H new ATOM 0 HE3 MET A 104 -5.028 -18.131 8.086 1.00 0.00 H new ATOM 18 N ASN A 105 -10.180 -15.467 4.735 1.00 0.00 N ATOM 19 CA ASN A 105 -10.315 -15.931 3.362 1.00 0.00 C ATOM 20 C ASN A 105 -10.338 -14.750 2.403 1.00 0.00 C ATOM 21 O ASN A 105 -11.338 -14.032 2.332 1.00 0.00 O ATOM 22 CB ASN A 105 -11.598 -16.756 3.204 1.00 0.00 C ATOM 23 CG ASN A 105 -11.834 -17.221 1.777 1.00 0.00 C ATOM 24 OD1 ASN A 105 -10.892 -17.449 1.018 1.00 0.00 O ATOM 25 ND2 ASN A 105 -13.096 -17.363 1.404 1.00 0.00 N ATOM 0 H ASN A 105 -10.470 -14.500 4.882 1.00 0.00 H new ATOM 0 HA ASN A 105 -9.457 -16.560 3.125 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -11.547 -17.625 3.860 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -12.449 -16.159 3.531 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -13.316 -17.672 0.457 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -13.848 -17.164 2.063 1.00 0.00 H new ATOM 32 N LYS A 106 -9.232 -14.544 1.686 1.00 0.00 N ATOM 33 CA LYS A 106 -9.134 -13.474 0.692 1.00 0.00 C ATOM 34 C LYS A 106 -9.447 -12.121 1.325 1.00 0.00 C ATOM 35 O LYS A 106 -10.308 -11.382 0.844 1.00 0.00 O ATOM 36 CB LYS A 106 -10.103 -13.735 -0.466 1.00 0.00 C ATOM 37 CG LYS A 106 -9.916 -15.080 -1.146 1.00 0.00 C ATOM 38 CD LYS A 106 -10.995 -15.315 -2.190 1.00 0.00 C ATOM 39 CE LYS A 106 -10.872 -16.685 -2.830 1.00 0.00 C ATOM 40 NZ LYS A 106 -11.934 -16.910 -3.845 1.00 0.00 N ATOM 0 H LYS A 106 -8.387 -15.108 1.776 1.00 0.00 H new ATOM 0 HA LYS A 106 -8.113 -13.457 0.310 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -11.125 -13.669 -0.091 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -9.984 -12.946 -1.209 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -8.934 -15.120 -1.617 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -9.945 -15.876 -0.401 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -11.977 -15.217 -1.726 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -10.929 -14.547 -2.960 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -9.893 -16.782 -3.299 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -10.934 -17.454 -2.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -11.820 -17.856 -4.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -12.868 -16.842 -3.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -11.858 -16.190 -4.592 1.00 0.00 H new ATOM 54 N VAL A 107 -8.738 -11.793 2.396 1.00 0.00 N ATOM 55 CA VAL A 107 -9.068 -10.612 3.186 1.00 0.00 C ATOM 56 C VAL A 107 -8.708 -9.312 2.467 1.00 0.00 C ATOM 57 O VAL A 107 -9.166 -8.245 2.863 1.00 0.00 O ATOM 58 CB VAL A 107 -8.399 -10.640 4.577 1.00 0.00 C ATOM 59 CG1 VAL A 107 -8.838 -11.870 5.355 1.00 0.00 C ATOM 60 CG2 VAL A 107 -6.884 -10.589 4.462 1.00 0.00 C ATOM 0 H VAL A 107 -7.936 -12.323 2.737 1.00 0.00 H new ATOM 0 HA VAL A 107 -10.149 -10.639 3.320 1.00 0.00 H new ATOM 0 HB VAL A 107 -8.721 -9.752 5.122 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -8.356 -11.873 6.333 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -9.920 -11.852 5.483 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -8.552 -12.768 4.807 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -6.443 -10.610 5.458 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -6.533 -11.449 3.891 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -6.588 -9.671 3.954 1.00 0.00 H new ATOM 70 N GLN A 108 -7.896 -9.395 1.415 1.00 0.00 N ATOM 71 CA GLN A 108 -7.555 -8.210 0.637 1.00 0.00 C ATOM 72 C GLN A 108 -8.740 -7.778 -0.216 1.00 0.00 C ATOM 73 O GLN A 108 -9.006 -8.347 -1.277 1.00 0.00 O ATOM 74 CB GLN A 108 -6.328 -8.442 -0.249 1.00 0.00 C ATOM 75 CG GLN A 108 -5.994 -7.242 -1.127 1.00 0.00 C ATOM 76 CD GLN A 108 -4.744 -7.436 -1.964 1.00 0.00 C ATOM 77 OE1 GLN A 108 -4.087 -6.338 -2.301 1.00 0.00 O flip ATOM 78 NE2 GLN A 108 -4.382 -8.557 -2.320 1.00 0.00 N flip ATOM 0 H GLN A 108 -7.467 -10.260 1.086 1.00 0.00 H new ATOM 0 HA GLN A 108 -7.309 -7.416 1.343 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -5.470 -8.674 0.382 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -6.503 -9.312 -0.882 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -6.837 -7.039 -1.788 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -5.866 -6.363 -0.495 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -4.917 -9.379 -2.039 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -3.547 -8.664 -2.896 1.00 0.00 H new ATOM 87 N ALA A 109 -9.450 -6.778 0.270 1.00 0.00 N ATOM 88 CA ALA A 109 -10.598 -6.230 -0.427 1.00 0.00 C ATOM 89 C ALA A 109 -10.168 -5.558 -1.728 1.00 0.00 C ATOM 90 O ALA A 109 -9.058 -5.033 -1.820 1.00 0.00 O ATOM 91 CB ALA A 109 -11.306 -5.242 0.476 1.00 0.00 C ATOM 0 H ALA A 109 -9.247 -6.322 1.160 1.00 0.00 H new ATOM 0 HA ALA A 109 -11.283 -7.039 -0.681 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -12.170 -4.828 -0.044 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -11.637 -5.750 1.382 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -10.621 -4.436 0.741 1.00 0.00 H new ATOM 97 N PRO A 110 -11.042 -5.587 -2.753 1.00 0.00 N ATOM 98 CA PRO A 110 -10.754 -5.010 -4.073 1.00 0.00 C ATOM 99 C PRO A 110 -10.427 -3.520 -4.012 1.00 0.00 C ATOM 100 O PRO A 110 -11.322 -2.674 -3.988 1.00 0.00 O ATOM 101 CB PRO A 110 -12.048 -5.240 -4.867 1.00 0.00 C ATOM 102 CG PRO A 110 -13.093 -5.506 -3.840 1.00 0.00 C ATOM 103 CD PRO A 110 -12.382 -6.191 -2.713 1.00 0.00 C ATOM 0 HA PRO A 110 -9.875 -5.472 -4.522 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -12.301 -4.368 -5.470 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -11.946 -6.082 -5.552 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -13.558 -4.579 -3.505 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -13.888 -6.134 -4.242 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -12.876 -6.015 -1.757 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -12.343 -7.271 -2.857 1.00 0.00 H new ATOM 111 N ALA A 111 -9.140 -3.211 -3.980 1.00 0.00 N ATOM 112 CA ALA A 111 -8.683 -1.834 -3.986 1.00 0.00 C ATOM 113 C ALA A 111 -8.767 -1.268 -5.386 1.00 0.00 C ATOM 114 O ALA A 111 -7.960 -1.609 -6.253 1.00 0.00 O ATOM 115 CB ALA A 111 -7.266 -1.745 -3.459 1.00 0.00 C ATOM 0 H ALA A 111 -8.390 -3.902 -3.949 1.00 0.00 H new ATOM 0 HA ALA A 111 -9.327 -1.246 -3.332 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -6.938 -0.705 -3.470 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -7.233 -2.125 -2.438 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -6.605 -2.340 -4.089 1.00 0.00 H new ATOM 121 N ARG A 112 -9.750 -0.416 -5.608 1.00 0.00 N ATOM 122 CA ARG A 112 -9.995 0.111 -6.930 1.00 0.00 C ATOM 123 C ARG A 112 -10.106 1.634 -6.887 1.00 0.00 C ATOM 124 O ARG A 112 -10.859 2.190 -6.085 1.00 0.00 O ATOM 125 CB ARG A 112 -11.268 -0.532 -7.500 1.00 0.00 C ATOM 126 CG ARG A 112 -11.531 -0.254 -8.976 1.00 0.00 C ATOM 127 CD ARG A 112 -12.229 1.079 -9.192 1.00 0.00 C ATOM 128 NE ARG A 112 -13.539 1.123 -8.544 1.00 0.00 N ATOM 129 CZ ARG A 112 -14.336 2.191 -8.544 1.00 0.00 C ATOM 130 NH1 ARG A 112 -13.962 3.305 -9.158 1.00 0.00 N ATOM 131 NH2 ARG A 112 -15.509 2.145 -7.926 1.00 0.00 N ATOM 0 H ARG A 112 -10.389 -0.077 -4.889 1.00 0.00 H new ATOM 0 HA ARG A 112 -9.158 -0.133 -7.585 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -11.207 -1.611 -7.355 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -12.123 -0.181 -6.923 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -10.586 -0.260 -9.519 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -12.143 -1.055 -9.392 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -11.604 1.883 -8.802 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -12.347 1.257 -10.261 1.00 0.00 H new ATOM 0 HE ARG A 112 -13.863 0.284 -8.062 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -13.061 3.347 -9.633 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -14.576 4.120 -9.155 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -15.802 1.292 -7.450 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -16.118 2.963 -7.927 1.00 0.00 H new ATOM 145 N PRO A 113 -9.333 2.320 -7.745 1.00 0.00 N ATOM 146 CA PRO A 113 -9.317 3.786 -7.829 1.00 0.00 C ATOM 147 C PRO A 113 -10.693 4.380 -8.100 1.00 0.00 C ATOM 148 O PRO A 113 -11.301 4.125 -9.142 1.00 0.00 O ATOM 149 CB PRO A 113 -8.382 4.086 -9.003 1.00 0.00 C ATOM 150 CG PRO A 113 -8.204 2.790 -9.722 1.00 0.00 C ATOM 151 CD PRO A 113 -8.389 1.715 -8.694 1.00 0.00 C ATOM 0 HA PRO A 113 -8.994 4.225 -6.885 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -8.810 4.842 -9.661 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -7.425 4.473 -8.652 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -8.931 2.688 -10.527 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -7.215 2.729 -10.176 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -8.789 0.801 -9.134 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -7.447 1.451 -8.213 1.00 0.00 H new ATOM 159 N GLY A 114 -11.167 5.182 -7.164 1.00 0.00 N ATOM 160 CA GLY A 114 -12.478 5.781 -7.292 1.00 0.00 C ATOM 161 C GLY A 114 -13.339 5.474 -6.092 1.00 0.00 C ATOM 162 O GLY A 114 -14.309 6.177 -5.813 1.00 0.00 O ATOM 0 H GLY A 114 -10.665 5.431 -6.312 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -12.378 6.861 -7.404 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -12.963 5.410 -8.195 1.00 0.00 H new ATOM 166 N ALA A 115 -12.972 4.419 -5.380 1.00 0.00 N ATOM 167 CA ALA A 115 -13.679 4.021 -4.176 1.00 0.00 C ATOM 168 C ALA A 115 -13.204 4.846 -2.986 1.00 0.00 C ATOM 169 O ALA A 115 -12.074 5.337 -2.968 1.00 0.00 O ATOM 170 CB ALA A 115 -13.465 2.540 -3.917 1.00 0.00 C ATOM 0 H ALA A 115 -12.182 3.820 -5.619 1.00 0.00 H new ATOM 0 HA ALA A 115 -14.745 4.202 -4.315 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -13.998 2.248 -3.012 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -13.842 1.965 -4.762 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -12.400 2.343 -3.790 1.00 0.00 H new ATOM 176 N ILE A 116 -14.071 4.999 -1.999 1.00 0.00 N ATOM 177 CA ILE A 116 -13.761 5.800 -0.824 1.00 0.00 C ATOM 178 C ILE A 116 -13.040 4.963 0.224 1.00 0.00 C ATOM 179 O ILE A 116 -13.434 3.830 0.500 1.00 0.00 O ATOM 180 CB ILE A 116 -15.046 6.413 -0.212 1.00 0.00 C ATOM 181 CG1 ILE A 116 -15.721 7.355 -1.216 1.00 0.00 C ATOM 182 CG2 ILE A 116 -14.742 7.147 1.090 1.00 0.00 C ATOM 183 CD1 ILE A 116 -14.864 8.536 -1.627 1.00 0.00 C ATOM 0 H ILE A 116 -15.000 4.577 -1.987 1.00 0.00 H new ATOM 0 HA ILE A 116 -13.106 6.611 -1.142 1.00 0.00 H new ATOM 0 HB ILE A 116 -15.732 5.597 0.017 1.00 0.00 H new ATOM 0 HG12 ILE A 116 -15.990 6.787 -2.107 1.00 0.00 H new ATOM 0 HG13 ILE A 116 -16.649 7.727 -0.782 1.00 0.00 H new ATOM 0 HG21 ILE A 116 -15.663 7.566 1.495 1.00 0.00 H new ATOM 0 HG22 ILE A 116 -14.314 6.449 1.810 1.00 0.00 H new ATOM 0 HG23 ILE A 116 -14.032 7.951 0.897 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -15.413 9.154 -2.338 1.00 0.00 H new ATOM 0 HD12 ILE A 116 -14.616 9.129 -0.747 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -13.946 8.175 -2.092 1.00 0.00 H new ATOM 195 N ALA A 117 -11.982 5.532 0.790 1.00 0.00 N ATOM 196 CA ALA A 117 -11.185 4.863 1.806 1.00 0.00 C ATOM 197 C ALA A 117 -11.912 4.866 3.147 1.00 0.00 C ATOM 198 O ALA A 117 -12.072 5.915 3.771 1.00 0.00 O ATOM 199 CB ALA A 117 -9.831 5.541 1.937 1.00 0.00 C ATOM 0 H ALA A 117 -11.654 6.469 0.556 1.00 0.00 H new ATOM 0 HA ALA A 117 -11.032 3.827 1.502 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -9.242 5.033 2.700 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -9.307 5.494 0.983 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -9.972 6.583 2.222 1.00 0.00 H new ATOM 205 N PRO A 118 -12.385 3.696 3.592 1.00 0.00 N ATOM 206 CA PRO A 118 -13.127 3.558 4.847 1.00 0.00 C ATOM 207 C PRO A 118 -12.234 3.608 6.086 1.00 0.00 C ATOM 208 O PRO A 118 -12.609 4.183 7.108 1.00 0.00 O ATOM 209 CB PRO A 118 -13.780 2.172 4.740 1.00 0.00 C ATOM 210 CG PRO A 118 -13.522 1.710 3.345 1.00 0.00 C ATOM 211 CD PRO A 118 -12.278 2.415 2.892 1.00 0.00 C ATOM 0 HA PRO A 118 -13.833 4.380 4.970 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -13.353 1.481 5.467 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -14.850 2.227 4.943 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -13.390 0.629 3.312 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -14.363 1.949 2.694 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -11.376 1.871 3.171 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -12.252 2.542 1.810 1.00 0.00 H new ATOM 219 N LEU A 119 -11.056 3.009 5.988 1.00 0.00 N ATOM 220 CA LEU A 119 -10.195 2.824 7.152 1.00 0.00 C ATOM 221 C LEU A 119 -8.880 3.576 7.004 1.00 0.00 C ATOM 222 O LEU A 119 -8.532 4.046 5.919 1.00 0.00 O ATOM 223 CB LEU A 119 -9.910 1.334 7.353 1.00 0.00 C ATOM 224 CG LEU A 119 -11.142 0.452 7.560 1.00 0.00 C ATOM 225 CD1 LEU A 119 -10.734 -1.005 7.683 1.00 0.00 C ATOM 226 CD2 LEU A 119 -11.922 0.893 8.791 1.00 0.00 C ATOM 0 H LEU A 119 -10.673 2.642 5.117 1.00 0.00 H new ATOM 0 HA LEU A 119 -10.718 3.225 8.020 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -9.362 0.966 6.485 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -9.254 1.220 8.216 1.00 0.00 H new ATOM 0 HG LEU A 119 -11.790 0.560 6.690 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -11.622 -1.620 7.830 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -10.222 -1.318 6.773 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -10.065 -1.125 8.535 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -12.794 0.251 8.918 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -11.284 0.818 9.672 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -12.247 1.926 8.665 1.00 0.00 H new ATOM 238 N SER A 120 -8.153 3.675 8.112 1.00 0.00 N ATOM 239 CA SER A 120 -6.854 4.327 8.131 1.00 0.00 C ATOM 240 C SER A 120 -5.769 3.323 7.786 1.00 0.00 C ATOM 241 O SER A 120 -5.079 2.802 8.667 1.00 0.00 O ATOM 242 CB SER A 120 -6.571 4.924 9.504 1.00 0.00 C ATOM 243 OG SER A 120 -7.584 5.832 9.902 1.00 0.00 O ATOM 0 H SER A 120 -8.448 3.307 9.016 1.00 0.00 H new ATOM 0 HA SER A 120 -6.862 5.129 7.393 1.00 0.00 H new ATOM 0 HB2 SER A 120 -6.491 4.123 10.239 1.00 0.00 H new ATOM 0 HB3 SER A 120 -5.609 5.437 9.486 1.00 0.00 H new ATOM 0 HG SER A 120 -7.370 6.193 10.787 1.00 0.00 H new ATOM 249 N VAL A 121 -5.633 3.051 6.505 1.00 0.00 N ATOM 250 CA VAL A 121 -4.676 2.059 6.036 1.00 0.00 C ATOM 251 C VAL A 121 -3.254 2.551 6.241 1.00 0.00 C ATOM 252 O VAL A 121 -2.928 3.702 5.935 1.00 0.00 O ATOM 253 CB VAL A 121 -4.873 1.716 4.545 1.00 0.00 C ATOM 254 CG1 VAL A 121 -3.960 0.571 4.127 1.00 0.00 C ATOM 255 CG2 VAL A 121 -6.322 1.375 4.252 1.00 0.00 C ATOM 0 H VAL A 121 -6.172 3.501 5.765 1.00 0.00 H new ATOM 0 HA VAL A 121 -4.850 1.157 6.623 1.00 0.00 H new ATOM 0 HB VAL A 121 -4.607 2.598 3.962 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -4.117 0.347 3.072 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -2.921 0.858 4.286 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -4.188 -0.313 4.723 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -6.433 1.137 3.194 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -6.622 0.515 4.851 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -6.954 2.228 4.500 1.00 0.00 H new ATOM 265 N VAL A 122 -2.419 1.675 6.764 1.00 0.00 N ATOM 266 CA VAL A 122 -1.034 1.988 7.004 1.00 0.00 C ATOM 267 C VAL A 122 -0.134 0.985 6.294 1.00 0.00 C ATOM 268 O VAL A 122 -0.356 -0.221 6.373 1.00 0.00 O ATOM 269 CB VAL A 122 -0.733 1.989 8.518 1.00 0.00 C ATOM 270 CG1 VAL A 122 0.761 2.012 8.780 1.00 0.00 C ATOM 271 CG2 VAL A 122 -1.405 3.176 9.193 1.00 0.00 C ATOM 0 H VAL A 122 -2.686 0.728 7.033 1.00 0.00 H new ATOM 0 HA VAL A 122 -0.834 2.984 6.608 1.00 0.00 H new ATOM 0 HB VAL A 122 -1.136 1.069 8.940 1.00 0.00 H new ATOM 0 HG11 VAL A 122 0.942 2.012 9.855 1.00 0.00 H new ATOM 0 HG12 VAL A 122 1.222 1.130 8.335 1.00 0.00 H new ATOM 0 HG13 VAL A 122 1.194 2.910 8.339 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -1.183 3.162 10.260 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -1.031 4.102 8.757 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -2.483 3.115 9.046 1.00 0.00 H new ATOM 281 N ILE A 123 0.855 1.498 5.575 1.00 0.00 N ATOM 282 CA ILE A 123 1.868 0.661 4.951 1.00 0.00 C ATOM 283 C ILE A 123 3.025 0.490 5.936 1.00 0.00 C ATOM 284 O ILE A 123 3.828 1.408 6.124 1.00 0.00 O ATOM 285 CB ILE A 123 2.363 1.279 3.619 1.00 0.00 C ATOM 286 CG1 ILE A 123 1.195 1.408 2.642 1.00 0.00 C ATOM 287 CG2 ILE A 123 3.473 0.440 2.994 1.00 0.00 C ATOM 288 CD1 ILE A 123 1.547 2.142 1.370 1.00 0.00 C ATOM 0 H ILE A 123 0.977 2.497 5.409 1.00 0.00 H new ATOM 0 HA ILE A 123 1.440 -0.312 4.710 1.00 0.00 H new ATOM 0 HB ILE A 123 2.770 2.267 3.836 1.00 0.00 H new ATOM 0 HG12 ILE A 123 0.833 0.412 2.388 1.00 0.00 H new ATOM 0 HG13 ILE A 123 0.375 1.928 3.136 1.00 0.00 H new ATOM 0 HG21 ILE A 123 3.797 0.902 2.061 1.00 0.00 H new ATOM 0 HG22 ILE A 123 4.316 0.382 3.682 1.00 0.00 H new ATOM 0 HG23 ILE A 123 3.100 -0.564 2.791 1.00 0.00 H new ATOM 0 HD11 ILE A 123 0.669 2.195 0.726 1.00 0.00 H new ATOM 0 HD12 ILE A 123 1.880 3.151 1.613 1.00 0.00 H new ATOM 0 HD13 ILE A 123 2.346 1.611 0.853 1.00 0.00 H new ATOM 300 N PRO A 124 3.089 -0.675 6.608 1.00 0.00 N ATOM 301 CA PRO A 124 4.010 -0.916 7.730 1.00 0.00 C ATOM 302 C PRO A 124 5.480 -0.814 7.361 1.00 0.00 C ATOM 303 O PRO A 124 5.915 -1.243 6.288 1.00 0.00 O ATOM 304 CB PRO A 124 3.667 -2.339 8.188 1.00 0.00 C ATOM 305 CG PRO A 124 2.318 -2.612 7.628 1.00 0.00 C ATOM 306 CD PRO A 124 2.260 -1.860 6.334 1.00 0.00 C ATOM 0 HA PRO A 124 3.881 -0.156 