USER MOD reduce.3.24.130724 H: found=0, std=0, add=949, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 950 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 30 HIS : no HE2:sc= -2.07! C(o=-2.9!,f=-5.1!) USER MOD Set 1.2: A 124 SER OG : rot -134:sc= -0.841 USER MOD Set 2.1: A 104 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 106 THR OG1 : rot 180:sc= 0.0151 USER MOD Set 3.1: A 74 SER OG : rot -130:sc= 0.133 USER MOD Set 3.2: A 114 LYS NZ :NH3+ -132:sc= -2.27! (180deg=-2.03!) USER MOD Set 4.1: A 29 TYR OH : rot 131:sc= -4.16! USER MOD Set 4.2: A 34 LYS NZ :NH3+ 147:sc= -0.164! (180deg=-1.48!) USER MOD Set 5.1: A 5 ASN : amide:sc= -2.5 K(o=-1.9,f=-12!) USER MOD Set 5.2: A 62 LYS NZ :NH3+ 167:sc= 0.61 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 150:sc= -0.217 (180deg=-0.485) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -2.58 K(o=-2.6,f=-3.7!) USER MOD Single : A 12 GLN : amide:sc= -0.92 X(o=-0.92,f=-0.84) USER MOD Single : A 14 LYS NZ :NH3+ -134:sc= -1.19! (180deg=-2.81!) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 167:sc= -3.85! USER MOD Single : A 25 ASN : amide:sc= -1.34 X(o=-1.3,f=-1.5) USER MOD Single : A 31 LYS NZ :NH3+ -161:sc= -0.019 (180deg=-0.236) USER MOD Single : A 38 THR OG1 : rot 45:sc= -6.12! USER MOD Single : A 42 ASN : amide:sc= -1.7 X(o=-1.7,f=-1.9) USER MOD Single : A 43 LYS NZ :NH3+ -151:sc= -0.294 (180deg=-1.09!) USER MOD Single : A 49 ASN : amide:sc= 0.108 X(o=0.11,f=-0.13) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 141:sc= 0.0301! USER MOD Single : A 59 ASN : amide:sc= -4.29! C(o=-4.3!,f=-19!) USER MOD Single : A 64 SER OG : rot -100:sc= -1.4 USER MOD Single : A 73 ASN : amide:sc= -1.52 K(o=-1.5,f=-0.37) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot -21:sc= -5.44! USER MOD Single : A 85 ASN : amide:sc= -9.89 X(o=-9.9,f=-10!) USER MOD Single : A 87 ASN : amide:sc= -4.96 K(o=-5,f=-5.7!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= -1.89 (180deg=-1.89) USER MOD Single : A 97 MET CE :methyl -122:sc= -4.67! (180deg=-12.3!) USER MOD Single : A 99 SER OG : rot 180:sc= 0.0364 USER MOD Single : A 100 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00127) USER MOD Single : A 101 ASN : amide:sc= -9.51! C(o=-9.5!,f=-19!) USER MOD Single : A 105 THR OG1 : rot -84:sc= 1.19 USER MOD Single : A 107 ASN : amide:sc= -0.382 X(o=-0.38,f=-0.51) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0.0876 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -5.7 X(o=-5.7,f=-6.2!) USER MOD Single : A 117 SER OG : rot 180:sc= -1.18 USER MOD Single : A 121 TYR OH : rot -121:sc= 0.131 USER MOD Single : A 127 ASN : amide:sc= -0.388 K(o=-0.39,f=-1.9!) USER MOD Single : A 128 HIS : no HD1:sc= 0 K(o=0,f=-0.53) USER MOD ----------------------------------------------------------------- ATOM 32 N LYS A 3 -14.871 21.050 -1.034 1.00 0.00 N ATOM 33 CA LYS A 3 -15.335 19.851 -0.342 1.00 0.00 C ATOM 34 C LYS A 3 -15.345 18.654 -1.286 1.00 0.00 C ATOM 35 O LYS A 3 -16.114 17.711 -1.101 1.00 0.00 O ATOM 36 CB LYS A 3 -16.741 20.077 0.223 1.00 0.00 C ATOM 37 CG LYS A 3 -16.827 19.929 1.733 1.00 0.00 C ATOM 38 CD LYS A 3 -16.089 21.049 2.449 1.00 0.00 C ATOM 39 CE LYS A 3 -16.579 22.419 2.004 1.00 0.00 C ATOM 40 NZ LYS A 3 -18.066 22.485 1.944 1.00 0.00 N ATOM 0 HA LYS A 3 -14.648 19.643 0.478 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -17.078 21.076 -0.054 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -17.427 19.369 -0.242 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -17.873 19.928 2.040 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -16.407 18.968 2.029 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -16.226 20.945 3.525 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -15.020 20.964 2.254 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -16.210 23.178 2.693 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -16.165 22.651 1.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -18.379 23.457 2.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -18.388 22.206 0.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -18.471 21.839 2.651 1.00 0.00 H new ATOM 54 N THR A 4 -14.491 18.701 -2.302 1.00 0.00 N ATOM 55 CA THR A 4 -14.409 17.624 -3.280 1.00 0.00 C ATOM 56 C THR A 4 -13.365 16.589 -2.876 1.00 0.00 C ATOM 57 O THR A 4 -13.667 15.403 -2.762 1.00 0.00 O ATOM 58 CB THR A 4 -14.074 18.189 -4.661 1.00 0.00 C ATOM 59 OG1 THR A 4 -14.988 19.209 -5.021 1.00 0.00 O ATOM 60 CG2 THR A 4 -14.097 17.144 -5.756 1.00 0.00 C ATOM 0 H THR A 4 -13.846 19.473 -2.469 1.00 0.00 H new ATOM 0 HA THR A 4 -15.381 17.131 -3.318 1.00 0.00 H new ATOM 0 HB THR A 4 -13.060 18.580 -4.575 1.00 0.00 H new ATOM 0 HG1 THR A 4 -14.756 19.559 -5.907 1.00 0.00 H new ATOM 0 HG21 THR A 4 -13.851 17.611 -6.710 1.00 0.00 H new ATOM 0 HG22 THR A 4 -13.366 16.367 -5.533 1.00 0.00 H new ATOM 0 HG23 THR A 4 -15.091 16.701 -5.815 1.00 0.00 H new ATOM 68 N ASN A 5 -12.133 17.046 -2.670 1.00 0.00 N ATOM 69 CA ASN A 5 -11.037 16.158 -2.294 1.00 0.00 C ATOM 70 C ASN A 5 -11.417 15.252 -1.126 1.00 0.00 C ATOM 71 O ASN A 5 -11.061 14.076 -1.108 1.00 0.00 O ATOM 72 CB ASN A 5 -9.788 16.972 -1.952 1.00 0.00 C ATOM 73 CG ASN A 5 -8.824 17.052 -3.119 1.00 0.00 C ATOM 74 OD1 ASN A 5 -7.608 