USER MOD reduce.3.24.130724 H: found=0, std=0, add=1095, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1097 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: B 11 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: B 12 ASN : amide:sc= -2.12 K(o=-2.1,f=-14!) USER MOD Set 2.1: A 67 THR OG1 : rot 180:sc= -0.0324 USER MOD Set 2.2: A 69 TYR OH : rot 0:sc= -0.112 USER MOD Set 3.1: A 4 THR OG1 : rot 70:sc= 1.15 USER MOD Set 3.2: A 49 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 34 ASN : amide:sc= -0.691 K(o=-0.59,f=-2.7) USER MOD Set 4.2: A 41 GLN :FLIP amide:sc= 0.0979 F(o=-2.6,f=-0.59) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 ASN : amide:sc= -1.1 K(o=-1.1,f=-15!) USER MOD Single : A 15 GLN : amide:sc= -1.85 K(o=-1.9,f=-8!) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= -0.376 X(o=-0.38,f=0) USER MOD Single : A 29 ASN : amide:sc= -0.0413 X(o=-0.041,f=-0.26) USER MOD Single : A 33 GLN : amide:sc= -1.5 K(o=-1.5,f=-3.4!) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 MET CE :methyl -169:sc= -0.91 (180deg=-1.18) USER MOD Single : A 58 MET CE :methyl 152:sc= -4.24! (180deg=-7.77!) USER MOD Single : A 60 LYS NZ :NH3+ 165:sc=-0.00964 (180deg=-0.18) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 THR OG1 : rot 13:sc= 0.601 USER MOD Single : B 15 GLN : amide:sc= -3.87 K(o=-3.9,f=-12!) USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 GLN : amide:sc= -0.303 X(o=-0.3,f=0) USER MOD Single : B 29 ASN : amide:sc= -0.189 K(o=-0.19,f=-2!) USER MOD Single : B 33 GLN :FLIP amide:sc= -0.795 F(o=-1.4,f=-0.79) USER MOD Single : B 34 ASN : amide:sc= -0.821 K(o=-0.82,f=-3.7!) USER MOD Single : B 37 THR OG1 : rot 180:sc= 0 USER MOD Single : B 41 GLN : amide:sc= -2.43 X(o=-2.4,f=-2.6!) USER MOD Single : B 49 SER OG : rot 180:sc= 0 USER MOD Single : B 51 MET CE :methyl -177:sc= -0.852 (180deg=-0.955) USER MOD Single : B 58 MET CE :methyl -157:sc= -1.37 (180deg=-3.64!) USER MOD Single : B 60 LYS NZ :NH3+ 169:sc= -0.195 (180deg=-0.357) USER MOD Single : B 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 67 THR OG1 : rot 180:sc= -0.234 USER MOD Single : B 69 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 19 N LYS A 3 1.328 -1.391 -6.191 1.00 0.00 N ATOM 20 CA LYS A 3 2.180 -1.307 -7.371 1.00 0.00 C ATOM 21 C LYS A 3 1.513 -1.968 -8.573 1.00 0.00 C ATOM 22 O LYS A 3 0.435 -2.552 -8.455 1.00 0.00 O ATOM 23 CB LYS A 3 3.532 -1.969 -7.097 1.00 0.00 C ATOM 24 CG LYS A 3 4.129 -1.599 -5.750 1.00 0.00 C ATOM 25 CD LYS A 3 5.619 -1.892 -5.701 1.00 0.00 C ATOM 26 CE LYS A 3 6.442 -0.640 -5.961 1.00 0.00 C ATOM 27 NZ LYS A 3 7.416 -0.837 -7.070 1.00 0.00 N ATOM 0 HA LYS A 3 2.338 -0.253 -7.600 1.00 0.00 H new ATOM 0 HB2 LYS A 3 3.414 -3.051 -7.148 1.00 0.00 H new ATOM 0 HB3 LYS A 3 4.231 -1.687 -7.884 1.00 0.00 H new ATOM 0 HG2 LYS A 3 3.959 -0.540 -5.554 1.00 0.00 H new ATOM 0 HG3 LYS A 3 3.622 -2.155 -4.961 1.00 0.00 H new ATOM 0 HD2 LYS A 3 5.878 -2.303 -4.725 1.00 0.00 H new ATOM 0 HD3 LYS A 3 5.866 -2.652 -6.443 1.00 0.00 H new ATOM 0 HE2 LYS A 3 5.776 0.188 -6.205 1.00 0.00 H new ATOM 0 HE3 LYS A 3 6.977 -0.362 -5.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 7.957 0.039 -7.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 8.067 -1.610 -6.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 6.904 -1.077 -7.943 1.00 0.00 H new ATOM 41 N THR A 4 2.161 -1.873 -9.730 1.00 0.00 N ATOM 42 CA THR A 4 1.630 -2.462 -10.953 1.00 0.00 C ATOM 43 C THR A 4 2.544 -3.567 -11.472 1.00 0.00 C ATOM 44 O THR A 4 3.685 -3.311 -11.858 1.00 0.00 O ATOM 45 CB THR A 4 1.449 -1.401 -12.055 1.00 0.00 C ATOM 46 OG1 THR A 4 1.882 -0.122 -11.579 1.00 0.00 O ATOM 47 CG2 THR A 4 -0.005 -1.320 -12.494 1.00 0.00 C ATOM 0 H THR A 4 3.054 -1.394 -9.846 1.00 0.00 H new ATOM 0 HA THR A 4 0.657 -2.886 -10.704 1.00 0.00 H new ATOM 0 HB THR A 4 2.055 -1.692 -12.913 1.00 0.00 H new ATOM 0 HG1 THR A 4 2.857 -0.121 -11.484 1.00 0.00 H new ATOM 0 HG21 THR A 4 -0.108 -0.564 -13.273 1.00 0.00 H new ATOM 0 HG22 THR A 4 -0.322 -2.288 -12.883 1.00 0.00 H new ATOM 0 HG23 THR A 4 -0.628 -1.050 -11.641 1.00 0.00 H new ATOM 55 N ILE A 5 2.035 -4.794 -11.481 1.00 0.00 N ATOM 56 CA ILE A 5 2.805 -5.937 -11.955 1.00 0.00 C ATOM 57 C ILE A 5 2.468 -6.264 -13.405 1.00 0.00 C ATOM 58 O ILE A 5 1.338 -6.637 -13.722 1.00 0.00 O ATOM 59 CB ILE A 5 2.554 -7.185 -11.087 1.00 0.00 C ATOM 60 CG1 ILE A 5 2.928 -6.904 -9.631 1.00 0.00 C ATOM 61 CG2 ILE A 5 3.342 -8.370 -11.623 1.00 0.00 C ATOM 62 CD1 ILE A 5 2.272 -7.846 -8.646 1.00 0.00 C ATOM 0 H ILE A 5 1.092 -5.022 -11.165 1.00 0.00 H new ATOM 0 HA ILE A 5 3.857 -5.660 -11.883 1.00 0.00 H new ATOM 0 HB ILE A 5 1.493 -7.431 -11.129 1.00 0.00 H new ATOM 0 HG12 ILE A 5 4.010 -6.974 -9.522 1.00 0.00 H new ATOM 0 HG13 ILE A 5 2.648 -5.880 -9.384 1.00 0.00 H new ATOM 0 HG21 ILE A 5 3.154 -9.244 -10.999 1.00 0.00 H new ATOM 0 HG22 ILE A 5 3.031 -8.581 -12.646 1.00 0.00 H new ATOM 0 HG23 ILE A 5 4.406 -8.136 -11.608 1.00 0.00 H new ATOM 0 HD11 ILE A 5 2.583 -7.588 -7.634 1.00 0.00 H new ATOM 0 HD12 ILE A 5 1.188 -7.760 -8.726 1.00 0.00 H new ATOM 0 HD13 ILE A 5 2.572 -8.870 -8.867 1.00 0.00 H new ATOM 74 N PHE A 6 3.455 -6.124 -14.283 1.00 0.00 N ATOM 75 CA PHE A 6 3.264 -6.405 -15.701 1.00 0.00 C ATOM 76 C PHE A 6 3.891 -7.743 -16.080 1.00 0.00 C ATOM 77 O PHE A 6 5.105 -7.923 -15.983 1.00 0.00 O ATOM 78 CB PHE A 6 3.871 -5.286 -16.551 1.00 0.00 C ATOM 79 CG PHE A 6 2.845 -4.380 -17.169 1.00 0.00 C ATOM 80 CD1 PHE A 6 1.980 -3.646 -16.374 1.00 0.00 C ATOM 81 CD2 PHE A 6 2.747 -4.260 -18.546 1.00 0.00 C ATOM 82 CE1 PHE A 6 1.035 -2.812 -16.940 1.00 0.00 C ATOM 83 CE2 PHE A 6 1.804 -3.427 -19.119 1.00 0.00 C ATOM 84 CZ PHE A 6 0.948 -2.701 -18.314 1.00 0.00 C ATOM 0 H PHE A 6 4.396 -5.817 -14.037 1.00 0.00 H new ATOM 0 HA PHE A 6 2.192 -6.458 -15.894 1.00 0.00 H new ATOM 0 HB2 PHE A 6 4.542 -4.692 -15.930 1.00 0.00 H new ATOM 0 HB3 PHE A 6 4.477 -5.729 -17.342 1.00 0.00 H new ATOM 0 HD1 PHE A 6 2.045 -3.727 -15.299 1.00 0.00 H new ATOM 0 HD2 PHE A 6 3.416 -4.824 -19.179 1.00 0.00 H new ATOM 0 HE1 PHE A 6 0.365 -2.247 -16.309 1.00 0.00 H new ATOM 0 HE2 PHE A 6 1.737 -3.344 -20.194 1.00 0.00 H new ATOM 0 HZ PHE A 6 0.212 -2.048 -18.758 1.00 0.00 H new ATOM 94 N VAL A 7 3.053 -8.681 -16.511 1.00 0.00 N ATOM 95 CA VAL A 7 3.523 -10.004 -16.905 1.00 0.00 C ATOM 96 C VAL A 7 3.412 -10.200 -18.413 1.00 0.00 C ATOM 97 O VAL A 7 2.332 -10.066 -18.988 1.00 0.00 O ATOM 98 CB VAL A 7 2.730 -11.116 -16.194 1.00 0.00 C ATOM 99 CG1 VAL A 7 3.198 -11.270 -14.754 1.00 0.00 C ATOM 100 CG2 VAL A 7 1.238 -10.826 -16.250 1.00 0.00 C ATOM 0 H VAL A 7 2.045 -8.549 -16.596 1.00 0.00 H new ATOM 0 HA VAL A 7 4.570 -10.069 -16.609 1.00 0.00 H new ATOM 0 HB VAL A 7 2.914 -12.057 -16.713 1.00 0.00 H new ATOM 0 HG11 VAL A 7 2.626 -12.060 -14.268 1.00 0.00 H new ATOM 0 HG12 VAL A 7 4.257 -11.528 -14.741 1.00 0.00 H new ATOM 0 HG13 VAL A 7 3.047 -10.332 -14.220 1.00 0.00 H new ATOM 0 HG21 VAL A 7 0.693 -11.622 -15.743 1.00 0.00 H new ATOM 0 HG22 VAL A 7 1.033 -9.875 -15.757 1.00 0.00 H new ATOM 0 HG23 VAL A 7 0.917 -10.772 -17.290 1.00 0.00 H new ATOM 110 N ILE A 8 4.536 -10.519 -19.046 1.00 0.00 N ATOM 111 CA ILE A 8 4.564 -10.735 -20.488 1.00 0.00 C ATOM 112 C ILE A 8 4.908 -12.183 -20.819 1.00 0.00 C ATOM 113 O ILE A 8 5.743 -12.802 -20.159 1.00 0.00 O ATOM 114 CB ILE A 8 5.582 -9.807 -21.176 1.00 0.00 C ATOM 115 CG1 ILE A 8 5.308 -8.348 -20.804 1.00 0.00 C ATOM 116 CG2 ILE A 8 5.532 -9.993 -22.685 1.00 0.00 C ATOM 117 CD1 ILE A 8 6.286 -7.788 -19.796 1.00 0.00 C ATOM 0 H ILE A 8 5.438 -10.634 -18.584 1.00 0.00 H new ATOM 0 HA ILE A 8 3.566 -10.506 -20.862 1.00 0.00 H new ATOM 0 HB ILE A 8 6.582 -10.069 -20.830 1.00 0.00 H new ATOM 0 HG12 ILE A 8 5.341 -7.739 -21.707 1.00 0.00 H new ATOM 0 HG13 ILE A 8 4.298 -8.267 -20.402 1.00 0.00 H new ATOM 0 HG21 ILE A 8 6.257 -9.330 -23.157 1.00 0.00 H new ATOM 0 HG22 ILE A 8 5.771 -11.027 -22.932 1.00 0.00 H new ATOM 0 HG23 ILE A 8 4.532 -9.755 -23.048 1.00 0.00 H new ATOM 0 HD11 ILE A 8 6.031 -6.751 -19.579 1.00 0.00 H new ATOM 0 HD12 ILE A 8 6.237 -8.373 -18.878 1.00 0.00 H new ATOM 0 HD13 ILE A 8 7.296 -7.836 -20.203 1.00 0.00 H new ATOM 129 N VAL A 9 4.260 -12.719 -21.849 1.00 0.00 N ATOM 130 CA VAL A 9 4.499 -14.093 -22.272 1.00 0.00 C ATOM 131 C VAL A 9 4.790 -14.166 -23.766 1.00 0.00 C ATOM 132 O VAL A 9 3.886 -14.279 -24.595 1.00 0.00 O ATOM 133 CB VAL A 9 3.294 -14.997 -21.949 1.00 0.00 C ATOM 134 CG1 VAL A 9 3.655 -16.461 -22.150 1.00 0.00 C ATOM 135 CG2 VAL A 9 2.807 -14.749 -20.530 1.00 0.00 C ATOM 0 H VAL A 9 3.565 -12.222 -22.406 1.00 0.00 H new ATOM 0 HA VAL A 9 5.369 -14.448 -21.719 1.00 0.00 H new ATOM 0 HB VAL A 9 2.483 -14.751 -22.635 1.00 0.00 H new ATOM 0 HG11 VAL A 9 2.791 -17.084 -21.917 1.00 0.00 H new ATOM 0 HG12 VAL A 9 3.951 -16.624 -23.186 1.00 0.00 H new ATOM 0 HG13 VAL A 9 4.482 -16.726 -21.491 1.00 0.00 H new ATOM 0 HG21 VAL A 9 1.956 -15.396 -20.319 1.00 0.00 H new ATOM 0 HG22 VAL A 9 3.611 -14.966 -19.826 1.00 0.00 H new ATOM 0 HG23 VAL A 9 2.505 -13.707 -20.426 1.00 0.00 H new ATOM 145 N PRO A 10 6.081 -14.102 -24.122 1.00 0.00 N ATOM 146 CA PRO A 10 6.522 -14.160 -25.519 1.00 0.00 C ATOM 147 C PRO A 10 6.321 -15.541 -26.133 1.00 0.00 C ATOM 148 O PRO A 10 6.404 -16.557 -25.443 1.00 0.00 O ATOM 149 CB PRO A 10 8.013 -13.824 -25.434 1.00 0.00 C ATOM 150 CG PRO A 10 8.413 -14.219 -24.055 1.00 0.00 C ATOM 151 CD PRO A 10 7.211 -13.967 -23.187 1.00 0.00 C ATOM 0 HA PRO A 10 5.954 -13.481 -26.155 1.00 0.00 H new ATOM 0 HB2 PRO A 10 8.585 -14.370 -26.184 1.00 0.00 H new ATOM 0 HB3 PRO A 10 8.190 -12.763 -25.609 1.00 0.00 H new ATOM 0 HG2 PRO A 10 8.707 -15.268 -24.019 1.00 0.00 H new ATOM 0 HG3 PRO A 10 9.269 -13.636 -23.715 1.00 0.00 H new ATOM 0 HD2 PRO A 10 7.146 -14.687 -22.371 1.00 0.00 H new ATOM 0 HD3 PRO A 10 7.242 -12.976 -22.735 1.00 0.00 H new ATOM 159 N THR A 11 6.056 -15.571 -27.435 1.00 0.00 N ATOM 160 CA THR A 11 5.842 -16.827 -28.143 1.00 0.00 C ATOM 161 C THR A 11 6.747 -16.931 -29.365 1.00 0.00 C ATOM 162 O THR A 11 6.521 -17.756 -30.249 1.00 0.00 O ATOM 163 CB THR A 11 4.376 -16.978 -28.590 1.00 0.00 C ATOM 164 OG1 THR A 11 4.167 -16.287 -29.826 1.00 0.00 O ATOM 165 CG2 THR A 11 3.429 -16.433 -27.532 1.00 0.00 C ATOM 0 H THR A 11 5.984 -14.739 -28.021 1.00 0.00 H new ATOM 0 HA THR A 11 6.085 -17.628 -27.445 1.00 0.00 H new ATOM 0 HB THR A 11 4.169 -18.039 -28.728 1.00 0.00 H new ATOM 0 HG1 THR A 11 3.233 -16.389 -30.104 1.00 0.00 H new ATOM 0 HG21 THR A 11 2.399 -16.551 -27.870 1.00 0.00 H new ATOM 0 HG22 THR A 11 3.570 -16.981 -26.600 1.00 0.00 H new ATOM 0 HG23 THR A 11 3.638 -15.376 -27.366 1.00 0.00 H new ATOM 173 N ASN A 12 7.774 -16.088 -29.408 1.00 0.00 N ATOM 174 CA ASN A 12 8.714 -16.085 -30.523 1.00 0.00 C ATOM 175 C ASN A 12 9.984 -15.321 -30.162 1.00 0.00 C ATOM 176 O ASN A 12 9.989 -14.508 -29.239 1.00 0.00 O ATOM 177 CB ASN A 12 8.066 -15.464 -31.762 1.00 0.00 C ATOM 178 CG ASN A 12 7.488 -14.090 -31.485 1.00 0.00 C ATOM 179 OD1 ASN A 12 7.791 -13.471 -30.465 1.00 0.00 O ATOM 180 ND2 ASN A 12 6.651 -13.606 -32.395 1.00 0.00 N ATOM 0 H ASN A 12 7.976 -15.399 -28.684 1.00 0.00 H new ATOM 0 HA ASN A 12 8.983 -17.118 -30.742 1.00 0.00 H new ATOM 0 HB2 ASN A 12 8.807 -15.390 -32.558 1.00 0.00 H new ATOM 0 HB3 ASN A 12 7.275 -16.122 -32.123 1.00 0.00 H new ATOM 0 HD21 ASN A 12 6.231 -12.686 -32.263 1.00 0.00 H new ATOM 0 HD22 ASN A 12 6.428 -14.154 -33.226 1.00 0.00 H new ATOM 187 N GLU A 13 11.059 -15.588 -30.898 1.00 0.00 N ATOM 188 CA GLU A 13 12.334 -14.925 -30.655 1.00 0.00 C ATOM 189 C GLU A 13 12.183 -13.408 -30.732 1.00 0.00 C ATOM 190 O GLU A 13 12.872 -12.669 -30.030 1.00 0.00 O ATOM 191 CB GLU A 13 13.381 -15.395 -31.667 1.00 0.00 C ATOM 192 CG GLU A 13 13.775 -16.854 -31.502 1.00 0.00 C ATOM 193 CD GLU A 13 15.047 -17.202 -32.250 1.00 0.00 C ATOM 194 OE1 GLU A 13 15.393 -16.476 -33.205 1.00 0.00 O ATOM 195 OE2 GLU A 13 15.697 -18.202 -31.879 1.00 0.00 O ATOM 0 H GLU A 13 11.072 -16.258 -31.667 1.00 0.00 H new ATOM 0 HA GLU A 13 12.665 -15.190 -29.651 1.00 0.00 H new ATOM 0 HB2 GLU A 13 12.994 -15.244 -32.675 1.00 0.00 H new ATOM 0 HB3 GLU A 13 14.271 -14.774 -31.571 1.00 0.00 H new ATOM 0 HG2 GLU A 13 13.909 -17.073 -30.443 1.00 0.00 H new ATOM 0 HG3 GLU A 13 12.963 -17.488 -31.858 1.00 0.00 H new ATOM 202 N GLU A 14 11.275 -12.953 -31.590 1.00 0.00 N ATOM 203 CA GLU A 14 11.034 -11.525 -31.760 1.00 0.00 C ATOM 204 C GLU A 14 10.597 -10.887 -30.444 1.00 0.00 C ATOM 205 O GLU A 14 11.222 -9.943 -29.963 1.00 0.00 O ATOM 206 CB GLU A 14 9.970 -11.289 -32.833 1.00 0.00 C ATOM 207 CG GLU A 14 9.872 -9.841 -33.285 1.00 0.00 C ATOM 208 CD GLU A 14 10.741 -9.548 -34.493 1.00 0.00 C ATOM 209 OE1 GLU A 14 11.863 -10.091 -34.564 1.00 0.00 O ATOM 210 OE2 GLU A 14 10.297 -8.774 -35.368 1.00 0.00 O ATOM 0 H GLU A 14 10.695 -13.552 -32.177 1.00 0.00 H new ATOM 0 HA GLU A 14 11.967 -11.060 -32.077 1.00 0.00 H new ATOM 0 HB2 GLU A 14 10.192 -11.916 -33.697 1.00 0.00 H new ATOM 0 HB3 GLU A 14 9.001 -11.607 -32.448 1.00 0.00 H new ATOM 0 HG2 GLU A 14 8.834 -9.608 -33.523 1.00 0.00 H new ATOM 0 HG3 GLU A 14 10.165 -9.187 -32.464 1.00 0.00 H new ATOM 217 N GLN A 15 9.518 -11.410 -29.870 1.00 0.00 N ATOM 218 CA GLN A 15 8.996 -10.891 -28.612 1.00 0.00 C ATOM 219 C GLN A 15 10.012 -11.064 -27.488 1.00 0.00 C ATOM 220 O GLN A 15 10.242 -10.148 -26.698 1.00 0.00 O ATOM 221 CB GLN A 15 7.689 -11.598 -28.247 1.00 0.00 C ATOM 222 CG GLN A 15 6.522 -11.219 -29.144 1.00 0.00 C ATOM 223 CD GLN A 15 5.256 -11.982 -28.808 1.00 0.00 C ATOM 224 OE1 GLN A 15 5.308 -13.086 -28.264 1.00 0.00 O ATOM 225 NE2 GLN A 15 4.108 -11.397 -29.130 1.00 0.00 N ATOM 0 H GLN A 15 8.989 -12.192 -30.256 1.00 0.00 H new ATOM 0 HA GLN A 15 8.801 -9.826 -28.741 1.00 0.00 H new ATOM 0 HB2 GLN A 15 7.842 -12.676 -28.299 1.00 0.00 H new ATOM 0 HB3 GLN A 15 7.434 -11.362 -27.214 1.00 0.00 H new ATOM 0 HG2 GLN A 15 6.332 -10.150 -29.054 1.00 0.00 H new ATOM 0 HG3 GLN A 15 6.791 -11.409 -30.183 1.00 0.00 H new ATOM 0 HE21 GLN A 15 4.111 -10.481 -29.580 1.00 0.00 H new ATOM 0 HE22 GLN A 15 3.224 -11.863 -28.928 1.00 0.00 H new ATOM 234 N VAL A 16 10.618 -12.246 -27.421 1.00 0.00 N ATOM 235 CA VAL A 16 11.610 -12.539 -26.394 1.00 0.00 C ATOM 236 C VAL A 16 12.774 -11.556 -26.458 1.00 0.00 C ATOM 237 O VAL A 16 13.174 -10.985 -25.444 1.00 0.00 O ATOM 238 CB VAL A 16 12.155 -13.973 -26.534 1.00 0.00 C ATOM 239 CG1 VAL A 16 13.349 -14.182 -25.615 1.00 0.00 C ATOM 240 CG2 VAL A 16 11.062 -14.989 -26.241 1.00 0.00 C ATOM 0 H VAL A 16 10.439 -13.016 -28.066 1.00 0.00 H new ATOM 0 HA VAL A 16 11.108 -12.441 -25.431 1.00 0.00 H new ATOM 0 HB VAL A 16 12.488 -14.118 -27.562 1.00 0.00 H new ATOM 0 HG11 VAL A 16 13.721 -15.200 -25.727 1.00 0.00 H new ATOM 0 HG12 VAL A 16 14.138 -13.477 -25.877 1.00 0.00 H new ATOM 0 HG13 VAL A 16 13.045 -14.019 -24.581 1.00 0.00 H new ATOM 0 HG21 VAL A 16 11.465 -15.997 -26.345 1.00 0.00 H new ATOM 0 HG22 VAL A 16 10.696 -14.847 -25.224 1.00 0.00 H new ATOM 0 HG23 VAL A 16 10.240 -14.853 -26.944 1.00 0.00 H new ATOM 250 N ALA A 17 13.313 -11.363 -27.658 1.00 0.00 N ATOM 251 CA ALA A 17 14.430 -10.447 -27.855 1.00 0.00 C ATOM 252 C ALA A 17 14.035 -9.017 -27.503 1.00 0.00 C ATOM 253 O ALA A 17 14.836 -8.258 -26.956 1.00 0.00 O ATOM 254 CB ALA A 17 14.926 -10.522 -29.291 1.00 0.00 C ATOM 0 H ALA A 17 12.994 -11.829 -28.508 1.00 0.00 H new ATOM 0 HA ALA A 17 15.237 -10.748 -27.187 1.00 0.00 H new ATOM 0 HB1 ALA A 17 15.760 -9.833 -29.424 1.00 0.00 H new ATOM 0 HB2 ALA A 17 15.256 -11.538 -29.509 1.00 0.00 H new ATOM 0 HB3 ALA A 17 14.118 -10.249 -29.970 1.00 0.00 H new ATOM 260 N PHE A 18 12.797 -8.654 -27.821 1.00 0.00 N ATOM 261 CA PHE A 18 12.297 -7.314 -27.540 1.00 0.00 C ATOM 262 C PHE A 18 12.187 -7.078 -26.036 1.00 0.00 C ATOM 263 O PHE A 18 12.602 -6.036 -25.528 1.00 0.00 O ATOM 264 CB PHE A 18 10.932 -7.107 -28.200 1.00 0.00 C ATOM 265 CG PHE A 18 10.270 -5.814 -27.816 