8.501 1.00 0.00 H new ATOM 0 HB2 PRO A 124 4.399 -3.058 7.821 1.00 0.00 H new ATOM 0 HB3 PRO A 124 3.665 -2.413 9.275 1.00 0.00 H new ATOM 0 HG2 PRO A 124 2.169 -3.680 7.468 1.00 0.00 H new ATOM 0 HG3 PRO A 124 1.536 -2.279 8.310 1.00 0.00 H new ATOM 0 HD2 PRO A 124 2.656 -2.448 5.506 1.00 0.00 H new ATOM 0 HD3 PRO A 124 1.238 -1.587 6.070 1.00 0.00 H new ATOM 314 N ALA A 125 6.228 -0.251 8.293 1.00 0.00 N ATOM 315 CA ALA A 125 7.645 0.004 8.135 1.00 0.00 C ATOM 316 C ALA A 125 8.479 -1.277 8.176 1.00 0.00 C ATOM 317 O ALA A 125 9.004 -1.657 9.223 1.00 0.00 O ATOM 318 CB ALA A 125 8.090 0.968 9.215 1.00 0.00 C ATOM 0 H ALA A 125 5.859 0.046 9.196 1.00 0.00 H new ATOM 0 HA ALA A 125 7.806 0.442 7.150 1.00 0.00 H new ATOM 0 HB1 ALA A 125 9.156 1.168 9.107 1.00 0.00 H new ATOM 0 HB2 ALA A 125 7.534 1.901 9.122 1.00 0.00 H new ATOM 0 HB3 ALA A 125 7.901 0.529 10.195 1.00 0.00 H new ATOM 324 N HIS A 126 8.589 -1.930 7.025 1.00 0.00 N ATOM 325 CA HIS A 126 9.450 -3.093 6.847 1.00 0.00 C ATOM 326 C HIS A 126 9.408 -3.506 5.385 1.00 0.00 C ATOM 327 O HIS A 126 8.729 -2.861 4.586 1.00 0.00 O ATOM 328 CB HIS A 126 9.050 -4.271 7.759 1.00 0.00 C ATOM 329 CG HIS A 126 7.728 -4.904 7.435 1.00 0.00 C ATOM 330 ND1 HIS A 126 6.467 -4.441 7.576 1.00 0.00 N flip ATOM 331 CD2 HIS A 126 7.609 -6.175 6.917 1.00 0.00 C flip ATOM 332 CE1 HIS A 126 5.617 -5.429 7.143 1.00 0.00 C flip ATOM 333 NE2 HIS A 126 6.332 -6.465 6.751 1.00 0.00 N flip ATOM 0 H HIS A 126 8.079 -1.665 6.182 1.00 0.00 H new ATOM 0 HA HIS A 126 10.465 -2.818 7.135 1.00 0.00 H new ATOM 0 HB2 HIS A 126 9.825 -5.035 7.701 1.00 0.00 H new ATOM 0 HB3 HIS A 126 9.025 -3.920 8.791 1.00 0.00 H new ATOM 0 HD2 HIS A 126 8.433 -6.833 6.683 1.00 0.00 H new ATOM 0 HE1 HIS A 126 4.539 -5.367 7.126 1.00 0.00 H new ATOM 0 HE2 HIS A 126 5.962 -7.341 6.382 1.00 0.00 H new ATOM 342 N ASN A 127 10.151 -4.543 5.028 1.00 0.00 N ATOM 343 CA ASN A 127 10.135 -5.059 3.663 1.00 0.00 C ATOM 344 C ASN A 127 8.721 -5.447 3.252 1.00 0.00 C ATOM 345 O ASN A 127 7.985 -6.060 4.020 1.00 0.00 O ATOM 346 CB ASN A 127 11.068 -6.266 3.525 1.00 0.00 C ATOM 347 CG ASN A 127 10.816 -7.323 4.583 1.00 0.00 C ATOM 348 OD1 ASN A 127 11.431 -7.298 5.647 1.00 0.00 O ATOM 349 ND2 ASN A 127 9.908 -8.246 4.309 1.00 0.00 N ATOM 0 H ASN A 127 10.773 -5.045 5.662 1.00 0.00 H new ATOM 0 HA ASN A 127 10.489 -4.268 3.002 1.00 0.00 H new ATOM 0 HB2 ASN A 127 10.940 -6.708 2.537 1.00 0.00 H new ATOM 0 HB3 ASN A 127 12.103 -5.930 3.592 1.00 0.00 H new ATOM 0 HD21 ASN A 127 9.696 -8.972 4.993 1.00 0.00 H new ATOM 0 HD22 ASN A 127 9.420 -8.231 3.414 1.00 0.00 H new ATOM 356 N THR A 128 8.344 -5.072 2.045 1.00 0.00 N ATOM 357 CA THR A 128 7.019 -5.376 1.532 1.00 0.00 C ATOM 358 C THR A 128 7.040 -6.660 0.712 1.00 0.00 C ATOM 359 O THR A 128 6.002 -7.146 0.260 1.00 0.00 O ATOM 360 CB THR A 128 6.505 -4.215 0.663 1.00 0.00 C ATOM 361 OG1 THR A 128 7.495 -3.880 -0.321 1.00 0.00 O ATOM 362 CG2 THR A 128 6.200 -2.993 1.519 1.00 0.00 C ATOM 0 H THR A 128 8.938 -4.554 1.398 1.00 0.00 H new ATOM 0 HA THR A 128 6.349 -5.513 2.381 1.00 0.00 H new ATOM 0 HB THR A 128 5.585 -4.529 0.170 1.00 0.00 H new ATOM 0 HG1 THR A 128 7.168 -3.141 -0.876 1.00 0.00 H new ATOM 0 HG21 THR A 128 5.838 -2.185 0.883 1.00 0.00 H new ATOM 0 HG22 THR A 128 5.437 -3.246 2.255 1.00 0.00 H new ATOM 0 HG23 THR A 128 7.107 -2.673 2.032 1.00 0.00 H new ATOM 370 N GLY A 129 8.238 -7.204 0.527 1.00 0.00 N ATOM 371 CA GLY A 129 8.402 -8.385 -0.300 1.00 0.00 C ATOM 372 C GLY A 129 8.430 -8.031 -1.769 1.00 0.00 C ATOM 373 O GLY A 129 8.517 -8.906 -2.633 1.00 0.00 O ATOM 0 H GLY A 129 9.101 -6.847 0.937 1.00 0.00 H new ATOM 0 HA2 GLY A 129 9.327 -8.895 -0.030 1.00 0.00 H new ATOM 0 HA3 GLY A 129 7.586 -9.082 -0.108 1.00 0.00 H new ATOM 377 N LEU A 130 8.356 -6.741 -2.044 1.00 0.00 N ATOM 378 CA LEU A 130 8.361 -6.238 -3.403 1.00 0.00 C ATOM 379 C LEU A 130 9.773 -5.877 -3.826 1.00 0.00 C ATOM 380 O LEU A 130 10.609 -5.511 -2.993 1.00 0.00 O ATOM 381 CB LEU A 130 7.459 -5.011 -3.505 1.00 0.00 C ATOM 382 CG LEU A 130 5.981 -5.263 -3.200 1.00 0.00 C ATOM 383 CD1 LEU A 130 5.208 -3.955 -3.205 1.00 0.00 C ATOM 384 CD2 LEU A 130 5.386 -6.239 -4.204 1.00 0.00 C ATOM 0 H LEU A 130 8.291 -6.014 -1.331 1.00 0.00 H new ATOM 0 HA LEU A 130 7.984 -7.016 -4.067 1.00 0.00 H new ATOM 0 HB2 LEU A 130 7.830 -4.249 -2.820 1.00 0.00 H new ATOM 0 HB3 LEU A 130 7.541 -4.602 -4.512 1.00 0.00 H new ATOM 0 HG LEU A 130 5.905 -5.705 -2.207 1.00 0.00 H new ATOM 0 HD11 LEU A 130 4.158 -4.152 -2.986 1.00 0.00 H new ATOM 0 HD12 LEU A 130 5.618 -3.287 -2.447 1.00 0.00 H new ATOM 0 HD13 LEU A 130 5.293 -3.486 -4.185 1.00 0.00 H new ATOM 0 HD21 LEU A 130 4.334 -6.405 -3.970 1.00 0.00 H new ATOM 0 HD22 LEU A 130 5.473 -5.826 -5.209 1.00 0.00 H new ATOM 0 HD23 LEU A 130 5.923 -7.186 -4.153 1.00 0.00 H new ATOM 396 N GLY A 131 10.035 -5.987 -5.119 1.00 0.00 N ATOM 397 CA GLY A 131 11.329 -5.621 -5.642 1.00 0.00 C ATOM 398 C GLY A 131 11.530 -4.121 -5.623 1.00 0.00 C ATOM 399 O GLY A 131 10.556 -3.369 -5.519 1.00 0.00 O ATOM 0 H GLY A 131 9.371 -6.325 -5.816 1.00 0.00 H new ATOM 0 HA2 GLY A 131 12.110 -6.101 -5.053 1.00 0.00 H new ATOM 0 HA3 GLY A 131 11.428 -5.990 -6.663 1.00 0.00 H new ATOM 403 N PRO A 132 12.783 -3.657 -5.736 1.00 0.00 N ATOM 404 CA PRO A 132 13.119 -2.230 -5.658 1.00 0.00 C ATOM 405 C PRO A 132 12.312 -1.375 -6.633 1.00 0.00 C ATOM 406 O PRO A 132 12.051 -0.209 -6.365 1.00 0.00 O ATOM 407 CB PRO A 132 14.605 -2.189 -6.021 1.00 0.00 C ATOM 408 CG PRO A 132 15.117 -3.548 -5.699 1.00 0.00 C ATOM 409 CD PRO A 132 13.978 -4.493 -5.950 1.00 0.00 C ATOM 0 HA PRO A 132 12.892 -1.821 -4.673 1.00 0.00 H new ATOM 0 HB2 PRO A 132 14.747 -1.953 -7.076 1.00 0.00 H new ATOM 0 HB3 PRO A 132 15.130 -1.424 -5.449 1.00 0.00 H new ATOM 0 HG2 PRO A 132 15.976 -3.799 -6.322 1.00 0.00 H new ATOM 0 HG3 PRO A 132 15.448 -3.604 -4.662 1.00 0.00 H new ATOM 0 HD2 PRO A 132 14.008 -4.898 -6.961 1.00 0.00 H new ATOM 0 HD3 PRO A 132 14.002 -5.341 -5.266 1.00 0.00 H new ATOM 417 N GLU A 133 11.905 -1.971 -7.748 1.00 0.00 N ATOM 418 CA GLU A 133 11.148 -1.265 -8.782 1.00 0.00 C ATOM 419 C GLU A 133 9.880 -0.609 -8.234 1.00 0.00 C ATOM 420 O GLU A 133 9.471 0.456 -8.699 1.00 0.00 O ATOM 421 CB GLU A 133 10.761 -2.229 -9.899 1.00 0.00 C ATOM 422 CG GLU A 133 9.969 -3.433 -9.411 1.00 0.00 C ATOM 423 CD GLU A 133 9.415 -4.269 -10.541 1.00 0.00 C ATOM 424 OE1 GLU A 133 8.395 -3.863 -11.141 1.00 0.00 O ATOM 425 OE2 GLU A 133 9.983 -5.343 -10.822 1.00 0.00 O ATOM 0 H GLU A 133 12.088 -2.951 -7.963 1.00 0.00 H new ATOM 0 HA GLU A 133 11.798 -0.478 -9.164 1.00 0.00 H new ATOM 0 HB2 GLU A 133 10.172 -1.693 -10.643 1.00 0.00 H new ATOM 0 HB3 GLU A 133 11.665 -2.577 -10.398 1.00 0.00 H new ATOM 0 HG2 GLU A 133 10.610 -4.055 -8.786 1.00 0.00 H new ATOM 0 HG3 GLU A 133 9.147 -3.090 -8.782 1.00 0.00 H new ATOM 432 N LYS A 134 9.265 -1.234 -7.235 1.00 0.00 N ATOM 433 CA LYS A 134 7.983 -0.764 -6.723 1.00 0.00 C ATOM 434 C LYS A 134 8.150 0.534 -5.943 1.00 0.00 C ATOM 435 O LYS A 134 7.168 1.194 -5.577 1.00 0.00 O ATOM 436 CB LYS A 134 7.325 -1.831 -5.847 1.00 0.00 C ATOM 437 CG LYS A 134 7.146 -3.168 -6.549 1.00 0.00 C ATOM 438 CD LYS A 134 6.553 -3.008 -7.943 1.00 0.00 C ATOM 439 CE LYS A 134 6.306 -4.359 -8.590 1.00 0.00 C ATOM 440 NZ LYS A 134 5.946 -4.244 -10.027 1.00 0.00 N ATOM 0 H LYS A 134 9.631 -2.063 -6.766 1.00 0.00 H new ATOM 0 HA LYS A 134 7.333 -0.569 -7.576 1.00 0.00 H new ATOM 0 HB2 LYS A 134 7.929 -1.978 -4.952 1.00 0.00 H new ATOM 0 HB3 LYS A 134 6.351 -1.469 -5.518 1.00 0.00 H new ATOM 0 HG2 LYS A 134 8.110 -3.671 -6.621 1.00 0.00 H new ATOM 0 HG3 LYS A 134 6.497 -3.807 -5.951 1.00 0.00 H new ATOM 0 HD2 LYS A 134 5.616 -2.454 -7.882 1.00 0.00 H new ATOM 0 HD3 LYS A 134 7.230 -2.422 -8.565 1.00 0.00 H new ATOM 0 HE2 LYS A 134 7.200 -4.975 -8.491 1.00 0.00 H new ATOM 0 HE3 LYS A 134 5.505 -4.872 -8.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 5.673 -5.179 -10.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 5.149 -3.584 -10.