16.987 -2.941 1.00 0.00 O ATOM 75 ND2 ASN A 5 -9.366 17.192 -4.325 1.00 0.00 N ATOM 0 H ASN A 5 -11.868 18.027 -2.757 1.00 0.00 H new ATOM 0 HA ASN A 5 -10.823 15.518 -3.150 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -10.082 17.979 -1.655 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -9.285 16.521 -1.097 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -8.768 17.250 -5.149 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -10.380 17.241 -4.426 1.00 0.00 H new ATOM 82 N LEU A 6 -12.146 15.795 -0.156 1.00 0.00 N ATOM 83 CA LEU A 6 -12.568 15.015 0.994 1.00 0.00 C ATOM 84 C LEU A 6 -13.783 14.176 0.641 1.00 0.00 C ATOM 85 O LEU A 6 -13.724 12.952 0.659 1.00 0.00 O ATOM 86 CB LEU A 6 -12.882 15.929 2.172 1.00 0.00 C ATOM 87 CG LEU A 6 -11.737 16.091 3.165 1.00 0.00 C ATOM 88 CD1 LEU A 6 -11.042 17.429 2.965 1.00 0.00 C ATOM 89 CD2 LEU A 6 -12.247 15.949 4.588 1.00 0.00 C ATOM 0 H LEU A 6 -12.454 16.767 -0.146 1.00 0.00 H new ATOM 0 HA LEU A 6 -11.753 14.350 1.280 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -13.158 16.912 1.790 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -13.751 15.536 2.699 1.00 0.00 H new ATOM 0 HG LEU A 6 -11.006 15.302 2.986 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -10.227 17.527 3.683 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -10.642 17.483 1.953 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -11.758 18.237 3.116 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -11.418 16.067 5.285 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -12.997 16.715 4.784 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -12.693 14.963 4.718 1.00 0.00 H new ATOM 101 N GLY A 7 -14.881 14.841 0.297 1.00 0.00 N ATOM 102 CA GLY A 7 -16.086 14.125 -0.077 1.00 0.00 C ATOM 103 C GLY A 7 -15.814 13.059 -1.122 1.00 0.00 C ATOM 104 O GLY A 7 -16.573 12.102 -1.255 1.00 0.00 O ATOM 0 H GLY A 7 -14.958 15.858 0.271 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -16.522 13.662 0.808 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -16.822 14.831 -0.462 1.00 0.00 H new ATOM 108 N GLU A 8 -14.721 13.226 -1.862 1.00 0.00 N ATOM 109 CA GLU A 8 -14.345 12.272 -2.898 1.00 0.00 C ATOM 110 C GLU A 8 -13.349 11.245 -2.362 1.00 0.00 C ATOM 111 O GLU A 8 -13.201 10.162 -2.929 1.00 0.00 O ATOM 112 CB GLU A 8 -13.750 13.003 -4.110 1.00 0.00 C ATOM 113 CG GLU A 8 -12.289 13.397 -3.945 1.00 0.00 C ATOM 114 CD GLU A 8 -11.361 12.582 -4.825 1.00 0.00 C ATOM 115 OE1 GLU A 8 -11.307 11.348 -4.647 1.00 0.00 O ATOM 116 OE2 GLU A 8 -10.690 13.180 -5.693 1.00 0.00 O ATOM 0 H GLU A 8 -14.081 14.014 -1.762 1.00 0.00 H new ATOM 0 HA GLU A 8 -15.245 11.744 -3.212 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -13.846 12.365 -4.988 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -14.337 13.901 -4.303 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -12.173 14.454 -4.183 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -11.998 13.271 -2.902 1.00 0.00 H new ATOM 123 N LEU A 9 -12.668 11.583 -1.267 1.00 0.00 N ATOM 124 CA LEU A 9 -11.697 10.676 -0.672 1.00 0.00 C ATOM 125 C LEU A 9 -12.299 9.960 0.529 1.00 0.00 C ATOM 126 O LEU A 9 -11.812 8.911 0.949 1.00 0.00 O ATOM 127 CB LEU A 9 -10.439 11.437 -0.249 1.00 0.00 C ATOM 128 CG LEU A 9 -9.448 11.741 -1.376 1.00 0.00 C ATOM 129 CD1 LEU A 9 -8.193 12.397 -0.820 1.00 0.00 C ATOM 130 CD2 LEU A 9 -9.098 10.469 -2.136 1.00 0.00 C ATOM 0 H LEU A 9 -12.772 12.473 -0.780 1.00 0.00 H new ATOM 0 HA LEU A 9 -11.423 9.934 -1.422 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -10.741 12.378 0.211 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -9.925 10.858 0.518 1.00 0.00 H new ATOM 0 HG LEU A 9 -9.918 12.437 -2.071 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -7.500 12.606 -1.635 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -8.460 13.329 -0.323 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -7.719 11.726 -0.103 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -8.393 10.704 -2.933 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -8.647 9.749 -1.453 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -10.004 10.042 -2.567 1.00 0.00 H new ATOM 142 N ILE A 10 -13.359 10.541 1.084 1.00 0.00 N ATOM 143 CA ILE A 10 -14.017 9.965 2.239 1.00 0.00 C ATOM 144 C ILE A 10 -15.149 9.031 1.831 1.00 0.00 C ATOM 145 O ILE A 10 -15.208 7.894 2.292 1.00 0.00 O ATOM 146 CB ILE A 10 -14.544 11.053 3.199 1.00 0.00 C ATOM 147 CG1 ILE A 10 -15.717 11.850 2.600 1.00 0.00 C ATOM 148 CG2 ILE A 10 -13.430 11.995 3.577 1.00 0.00 C ATOM 149 CD1 ILE A 10 -16.036 13.140 3.357 1.00 0.00 C ATOM 0 H ILE A 10 -13.776 11.409 0.749 1.00 0.00 H new ATOM 0 HA ILE A 10 -13.264 9.381 2.768 1.00 0.00 H new ATOM 0 HB ILE A 10 -14.916 10.542 4.087 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -15.486 12.096 1.563 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -16.605 11.218 2.587 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -13.813 12.758 4.254 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -12.634 11.438 4.071 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -13.036 12.471 2.679 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -16.873 13.646 2.876 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -16.300 