1.00 0.00 C ATOM 266 CD1 PHE A 18 9.449 -5.745 -26.703 1.00 0.00 C ATOM 267 CD2 PHE A 18 10.469 -4.668 -28.570 1.00 0.00 C ATOM 268 CE1 PHE A 18 8.839 -4.556 -26.347 1.00 0.00 C ATOM 269 CE2 PHE A 18 9.862 -3.478 -28.219 1.00 0.00 C ATOM 270 CZ PHE A 18 9.045 -3.422 -27.107 1.00 0.00 C ATOM 0 H PHE A 18 12.121 -9.270 -28.274 1.00 0.00 H new ATOM 0 HA PHE A 18 13.006 -6.596 -27.952 1.00 0.00 H new ATOM 0 HB2 PHE A 18 11.053 -7.136 -29.283 1.00 0.00 H new ATOM 0 HB3 PHE A 18 10.277 -7.935 -27.930 1.00 0.00 H new ATOM 0 HD1 PHE A 18 9.283 -6.630 -26.106 1.00 0.00 H new ATOM 0 HD2 PHE A 18 11.106 -4.706 -29.442 1.00 0.00 H new ATOM 0 HE1 PHE A 18 8.202 -4.515 -25.476 1.00 0.00 H new ATOM 0 HE2 PHE A 18 10.026 -2.592 -28.814 1.00 0.00 H new ATOM 0 HZ PHE A 18 8.568 -2.493 -26.832 1.00 0.00 H new ATOM 280 N LEU A 19 11.626 -8.054 -25.330 1.00 0.00 N ATOM 281 CA LEU A 19 11.462 -7.954 -23.884 1.00 0.00 C ATOM 282 C LEU A 19 12.816 -7.898 -23.184 1.00 0.00 C ATOM 283 O LEU A 19 13.044 -7.051 -22.321 1.00 0.00 O ATOM 284 CB LEU A 19 10.652 -9.141 -23.360 1.00 0.00 C ATOM 285 CG LEU A 19 9.179 -9.182 -23.769 1.00 0.00 C ATOM 286 CD1 LEU A 19 8.582 -10.549 -23.475 1.00 0.00 C ATOM 287 CD2 LEU A 19 8.397 -8.091 -23.053 1.00 0.00 C ATOM 0 H LEU A 19 11.277 -8.923 -25.735 1.00 0.00 H new ATOM 0 HA LEU A 19 10.924 -7.031 -23.667 1.00 0.00 H new ATOM 0 HB2 LEU A 19 11.129 -10.060 -23.702 1.00 0.00 H new ATOM 0 HB3 LEU A 19 10.706 -9.140 -22.271 1.00 0.00 H new ATOM 0 HG LEU A 19 9.114 -9.003 -24.842 1.00 0.00 H new ATOM 0 HD11 LEU A 19 7.533 -10.560 -23.772 1.00 0.00 H new ATOM 0 HD12 LEU A 19 9.125 -11.311 -24.034 1.00 0.00 H new ATOM 0 HD13 LEU A 19 8.659 -10.758 -22.408 1.00 0.00 H new ATOM 0 HD21 LEU A 19 7.351 -8.135 -23.356 1.00 0.00 H new ATOM 0 HD22 LEU A 19 8.469 -8.239 -21.976 1.00 0.00 H new ATOM 0 HD23 LEU A 19 8.810 -7.117 -23.314 1.00 0.00 H new ATOM 299 N GLU A 20 13.710 -8.805 -23.564 1.00 0.00 N ATOM 300 CA GLU A 20 15.042 -8.858 -22.973 1.00 0.00 C ATOM 301 C GLU A 20 15.861 -7.632 -23.367 1.00 0.00 C ATOM 302 O GLU A 20 16.746 -7.200 -22.630 1.00 0.00 O ATOM 303 CB GLU A 20 15.769 -10.131 -23.410 1.00 0.00 C ATOM 304 CG GLU A 20 16.182 -10.125 -24.872 1.00 0.00 C ATOM 305 CD GLU A 20 16.730 -11.463 -25.329 1.00 0.00 C ATOM 306 OE1 GLU A 20 16.147 -12.502 -24.952 1.00 0.00 O ATOM 307 OE2 GLU A 20 17.740 -11.472 -26.063 1.00 0.00 O ATOM 0 H GLU A 20 13.536 -9.513 -24.278 1.00 0.00 H new ATOM 0 HA GLU A 20 14.930 -8.867 -21.889 1.00 0.00 H new ATOM 0 HB2 GLU A 20 16.656 -10.263 -22.791 1.00 0.00 H new ATOM 0 HB3 GLU A 20 15.122 -10.989 -23.227 1.00 0.00 H new ATOM 0 HG2 GLU A 20 15.322 -9.859 -25.487 1.00 0.00 H new ATOM 0 HG3 GLU A 20 16.937 -9.355 -25.029 1.00 0.00 H new ATOM 314 N ALA A 21 15.558 -7.076 -24.536 1.00 0.00 N ATOM 315 CA ALA A 21 16.264 -5.900 -25.029 1.00 0.00 C ATOM 316 C ALA A 21 15.927 -4.668 -24.195 1.00 0.00 C ATOM 317 O ALA A 21 16.819 -3.955 -23.734 1.00 0.00 O ATOM 318 CB ALA A 21 15.927 -5.656 -26.492 1.00 0.00 C ATOM 0 H ALA A 21 14.828 -7.422 -25.159 1.00 0.00 H new ATOM 0 HA ALA A 21 17.334 -6.086 -24.940 1.00 0.00 H new ATOM 0 HB1 ALA A 21 16.461 -4.775 -26.846 1.00 0.00 H new ATOM 0 HB2 ALA A 21 16.224 -6.522 -27.083 1.00 0.00 H new ATOM 0 HB3 ALA A 21 14.854 -5.496 -26.596 1.00 0.00 H new ATOM 324 N LEU A 22 14.635 -4.424 -24.005 1.00 0.00 N ATOM 325 CA LEU A 22 14.180 -3.277 -23.226 1.00 0.00 C ATOM 326 C LEU A 22 14.625 -3.395 -21.772 1.00 0.00 C ATOM 327 O LEU A 22 14.860 -2.390 -21.101 1.00 0.00 O ATOM 328 CB LEU A 22 12.656 -3.160 -23.297 1.00 0.00 C ATOM 329 CG LEU A 22 11.872 -3.981 -22.273 1.00 0.00 C ATOM 330 CD1 LEU A 22 11.650 -3.177 -21.001 1.00 0.00 C ATOM 331 CD2 LEU A 22 10.542 -4.434 -22.858 1.00 0.00 C ATOM 0 H LEU A 22 13.884 -5.004 -24.379 1.00 0.00 H new ATOM 0 HA LEU A 22 14.628 -2.379 -23.652 1.00 0.00 H new ATOM 0 HB2 LEU A 22 12.386 -2.111 -23.175 1.00 0.00 H new ATOM 0 HB3 LEU A 22 12.335 -3.458 -24.295 1.00 0.00 H new ATOM 0 HG LEU A 22 12.456 -4.866 -22.022 1.00 0.00 H new ATOM 0 HD11 LEU A 22 11.090 -3.778 -20.284 1.00 0.00 H new ATOM 0 HD12 LEU A 22 12.613 -2.903 -20.571 1.00 0.00 H new ATOM 0 HD13 LEU A 22 11.087 -2.274 -21.235 1.00 0.00 H new ATOM 0 HD21 LEU A 22 9.998 -5.017 -22.115 1.00 0.00 H new ATOM 0 HD22 LEU A 22 9.952 -3.562 -23.138 1.00 0.00 H new ATOM 0 HD23 LEU A 22 10.723 -5.048 -23.740 1.00 0.00 H new ATOM 343 N ALA A 23 14.741 -4.629 -21.292 1.00 0.00 N ATOM 344 CA ALA A 23 15.163 -4.878 -19.919 1.00 0.00 C ATOM 345 C ALA A 23 16.493 -4.195 -19.621 1.00 0.00 C ATOM 346 O ALA A 23 16.753 -3.785 -18.490 1.00 0.00 O ATOM 347 CB ALA A 23 15.266 -6.374 -19.662 1.00 0.00 C ATOM 0 H ALA A 23 14.549 -5.472 -21.834 1.00 0.00 H new ATOM 0 HA ALA A 23 14.411 -4.457 -19.252 1.00 0.00 H new ATOM 0 HB1 ALA A 23 15.582 -6.545 -18.633 1.00 0.00 H new ATOM 0 HB2 ALA A 23 14.294 -6.839 -19.825 1.00 0.00 H new ATOM 0 HB3 ALA A 23 15.996 -6.811 -20.343 1.00 0.00 H new ATOM 353 N LYS A 24 17.334 -4.076 -20.643 1.00 0.00 N ATOM 354 CA LYS A 24 18.639 -3.443 -20.492 1.00 0.00 C ATOM 355 C LYS A 24 18.489 -1.955 -20.189 1.00 0.00 C ATOM 356 O LYS A 24 19.379 -1.340 -19.603 1.00 0.00 O ATOM 357 CB LYS A 24 19.472 -3.635 -21.760 1.00 0.00 C ATOM 358 CG LYS A 24 19.457 -5.059 -22.288 1.00 0.00 C ATOM 359 CD LYS A 24 20.756 -5.405 -22.996 1.00 0.00 C ATOM 360 CE LYS A 24 20.928 -4.596 -24.273 1.00 0.00 C ATOM 361 NZ LYS A 24 22.202 -4.924 -24.970 1.00 0.00 N ATOM 0 H LYS A 24 17.135 -4.410 -21.586 1.00 0.00 H new ATOM 0 HA LYS A 24 19.151 -3.917 -19.654 1.00 0.00 H new ATOM 0 HB2 LYS A 24 19.099 -2.965 -22.535 1.00 0.00 H new ATOM 0 HB3 LYS A 24 20.502 -3.343 -21.556 1.00 0.00 H new ATOM 0 HG2 LYS A 24 19.296 -5.752 -21.463 1.00 0.00 H new ATOM 0 HG3 LYS A 24 18.622 -5.184 -22.977 1.00 0.00 H new ATOM 0 HD2 LYS A 24 21.597 -5.216 -22.329 1.00 0.00 H new ATOM 0 HD3 LYS A 24 20.770 -6.469 -23.233 1.00 0.00 H new ATOM 0 HE2 LYS A 24 20.089 -4.789 -24.941 1.00 0.00 H new ATOM 0 HE3 LYS A 24 20.908 -3.533 -24.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 22.282 -4.352 -25.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 23.005 -4.716 -24.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 22.211 -5.933 -25.220 1.00 0.00 H new ATOM 375 N GLN A 25 17.358 -1.385 -20.592 1.00 0.00 N ATOM 376 CA GLN A 25 17.093 0.031 -20.363 1.00 0.00 C ATOM 377 C GLN A 25 17.094 0.350 -18.872 1.00 0.00 C ATOM 378 O GLN A 25 16.112 0.100 -18.172 1.00 0.00 O ATOM 379 CB GLN A 25 15.751 0.426 -20.980 1.00 0.00 C ATOM 380 CG GLN A 25 15.679 0.194 -22.481 1.00 0.00 C ATOM 381 CD GLN A 25 14.909 1.282 -23.203 1.00 0.00 C ATOM 382 OE1 GLN A 25 15.380 1.836 -24.198 1.00 0.00 O ATOM 383 NE2 GLN A 25 13.718 1.595 -22.706 1.00 0.00 N ATOM 0 H GLN A 25 16.611 -1.881 -21.078 1.00 0.00 H new ATOM 0 HA GLN A 25 17.887 0.606 -20.840 1.00 0.00 H new ATOM 0 HB2 GLN A 25 14.957 -0.141 -20.495 1.00 0.00 H new ATOM 0 HB3 GLN A 25 15.562 1.480 -20.774 1.00 0.00 H new ATOM 0 HG2 GLN A 25 16.690 0.140 -22.885 1.00 0.00 H new ATOM 0 HG3 GLN A 25 15.207 -0.769 -22.674 1.00 0.00 H new ATOM 0 HE21 GLN A 25 13.367 1.111 -21.880 1.00 0.00 H new ATOM 0 HE22 GLN A 25 13.154 2.320 -23.150 1.00 0.00 H new ATOM 392 N ASP A 26 18.203 0.903 -18.391 1.00 0.00 N ATOM 393 CA ASP A 26 18.331 1.258 -16.983 1.00 0.00 C ATOM 394 C ASP A 26 17.495 2.491 -16.654 1.00 0.00 C ATOM 395 O ASP A 26 17.202 2.761 -15.489 1.00 0.00 O ATOM 396 CB ASP A 26 19.798 1.513 -16.631 1.00 0.00 C ATOM 397 CG ASP A 26 20.565 0.229 -16.381 1.00 0.00 C ATOM 398 OD1 ASP A 26 20.442 -0.329 -15.271 1.00 0.00 O ATOM 399 OD2 ASP A 26 21.288 -0.217 -17.296 1.00 0.00 O ATOM 0 H ASP A 26 19.026 1.115 -18.956 1.00 0.00 H new ATOM 0 HA ASP A 26 17.962 0.422 -16.389 1.00 0.00 H new ATOM 0 HB2 ASP A 26 20.273 2.064 -17.443 1.00 0.00 H new ATOM 0 HB3 ASP A 26 19.851 2.143 -15.743 1.00 0.00 H new ATOM 404 N GLU A 27 17.115 3.235 -17.688 1.00 0.00 N ATOM 405 CA GLU A 27 16.314 4.440 -17.507 1.00 0.00 C ATOM 406 C GLU A 27 14.933 4.097 -16.956 1.00 0.00 C ATOM 407 O GLU A 27 14.274 4.934 -16.336 1.00 0.00 O ATOM 408 CB GLU A 27 16.174 5.189 -18.834 1.00 0.00 C ATOM 409 CG GLU A 27 15.367 4.435 -19.877 1.00 0.00 C ATOM 410 CD GLU A 27 15.211 5.213 -21.169 1.00 0.00 C ATOM 411 OE1 GLU A 27 15.015 6.444 -21.101 1.00 0.00 O ATOM 412 OE2 GLU A 27 15.285 4.590 -22.249 1.00 0.00 O ATOM 0 H GLU A 27 17.349 3.025 -18.658 1.00 0.00 H new ATOM 0 HA GLU A 27 16.824 5.081 -16.788 1.00 0.00 H new ATOM 0 HB2 GLU A 27 15.701 6.154 -18.649 1.00 0.00 H new ATOM 0 HB3 GLU A 27 17.168 5.392 -19.233 1.00 0.00 H new ATOM 0 HG2 GLU A 27 15.853 3.482 -20.088 1.00 0.00 H new ATOM 0 HG3 GLU A 27 14.381 4.208 -19.473 1.00 0.00 H new ATOM 419 N LEU A 28 14.500 2.863 -17.185 1.00 0.00 N ATOM 420 CA LEU A 28 13.197 2.408 -16.712 1.00 0.00 C ATOM 421 C LEU A 28 13.198 2.234 -15.197 1.00 0.00 C ATOM 422 O LEU A 28 12.275 2.672 -14.511 1.00 0.00 O ATOM 423 CB LEU A 28 12.818 1.089 -17.388 1.00 0.00 C ATOM 424 CG LEU A 28 12.947 1.055 -18.912 1.00 0.00 C ATOM 425 CD1 LEU A 28 12.547 -0.310 -19.451 1.00 0.00 C ATOM 426 CD2 LEU A 28 12.099 2.150 -19.543 1.00 0.00 C ATOM 0 H LEU A 28 15.032 2.159 -17.696 1.00 0.00 H new ATOM 0 HA LEU A 28 12.459 3.167 -16.972 1.00 0.00 H new ATOM 0 HB2 LEU A 28 13.443 0.298 -16.973 1.00 0.00 H new ATOM 0 HB3 LEU A 28 11.787 0.852 -17.125 1.00 0.00 H new ATOM 0 HG LEU A 28 13.990 1.234 -19.174 1.00 0.00 H new ATOM 0 HD11 LEU A 28 12.645 -0.316 -20.537 1.00 0.00 H new ATOM 0 HD12 LEU A 28 13.196 -1.074 -19.024 1.00 0.00 H new ATOM 0 HD13 LEU A 28 11.513 -0.520 -19.179 1.00 0.00 H new ATOM 0 HD21 LEU A 28 12.203 2.111 -20.627 1.00 0.00 H new ATOM 0 HD22 LEU A 28 11.053 2.002 -19.273 1.00 0.00 H new ATOM 0 HD23 LEU A 28 12.433 3.123 -19.181 1.00 0.00 H new ATOM 438 N ASN A 29 14.242 1.593 -14.681 1.00 0.00 N ATOM 439 CA ASN A 29 14.365 1.362 -13.246 1.00 0.00 C ATOM 440 C ASN A 29 13.254 0.444 -12.746 1.00 0.00 C ATOM 441 O ASN A 29 12.800 0.564 -11.607 1.00 0.00 O ATOM 442 CB ASN A 29 14.322 2.692 -12.489 1.00 0.00 C ATOM 443 CG ASN A 29 14.990 2.605 -11.131 1.00 0.00 C ATOM 444 OD1 ASN A 29 16.118 2.126 -11.010 1.00 0.00 O ATOM 445 ND2 ASN A 29 14.295 3.069 -10.099 1.00 0.00 N ATOM 0 H ASN A 29 15.015 1.224 -15.235 1.00 0.00 H new ATOM 0 HA ASN A 29 15.324 0.877 -13.062 1.00 0.00 H new ATOM 0 HB2 ASN A 29 14.813 3.462 -13.084 1.00 0.00 H new ATOM 0 HB3 ASN A 29 13.285 3.001 -12.362 1.00 0.00 H new ATOM 0 HD21 ASN A 29 14.693 3.037 -9.160 1.00 0.00 H new ATOM 0 HD22 ASN A 29 13.363 3.458 -10.245 1.00 0.00 H new ATOM 452 N PHE A 30 12.820 -0.473 -13.604 1.00 0.00 N ATOM 453 CA PHE A 30 11.761 -1.411 -13.250 1.00 0.00 C ATOM 454 C PHE A 30 12.293 -2.511 -12.336 1.00 0.00 C ATOM 455 O PHE A 30 13.457 -2.490 -11.935 1.00 0.00 O ATOM 456 CB PHE A 30 11.156 -2.030 -14.512 1.00 0.00 C ATOM 457 CG PHE A 30 10.362 -1.057 -15.335 1.00 0.00 C ATOM 458 CD1 PHE A 30 9.689 -0.006 -14.732 1.00 0.00 C ATOM 459 CD2 PHE A 30 10.288 -1.192 -16.712 1.00 0.00 C ATOM 460 CE1 PHE A 30 8.956 0.890 -15.487 1.00 0.00 C ATOM 461 CE2 PHE A 30 9.557 -0.298 -17.472 1.00 0.00 C ATOM 462 CZ PHE A 30 8.891 0.745 -16.859 1.00 0.00 C ATOM 0 H PHE A 30 13.185 -0.587 -14.550 1.00 0.00 H new ATOM 0 HA PHE A 30 10.986 -0.861 -12.716 1.00 0.00 H new ATOM 0 HB2 PHE A 30 11.957 -2.443 -15.125 1.00 0.00 H new ATOM 0 HB3 PHE A 30 10.512 -2.862 -14.226 1.00 0.00 H new ATOM 0 HD1 PHE A 30 9.738 0.114 -13.660 1.00 0.00 H new ATOM 0 HD2 PHE A 30 10.807 -2.005 -17.197 1.00 0.00 H new ATOM 0 HE1 PHE A 30 8.434 1.703 -15.004 1.00 0.00 H new ATOM 0 HE2 PHE A 30 9.507 -0.415 -18.544 1.00 0.00 H new ATOM 0 HZ PHE A 30 8.321 1.446 -17.451 1.00 0.00 H new ATOM 472 N ASP A 31 11.433 -3.470 -12.011 1.00 0.00 N ATOM 473 CA ASP A 31 11.815 -4.579 -11.145 1.00 0.00 C ATOM 474 C ASP A 31 11.522 -5.917 -11.814 1.00 0.00 C ATOM 475 O ASP A 31 10.399 -6.420 -11.753 1.00 0.00 O ATOM 476 CB ASP A 31 11.075 -4.489 -9.809 1.00 0.00 C ATOM 477 CG ASP A 31 11.591 -3.362 -8.936 1.00 0.00 C ATOM 478 OD1 ASP A 31 11.866 -2.270 -9.477 1.00 0.00 O ATOM 479 OD2 ASP A 31 11.718 -3.571 -7.712 1.00 0.00 O ATOM 0 H ASP A 31 10.466 -3.502 -12.334 1.00 0.00 H new ATOM 0 HA ASP A 31 12.888 -4.512 -10.963 1.00 0.00 H new ATOM 0 HB2 ASP A 31 10.011 -4.342 -9.995 1.00 0.00 H new ATOM 0 HB3 ASP A 31 11.178 -5.434 -9.276 1.00 0.00 H new ATOM 484 N TRP A 32 12.536 -6.489 -12.453 1.00 0.00 N ATOM 485 CA TRP A 32 12.386 -7.769 -13.135 1.00 0.00 C ATOM 486 C TRP A 32 12.492 -8.927 -12.149 1.00 0.00 C ATOM 487 O TRP A 32 13.338 -8.916 -11.255 1.00 0.00 O ATOM 488 CB TRP A 32 13.446 -7.915 -14.228 1.00 0.00 C ATOM 489 CG TRP A 32 13.289 -6.927 -15.344 1.00 0.00 C ATOM 490 CD1 TRP A 32 13.670 -5.616 -15.337 1.00 0.00 C ATOM 491 CD2 TRP A 32 12.706 -7.171 -16.629 1.00 0.00 C ATOM 492 NE1 TRP A 32 13.360 -5.030 -16.541 1.00 0.00 N ATOM 493 CE2 TRP A 32 12.768 -5.963 -17.351 1.00 0.00 C ATOM 494 CE3 TRP A 32 12.140 -8.293 -17.240 1.00 0.00 C ATOM 495 CZ2 TRP A 32 12.284 -5.848 -18.651 1.00 0.00 C ATOM 496 CZ3 TRP A 32 11.660 -8.176 -18.531 1.00 0.00 C ATOM 497 CH2 TRP A 32 11.735 -6.962 -19.225 1.00 0.00 C ATOM 0 H TRP A 32 13.471 -6.086 -12.513 1.00 0.00 H new ATOM 0 HA TRP A 32 11.397 -7.795 -13.592 1.00 0.00 H new ATOM 0 HB2 TRP A 32 14.434 -7.796 -13.784 1.00 0.00 H new ATOM 0 HB3 TRP A 32 13.399 -8.924 -14.637 1.00 0.00 H new ATOM 0 HD1 TRP A 32 14.145 -5.113 -14.507 1.00 0.00 H new ATOM 0 HE1 TRP A 32 13.541 -4.058 -16.791 1.00 0.00 H new ATOM 0 HE3 TRP A 32 12.079 -9.234 -16.713 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 12.340 -4.912 -19.188 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 11.219 -9.036 -19.013 1.00 0.00 H new ATOM 0 HH2 TRP A 32 11.352 -6.904 -20.233 1.00 0.00 H new ATOM 508 N GLN A 33 11.630 -9.924 -12.319 1.00 0.00 N ATOM 509 CA GLN A 33 11.628 -11.089 -11.442 1.00 0.00 C ATOM 510 C GLN A 33 12.490 -12.206 -12.019 1.00 0.00 C ATOM 511 O GLN A 33 13.205 -12.891 -11.289 1.00 0.00 O ATOM 512 CB GLN A 33 10.198 -11.591 -11.229 1.00 0.00 C ATOM 513 CG GLN A 33 9.336 -10.641 -10.413 1.00 0.00 C ATOM 514 CD GLN A 33 9.997 -10.222 -9.115 1.00 0.00 C ATOM 515 OE1 GLN A 33 9.896 -10.914 -8.101 1.00 0.00 O ATOM 516 NE2 GLN A 33 10.678 -9.083 -9.139 1.00 0.00 N ATOM 0 H GLN A 33 10.925 -9.949 -13.055 1.00 0.00 H new ATOM 0 HA GLN A 33 12.048 -10.790 -10.482 1.00 0.00 H new ATOM 0 HB2 GLN A 33 9.729 -11.751 -12.200 1.00 0.00 H new ATOM 0 HB3 GLN A 33 10.232 -12.559 -10.728 1.00 0.00 H new ATOM 0 HG2 GLN A 33 9.117 -9.754 -11.007 1.00 0.00 H new ATOM 0 HG3 GLN A 33 8.382 -11.121 -10.192 1.00 0.00 H new ATOM 0 HE21 GLN A 33 10.736 -8.541 -10.001 1.00 0.00 H new ATOM 0 HE22 GLN A 33 11.144 -8.749 -8.295 1.00 0.00 H new ATOM 525 N ASN A 34 12.418 -12.384 -13.334 1.00 0.00 N ATOM 526 CA ASN A 34 13.192 -13.419 -14.009 1.00 0.00 C ATOM 527 C ASN A 34 13.619 -12.959 -15.400 1.00 0.00 C ATOM 528 O ASN A 34 12.903 -12.229 -16.086 1.00 0.00 O ATOM 529 CB ASN A 34 12.376 -14.709 -14.114 1.00 0.00 C ATOM 530 CG ASN A 34 10.990 -14.471 -14.682 1.00 0.00 C ATOM 531 OD1 ASN A 34 10.176 -13.765 -14.088 1.00 0.00 O ATOM 532 ND2 ASN A 34 10.716 -15.062 -15.840 1.00 0.00 N ATOM 0 H ASN A 34 11.831 -11.825 -13.953 1.00 0.00 H new ATOM 0 HA ASN A 34 14.088 -13.611 -13.418 1.00 0.00 H new ATOM 0 HB2 ASN A 34 12.907 -15.421 -14.745 1.00 0.00 H new ATOM 0 HB3 ASN A 34 12.288 -15.162 -13.126 1.00 0.00 H new ATOM 0 HD21 ASN A 34 9.800 -14.939 -16.271 1.00 0.00 H new ATOM 0 HD22 ASN A 34 11.422 -15.639 -16.298 1.00 0.00 H new ATOM 539 N PRO A 35 14.812 -13.397 -15.828 1.00 0.00 N ATOM 540 CA PRO A 35 15.361 -13.044 -17.140 1.00 0.00 C ATOM 541 C PRO A 35 14.599 -13.705 -18.284 1.00 0.00 C ATOM 542 O PRO A 35 14.631 -14.923 -18.460 1.00 0.00 O ATOM 543 CB PRO A 35 16.797 -13.571 -17.078 1.00 0.00 C ATOM 544 CG PRO A 35 16.752 -14.673 -16.077 1.00 0.00 C ATOM 545 CD PRO A 35 15.718 -14.270 -15.063 1.00 0.00 C ATOM 0 HA PRO A 35 15.294 -11.974 -17.335 1.00 0.00 H new ATOM 0 HB2 