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 6.764 -3.889 -10.562 1.00 0.00 H new ATOM 454 N THR A 135 9.400 0.917 -5.724 1.00 0.00 N ATOM 455 CA THR A 135 9.698 2.126 -4.979 1.00 0.00 C ATOM 456 C THR A 135 9.218 3.346 -5.753 1.00 0.00 C ATOM 457 O THR A 135 8.959 4.392 -5.172 1.00 0.00 O ATOM 458 CB THR A 135 11.203 2.240 -4.652 1.00 0.00 C ATOM 459 OG1 THR A 135 11.406 3.166 -3.579 1.00 0.00 O ATOM 460 CG2 THR A 135 12.014 2.690 -5.862 1.00 0.00 C ATOM 0 H THR A 135 10.221 0.408 -6.052 1.00 0.00 H new ATOM 0 HA THR A 135 9.166 2.077 -4.029 1.00 0.00 H new ATOM 0 HB THR A 135 11.547 1.248 -4.359 1.00 0.00 H new ATOM 0 HG1 THR A 135 11.667 4.037 -3.944 1.00 0.00 H new ATOM 0 HG21 THR A 135 13.067 2.758 -5.589 1.00 0.00 H new ATOM 0 HG22 THR A 135 11.894 1.968 -6.670 1.00 0.00 H new ATOM 0 HG23 THR A 135 11.662 3.667 -6.193 1.00 0.00 H new ATOM 468 N SER A 136 9.058 3.190 -7.064 1.00 0.00 N ATOM 469 CA SER A 136 8.507 4.248 -7.890 1.00 0.00 C ATOM 470 C SER A 136 7.065 4.533 -7.467 1.00 0.00 C ATOM 471 O SER A 136 6.645 5.686 -7.400 1.00 0.00 O ATOM 472 CB SER A 136 8.572 3.856 -9.370 1.00 0.00 C ATOM 473 OG SER A 136 8.233 4.947 -10.207 1.00 0.00 O ATOM 0 H SER A 136 9.303 2.340 -7.572 1.00 0.00 H new ATOM 0 HA SER A 136 9.098 5.154 -7.754 1.00 0.00 H new ATOM 0 HB2 SER A 136 9.576 3.507 -9.612 1.00 0.00 H new ATOM 0 HB3 SER A 136 7.892 3.025 -9.559 1.00 0.00 H new ATOM 0 HG SER A 136 8.285 4.668 -11.145 1.00 0.00 H new ATOM 479 N PHE A 137 6.325 3.474 -7.146 1.00 0.00 N ATOM 480 CA PHE A 137 4.946 3.607 -6.687 1.00 0.00 C ATOM 481 C PHE A 137 4.911 4.153 -5.267 1.00 0.00 C ATOM 482 O PHE A 137 4.108 5.040 -4.946 1.00 0.00 O ATOM 483 CB PHE A 137 4.220 2.259 -6.739 1.00 0.00 C ATOM 484 CG PHE A 137 3.969 1.755 -8.129 1.00 0.00 C ATOM 485 CD1 PHE A 137 4.965 1.105 -8.835 1.00 0.00 C ATOM 486 CD2 PHE A 137 2.733 1.931 -8.728 1.00 0.00 C ATOM 487 CE1 PHE A 137 4.736 0.640 -10.114 1.00 0.00 C ATOM 488 CE2 PHE A 137 2.496 1.469 -10.008 1.00 0.00 C ATOM 489 CZ PHE A 137 3.499 0.823 -10.702 1.00 0.00 C ATOM 0 H PHE A 137 6.660 2.512 -7.196 1.00 0.00 H new ATOM 0 HA PHE A 137 4.436 4.304 -7.352 1.00 0.00 H new ATOM 0 HB2 PHE A 137 4.809 1.520 -6.196 1.00 0.00 H new ATOM 0 HB3 PHE A 137 3.266 2.351 -6.219 1.00 0.00 H new ATOM 0 HD1 PHE A 137 5.934 0.960 -8.380 1.00 0.00 H new ATOM 0 HD2 PHE A 137 1.945 2.435 -8.188 1.00 0.00 H new ATOM 0 HE1 PHE A 137 5.522 0.134 -10.654 1.00 0.00 H new ATOM 0 HE2 PHE A 137 1.528 1.613 -10.465 1.00 0.00 H new ATOM 0 HZ PHE A 137 3.317 0.461 -11.703 1.00 0.00 H new ATOM 499 N PHE A 138 5.798 3.636 -4.421 1.00 0.00 N ATOM 500 CA PHE A 138 5.880 4.111 -3.045 1.00 0.00 C ATOM 501 C PHE A 138 6.192 5.604 -3.042 1.00 0.00 C ATOM 502 O PHE A 138 5.514 6.397 -2.400 1.00 0.00 O ATOM 503 CB PHE A 138 6.948 3.347 -2.256 1.00 0.00 C ATOM 504 CG PHE A 138 6.579 1.923 -1.938 1.00 0.00 C ATOM 505 CD1 PHE A 138 7.126 0.873 -2.659 1.00 0.00 C ATOM 506 CD2 PHE A 138 5.685 1.630 -0.916 1.00 0.00 C ATOM 507 CE1 PHE A 138 6.790 -0.432 -2.371 1.00 0.00 C ATOM 508 CE2 PHE A 138 5.350 0.325 -0.628 1.00 0.00 C ATOM 509 CZ PHE A 138 5.903 -0.707 -1.357 1.00 0.00 C ATOM 0 H PHE A 138 6.461 2.899 -4.660 1.00 0.00 H new ATOM 0 HA PHE A 138 4.920 3.936 -2.560 1.00 0.00 H new ATOM 0 HB2 PHE A 138 7.877 3.351 -2.826 1.00 0.00 H new ATOM 0 HB3 PHE A 138 7.143 3.877 -1.324 1.00 0.00 H new ATOM 0 HD1 PHE A 138 7.824 1.080 -3.456 1.00 0.00 H new ATOM 0 HD2 PHE A 138 5.248 2.433 -0.341 1.00 0.00 H new ATOM 0 HE1 PHE A 138 7.224 -1.239 -2.942 1.00 0.00 H new ATOM 0 HE2 PHE A 138 4.654 0.110 0.169 1.00 0.00 H new ATOM 0 HZ PHE A 138 5.640 -1.730 -1.132 1.00 0.00 H new ATOM 519 N GLN A 139 7.205 5.976 -3.807 1.00 0.00 N ATOM 520 CA GLN A 139 7.615 7.364 -3.935 1.00 0.00 C ATOM 521 C GLN A 139 6.543 8.197 -4.635 1.00 0.00 C ATOM 522 O GLN A 139 6.420 9.397 -4.388 1.00 0.00 O ATOM 523 CB GLN A 139 8.934 7.434 -4.700 1.00 0.00 C ATOM 524 CG GLN A 139 10.120 6.915 -3.901 1.00 0.00 C ATOM 525 CD GLN A 139 11.393 6.832 -4.719 1.00 0.00 C ATOM 526 OE1 GLN A 139 12.245 5.880 -4.382 1.00 0.00 O flip ATOM 527 NE2 GLN A 139 11.606 7.608 -5.651 1.00 0.00 N flip ATOM 0 H GLN A 139 7.766 5.325 -4.356 1.00 0.00 H new ATOM 0 HA GLN A 139 7.752 7.781 -2.937 1.00 0.00 H new ATOM 0 HB2 GLN A 139 8.844 6.857 -5.620 1.00 0.00 H new ATOM 0 HB3 GLN A 139 9.124 8.468 -4.990 1.00 0.00 H new ATOM 0 HG2 GLN A 139 10.287 7.567 -3.044 1.00 0.00 H new ATOM 0 HG3 GLN A 139 9.882 5.927 -3.508 1.00 0.00 H new ATOM 0 HE21 GLN A 139 10.923 8.330 -5.880 1.00 0.00 H new ATOM 0 HE22 GLN A 139 12.466 7.529 -6.194 1.00 0.00 H new ATOM 536 N ALA A 140 5.767 7.556 -5.504 1.00 0.00 N ATOM 537 CA ALA A 140 4.648 8.221 -6.165 1.00 0.00 C ATOM 538 C ALA A 140 3.626 8.675 -5.134 1.00 0.00 C ATOM 539 O ALA A 140 3.067 9.769 -5.234 1.00 0.00 O ATOM 540 CB ALA A 140 3.994 7.303 -7.191 1.00 0.00 C ATOM 0 H ALA A 140 5.892 6.578 -5.767 1.00 0.00 H new ATOM 0 HA ALA A 140 5.033 9.095 -6.691 1.00 0.00 H new ATOM 0 HB1 ALA A 140 3.164 7.824 -7.668 1.00 0.00 H new ATOM 0 HB2 ALA A 140 4.727 7.021 -7.946 1.00 0.00 H new ATOM 0 HB3 ALA A 140 3.623 6.407 -6.693 1.00 0.00 H new ATOM 546 N LEU A 141 3.396 7.834 -4.131 1.00 0.00 N ATOM 547 CA LEU A 141 2.504 8.192 -3.035 1.00 0.00 C ATOM 548 C LEU A 141 3.277 8.842 -1.883 1.00 0.00 C ATOM 549 O LEU A 141 2.833 8.826 -0.734 1.00 0.00 O ATOM 550 CB LEU A 141 1.714 6.972 -2.540 1.00 0.00 C ATOM 551 CG LEU A 141 0.508 6.570 -3.400 1.00 0.00 C ATOM 552 CD1 LEU A 141 -0.450 7.740 -3.549 1.00 0.00 C ATOM 553 CD2 LEU A 141 0.942 6.067 -4.767 1.00 0.00 C ATOM 0 H LEU A 141 3.812 6.906 -4.055 1.00 0.00 H new ATOM 0 HA LEU A 141 1.791 8.922 -3.417 1.00 0.00 H new ATOM 0 HB2 LEU A 141 2.393 6.122 -2.479 1.00 0.00 H new ATOM 0 HB3 LEU A 141 1.364 7.174 -1.528 1.00 0.00 H new ATOM 0 HG LEU A 141 -0.005 5.754 -2.891 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -1.300 7.439 -4.161 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -0.803 8.049 -2.565 1.00 0.00 H new ATOM 0 HD13 LEU A 141 0.065 8.573 -4.027 1.00 0.00 H new ATOM 0 HD21 LEU A 141 0.063 5.791 -5.349 1.00 0.00 H new ATOM 0 HD22 LEU A 141 1.490 6.853 -5.287 1.00 0.00 H new ATOM 0 HD23 LEU A 141 1.585 5.195 -4.647 1.00 0.00 H new ATOM 565 N SER A 142 4.439 9.410 -2.219 1.00 0.00 N ATOM 566 CA SER A 142 5.255 10.173 -1.275 1.00 0.00 C ATOM 567 C SER A 142 5.662 9.336 -0.064 1.00 0.00 C ATOM 568 O SER A 142 5.503 9.757 1.080 1.00 0.00 O ATOM 569 CB SER A 142 4.500 11.425 -0.827 1.00 0.00 C ATOM 570 OG SER A 142 4.138 12.218 -1.949 1.00 0.00 O ATOM 0 H SER A 142 4.839 9.352 -3.155 1.00 0.00 H new ATOM 0 HA SER A 142 6.171 10.466 -1.789 1.00 0.00 H new ATOM 0 HB2 SER A 142 3.606 11.139 -0.273 1.00 0.00 H new ATOM 0 HB3 SER A 142 5.122 12.008 -0.148 1.00 0.00 H new ATOM 0 HG SER A 142 3.654 13.014 -1.645 1.00 0.00 H new ATOM 576 N ILE A 143 6.200 8.158 -0.319 1.00 0.00 N ATOM 577 CA ILE A 143 6.602 7.262 0.752 1.00 0.00 C ATOM 578 C ILE A 143 8.119 7.224 0.914 1.00 0.00 C ATOM 579 O ILE A 143 8.850 7.119 -0.073 1.00 0.00 O ATOM 580 CB ILE A 143 6.060 5.848 0.496 1.00 0.00 C ATOM 581 CG1 ILE A 143 4.538 5.890 0.587 1.00 0.00 C ATOM 582 CG2 ILE A 143 6.649 4.838 1.472 1.00 0.00 C ATOM 583 CD1 ILE A 143 3.886 4.543 0.478 1.00 0.00 C ATOM 0 H ILE A 143 6.369 7.798 -1.258 1.00 0.00 H new ATOM 0 HA ILE A 143 6.178 7.645 1.680 1.00 0.00 H new ATOM 0 HB ILE A 143 6.357 5.520 -0.500 1.00 0.00 H new ATOM 0 HG12 ILE A 143 4.253 6.345 1.535 1.00 0.00 H new ATOM 0 HG13 ILE A 143 4.154 6.534 -0.204 1.00 0.00 H new ATOM 0 HG21 ILE A 143 6.243 3.849 1.261 1.00 0.00 H new ATOM 0 HG22 ILE A 143 7.733 4.816 1.363 1.00 0.00 H new ATOM 0 HG23 ILE A 143 6.393 5.125 2.492 1.00 0.00 H new ATOM 0 HD11 ILE A 143 2.804 4.655 0.552 1.00 0.00 H new ATOM 0 HD12 ILE A 143 4.140 4.093 -0.482 1.00 0.00 H new ATOM 0 HD13 ILE A 143 4.240 3.901 1.285 1.00 0.00 H new ATOM 595 N PRO A 144 8.611 7.331 2.166 1.00 0.00 N ATOM 596 CA PRO A 144 10.036 7.205 2.476 1.00 0.00 C ATOM 597 C PRO A 144 10.495 5.758 2.339 1.00 0.00 C ATOM 598 O PRO A 144 9.999 4.870 3.041 1.00 0.00 O ATOM 599 CB PRO A 144 10.148 7.669 3.936 1.00 0.00 C ATOM 600 CG PRO A 144 8.808 8.217 4.302 1.00 0.00 C ATOM 601 CD PRO A 144 7.818 7.572 3.378 1.00 0.00 C ATOM 0 HA PRO A 144 10.660 7.789 1.800 1.00 0.00 H new ATOM 0 HB2 PRO A 144 10.421 6.840 4.588 1.00 0.00 H new ATOM 0 HB3 PRO A 144 10.922 8.428 4.045 1.00 0.00 H new ATOM 0 HG2 PRO A 144 8.569 7.996 5.342 1.00 0.00 H new ATOM 0 HG3 PRO A 144 8.790 9.302 4.195 1.00 0.00 H new ATOM 0 HD2 PRO A 144 7.422 6.645 3.793 1.00 0.00 H new ATOM 0 HD3 PRO A 144 6.966 8.222 3.181 1.00 0.00 H new ATOM 609 N THR A 145 11.439 5.519 1.443 1.00 0.00 N ATOM 610 CA THR A 145 11.797 4.160 1.073 1.00 0.00 C ATOM 611 C THR A 145 13.294 3.899 1.192 1.00 0.00 C ATOM 612 O THR A 145 14.113 4.800 1.011 1.00 0.00 O ATOM 613 CB THR A 145 11.350 3.867 -0.370 1.00 0.00 C ATOM 614 OG1 THR A 145 11.863 4.877 -1.252 1.00 0.00 O ATOM 615 CG2 THR A 145 9.836 3.830 -0.469 1.00 0.00 C ATOM 0 H THR A 145 11.969 6.245 0.961 1.00 0.00 H new ATOM 0 HA THR A 145 11.283 3.499 1.771 1.00 0.00 H new ATOM 0 HB THR A 145 11.742 2.892 -0.659 1.00 0.00 H new ATOM 0 HG1 THR A 145 11.845 4.546 -2.174 1.00 0.00 H new ATOM 0 HG21 THR A 145 9.544 3.621 -1.498 1.00 0.00 H new ATOM 0 HG22 THR A 145 9.448 3.048 0.184 1.00 0.00 H new ATOM 0 HG23 THR A 145 9.428 4.794 -0.164 1.00 0.00 H new ATOM 623 N LYS A 146 13.634 2.657 1.506 1.00 0.00 N ATOM 624 CA LYS A 146 15.016 2.208 1.554 1.00 0.00 C ATOM 625 C LYS A 146 15.090 0.730 1.194 1.00 0.00 C ATOM 626 O LYS A 146 14.226 -0.053 1.581 1.00 0.00 O ATOM 627 CB LYS A 146 15.612 2.463 2.940 1.00 0.00 C ATOM 628 CG LYS A 146 16.421 3.749 3.012 1.00 0.00 C ATOM 629 CD LYS A 146 16.552 4.277 4.436 1.00 0.00 C ATOM 630 CE LYS A 146 17.013 3.207 5.414 1.00 0.00 C ATOM 631 NZ LYS A 146 18.428 2.806 5.189 1.00 0.00 N ATOM 0 H LYS A 146 12.956 1.931 1.735 1.00 0.00 H new ATOM 0 HA LYS A 146 15.601 2.773 0.828 1.00 0.00 H new ATOM 0 HB2 LYS A 146 14.807 2.505 3.673 1.00 0.00 H new ATOM 0 HB3 LYS A 146 16.250 1.623 3.215 1.00 0.00 H new ATOM 0 HG2 LYS A 146 17.415 3.573 2.600 1.00 0.00 H new ATOM 0 HG3 LYS A 146 15.948 4.508 2.389 1.00 0.00 H new ATOM 0 HD2 LYS A 146 17.260 5.106 4.449 1.00 0.00 H new ATOM 0 HD3 LYS A 146 15.591 4.674 4.763 1.00 0.00 H new ATOM 0 HE2 LYS A 146 16.901 3.577 6.433 1.00 0.00 H new ATOM 0 HE3 LYS A 146 16.371 2.331 5.