12.902 4.387 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -15.163 13.793 3.348 1.00 0.00 H new ATOM 161 N ASN A 11 -16.042 9.501 0.957 1.00 0.00 N ATOM 162 CA ASN A 11 -17.162 8.679 0.492 1.00 0.00 C ATOM 163 C ASN A 11 -16.716 7.238 0.286 1.00 0.00 C ATOM 164 O ASN A 11 -17.406 6.295 0.669 1.00 0.00 O ATOM 165 CB ASN A 11 -17.721 9.228 -0.819 1.00 0.00 C ATOM 166 CG ASN A 11 -18.610 10.434 -0.608 1.00 0.00 C ATOM 167 OD1 ASN A 11 -19.036 10.721 0.510 1.00 0.00 O ATOM 168 ND2 ASN A 11 -18.895 11.146 -1.689 1.00 0.00 N ATOM 0 H ASN A 11 -16.012 10.440 0.559 1.00 0.00 H new ATOM 0 HA ASN A 11 -17.941 8.708 1.254 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -16.896 9.499 -1.477 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -18.288 8.446 -1.325 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -19.491 11.971 -1.614 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -18.519 10.869 -2.596 1.00 0.00 H new ATOM 175 N GLN A 12 -15.543 7.092 -0.314 1.00 0.00 N ATOM 176 CA GLN A 12 -14.971 5.778 -0.570 1.00 0.00 C ATOM 177 C GLN A 12 -14.103 5.329 0.602 1.00 0.00 C ATOM 178 O GLN A 12 -13.984 4.138 0.876 1.00 0.00 O ATOM 179 CB GLN A 12 -14.138 5.804 -1.853 1.00 0.00 C ATOM 180 CG GLN A 12 -12.918 6.706 -1.763 1.00 0.00 C ATOM 181 CD GLN A 12 -12.045 6.637 -3.001 1.00 0.00 C ATOM 182 OE1 GLN A 12 -12.380 5.962 -3.975 1.00 0.00 O ATOM 183 NE2 GLN A 12 -10.917 7.336 -2.968 1.00 0.00 N ATOM 0 H GLN A 12 -14.967 7.871 -0.634 1.00 0.00 H new ATOM 0 HA GLN A 12 -15.789 5.068 -0.690 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -13.814 4.790 -2.088 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -14.767 6.137 -2.679 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -13.243 7.735 -1.610 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -12.327 6.425 -0.891 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -10.679 7.882 -2.140 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -10.288 7.328 -3.771 1.00 0.00 H new ATOM 192 N GLY A 13 -13.496 6.294 1.287 1.00 0.00 N ATOM 193 CA GLY A 13 -12.644 5.982 2.421 1.00 0.00 C ATOM 194 C GLY A 13 -13.391 5.290 3.546 1.00 0.00 C ATOM 195 O GLY A 13 -13.105 4.138 3.871 1.00 0.00 O ATOM 0 H GLY A 13 -13.579 7.289 1.076 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -11.825 5.344 2.089 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -12.199 6.902 2.799 1.00 0.00 H new ATOM 199 N LYS A 14 -14.357 5.988 4.141 1.00 0.00 N ATOM 200 CA LYS A 14 -15.144 5.415 5.232 1.00 0.00 C ATOM 201 C LYS A 14 -15.868 4.163 4.752 1.00 0.00 C ATOM 202 O LYS A 14 -16.229 3.297 5.549 1.00 0.00 O ATOM 203 CB LYS A 14 -16.147 6.426 5.826 1.00 0.00 C ATOM 204 CG LYS A 14 -16.649 7.490 4.858 1.00 0.00 C ATOM 205 CD LYS A 14 -16.984 8.794 5.577 1.00 0.00 C ATOM 206 CE LYS A 14 -16.923 9.990 4.632 1.00 0.00 C ATOM 207 NZ LYS A 14 -18.249 10.653 4.482 1.00 0.00 N ATOM 0 H LYS A 14 -14.612 6.943 3.889 1.00 0.00 H new ATOM 0 HA LYS A 14 -14.451 5.149 6.030 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -17.005 5.877 6.213 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -15.677 6.923 6.675 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -15.890 7.678 4.098 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -17.535 7.122 4.340 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -17.981 8.724 6.012 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -16.287 8.945 6.401 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -16.198 10.712 5.007 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -16.569 9.662 3.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -18.433 10.838 3.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -18.992 10.032 4.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -18.249 11.552 5.005 1.00 0.00 H new ATOM 221 N SER A 15 -16.049 4.059 3.438 1.00 0.00 N ATOM 222 CA SER A 15 -16.696 2.901 2.844 1.00 0.00 C ATOM 223 C SER A 15 -15.674 1.786 2.651 1.00 0.00 C ATOM 224 O SER A 15 -15.999 0.604 2.753 1.00 0.00 O ATOM 225 CB SER A 15 -17.334 3.270 1.504 1.00 0.00 C ATOM 226 OG SER A 15 -18.381 2.373 1.173 1.00 0.00 O ATOM 0 H SER A 15 -15.754 4.767 2.766 1.00 0.00 H new ATOM 0 HA SER A 15 -17.483 2.555 3.514 1.00 0.00 H new ATOM 0 HB2 SER A 15 -17.723 4.287 1.551 1.00 0.00 H new ATOM 0 HB3 SER A 15 -16.576 3.255 0.720 1.00 0.00 H new ATOM 0 HG SER A 15 -18.773 2.631 0.313 1.00 0.00 H new ATOM 232 N LEU A 16 -14.427 2.179 2.394 1.00 0.00 N ATOM 233 CA LEU A 16 -13.342 1.231 2.209 1.00 0.00 C ATOM 234 C LEU A 16 -13.075 0.520 3.519 1.00 0.00 C ATOM 235 O LEU A 16 -13.221 -0.695 3.617 1.00 0.00 O ATOM 236 CB LEU A 16 -12.078 1.954 1.743 1.00 0.00 C ATOM 237 CG LEU A 16 -10.989 1.058 1.151 1.00 0.00 C ATOM 238 CD1 LEU A 16 -9.927 1.902 0.463 1.00 0.00 C ATOM 239 CD2 LEU A 16 -10.366 0.188 2.234 1.00 0.00 C ATOM 0 H LEU A 16 -14.147 3.156 2.310 1.00 0.00 H new ATOM 0 HA LEU A 16 -13.626 0.505 1.447 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -12.359 2.697 0.996 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -11.658 2.497 2.590 1.00 0.00 H new ATOM 0 HG LEU A 16 -11.444 0.403 0.408 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -9.158 1.251 0.046 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -10.385 2.481 -0.339 