PRO A 35 17.128 -13.933 -18.051 1.00 0.00 H new ATOM 0 HB3 PRO A 35 17.493 -12.789 -16.775 1.00 0.00 H new ATOM 0 HG2 PRO A 35 16.487 -15.619 -16.550 1.00 0.00 H new ATOM 0 HG3 PRO A 35 17.725 -14.813 -15.607 1.00 0.00 H new ATOM 0 HD2 PRO A 35 15.194 -15.136 -14.657 1.00 0.00 H new ATOM 0 HD3 PRO A 35 16.166 -13.744 -14.220 1.00 0.00 H new ATOM 553 N PRO A 36 13.898 -12.886 -19.081 1.00 0.00 N ATOM 554 CA PRO A 36 13.116 -13.370 -20.222 1.00 0.00 C ATOM 555 C PRO A 36 13.999 -13.877 -21.357 1.00 0.00 C ATOM 556 O PRO A 36 14.203 -13.186 -22.356 1.00 0.00 O ATOM 557 CB PRO A 36 12.333 -12.132 -20.667 1.00 0.00 C ATOM 558 CG PRO A 36 13.155 -10.978 -20.206 1.00 0.00 C ATOM 559 CD PRO A 36 13.815 -11.423 -18.930 1.00 0.00 C ATOM 0 HA PRO A 36 12.485 -14.217 -19.953 1.00 0.00 H new ATOM 0 HB2 PRO A 36 12.199 -12.116 -21.749 1.00 0.00 H new ATOM 0 HB3 PRO A 36 11.338 -12.112 -20.222 1.00 0.00 H new ATOM 0 HG2 PRO A 36 13.898 -10.704 -20.955 1.00 0.00 H new ATOM 0 HG3 PRO A 36 12.533 -10.099 -20.038 1.00 0.00 H new ATOM 0 HD2 PRO A 36 14.801 -10.975 -18.810 1.00 0.00 H new ATOM 0 HD3 PRO A 36 13.229 -11.142 -18.055 1.00 0.00 H new ATOM 567 N THR A 37 14.521 -15.090 -21.198 1.00 0.00 N ATOM 568 CA THR A 37 15.383 -15.690 -22.209 1.00 0.00 C ATOM 569 C THR A 37 14.708 -16.889 -22.865 1.00 0.00 C ATOM 570 O THR A 37 15.010 -17.233 -24.007 1.00 0.00 O ATOM 571 CB THR A 37 16.728 -16.137 -21.606 1.00 0.00 C ATOM 572 OG1 THR A 37 17.177 -15.177 -20.643 1.00 0.00 O ATOM 573 CG2 THR A 37 17.779 -16.303 -22.693 1.00 0.00 C ATOM 0 H THR A 37 14.362 -15.676 -20.378 1.00 0.00 H new ATOM 0 HA THR A 37 15.568 -14.924 -22.962 1.00 0.00 H new ATOM 0 HB THR A 37 16.580 -17.099 -21.116 1.00 0.00 H new ATOM 0 HG1 THR A 37 18.032 -15.470 -20.263 1.00 0.00 H new ATOM 0 HG21 THR A 37 18.720 -16.619 -22.244 1.00 0.00 H new ATOM 0 HG22 THR A 37 17.447 -17.056 -23.408 1.00 0.00 H new ATOM 0 HG23 THR A 37 17.923 -15.353 -23.208 1.00 0.00 H new ATOM 581 N GLU A 38 13.794 -17.521 -22.135 1.00 0.00 N ATOM 582 CA GLU A 38 13.078 -18.682 -22.648 1.00 0.00 C ATOM 583 C GLU A 38 11.685 -18.291 -23.135 1.00 0.00 C ATOM 584 O GLU A 38 10.926 -17.612 -22.444 1.00 0.00 O ATOM 585 CB GLU A 38 12.967 -19.760 -21.566 1.00 0.00 C ATOM 586 CG GLU A 38 14.227 -20.596 -21.410 1.00 0.00 C ATOM 587 CD GLU A 38 14.589 -21.347 -22.675 1.00 0.00 C ATOM 588 OE1 GLU A 38 13.932 -22.369 -22.966 1.00 0.00 O ATOM 589 OE2 GLU A 38 15.529 -20.915 -23.375 1.00 0.00 O ATOM 0 H GLU A 38 13.533 -17.248 -21.188 1.00 0.00 H new ATOM 0 HA GLU A 38 13.641 -19.080 -23.492 1.00 0.00 H new ATOM 0 HB2 GLU A 38 12.736 -19.284 -20.613 1.00 0.00 H new ATOM 0 HB3 GLU A 38 12.131 -20.418 -21.804 1.00 0.00 H new ATOM 0 HG2 GLU A 38 15.056 -19.947 -21.127 1.00 0.00 H new ATOM 0 HG3 GLU A 38 14.088 -21.308 -20.597 1.00 0.00 H new ATOM 596 N PRO A 39 11.342 -18.730 -24.355 1.00 0.00 N ATOM 597 CA PRO A 39 10.040 -18.438 -24.963 1.00 0.00 C ATOM 598 C PRO A 39 8.898 -19.174 -24.270 1.00 0.00 C ATOM 599 O PRO A 39 9.029 -20.343 -23.909 1.00 0.00 O ATOM 600 CB PRO A 39 10.201 -18.936 -26.402 1.00 0.00 C ATOM 601 CG PRO A 39 11.258 -19.983 -26.324 1.00 0.00 C ATOM 602 CD PRO A 39 12.197 -19.544 -25.235 1.00 0.00 C ATOM 0 HA PRO A 39 9.784 -17.381 -24.889 1.00 0.00 H new ATOM 0 HB2 PRO A 39 9.266 -19.345 -26.786 1.00 0.00 H new ATOM 0 HB3 PRO A 39 10.494 -18.127 -27.071 1.00 0.00 H new ATOM 0 HG2 PRO A 39 10.826 -20.958 -26.097 1.00 0.00 H new ATOM 0 HG3 PRO A 39 11.782 -20.080 -27.275 1.00 0.00 H new ATOM 0 HD2 PRO A 39 12.624 -20.395 -24.705 1.00 0.00 H new ATOM 0 HD3 PRO A 39 13.031 -18.965 -25.632 1.00 0.00 H new ATOM 610 N GLY A 40 7.778 -18.481 -24.087 1.00 0.00 N ATOM 611 CA GLY A 40 6.630 -19.085 -23.438 1.00 0.00 C ATOM 612 C GLY A 40 6.655 -18.908 -21.933 1.00 0.00 C ATOM 613 O GLY A 40 5.695 -19.255 -21.245 1.00 0.00 O ATOM 0 H GLY A 40 7.646 -17.512 -24.377 1.00 0.00 H new ATOM 0 HA2 GLY A 40 5.717 -18.644 -23.837 1.00 0.00 H new ATOM 0 HA3 GLY A 40 6.600 -20.148 -23.675 1.00 0.00 H new ATOM 617 N GLN A 41 7.756 -18.368 -21.420 1.00 0.00 N ATOM 618 CA GLN A 41 7.902 -18.148 -19.986 1.00 0.00 C ATOM 619 C GLN A 41 7.354 -16.782 -19.586 1.00 0.00 C ATOM 620 O GLN A 41 7.764 -15.745 -20.106 1.00 0.00 O ATOM 621 CB GLN A 41 9.373 -18.259 -19.579 1.00 0.00 C ATOM 622 CG GLN A 41 9.584 -18.333 -18.076 1.00 0.00 C ATOM 623 CD GLN A 41 11.049 -18.289 -17.689 1.00 0.00 C ATOM 624 OE1 GLN A 41 11.686 -17.145 -17.910 1.00 0.00 O flip ATOM 625 NE2 GLN A 41 11.603 -19.273 -17.198 1.00 0.00 N flip ATOM 0 H GLN A 41 8.559 -18.075 -21.976 1.00 0.00 H new ATOM 0 HA GLN A 41 7.329 -18.916 -19.466 1.00 0.00 H new ATOM 0 HB2 GLN A 41 9.804 -19.147 -20.042 1.00 0.00 H new ATOM 0 HB3 GLN A 41 9.916 -17.399 -19.972 1.00 0.00 H new ATOM 0 HG2 GLN A 41 9.061 -17.504 -17.598 1.00 0.00 H new ATOM 0 HG3 GLN A 41 9.139 -19.252 -17.695 1.00 0.00 H new ATOM 0 HE21 GLN A 41 11.075 -20.132 -17.045 1.00 0.00 H new ATOM 0 HE22 GLN A 41 12.590 -19.229 -16.944 1.00 0.00 H new ATOM 634 N PRO A 42 6.403 -16.780 -18.640 1.00 0.00 N ATOM 635 CA PRO A 42 5.777 -15.549 -18.149 1.00 0.00 C ATOM 636 C PRO A 42 6.738 -14.700 -17.324 1.00 0.00 C ATOM 637 O PRO A 42 7.010 -15.004 -16.162 1.00 0.00 O ATOM 638 CB PRO A 42 4.628 -16.059 -17.275 1.00 0.00 C ATOM 639 CG PRO A 42 5.058 -17.417 -16.840 1.00 0.00 C ATOM 640 CD PRO A 42 5.866 -17.980 -17.976 1.00 0.00 C ATOM 0 HA PRO A 42 5.455 -14.902 -18.965 1.00 0.00 H new ATOM 0 HB2 PRO A 42 4.460 -15.404 -16.420 1.00 0.00 H new ATOM 0 HB3 PRO A 42 3.693 -16.100 -17.834 1.00 0.00 H new ATOM 0 HG2 PRO A 42 5.652 -17.364 -15.927 1.00 0.00 H new ATOM 0 HG3 PRO A 42 4.196 -18.048 -16.624 1.00 0.00 H new ATOM 0 HD2 PRO A 42 6.663 -18.632 -17.618 1.00 0.00 H new ATOM 0 HD3 PRO A 42 5.250 -18.572 -18.653 1.00 0.00 H new ATOM 648 N VAL A 43 7.249 -13.633 -17.931 1.00 0.00 N ATOM 649 CA VAL A 43 8.179 -12.739 -17.251 1.00 0.00 C ATOM 650 C VAL A 43 7.434 -11.679 -16.448 1.00 0.00 C ATOM 651 O VAL A 43 6.622 -10.930 -16.991 1.00 0.00 O ATOM 652 CB VAL A 43 9.120 -12.042 -18.251 1.00 0.00 C ATOM 653 CG1 VAL A 43 8.320 -11.245 -19.271 1.00 0.00 C ATOM 654 CG2 VAL A 43 10.108 -11.147 -17.518 1.00 0.00 C ATOM 0 H VAL A 43 7.035 -13.367 -18.892 1.00 0.00 H new ATOM 0 HA VAL A 43 8.772 -13.354 -16.574 1.00 0.00 H new ATOM 0 HB VAL A 43 9.685 -12.806 -18.785 1.00 0.00 H new ATOM 0 HG11 VAL A 43 9.002 -10.760 -19.969 1.00 0.00 H new ATOM 0 HG12 VAL A 43 7.657 -11.916 -19.818 1.00 0.00 H new ATOM 0 HG13 VAL A 43 7.727 -10.488 -18.757 1.00 0.00 H new ATOM 0 HG21 VAL A 43 10.765 -10.662 -18.240 1.00 0.00 H new ATOM 0 HG22 VAL A 43 9.564 -10.388 -16.956 1.00 0.00 H new ATOM 0 HG23 VAL A 43 10.704 -11.749 -16.832 1.00 0.00 H new ATOM 664 N VAL A 44 7.715 -11.621 -15.150 1.00 0.00 N ATOM 665 CA VAL A 44 7.073 -10.652 -14.270 1.00 0.00 C ATOM 666 C VAL A 44 7.915 -9.387 -14.139 1.00 0.00 C ATOM 667 O VAL A 44 9.128 -9.455 -13.939 1.00 0.00 O ATOM 668 CB VAL A 44 6.829 -11.241 -12.868 1.00 0.00 C ATOM 669 CG1 VAL A 44 5.958 -10.308 -12.041 1.00 0.00 C ATOM 670 CG2 VAL A 44 6.198 -12.621 -12.973 1.00 0.00 C ATOM 0 H VAL A 44 8.384 -12.234 -14.684 1.00 0.00 H new ATOM 0 HA VAL A 44 6.113 -10.401 -14.722 1.00 0.00 H new ATOM 0 HB VAL A 44 7.790 -11.344 -12.363 1.00 0.00 H new ATOM 0 HG11 VAL A 44 5.796 -10.741 -11.054 1.00 0.00 H new ATOM 0 HG12 VAL A 44 6.455 -9.343 -11.937 1.00 0.00 H new ATOM 0 HG13 VAL A 44 4.998 -10.170 -12.538 1.00 0.00 H new ATOM 0 HG21 VAL A 44 6.033 -13.022 -11.973 1.00 0.00 H new ATOM 0 HG22 VAL A 44 5.245 -12.546 -13.496 1.00 0.00 H new ATOM 0 HG23 VAL A 44 6.864 -13.285 -13.525 1.00 0.00 H new ATOM 680 N ILE A 45 7.263 -8.235 -14.253 1.00 0.00 N ATOM 681 CA ILE A 45 7.951 -6.955 -14.145 1.00 0.00 C ATOM 682 C ILE A 45 7.162 -5.978 -13.280 1.00 0.00 C ATOM 683 O ILE A 45 6.077 -5.533 -13.658 1.00 0.00 O ATOM 684 CB ILE A 45 8.185 -6.323 -15.530 1.00 0.00 C ATOM 685 CG1 ILE A 45 8.742 -7.365 -16.502 1.00 0.00 C ATOM 686 CG2 ILE A 45 9.130 -5.136 -15.418 1.00 0.00 C ATOM 687 CD1 ILE A 45 8.819 -6.877 -17.932 1.00 0.00 C ATOM 0 H ILE A 45 6.259 -8.162 -14.420 1.00 0.00 H new ATOM 0 HA ILE A 45 8.915 -7.154 -13.677 1.00 0.00 H new ATOM 0 HB ILE A 45 7.230 -5.967 -15.917 1.00 0.00 H new ATOM 0 HG12 ILE A 45 9.738 -7.661 -16.173 1.00 0.00 H new ATOM 0 HG13 ILE A 45 8.116 -8.257 -16.464 1.00 0.00 H new ATOM 0 HG21 ILE A 45 9.285 -4.700 -16.405 1.00 0.00 H new ATOM 0 HG22 ILE A 45 8.697 -4.387 -14.755 1.00 0.00 H new ATOM 0 HG23 ILE A 45 10.086 -5.469 -15.014 1.00 0.00 H new ATOM 0 HD11 ILE A 45 9.223 -7.667 -18.565 1.00 0.00 H new ATOM 0 HD12 ILE A 45 7.821 -6.608 -18.279 1.00 0.00 H new ATOM 0 HD13 ILE A 45 9.469 -6.003 -17.984 1.00 0.00 H new ATOM 699 N LEU A 46 7.714 -5.646 -12.118 1.00 0.00 N ATOM 700 CA LEU A 46 7.063 -4.719 -11.198 1.00 0.00 C ATOM 701 C LEU A 46 7.366 -3.273 -11.578 1.00 0.00 C ATOM 702 O LEU A 46 8.422 -2.740 -11.237 1.00 0.00 O ATOM 703 CB LEU A 46 7.520 -4.988 -9.764 1.00 0.00 C ATOM 704 CG LEU A 46 6.551 -5.782 -8.888 1.00 0.00 C ATOM 705 CD1 LEU A 46 6.806 -7.275 -9.025 1.00 0.00 C ATOM 706 CD2 LEU A 46 6.670 -5.351 -7.433 1.00 0.00 C ATOM 0 H LEU A 46 8.611 -6.005 -11.790 1.00 0.00 H new ATOM 0 HA LEU A 46 5.986 -4.875 -11.265 1.00 0.00 H new ATOM 0 HB2 LEU A 46 8.468 -5.525 -9.801 1.00 0.00 H new ATOM 0 HB3 LEU A 46 7.714 -4.031 -9.280 1.00 0.00 H new ATOM 0 HG LEU A 46 5.536 -5.575 -9.226 1.00 0.00 H new ATOM 0 HD11 LEU A 46 6.106 -7.823 -8.394 1.00 0.00 H new ATOM 0 HD12 LEU A 46 6.668 -7.574 -10.064 1.00 0.00 H new ATOM 0 HD13 LEU A 46 7.827 -7.500 -8.715 1.00 0.00 H new ATOM 0 HD21 LEU A 46 5.973 -5.927 -6.825 1.00 0.00 H new ATOM 0 HD22 LEU A 46 7.687 -5.527 -7.083 1.00 0.00 H new ATOM 0 HD23 LEU A 46 6.435 -4.290 -7.347 1.00 0.00 H new ATOM 718 N ILE A 47 6.432 -2.645 -12.284 1.00 0.00 N ATOM 719 CA ILE A 47 6.597 -1.260 -12.706 1.00 0.00 C ATOM 720 C ILE A 47 5.636 -0.339 -11.963 1.00 0.00 C ATOM 721 O ILE A 47 4.554 -0.744 -11.536 1.00 0.00 O ATOM 722 CB ILE A 47 6.372 -1.103 -14.222 1.00 0.00 C ATOM 723 CG1 ILE A 47 4.901 -1.341 -14.568 1.00 0.00 C ATOM 724 CG2 ILE A 47 7.265 -2.063 -14.992 1.00 0.00 C ATOM 725 CD1 ILE A 47 4.597 -1.204 -16.043 1.00 0.00 C ATOM 0 H ILE A 47 5.553 -3.073 -12.576 1.00 0.00 H new ATOM 0 HA ILE A 47 7.623 -0.978 -12.467 1.00 0.00 H new ATOM 0 HB ILE A 47 6.633 -0.085 -14.510 1.00 0.00 H new ATOM 0 HG12 ILE A 47 4.616 -2.340 -14.238 1.00 0.00 H new ATOM 0 HG13 ILE A 47 4.286 -0.634 -14.011 1.00 0.00 H new ATOM 0 HG21 ILE A 47 7.094 -1.940 -16.062 1.00 0.00 H new ATOM 0 HG22 ILE A 47 8.310 -1.850 -14.764 1.00 0.00 H new ATOM 0 HG23 ILE A 47 7.032 -3.088 -14.703 1.00 0.00 H new ATOM 0 HD11 ILE A 47 3.536 -1.386 -16.214 1.00 0.00 H new ATOM 0 HD12 ILE A 47 4.851 -0.197 -16.375 1.00 0.00 H new ATOM 0 HD13 ILE A 47 5.185 -1.930 -16.605 1.00 0.00 H new ATOM 737 N PRO A 48 6.036 0.931 -11.804 1.00 0.00 N ATOM 738 CA PRO A 48 5.223 1.937 -11.113 1.00 0.00 C ATOM 739 C PRO A 48 3.982 2.325 -11.909 1.00 0.00 C ATOM 740 O PRO A 48 3.921 2.120 -13.122 1.00 0.00 O ATOM 741 CB PRO A 48 6.171 3.132 -10.985 1.00 0.00 C ATOM 742 CG PRO A 48 7.143 2.966 -12.102 1.00 0.00 C ATOM 743 CD PRO A 48 7.313 1.483 -12.286 1.00 0.00 C ATOM 0 HA PRO A 48 4.846 1.571 -10.158 1.00 0.00 H new ATOM 0 HB2 PRO A 48 5.632 4.076 -11.067 1.00 0.00 H new ATOM 0 HB3 PRO A 48 6.675 3.136 -10.019 1.00 0.00 H new ATOM 0 HG2 PRO A 48 6.772 3.432 -13.015 1.00 0.00 H new ATOM 0 HG3 PRO A 48 8.095 3.442 -11.865 1.00 0.00 H new ATOM 0 HD2 PRO A 48 7.494 1.226 -13.330 1.00 0.00 H new ATOM 0 HD3 PRO A 48 8.158 1.101 -11.713 1.00 0.00 H new ATOM 751 N SER A 49 2.994 2.886 -11.220 1.00 0.00 N ATOM 752 CA SER A 49 1.752 3.299 -11.862 1.00 0.00 C ATOM 753 C SER A 49 2.003 4.433 -12.852 1.00 0.00 C ATOM 754 O SER A 49 1.152 4.744 -13.685 1.00 0.00 O ATOM 755 CB SER A 49 0.731 3.741 -10.811 1.00 0.00 C ATOM 756 OG SER A 49 0.114 2.622 -10.198 1.00 0.00 O ATOM 0 H SER A 49 3.030 3.065 -10.216 1.00 0.00 H new ATOM 0 HA SER A 49 1.353 2.444 -12.408 1.00 0.00 H new ATOM 0 HB2 SER A 49 1.225 4.349 -10.053 1.00 0.00 H new ATOM 0 HB3 SER A 49 -0.028 4.368 -11.278 1.00 0.00 H new ATOM 0 HG SER A 49 -0.533 2.931 -9.529 1.00 0.00 H new ATOM 762 N ASP A 50 3.177 5.046 -12.753 1.00 0.00 N ATOM 763 CA ASP A 50 3.543 6.145 -13.639 1.00 0.00 C ATOM 764 C ASP A 50 4.282 5.628 -14.869 1.00 0.00 C ATOM 765 O ASP A 50 4.811 6.408 -15.660 1.00 0.00 O ATOM 766 CB ASP A 50 4.412 7.160 -12.895 1.00 0.00 C ATOM 767 CG ASP A 50 4.495 8.491 -13.617 1.00 0.00 C ATOM 768 OD1 ASP A 50 3.456 8.950 -14.136 1.00 0.00 O ATOM 769 OD2 ASP A 50 5.599 9.073 -13.663 1.00 0.00 O ATOM 0 H ASP A 50 3.892 4.801 -12.068 1.00 0.00 H new ATOM 0 HA ASP A 50 2.627 6.635 -13.968 1.00 0.00 H new ATOM 0 HB2 ASP A 50 4.007 7.317 -11.895 1.00 0.00 H new ATOM 0 HB3 ASP A 50 5.416 6.753 -12.772 1.00 0.00 H new ATOM 774 N MET A 51 4.314 4.309 -15.022 1.00 0.00 N ATOM 775 CA MET A 51 4.989 3.688 -16.157 1.00 0.00 C ATOM 776 C MET A 51 4.137 2.570 -16.751 1.00 0.00 C ATOM 777 O MET A 51 4.599 1.809 -17.600 1.00 0.00 O ATOM 778 CB MET A 51 6.349 3.136 -15.729 1.00 0.00 C ATOM 779 CG MET A 51 7.366 4.215 -15.394 1.00 0.00 C ATOM 780 SD MET A 51 7.812 5.217 -16.825 1.00 0.00 S ATOM 781 CE MET A 51 8.517 3.972 -17.903 1.00 0.00 C ATOM 0 H MET A 51 3.881 3.649 -14.376 1.00 0.00 H new ATOM 0 HA MET A 51 5.139 4.451 -16.921 1.00 0.00 H new ATOM 0 HB2 MET A 51 6.213 2.494 -14.859 1.00 0.00 H new ATOM 0 HB3 MET A 51 6.746 2.510 -16.529 1.00 0.00 H new ATOM 0 HG2 MET A 51 6.961 4.861 -14.615 1.00 0.00 H new ATOM 0 HG3 MET A 51 8.264 3.749 -14.987 1.00 0.00 H new ATOM 0 HE1 MET A 51 9.015 4.457 -18.742 1.00 0.00 H new ATOM 0 HE2 MET A 51 9.241 3.377 -17.347 1.00 0.00 H new ATOM 0 HE3 MET A 51 7.725 3.323 -18.277 1.00 0.00 H new ATOM 791 N VAL A 52 2.891 2.478 -16.297 1.00 0.00 N ATOM 792 CA VAL A 52 1.974 1.453 -16.784 1.00 0.00 C ATOM 793 C VAL A 52 1.526 1.750 -18.211 1.00 0.00 C ATOM 794 O VAL A 52 1.598 0.889 -19.086 1.00 0.00 O ATOM 795 CB VAL A 52 0.732 1.336 -15.881 1.00 0.00 C ATOM 796 CG1 VAL A 52 -0.261 0.344 -16.466 1.00 0.00 C ATOM 797 CG2 VAL A 52 1.135 0.932 -14.471 1.00 0.00 C ATOM 0 H VAL A 52 2.493 3.100 -15.593 1.00 0.00 H new ATOM 0 HA VAL A 52 2.517 0.508 -16.766 1.00 0.00 H new ATOM 0 HB VAL A 52 0.247 2.311 -15.830 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -1.132 0.274 -15.815 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -0.573 0.681 -17.454 1.00 0.00 H new ATOM 0 HG13 VAL A 52 0.209 -0.636 -16.549 1.00 0.00 H new ATOM 0 HG21 VAL A 52 0.245 0.854 -13.846 1.00 0.00 H new ATOM 0 HG22 VAL A 52 1.644 -0.032 -14.500 1.00 0.00 H new ATOM 0 HG23 VAL A 52 1.806 1.684 -14.055 1.00 0.00 H new ATOM 807 N GLU A 53 1.064 2.976 -18.437 1.00 0.00 N ATOM 808 CA GLU A 53 0.604 3.387 -19.758 1.00 0.00 C ATOM 809 C GLU A 53 1.697 3.183 -20.803 1.00 0.00 C ATOM 810 O GLU A 53 1.422 2.788 -21.936 1.00 0.00 O ATOM 811 CB GLU A 53 0.169 4.854 -19.739 1.00 0.00 C ATOM 812 CG GLU A 53 -0.982 5.134 -18.787 1.00 0.00 C ATOM 813 CD GLU A 53 -2.337 4.892 -19.424 1.00 0.00 C ATOM 814 OE1 GLU A 53 -2.581 3.758 -19.886 1.00 0.00 O ATOM 815 OE2 GLU A 53 -3.153 5.836 -19.458 1.00 0.00 O ATOM 0 H GLU A 53 0.998 3.701 -17.723 1.00 0.00 H new ATOM 0 HA GLU A 53 -0.251 2.766 -20.025 1.00 0.00 H new ATOM 0 HB2 GLU A 53 1.021 5.473 -19.458 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -0.123 5.151 -20.746 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -0.881 4.502 -17.905 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -0.924 6.168 -18.447 1.00 0.00 H new ATOM 822 N TRP A 54 2.937 3.455 -20.413 1.00 0.00 N ATOM 823 CA TRP A 54 4.073 3.303 -21.316 1.00 0.00 C ATOM 824 C TRP A 54 4.247 1.846 -21.729 1.00 0.00 C ATOM 825 O TRP A 54 4.311 1.531 -22.918 1.00 0.00 O ATOM 826 CB TRP A 54 5.351 3.814 -20.651 1.00 0.00 C ATOM 827 CG TRP A 54 6.587 3.551 -21.458 1.00 0.00 C ATOM 828 CD1 TRP A 54 7.128 4.361 -22.415 1.00 0.00 C ATOM 829 CD2 TRP A 54 7.433 2.399 -21.379 1.00 0.00 C ATOM 830 NE1 TRP A 54 8.260 3.782 -22.936 1.00 0.00 N ATOM 831 CE2 TRP A 54 8.469 2.578 -22.317 1.00 0.00 C ATOM 832 CE3 TRP A 54 7.418 1.234 -20.607 1.00 0.00 C ATOM 833 CZ2 TRP A 54 9.476 1.635 -22.502 1.00 0.00 C ATOM 834 CZ3 TRP A 54 8.418 0.299 -20.792 1.00 0.00 C ATOM 835 CH2 TRP A 54 9.437 0.504 -21.732 1.00 0.00 C ATOM 0 H TRP A 54 3.182 3.782 -19.478 1.00 0.00 H new ATOM 0 HA TRP A 54 3.877 3.894 -22.211 1.00 0.00 H new ATOM 0 HB2 TRP A 54 5.259 4.887 -20.480 1.00 0.00 H new ATOM 0 HB3 TRP A 54 5.457 3.343 -19.674 1.00 0.00 H new ATOM 0 HD1 TRP A 54 6.725 5.316 -22.718 1.00 0.00 H new ATOM 0 HE1 TRP A 54 8.849 4.184 -23.665 1.00 0.00 H new ATOM 0 HE3 TRP A 54 6.638 1.068 -19.879 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 10.261 1.790 -23.228 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 8.414 -0.606 -20.202 1.00 0.00 H new ATOM 0 HH2 TRP A 54 10.206 -0.245 -21.851 1.00 0.00 H new ATOM 846 N PHE A 55 4.324 0.960 -20.742 1.00 0.00 N ATOM 847 CA PHE A 55 4.492 -0.465 -21.004 1.00 0.00 C ATOM 848 C PHE A 55 3.266 -1.036 -21.709 1.00 0.00 C ATOM 849 O PHE A 55 3.376 -1.953 -22.525 1.00 0.00 O ATOM 850 CB PHE A 55 4.740 -1.220 -19.696 1.00 0.00 C ATOM 851 CG PHE A 55 5.880 -2.195 -19.774 1.00 0.00 C ATOM 852 CD1 PHE A 55 6.064 -2.977 -20.903 1.00 0.00 C ATOM 853 CD2 PHE A 55 6.767 -2.330 -18.718 1.00 0.00 C ATOM 854 CE1 PHE A 55 7.112 -3.875 -20.977 1.00 0.00 C ATOM 855 CE2 PHE A 55 7.816 -3.227 -18.786 1.00 0.00 C ATOM 856 CZ PHE A 55 7.990 -4.000 -19.917 1.00 0.00 C ATOM 0 H PHE A 55 4.273 1.203 -19.753 1.00 0.00 H new ATOM 0 HA PHE A 55 5.356 -0.590 -21.657 1.00 0.00 H new ATOM 0 HB2 PHE A 55 4.942 -0.500 -18.903 1.00 0.00 H new ATOM 0 HB3 PHE A 55 3.833 -1.756 -19.417 1.00 0.00 H new ATOM 0 HD1 PHE A 55 5.381 -2.884 -21.734 1.00 0.00 H new ATOM 0 HD2 PHE A 55 6.637 -1.727 -17.831 1.00 0.00 H new ATOM 0 HE1 PHE A 55 7.245 -4.479 -21.863 1.00 0.00 H new ATOM 0 HE2 PHE A 55 8.499 -3.323 -17.955 1.00 0.00 H new ATOM 0 HZ PHE A 55 8.810 -4.700 -19.973 1.00 0.00 H new ATOM 866 N LEU A 56 2.099 -0.490 -21.389 1.00 0.00 N ATOM 867 CA LEU A 56 0.850 -0.945 -21.992 1.00 0.00 C ATOM 868 C LEU A 56 0.858 -0.715 -23.500 1.00 0.00 C ATOM 869 O LEU A 56 0.631 -1.640 -24.279 1.00 0.00 O ATOM 870 CB LEU A 56 -0.338 -0.218 -21.359 1.00 0.00 C ATOM 871 CG LEU A 56 -1.681 -0.948 -21.420 1.00 0.00 C ATOM 872 CD1 LEU A 56 -1.649 -2.197 -20.552 1.00 0.00 C ATOM 873 CD2 LEU A 56 -2.810 -0.025 -20.987 1.00 0.00 C ATOM 0 H LEU A 56 1.990 0.268 -20.716 1.00 0.00 H new ATOM 0 HA LEU A 56 0.754 -2.015 -21.808 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -0.102 -0.020 -20.314 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -0.450 0.749 -21.849 1.00 0.00 H new ATOM 0 HG LEU A 56 -1.862 -1.251 -22.451 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -2.613 -2.703 -20.608 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.866 -2.867 -20.907 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -1.446 -1.917 -19.518 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -3.758 -0.561 -21.037 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -2.635 0.309 -19.964 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -2.847 0.840 -21.649 1.00 0.00 H new ATOM 885 N GLU A 57 1.121 0.524 -23.903 1.00 0.00 N ATOM 886 CA GLU A 57 1.159 0.874 -25.318 1.00 0.00 C ATOM 887 C GLU A 57 2.365 0.238 -26.003 1.00 0.00 C ATOM 888 O GLU A 57 2.321 -0.080 -27.191 1.00 0.00 O ATOM 889 CB GLU A 57 1.204 2.394 -25.489 1.00 0.00 C ATOM 890 CG GLU A 57 -0.164 3.053 -25.435 1.00 0.00 C ATOM 891 CD GLU A 57 -0.461 3.882 -26.670 1.00 0.00 C ATOM 892 OE1 GLU A 57 0.420 4.662 -27.087 1.00 0.00 O ATOM 893 OE2 GLU A 57 -1.575 3.750 -27.219 1.00 0.00 O ATOM 0 H GLU A 57 1.311 1.301 -23.270 1.00 0.00 H new ATOM 0 HA GLU A 57 0.253 0.490 -25.786 1.00 0.00 H new ATOM 0 HB2 GLU A 57 1.835 2.820 -24.709 1.00 0.00 H new ATOM 0 HB3 GLU A 57 1.674 2.630 -26.444 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -0.929 2.285 -25.325 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -0.222 3.689 -24.552 1.00 0.00 H new ATOM 900 N MET A 58 3.442 0.057 -25.245 1.00 0.00 N ATOM 901 CA MET A 58 4.660 -0.541 -25.779 1.00 0.00 C ATOM 902 C MET A 58 4.421 -1.993 -26.182 1.00 0.00 C ATOM 903 O MET A 58 4.715 -2.392 -27.310 1.00 0.00 O ATOM 904 CB MET A 58 5.786 -0.465 -24.747 1.00 0.00 C ATOM 905 CG MET A 58 7.101 -1.049 -25.237 1.00 0.00 C ATOM 906 SD MET A 58 7.948 -2.014 -23.971 1.00 0.00 S ATOM 907 CE MET A 58 9.641 -1.484 -24.216 1.00 0.00 C ATOM 0 H MET A 58 3.496 0.316 -24.260 1.00 0.00 H new ATOM 0 HA MET A 58 4.952 0.021 -26.666 1.00 0.00 H new ATOM 0 HB2 MET A 58 5.942 0.577 -24.468 1.00 0.00 H new ATOM 0 HB3 MET A 58 5.477 -0.993 -23.845 1.00 0.00 H new ATOM 0 HG2 MET A 58 6.912 -1.681 -26.104 1.00 0.00 H new ATOM 0 HG3 MET A 58 7.752 -0.240 -25.568 1.00 0.00 H new ATOM 0 HE1 MET A 58 10.187 -1.565 -23.276 1.00 0.00 H new ATOM 0 HE2 MET A 58 10.115 -2.116 -24.967 1.00 0.00 H new ATOM 0 HE3 MET A 58 9.653 -0.448 -24.554 1.00 0.00 H new ATOM 917 N LEU A 59 3.888 -2.780 -25.254 1.00 0.00 N ATOM 918 CA LEU A 59 3.610 -4.188 -25.512 1.00 0.00 C ATOM 919 C LEU A 59 2.443 -4.344 -26.481 1.00 0.00 C ATOM 920 O LEU A 59 2.423 -5.260 -27.305 1.00 0.00 O ATOM 921 CB LEU A 59 3.301 -4.916 -24.202 1.00 0.00 C ATOM 922 CG LEU A 59 4.490 -5.157 -23.272 1.00 0.00 C ATOM 923 CD1 LEU A 59 4.010 -5.519 -21.875 1.00 0.00 C ATOM 924 CD2 LEU A 59 5.389 -6.252 -23.828 1.00 0.00 C ATOM 0 H LEU A 59 3.640 -2.467 -24.316 1.00 0.00 H new ATOM 0 HA LEU A 59 4.497 -4.630 -25.966 1.00 0.00 H new ATOM 0 HB2 LEU A 59 2.551 -4.342 -23.659 1.00 0.00 H new ATOM 0 HB3 LEU A 59 2.852 -5.880 -24.442 1.00 0.00 H new ATOM 0 HG LEU A 59 5.069 -4.236 -23.208 1.00 0.00 H new ATOM 0 HD11 LEU A 59 4.870 -5.687 -21.227 1.00 0.00 H new ATOM 0 HD12 LEU A 59 3.408 -4.704 -21.475 1.00 0.00 H new ATOM 0 HD13 LEU A 59 3.408 -6.426 -21.921 1.00 0.00 H new ATOM 0 HD21 LEU A 59 6.230 -6.410 -23.153 1.00 0.00 H new ATOM 0 HD22 LEU A 59 4.820 -7.177 -23.922 1.00 0.00 H new ATOM 0 HD23 LEU A 59 5.761 -5.954 -24.808 1.00 0.00 H new ATOM 936 N LYS A 60 1.472 -3.444 -26.379 1.00 0.00 N ATOM 937 CA LYS A 60 0.302 -3.478 -27.249 1.00 0.00 C ATOM 938 C LYS A 60 0.679 -3.123 -28.684 1.00 0.00 C ATOM 939 O LYS A 60 0.112 -3.660 -29.635 1.00 0.00 O ATOM 940 CB LYS A 60 -0.768 -2.509 -26.738 1.00 0.00 C ATOM 941 CG LYS A 60 -1.590 -3.064 -25.588 1.00 0.00 C ATOM 942 CD LYS A 60 -2.398 -1.973 -24.903 1.00 0.00 C ATOM 943 CE LYS A 60 -3.551 -1.502 -25.776 1.00 0.00 C ATOM 944 NZ LYS A 60 -4.605 -2.545 -25.912 1.00 0.00 N ATOM 0 H LYS A 60 1.472 -2.681 -25.702 1.00 0.00 H new ATOM 0 HA LYS A 60 -0.098 -4.492 -27.237 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -0.287 -1.585 -26.417 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -1.436 -2.251 -27.560 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -2.262 -3.837 -25.960 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -0.929 -3.538 -24.863 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -2.787 -2.347 -23.956 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -1.748 -1.129 -24.670 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -3.986 -0.599 -25.347 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -3.174 -1.236 -26.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -5.473 -2.114 -26.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -4.276 -3.288 -26.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -4.803 -2.962 -24.980 1.00 0.00 H new ATOM 958 N ALA A 61 1.641 -2.218 -28.831 1.00 0.00 N ATOM 959 CA ALA A 61 2.097 -1.795 -30.150 1.00 0.00 C ATOM 960 C ALA A 61 2.689 -2.966 -30.927 1.00 0.00 C ATOM 961 O ALA A 61 2.571 -3.036 -32.150 1.00 0.00 O ATOM 962 CB ALA A 61 3.117 -0.674 -30.021 1.00 0.00 C ATOM 0 H ALA A 61 2.120 -1.764 -28.053 1.00 0.00 H new ATOM 0 HA ALA A 61 1.235 -1.424 -30.704 1.00 0.00 H new ATOM 0 HB1 ALA A 61 3.449 -0.368 -31.013 1.00 0.00 H new ATOM 0 HB2 ALA A 61 2.661 0.176 -29.513 1.00 0.00 H new ATOM 0 HB3 ALA A 61 3.973 -1.025 -29.445 1.00 0.00 H new ATOM 968 N LYS A 62 3.329 -3.883 -30.209 1.00 0.00 N ATOM 969 CA LYS A 62 3.940 -5.052 -30.831 1.00 0.00 C ATOM 970 C LYS A 62 2.948 -6.208 -30.909 1.00 0.00 C ATOM 971 O LYS A 62 3.089 -7.104 -31.740 1.00 0.00 O ATOM 972 CB LYS A 62 5.181 -5.483 -30.045 1.00 0.00 C ATOM 973 CG LYS A 62 6.205 -4.375 -29.872 1.00 0.00 C ATOM 974 CD LYS A 62 6.618 -3.782 -31.208 1.00 0.00 C ATOM 975 CE LYS A 62 8.061 -3.303 -31.184 1.00 0.00 C ATOM 976 NZ LYS A 62 8.715 -3.444 -32.515 1.00 0.00 N ATOM 0 H LYS A 62 3.438 -3.839 -29.196 1.00 0.00 H new ATOM 0 HA LYS A 62 4.235 -4.781 -31.845 1.00 0.00 H new ATOM 0 HB2 LYS A 62 4.873 -5.839 -29.062 1.00 0.00 H new ATOM 0 HB3 LYS A 62 5.650 -6.324 -30.555 1.00 0.00 H new ATOM 0 HG2 LYS A 62 5.790 -3.591 -29.238 1.00 0.00 H new ATOM 0 HG3 LYS A 62 7.084 -4.767 -29.360 1.00 0.00 H new ATOM 0 HD2 LYS A 62 6.495 -4.529 -31.992 1.00 0.00 H new ATOM 0 HD3 LYS A 62 5.961 -2.948 -31.456 1.00 0.00 H new ATOM 0 HE2 LYS A 62 8.092 -2.259 -30.873 1.00 0.00 H new ATOM 0 HE3 LYS A 62 8.621 -3.873 -30.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 9.697 -3.107 -32.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 8.709 -4.444 -32.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 8.196 -2.880 -33.218 1.00 0.00 H new ATOM 990 N GLY A 63 1.944 -6.180 -30.038 1.00 0.00 N ATOM 991 CA GLY A 63 0.943 -7.231 -30.027 1.00 0.00 C ATOM 992 C GLY A 63 1.360 -8.421 -29.186 1.00 0.00 C ATOM 993 O GLY A 63 1.125 -9.569 -29.563 1.00 0.00 O ATOM 0 H GLY A 63 1.806 -5.449 -29.340 1.00 0.00 H new ATOM 0 HA2 GLY A 63 0.004 -6.830 -29.644 1.00 0.00 H new ATOM 0 HA3 GLY A 63 0.755 -7.560 -31.049 1.00 0.00 H new ATOM 997 N ILE A 64 1.982 -8.147 -28.044 1.00 0.00 N ATOM 998 CA ILE A 64 2.434 -9.204 -27.148 1.00 0.00 C ATOM 999 C ILE A 64 1.428 -9.442 -26.027 1.00 0.00 C ATOM 1000 O ILE A 64 0.958 -8.511 -25.372 1.00 0.00 O ATOM 1001 CB ILE A 64 3.805 -8.870 -26.529 1.00 0.00 C ATOM 1002 CG1 ILE A 64 4.767 -8.368 -27.608 1.00 0.00 C ATOM 1003 CG2 ILE A 64 4.379 -10.091 -25.826 1.00 0.00 C ATOM 1004 CD1 ILE A 64 6.192 -8.219 -27.124 1.00 0.00 C ATOM 0 H ILE A 64 2.184 -7.202 -27.718 1.00 0.00 H new ATOM 0 HA ILE A 64 2.526 -10.109 -27.749 1.00 0.00 H new ATOM 0 HB ILE A 64 3.672 -8.079 -25.791 1.00 0.00 H new ATOM 0 HG12 ILE A 64 4.748 -9.059 -28.450 1.00 0.00 H new ATOM 0 HG13 ILE A 64 4.415 -7.405 -27.978 1.00 0.00 H new ATOM 0 HG21 ILE A 64 5.348 -9.840 -25.394 1.00 0.00 H new ATOM 0 HG22 ILE A 64 3.700 -10.408 -25.035 1.00 0.00 H new ATOM 0 HG23 ILE A 64 4.502 -10.901 -26.545 1.00 0.00 H new ATOM 0 HD11 ILE A 64 6.818 -7.860 -27.941 1.00 0.00 H new ATOM 0 HD12 ILE A 64 6.224 -7.505 -26.301 1.00 0.00 H new ATOM 0 HD13 ILE A 64 6.563 -9.185 -26.781 1.00 0.00 H new ATOM 1016 N PRO A 65 1.088 -10.719 -25.798 1.00 0.00 N ATOM 1017 CA PRO A 65 0.136 -11.110 -24.754 1.00 0.00 C ATOM 1018 C PRO A 65 0.697 -10.905 -23.351 1.00 0.00 C ATOM 1019 O PRO A 65 1.562 -11.657 -22.902 1.00 0.00 O ATOM 1020 CB PRO A 65 -0.096 -12.599 -25.025 1.00 0.00 C ATOM 1021 CG PRO A 65 1.139 -13.053 -25.725 1.00 0.00 C ATOM 1022 CD PRO A 65 1.608 -11.880 -26.540 1.00 0.00 C ATOM 0 HA PRO A 65 -0.773 -10.510 -24.787 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -0.251 -13.151 -24.098 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -0.981 -12.756 -25.641 1.00 0.00 H new ATOM 0 HG2 PRO A 65 1.902 -13.361 -25.010 1.00 0.00 H new ATOM 0 HG3 PRO A 65 0.933 -13.913 -26.362 1.00 0.00 H new ATOM 0 HD2 PRO A 65 2.695 -11.853 -26.617 1.00 0.00 H new ATOM 0 HD3 PRO A 65 1.217 -11.915 -27.557 1.00 0.00 H new ATOM 1030 N PHE A 66 0.199 -9.883 -22.663 1.00 0.00 N ATOM 1031 CA PHE A 66 0.651 -9.579 -21.311 1.00 0.00 C ATOM 1032 C PHE A 66 -0.535 -9.334 -20.383 1.00 0.00 C ATOM 1033 O PHE A 66 -1.687 -9.325 -20.817 1.00 0.00 O ATOM 1034 CB PHE A 66 1.568 -8.354 -21.320 1.00 0.00 C ATOM 1035 CG PHE A 66 0.854 -7.074 -21.647 1.00 0.00 C ATOM 1036 CD1 PHE A 66 0.150 -6.389 -20.669 1.00 0.00 C ATOM 1037 CD2 PHE A 66 0.887 -6.554 -22.931 1.00 0.00 C ATOM 1038 CE1 PHE A 66 -0.509 -5.211 -20.967 1.00 0.00 C ATOM 1039 CE2 PHE A 66 0.231 -5.376 -23.234 1.00 0.00 C ATOM 1040 CZ PHE A 66 -0.467 -4.703 -22.251 1.00 0.00 C ATOM 0 H PHE A 66 -0.518 -9.251 -23.020 1.00 0.00 H new ATOM 0 HA PHE A 66 1.209 -10.439 -20.940 1.00 0.00 H new ATOM 0 HB2 PHE A 66 2.042 -8.257 -20.343 1.00 0.00 H new ATOM 0 HB3 PHE A 66 2.365 -8.512 -22.046 1.00 0.00 H new ATOM 0 HD1 PHE A 66 0.116 -6.780 -19.663 1.00 0.00 H new ATOM 0 HD2 PHE A 66 1.432 -7.075 -23.704 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -1.056 -4.688 -20.197 1.00 0.00 H new ATOM 0 HE2 PHE A 66 0.264 -4.982 -24.239 1.00 0.00 H new ATOM 0 HZ PHE A 66 -0.979 -3.781 -22.485 1.00 0.00 H new ATOM 1050 N THR A 67 -0.244 -9.135 -19.101 1.00 0.00 N ATOM 1051 CA THR A 67 -1.285 -8.891 -18.110 1.00 0.00 C ATOM 1052 C THR A 67 -0.797 -7.942 -17.022 1.00 0.00 C ATOM 1053 O THR A 67 0.370 -7.975 -16.633 1.00 0.00 O ATOM 1054 CB THR A 67 -1.757 -10.204 -17.457 1.00 0.00 C ATOM 1055 OG1 THR A 67 -1.408 -11.317 -18.286 1.00 0.00 O ATOM 1056 CG2 THR A 67 -3.261 -10.185 -17.230 1.00 0.00 C ATOM 0 H THR A 67 0.704 -9.138 -18.725 1.00 0.00 H new ATOM 0 HA THR A 67 -2.123 -8.434 -18.637 1.00 0.00 H new ATOM 0 HB THR A 67 -1.261 -10.302 -16.491 1.00 0.00 H new ATOM 0 HG1 THR A 67 -1.710 -12.148 -17.863 1.00 0.00 H new ATOM 0 HG21 THR A 67 -3.571 -11.122 -16.768 1.00 0.00 H new ATOM 0 HG22 THR A 67 -3.519 -9.354 -16.574 1.00 0.00 H new ATOM 0 HG23 THR A 67 -3.772 -10.065 -18.185 1.00 0.00 H new ATOM 1064 N VAL A 68 -1.699 -7.096 -16.533 1.00 0.00 N ATOM 1065 CA VAL A 68 -1.360 -6.137 -15.488 1.00 0.00 C ATOM 1066 C VAL A 68 -2.187 -6.381 -14.230 1.00 0.00 C ATOM 1067 O VAL A 68 -3.417 -6.403 -14.279 1.00 0.00 O ATOM 1068 CB VAL A 68 -1.580 -4.689 -15.962 1.00 0.00 C ATOM 1069 CG1 VAL A 68 -3.003 -4.502 -16.466 1.00 0.00 C ATOM 1070 CG2 VAL A 68 -1.271 -3.709 -14.840 1.00 0.00 C ATOM 0 H VAL A 68 -2.670 -7.055 -16.844 1.00 0.00 H new ATOM 0 HA VAL A 68 -0.304 -6.279 -15.258 1.00 0.00 H new ATOM 0 HB VAL A 68 -0.898 -4.488 -16.788 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -3.140 -3.472 -16.797 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -3.185 -5.179 -17.301 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -3.706 -4.721 -15.662 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -1.432 -2.690 -15.192 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -1.927 -3.908 -13.992 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -0.233 -3.826 -14.530 1.00 0.00 H new ATOM 1080 N TYR A 69 -1.504 -6.562 -13.106 1.00 0.00 N ATOM 1081 CA TYR A 69 -2.175 -6.806 -11.835 1.00 0.00 C ATOM 1082 C TYR A 69 -1.887 -5.683 -10.843 1.00 0.00 C ATOM 1083 O TYR A 69 -0.878 -4.985 -10.952 1.00 0.00 O ATOM 1084 CB TYR A 69 -1.730 -8.146 -11.248 1.00 0.00 C ATOM 1085 CG TYR A 69 -1.683 -9.266 -12.263 1.00 0.00 C ATOM 1086 CD1 TYR A 69 -2.840 -9.707 -12.893 1.00 0.00 C ATOM 1087 CD2 TYR A 69 -0.482 -9.883 -12.591 1.00 0.00 C ATOM 1088 CE1 TYR A 69 -2.803 -10.730 -13.820 1.00 0.00 C ATOM 1089 CE2 TYR A 69 -0.435 -10.906 -13.518 1.00 0.00 C ATOM 1090 CZ TYR A 69 -1.598 -11.326 -14.130 1.00 0.00 C ATOM 1091 OH TYR A 69 -1.555 -12.346 -15.053 1.00 0.00 O ATOM 0 H TYR A 69 -0.486 -6.544 -13.049 1.00 0.00 H new ATOM 0 HA TYR A 69 -3.249 -6.837 -12.020 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -0.742 -8.028 -10.803 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -2.410 -8.425 -10.443 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -3.785 -9.242 -12.654 1.00 0.00 H new ATOM 0 HD2 TYR A 69 0.430 -9.557 -12.113 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -3.712 -11.062 -14.300 1.00 0.00 H new ATOM 0 HE2 TYR A 69 0.507 -11.374 -13.762 1.00 0.00 H new ATOM 0 HH TYR A 69 -2.459 -12.522 -15.388 1.00 0.00 H new ATOM 1101 N VAL A 70 -2.781 -5.514 -9.874 1.00 0.00 N ATOM 1102 CA VAL A 70 -2.624 -4.478 -8.860 1.00 0.00 C ATOM 1103 C VAL A 70 -3.101 -4.966 -7.497 1.00 0.00 C ATOM 1104 O VAL A 70 -4.077 -5.710 -7.400 1.00 0.00 O ATOM 1105 CB VAL A 70 -3.400 -3.202 -9.237 1.00 0.00 C ATOM 1106 CG1 VAL A 70 -4.893 -3.486 -9.308 1.00 0.00 C ATOM 1107 CG2 VAL A 70 -3.108 -2.089 -8.242 1.00 0.00 C ATOM 0 H VAL A 70 -3.622 -6.082 -9.770 1.00 0.00 H new ATOM 0 HA VAL A 70 -1.560 -4.245 -8.807 1.00 0.00 H new ATOM 0 HB VAL A 70 -3.070 -2.874 -10.223 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -5.425 -2.573 -9.576 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -5.083 -4.250 -10.062 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -5.243 -3.838 -8.338 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -3.664 -1.195 -8.523 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -3.410 -2.405 -7.243 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -2.041 -1.869 -8.246 1.00 0.00 H new ATOM 1188 N THR B 4 -4.032 -16.273 -8.977 1.00 0.00 N ATOM 1189 CA THR B 4 -3.565 -15.695 -7.723 1.00 0.00 C ATOM 1190 C THR B 4 -2.042 -15.685 -7.656 1.00 0.00 C ATOM 1191 O THR B 4 -1.403 -16.737 -7.705 1.00 0.00 O ATOM 1192 CB THR B 4 -4.116 -16.467 -6.509 1.00 0.00 C ATOM 1193 OG1 THR B 4 -5.270 -17.223 -6.892 1.00 0.00 O ATOM 1194 CG2 THR B 4 -4.480 -15.513 -5.381 1.00 0.00 C ATOM 0 HA THR B 4 -3.934 -14.670 -7.690 1.00 0.00 H new ATOM 0 HB THR B 4 -3.340 -17.145 -6.154 1.00 0.00 H new ATOM 0 HG1 THR B 4 -5.334 -17.249 -7.870 1.00 0.00 H new ATOM 0 HG21 THR B 4 -4.867 -16.081 -4.535 1.00 0.00 H new ATOM 0 HG22 THR B 4 -3.593 -14.960 -5.072 1.00 0.00 H new ATOM 0 HG23 THR B 4 -5.241 -14.814 -5.727 1.00 0.00 H new ATOM 1202 N ILE B 5 -1.467 -14.493 -7.542 1.00 0.00 N ATOM 1203 CA ILE B 5 -0.019 -14.348 -7.466 1.00 0.00 C ATOM 1204 C ILE B 5 0.417 -13.907 -6.073 1.00 0.00 C ATOM 1205 O ILE B 5 0.078 -12.813 -5.622 1.00 0.00 O ATOM 1206 CB ILE B 5 0.500 -13.331 -8.500 1.00 0.00 C ATOM 1207 CG1 ILE B 5 0.133 -13.778 -9.917 1.00 0.00 C ATOM 1208 CG2 ILE B 5 2.006 -13.161 -8.366 1.00 0.00 C ATOM 1209 CD1 ILE B 5 -0.232 -12.634 -10.836 1.00 0.00 C ATOM 0 H ILE B 5 -1.982 -13.613 -7.500 1.00 0.00 H new ATOM 0 HA ILE B 5 0.408 -15.327 -7.685 1.00 0.00 H new ATOM 0 HB ILE B 5 0.027 -12.368 -8.309 1.00 0.00 H new ATOM 0 HG12 ILE B 5 0.973 -14.324 -10.346 1.00 0.00 H new ATOM 0 HG13 ILE B 5 -0.705 -14.473 -9.864 1.00 0.00 H new ATOM 0 HG21 ILE B 5 2.358 -12.439 -9.103 1.00 0.00 H new ATOM 0 HG22 ILE B 5 2.244 -12.802 -7.365 1.00 0.00 H new ATOM 0 HG23 ILE B 5 2.497 -14.120 -8.534 1.00 0.00 H new ATOM 0 HD11 ILE B 5 -0.480 -13.025 -11.823 1.00 0.00 H new ATOM 0 HD12 ILE B 5 -1.092 -12.101 -10.430 1.00 0.00 H new ATOM 0 HD13 ILE B 5 0.613 -11.950 -10.919 1.00 0.00 H new ATOM 1221 N PHE B 6 1.173 -14.765 -5.396 1.00 0.00 N ATOM 1222 CA PHE B 6 1.656 -14.465 -4.054 1.00 0.00 C ATOM 1223 C PHE B 6 3.102 -13.978 -4.093 1.00 0.00 C ATOM 1224 O PHE B 6 3.998 -14.694 -4.541 1.00 0.00 O ATOM 1225 CB PHE B 6 1.547 -15.702 -3.160 1.00 0.00 C ATOM 1226 CG PHE B 6 0.288 -15.741 -2.343 1.00 0.00 C ATOM 1227 CD1 PHE B 6 -0.954 -15.756 -2.959 1.00 0.00 C ATOM 1228 CD2 PHE B 6 0.345 -15.763 -0.959 1.00 0.00 C ATOM 1229 CE1 PHE B 6 -2.115 -15.793 -2.209 1.00 0.00 C ATOM 1230 CE2 PHE B 6 -0.813 -15.801 -0.204 1.00 0.00 C ATOM 1231 CZ PHE B 6 -2.044 -15.814 -0.830 1.00 0.00 C ATOM 0 H PHE B 6 1.464 -15.674 -5.755 1.00 0.00 H new ATOM 0 HA PHE B 6 1.034 -13.671 -3.641 1.00 0.00 H new ATOM 0 HB2 PHE B 6 1.595 -16.596 -3.782 1.00 0.00 H new ATOM 0 HB3 PHE B 6 2.406 -15.734 -2.490 1.00 0.00 H new ATOM 0 HD1 PHE B 6 -1.015 -15.739 -4.037 1.00 0.00 H new ATOM 0 HD2 PHE B 6 1.305 -15.750 -0.464 1.00 0.00 H new ATOM 0 HE1 PHE B 6 -3.076 -15.805 -2.701 1.00 0.00 H new ATOM 0 HE2 PHE B 6 -0.755 -15.820 0.874 1.00 0.00 H new ATOM 0 HZ PHE B 6 -2.950 -15.841 -0.242 1.00 0.00 H new ATOM 1241 N VAL B 7 3.322 -12.755 -3.622 1.00 0.00 N ATOM 1242 CA VAL B 7 4.658 -12.171 -3.602 1.00 0.00 C ATOM 1243 C VAL B 7 5.242 -12.184 -2.194 1.00 0.00 C ATOM 1244 O VAL B 7 4.803 -11.432 -1.322 1.00 0.00 O ATOM 1245 CB VAL B 7 4.646 -10.724 -4.128 1.00 0.00 C ATOM 1246 CG1 VAL B 7 6.065 -10.200 -4.283 1.00 0.00 C ATOM 1247 CG2 VAL B 7 3.892 -10.643 -5.447 1.00 0.00 C ATOM 0 H VAL B 7 2.592 -12.149 -3.249 1.00 0.00 H new ATOM 0 HA VAL B 7 5.280 -12.782 -4.256 1.00 0.00 H new ATOM 0 HB VAL B 7 4.130 -10.096 -3.401 1.00 0.00 H new ATOM 0 HG11 VAL B 7 6.036 -9.176 -4.656 1.00 0.00 H new ATOM 0 HG12 VAL B 7 6.568 -10.220 -3.316 1.00 0.00 H new ATOM 0 HG13 VAL B 7 6.610 -10.828 -4.988 1.00 0.00 H new ATOM 0 HG21 VAL B 7 3.893 -9.613 -5.804 1.00 0.00 H new ATOM 0 HG22 VAL B 7 4.377 -11.283 -6.184 1.00 0.00 H new ATOM 0 HG23 VAL B 7 2.864 -10.974 -5.299 1.00 0.00 H new ATOM 1257 N ILE B 8 6.234 -13.041 -1.978 1.00 0.00 N ATOM 1258 CA ILE B 8 6.880 -13.149 -0.676 1.00 0.00 C ATOM 1259 C ILE B 8 8.272 -12.528 -0.699 1.00 0.00 C ATOM 1260 O ILE B 8 9.029 -12.709 -1.653 1.00 0.00 O ATOM 1261 CB ILE B 8 6.992 -14.617 -0.225 1.00 0.00 C ATOM 1262 CG1 ILE B 8 5.668 -15.348 -0.457 1.00 0.00 C ATOM 1263 CG2 ILE B 8 7.394 -14.691 1.241 1.00 0.00 C ATOM 1264 CD1 ILE B 8 5.761 -16.845 -0.257 1.00 0.00 C ATOM 0 H ILE B 8 6.608 -13.671 -2.688 1.00 0.00 H new ATOM 0 HA ILE B 8 6.255 -12.606 0.033 1.00 0.00 H new ATOM 0 HB ILE B 8 7.764 -15.106 -0.819 1.00 0.00 H new ATOM 0 HG12 ILE B 8 4.916 -14.945 0.221 1.00 0.00 H new ATOM 0 HG13 ILE B 8 5.323 -15.146 -1.471 1.00 0.00 H new ATOM 0 HG21 ILE B 8 7.469 -15.735 1.545 1.00 0.00 H new ATOM 0 HG22 ILE B 8 8.359 -14.202 1.379 1.00 0.00 H new ATOM 0 HG23 ILE B 8 6.643 -14.189 1.850 1.00 0.00 H new ATOM 0 HD11 ILE B 8 4.786 -17.298 -0.438 1.00 0.00 H new ATOM 0 HD12 ILE B 8 6.489 -17.261 -0.954 1.00 0.00 H new ATOM 0 HD13 ILE B 8 6.075 -17.057 0.765 1.00 0.00 H new ATOM 1276 N VAL B 9 8.605 -11.796 0.359 1.00 0.00 N ATOM 1277 CA VAL B 9 9.908 -11.150 0.462 1.00 0.00 C ATOM 1278 C VAL B 9 10.581 -11.479 1.790 1.00 0.00 C ATOM 1279 O VAL B 9 10.286 -10.887 2.828 1.00 0.00 O ATOM 1280 CB VAL B 9 9.789 -9.620 0.325 1.00 0.00 C ATOM 1281 CG1 VAL B 9 11.160 -8.993 0.124 1.00 0.00 C ATOM 1282 CG2 VAL B 9 8.855 -9.259 -0.820 1.00 0.00 C ATOM 0 H VAL B 9 7.990 -11.635 1.157 1.00 0.00 H new ATOM 0 HA VAL B 9 10.517 -11.534 -0.356 1.00 0.00 H new ATOM 0 HB VAL B 9 9.366 -9.222 1.248 1.00 0.00 H new ATOM 0 HG11 VAL B 9 11.055 -7.912 0.029 1.00 0.00 H new ATOM 0 HG12 VAL B 9 11.794 -9.223 0.980 1.00 0.00 H new ATOM 0 HG13 VAL B 9 11.614 -9.394 -0.782 1.00 0.00 H new ATOM 0 HG21 VAL B 9 8.783 -8.175 -0.902 1.00 0.00 H new ATOM 0 HG22 VAL B 9 9.246 -9.668 -1.751 1.00 0.00 H new ATOM 0 HG23 VAL B 9 7.866 -9.675 -0.628 1.00 0.00 H new ATOM 1292 N PRO B 10 11.510 -12.447 1.758 1.00 0.00 N ATOM 1293 CA PRO B 10 12.246 -12.877 2.951 1.00 0.00 C ATOM 1294 C PRO B 10 13.226 -11.817 3.440 1.00 0.00 C ATOM 1295 O PRO B 10 13.822 -11.091 2.644 1.00 0.00 O ATOM 1296 CB PRO B 10 12.998 -14.121 2.474 1.00 0.00 C ATOM 1297 CG PRO B 10 13.143 -13.936 1.003 1.00 0.00 C ATOM 1298 CD PRO B 10 11.913 -13.195 0.556 1.00 0.00 C ATOM 0 HA PRO B 10 11.582 -13.061 3.796 1.00 0.00 H new ATOM 0 HB2 PRO B 10 13.970 -14.206 2.960 1.00 0.00 H new ATOM 0 HB3 PRO B 10 12.445 -15.031 2.706 1.00 0.00 H new ATOM 0 HG2 PRO B 10 14.046 -13.372 0.768 1.00 0.00 H new ATOM 0 HG3 PRO B 10 13.226 -14.897 0.495 1.00 0.00 H new ATOM 0 HD2 PRO B 10 12.127 -12.528 -0.279 1.00 0.00 H new ATOM 0 HD3 PRO B 10 11.130 -13.878 0.226 1.00 0.00 H new ATOM 1306 N THR B 11 13.391 -11.732 4.757 1.00 0.00 N ATOM 1307 CA THR B 11 14.299 -10.760 5.353 1.00 0.00 C ATOM 1308 C THR B 11 15.327 -11.444 6.247 1.00 0.00 C ATOM 1309 O THR B 11 15.923 -10.813 7.118 1.00 0.00 O ATOM 1310 CB THR B 11 13.533 -9.710 6.180 1.00 0.00 C ATOM 1311 OG1 THR B 11 13.111 -10.280 7.425 1.00 0.00 O ATOM 1312 CG2 THR B 11 12.323 -9.196 5.416 1.00 0.00 C ATOM 0 H THR B 11 12.907 -12.325 5.431 1.00 0.00 H new ATOM 0 HA THR B 11 14.812 -10.261 4.531 1.00 0.00 H new ATOM 0 HB THR B 11 14.203 -8.872 6.373 1.00 0.00 H new ATOM 0 HG1 THR B 11 12.626 -9.606 7.946 1.00 0.00 H new ATOM 0 HG21 THR B 11 11.798 -8.456 6.020 1.00 0.00 H new ATOM 0 HG22 THR B 11 12.650 -8.737 4.483 1.00 0.00 H new ATOM 0 HG23 THR B 11 11.652 -10.026 5.196 1.00 0.00 H new ATOM 1320 N ASN B 12 15.530 -12.738 6.024 1.00 0.00 N ATOM 1321 CA ASN B 12 16.487 -13.508 6.810 1.00 0.00 C ATOM 1322 C ASN B 12 16.534 -14.959 6.341 1.00 0.00 C ATOM 1323 O ASN B 12 15.679 -15.402 5.575 1.00 0.00 O ATOM 1324 CB ASN B 12 16.121 -13.452 8.295 1.00 0.00 C ATOM 1325 CG ASN B 12 14.677 -13.839 8.550 1.00 0.00 C ATOM 1326 OD1 ASN B 12 14.286 -14.988 8.349 1.00 0.00 O ATOM 1327 ND2 ASN B 12 13.877 -12.876 8.994 1.00 0.00 N ATOM 0 H ASN B 12 15.045 -13.275 5.306 1.00 0.00 H new ATOM 0 HA ASN B 12 17.474 -13.067 6.669 1.00 0.00 H new ATOM 0 HB2 ASN B 12 16.777 -14.120 8.853 1.00 0.00 H new ATOM 0 HB3 ASN B 12 16.296 -12.444 8.672 1.00 0.00 H new ATOM 0 HD21 ASN B 12 12.895 -13.076 9.183 1.00 0.00 H new ATOM 0 HD22 ASN B 12 14.245 -11.937 9.146 1.00 0.00 H new ATOM 1334 N GLU B 13 17.540 -15.694 6.807 1.00 0.00 N ATOM 1335 CA GLU B 13 17.698 -17.094 6.435 1.00 0.00 C ATOM 1336 C GLU B 13 16.446 -17.895 6.783 1.00 0.00 C ATOM 1337 O GLU B 13 16.078 -18.830 6.073 1.00 0.00 O ATOM 1338 CB GLU B 13 18.915 -17.698 7.139 1.00 0.00 C ATOM 1339 CG GLU B 13 19.041 -19.201 6.956 1.00 0.00 C ATOM 1340 CD GLU B 13 18.260 -19.983 7.995 1.00 0.00 C ATOM 1341 OE1 GLU B 13 18.452 -19.720 9.201 1.00 0.00 O ATOM 1342 OE2 GLU B 13 17.459 -20.856 7.602 1.00 0.00 O ATOM 0 H GLU B 13 18.257 -15.343 7.442 1.00 0.00 H new ATOM 0 HA GLU B 13 17.850 -17.141 5.357 1.00 0.00 H new ATOM 0 HB2 GLU B 13 19.818 -17.218 6.762 1.00 0.00 H new ATOM 0 HB3 GLU B 13 18.856 -17.474 8.204 1.00 0.00 H new ATOM 0 HG2 GLU B 13 18.688 -19.473 5.961 1.00 0.00 H new ATOM 0 HG3 GLU B 13 20.093 -19.483 7.009 1.00 0.00 H new ATOM 1349 N GLU B 14 15.799 -17.521 7.882 1.00 0.00 N ATOM 1350 CA GLU B 14 14.590 -18.205 8.325 1.00 0.00 C ATOM 1351 C GLU B 14 13.510 -18.155 7.248 1.00 0.00 C ATOM 1352 O GLU B 14 12.970 -19.187 6.849 1.00 0.00 O ATOM 1353 CB GLU B 14 14.065 -17.575 9.617 1.00 0.00 C ATOM 1354 CG GLU B 14 13.412 -18.572 10.560 1.00 0.00 C ATOM 1355 CD GLU B 14 14.370 -19.656 11.017 1.00 0.00 C ATOM 1356 OE1 GLU B 14 15.157 -19.395 11.951 1.00 0.00 O ATOM 1357 OE2 GLU B 14 14.332 -20.763 10.441 1.00 0.00 O ATOM 0 H GLU B 14 16.091 -16.749 8.481 1.00 0.00 H new ATOM 0 HA GLU B 14 14.843 -19.248 8.514 1.00 0.00 H new ATOM 0 HB2 GLU B 14 14.891 -17.086 10.134 1.00 0.00 H new ATOM 0 HB3 GLU B 14 13.342 -16.799 9.365 1.00 0.00 H new ATOM 0 HG2 GLU B 14 13.025 -18.043 11.431 1.00 0.00 H new ATOM 0 HG3 GLU B 14 12.559 -19.033 10.062 1.00 0.00 H new ATOM 1364 N GLN B 15 13.202 -16.949 6.782 1.00 0.00 N ATOM 1365 CA GLN B 15 12.186 -16.765 5.753 1.00 0.00 C ATOM 1366 C GLN B 15 12.601 -17.443 4.451 1.00 0.00 C ATOM 1367 O GLN B 15 11.827 -18.190 3.854 1.00 0.00 O ATOM 1368 CB GLN B 15 11.941 -15.275 5.509 1.00 0.00 C ATOM 1369 CG GLN B 15 11.838 -14.459 6.787 1.00 0.00 C ATOM 1370 CD GLN B 15 10.740 -13.415 6.726 1.00 0.00 C ATOM 1371 OE1 GLN B 15 10.690 -12.604 5.801 1.00 0.00 O ATOM 1372 NE2 GLN B 15 9.853 -13.430 7.714 1.00 0.00 N ATOM 0 H GLN B 15 13.641 -16.085 7.101 1.00 0.00 H new ATOM 0 HA GLN B 15 11.262 -17.226 6.104 1.00 0.00 H new ATOM 0 HB2 GLN B 15 12.751 -14.877 4.898 1.00 0.00 H new ATOM 0 HB3 GLN B 15 11.021 -15.155 4.936 1.00 0.00 H new ATOM 0 HG2 GLN B 15 11.651 -15.128 7.627 1.00 0.00 H new ATOM 0 HG3 GLN B 15 12.792 -13.967 6.977 1.00 0.00 H new ATOM 0 HE21 GLN B 15 9.933 -14.120 8.461 1.00 0.00 H new ATOM 0 HE22 GLN B 15 9.092 -12.751 7.726 1.00 0.00 H new ATOM 1381 N VAL B 16 13.829 -17.178 4.017 1.00 0.00 N ATOM 1382 CA VAL B 16 14.348 -17.763 2.786 1.00 0.00 C ATOM 1383 C VAL B 16 14.269 -19.285 2.825 1.00 0.00 C ATOM 1384 O VAL B 16 13.751 -19.913 1.903 1.00 0.00 O ATOM 1385 CB VAL B 16 15.809 -17.342 2.537 1.00 0.00 C ATOM 1386 CG1 VAL B 16 16.391 -18.106 1.357 1.00 0.00 C ATOM 1387 CG2 VAL B 16 15.899 -15.841 2.307 1.00 0.00 C ATOM 0 H VAL B 16 14.483 -16.562 4.500 1.00 0.00 H new ATOM 0 HA VAL B 16 13.726 -17.390 1.972 1.00 0.00 H new ATOM 0 HB VAL B 16 16.395 -17.587 3.423 1.00 0.00 H new ATOM 0 HG11 VAL B 16 17.423 -17.796 1.196 1.00 0.00 H new ATOM 0 HG12 VAL B 16 16.362 -19.175 1.566 1.00 0.00 H new ATOM 0 HG13 VAL B 16 15.805 -17.895 0.462 1.00 0.00 H new ATOM 0 HG21 VAL B 16 16.938 -15.561 2.133 1.00 0.00 H new ATOM 0 HG22 VAL B 16 15.300 -15.569 1.438 1.00 0.00 H new ATOM 0 HG23 VAL B 16 15.524 -15.315 3.185 1.00 0.00 H new ATOM 1397 N ALA B 17 14.786 -19.871 3.900 1.00 0.00 N ATOM 1398 CA ALA B 17 14.771 -21.320 4.061 1.00 0.00 C ATOM 1399 C ALA B 17 13.345 -21.860 4.046 1.00 0.00 C ATOM 1400 O ALA B 17 13.073 -22.908 3.460 1.00 0.00 O ATOM 1401 CB ALA B 17 15.473 -21.714 5.352 1.00 0.00 C ATOM 0 H ALA B 17 15.220 -19.365 4.672 1.00 0.00 H new ATOM 0 HA ALA B 17 15.306 -21.760 3.220 1.00 0.00 H new ATOM 0 HB1 ALA B 17 15.455 -22.798 5.460 1.00 0.00 H new ATOM 0 HB2 ALA B 17 16.507 -21.370 5.324 1.00 0.00 H new ATOM 0 HB3 ALA B 17 14.961 -21.256 6.199 1.00 0.00 H new ATOM 1407 N PHE B 18 12.437 -21.137 4.694 1.00 0.00 N ATOM 1408 CA PHE B 18 11.038 -21.545 4.757 1.00 0.00 C ATOM 1409 C PHE B 18 10.412 -21.556 3.366 1.00 0.00 C ATOM 1410 O PHE B 18 9.664 -22.470 3.016 1.00 0.00 O ATOM 1411 CB PHE B 18 10.252 -20.607 5.675 1.00 0.00 C ATOM 1412 CG PHE B 18 8.803 -20.975 5.809 1.00 0.00 C ATOM 1413 CD1 PHE B 18 7.862 -20.476 4.923 1.00 0.00 C ATOM 1414 CD2 PHE B 18 8.380 -21.821 6.823 1.00 0.00 C ATOM 1415 CE1 PHE B 18 6.527 -20.813 5.043 1.00 0.00 C ATOM 1416 CE2 PHE B 18 7.046 -22.162 6.948 1.00 0.00 C ATOM 1417 CZ PHE B 18 6.119 -21.657 6.058 1.00 0.00 C ATOM 0 H PHE B 18 12.645 -20.266 5.183 1.00 0.00 H new ATOM 0 HA PHE B 18 10.998 -22.556 5.162 1.00 0.00 H new ATOM 0 HB2 PHE B 18 10.712 -20.609 6.663 1.00 0.00 H new ATOM 0 HB3 PHE B 18 10.326 -19.590 5.291 1.00 0.00 H new ATOM 0 HD1 PHE B 18 8.176 -19.815 4.128 1.00 0.00 H new ATOM 0 HD2 PHE B 18 9.101 -22.218 7.523 1.00 0.00 H new ATOM 0 HE1 PHE B 18 5.804 -20.417 4.345 1.00 0.00 H new ATOM 0 HE2 PHE B 18 6.729 -22.823 7.741 1.00 0.00 H new ATOM 0 HZ PHE B 18 5.076 -21.921 6.155 1.00 0.00 H new ATOM 1427 N LEU B 19 10.722 -20.533 2.576 1.00 0.00 N ATOM 1428 CA LEU B 19 10.190 -20.423 1.222 1.00 0.00 C ATOM 1429 C LEU B 19 10.798 -21.485 0.311 1.00 0.00 C ATOM 1430 O LEU B 19 10.080 -22.215 -0.372 1.00 0.00 O ATOM 1431 CB LEU B 19 10.467 -19.030 0.656 1.00 0.00 C ATOM 1432 CG LEU B 19 9.395 -17.972 0.923 1.00 0.00 C ATOM 1433 CD1 LEU B 19 8.895 -18.068 2.356 1.00 0.00 C ATOM 1434 CD2 LEU B 19 9.937 -16.579 0.638 1.00 0.00 C ATOM 0 H LEU B 19 11.339 -19.768 2.850 1.00 0.00 H new ATOM 0 HA LEU B 19 9.113 -20.582 1.267 1.00 0.00 H new ATOM 0 HB2 LEU B 19 11.411 -18.674 1.067 1.00 0.00 H new ATOM 0 HB3 LEU B 19 10.602 -19.118 -0.422 1.00 0.00 H new ATOM 0 HG LEU B 19 8.555 -18.157 0.253 1.00 0.00 H new ATOM 0 HD11 LEU B 19 8.133 -17.308 2.527 1.00 0.00 H new ATOM 0 HD12 LEU B 19 8.467 -19.056 2.527 1.00 0.00 H new ATOM 0 HD13 LEU B 19 9.726 -17.910 3.043 1.00 0.00 H new ATOM 0 HD21 LEU B 19 9.161 -15.839 0.833 1.00 0.00 H new ATOM 0 HD22 LEU B 19 10.795 -16.384 1.282 1.00 0.00 H new ATOM 0 HD23 LEU B 19 10.245 -16.515 -0.406 1.00 0.00 H new ATOM 1446 N GLU B 20 12.125 -21.565 0.307 1.00 0.00 N ATOM 1447 CA GLU B 20 12.828 -22.538 -0.520 1.00 0.00 C ATOM 1448 C GLU B 20 12.486 -23.963 -0.094 1.00 0.00 C ATOM 1449 O GLU B 20 12.567 -24.897 -0.891 1.00 0.00 O ATOM 1450 CB GLU B 20 14.340 -22.318 -0.432 1.00 0.00 C ATOM 1451 CG GLU B 20 14.956 -22.832 0.858 1.00 0.00 C ATOM 1452 CD GLU B 20 16.387 -22.366 1.047 1.00 0.00 C ATOM 1453 OE1 GLU B 20 16.746 -21.310 0.488 1.00 0.00 O ATOM 1454 OE2 GLU B 20 17.147 -23.060 1.755 1.00 0.00 O ATOM 0 H GLU B 20 12.734 -20.968 0.867 1.00 0.00 H new ATOM 0 HA GLU B 20 12.507 -22.398 -1.552 1.00 0.00 H