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 18.696 2.075 5.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 18.533 2.428 4.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 19.046 3.634 5.304 1.00 0.00 H new ATOM 645 N ILE A 147 16.102 0.359 0.428 1.00 0.00 N ATOM 646 CA ILE A 147 16.241 -1.011 -0.047 1.00 0.00 C ATOM 647 C ILE A 147 16.867 -1.895 1.028 1.00 0.00 C ATOM 648 O ILE A 147 17.976 -1.635 1.499 1.00 0.00 O ATOM 649 CB ILE A 147 17.100 -1.068 -1.332 1.00 0.00 C ATOM 650 CG1 ILE A 147 16.495 -0.171 -2.419 1.00 0.00 C ATOM 651 CG2 ILE A 147 17.232 -2.500 -1.838 1.00 0.00 C ATOM 652 CD1 ILE A 147 15.063 -0.514 -2.779 1.00 0.00 C ATOM 0 H ILE A 147 16.843 0.989 0.120 1.00 0.00 H new ATOM 0 HA ILE A 147 15.242 -1.383 -0.276 1.00 0.00 H new ATOM 0 HB ILE A 147 18.097 -0.701 -1.090 1.00 0.00 H new ATOM 0 HG12 ILE A 147 16.536 0.865 -2.084 1.00 0.00 H new ATOM 0 HG13 ILE A 147 17.110 -0.240 -3.316 1.00 0.00 H new ATOM 0 HG21 ILE A 147 17.841 -2.512 -2.742 1.00 0.00 H new ATOM 0 HG22 ILE A 147 17.707 -3.114 -1.073 1.00 0.00 H new ATOM 0 HG23 ILE A 147 16.243 -2.900 -2.061 1.00 0.00 H new ATOM 0 HD11 ILE A 147 14.710 0.166 -3.554 1.00 0.00 H new ATOM 0 HD12 ILE A 147 15.016 -1.539 -3.147 1.00 0.00 H new ATOM 0 HD13 ILE A 147 14.432 -0.416 -1.895 1.00 0.00 H new ATOM 664 N SER A 148 16.140 -2.942 1.404 1.00 0.00 N ATOM 665 CA SER A 148 16.584 -3.855 2.444 1.00 0.00 C ATOM 666 C SER A 148 17.654 -4.799 1.897 1.00 0.00 C ATOM 667 O SER A 148 18.810 -4.739 2.311 1.00 0.00 O ATOM 668 CB SER A 148 15.389 -4.641 2.996 1.00 0.00 C ATOM 669 OG SER A 148 15.736 -5.365 4.162 1.00 0.00 O ATOM 0 H SER A 148 15.234 -3.178 0.999 1.00 0.00 H new ATOM 0 HA SER A 148 17.024 -3.281 3.260 1.00 0.00 H new ATOM 0 HB2 SER A 148 14.574 -3.954 3.223 1.00 0.00 H new ATOM 0 HB3 SER A 148 15.023 -5.330 2.235 1.00 0.00 H new ATOM 0 HG SER A 148 14.952 -5.853 4.489 1.00 0.00 H new ATOM 675 N LYS A 149 17.265 -5.663 0.962 1.00 0.00 N ATOM 676 CA LYS A 149 18.211 -6.542 0.279 1.00 0.00 C ATOM 677 C LYS A 149 17.628 -7.013 -1.052 1.00 0.00 C ATOM 678 O LYS A 149 17.080 -8.109 -1.161 1.00 0.00 O ATOM 679 CB LYS A 149 18.597 -7.735 1.165 1.00 0.00 C ATOM 680 CG LYS A 149 17.412 -8.477 1.751 1.00 0.00 C ATOM 681 CD LYS A 149 17.857 -9.717 2.511 1.00 0.00 C ATOM 682 CE LYS A 149 16.673 -10.481 3.084 1.00 0.00 C ATOM 683 NZ LYS A 149 15.724 -10.921 2.028 1.00 0.00 N ATOM 0 H LYS A 149 16.297 -5.773 0.659 1.00 0.00 H new ATOM 0 HA LYS A 149 19.121 -5.976 0.076 1.00 0.00 H new ATOM 0 HB2 LYS A 149 19.195 -8.432 0.578 1.00 0.00 H new ATOM 0 HB3 LYS A 149 19.229 -7.380 1.979 1.00 0.00 H new ATOM 0 HG2 LYS A 149 16.861 -7.816 2.420 1.00 0.00 H new ATOM 0 HG3 LYS A 149 16.728 -8.764 0.952 1.00 0.00 H new ATOM 0 HD2 LYS A 149 18.423 -10.369 1.845 1.00 0.00 H new ATOM 0 HD3 LYS A 149 18.529 -9.427 3.319 1.00 0.00 H new ATOM 0 HE2 LYS A 149 17.035 -11.352 3.630 1.00 0.00 H new ATOM 0 HE3 LYS A 149 16.148 -9.850 3.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 15.060 -11.616 2.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 15.194 -10.099 1.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 16.253 -11.356 1.245 1.00 0.00 H new ATOM 697 N GLY A 150 17.746 -6.162 -2.065 1.00 0.00 N ATOM 698 CA GLY A 150 17.110 -6.435 -3.343 1.00 0.00 C ATOM 699 C GLY A 150 15.606 -6.334 -3.238 1.00 0.00 C ATOM 700 O GLY A 150 14.869 -6.824 -4.094 1.00 0.00 O ATOM 0 H GLY A 150 18.270 -5.288 -2.025 1.00 0.00 H new ATOM 0 HA2 GLY A 150 17.473 -5.730 -4.091 1.00 0.00 H new ATOM 0 HA3 GLY A 150 17.387 -7.432 -3.684 1.00 0.00 H new ATOM 704 N THR A 151 15.163 -5.693 -2.173 1.00 0.00 N ATOM 705 CA THR A 151 13.754 -5.510 -1.894 1.00 0.00 C ATOM 706 C THR A 151 13.523 -4.107 -1.371 1.00 0.00 C ATOM 707 O THR A 151 14.403 -3.525 -0.734 1.00 0.00 O ATOM 708 CB THR A 151 13.272 -6.522 -0.837 1.00 0.00 C ATOM 709 OG1 THR A 151 14.197 -6.545 0.262 1.00 0.00 O ATOM 710 CG2 THR A 151 13.135 -7.918 -1.427 1.00 0.00 C ATOM 0 H THR A 151 15.778 -5.281 -1.471 1.00 0.00 H new ATOM 0 HA THR A 151 13.195 -5.667 -2.817 1.00 0.00 H new ATOM 0 HB THR A 151 12.289 -6.208 -0.487 1.00 0.00 H new ATOM 0 HG1 THR A 151 13.889 -7.187 0.935 1.00 0.00 H new ATOM 0 HG21 THR A 151 12.793 -8.607 -0.655 1.00 0.00 H new ATOM 0 HG22 THR A 151 12.412 -7.899 -2.242 1.00 0.00 H new ATOM 0 HG23 THR A 151 14.102 -8.249 -1.807 1.00 0.00 H new ATOM 718 N ILE A 152 12.355 -3.558 -1.631 1.00 0.00 N ATOM 719 CA ILE A 152 12.040 -2.232 -1.156 1.00 0.00 C ATOM 720 C ILE A 152 11.377 -2.323 0.218 1.00 0.00 C ATOM 721 O ILE A 152 10.400 -3.054 0.413 1.00 0.00 O ATOM 722 CB ILE A 152 11.166 -1.461 -2.188 1.00 0.00 C ATOM 723 CG1 ILE A 152 10.945 0.001 -1.767 1.00 0.00 C ATOM 724 CG2 ILE A 152 9.842 -2.163 -2.441 1.00 0.00 C ATOM 725 CD1 ILE A 152 9.918 0.207 -0.671 1.00 0.00 C ATOM 0 H ILE A 152 11.613 -4.009 -2.166 1.00 0.00 H new ATOM 0 HA ILE A 152 12.961 -1.660 -1.046 1.00 0.00 H new ATOM 0 HB ILE A 152 11.719 -1.453 -3.127 1.00 0.00 H new ATOM 0 HG12 ILE A 152 11.897 0.415 -1.434 1.00 0.00 H new ATOM 0 HG13 ILE A 152 10.638 0.573 -2.643 1.00 0.00 H new ATOM 0 HG21 ILE A 152 9.261 -1.594 -3.167 1.00 0.00 H new ATOM 0 HG22 ILE A 152 10.029 -3.164 -2.831 1.00 0.00 H new ATOM 0 HG23 ILE A 152 9.285 -2.236 -1.507 1.00 0.00 H new ATOM 0 HD11 ILE A 152 9.835 1.270 -0.446 1.00 0.00 H new ATOM 0 HD12 ILE A 152 8.951 -0.170 -1.003 1.00 0.00 H new ATOM 0 HD13 ILE A 152 10.229 -0.331 0.225 1.00 0.00 H new ATOM 737 N GLU A 153 11.946 -1.607 1.177 1.00 0.00 N ATOM 738 CA GLU A 153 11.434 -1.599 2.533 1.00 0.00 C ATOM 739 C GLU A 153 10.940 -0.216 2.922 1.00 0.00 C ATOM 740 O GLU A 153 11.445 0.809 2.453 1.00 0.00 O ATOM 741 CB GLU A 153 12.506 -2.082 3.515 1.00 0.00 C ATOM 742 CG GLU A 153 12.176 -1.814 4.977 1.00 0.00 C ATOM 743 CD GLU A 153 13.089 -2.548 5.932 1.00 0.00 C ATOM 744 OE1 GLU A 153 12.641 -3.545 6.536 1.00 0.00 O ATOM 745 OE2 GLU A 153 14.253 -2.135 6.083 1.00 0.00 O ATOM 0 H GLU A 153 12.769 -1.021 1.036 1.00 0.00 H new ATOM 0 HA GLU A 153 10.588 -2.284 2.578 1.00 0.00 H new ATOM 0 HB2 GLU A 153 12.653 -3.153 3.377 1.00 0.00 H new ATOM 0 HB3 GLU A 153 13.451 -1.596 3.272 1.00 0.00 H new ATOM 0 HG2 GLU A 153 12.244 -0.743 5.169 1.00 0.00 H new ATOM 0 HG3 GLU A 153 11.144 -2.108 5.171 1.00 0.00 H new ATOM 752 N ILE A 154 9.939 -0.214 3.775 1.00 0.00 N ATOM 753 CA ILE A 154 9.349 1.005 4.291 1.00 0.00 C ATOM 754 C ILE A 154 10.039 1.381 5.594 1.00 0.00 C ATOM 755 O ILE A 154 10.236 0.533 6.460 1.00 0.00 O ATOM 756 CB ILE A 154 7.841 0.808 4.535 1.00 0.00 C ATOM 757 CG1 ILE A 154 7.176 0.238 3.282 1.00 0.00 C ATOM 758 CG2 ILE A 154 7.178 2.114 4.949 1.00 0.00 C ATOM 759 CD1 ILE A 154 7.327 1.112 2.057 1.00 0.00 C ATOM 0 H ILE A 154 9.507 -1.065 4.134 1.00 0.00 H new ATOM 0 HA ILE A 154 9.480 1.804 3.562 1.00 0.00 H new ATOM 0 HB ILE A 154 7.715 0.098 5.353 1.00 0.00 H new ATOM 0 HG12 ILE A 154 7.602 -0.743 3.071 1.00 0.00 H new ATOM 0 HG13 ILE A 154 6.115 0.089 3.481 1.00 0.00 H new ATOM 0 HG21 ILE A 154 6.114 1.945 5.115 1.00 0.00 H new ATOM 0 HG22 ILE A 154 7.635 2.478 5.869 1.00 0.00 H new ATOM 0 HG23 ILE A 154 7.309 2.855 4.160 1.00 0.00 H new ATOM 0 HD11 ILE A 154 6.829 0.640 1.210 1.00 0.00 H new ATOM 0 HD12 ILE A 154 6.876 2.086 2.247 1.00 0.00 H new ATOM 0 HD13 ILE A 154 8.385 1.241 1.830 1.00 0.00 H new ATOM 771 N ILE A 155 10.428 2.637 5.726 1.00 0.00 N ATOM 772 CA ILE A 155 11.174 3.067 6.895 1.00 0.00 C ATOM 773 C ILE A 155 10.267 3.711 7.940 1.00 0.00 C ATOM 774 O ILE A 155 10.461 3.531 9.141 1.00 0.00 O ATOM 775 CB ILE A 155 12.305 4.025 6.500 1.00 0.00 C ATOM 776 CG1 ILE A 155 11.758 5.318 5.913 1.00 0.00 C ATOM 777 CG2 ILE A 155 13.213 3.348 5.494 1.00 0.00 C ATOM 778 CD1 ILE A 155 12.837 6.308 5.554 1.00 0.00 C ATOM 0 H ILE A 155 10.241 3.372 5.044 1.00 0.00 H new ATOM 0 HA ILE A 155 11.614 2.176 7.344 1.00 0.00 H new ATOM 0 HB ILE A 155 12.869 4.276 7.398 1.00 0.00 H new ATOM 0 HG12 ILE A 155 11.174 5.087 5.022 1.00 0.00 H new ATOM 0 HG13 ILE A 155 11.077 5.776 6.630 1.00 0.00 H new ATOM 0 HG21 ILE A 155 14.017 4.029 