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -9.475 2.579 1.187 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -9.593 -0.443 1.794 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.923 0.823 3.001 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -11.135 -0.440 2.683 1.00 0.00 H new ATOM 251 N LEU A 17 -12.706 1.294 4.536 1.00 0.00 N ATOM 252 CA LEU A 17 -12.444 0.755 5.849 1.00 0.00 C ATOM 253 C LEU A 17 -13.572 -0.179 6.280 1.00 0.00 C ATOM 254 O LEU A 17 -13.338 -1.224 6.881 1.00 0.00 O ATOM 255 CB LEU A 17 -12.309 1.900 6.846 1.00 0.00 C ATOM 256 CG LEU A 17 -11.430 1.598 8.053 1.00 0.00 C ATOM 257 CD1 LEU A 17 -10.115 2.365 7.962 1.00 0.00 C ATOM 258 CD2 LEU A 17 -12.175 1.927 9.340 1.00 0.00 C ATOM 0 H LEU A 17 -12.583 2.304 4.465 1.00 0.00 H new ATOM 0 HA LEU A 17 -11.516 0.183 5.819 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -11.903 2.768 6.327 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -13.303 2.175 7.198 1.00 0.00 H new ATOM 0 HG LEU A 17 -11.193 0.534 8.061 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -9.500 2.137 8.833 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -9.585 2.072 7.056 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -10.319 3.435 7.932 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -11.537 1.707 10.196 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -12.440 2.984 9.347 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -13.082 1.325 9.399 1.00 0.00 H new ATOM 270 N ASP A 18 -14.800 0.220 5.963 1.00 0.00 N ATOM 271 CA ASP A 18 -15.982 -0.566 6.314 1.00 0.00 C ATOM 272 C ASP A 18 -16.330 -1.594 5.232 1.00 0.00 C ATOM 273 O ASP A 18 -17.300 -2.339 5.371 1.00 0.00 O ATOM 274 CB ASP A 18 -17.176 0.359 6.549 1.00 0.00 C ATOM 275 CG ASP A 18 -18.111 -0.163 7.622 1.00 0.00 C ATOM 276 OD1 ASP A 18 -18.222 -1.400 7.760 1.00 0.00 O ATOM 277 OD2 ASP A 18 -18.732 0.663 8.324 1.00 0.00 O ATOM 0 H ASP A 18 -15.005 1.085 5.462 1.00 0.00 H new ATOM 0 HA ASP A 18 -15.751 -1.111 7.229 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -16.815 1.347 6.835 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -17.728 0.478 5.617 1.00 0.00 H new ATOM 282 N GLU A 19 -15.537 -1.642 4.164 1.00 0.00 N ATOM 283 CA GLU A 19 -15.767 -2.588 3.085 1.00 0.00 C ATOM 284 C GLU A 19 -14.730 -3.680 3.167 1.00 0.00 C ATOM 285 O GLU A 19 -15.022 -4.860 2.977 1.00 0.00 O ATOM 286 CB GLU A 19 -15.699 -1.889 1.723 1.00 0.00 C ATOM 287 CG GLU A 19 -15.756 -2.844 0.540 1.00 0.00 C ATOM 288 CD GLU A 19 -15.727 -2.123 -0.793 1.00 0.00 C ATOM 289 OE1 GLU A 19 -16.451 -1.115 -0.939 1.00 0.00 O ATOM 290 OE2 GLU A 19 -14.982 -2.566 -1.692 1.00 0.00 O ATOM 0 H GLU A 19 -14.729 -1.034 4.027 1.00 0.00 H new ATOM 0 HA GLU A 19 -16.764 -3.017 3.188 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -16.524 -1.181 1.647 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -14.777 -1.311 1.667 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -14.914 -3.534 0.594 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -16.664 -3.443 0.605 1.00 0.00 H new ATOM 297 N SER A 20 -13.511 -3.264 3.476 1.00 0.00 N ATOM 298 CA SER A 20 -12.419 -4.175 3.614 1.00 0.00 C ATOM 299 C SER A 20 -12.642 -5.045 4.827 1.00 0.00 C ATOM 300 O SER A 20 -13.699 -5.009 5.458 1.00 0.00 O ATOM 301 CB SER A 20 -11.099 -3.415 3.745 1.00 0.00 C ATOM 302 OG SER A 20 -11.324 -2.031 3.939 1.00 0.00 O ATOM 0 H SER A 20 -13.266 -2.287 3.635 1.00 0.00 H new ATOM 0 HA SER A 20 -12.364 -4.802 2.724 1.00 0.00 H new ATOM 0 HB2 SER A 20 -10.528 -3.814 4.583 1.00 0.00 H new ATOM 0 HB3 SER A 20 -10.498 -3.567 2.848 1.00 0.00 H new ATOM 0 HG SER A 20 -10.493 -1.602 4.232 1.00 0.00 H new ATOM 308 N VAL A 21 -11.646 -5.827 5.128 1.00 0.00 N ATOM 309 CA VAL A 21 -11.706 -6.735 6.257 1.00 0.00 C ATOM 310 C VAL A 21 -10.321 -7.120 6.750 1.00 0.00 C ATOM 311 O VAL A 21 -9.511 -7.637 5.989 1.00 0.00 O ATOM 312 CB VAL A 21 -12.481 -8.004 5.875 1.00 0.00 C ATOM 313 CG1 VAL A 21 -11.974 -8.555 4.552 1.00 0.00 C ATOM 314 CG2 VAL A 21 -12.400 -9.055 6.975 1.00 0.00 C ATOM 0 H VAL A 21 -10.770 -5.860 4.606 1.00 0.00 H new ATOM 0 HA VAL A 21 -12.220 -6.214 7.064 1.00 0.00 H new ATOM 0 HB VAL A 21 -13.531 -7.738 5.757 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -12.533 -9.455 4.294 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -12.110 -7.807 3.771 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -10.915 -8.799 4.641 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -12.959 -9.941 6.674 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -11.358 -9.324 7.145 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -12.826 -8.653 7.894 1.00 0.00 H new ATOM 324 N GLU A 22 -10.061 -6.897 8.025 1.00 0.00 N ATOM 325 CA GLU A 22 -8.774 -7.265 8.593 1.00 0.00 C ATOM 326 C GLU A 22 -8.742 -8.765 8.886 1.00 0.00 C ATOM 327 O GLU A 22 -9.418 -9.241 9.799 1.00 0.00 O ATOM 328 CB GLU A 22 -8.509 -6.486 9.883 1.00 0.00 C ATOM 329 CG GLU A 22 -9.485 -6.803 11.004 1.00 0.00 C ATOM 330 CD GLU A 22 -8.901 -7.746 12.038 1.00 0.00 C ATOM 331 OE1 GLU A 22 -7.690 -7.634 12.325 1.00 0.00 O ATOM 332 OE2 GLU A 22 -9.653 -8.594 12.561 1.00 0.00 O ATOM 0 H GLU A 22 -10.714 -6.468 8.681 1.00 0.00 H new ATOM 0 HA GLU A 22 -7.997 -7.019 7.869 