new ATOM 0 HB2 GLU B 20 14.820 -22.813 -1.276 1.00 0.00 H new ATOM 0 HB3 GLU B 20 14.550 -21.252 -0.525 1.00 0.00 H new ATOM 0 HG2 GLU B 20 14.354 -22.497 1.703 1.00 0.00 H new ATOM 0 HG3 GLU B 20 14.929 -23.922 0.860 1.00 0.00 H new ATOM 1461 N ALA B 21 12.103 -24.121 1.169 1.00 0.00 N ATOM 1462 CA ALA B 21 11.746 -25.430 1.701 1.00 0.00 C ATOM 1463 C ALA B 21 10.362 -25.858 1.225 1.00 0.00 C ATOM 1464 O ALA B 21 10.181 -26.971 0.731 1.00 0.00 O ATOM 1465 CB ALA B 21 11.802 -25.414 3.222 1.00 0.00 C ATOM 0 H ALA B 21 12.032 -23.358 1.843 1.00 0.00 H new ATOM 0 HA ALA B 21 12.469 -26.156 1.329 1.00 0.00 H new ATOM 0 HB1 ALA B 21 11.533 -26.398 3.606 1.00 0.00 H new ATOM 0 HB2 ALA B 21 12.811 -25.161 3.546 1.00 0.00 H new ATOM 0 HB3 ALA B 21 11.102 -24.671 3.604 1.00 0.00 H new ATOM 1471 N LEU B 22 9.388 -24.967 1.377 1.00 0.00 N ATOM 1472 CA LEU B 22 8.019 -25.253 0.963 1.00 0.00 C ATOM 1473 C LEU B 22 7.936 -25.447 -0.548 1.00 0.00 C ATOM 1474 O LEU B 22 7.105 -26.209 -1.041 1.00 0.00 O ATOM 1475 CB LEU B 22 7.087 -24.119 1.395 1.00 0.00 C ATOM 1476 CG LEU B 22 6.896 -22.986 0.386 1.00 0.00 C ATOM 1477 CD1 LEU B 22 5.755 -23.307 -0.567 1.00 0.00 C ATOM 1478 CD2 LEU B 22 6.638 -21.670 1.105 1.00 0.00 C ATOM 0 H LEU B 22 9.521 -24.041 1.784 1.00 0.00 H new ATOM 0 HA LEU B 22 7.705 -26.178 1.447 1.00 0.00 H new ATOM 0 HB2 LEU B 22 6.110 -24.545 1.622 1.00 0.00 H new ATOM 0 HB3 LEU B 22 7.472 -23.693 2.321 1.00 0.00 H new ATOM 0 HG LEU B 22 7.812 -22.886 -0.197 1.00 0.00 H new ATOM 0 HD11 LEU B 22 5.634 -22.490 -1.278 1.00 0.00 H new ATOM 0 HD12 LEU B 22 5.980 -24.227 -1.107 1.00 0.00 H new ATOM 0 HD13 LEU B 22 4.833 -23.435 -0.000 1.00 0.00 H new ATOM 0 HD21 LEU B 22 6.504 -20.875 0.372 1.00 0.00 H new ATOM 0 HD22 LEU B 22 5.738 -21.758 1.713 1.00 0.00 H new ATOM 0 HD23 LEU B 22 7.487 -21.433 1.746 1.00 0.00 H new ATOM 1490 N ALA B 23 8.804 -24.753 -1.276 1.00 0.00 N ATOM 1491 CA ALA B 23 8.832 -24.852 -2.730 1.00 0.00 C ATOM 1492 C ALA B 23 9.047 -26.293 -3.178 1.00 0.00 C ATOM 1493 O ALA B 23 8.594 -26.696 -4.250 1.00 0.00 O ATOM 1494 CB ALA B 23 9.919 -23.952 -3.300 1.00 0.00 C ATOM 0 H ALA B 23 9.497 -24.116 -0.883 1.00 0.00 H new ATOM 0 HA ALA B 23 7.866 -24.521 -3.110 1.00 0.00 H new ATOM 0 HB1 ALA B 23 9.928 -24.036 -4.387 1.00 0.00 H new ATOM 0 HB2 ALA B 23 9.720 -22.918 -3.018 1.00 0.00 H new ATOM 0 HB3 ALA B 23 10.888 -24.256 -2.904 1.00 0.00 H new ATOM 1500 N LYS B 24 9.743 -27.067 -2.352 1.00 0.00 N ATOM 1501 CA LYS B 24 10.019 -28.465 -2.663 1.00 0.00 C ATOM 1502 C LYS B 24 8.734 -29.288 -2.656 1.00 0.00 C ATOM 1503 O LYS B 24 8.649 -30.326 -3.312 1.00 0.00 O ATOM 1504 CB LYS B 24 11.014 -29.046 -1.655 1.00 0.00 C ATOM 1505 CG LYS B 24 12.339 -28.305 -1.613 1.00 0.00 C ATOM 1506 CD LYS B 24 13.137 -28.660 -0.369 1.00 0.00 C ATOM 1507 CE LYS B 24 14.025 -29.872 -0.604 1.00 0.00 C ATOM 1508 NZ LYS B 24 15.166 -29.917 0.352 1.00 0.00 N ATOM 0 H LYS B 24 10.126 -26.750 -1.462 1.00 0.00 H new ATOM 0 HA LYS B 24 10.454 -28.510 -3.662 1.00 0.00 H new ATOM 0 HB2 LYS B 24 10.565 -29.027 -0.662 1.00 0.00 H new ATOM 0 HB3 LYS B 24 11.199 -30.091 -1.901 1.00 0.00 H new ATOM 0 HG2 LYS B 24 12.921 -28.548 -2.502 1.00 0.00 H new ATOM 0 HG3 LYS B 24 12.157 -27.231 -1.635 1.00 0.00 H new ATOM 0 HD2 LYS B 24 13.751 -27.809 -0.074 1.00 0.00 H new ATOM 0 HD3 LYS B 24 12.455 -28.862 0.457 1.00 0.00 H new ATOM 0 HE2 LYS B 24 13.432 -30.781 -0.505 1.00 0.00 H new ATOM 0 HE3 LYS B 24 14.407 -29.850 -1.625 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 15.747 -30.757 0.159 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 15.746 -29.061 0.240 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 14.802 -29.964 1.325 1.00 0.00 H new ATOM 1522 N GLN B 25 7.739 -28.816 -1.913 1.00 0.00 N ATOM 1523 CA GLN B 25 6.459 -29.508 -1.823 1.00 0.00 C ATOM 1524 C GLN B 25 5.801 -29.616 -3.195 1.00 0.00 C ATOM 1525 O GLN B 25 5.134 -28.687 -3.649 1.00 0.00 O ATOM 1526 CB GLN B 25 5.527 -28.778 -0.854 1.00 0.00 C ATOM 1527 CG GLN B 25 6.096 -28.640 0.549 1.00 0.00 C ATOM 1528 CD GLN B 25 5.032 -28.747 1.624 1.00 0.00 C ATOM 1529 OE1 GLN B 25 5.208 -29.448 2.621 1.00 0.00 O ATOM 1530 NE2 GLN B 25 3.919 -28.050 1.426 1.00 0.00 N ATOM 0 H GLN B 25 7.794 -27.958 -1.365 1.00 0.00 H new ATOM 0 HA GLN B 25 6.645 -30.515 -1.449 1.00 0.00 H new ATOM 0 HB2 GLN B 25 5.311 -27.785 -1.249 1.00 0.00 H new ATOM 0 HB3 GLN B 25 4.579 -29.313 -0.802 1.00 0.00 H new ATOM 0 HG2 GLN B 25 6.848 -29.413 0.709 1.00 0.00 H new ATOM 0 HG3 GLN B 25 6.602 -27.679 0.639 1.00 0.00 H new ATOM 0 HE21 GLN B 25 3.816 -27.482 0.585 1.00 0.00 H new ATOM 0 HE22 GLN B 25 3.167 -28.083 2.115 1.00 0.00 H new ATOM 1539 N ASP B 26 5.993 -30.756 -3.849 1.00 0.00 N ATOM 1540 CA ASP B 26 5.418 -30.986 -5.169 1.00 0.00 C ATOM 1541 C ASP B 26 3.899 -31.101 -5.088 1.00 0.00 C ATOM 1542 O ASP B 26 3.200 -30.926 -6.085 1.00 0.00 O ATOM 1543 CB ASP B 26 6.005 -32.255 -5.791 1.00 0.00 C ATOM 1544 CG ASP B 26 5.360 -32.601 -7.119 1.00 0.00 C ATOM 1545 OD1 ASP B 26 5.138 -31.677 -7.929 1.00 0.00 O ATOM 1546 OD2 ASP B 26 5.077 -33.795 -7.347 1.00 0.00 O ATOM 0 H ASP B 26 6.542 -31.535 -3.487 1.00 0.00 H new ATOM 0 HA ASP B 26 5.667 -30.133 -5.800 1.00 0.00 H new ATOM 0 HB2 ASP B 26 7.077 -32.123 -5.935 1.00 0.00 H new ATOM 0 HB3 ASP B 26 5.876 -33.088 -5.100 1.00 0.00 H new ATOM 1551 N GLU B 27 3.396 -31.398 -3.893 1.00 0.00 N ATOM 1552 CA GLU B 27 1.960 -31.538 -3.683 1.00 0.00 C ATOM 1553 C GLU B 27 1.245 -30.209 -3.913 1.00 0.00 C ATOM 1554 O GLU B 27 0.042 -30.177 -4.179 1.00 0.00 O ATOM 1555 CB GLU B 27 1.676 -32.044 -2.267 1.00 0.00 C ATOM 1556 CG GLU B 27 2.126 -31.086 -1.177 1.00 0.00 C ATOM 1557 CD GLU B 27 1.923 -31.651 0.216 1.00 0.00 C ATOM 1558 OE1 GLU B 27 1.434 -32.795 0.326 1.00 0.00 O ATOM 1559 OE2 GLU B 27 2.253 -30.950 1.195 1.00 0.00 O ATOM 0 H GLU B 27 3.961 -31.546 -3.057 1.00 0.00 H new ATOM 0 HA GLU B 27 1.582 -32.264 -4.403 1.00 0.00 H new ATOM 0 HB2 GLU B 27 0.606 -32.224 -2.162 1.00 0.00 H new ATOM 0 HB3 GLU B 27 2.175 -33.002 -2.126 1.00 0.00 H new ATOM 0 HG2 GLU B 27 3.180 -30.849 -1.319 1.00 0.00 H new ATOM 0 HG3 GLU B 27 1.574 -30.151 -1.270 1.00 0.00 H new ATOM 1566 N LEU B 28 1.992 -29.116 -3.808 1.00 0.00 N ATOM 1567 CA LEU B 28 1.430 -27.784 -4.004 1.00 0.00 C ATOM 1568 C LEU B 28 1.106 -27.540 -5.475 1.00 0.00 C ATOM 1569 O LEU B 28 0.031 -27.046 -5.810 1.00 0.00 O ATOM 1570 CB LEU B 28 2.406 -26.719 -3.502 1.00 0.00 C ATOM 1571 CG LEU B 28 2.851 -26.849 -2.045 1.00 0.00 C ATOM 1572 CD1 LEU B 28 3.815 -25.732 -1.679 1.00 0.00 C ATOM 1573 CD2 LEU B 28 1.645 -26.842 -1.116 1.00 0.00 C ATOM 0 H LEU B 28 2.988 -29.125 -3.588 1.00 0.00 H new ATOM 0 HA LEU B 28 0.505 -27.719 -3.432 1.00 0.00 H new ATOM 0 HB2 LEU B 28 3.293 -26.741 -4.135 1.00 0.00 H new ATOM 0 HB3 LEU B 28 1.944 -25.741 -3.634 1.00 0.00 H new ATOM 0 HG LEU B 28 3.369 -27.801 -1.927 1.00 0.00 H new ATOM 0 HD11 LEU B 28 4.120 -25.841 -0.638 1.00 0.00 H new ATOM 0 HD12 LEU B 28 4.693 -25.784 -2.322 1.00 0.00 H new ATOM 0 HD13 LEU B 28 3.323 -24.768 -1.813 1.00 0.00 H new ATOM 0 HD21 LEU B 28 1.981 -26.935 -0.083 1.00 0.00 H new ATOM 0 HD22 LEU B 28 1.098 -25.907 -1.237 1.00 0.00 H new ATOM 0 HD23 LEU B 28 0.991 -27.679 -1.362 1.00 0.00 H new ATOM 1585 N ASN B 29 2.044 -27.893 -6.348 1.00 0.00 N ATOM 1586 CA ASN B 29 1.857 -27.714 -7.784 1.00 0.00 C ATOM 1587 C ASN B 29 1.789 -26.233 -8.143 1.00 0.00 C ATOM 1588 O ASN B 29 1.113 -25.845 -9.095 1.00 0.00 O ATOM 1589 CB ASN B 29 0.582 -28.422 -8.245 1.00 0.00 C ATOM 1590 CG ASN B 29 0.587 -28.710 -9.734 1.00 0.00 C ATOM 1591 OD1 ASN B 29 1.618 -28.595 -10.396 1.00 0.00 O ATOM 1592 ND2 ASN B 29 -0.569 -29.088 -10.267 1.00 0.00 N ATOM 0 H ASN B 29 2.940 -28.304 -6.087 1.00 0.00 H new ATOM 0 HA ASN B 29 2.713 -28.154 -8.295 1.00 0.00 H new ATOM 0 HB2 ASN B 29 0.471 -29.358 -7.697 1.00 0.00 H new ATOM 0 HB3 ASN B 29 -0.282 -27.805 -8.000 1.00 0.00 H new ATOM 0 HD21 ASN B 29 -0.627 -29.296 -11.264 1.00 0.00 H new ATOM 0 HD22 ASN B 29 -1.399 -29.170 -9.680 1.00 0.00 H new ATOM 1599 N PHE B 30 2.495 -25.410 -7.374 1.00 0.00 N ATOM 1600 CA PHE B 30 2.514 -23.972 -7.611 1.00 0.00 C ATOM 1601 C PHE B 30 3.448 -23.623 -8.766 1.00 0.00 C ATOM 1602 O PHE B 30 4.139 -24.489 -9.303 1.00 0.00 O ATOM 1603 CB PHE B 30 2.952 -23.231 -6.345 1.00 0.00 C ATOM 1604 CG PHE B 30 1.978 -23.359 -5.209 1.00 0.00 C ATOM 1605 CD1 PHE B 30 0.635 -23.599 -5.453 1.00 0.00 C ATOM 1606 CD2 PHE B 30 2.405 -23.239 -3.896 1.00 0.00 C ATOM 1607 CE1 PHE B 30 -0.264 -23.717 -4.410 1.00 0.00 C ATOM 1608 CE2 PHE B 30 1.511 -23.358 -2.849 1.00 0.00 C ATOM 1609 CZ PHE B 30 0.175 -23.595 -3.106 1.00 0.00 C ATOM 0 H PHE B 30 3.061 -25.715 -6.582 1.00 0.00 H new ATOM 0 HA PHE B 30 1.504 -23.660 -7.876 1.00 0.00 H new ATOM 0 HB2 PHE B 30 3.922 -23.614 -6.027 1.00 0.00 H new ATOM 0 HB3 PHE B 30 3.087 -22.175 -6.580 1.00 0.00 H new ATOM 0 HD1 PHE B 30 0.287 -23.695 -6.471 1.00 0.00 H new ATOM 0 HD2 PHE B 30 3.448 -23.050 -3.689 1.00 0.00 H new ATOM 0 HE1 PHE B 30 -1.308 -23.904 -4.614 1.00 0.00 H new ATOM 0 HE2 PHE B 30 1.857 -23.266 -1.830 1.00 0.00 H new ATOM 0 HZ PHE B 30 -0.525 -23.685 -2.289 1.00 0.00 H new ATOM 1619 N ASP B 31 3.463 -22.349 -9.143 1.00 0.00 N ATOM 1620 CA ASP B 31 4.312 -21.885 -10.234 1.00 0.00 C ATOM 1621 C ASP B 31 5.276 -20.806 -9.750 1.00 0.00 C ATOM 1622 O ASP B 31 4.931 -19.625 -9.707 1.00 0.00 O ATOM 1623 CB ASP B 31 3.456 -21.344 -11.380 1.00 0.00 C ATOM 1624 CG ASP B 31 3.289 -22.350 -12.502 1.00 0.00 C ATOM 1625 OD1 ASP B 31 4.284 -23.019 -12.851 1.00 0.00 O ATOM 1626 OD2 ASP B 31 2.164 -22.468 -13.031 1.00 0.00 O ATOM 0 H ASP B 31 2.897 -21.620 -8.709 1.00 0.00 H new ATOM 0 HA ASP B 31 4.894 -22.733 -10.595 1.00 0.00 H new ATOM 0 HB2 ASP B 31 2.474 -21.065 -10.996 1.00 0.00 H new ATOM 0 HB3 ASP B 31 3.913 -20.437 -11.774 1.00 0.00 H new ATOM 1631 N TRP B 32 6.485 -21.219 -9.387 1.00 0.00 N ATOM 1632 CA TRP B 32 7.498 -20.288 -8.905 1.00 0.00 C ATOM 1633 C TRP B 32 8.133 -19.527 -10.064 1.00 0.00 C ATOM 1634 O TRP B 32 8.566 -20.126 -11.048 1.00 0.00 O ATOM 1635 CB TRP B 32 8.576 -21.037 -8.120 1.00 0.00 C ATOM 1636 CG TRP B 32 8.086 -21.584 -6.813 1.00 0.00 C ATOM 1637 CD1 TRP B 32 7.317 -22.697 -6.628 1.00 0.00 C ATOM 1638 CD2 TRP B 32 8.331 -21.042 -5.511 1.00 0.00 C ATOM 1639 NE1 TRP B 32 7.069 -22.879 -5.288 1.00 0.00 N ATOM 1640 CE2 TRP B 32 7.681 -21.878 -4.582 1.00 0.00 C ATOM 1641 CE3 TRP B 32 9.039 -19.933 -5.039 1.00 0.00 C ATOM 1642 CZ2 TRP B 32 7.717 -21.637 -3.211 1.00 0.00 C ATOM 1643 CZ3 TRP B 32 9.073 -19.695 -3.678 1.00 0.00 C ATOM 1644 CH2 TRP B 32 8.417 -20.544 -2.777 1.00 0.00 C ATOM 0 H TRP B 32 6.787 -22.193 -9.417 1.00 0.00 H new ATOM 0 HA TRP B 32 7.011 -19.569 -8.246 1.00 0.00 H new ATOM 0 HB2 TRP B 32 8.956 -21.857 -8.730 1.00 0.00 H new ATOM 0 HB3 TRP B 32 9.413 -20.364 -7.933 1.00 0.00 H new ATOM 0 HD1 TRP B 32 6.957 -23.340 -7.418 1.00 0.00 H new ATOM 0 HE1 TRP B 32 6.518 -23.637 -4.885 1.00 0.00 H new ATOM 0 HE3 TRP B 32 9.550 -19.274 -5.725 1.00 0.00 H new ATOM 0 HZ2 TRP B 32 7.211 -22.289 -2.515 1.00 0.00 H new ATOM 0 HZ3 TRP B 32 9.615 -18.840 -3.302 1.00 0.00 H new ATOM 0 HH2 TRP B 32 8.465 -20.332 -1.719 1.00 0.00 H new ATOM 1655 N GLN B 33 8.184 -18.205 -9.941 1.00 0.00 N ATOM 1656 CA GLN B 33 8.766 -17.363 -10.980 1.00 0.00 C ATOM 1657 C GLN B 33 10.286 -17.325 -10.862 1.00 0.00 C ATOM 1658 O GLN B 33 10.995 -17.298 -11.866 1.00 0.00 O ATOM 1659 CB GLN B 33 8.200 -15.944 -10.892 1.00 0.00 C ATOM 1660 CG GLN B 33 6.787 -15.818 -11.439 1.00 0.00 C ATOM 1661 CD GLN B 33 6.654 -16.370 -12.845 1.00 0.00 C ATOM 1662 OE1 GLN B 33 5.538 -17.038 -13.116 1.00 0.00 O flip ATOM 1663 NE2 GLN B 33 7.544 -16.199 -13.678 1.00 0.00 N flip ATOM 0 H GLN B 33 7.830 -17.694 -9.133 1.00 0.00 H new ATOM 0 HA GLN B 33 8.506 -17.791 -11.948 1.00 0.00 H new ATOM 0 HB2 GLN B 33 8.208 -15.623 -9.850 1.00 0.00 H new ATOM 0 HB3 GLN B 33 8.855 -15.266 -11.440 1.00 0.00 H new ATOM 0 HG2 GLN B 33 6.098 -16.345 -10.779 1.00 0.00 H new ATOM 0 HG3 GLN B 33 6.492 -14.769 -11.435 1.00 0.00 H new ATOM 0 HE21 GLN B 33 8.385 -15.679 -13.427 1.00 0.00 H new ATOM 0 HE22 GLN B 33 7.441 -16.577 -14.620 1.00 0.00 H new ATOM 1672 N ASN B 34 10.779 -17.323 -9.627 1.00 0.00 N ATOM 1673 CA ASN B 34 12.215 -17.287 -9.378 1.00 0.00 C ATOM 1674 C ASN B 34 12.576 -18.122 -8.154 1.00 0.00 C ATOM 1675 O ASN B 34 11.781 -18.287 -7.228 1.00 0.00 O ATOM 1676 CB ASN B 34 12.684 -15.844 -9.181 1.00 0.00 C ATOM 1677 CG ASN B 34 11.867 -15.108 -8.137 1.00 0.00 C ATOM 1678 OD1 ASN B 34 10.658 -14.931 -8.290 1.00 0.00 O ATOM 1679 ND2 ASN B 34 12.525 -14.676 -7.067 1.00 0.00 N ATOM 0 H ASN B 34 10.205 -17.346 -8.784 1.00 0.00 H new ATOM 0 HA ASN B 34 12.719 -17.711 -10.246 1.00 0.00 H new ATOM 0 HB2 ASN B 34 13.733 -15.843 -8.885 1.00 0.00 H new ATOM 0 HB3 ASN B 34 12.620 -15.311 -10.130 1.00 0.00 H new ATOM 0 HD21 ASN B 34 12.028 -14.175 -6.330 1.00 0.00 H new ATOM 0 HD22 ASN B 34 13.527 -14.845 -6.982 1.00 0.00 H new ATOM 1686 N PRO B 35 13.803 -18.663 -8.147 1.00 0.00 N ATOM 1687 CA PRO B 35 14.298 -19.489 -7.042 1.00 0.00 C ATOM 1688 C PRO B 35 14.542 -18.677 -5.774 1.00 0.00 C ATOM 1689 O PRO B 35 15.373 -17.769 -5.740 1.00 0.00 O ATOM 1690 CB PRO B 35 15.618 -20.048 -7.580 1.00 0.00 C ATOM 1691 CG PRO B 35 16.060 -19.058 -8.601 1.00 0.00 C ATOM 1692 CD PRO B 35 14.803 -18.508 -9.217 1.00 0.00 C ATOM 0 HA PRO B 35 13.579 -20.256 -6.754 1.00 0.00 H new ATOM 0 HB2 PRO B 35 16.356 -20.154 -6.785 1.00 0.00 H new ATOM 0 HB3 PRO B 35 15.480 -21.036 -8.020 1.00 0.00 H new ATOM 0 HG2 PRO B 35 16.650 -18.264 -8.144 1.00 0.00 H new ATOM 0 HG3 PRO B 35 16.690 -19.530 -9.355 1.00 0.00 H new ATOM 0 HD2 PRO B 35 14.922 -17.464 -9.508 1.00 0.00 H new ATOM 0 HD3 PRO B 35 14.521 -19.059 -10.114 1.00 0.00 H new ATOM 1700 N PRO B 36 13.802 -19.009 -4.706 1.00 0.00 N ATOM 1701 CA PRO B 36 13.920 -18.322 -3.416 1.00 0.00 C ATOM 1702 C PRO B 36 15.241 -18.626 -2.718 1.00 0.00 C ATOM 1703 O PRO B 36 15.278 -19.351 -1.722 1.00 0.00 O ATOM 1704 CB PRO B 36 12.747 -18.881 -2.608 1.00 0.00 C ATOM 1705 CG PRO B 36 12.471 -20.215 -3.212 1.00 0.00 C ATOM 1706 CD PRO B 36 12.792 -20.080 -4.675 1.00 0.00 C ATOM 0 HA PRO B 36 13.900 -17.238 -3.527 1.00 0.00 H new ATOM 0 HB2 PRO B 36 13.001 -18.970 -1.552 1.00 0.00 H new ATOM 0 HB3 PRO B 36 11.876 -18.229 -2.673 1.00 0.00 H new ATOM 0 HG2 PRO B 36 13.083 -20.988 -2.748 1.00 0.00 H new ATOM 0 HG3 PRO B 36 11.430 -20.502 -3.066 1.00 0.00 H new ATOM 0 HD2 PRO B 36 13.181 -21.011 -5.089 1.00 0.00 H new ATOM 0 HD3 PRO B 36 11.909 -19.817 -5.257 1.00 0.00 H new ATOM 1714 N THR B 37 16.327 -18.067 -3.245 1.00 0.00 N ATOM 1715 CA THR B 37 17.650 -18.279 -2.672 1.00 0.00 C ATOM 1716 C THR B 37 18.326 -16.952 -2.344 1.00 0.00 C ATOM 1717 O THR B 37 19.421 -16.926 -1.785 1.00 0.00 O ATOM 1718 CB THR B 37 18.554 -19.080 -3.628 1.00 0.00 C ATOM 1719 OG1 THR B 37 17.799 -20.117 -4.263 1.00 0.00 O ATOM 1720 CG2 THR B 37 19.730 -19.687 -2.878 1.00 0.00 C ATOM 0 H THR B 37 16.315 -17.464 -4.068 1.00 0.00 H new ATOM 0 HA THR B 37 17.509 -18.849 -1.754 1.00 0.00 H new ATOM 0 HB THR B 37 18.940 -18.398 -4.385 1.00 0.00 H new ATOM 0 HG1 THR B 37 18.381 -20.620 -4.870 1.00 0.00 H new ATOM 0 HG21 THR B 37 20.354 -20.248 -3.573 1.00 0.00 H new ATOM 0 HG22 THR B 37 20.319 -18.892 -2.421 1.00 0.00 H new ATOM 0 HG23 THR B 37 19.360 -20.356 -2.102 1.00 0.00 H new ATOM 1728 N GLU B 38 17.664 -15.854 -2.694 1.00 0.00 N ATOM 1729 CA GLU B 38 18.203 -14.523 -2.436 1.00 0.00 C ATOM 1730 C GLU B 38 17.383 -13.802 -1.370 1.00 0.00 C ATOM 1731 O GLU B 38 16.255 -13.369 -1.605 1.00 0.00 O ATOM 1732 CB GLU B 38 18.222 -13.698 -3.724 1.00 0.00 C ATOM 1733 CG GLU B 38 16.959 -13.839 -4.557 1.00 0.00 C ATOM 1734 CD GLU B 38 16.994 -12.997 -5.817 1.00 0.00 C ATOM 1735 OE1 GLU B 38 18.033 -12.352 -6.072 1.00 0.00 O ATOM 1736 OE2 GLU B 38 15.983 -12.984 -6.550 1.00 0.00 O ATOM 0 H GLU B 38 16.755 -15.859 -3.156 1.00 0.00 H new ATOM 