5.213 1.00 0.00 H new ATOM 0 HG22 ILE A 155 13.638 2.447 5.936 1.00 0.00 H new ATOM 0 HG23 ILE A 155 12.638 3.080 4.607 1.00 0.00 H new ATOM 0 HD11 ILE A 155 12.382 7.208 5.141 1.00 0.00 H new ATOM 0 HD12 ILE A 155 13.406 6.566 6.447 1.00 0.00 H new ATOM 0 HD13 ILE A 155 13.504 5.866 4.814 1.00 0.00 H new ATOM 790 N ASN A 156 9.279 4.461 7.478 1.00 0.00 N ATOM 791 CA ASN A 156 8.282 5.060 8.362 1.00 0.00 C ATOM 792 C ASN A 156 6.899 4.552 7.992 1.00 0.00 C ATOM 793 O ASN A 156 6.512 4.622 6.828 1.00 0.00 O ATOM 794 CB ASN A 156 8.303 6.592 8.264 1.00 0.00 C ATOM 795 CG ASN A 156 9.602 7.210 8.744 1.00 0.00 C ATOM 796 OD1 ASN A 156 10.526 7.428 7.961 1.00 0.00 O ATOM 797 ND2 ASN A 156 9.679 7.516 10.029 1.00 0.00 N ATOM 0 H ASN A 156 9.143 4.673 6.490 1.00 0.00 H new ATOM 0 HA ASN A 156 8.523 4.775 9.386 1.00 0.00 H new ATOM 0 HB2 ASN A 156 8.131 6.884 7.228 1.00 0.00 H new ATOM 0 HB3 ASN A 156 7.478 6.997 8.850 1.00 0.00 H new ATOM 0 HD21 ASN A 156 10.525 7.948 10.401 1.00 0.00 H new ATOM 0 HD22 ASN A 156 8.892 7.320 10.648 1.00 0.00 H new ATOM 804 N ASP A 157 6.163 4.040 8.980 1.00 0.00 N ATOM 805 CA ASP A 157 4.809 3.526 8.754 1.00 0.00 C ATOM 806 C ASP A 157 3.954 4.585 8.073 1.00 0.00 C ATOM 807 O ASP A 157 3.713 5.656 8.635 1.00 0.00 O ATOM 808 CB ASP A 157 4.147 3.106 10.070 1.00 0.00 C ATOM 809 CG ASP A 157 4.882 1.986 10.782 1.00 0.00 C ATOM 810 OD1 ASP A 157 5.514 2.257 11.831 1.00 0.00 O ATOM 811 OD2 ASP A 157 4.827 0.833 10.311 1.00 0.00 O ATOM 0 H ASP A 157 6.482 3.970 9.946 1.00 0.00 H new ATOM 0 HA ASP A 157 4.889 2.649 8.112 1.00 0.00 H new ATOM 0 HB2 ASP A 157 4.089 3.971 10.731 1.00 0.00 H new ATOM 0 HB3 ASP A 157 3.124 2.789 9.869 1.00 0.00 H new ATOM 816 N VAL A 158 3.509 4.291 6.865 1.00 0.00 N ATOM 817 CA VAL A 158 2.828 5.281 6.041 1.00 0.00 C ATOM 818 C VAL A 158 1.331 5.304 6.296 1.00 0.00 C ATOM 819 O VAL A 158 0.669 4.269 6.260 1.00 0.00 O ATOM 820 CB VAL A 158 3.051 5.017 4.541 1.00 0.00 C ATOM 821 CG1 VAL A 158 2.499 6.164 3.707 1.00 0.00 C ATOM 822 CG2 VAL A 158 4.524 4.789 4.248 1.00 0.00 C ATOM 0 H VAL A 158 3.606 3.374 6.429 1.00 0.00 H new ATOM 0 HA VAL A 158 3.258 6.243 6.319 1.00 0.00 H new ATOM 0 HB VAL A 158 2.511 4.111 4.268 1.00 0.00 H new ATOM 0 HG11 VAL A 158 2.666 5.959 2.650 1.00 0.00 H new ATOM 0 HG12 VAL A 158 1.430 6.267 3.892 1.00 0.00 H new ATOM 0 HG13 VAL A 158 3.005 7.090 3.981 1.00 0.00 H new ATOM 0 HG21 VAL A 158 4.659 4.604 3.182 1.00 0.00 H new ATOM 0 HG22 VAL A 158 5.094 5.672 4.538 1.00 0.00 H new ATOM 0 HG23 VAL A 158 4.878 3.927 4.813 1.00 0.00 H new ATOM 832 N HIS A 159 0.799 6.493 6.533 1.00 0.00 N ATOM 833 CA HIS A 159 -0.641 6.683 6.610 1.00 0.00 C ATOM 834 C HIS A 159 -1.183 6.848 5.199 1.00 0.00 C ATOM 835 O HIS A 159 -1.541 7.946 4.787 1.00 0.00 O ATOM 836 CB HIS A 159 -0.987 7.915 7.454 1.00 0.00 C ATOM 837 CG HIS A 159 -0.460 7.856 8.855 1.00 0.00 C ATOM 838 ND1 HIS A 159 0.608 8.609 9.287 1.00 0.00 N ATOM 839 CD2 HIS A 159 -0.863 7.131 9.923 1.00 0.00 C ATOM 840 CE1 HIS A 159 0.844 8.347 10.556 1.00 0.00 C ATOM 841 NE2 HIS A 159 -0.035 7.455 10.969 1.00 0.00 N ATOM 0 H HIS A 159 1.345 7.343 6.676 1.00 0.00 H new ATOM 0 HA HIS A 159 -1.094 5.815 7.088 1.00 0.00 H new ATOM 0 HB2 HIS A 159 -0.589 8.803 6.963 1.00 0.00 H new ATOM 0 HB3 HIS A 159 -2.071 8.028 7.488 1.00 0.00 H new ATOM 0 HD2 HIS A 159 -1.683 6.428 9.948 1.00 0.00 H new ATOM 0 HE1 HIS A 159 1.625 8.788 11.157 1.00 0.00 H new ATOM 0 HE2 HIS A 159 -0.091 7.069 11.911 1.00 0.00 H new ATOM 850 N ILE A 160 -1.219 5.750 4.460 1.00 0.00 N ATOM 851 CA ILE A 160 -1.543 5.796 3.043 1.00 0.00 C ATOM 852 C ILE A 160 -2.996 6.227 2.810 1.00 0.00 C ATOM 853 O ILE A 160 -3.244 7.208 2.111 1.00 0.00 O ATOM 854 CB ILE A 160 -1.238 4.443 2.347 1.00 0.00 C ATOM 855 CG1 ILE A 160 -1.609 4.491 0.862 1.00 0.00 C ATOM 856 CG2 ILE A 160 -1.943 3.290 3.038 1.00 0.00 C ATOM 857 CD1 ILE A 160 -0.734 5.419 0.048 1.00 0.00 C ATOM 0 H ILE A 160 -1.027 4.815 4.819 1.00 0.00 H new ATOM 0 HA ILE A 160 -0.902 6.552 2.589 1.00 0.00 H new ATOM 0 HB ILE A 160 -0.164 4.272 2.425 1.00 0.00 H new ATOM 0 HG12 ILE A 160 -1.542 3.485 0.447 1.00 0.00 H new ATOM 0 HG13 ILE A 160 -2.648 4.807 0.766 1.00 0.00 H new ATOM 0 HG21 ILE A 160 -1.707 2.358 2.524 1.00 0.00 H new ATOM 0 HG22 ILE A 160 -1.609 3.228 4.074 1.00 0.00 H new ATOM 0 HG23 ILE A 160 -3.020 3.455 3.013 1.00 0.00 H new ATOM 0 HD11 ILE A 160 -1.055 5.402 -0.993 1.00 0.00 H new ATOM 0 HD12 ILE A 160 -0.819 6.434 0.437 1.00 0.00 H new ATOM 0 HD13 ILE A 160 0.303 5.091 0.113 1.00 0.00 H new ATOM 869 N LEU A 161 -3.951 5.535 3.422 1.00 0.00 N ATOM 870 CA LEU A 161 -5.355 5.886 3.245 1.00 0.00 C ATOM 871 C LEU A 161 -5.922 6.514 4.501 1.00 0.00 C ATOM 872 O LEU A 161 -5.475 6.235 5.615 1.00 0.00 O ATOM 873 CB LEU A 161 -6.209 4.676 2.858 1.00 0.00 C ATOM 874 CG LEU A 161 -6.008 4.138 1.442 1.00 0.00 C ATOM 875 CD1 LEU A 161 -7.124 3.173 1.084 1.00 0.00 C ATOM 876 CD2 LEU A 161 -5.945 5.276 0.431 1.00 0.00 C ATOM 0 H LEU A 161 -3.782 4.739 4.037 1.00 0.00 H new ATOM 0 HA LEU A 161 -5.391 6.607 2.429 1.00 0.00 H new ATOM 0 HB2 LEU A 161 -6.003 3.871 3.564 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -7.259 4.944 2.978 1.00 0.00 H new ATOM 0 HG LEU A 161 -5.058 3.605 1.411 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -6.969 2.797 0.073 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -7.123 2.339 1.786 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -8.082 3.690 1.136 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -5.801 4.867 -0.569 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -6.876 5.842 0.461 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -5.112 5.935 0.676 1.00 0.00 H new ATOM 888 N LYS A 162 -6.915 7.361 4.301 1.00 0.00 N ATOM 889 CA LYS A 162 -7.586 8.048 5.393 1.00 0.00 C ATOM 890 C LYS A 162 -9.089 7.887 5.231 1.00 0.00 C ATOM 891 O LYS A 162 -9.608 8.046 4.127 1.00 0.00 O ATOM 892 CB LYS A 162 -7.238 9.546 5.414 1.00 0.00 C ATOM 893 CG LYS A 162 -5.752 9.866 5.531 1.00 0.00 C ATOM 894 CD LYS A 162 -5.040 9.753 4.192 1.00 0.00 C ATOM 895 CE LYS A 162 -3.566 10.096 4.311 1.00 0.00 C ATOM 896 NZ LYS A 162 -2.856 9.932 3.015 1.00 0.00 N ATOM 0 H LYS A 162 -7.280 7.593 3.377 1.00 0.00 H new ATOM 0 HA LYS A 162 -7.251 7.608 6.332 1.00 0.00 H new ATOM 0 HB2 LYS A 162 -7.621 10.004 4.502 1.00 0.00 H new ATOM 0 HB3 LYS A 162 -7.761 10.012 6.249 1.00 0.00 H new ATOM 0 HG2 LYS A 162 -5.628 10.875 5.924 1.00 0.00 H new ATOM 0 HG3 LYS A 162 -5.290 9.186 6.247 1.00 0.00 H new ATOM 0 HD2 LYS A 162 -5.148 8.739 3.806 1.00 0.00 H new ATOM 0 HD3 LYS A 162 -5.512 10.420 3.471 1.00 0.00 H new ATOM 0 HE2 LYS A 162 -3.459 11.124 4.657 1.00 0.00 H new ATOM 0 HE3 LYS A 162 -3.103 9.457 5.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 -1.843 10.126 3.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 -2.980 8.958 2.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 -3.248 10.597 2.318 1.00 0.00 H new ATOM 910 N PRO A 163 -9.798 7.533 6.312 1.00 0.00 N ATOM 911 CA PRO A 163 -11.260 7.425 6.308 1.00 0.00 C ATOM 912 C PRO A 163 -11.934 8.677 5.751 1.00 0.00 C ATOM 913 O PRO A 163 -12.020 9.705 6.426 1.00 0.00 O ATOM 914 CB PRO A 163 -11.607 7.249 7.784 1.00 0.00 C ATOM 915 CG PRO A 163 -10.397 6.625 8.382 1.00 0.00 C ATOM 916 CD PRO A 163 -9.223 7.172 7.618 1.00 0.00 C ATOM 0 HA PRO A 163 -11.605 6.609 5.673 1.00 0.00 H new ATOM 0 HB2 PRO A 163 -11.833 8.206 8.255 1.00 0.00 H new ATOM 0 HB3 PRO A 163 -12.484 6.615 7.912 1.00 0.00 H new ATOM 0 HG2 PRO A 163 -10.318 6.866 9.442 1.00 0.00 H new ATOM 0 HG3 PRO A 163 -10.440 5.539 8.304 1.00 0.00 H new ATOM 0 HD2 PRO A 163 -8.788 8.038 8.117 1.00 0.00 H new ATOM 0 HD3 PRO A 163 -8.430 6.431 7.516 1.00 0.00 H new ATOM 924 N GLY A 164 -12.408 8.580 4.519 1.00 0.00 N ATOM 925 CA GLY A 164 -13.048 9.709 3.880 1.00 0.00 C ATOM 926 C GLY A 164 -12.334 10.127 2.611 1.00 0.00 C ATOM 927 O GLY A 164 -12.867 10.906 1.817 1.00 0.00 O ATOM 0 H GLY A 164 -12.360 7.736 3.948 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -14.082 9.454 3.646 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -13.076 10.550 4.573 1.00 0.00 H new ATOM 931 N ASP A 165 -11.127 9.610 2.422 1.00 0.00 N ATOM 932 CA ASP A 165 -10.346 9.898 1.225 1.00 0.00 C ATOM 933 C ASP A 165 -10.812 8.994 0.089 1.00 0.00 C ATOM 934 O ASP A 165 -11.713 8.177 0.274 1.00 0.00 O ATOM 935 CB ASP A 165 -8.852 9.679 1.500 1.00 0.00 C ATOM 936 CG ASP A 165 -7.959 10.491 0.583 1.00 0.00 C ATOM 937 OD1 ASP A 165 -7.544 11.601 0.983 1.00 0.00 O ATOM 938 OD2 ASP A 165 -7.660 10.028 -0.535 1.00 0.00 O ATOM 0 H ASP A 165 -10.666 8.987 3.085 1.00 0.00 H new ATOM 0 HA ASP A 165 -10.494 10.940 0.940 1.00 0.00 H new ATOM 0 HB2 ASP A 165 -8.636 9.942 2.536 1.00 0.00 H new ATOM 0 HB3 ASP A 165 -8.617 8.621 1.384 1.00 0.00 H new ATOM 943 N LYS A 166 -10.204 9.123 -1.073 1.00 0.00 N ATOM 944 CA LYS A 166 -10.597 8.329 -2.224 1.00 0.00 C ATOM 945 C LYS A 166 -9.384 7.647 -2.821 1.00 0.00 C ATOM 946 O LYS A 166 -8.457 8.308 -3.288 1.00 0.00 O ATOM 947 CB LYS A 166 -11.287 9.206 -3.268 1.00 0.00 C ATOM 948 CG LYS A 166 -11.788 8.435 -4.480 1.00 0.00 C ATOM 949 CD LYS A 166 -12.479 9.348 -5.481 1.00 0.00 C ATOM 950 CE LYS A 166 -13.696 10.022 -4.872 1.00 0.00 C ATOM 951 NZ LYS A 166 -14.407 10.875 -5.854 1.00 0.00 N ATOM 0 H LYS A 166 -9.435 9.770 -1.247 1.00 0.00 H new ATOM 0 HA LYS A 166 -11.304 7.565 -1.899 1.00 0.00 H new ATOM 0 HB2 LYS A 166 -12.128 9.718 -2.801 1.00 0.00 H new ATOM 0 HB3 LYS A 166 -10.591 9.976 -3.601 1.00 0.00 H new ATOM 0 HG2 LYS A 166 -10.950 7.933 -4.964 1.00 0.00 H new ATOM 0 HG3 LYS A 166 -12.481 7.659 -4.156 1.00 0.00 H new ATOM 0 HD2 LYS A 166 -11.777 10.106 -5.828 1.00 0.00 H new ATOM 0 HD3 LYS A 166 -12.781 8.770 -6.354 1.00 0.00 H new ATOM 0 HE2 LYS A 166 -14.378 9.262 -4.490 1.00 0.00 H new ATOM 0 HE3 LYS A 166 -13.387 10.629 -4.