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -7.496 -6.701 10.224 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -8.553 -5.419 9.667 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -9.785 -5.876 11.492 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -10.386 -7.247 10.581 1.00 0.00 H new ATOM 339 N GLY A 23 -7.957 -9.505 8.112 1.00 0.00 N ATOM 340 CA GLY A 23 -7.857 -10.937 8.313 1.00 0.00 C ATOM 341 C GLY A 23 -6.419 -11.405 8.394 1.00 0.00 C ATOM 342 O GLY A 23 -5.797 -11.344 9.455 1.00 0.00 O ATOM 0 H GLY A 23 -7.388 -9.138 7.349 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -8.378 -11.211 9.230 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -8.360 -11.453 7.495 1.00 0.00 H new ATOM 346 N PHE A 24 -5.888 -11.871 7.269 1.00 0.00 N ATOM 347 CA PHE A 24 -4.510 -12.351 7.209 1.00 0.00 C ATOM 348 C PHE A 24 -4.222 -12.998 5.859 1.00 0.00 C ATOM 349 O PHE A 24 -3.545 -14.023 5.785 1.00 0.00 O ATOM 350 CB PHE A 24 -4.237 -13.351 8.337 1.00 0.00 C ATOM 351 CG PHE A 24 -5.366 -14.315 8.575 1.00 0.00 C ATOM 352 CD1 PHE A 24 -5.800 -15.158 7.565 1.00 0.00 C ATOM 353 CD2 PHE A 24 -5.992 -14.376 9.810 1.00 0.00 C ATOM 354 CE1 PHE A 24 -6.838 -16.045 7.782 1.00 0.00 C ATOM 355 CE2 PHE A 24 -7.030 -15.261 10.033 1.00 0.00 C ATOM 356 CZ PHE A 24 -7.453 -16.096 9.017 1.00 0.00 C ATOM 0 H PHE A 24 -6.391 -11.927 6.384 1.00 0.00 H new ATOM 0 HA PHE A 24 -3.849 -11.493 7.333 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -3.334 -13.914 8.101 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -4.039 -12.802 9.258 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -5.322 -15.122 6.597 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -5.665 -13.725 10.607 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -7.167 -16.697 6.987 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -7.510 -15.300 11.000 1.00 0.00 H new ATOM 0 HZ PHE A 24 -8.264 -16.788 9.189 1.00 0.00 H new ATOM 366 N ASN A 25 -4.741 -12.397 4.793 1.00 0.00 N ATOM 367 CA ASN A 25 -4.533 -12.928 3.448 1.00 0.00 C ATOM 368 C ASN A 25 -5.041 -11.958 2.387 1.00 0.00 C ATOM 369 O ASN A 25 -5.609 -10.915 2.707 1.00 0.00 O ATOM 370 CB ASN A 25 -5.237 -14.279 3.299 1.00 0.00 C ATOM 371 CG ASN A 25 -4.307 -15.447 3.567 1.00 0.00 C ATOM 372 OD1 ASN A 25 -3.224 -15.538 2.991 1.00 0.00 O ATOM 373 ND2 ASN A 25 -4.729 -16.349 4.447 1.00 0.00 N ATOM 0 H ASN A 25 -5.305 -11.548 4.832 1.00 0.00 H new ATOM 0 HA ASN A 25 -3.461 -13.062 3.302 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -6.081 -14.324 3.988 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -5.643 -14.365 2.291 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -4.147 -17.157 4.668 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -5.635 -16.233 4.901 1.00 0.00 H new ATOM 380 N VAL A 26 -4.835 -12.313 1.119 1.00 0.00 N ATOM 381 CA VAL A 26 -5.276 -11.476 0.009 1.00 0.00 C ATOM 382 C VAL A 26 -6.750 -11.116 0.155 1.00 0.00 C ATOM 383 O VAL A 26 -7.615 -11.992 0.171 1.00 0.00 O ATOM 384 CB VAL A 26 -5.055 -12.171 -1.350 1.00 0.00 C ATOM 385 CG1 VAL A 26 -5.848 -13.467 -1.426 1.00 0.00 C ATOM 386 CG2 VAL A 26 -5.426 -11.241 -2.497 1.00 0.00 C ATOM 0 H VAL A 26 -4.366 -13.174 0.837 1.00 0.00 H new ATOM 0 HA VAL A 26 -4.675 -10.567 0.037 1.00 0.00 H new ATOM 0 HB VAL A 26 -3.997 -12.415 -1.441 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.678 -13.941 -2.393 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -5.525 -14.138 -0.630 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.910 -13.251 -1.310 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -5.263 -11.751 -3.446 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -6.476 -10.960 -2.412 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -4.806 -10.346 -2.455 1.00 0.00 H new ATOM 396 N GLY A 27 -7.027 -9.825 0.275 1.00 0.00 N ATOM 397 CA GLY A 27 -8.395 -9.374 0.435 1.00 0.00 C ATOM 398 C GLY A 27 -8.684 -8.922 1.854 1.00 0.00 C ATOM 399 O GLY A 27 -9.677 -8.239 2.103 1.00 0.00 O ATOM 0 H GLY A 27 -6.329 -9.082 0.264 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -8.588 -8.551 -0.254 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -9.076 -10.181 0.166 1.00 0.00 H new ATOM 403 N GLU A 28 -7.810 -9.300 2.786 1.00 0.00 N ATOM 404 CA GLU A 28 -7.969 -8.925 4.177 1.00 0.00 C ATOM 405 C GLU A 28 -6.637 -8.497 4.763 1.00 0.00 C ATOM 406 O GLU A 28 -5.623 -9.159 4.570 1.00 0.00 O ATOM 407 CB GLU A 28 -8.555 -10.089 4.983 1.00 0.00 C ATOM 408 CG GLU A 28 -9.665 -10.835 4.262 1.00 0.00 C ATOM 409 CD GLU A 28 -10.760 -11.302 5.201 1.00 0.00 C ATOM 410 OE1 GLU A 28 -10.509 -11.361 6.423 1.00 0.00 O ATOM 411 OE2 GLU A 28 -11.869 -11.611 4.715 1.00 0.00 O ATOM 0 H GLU A 28 -6.984 -9.867 2.595 1.00 0.00 H new ATOM 0 HA GLU A 28 -8.660 -8.084 4.231 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -7.756 -10.790 5.225 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -8.941 -9.707 5.928 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -10.097 -10.187 3.500 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -9.242 -11.697 3.746 1.00 0.00 H new ATOM 418 N TYR A 29 -6.646 -7.378 5.471 1.00 0.00 N ATOM 419 CA TYR A 29 -5.426 -6.853 6.071 1.00 0.00 C ATOM 420 C TYR A 29 -5.262 -7.351 7.500 1.00 0.00 C ATOM 421 O