0 HA GLU B 38 19.224 -14.637 -2.071 1.00 0.00 H new ATOM 0 HB2 GLU B 38 18.364 -12.648 -3.470 1.00 0.00 H new ATOM 0 HB3 GLU B 38 19.079 -13.999 -4.326 1.00 0.00 H new ATOM 0 HG2 GLU B 38 16.822 -14.886 -4.828 1.00 0.00 H new ATOM 0 HG3 GLU B 38 16.097 -13.550 -3.955 1.00 0.00 H new ATOM 1743 N PRO B 39 17.963 -13.671 -0.167 1.00 0.00 N ATOM 1744 CA PRO B 39 17.305 -13.003 0.960 1.00 0.00 C ATOM 1745 C PRO B 39 17.178 -11.498 0.748 1.00 0.00 C ATOM 1746 O PRO B 39 18.152 -10.823 0.419 1.00 0.00 O ATOM 1747 CB PRO B 39 18.234 -13.300 2.139 1.00 0.00 C ATOM 1748 CG PRO B 39 19.570 -13.528 1.521 1.00 0.00 C ATOM 1749 CD PRO B 39 19.305 -14.164 0.184 1.00 0.00 C ATOM 0 HA PRO B 39 16.284 -13.357 1.104 1.00 0.00 H new ATOM 0 HB2 PRO B 39 18.260 -12.467 2.842 1.00 0.00 H new ATOM 0 HB3 PRO B 39 17.900 -14.176 2.695 1.00 0.00 H new ATOM 0 HG2 PRO B 39 20.112 -12.589 1.406 1.00 0.00 H new ATOM 0 HG3 PRO B 39 20.184 -14.176 2.147 1.00 0.00 H new ATOM 0 HD2 PRO B 39 20.048 -13.868 -0.556 1.00 0.00 H new ATOM 0 HD3 PRO B 39 19.331 -15.252 0.244 1.00 0.00 H new ATOM 1757 N GLY B 40 15.969 -10.979 0.939 1.00 0.00 N ATOM 1758 CA GLY B 40 15.737 -9.557 0.765 1.00 0.00 C ATOM 1759 C GLY B 40 15.229 -9.218 -0.623 1.00 0.00 C ATOM 1760 O GLY B 40 15.066 -8.046 -0.962 1.00 0.00 O ATOM 0 H GLY B 40 15.147 -11.518 1.211 1.00 0.00 H new ATOM 0 HA2 GLY B 40 15.014 -9.217 1.506 1.00 0.00 H new ATOM 0 HA3 GLY B 40 16.664 -9.015 0.952 1.00 0.00 H new ATOM 1764 N GLN B 41 14.980 -10.246 -1.427 1.00 0.00 N ATOM 1765 CA GLN B 41 14.490 -10.051 -2.787 1.00 0.00 C ATOM 1766 C GLN B 41 13.052 -10.541 -2.923 1.00 0.00 C ATOM 1767 O GLN B 41 12.623 -11.477 -2.249 1.00 0.00 O ATOM 1768 CB GLN B 41 15.388 -10.784 -3.785 1.00 0.00 C ATOM 1769 CG GLN B 41 16.564 -9.951 -4.271 1.00 0.00 C ATOM 1770 CD GLN B 41 16.131 -8.642 -4.901 1.00 0.00 C ATOM 1771 OE1 GLN B 41 15.744 -8.600 -6.069 1.00 0.00 O ATOM 1772 NE2 GLN B 41 16.194 -7.563 -4.128 1.00 0.00 N ATOM 0 H GLN B 41 15.109 -11.222 -1.161 1.00 0.00 H new ATOM 0 HA GLN B 41 14.513 -8.983 -3.005 1.00 0.00 H new ATOM 0 HB2 GLN B 41 15.766 -11.695 -3.320 1.00 0.00 H new ATOM 0 HB3 GLN B 41 14.790 -11.089 -4.644 1.00 0.00 H new ATOM 0 HG2 GLN B 41 17.229 -9.744 -3.432 1.00 0.00 H new ATOM 0 HG3 GLN B 41 17.137 -10.527 -4.997 1.00 0.00 H new ATOM 0 HE21 GLN B 41 16.521 -7.644 -3.165 1.00 0.00 H new ATOM 0 HE22 GLN B 41 15.915 -6.654 -4.497 1.00 0.00 H new ATOM 1781 N PRO B 42 12.288 -9.894 -3.816 1.00 0.00 N ATOM 1782 CA PRO B 42 10.887 -10.248 -4.062 1.00 0.00 C ATOM 1783 C PRO B 42 10.743 -11.592 -4.767 1.00 0.00 C ATOM 1784 O PRO B 42 11.416 -11.858 -5.763 1.00 0.00 O ATOM 1785 CB PRO B 42 10.389 -9.116 -4.964 1.00 0.00 C ATOM 1786 CG PRO B 42 11.613 -8.606 -5.644 1.00 0.00 C ATOM 1787 CD PRO B 42 12.734 -8.769 -4.655 1.00 0.00 C ATOM 0 HA PRO B 42 10.324 -10.352 -3.134 1.00 0.00 H new ATOM 0 HB2 PRO B 42 9.657 -9.478 -5.686 1.00 0.00 H new ATOM 0 HB3 PRO B 42 9.903 -8.332 -4.383 1.00 0.00 H new ATOM 0 HG2 PRO B 42 11.814 -9.166 -6.557 1.00 0.00 H new ATOM 0 HG3 PRO B 42 11.494 -7.561 -5.930 1.00 0.00 H new ATOM 0 HD2 PRO B 42 13.679 -8.988 -5.152 1.00 0.00 H new ATOM 0 HD3 PRO B 42 12.885 -7.864 -4.066 1.00 0.00 H new ATOM 1795 N VAL B 43 9.862 -12.438 -4.243 1.00 0.00 N ATOM 1796 CA VAL B 43 9.628 -13.756 -4.823 1.00 0.00 C ATOM 1797 C VAL B 43 8.176 -13.916 -5.256 1.00 0.00 C ATOM 1798 O VAL B 43 7.263 -13.879 -4.431 1.00 0.00 O ATOM 1799 CB VAL B 43 9.983 -14.877 -3.829 1.00 0.00 C ATOM 1800 CG1 VAL B 43 9.950 -16.233 -4.518 1.00 0.00 C ATOM 1801 CG2 VAL B 43 11.346 -14.622 -3.202 1.00 0.00 C ATOM 0 H VAL B 43 9.298 -12.235 -3.418 1.00 0.00 H new ATOM 0 HA VAL B 43 10.275 -13.837 -5.697 1.00 0.00 H new ATOM 0 HB VAL B 43 9.238 -14.882 -3.034 1.00 0.00 H new ATOM 0 HG11 VAL B 43 10.204 -17.012 -3.799 1.00 0.00 H new ATOM 0 HG12 VAL B 43 8.951 -16.416 -4.914 1.00 0.00 H new ATOM 0 HG13 VAL B 43 10.672 -16.244 -5.335 1.00 0.00 H new ATOM 0 HG21 VAL B 43 11.580 -15.424 -2.502 1.00 0.00 H new ATOM 0 HG22 VAL B 43 12.105 -14.589 -3.983 1.00 0.00 H new ATOM 0 HG23 VAL B 43 11.330 -13.670 -2.671 1.00 0.00 H new ATOM 1811 N VAL B 44 7.968 -14.095 -6.557 1.00 0.00 N ATOM 1812 CA VAL B 44 6.625 -14.263 -7.101 1.00 0.00 C ATOM 1813 C VAL B 44 6.263 -15.738 -7.225 1.00 0.00 C ATOM 1814 O VAL B 44 7.054 -16.543 -7.719 1.00 0.00 O ATOM 1815 CB VAL B 44 6.492 -13.595 -8.482 1.00 0.00 C ATOM 1816 CG1 VAL B 44 5.098 -13.816 -9.050 1.00 0.00 C ATOM 1817 CG2 VAL B 44 6.809 -12.110 -8.388 1.00 0.00 C ATOM 0 H VAL B 44 8.712 -14.127 -7.254 1.00 0.00 H new ATOM 0 HA VAL B 44 5.939 -13.781 -6.405 1.00 0.00 H new ATOM 0 HB VAL B 44 7.212 -14.055 -9.160 1.00 0.00 H new ATOM 0 HG11 VAL B 44 5.023 -13.337 -10.026 1.00 0.00 H new ATOM 0 HG12 VAL B 44 4.913 -14.885 -9.155 1.00 0.00 H new ATOM 0 HG13 VAL B 44 4.358 -13.385 -8.376 1.00 0.00 H new ATOM 0 HG21 VAL B 44 6.710 -11.654 -9.373 1.00 0.00 H new ATOM 0 HG22 VAL B 44 6.115 -11.633 -7.696 1.00 0.00 H new ATOM 0 HG23 VAL B 44 7.829 -11.978 -8.028 1.00 0.00 H new ATOM 1827 N ILE B 45 5.063 -16.087 -6.773 1.00 0.00 N ATOM 1828 CA ILE B 45 4.596 -17.467 -6.835 1.00 0.00 C ATOM 1829 C ILE B 45 3.162 -17.538 -7.351 1.00 0.00 C ATOM 1830 O ILE B 45 2.228 -17.092 -6.684 1.00 0.00 O ATOM 1831 CB ILE B 45 4.668 -18.148 -5.456 1.00 0.00 C ATOM 1832 CG1 ILE B 45 6.029 -17.891 -4.807 1.00 0.00 C ATOM 1833 CG2 ILE B 45 4.412 -19.642 -5.589 1.00 0.00 C ATOM 1834 CD1 ILE B 45 6.128 -18.403 -3.387 1.00 0.00 C ATOM 0 H ILE B 45 4.397 -15.434 -6.360 1.00 0.00 H new ATOM 0 HA ILE B 45 5.255 -17.993 -7.525 1.00 0.00 H new ATOM 0 HB ILE B 45 3.895 -17.722 -4.816 1.00 0.00 H new ATOM 0 HG12 ILE B 45 6.805 -18.363 -5.410 1.00 0.00 H new ATOM 0 HG13 ILE B 45 6.229 -16.819 -4.813 1.00 0.00 H new ATOM 0 HG21 ILE B 45 4.466 -20.109 -4.606 1.00 0.00 H new ATOM 0 HG22 ILE B 45 3.422 -19.805 -6.014 1.00 0.00 H new ATOM 0 HG23 ILE B 45 5.164 -20.083 -6.243 1.00 0.00 H new ATOM 0 HD11 ILE B 45 7.120 -18.186 -2.990 1.00 0.00 H new ATOM 0 HD12 ILE B 45 5.375 -17.912 -2.770 1.00 0.00 H new ATOM 0 HD13 ILE B 45 5.960 -19.480 -3.376 1.00 0.00 H new ATOM 1846 N LEU B 46 2.996 -18.104 -8.541 1.00 0.00 N ATOM 1847 CA LEU B 46 1.675 -18.237 -9.147 1.00 0.00 C ATOM 1848 C LEU B 46 0.921 -19.423 -8.554 1.00 0.00 C ATOM 1849 O LEU B 46 1.146 -20.570 -8.942 1.00 0.00 O ATOM 1850 CB LEU B 46 1.802 -18.404 -10.662 1.00 0.00 C ATOM 1851 CG LEU B 46 1.778 -17.115 -11.484 1.00 0.00 C ATOM 1852 CD1 LEU B 46 0.373 -16.536 -11.528 1.00 0.00 C ATOM 1853 CD2 LEU B 46 2.757 -16.100 -10.912 1.00 0.00 C ATOM 0 H LEU B 46 3.759 -18.478 -9.106 1.00 0.00 H new ATOM 0 HA LEU B 46 1.111 -17.329 -8.934 1.00 0.00 H new ATOM 0 HB2 LEU B 46 2.734 -18.928 -10.873 1.00 0.00 H new ATOM 0 HB3 LEU B 46 0.991 -19.046 -11.006 1.00 0.00 H new ATOM 0 HG LEU B 46 2.084 -17.351 -12.503 1.00 0.00 H new ATOM 0 HD11 LEU B 46 0.376 -15.619 -12.117 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -0.304 -17.258 -11.984 1.00 0.00 H new ATOM 0 HD13 LEU B 46 0.039 -16.315 -10.514 1.00 0.00 H new ATOM 0 HD21 LEU B 46 2.727 -15.189 -11.509 1.00 0.00 H new ATOM 0 HD22 LEU B 46 2.482 -15.869 -9.883 1.00 0.00 H new ATOM 0 HD23 LEU B 46 3.765 -16.515 -10.933 1.00 0.00 H new ATOM 1865 N ILE B 47 0.026 -19.139 -7.615 1.00 0.00 N ATOM 1866 CA ILE B 47 -0.764 -20.182 -6.972 1.00 0.00 C ATOM 1867 C ILE B 47 -2.240 -20.056 -7.334 1.00 0.00 C ATOM 1868 O ILE B 47 -2.741 -18.972 -7.633 1.00 0.00 O ATOM 1869 CB ILE B 47 -0.617 -20.135 -5.440 1.00 0.00 C ATOM 1870 CG1 ILE B 47 -1.091 -18.783 -4.901 1.00 0.00 C ATOM 1871 CG2 ILE B 47 0.827 -20.394 -5.038 1.00 0.00 C ATOM 1872 CD1 ILE B 47 -1.751 -18.872 -3.543 1.00 0.00 C ATOM 0 H ILE B 47 -0.171 -18.195 -7.282 1.00 0.00 H new ATOM 0 HA ILE B 47 -0.383 -21.136 -7.336 1.00 0.00 H new ATOM 0 HB ILE B 47 -1.240 -20.917 -5.006 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -0.238 -18.107 -4.838 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -1.794 -18.345 -5.610 1.00 0.00 H new ATOM 0 HG21 ILE B 47 0.915 -20.357 -3.952 1.00 0.00 H new ATOM 0 HG22 ILE B 47 1.133 -21.378 -5.394 1.00 0.00 H new ATOM 0 HG23 ILE B 47 1.470 -19.633 -5.480 1.00 0.00 H new ATOM 0 HD11 ILE B 47 -2.062 -17.877 -3.223 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -2.624 -19.522 -3.604 1.00 0.00 H new ATOM 0 HD13 ILE B 47 -1.044 -19.281 -2.821 1.00 0.00 H new ATOM 1884 N PRO B 48 -2.954 -21.191 -7.306 1.00 0.00 N ATOM 1885 CA PRO B 48 -4.384 -21.234 -7.626 1.00 0.00 C ATOM 1886 C PRO B 48 -5.238 -20.554 -6.560 1.00 0.00 C ATOM 1887 O PRO B 48 -4.830 -20.440 -5.405 1.00 0.00 O ATOM 1888 CB PRO B 48 -4.691 -22.733 -7.680 1.00 0.00 C ATOM 1889 CG PRO B 48 -3.658 -23.362 -6.810 1.00 0.00 C ATOM 1890 CD PRO B 48 -2.422 -22.519 -6.958 1.00 0.00 C ATOM 0 HA PRO B 48 -4.610 -20.705 -8.552 1.00 0.00 H new ATOM 0 HB2 PRO B 48 -5.697 -22.945 -7.317 1.00 0.00 H new ATOM 0 HB3 PRO B 48 -4.634 -23.112 -8.700 1.00 0.00 H new ATOM 0 HG2 PRO B 48 -3.988 -23.392 -5.772 1.00 0.00 H new ATOM 0 HG3 PRO B 48 -3.467 -24.391 -7.113 1.00 0.00 H new ATOM 0 HD2 PRO B 48 -1.842 -22.490 -6.035 1.00 0.00 H new ATOM 0 HD3 PRO B 48 -1.764 -22.905 -7.736 1.00 0.00 H new ATOM 1898 N SER B 49 -6.424 -20.104 -6.957 1.00 0.00 N ATOM 1899 CA SER B 49 -7.334 -19.433 -6.036 1.00 0.00 C ATOM 1900 C SER B 49 -7.841 -20.400 -4.971 1.00 0.00 C ATOM 1901 O SER B 49 -8.418 -19.987 -3.966 1.00 0.00 O ATOM 1902 CB SER B 49 -8.515 -18.832 -6.801 1.00 0.00 C ATOM 1903 OG SER B 49 -9.048 -17.711 -6.118 1.00 0.00 O ATOM 0 H SER B 49 -6.777 -20.192 -7.910 1.00 0.00 H new ATOM 0 HA SER B 49 -6.785 -18.632 -5.541 1.00 0.00 H new ATOM 0 HB2 SER B 49 -8.192 -18.534 -7.799 1.00 0.00 H new ATOM 0 HB3 SER B 49 -9.291 -19.587 -6.929 1.00 0.00 H new ATOM 0 HG SER B 49 -9.800 -17.344 -6.628 1.00 0.00 H new ATOM 1909 N ASP B 50 -7.621 -21.690 -5.200 1.00 0.00 N ATOM 1910 CA ASP B 50 -8.054 -22.718 -4.261 1.00 0.00 C ATOM 1911 C ASP B 50 -6.988 -22.967 -3.199 1.00 0.00 C ATOM 1912 O ASP B 50 -7.207 -23.721 -2.251 1.00 0.00 O ATOM 1913 CB ASP B 50 -8.366 -24.019 -5.003 1.00 0.00 C ATOM 1914 CG ASP B 50 -9.407 -23.830 -6.089 1.00 0.00 C ATOM 1915 OD1 ASP B 50 -10.569 -23.521 -5.751 1.00 0.00 O ATOM 1916 OD2 ASP B 50 -9.059 -23.990 -7.278 1.00 0.00 O ATOM 0 H ASP B 50 -7.145 -22.049 -6.028 1.00 0.00 H new ATOM 0 HA ASP B 50 -8.959 -22.365 -3.766 1.00 0.00 H new ATOM 0 HB2 ASP B 50 -7.450 -24.410 -5.446 1.00 0.00 H new ATOM 0 HB3 ASP B 50 -8.719 -24.765 -4.291 1.00 0.00 H new ATOM 1921 N MET B 51 -5.834 -22.330 -3.365 1.00 0.00 N ATOM 1922 CA MET B 51 -4.734 -22.483 -2.420 1.00 0.00 C ATOM 1923 C MET B 51 -4.335 -21.135 -1.827 1.00 0.00 C ATOM 1924 O MET B 51 -3.364 -21.039 -1.077 1.00 0.00 O ATOM 1925 CB MET B 51 -3.529 -23.128 -3.107 1.00 0.00 C ATOM 1926 CG MET B 51 -3.711 -24.610 -3.389 1.00 0.00 C ATOM 1927 SD MET B 51 -3.816 -25.596 -1.883 1.00 0.00 S ATOM 1928 CE MET B 51 -2.200 -25.298 -1.170 1.00 0.00 C ATOM 0 H MET B 51 -5.636 -21.703 -4.145 1.00 0.00 H new ATOM 0 HA MET B 51 -5.071 -23.131 -1.611 1.00 0.00 H new ATOM 0 HB2 MET B 51 -3.336 -22.609 -4.046 1.00 0.00 H new ATOM 0 HB3 MET B 51 -2.648 -22.991 -2.480 1.00 0.00 H new ATOM 0 HG2 MET B 51 -4.617 -24.755 -3.978 1.00 0.00 H new ATOM 0 HG3 MET B 51 -2.877 -24.966 -3.994 1.00 0.00 H new ATOM 0 HE1 MET B 51 -2.091 -25.884 -0.258 1.00 0.00 H new ATOM 0 HE2 MET B 51 -1.428 -25.589 -1.883 1.00 0.00 H new ATOM 0 HE3 MET B 51 -2.096 -24.239 -0.935 1.00 0.00 H new ATOM 1938 N VAL B 52 -5.091 -20.096 -2.169 1.00 0.00 N ATOM 1939 CA VAL B 52 -4.817 -18.754 -1.669 1.00 0.00 C ATOM 1940 C VAL B 52 -4.979 -18.687 -0.155 1.00 0.00 C ATOM 1941 O VAL B 52 -4.176 -18.063 0.538 1.00 0.00 O ATOM 1942 CB VAL B 52 -5.746 -17.712 -2.321 1.00 0.00 C ATOM 1943 CG1 VAL B 52 -7.204 -18.074 -2.082 1.00 0.00 C ATOM 1944 CG2 VAL B 52 -5.439 -16.320 -1.790 1.00 0.00 C ATOM 0 H VAL B 52 -5.898 -20.158 -2.790 1.00 0.00 H new ATOM 0 HA VAL B 52 -3.784 -18.524 -1.931 1.00 0.00 H new ATOM 0 HB VAL B 52 -5.568 -17.713 -3.396 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -7.846 -17.327 -2.549 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -7.412 -19.053 -2.515 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -7.401 -18.102 -1.010 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -6.104 -15.596 -2.261 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -5.588 -16.301 -0.710 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -4.404 -16.064 -2.018 1.00 0.00 H new ATOM 1954 N GLU B 53 -6.023 -19.335 0.352 1.00 0.00 N ATOM 1955 CA GLU B 53 -6.290 -19.349 1.786 1.00 0.00 C ATOM 1956 C GLU B 53 -5.168 -20.054 2.542 1.00 0.00 C ATOM 1957 O GLU B 53 -4.712 -19.579 3.582 1.00 0.00 O ATOM 1958 CB GLU B 53 -7.625 -20.039 2.072 1.00 0.00 C ATOM 1959 CG GLU B 53 -8.776 -19.509 1.234 1.00 0.00 C ATOM 1960 CD GLU B 53 -10.116 -20.081 1.655 1.00 0.00 C ATOM 1961 OE1 GLU B 53 -10.139 -21.210 2.189 1.00 0.00 O ATOM 1962 OE2 GLU B 53 -11.142 -19.399 1.450 1.00 0.00 O ATOM 0 H GLU B 53 -6.697 -19.857 -0.208 1.00 0.00 H new ATOM 0 HA GLU B 53 -6.342 -18.316 2.130 1.00 0.00 H new ATOM 0 HB2 GLU B 53 -7.518 -21.109 1.891 1.00 0.00 H new ATOM 0 HB3 GLU B 53 -7.869 -19.917 3.127 1.00 0.00 H new ATOM 0 HG2 GLU B 53 -8.808 -18.422 1.313 1.00 0.00 H new ATOM 0 HG3 GLU B 53 -8.597 -19.747 0.185 1.00 0.00 H new ATOM 1969 N TRP B 54 -4.729 -21.190 2.012 1.00 0.00 N ATOM 1970 CA TRP B 54 -3.660 -21.962 2.636 1.00 0.00 C ATOM 1971 C TRP B 54 -2.363 -21.163 2.675 1.00 0.00 C ATOM 1972 O TRP B 54 -1.741 -21.021 3.728 1.00 0.00 O ATOM 1973 CB TRP B 54 -3.443 -23.274 1.881 1.00 0.00 C ATOM 1974 CG TRP B 54 -2.281 -24.069 2.394 1.00 0.00 C ATOM 1975 CD1 TRP B 54 -2.307 -25.023 3.371 1.00 0.00 C ATOM 1976 CD2 TRP B 54 -0.920 -23.977 1.958 1.00 0.00 C ATOM 1977 NE1 TRP B 54 -1.045 -25.530 3.569 1.00 0.00 N ATOM 1978 CE2 TRP B 54 -0.177 -24.905 2.713 1.00 0.00 C ATOM 1979 CE3 TRP B 54 -0.258 -23.204 1.001 1.00 0.00 C ATOM 1980 CZ2 TRP B 54 1.194 -25.077 2.541 1.00 0.00 C ATOM 1981 CZ3 TRP B 54 1.103 -23.375 0.831 1.00 0.00 C ATOM 1982 CH2 TRP B 54 1.817 -24.306 1.597 1.00 0.00 C ATOM 0 H TRP B 54 -5.096 -21.597 1.152 1.00 0.00 H new ATOM 0 HA TRP B 54 -3.958 -22.186 3.660 1.00 0.00 H new ATOM 0 HB2 TRP B 54 -4.347 -23.879 1.951 1.00 0.00 H new ATOM 0 HB3 TRP B 54 -3.287 -23.055 0.825 1.00 0.00 H new ATOM 0 HD1 TRP B 54 -3.190 -25.334 3.909 1.00 0.00 H new ATOM 0 HE1 TRP B 54 -0.795 -26.254 4.243 1.00 0.00 H new ATOM 0 HE3 TRP B 54 -0.800 -22.485 0.404 1.00 0.00 H new ATOM 0 HZ2 TRP B 54 1.746 -25.793 3.131 1.00 0.00 H new ATOM 0 HZ3 TRP B 54 1.625 -22.781 0.095 1.00 0.00 H new ATOM 0 HH2 TRP B 54 2.880 -24.417 1.440 1.00 0.00 H new ATOM 1993 N PHE B 55 -1.959 -20.641 1.522 1.00 0.00 N ATOM 1994 CA PHE B 55 -0.734 -19.856 1.424 1.00 0.00 C ATOM 1995 C PHE B 55 -0.803 -18.626 2.324 1.00 0.00 C ATOM 1996 O PHE B 55 0.195 -18.222 2.922 1.00 0.00 O ATOM 1997 CB PHE B 55 -0.490 -19.429 -0.024 1.00 0.00 C ATOM 1998 CG PHE B 55 0.917 -19.671 -0.492 1.00 0.00 C ATOM 1999 CD1 PHE B 55 1.992 -19.422 0.346 1.00 0.00 C ATOM 2000 CD2 PHE B 55 1.165 -20.148 -1.769 1.00 0.00 C ATOM 2001 CE1 PHE B 55 3.287 -19.642 -0.082 1.00 0.00 C ATOM 2002 CE2 PHE B 55 2.458 -20.371 -2.203 1.00 0.00 C ATOM 2003 CZ PHE B 55 3.521 -20.119 -1.357 1.00 0.00 C ATOM 0 H PHE B 55 -2.463 -20.747 0.641 1.00 0.00 H new ATOM 0 HA PHE B 55 0.095 -20.481 1.755 1.00 0.00 H new ATOM 0 HB2 PHE B 55 -1.178 -19.969 -0.674 1.00 0.00 H new ATOM 0 HB3 PHE B 55 -0.721 -18.369 -0.125 1.00 0.00 H new ATOM 0 HD1 PHE B 55 1.816 -19.052 1.345 1.00 0.00 H new ATOM 0 HD2 PHE B 55 0.337 -20.348 -2.434 1.00 0.00 H new ATOM 0 HE1 PHE B 55 4.116 -19.441 0.580 1.00 0.00 H new ATOM 0 HE2 PHE B 55 2.637 -20.742 -3.201 1.00 0.00 H new ATOM 0 HZ PHE B 55 4.533 -20.295 -1.692 1.00 0.00 H new ATOM 2013 N LEU B 56 -1.989 -18.034 2.415 1.00 0.00 N ATOM 2014 CA LEU B 56 -2.191 -16.849 3.242 1.00 0.00 C ATOM 2015 C LEU B 56 -1.936 -17.161 4.713 1.00 0.00 C ATOM 2016 O LEU B 56 -1.118 -16.510 5.362 1.00 0.00 O ATOM 2017 CB LEU B 56 -3.612 -16.312 3.061 1.00 0.00 C ATOM 2018 CG LEU B 56 -3.749 -15.048 2.212 1.00 0.00 C ATOM 2019 CD1 LEU B 56 -4.993 -15.124 1.340 1.00 0.00 C ATOM 2020 CD2 LEU B 56 -3.792 -13.812 3.098 1.00 0.00 C ATOM 0 H LEU B 56 -2.825 -18.355 1.927 1.00 0.00 H new ATOM 0 HA LEU B 56 -1.479 -16.088 2.923 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -4.220 -17.096 2.610 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -4.031 -16.111 4.047 1.00 0.00 H new ATOM 0 HG LEU B 56 -2.877 -14.974 1.562 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -5.075 -14.216 0.743 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -4.922 -15.988 0.679 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -5.875 -15.223 1.973 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -3.890 -12.922 2.476 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -4.645 -13.878 3.774 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -2.872 -13.749 3.680 1.00 0.00 H new ATOM 2032 N GLU B 57 -2.642 -18.162 5.231 1.00 0.00 N ATOM 2033 CA GLU B 57 -2.490 -18.560 6.625 1.00 0.00 C ATOM 2034 C GLU B 57 -1.056 -18.995 6.914 1.00 0.00 C ATOM 2035 O GLU B 57 -0.536 -18.768 8.006 1.00 0.00 O ATOM 2036 CB GLU B 57 -3.457 -19.698 6.961 1.00 0.00 C ATOM 2037 CG GLU B 57 -4.881 -19.232 7.212 1.00 0.00 C ATOM 2038 CD GLU B 57 -5.715 -20.269 7.940 1.00 0.00 C ATOM 2039 OE1 GLU B 57 -5.606 -20.354 9.181 1.00 0.00 O ATOM 2040 OE2 GLU B 57 -6.476 -20.995 7.267 1.00 0.00 O ATOM 0 H GLU B 57 -3.323 -18.711 4.707 1.00 0.00 H new ATOM 0 HA GLU B 57 -2.722 -17.698 7.250 1.00 0.00 H new ATOM 0 HB2 GLU B 57 -3.458 -20.417 6.141 1.00 0.00 H new ATOM 0 HB3 GLU B 57 -3.094 -20.223 7.845 1.00 0.00 H new ATOM 0 HG2 GLU B 57 -4.861 -18.312 7.797 1.00 0.00 H new ATOM 0 HG3 GLU B 57 -5.355 -18.994 6.260 1.00 0.00 H new ATOM 2047 N MET B 58 -0.424 -19.622 5.928 1.00 0.00 N ATOM 2048 CA MET B 58 0.950 -20.088 6.076 1.00 0.00 C ATOM 2049 C MET B 58 1.910 -18.912 6.223 1.00 0.00 C ATOM 2050 O MET B 58 2.802 -18.928 7.073 1.00 0.00 O ATOM 2051 CB MET B 58 1.353 -20.943 4.873 1.00 0.00 C ATOM 2052 CG MET B 58 2.770 -21.486 4.961 1.00 0.00 C ATOM 2053 SD MET B 58 2.816 -23.270 5.218 1.00 0.00 S ATOM 2054 CE MET B 58 3.941 -23.771 3.918 1.00 0.00 C ATOM 0 H MET B 58 -0.841 -19.819 5.018 1.00 0.00 H new ATOM 0 HA MET B 58 1.006 -20.695 6.980 1.00 0.00 H new ATOM 0 HB2 MET B 58 0.658 -21.778 4.782 1.00 0.00 H new ATOM 0 HB3 MET B 58 1.257 -20.347 3.965 1.00 0.00 H new ATOM 0 HG2 MET B 58 3.306 -21.241 4.044 1.00 0.00 H new ATOM 0 HG3 MET B 58 3.294 -20.991 5.779 1.00 0.00 H new ATOM 0 HE1 MET B 58 3.769 -24.819 3.672 1.00 0.00 H new ATOM 0 HE2 MET B 58 3.770 -23.158 3.033 1.00 0.00 H new ATOM 0 HE3 MET B 58 4.969 -23.641 4.256 1.00 0.00 H new ATOM 2064 N LEU B 59 1.724 -17.894 5.390 1.00 0.00 N ATOM 2065 CA LEU B 59 2.574 -16.709 5.428 1.00 0.00 C ATOM 2066 C LEU B 59 2.420 -15.970 6.754 1.00 0.00 C ATOM 2067 O LEU B 59 3.407 -15.641 7.412 1.00 0.00 O ATOM 2068 CB LEU B 59 2.230 -15.773 4.268 1.00 0.00 C ATOM 2069 CG LEU B 59 3.081 -15.928 3.006 1.00 0.00 C ATOM 2070 CD1 LEU B 59 4.420 -15.227 3.176 1.00 0.00 C ATOM 2071 CD2 LEU B 59 3.284 -17.400 2.678 1.00 0.00 C ATOM 0 H LEU B 59 0.992 -17.865 4.680 1.00 0.00 H new ATOM 0 HA LEU B 59 3.610 -17.033 5.331 1.00 0.00 H new ATOM 0 HB2 LEU B 59 1.185 -15.929 3.999 1.00 0.00 H new ATOM 0 HB3 LEU B 59 2.319 -14.745 4.618 1.00 0.00 H new ATOM 0 HG LEU B 59 2.553 -15.461 2.174 1.00 0.00 H new ATOM 0 HD11 LEU B 59 5.012 -15.348 2.269 1.00 0.00 H new ATOM 0 HD12 LEU B 59 4.254 -14.166 3.362 1.00 0.00 H new ATOM 0 HD13 LEU B 59 4.955 -15.664 4.019 1.00 0.00 H new ATOM 0 HD21 LEU B 59 3.891 -17.492 1.778 1.00 0.00 H new ATOM 0 HD22 LEU B 59 3.790 -17.891 3.509 1.00 0.00 H new ATOM 0 HD23 LEU B 59 2.316 -17.873 2.512 1.00 0.00 H new ATOM 2083 N LYS B 60 1.175 -15.715 7.142 1.00 0.00 N ATOM 2084 CA LYS B 60 0.891 -15.019 8.392 1.00 0.00 C ATOM 2085 C LYS B 60 1.311 -15.861 9.592 1.00 0.00 C ATOM 2086 O LYS B 60 1.762 -15.331 10.607 1.00 0.00 O ATOM 2087 CB LYS B 60 -0.600 -14.687 8.486 1.00 0.00 C ATOM 2088 CG LYS B 60 -1.133 -13.934 7.279 1.00 0.00 C ATOM 2089 CD LYS B 60 -2.644 -13.785 7.337 1.00 0.00 C ATOM 2090 CE LYS B 60 -3.342 -14.868 6.528 1.00 0.00 C ATOM 2091 NZ LYS B 60 -4.771 -14.535 6.273 1.00 0.00 N ATOM 0 H LYS B 60 0.347 -15.980 6.609 1.00 0.00 H new ATOM 0 HA LYS B 60 1.466 -14.093 8.402 1.00 0.00 H new ATOM 0 HB2 LYS B 60 -1.163 -15.613 8.604 1.00 0.00 H new ATOM 0 HB3 LYS B 60 -0.775 -14.091 9.382 1.00 0.00 H new ATOM 0 HG2 LYS B 60 -0.671 -12.948 7.231 1.00 0.00 H new ATOM 0 HG3 LYS B 60 -0.853 -14.462 6.367 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -2.976 -13.833 8.374 1.00 0.00 H new ATOM 0 HD3 LYS B 60 -2.929 -12.804 6.956 1.00 0.00 H new ATOM 0 HE2 LYS B 60 -2.825 -15.002 5.578 1.00 0.00 H new ATOM 0 HE3 LYS B 60 -3.280 -15.817 7.061 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 -5.161 -15.195 5.570 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 -5.310 -14.615 7.159 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -4.842 -13.562 5.912 1.00 0.00 H new ATOM 2105 N ALA B 61 1.162 -17.176 9.468 1.00 0.00 N ATOM 2106 CA ALA B 61 1.530 -18.091 10.541 1.00 0.00 C ATOM 2107 C ALA B 61 2.983 -17.891 10.959 1.00 0.00 C ATOM 2108 O ALA B 61 3.304 -17.898 12.148 1.00 0.00 O ATOM 2109 CB ALA B 61 1.297 -19.532 10.109 1.00 0.00 C ATOM 0 H ALA B 61 0.789 -17.631 8.635 1.00 0.00 H new ATOM 0 HA ALA B 61 0.898 -17.874 11.402 1.00 0.00 H new ATOM 0 HB1 ALA B 61 1.576 -20.205 10.920 1.00 0.00 H new ATOM 0 HB2 ALA B 61 0.244 -19.673 9.866 1.00 0.00 H new ATOM 0 HB3 ALA B 61 1.904 -19.751 9.231 1.00 0.00 H new ATOM 2115 N LYS B 62 3.858 -17.712 9.975 1.00 0.00 N ATOM 2116 CA LYS B 62 5.277 -17.509 10.241 1.00 0.00 C ATOM 2117 C LYS B 62 5.592 -16.027 10.411 1.00 0.00 C ATOM 2118 O LYS B 62 6.622 -15.662 10.977 1.00 0.00 O ATOM 2119 CB LYS B 62 6.118 -18.093 9.104 1.00 0.00 C ATOM 2120 CG LYS B 62 5.746 -19.521 8.743 1.00 0.00 C ATOM 2121 CD LYS B 62 5.983 -20.470 9.906 1.00 0.00 C ATOM 2122 CE LYS B 62 7.463 -20.776 10.083 1.00 0.00 C ATOM 2123 NZ LYS B 62 7.685 -22.142 10.632 1.00 0.00 N ATOM 0 H LYS B 62 3.609 -17.703 8.986 1.00 0.00 H new ATOM 0 HA LYS B 62 5.525 -18.024 11.169 1.00 0.00 H new ATOM 0 HB2 LYS B 62 6.007 -17.463 8.221 1.00 0.00 H new ATOM 0 HB3 LYS B 62 7.170 -18.061 9.388 1.00 0.00 H new ATOM 0 HG2 LYS B 62 4.698 -19.561 8.447 1.00 0.00 H new ATOM 0 HG3 LYS B 62 6.332 -19.844 7.883 1.00 0.00 H new ATOM 0 HD2 LYS B 62 5.589 -20.030 10.822 1.00 0.00 H new ATOM 0 HD3 LYS B 62 5.436 -21.398 9.737 1.00 0.00 H new ATOM 0 HE2 LYS B 62 7.970 -20.684 9.123 1.00 0.00 H new ATOM 0 HE3 LYS B 62 7.909 -20.039 10.751 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 8.706 -22.312 10.738 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 7.223 -22.223 11.560 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 7.282 -22.847 9.982 1.00 0.00 H new ATOM 2137 N GLY B 63 4.697 -15.176 9.917 1.00 0.00 N ATOM 2138 CA GLY B 63 4.898 -13.742 10.026 1.00 0.00 C ATOM 2139 C GLY B 63 5.827 -13.204 8.956 1.00 0.00 C ATOM 2140 O GLY B 63 6.727 -12.416 9.245 1.00 0.00 O ATOM 0 H GLY B 63 3.837 -15.454 9.444 1.00 0.00 H new ATOM 0 HA2 GLY B 63 3.935 -13.237 9.954 1.00 0.00 H new ATOM 0 HA3 GLY B 63 5.308 -13.509 11.009 1.00 0.00 H new ATOM 2144 N ILE B 64 5.610 -13.632 7.717 1.00 0.00 N ATOM 2145 CA ILE B 64 6.435 -13.188 6.600 1.00 0.00 C ATOM 2146 C ILE B 64 5.709 -12.141 5.763 1.00 0.00 C ATOM 2147 O ILE B 64 4.543 -12.298 5.401 1.00 0.00 O ATOM 2148 CB ILE B 64 6.836 -14.366 5.693 1.00 0.00 C ATOM 2149 CG1 ILE B 64 7.362 -15.531 6.535 1.00 0.00 C ATOM 2150 CG2 ILE B 64 7.882 -13.923 4.681 1.00 0.00 C ATOM 2151 CD1 ILE B 64 7.962 -16.649 5.713 1.00 0.00 C ATOM 0 H ILE B 64 4.870 -14.286 7.461 1.00 0.00 H new ATOM 0 HA ILE B 64 7.335 -12.747 7.028 1.00 0.00 H new ATOM 0 HB ILE B 64 5.953 -14.704 5.150 1.00 0.00 H new ATOM 0 HG12 ILE B 64 8.115 -15.156 7.228 1.00 0.00 H new ATOM 0 HG13 ILE B 64 6.546 -15.931 7.137 1.00 0.00 H new ATOM 0 HG21 ILE B 64 8.155 -14.767 4.047 1.00 0.00 H new ATOM 0 HG22 ILE B 64 7.475 -13.122 4.064 1.00 0.00 H new ATOM 0 HG23 ILE B 64 8.766 -13.562 5.206 1.00 0.00 H new ATOM 0 HD11 ILE B 64 8.314 -17.440 6.376 1.00 0.00 H new ATOM 0 HD12 ILE B 64 7.206 -17.051 5.038 1.00 0.00 H new ATOM 0 HD13 ILE B 64 8.800 -16.264 5.131 1.00 0.00 H new ATOM 2163 N PRO B 65 6.415 -11.046 5.443 1.00 0.00 N ATOM 2164 CA PRO B 65 5.859 -9.951 4.642 1.00 0.00 C ATOM 2165 C PRO B 65 5.637 -10.352 3.188 1.00 0.00 C ATOM 2166 O PRO B 65 6.591 -10.510 2.425 1.00 0.00 O ATOM 2167 CB PRO B 65 6.929 -8.861 4.740 1.00 0.00 C ATOM 2168 CG PRO B 65 8.195 -9.597 5.012 1.00 0.00 C ATOM 2169 CD PRO B 65 7.810 -10.792 5.840 1.00 0.00 C ATOM 0 HA PRO B 65 4.879 -9.638 5.003 1.00 0.00 H new ATOM 0 HB2 PRO B 65 6.995 -8.287 3.816 1.00 0.00 H new ATOM 0 HB3 PRO B 65 6.702 -8.154 5.538 1.00 0.00 H new ATOM 0 HG2 PRO B 65 8.675 -9.904 4.083 1.00 0.00 H new ATOM 0 HG3 PRO B 65 8.906 -8.966 5.545 1.00 0.00 H new ATOM 0 HD2 PRO B 65 8.450 -11.649 5.631 1.00 0.00 H new ATOM 0 HD3 PRO B 65 7.893 -10.585 6.907 1.00 0.00 H new ATOM 2177 N PHE B 66 4.374 -10.515 2.809 1.00 0.00 N ATOM 2178 CA PHE B 66 4.028 -10.898 1.446 1.00 0.00 C ATOM 2179 C PHE B 66 2.911 -10.013 0.899 1.00 0.00 C ATOM 2180 O PHE B 66 2.372 -9.162 1.609 1.00 0.00 O ATOM 2181 CB PHE B 66 3.599 -12.366 1.399 1.00 0.00 C ATOM 2182 CG PHE B 66 2.242 -12.613 1.994 1.00 0.00 C ATOM 2183 CD1 PHE B 66 2.022 -12.430 3.350 1.00 0.00 C ATOM 2184 CD2 PHE B 66 1.188 -13.030 1.198 1.00 0.00 C ATOM 2185 CE1 PHE B 66 0.775 -12.657 3.901 1.00 0.00 C ATOM 2186 CE2 PHE B 66 -0.062 -13.258 1.744 1.00 0.00 C ATOM 2187 CZ PHE B 66 -0.268 -13.072 3.097 1.00 0.00 C ATOM 0 H PHE B 66 3.573 -10.388 3.427 1.00 0.00 H new ATOM 0 HA PHE B 66 4.912 -10.765 0.823 1.00 0.00 H new ATOM 0 HB2 PHE B 66 3.599 -12.703 0.363 1.00 0.00 H new ATOM 0 HB3 PHE B 66 4.335 -12.969 1.931 1.00 0.00 H new ATOM 0 HD1 PHE B 66 2.835 -12.106 3.984 1.00 0.00 H new ATOM 0 HD2 PHE B 66 1.344 -13.179 0.140 1.00 0.00 H new ATOM 0 HE1 PHE B 66 0.617 -12.510 4.959 1.00 0.00 H new ATOM 0 HE2 PHE B 66 -0.877 -13.581 1.113 1.00 0.00 H new ATOM 0 HZ PHE B 66 -1.243 -13.251 3.525 1.00 0.00 H new ATOM 2197 N THR B 67 2.568 -10.218 -0.369 1.00 0.00 N ATOM 2198 CA THR B 67 1.518 -9.439 -1.013 1.00 0.00 C ATOM 2199 C THR B 67 0.885 -10.214 -2.163 1.00 0.00 C ATOM 2200 O THR B 67 1.528 -10.470 -3.180 1.00 0.00 O ATOM 2201 CB THR B 67 2.060 -8.100 -1.548 1.00 0.00 C ATOM 2202 OG1 THR B 67 2.891 -7.478 -0.561 1.00 0.00 O ATOM 2203 CG2 THR B 67 0.920 -7.164 -1.920 1.00 0.00 C ATOM 0 H THR B 67 3.003 -10.918 -0.971 1.00 0.00 H new ATOM 0 HA THR B 67 0.762 -9.239 -0.254 1.00 0.00 H new ATOM 0 HB THR B 67 2.649 -8.304 -2.442 1.00 0.00 H new ATOM 0 HG1 THR B 67 3.233 -6.628 -0.910 1.00 0.00 H new ATOM 0 HG21 THR B 67 1.328 -6.225 -2.295 1.00 0.00 H new ATOM 0 HG22 THR B 67 0.306 -7.627 -2.692 1.00 0.00 H new ATOM 0 HG23 THR B 67 0.308 -6.968 -1.039 1.00 0.00 H new ATOM 2211 N VAL B 68 -0.380 -10.584 -1.994 1.00 0.00 N ATOM 2212 CA VAL B 68 -1.101 -11.329 -3.020 1.00 0.00 C ATOM 2213 C VAL B 68 -1.735 -10.388 -4.038 1.00 0.00 C ATOM 2214 O VAL B 68 -2.228 -9.316 -3.686 1.00 0.00 O ATOM 2215 CB VAL B 68 -2.200 -12.215 -2.402 1.00 0.00 C ATOM 2216 CG1 VAL B 68 -3.138 -11.381 -1.543 1.00 0.00 C ATOM 2217 CG2 VAL B 68 -2.969 -12.946 -3.492 1.00 0.00 C ATOM 0 H VAL B 68 -0.927 -10.381 -1.157 1.00 0.00 H new ATOM 0 HA VAL B 68 -0.371 -11.965 -3.522 1.00 0.00 H new ATOM 0 HB VAL B 68 -1.726 -12.959 -1.762 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -3.907 -12.024 -1.115 1.00 0.00 H new ATOM 0 HG12 VAL B 68 -2.572 -10.908 -0.740 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -3.607 -10.613 -2.157 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -3.741 -13.567 -3.038 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -3.433 -12.220 -4.159 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -2.284 -13.576 -4.060 1.00 0.00 H new ATOM 2227 N TYR B 69 -1.719 -10.797 -5.302 1.00 0.00 N ATOM 2228 CA TYR B 69 -2.291 -9.989 -6.374 1.00 0.00 C ATOM 2229 C TYR B 69 -3.277 -10.805 -7.204 1.00 0.00 C ATOM 2230 O TYR B 69 -3.183 -12.031 -7.274 1.00 0.00 O ATOM 2231 CB TYR B 69 -1.183 -9.439 -7.273 1.00 0.00 C ATOM 2232 CG TYR B 69 -0.253 -8.477 -6.569 1.00 0.00 C ATOM 2233 CD1 TYR B 69 -0.552 -7.123 -6.491 1.00 0.00 C ATOM 2234 CD2 TYR B 69 0.924 -8.923 -5.980 1.00 0.00 C ATOM 2235 CE1 TYR B 69 0.296 -6.240 -5.849 1.00 0.00 C ATOM 2236 CE2 TYR B 69 1.776 -8.048 -5.335 1.00 0.00 C ATOM 2237 CZ TYR B 69 1.458 -6.708 -5.273 1.00 0.00 C ATOM 2238 OH TYR B 69 2.304 -5.832 -4.631 1.00 0.00 O ATOM 0 H TYR B 69 -1.317 -11.682 -5.610 1.00 0.00 H new ATOM 0 HA TYR B 69 -2.828 -9.156 -5.920 1.00 0.00 H new ATOM 0 HB2 TYR B 69 -0.600 -10.271 -7.668 1.00 0.00 H new ATOM 0 HB3 TYR B 69 -1.636 -8.934 -8.126 1.00 0.00 H new ATOM 0 HD1 TYR B 69 -1.462 -6.754 -6.939 1.00 0.00 H new ATOM 0 HD2 TYR B 69 1.177 -9.972 -6.027 1.00 0.00 H new ATOM 0 HE1 TYR B 69 0.050 -5.190 -5.799 1.00 0.00 H new ATOM 0 HE2 TYR B 69 2.686 -8.412 -4.882 1.00 0.00 H new ATOM 0 HH TYR B 69 3.077 -6.322 -4.279 1.00 0.00 H new ATOM 2248 N VAL B 70 -4.224 -10.116 -7.832 1.00 0.00 N ATOM 2249 CA VAL B 70 -5.228 -10.775 -8.660 1.00 0.00 C ATOM 2250 C VAL B 70 -5.707 -9.856 -9.778 1.00 0.00 C ATOM 2251 O VAL B 70 -5.713 -8.635 -9.631 1.00 0.00 O ATOM 2252 CB VAL B 70 -6.441 -11.221 -7.822 1.00 0.00 C ATOM 2253 CG1 VAL B 70 -7.191 -10.012 -7.283 1.00 0.00 C ATOM 2254 CG2 VAL B 70 -7.362 -12.106 -8.648 1.00 0.00 C ATOM 0 H VAL B 70 -4.317 -9.101 -7.783 1.00 0.00 H new ATOM 0 HA VAL B 70 -4.753 -11.654 -9.095 1.00 0.00 H new ATOM 0 HB VAL B 70 -6.081 -11.803 -6.973 1.00 0.00 H new ATOM 0 HG11 VAL B 70 -8.045 -10.347 -6.694 1.00 0.00 H new ATOM 0 HG12 VAL B 70 -6.525 -9.421 -6.654 1.00 0.00 H new ATOM 0 HG13 VAL B 70 -7.542 -9.401 -8.115 1.00 0.00 H new ATOM 0 HG21 VAL B 70 -8.214 -12.412 -8.040 1.00 0.00 H new ATOM 0 HG22 VAL B 70 -7.717 -11.551 -9.517 1.00 0.00 H new ATOM 0 HG23 VAL B 70 -6.817 -12.990 -8.979 1.00 0.00 H new ATOM 2264 N GLU B 71 -6.107 -10.454 -10.896 1.00 0.00 N ATOM 2265 CA GLU B 71 -6.588 -9.688 -12.041 1.00 0.00 C ATOM 2266 C GLU B 71 -7.691 -8.721 -11.623 1.00 0.00 C ATOM 2267 O GLU B 71 -8.813 -9.133 -11.330 1.00 0.00 O ATOM 2268 CB GLU B 71 -7.104 -10.629 -13.131 1.00 0.00 C ATOM 2269 CG GLU B 71 -7.444 -9.923 -14.433 1.00 0.00 C ATOM 2270 CD GLU B 71 -8.861 -9.384 -14.452 1.00 0.00 C ATOM 2271 OE1 GLU B 71 -9.754 -10.044 -13.880 1.00 0.00 O ATOM 2272 OE2 GLU B 71 -9.077 -8.303 -15.038 1.00 0.00 O ATOM 0 H GLU B 71 -6.108 -11.465 -11.034 1.00 0.00 H new ATOM 0 HA GLU B 71 -5.753 -9.110 -12.437 1.00 0.00 H new ATOM 0 HB2 GLU B 71 -6.351 -11.392 -13.327 1.00 0.00 H new ATOM 0 HB3 GLU B 71 -7.992 -11.144 -12.764 1.00 0.00 H new ATOM 0 HG2 GLU B 71 -6.745 -9.102 -14.590 1.00 0.00 H new ATOM 0 HG3 GLU B 71 -7.312 -10.617 -15.263 1.00 0.00 H new ATOM 2279 N GLU B 72 -7.363 -7.433 -11.600 1.00 0.00 N ATOM 2280 CA GLU B 72 -8.326 -6.407 -11.217 1.00 0.00 C ATOM 2281 C GLU B 72 -9.618 -6.547 -12.018 1.00 0.00 C ATOM 2282 O GLU B 72 -10.714 -6.431 -11.471 1.00 0.00 O ATOM 2283 CB GLU B 72 -7.731 -5.013 -11.428 1.00 0.00 C ATOM 2284 CG GLU B 72 -7.684 -4.586 -12.885 1.00 0.00 C ATOM 2285 CD GLU B 72 -6.794 -5.480 -13.727 1.00 0.00 C ATOM 2286 OE1 GLU B 72 -5.740 -5.914 -13.218 1.00 0.00 O ATOM 2287 OE2 GLU B 72 -7.152 -5.745 -14.893 1.00 0.00 O ATOM 0 H GLU B 72 -6.439 -7.075 -11.842 1.00 0.00 H new ATOM 0 HA GLU B 72 -8.558 -6.539 -10.160 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -8.318 -4.288 -10.864 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -6.721 -4.993 -11.019 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -8.694 -4.595 -13.295 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -7.324 -3.559 -12.947 1.00 0.00 H new