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 166 -15.231 11.316 -5.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 166 -13.764 11.616 -6.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 166 -14.725 10.292 -6.654 1.00 0.00 H new ATOM 965 N VAL A 167 -9.410 6.322 -2.788 1.00 0.00 N ATOM 966 CA VAL A 167 -8.312 5.499 -3.283 1.00 0.00 C ATOM 967 C VAL A 167 -7.929 5.887 -4.715 1.00 0.00 C ATOM 968 O VAL A 167 -8.770 5.870 -5.621 1.00 0.00 O ATOM 969 CB VAL A 167 -8.698 4.006 -3.242 1.00 0.00 C ATOM 970 CG1 VAL A 167 -7.501 3.127 -3.565 1.00 0.00 C ATOM 971 CG2 VAL A 167 -9.296 3.636 -1.887 1.00 0.00 C ATOM 0 H VAL A 167 -10.194 5.785 -2.417 1.00 0.00 H new ATOM 0 HA VAL A 167 -7.453 5.671 -2.634 1.00 0.00 H new ATOM 0 HB VAL A 167 -9.458 3.833 -4.004 1.00 0.00 H new ATOM 0 HG11 VAL A 167 -7.799 2.079 -3.530 1.00 0.00 H new ATOM 0 HG12 VAL A 167 -7.133 3.366 -4.563 1.00 0.00 H new ATOM 0 HG13 VAL A 167 -6.712 3.305 -2.835 1.00 0.00 H new ATOM 0 HG21 VAL A 167 -9.560 2.579 -1.882 1.00 0.00 H new ATOM 0 HG22 VAL A 167 -8.566 3.831 -1.102 1.00 0.00 H new ATOM 0 HG23 VAL A 167 -10.190 4.234 -1.708 1.00 0.00 H new ATOM 981 N GLY A 168 -6.664 6.253 -4.902 1.00 0.00 N ATOM 982 CA GLY A 168 -6.177 6.688 -6.203 1.00 0.00 C ATOM 983 C GLY A 168 -5.810 5.535 -7.117 1.00 0.00 C ATOM 984 O GLY A 168 -5.931 4.374 -6.736 1.00 0.00 O ATOM 0 H GLY A 168 -5.958 6.256 -4.166 1.00 0.00 H new ATOM 0 HA2 GLY A 168 -6.942 7.297 -6.685 1.00 0.00 H new ATOM 0 HA3 GLY A 168 -5.304 7.325 -6.063 1.00 0.00 H new ATOM 988 N ALA A 169 -5.344 5.858 -8.323 1.00 0.00 N ATOM 989 CA ALA A 169 -5.005 4.846 -9.323 1.00 0.00 C ATOM 990 C ALA A 169 -3.760 4.069 -8.925 1.00 0.00 C ATOM 991 O ALA A 169 -3.840 2.893 -8.559 1.00 0.00 O ATOM 992 CB ALA A 169 -4.814 5.493 -10.686 1.00 0.00 C ATOM 0 H ALA A 169 -5.192 6.818 -8.632 1.00 0.00 H new ATOM 0 HA ALA A 169 -5.834 4.141 -9.380 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -4.562 4.728 -11.420 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -5.736 5.992 -10.984 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -4.007 6.224 -10.632 1.00 0.00 H new ATOM 998 N SER A 170 -2.614 4.731 -8.975 1.00 0.00 N ATOM 999 CA SER A 170 -1.358 4.102 -8.599 1.00 0.00 C ATOM 1000 C SER A 170 -1.344 3.812 -7.105 1.00 0.00 C ATOM 1001 O SER A 170 -0.603 2.953 -6.633 1.00 0.00 O ATOM 1002 CB SER A 170 -0.186 4.997 -8.992 1.00 0.00 C ATOM 1003 OG SER A 170 -0.219 5.276 -10.382 1.00 0.00 O ATOM 0 H SER A 170 -2.528 5.703 -9.272 1.00 0.00 H new ATOM 0 HA SER A 170 -1.259 3.156 -9.131 1.00 0.00 H new ATOM 0 HB2 SER A 170 -0.226 5.928 -8.427 1.00 0.00 H new ATOM 0 HB3 SER A 170 0.754 4.509 -8.735 1.00 0.00 H new ATOM 0 HG SER A 170 0.538 5.852 -10.618 1.00 0.00 H new ATOM 1009 N GLU A 171 -2.187 4.529 -6.376 1.00 0.00 N ATOM 1010 CA GLU A 171 -2.372 4.303 -4.953 1.00 0.00 C ATOM 1011 C GLU A 171 -3.015 2.935 -4.729 1.00 0.00 C ATOM 1012 O GLU A 171 -2.566 2.154 -3.886 1.00 0.00 O ATOM 1013 CB GLU A 171 -3.250 5.412 -4.380 1.00 0.00 C ATOM 1014 CG GLU A 171 -3.205 5.536 -2.871 1.00 0.00 C ATOM 1015 CD GLU A 171 -4.044 6.696 -2.387 1.00 0.00 C ATOM 1016 OE1 GLU A 171 -5.275 6.655 -2.565 1.00 0.00 O ATOM 1017 OE2 GLU A 171 -3.477 7.665 -1.847 1.00 0.00 O ATOM 0 H GLU A 171 -2.761 5.282 -6.755 1.00 0.00 H new ATOM 0 HA GLU A 171 -1.408 4.317 -4.445 1.00 0.00 H new ATOM 0 HB2 GLU A 171 -2.945 6.362 -4.819 1.00 0.00 H new ATOM 0 HB3 GLU A 171 -4.281 5.236 -4.686 1.00 0.00 H new ATOM 0 HG2 GLU A 171 -3.564 4.612 -2.418 1.00 0.00 H new ATOM 0 HG3 GLU A 171 -2.173 5.671 -2.546 1.00 0.00 H new ATOM 1024 N ALA A 172 -4.060 2.643 -5.506 1.00 0.00 N ATOM 1025 CA ALA A 172 -4.694 1.332 -5.472 1.00 0.00 C ATOM 1026 C ALA A 172 -3.712 0.263 -5.919 1.00 0.00 C ATOM 1027 O ALA A 172 -3.606 -0.792 -5.298 1.00 0.00 O ATOM 1028 CB ALA A 172 -5.933 1.299 -6.347 1.00 0.00 C ATOM 0 H ALA A 172 -4.482 3.298 -6.164 1.00 0.00 H new ATOM 0 HA ALA A 172 -4.999 1.132 -4.445 1.00 0.00 H new ATOM 0 HB1 ALA A 172 -6.384 0.308 -6.301 1.00 0.00 H new ATOM 0 HB2 ALA A 172 -6.649 2.040 -5.992 1.00 0.00 H new ATOM 0 HB3 ALA A 172 -5.657 1.525 -7.377 1.00 0.00 H new ATOM 1034 N THR A 173 -2.990 0.552 -7.001 1.00 0.00 N ATOM 1035 CA THR A 173 -1.954 -0.346 -7.495 1.00 0.00 C ATOM 1036 C THR A 173 -0.953 -0.650 -6.387 1.00 0.00 C ATOM 1037 O THR A 173 -0.609 -1.807 -6.135 1.00 0.00 O ATOM 1038 CB THR A 173 -1.204 0.275 -8.690 1.00 0.00 C ATOM 1039 OG1 THR A 173 -2.145 0.790 -9.640 1.00 0.00 O ATOM 1040 CG2 THR A 173 -0.308 -0.752 -9.367 1.00 0.00 C ATOM 0 H THR A 173 -3.106 1.403 -7.551 1.00 0.00 H new ATOM 0 HA THR A 173 -2.439 -1.266 -7.821 1.00 0.00 H new ATOM 0 HB THR A 173 -0.579 1.085 -8.315 1.00 0.00 H new ATOM 0 HG1 THR A 173 -2.608 1.563 -9.256 1.00 0.00 H new ATOM 0 HG21 THR A 173 0.209 -0.287 -10.206 1.00 0.00 H new ATOM 0 HG22 THR A 173 0.425 -1.124 -8.651 1.00 0.00 H new ATOM 0 HG23 THR A 173 -0.915 -1.582 -9.729 1.00 0.00 H new ATOM 1048 N LEU A 174 -0.524 0.405 -5.715 1.00 0.00 N ATOM 1049 CA LEU A 174 0.399 0.303 -4.600 1.00 0.00 C ATOM 1050 C LEU A 174 -0.142 -0.652 -3.540 1.00 0.00 C ATOM 1051 O LEU A 174 0.464 -1.688 -3.270 1.00 0.00 O ATOM 1052 CB LEU A 174 0.649 1.700 -4.011 1.00 0.00 C ATOM 1053 CG LEU A 174 1.422 1.748 -2.693 1.00 0.00 C ATOM 1054 CD1 LEU A 174 2.790 1.099 -2.827 1.00 0.00 C ATOM 1055 CD2 LEU A 174 1.562 3.184 -2.220 1.00 0.00 C ATOM 0 H LEU A 174 -0.808 1.361 -5.930 1.00 0.00 H new ATOM 0 HA LEU A 174 1.347 -0.102 -4.954 1.00 0.00 H new ATOM 0 HB2 LEU A 174 1.192 2.291 -4.749 1.00 0.00 H new ATOM 0 HB3 LEU A 174 -0.315 2.186 -3.861 1.00 0.00 H new ATOM 0 HG LEU A 174 0.857 1.182 -1.952 1.00 0.00 H new ATOM 0 HD11 LEU A 174 3.312 1.151 -1.872 1.00 0.00 H new ATOM 0 HD12 LEU A 174 2.671 0.056 -3.119 1.00 0.00 H new ATOM 0 HD13 LEU A 174 3.369 1.625 -3.586 1.00 0.00 H new ATOM 0 HD21 LEU A 174 2.114 3.205 -1.280 1.00 0.00 H new ATOM 0 HD22 LEU A 174 2.100 3.763 -2.970 1.00 0.00 H new ATOM 0 HD23 LEU A 174 0.572 3.615 -2.069 1.00 0.00 H new ATOM 1067 N LEU A 175 -1.304 -0.323 -2.979 1.00 0.00 N ATOM 1068 CA LEU A 175 -1.911 -1.126 -1.911 1.00 0.00 C ATOM 1069 C LEU A 175 -2.176 -2.563 -2.369 1.00 0.00 C ATOM 1070 O LEU A 175 -2.193 -3.488 -1.555 1.00 0.00 O ATOM 1071 CB LEU A 175 -3.219 -0.474 -1.451 1.00 0.00 C ATOM 1072 CG LEU A 175 -3.069 0.902 -0.814 1.00 0.00 C ATOM 1073 CD1 LEU A 175 -4.424 1.576 -0.683 1.00 0.00 C ATOM 1074 CD2 LEU A 175 -2.411 0.775 0.546 1.00 0.00 C ATOM 0 H LEU A 175 -1.849 0.497 -3.246 1.00 0.00 H new ATOM 0 HA LEU A 175 -1.208 -1.165 -1.079 1.00 0.00 H new ATOM 0 HB2 LEU A 175 -3.885 -0.389 -2.309 1.00 0.00 H new ATOM 0 HB3 LEU A 175 -3.705 -1.137 -0.735 1.00 0.00 H new ATOM 0 HG LEU A 175 -2.438 1.518 -1.455 1.00 0.00 H new ATOM 0 HD11 LEU A 175 -4.299 2.558 -0.226 1.00 0.00 H new ATOM 0 HD12 LEU A 175 -4.871 1.689 -1.671 1.00 0.00 H new ATOM 0 HD13 LEU A 175 -5.075 0.965 -0.058 1.00 0.00 H new ATOM 0 HD21 LEU A 175 -2.308 1.763 0.994 1.00 0.00 H new ATOM 0 HD22 LEU A 175 -3.026 0.147 1.191 1.00 0.00 H new ATOM 0 HD23 LEU A 175 -1.425 0.323 0.433 1.00 0.00 H new ATOM 1086 N ASN A 176 -2.367 -2.751 -3.673 1.00 0.00 N ATOM 1087 CA ASN A 176 -2.571 -4.080 -4.226 1.00 0.00 C ATOM 1088 C ASN A 176 -1.281 -4.856 -4.145 1.00 0.00 C ATOM 1089 O ASN A 176 -1.269 -6.028 -3.765 1.00 0.00 O ATOM 1090 CB ASN A 176 -3.045 -4.021 -5.681 1.00 0.00 C ATOM 1091 CG ASN A 176 -4.553 -4.075 -5.811 1.00 0.00 C ATOM 1092 OD1 ASN A 176 -5.138 -5.155 -5.865 1.00 0.00 O ATOM 1093 ND2 ASN A 176 -5.190 -2.920 -5.872 1.00 0.00 N ATOM 0 H ASN A 176 -2.384 -1.999 -4.362 1.00 0.00 H new ATOM 0 HA ASN A 176 -3.347 -4.575 -3.643 1.00 0.00 H new ATOM 0 HB2 ASN A 176 -2.678 -3.103 -6.141 1.00 0.00 H new ATOM 0 HB3 ASN A 176 -2.607 -4.852 -6.235 1.00 0.00 H new ATOM 0 HD21 ASN A 176 -6.205 -2.902 -5.967 1.00 