TYR A 29 -6.191 -7.897 8.082 1.00 0.00 O ATOM 422 CB TYR A 29 -5.444 -5.326 6.033 1.00 0.00 C ATOM 423 CG TYR A 29 -6.432 -4.704 6.988 1.00 0.00 C ATOM 424 CD1 TYR A 29 -7.770 -4.532 6.636 1.00 0.00 C ATOM 425 CD2 TYR A 29 -6.022 -4.284 8.247 1.00 0.00 C ATOM 426 CE1 TYR A 29 -8.663 -3.960 7.513 1.00 0.00 C ATOM 427 CE2 TYR A 29 -6.915 -3.708 9.128 1.00 0.00 C ATOM 428 CZ TYR A 29 -8.235 -3.549 8.755 1.00 0.00 C ATOM 429 OH TYR A 29 -9.129 -2.979 9.626 1.00 0.00 O ATOM 0 H TYR A 29 -7.480 -6.817 5.645 1.00 0.00 H new ATOM 0 HA TYR A 29 -4.574 -7.212 5.494 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -4.446 -4.954 6.265 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -5.678 -5.000 5.020 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -8.110 -4.852 5.662 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -4.990 -4.410 8.541 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -9.697 -3.834 7.228 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -6.583 -3.384 10.103 1.00 0.00 H new ATOM 0 HH TYR A 29 -9.050 -3.409 10.503 1.00 0.00 H new ATOM 439 N HIS A 30 -4.077 -7.179 8.066 1.00 0.00 N ATOM 440 CA HIS A 30 -3.842 -7.642 9.429 1.00 0.00 C ATOM 441 C HIS A 30 -4.323 -6.624 10.458 1.00 0.00 C ATOM 442 O HIS A 30 -5.358 -6.817 11.095 1.00 0.00 O ATOM 443 CB HIS A 30 -2.367 -7.950 9.641 1.00 0.00 C ATOM 444 CG HIS A 30 -2.125 -9.226 10.387 1.00 0.00 C ATOM 445 ND1 HIS A 30 -2.263 -9.337 11.755 1.00 0.00 N ATOM 446 CD2 HIS A 30 -1.754 -10.452 9.948 1.00 0.00 C ATOM 447 CE1 HIS A 30 -1.986 -10.574 12.125 1.00 0.00 C ATOM 448 NE2 HIS A 30 -1.675 -11.271 11.048 1.00 0.00 N ATOM 0 H HIS A 30 -3.278 -6.733 7.616 1.00 0.00 H new ATOM 0 HA HIS A 30 -4.418 -8.557 9.570 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -1.872 -8.006 8.671 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -1.907 -7.126 10.187 1.00 0.00 H new ATOM 0 HD1 HIS A 30 -2.536 -8.581 12.383 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -1.557 -10.733 8.924 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -2.010 -10.951 13.137 1.00 0.00 H new ATOM 457 N LYS A 31 -3.570 -5.543 10.620 1.00 0.00 N ATOM 458 CA LYS A 31 -3.929 -4.505 11.577 1.00 0.00 C ATOM 459 C LYS A 31 -3.298 -3.174 11.195 1.00 0.00 C ATOM 460 O LYS A 31 -2.120 -3.111 10.842 1.00 0.00 O ATOM 461 CB LYS A 31 -3.488 -4.907 12.986 1.00 0.00 C ATOM 462 CG LYS A 31 -4.127 -4.071 14.084 1.00 0.00 C ATOM 463 CD LYS A 31 -3.587 -4.446 15.454 1.00 0.00 C ATOM 464 CE LYS A 31 -3.904 -3.378 16.489 1.00 0.00 C ATOM 465 NZ LYS A 31 -3.123 -2.132 16.259 1.00 0.00 N ATOM 0 H LYS A 31 -2.710 -5.363 10.103 1.00 0.00 H new ATOM 0 HA LYS A 31 -5.013 -4.390 11.562 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.734 -5.956 13.150 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -2.404 -4.819 13.058 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -3.939 -3.014 13.894 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -5.208 -4.211 14.067 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -4.017 -5.397 15.768 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -2.508 -4.588 15.395 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -4.969 -3.149 16.460 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -3.688 -3.763 17.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -3.111 -1.564 17.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -2.148 -2.378 15.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -3.563 -1.583 15.493 1.00 0.00 H new ATOM 479 N GLY A 32 -4.089 -2.111 11.270 1.00 0.00 N ATOM 480 CA GLY A 32 -3.589 -0.793 10.930 1.00 0.00 C ATOM 481 C GLY A 32 -4.478 -0.071 9.937 1.00 0.00 C ATOM 482 O GLY A 32 -4.404 1.151 9.810 1.00 0.00 O ATOM 0 H GLY A 32 -5.067 -2.138 11.560 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -3.504 -0.195 11.838 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -2.586 -0.885 10.514 1.00 0.00 H new ATOM 486 N ALA A 33 -5.320 -0.821 9.229 1.00 0.00 N ATOM 487 CA ALA A 33 -6.215 -0.224 8.247 1.00 0.00 C ATOM 488 C ALA A 33 -7.405 0.447 8.924 1.00 0.00 C ATOM 489 O ALA A 33 -7.614 1.650 8.771 1.00 0.00 O ATOM 490 CB ALA A 33 -6.680 -1.273 7.252 1.00 0.00 C ATOM 0 H ALA A 33 -5.399 -1.834 9.317 1.00 0.00 H new ATOM 0 HA ALA A 33 -5.664 0.546 7.707 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -7.348 -0.813 6.524 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -5.817 -1.694 6.737 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -7.209 -2.066 7.780 1.00 0.00 H new ATOM 496 N LYS A 34 -8.183 -0.334 9.675 1.00 0.00 N ATOM 497 CA LYS A 34 -9.356 0.190 10.378 1.00 0.00 C ATOM 498 C LYS A 34 -9.062 1.526 11.066 1.00 0.00 C ATOM 499 O LYS A 34 -9.969 2.321 11.294 1.00 0.00 O ATOM 500 CB LYS A 34 -9.850 -0.818 11.420 1.00 0.00 C ATOM 501 CG LYS A 34 -11.356 -1.020 11.406 1.00 0.00 C ATOM 502 CD LYS A 34 -11.765 -2.141 10.464 1.00 0.00 C ATOM 503 CE LYS A 34 -11.609 -1.741 9.004 1.00 0.00 C ATOM 504 NZ LYS A 34 -11.891 -2.884 8.092 1.00 0.00 N ATOM 0 H LYS A 34 -8.022 -1.332 9.812 1.00 0.00 H new ATOM 0 HA LYS A 34 -10.130 0.356 9.628 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -9.362 -1.777 11.246 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -9.546 -0.481 12.411 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -11.702 -1.248 12.414 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -11.844 -0.094 11.103 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -11.158 -3.024 10.665 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -12.802 -2.416 10.656 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -12.286 -0.917 8.777 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -10.596 -1.378 8.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -12.320 -2.529 7.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -11.003 -3.378 7.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -12.547 -3.544 8.556 1.00 0.00 H new ATOM 518 N ASP A 35 -7.802 1.769 11.409 1.00 0.00 N ATOM 519 CA ASP A 35 -7.439 3.016 12.071 1.00 0.00 C ATOM 520 C ASP A 35 -6.943 4.055 11.071 1.00 0.00 C ATOM 521 O ASP A 35 -7.621 5.038 10.810 1.00 0.00 O ATOM 522 CB ASP A 35 -6.363 2.766 13.118 1.00 0.00 C ATOM 523 CG ASP A 35 -6.808 1.790 14.190 1.00 0.00 C ATOM 524 OD1 ASP A 35 -7.931 1.952 14.710 1.00 0.00 O ATOM 525 OD2 ASP A 35 -6.033 0.864 14.508 1.00 0.00 O ATOM 0 H ASP A 35 -7.025 1.129 11.243 1.00 0.00 H new ATOM 0 HA ASP A 35 -8.336 3.403 12.554 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -5.468 2.380 12.629 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -6.088 3.712 13.585 1.00 0.00 H new ATOM 530 N GLY A 36 -5.752 3.825 10.522 1.00 0.00 N ATOM 531 CA GLY A 36 -5.162 4.745 9.555 1.00 0.00 C ATOM 532 C GLY A 36 -6.184 5.406 8.648 1.00 0.00 C ATOM 533 O GLY A 36 -6.623 6.524 8.917 1.00 0.00 O ATOM 0 H GLY A 36 -5.177 3.009 10.731 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -4.609 5.517 10.090 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.441 4.203 8.943 1.00 0.00 H new ATOM 537 N LEU A 37 -6.564 4.713 7.574 1.00 0.00 N ATOM 538 CA LEU A 37 -7.541 5.232 6.623 1.00 0.00 C ATOM 539 C LEU A 37 -8.677 5.969 7.330 1.00 0.00 C ATOM 540 O LEU A 37 -9.050 7.068 6.932 1.00 0.00 O ATOM 541 CB LEU A 37 -8.109 4.077 5.788 1.00 0.00 C ATOM 542 CG LEU A 37 -9.008 4.484 4.617 1.00 0.00 C ATOM 543 CD1 LEU A 37 -9.357 3.283 3.755 1.00 0.00 C ATOM 544 CD2 LEU A 37 -10.274 5.162 5.110 1.00 0.00 C ATOM 0 H LEU A 37 -6.206 3.786 7.342 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.035 5.946 5.973 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -7.277 3.492 5.397 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -8.677 3.421 6.448 1.00 0.00 H new ATOM 0 HG LEU A 37 -8.452 5.196 4.008 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -9.996 3.600 2.931 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -8.443 2.843 3.357 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -9.883 2.543 4.358 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -10.893 5.440 4.257 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -10.827 4.477 5.752 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -10.011 6.056 5.675 1.00 0.00 H new ATOM 556 N THR A 38 -9.229 5.350 8.369 1.00 0.00 N ATOM 557 CA THR A 38 -10.340 5.937 9.116 1.00 0.00 C ATOM 558 C THR A 38 -9.906 7.170 9.905 1.00 0.00 C ATOM 559 O THR A 38 -10.577 8.197 9.882 1.00 0.00 O ATOM 560 CB THR A 38 -10.955 4.871 10.031 1.00 0.00 C ATOM 561 OG1 THR A 38 -12.270 4.559 9.612 1.00 0.00 O ATOM 562 CG2 THR A 38 -11.028 5.239 11.496 1.00 0.00 C ATOM 0 H THR A 38 -8.925 4.440 8.715 1.00 0.00 H new ATOM 0 HA THR A 38 -11.096 6.277 8.408 1.00 0.00 H new ATOM 0 HB THR A 38 -10.275 4.024 9.941 1.00 0.00 H new ATOM 0 HG1 THR A 38 -12.286 4.450 8.638 1.00 0.00 H new ATOM 0 HG21 THR A 38 -11.478 4.419 12.055 1.00 0.00 H new ATOM 0 HG22 THR A 38 -10.023 5.428 11.874 1.00 0.00 H new ATOM 0 HG23 THR A 38 -11.635 6.136 11.616 1.00 0.00 H new ATOM 570 N VAL A 39 -8.785 7.063 10.600 1.00 0.00 N ATOM 571 CA VAL A 39 -8.262 8.168 11.392 1.00 0.00 C ATOM 572 C VAL A 39 -8.230 9.447 10.569 1.00 0.00 C ATOM 573 O VAL A 39 -8.375 10.547 11.103 1.00 0.00 O ATOM 574 CB VAL A 39 -6.858 7.823 11.927 1.00 0.00 C ATOM 575 CG1 VAL A 39 -6.130 9.045 12.464 1.00 0.00 C ATOM 576 CG2 VAL A 39 -6.984 6.759 12.998 1.00 0.00 C ATOM 0 H VAL A 39 -8.216 6.217 10.632 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.923 8.331 12.243 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.259 7.445 11.098 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -5.146 8.751 12.829 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -6.017 9.780 11.667 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -6.705 9.481 13.281 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -5.995 6.510 13.381 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -7.605 7.134 13.812 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -7.444 5.867 12.572 1.00 0.00 H new ATOM 586 N GLU A 40 -8.082 9.288 9.263 1.00 0.00 N ATOM 587 CA GLU A 40 -8.080 10.421 8.362 1.00 0.00 C ATOM 588 C GLU A 40 -9.512 10.719 7.943 1.00 0.00 C ATOM 589 O GLU A 40 -9.878 11.872 7.743 1.00 0.00 O ATOM 590 CB GLU A 40 -7.201 10.139 7.151 1.00 0.00 C ATOM 591 CG GLU A 40 -5.867 9.490 7.512 1.00 0.00 C ATOM 592 CD GLU A 40 -5.118 10.243 8.595 1.00 0.00 C ATOM 593 OE1 GLU A 40 -5.721 10.527 9.651 1.00 0.00 O ATOM 594 OE2 GLU A 40 -3.925 10.549 8.387 1.00 0.00 O ATOM 0 H GLU A 40 -7.962 8.384 8.807 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.667 11.293 