0.00 H new ATOM 0 HD22 ASN A 176 -4.667 -2.046 -5.824 1.00 0.00 H new ATOM 1100 N MET A 177 -0.188 -4.183 -4.473 1.00 0.00 N ATOM 1101 CA MET A 177 1.126 -4.791 -4.408 1.00 0.00 C ATOM 1102 C MET A 177 1.508 -5.058 -2.959 1.00 0.00 C ATOM 1103 O MET A 177 2.206 -6.025 -2.656 1.00 0.00 O ATOM 1104 CB MET A 177 2.181 -3.904 -5.071 1.00 0.00 C ATOM 1105 CG MET A 177 1.867 -3.548 -6.512 1.00 0.00 C ATOM 1106 SD MET A 177 3.245 -2.741 -7.347 1.00 0.00 S ATOM 1107 CE MET A 177 3.488 -1.310 -6.299 1.00 0.00 C ATOM 0 H MET A 177 -0.189 -3.213 -4.787 1.00 0.00 H new ATOM 0 HA MET A 177 1.087 -5.735 -4.951 1.00 0.00 H new ATOM 0 HB2 MET A 177 2.284 -2.985 -4.494 1.00 0.00 H new ATOM 0 HB3 MET A 177 3.144 -4.413 -5.034 1.00 0.00 H new ATOM 0 HG2 MET A 177 1.599 -4.454 -7.055 1.00 0.00 H new ATOM 0 HG3 MET A 177 0.997 -2.892 -6.538 1.00 0.00 H new ATOM 0 HE1 MET A 177 4.395 -0.787 -6.602 1.00 0.00 H new ATOM 0 HE2 MET A 177 2.634 -0.640 -6.395 1.00 0.00 H new ATOM 0 HE3 MET A 177 3.583 -1.631 -5.262 1.00 0.00 H new ATOM 1117 N LEU A 178 1.034 -4.194 -2.066 1.00 0.00 N ATOM 1118 CA LEU A 178 1.258 -4.365 -0.635 1.00 0.00 C ATOM 1119 C LEU A 178 0.487 -5.564 -0.105 1.00 0.00 C ATOM 1120 O LEU A 178 0.814 -6.110 0.947 1.00 0.00 O ATOM 1121 CB LEU A 178 0.825 -3.120 0.150 1.00 0.00 C ATOM 1122 CG LEU A 178 1.752 -1.906 0.076 1.00 0.00 C ATOM 1123 CD1 LEU A 178 3.038 -2.223 -0.671 1.00 0.00 C ATOM 1124 CD2 LEU A 178 1.049 -0.731 -0.542 1.00 0.00 C ATOM 0 H LEU A 178 0.491 -3.366 -2.310 1.00 0.00 H new ATOM 0 HA LEU A 178 2.328 -4.524 -0.498 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -0.160 -2.818 -0.206 1.00 0.00 H new ATOM 0 HB3 LEU A 178 0.713 -3.400 1.198 1.00 0.00 H new ATOM 0 HG LEU A 178 2.025 -1.643 1.098 1.00 0.00 H new ATOM 0 HD11 LEU A 178 3.669 -1.335 -0.702 1.00 0.00 H new ATOM 0 HD12 LEU A 178 3.567 -3.027 -0.159 1.00 0.00 H new ATOM 0 HD13 LEU A 178 2.801 -2.535 -1.688 1.00 0.00 H new ATOM 0 HD21 LEU A 178 1.729 0.120 -0.583 1.00 0.00 H new ATOM 0 HD22 LEU A 178 0.728 -0.989 -1.551 1.00 0.00 H new ATOM 0 HD23 LEU A 178 0.178 -0.470 0.060 1.00 0.00 H new ATOM 1136 N ASN A 179 -0.547 -5.951 -0.854 1.00 0.00 N ATOM 1137 CA ASN A 179 -1.449 -7.034 -0.469 1.00 0.00 C ATOM 1138 C ASN A 179 -2.224 -6.632 0.785 1.00 0.00 C ATOM 1139 O ASN A 179 -2.675 -7.472 1.564 1.00 0.00 O ATOM 1140 CB ASN A 179 -0.674 -8.345 -0.252 1.00 0.00 C ATOM 1141 CG ASN A 179 -1.548 -9.582 -0.381 1.00 0.00 C ATOM 1142 OD1 ASN A 179 -1.741 -10.104 -1.479 1.00 0.00 O ATOM 1143 ND2 ASN A 179 -2.060 -10.072 0.735 1.00 0.00 N ATOM 0 H ASN A 179 -0.782 -5.519 -1.748 1.00 0.00 H new ATOM 0 HA ASN A 179 -2.159 -7.210 -1.277 1.00 0.00 H new ATOM 0 HB2 ASN A 179 0.138 -8.404 -0.976 1.00 0.00 H new ATOM 0 HB3 ASN A 179 -0.218 -8.331 0.738 1.00 0.00 H new ATOM 0 HD21 ASN A 179 -2.638 -10.912 0.705 1.00 0.00 H new ATOM 0 HD22 ASN A 179 -1.877 -9.610 1.626 1.00 0.00 H new ATOM 1150 N ILE A 180 -2.382 -5.325 0.963 1.00 0.00 N ATOM 1151 CA ILE A 180 -3.071 -4.783 2.120 1.00 0.00 C ATOM 1152 C ILE A 180 -4.526 -4.494 1.779 1.00 0.00 C ATOM 1153 O ILE A 180 -4.836 -4.019 0.685 1.00 0.00 O ATOM 1154 CB ILE A 180 -2.381 -3.493 2.629 1.00 0.00 C ATOM 1155 CG1 ILE A 180 -0.980 -3.815 3.154 1.00 0.00 C ATOM 1156 CG2 ILE A 180 -3.209 -2.822 3.715 1.00 0.00 C ATOM 1157 CD1 ILE A 180 -0.188 -2.591 3.567 1.00 0.00 C ATOM 0 H ILE A 180 -2.038 -4.619 0.312 1.00 0.00 H new ATOM 0 HA ILE A 180 -3.030 -5.528 2.915 1.00 0.00 H new ATOM 0 HB ILE A 180 -2.296 -2.800 1.792 1.00 0.00 H new ATOM 0 HG12 ILE A 180 -1.067 -4.486 4.009 1.00 0.00 H new ATOM 0 HG13 ILE A 180 -0.427 -4.351 2.383 1.00 0.00 H new ATOM 0 HG21 ILE A 180 -2.701 -1.919 4.054 1.00 0.00 H new ATOM 0 HG22 ILE A 180 -4.189 -2.559 3.316 1.00 0.00 H new ATOM 0 HG23 ILE A 180 -3.331 -3.506 4.554 1.00 0.00 H new ATOM 0 HD11 ILE A 180 0.794 -2.898 3.928 1.00 0.00 H new ATOM 0 HD12 ILE A 180 -0.069 -1.929 2.710 1.00 0.00 H new ATOM 0 HD13 ILE A 180 -0.719 -2.065 4.361 1.00 0.00 H new ATOM 1169 N SER A 181 -5.414 -4.804 2.710 1.00 0.00 N ATOM 1170 CA SER A 181 -6.833 -4.574 2.518 1.00 0.00 C ATOM 1171 C SER A 181 -7.209 -3.170 2.984 1.00 0.00 C ATOM 1172 O SER A 181 -7.088 -2.851 4.166 1.00 0.00 O ATOM 1173 CB SER A 181 -7.644 -5.611 3.297 1.00 0.00 C ATOM 1174 OG SER A 181 -9.012 -5.583 2.922 1.00 0.00 O ATOM 0 H SER A 181 -5.173 -5.218 3.611 1.00 0.00 H new ATOM 0 HA SER A 181 -7.059 -4.667 1.456 1.00 0.00 H new ATOM 0 HB2 SER A 181 -7.236 -6.605 3.117 1.00 0.00 H new ATOM 0 HB3 SER A 181 -7.554 -5.418 4.366 1.00 0.00 H new ATOM 0 HG SER A 181 -9.402 -6.474 3.039 1.00 0.00 H new ATOM 1180 N PRO A 182 -7.640 -2.304 2.058 1.00 0.00 N ATOM 1181 CA PRO A 182 -8.115 -0.969 2.400 1.00 0.00 C ATOM 1182 C PRO A 182 -9.582 -0.960 2.822 1.00 0.00 C ATOM 1183 O PRO A 182 -10.086 0.041 3.329 1.00 0.00 O ATOM 1184 CB PRO A 182 -7.915 -0.189 1.105 1.00 0.00 C ATOM 1185 CG PRO A 182 -8.015 -1.200 0.014 1.00 0.00 C ATOM 1186 CD PRO A 182 -7.658 -2.542 0.607 1.00 0.00 C ATOM 0 HA PRO A 182 -7.583 -0.548 3.253 1.00 0.00 H new ATOM 0 HB2 PRO A 182 -8.673 0.586 0.993 1.00 0.00 H new ATOM 0 HB3 PRO A 182 -6.945 0.309 1.092 1.00 0.00 H new ATOM 0 HG2 PRO A 182 -9.023 -1.219 -0.400 1.00 0.00 H new ATOM 0 HG3 PRO A 182 -7.339 -0.950 -0.804 1.00 0.00 H new ATOM 0 HD2 PRO A 182 -8.390 -3.303 0.338 1.00 0.00 H new ATOM 0 HD3 PRO A 182 -6.689 -2.890 0.249 1.00 0.00 H new ATOM 1194 N PHE A 183 -10.258 -2.081 2.610 1.00 0.00 N ATOM 1195 CA PHE A 183 -11.659 -2.215 2.977 1.00 0.00 C ATOM 1196 C PHE A 183 -11.820 -3.368 3.968 1.00 0.00 C ATOM 1197 O PHE A 183 -11.149 -3.400 5.002 1.00 0.00 O ATOM 1198 CB PHE A 183 -12.526 -2.453 1.733 1.00 0.00 C ATOM 1199 CG PHE A 183 -12.397 -1.394 0.671 1.00 0.00 C ATOM 1200 CD1 PHE A 183 -13.249 -0.304 0.663 1.00 0.00 C ATOM 1201 CD2 PHE A 183 -11.432 -1.491 -0.322 1.00 0.00 C ATOM 1202 CE1 PHE A 183 -13.142 0.670 -0.309 1.00 0.00 C ATOM 1203 CE2 PHE A 183 -11.323 -0.517 -1.295 1.00 0.00 C ATOM 1204 CZ PHE A 183 -12.178 0.564 -1.289 1.00 0.00 C ATOM 0 H PHE A 183 -9.855 -2.915 2.183 1.00 0.00 H new ATOM 0 HA PHE A 183 -11.991 -1.289 3.447 1.00 0.00 H new ATOM 0 HB2 PHE A 183 -12.261 -3.418 1.300 1.00 0.00 H new ATOM 0 HB3 PHE A 183 -13.570 -2.517 2.040 1.00 0.00 H new ATOM 0 HD1 PHE A 183 -14.007 -0.214 1.427 1.00 0.00 H new ATOM 0 HD2 PHE A 183 -10.760 -2.336 -0.334 1.00 0.00 H new ATOM 0 HE1 PHE A 183 -13.814 1.516 -0.302 1.00 0.00 H new ATOM 0 HE2 PHE A 183 -10.567 -0.602 -2.061 1.00 0.00 H new ATOM 0 HZ PHE A 183 -12.093 1.326 -2.050 1.00 0.00 H new ATOM 1214 N SER A 184 -12.688 -4.324 3.653 1.00 0.00 N ATOM 1215 CA SER A 184 -12.895 -5.468 4.527 1.00 0.00 C ATOM 1216 C SER A 184 -12.298 -6.742 3.932 1.00 0.00 C ATOM 1217 O SER A 184 -11.257 -7.212 4.393 1.00 0.00 O ATOM 1218 CB SER A 184 -14.383 -5.651 4.825 1.00 0.00 C ATOM 1219 OG SER A 184 -14.935 -4.470 5.380 1.00 0.00 O ATOM 0 H SER A 184 -13.255 -4.328 2.805 1.00 0.00 H new ATOM 0 HA SER A 184 -12.376 -5.271 5.465 1.00 0.00 H new ATOM 0 HB2 SER A 184 -14.913 -5.909 3.908 1.00 0.00 H new ATOM 0 HB3 SER A 184 -14.520 -6.482 5.517 1.00 0.00 H new ATOM 0 HG SER A 184 -15.888 -4.608 5.561 1.00 0.00 H new ATOM 1225 N TYR A 185 -12.939 -7.294 2.906 1.00 0.00 N ATOM 1226 CA TYR A 185 -12.457 -8.523 2.283 1.00 0.00 C ATOM 1227 C TYR A 185 -12.797 -8.538 0.797 1.00 0.00 C ATOM 1228 O TYR A 185 -13.576 -7.708 0.325 1.00 0.00 O ATOM 1229 CB TYR A 185 -13.048 -9.758 2.980 1.00 0.00 C ATOM 1230 CG TYR A 185 -14.558 -9.863 2.890 1.00 0.00 C ATOM 1231 CD1 TYR A 185 -15.164 -10.520 1.827 1.00 0.00 C ATOM 1232 CD2 TYR A 185 -15.373 -9.313 3.872 1.00 0.00 C ATOM 1233 CE1 TYR A 185 -16.537 -10.621 1.742 1.00 0.00 C ATOM 1234 CE2 TYR A 185 -16.749 -9.410 3.792 1.00 0.00 C ATOM 1235 CZ TYR A 185 -17.325 -10.067 2.726 1.00 0.00 C ATOM 1236 OH TYR A 185 -18.693 -10.168 2.641 1.00 0.00 O ATOM 0 H TYR A 185 -13.789 -6.913 2.490 1.00 0.00 H new ATOM 0 HA TYR A 185 -11.373 -8.556 2.392 1.00 0.00 H new ATOM 0 HB2 TYR A 185 -12.607 -10.653 2.543 1.00 0.00 H new ATOM 0 HB3 TYR A 185 -12.759 -9.741 4.031 1.00 0.00 H new ATOM 0 HD1 TYR A 185 -14.550 -10.959 1.054 1.00 0.00 H new ATOM 0 HD2 TYR A 185 -14.924 -8.802 4.711 1.00 0.00 H new ATOM 0 HE1 TYR A 185 -16.992 -11.133 0.907 1.00 0.00 H new ATOM 0 HE2 TYR A 185 -17.370 -8.973 4.560 1.00 0.00 H new ATOM 0 HH TYR A 185 -19.102 -9.726 3.414 1.00 0.00 H new ATOM 1246 N GLY A 186 -12.217 -9.481 0.070 1.00 0.00 N ATOM 1247 CA GLY A 186 -12.432 -9.559 -1.359 1.00 0.00 C ATOM 1248 C GLY A 186 -13.239 -10.775 -1.750 1.00 0.00 C ATOM 1249 O GLY A 186 -13.213 -11.776 -1.006 1.00 0.00 O ATOM 1250 OXT GLY A 186 -13.895 -10.741 -2.813 1.00 0.00 O ATOM 0 H GLY A 186 -11.597 -10.198 0.448 1.00 0.00 H new ATOM 0 HA2 GLY A 186 -12.947 -8.660 -1.697 1.00 0.00 H new ATOM 0 HA3 GLY A 186 -11.469 -9.585 -1.869 1.00 0.00 H new TER 1254 GLY A 186