8.869 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -7.740 9.487 6.463 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -7.012 11.073 6.623 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -6.044 8.467 7.844 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -5.244 9.432 6.620 1.00 0.00 H new ATOM 601 N ILE A 41 -10.330 9.665 7.862 1.00 0.00 N ATOM 602 CA ILE A 41 -11.739 9.816 7.525 1.00 0.00 C ATOM 603 C ILE A 41 -12.426 10.579 8.644 1.00 0.00 C ATOM 604 O ILE A 41 -13.078 11.595 8.411 1.00 0.00 O ATOM 605 CB ILE A 41 -12.441 8.455 7.337 1.00 0.00 C ATOM 606 CG1 ILE A 41 -11.808 7.690 6.177 1.00 0.00 C ATOM 607 CG2 ILE A 41 -13.936 8.645 7.103 1.00 0.00 C ATOM 608 CD1 ILE A 41 -12.083 8.298 4.821 1.00 0.00 C ATOM 0 H ILE A 41 -10.036 8.702 8.026 1.00 0.00 H new ATOM 0 HA ILE A 41 -11.806 10.356 6.580 1.00 0.00 H new ATOM 0 HB ILE A 41 -12.313 7.872 8.249 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -10.730 7.642 6.331 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -12.177 6.664 6.186 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -14.410 7.672 6.973 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -14.377 9.152 7.961 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -14.091 9.247 6.207 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -11.601 7.699 4.049 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -13.158 8.321 4.644 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -11.689 9.314 4.791 1.00 0.00 H new ATOM 620 N ASN A 42 -12.236 10.100 9.874 1.00 0.00 N ATOM 621 CA ASN A 42 -12.799 10.763 11.039 1.00 0.00 C ATOM 622 C ASN A 42 -12.368 12.220 11.022 1.00 0.00 C ATOM 623 O ASN A 42 -13.182 13.132 11.160 1.00 0.00 O ATOM 624 CB ASN A 42 -12.316 10.093 12.328 1.00 0.00 C ATOM 625 CG ASN A 42 -12.514 8.590 12.319 1.00 0.00 C ATOM 626 OD1 ASN A 42 -13.297 8.058 11.533 1.00 0.00 O ATOM 627 ND2 ASN A 42 -11.798 7.899 13.199 1.00 0.00 N ATOM 0 H ASN A 42 -11.698 9.259 10.084 1.00 0.00 H new ATOM 0 HA ASN A 42 -13.886 10.691 11.007 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -11.259 10.315 12.473 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -12.851 10.520 13.176 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -11.885 6.884 13.242 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -11.161 8.384 13.831 1.00 0.00 H new ATOM 634 N LYS A 43 -11.067 12.419 10.830 1.00 0.00 N ATOM 635 CA LYS A 43 -10.498 13.761 10.768 1.00 0.00 C ATOM 636 C LYS A 43 -10.905 14.479 9.475 1.00 0.00 C ATOM 637 O LYS A 43 -10.843 15.706 9.396 1.00 0.00 O ATOM 638 CB LYS A 43 -8.973 13.689 10.860 1.00 0.00 C ATOM 639 CG LYS A 43 -8.315 15.037 11.106 1.00 0.00 C ATOM 640 CD LYS A 43 -7.892 15.696 9.804 1.00 0.00 C ATOM 641 CE LYS A 43 -6.501 15.253 9.382 1.00 0.00 C ATOM 642 NZ LYS A 43 -5.485 15.530 10.434 1.00 0.00 N ATOM 0 H LYS A 43 -10.387 11.667 10.715 1.00 0.00 H new ATOM 0 HA LYS A 43 -10.888 14.330 11.612 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -8.697 13.007 11.665 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -8.581 13.266 9.935 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.008 15.690 11.637 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -7.444 14.906 11.748 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -8.608 15.448 9.020 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -7.910 16.780 9.921 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -6.512 14.186 9.160 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -6.220 15.767 8.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -4.559 15.689 9.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -5.762 16.377 10.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -5.423 14.717 11.080 1.00 0.00 H new ATOM 656 N ALA A 44 -11.312 13.712 8.463 1.00 0.00 N ATOM 657 CA ALA A 44 -11.718 14.282 7.181 1.00 0.00 C ATOM 658 C ALA A 44 -13.173 14.724 7.211 1.00 0.00 C ATOM 659 O ALA A 44 -13.482 15.889 6.975 1.00 0.00 O ATOM 660 CB ALA A 44 -11.504 13.281 6.054 1.00 0.00 C ATOM 0 H ALA A 44 -11.369 12.695 8.508 1.00 0.00 H new ATOM 0 HA ALA A 44 -11.095 15.158 6.999 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -11.813 13.726 5.108 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -10.449 13.013 6.001 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -12.097 12.386 6.245 1.00 0.00 H new ATOM 666 N GLU A 45 -14.065 13.781 7.497 1.00 0.00 N ATOM 667 CA GLU A 45 -15.495 14.064 7.558 1.00 0.00 C ATOM 668 C GLU A 45 -15.768 15.345 8.334 1.00 0.00 C ATOM 669 O GLU A 45 -16.615 16.150 7.946 1.00 0.00 O ATOM 670 CB GLU A 45 -16.231 12.895 8.205 1.00 0.00 C ATOM 671 CG GLU A 45 -16.383 11.704 7.281 1.00 0.00 C ATOM 672 CD GLU A 45 -17.812 11.200 7.219 1.00 0.00 C ATOM 673 OE1 GLU A 45 -18.672 11.920 6.670 1.00 0.00 O ATOM 674 OE2 GLU A 45 -18.072 10.089 7.727 1.00 0.00 O ATOM 0 H GLU A 45 -13.821 12.810 7.691 1.00 0.00 H new ATOM 0 HA GLU A 45 -15.858 14.200 6.539 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -15.693 12.586 9.101 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -17.219 13.227 8.525 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -16.054 11.980 6.279 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -15.731 10.899 7.620 1.00 0.00 H new ATOM 681 N GLU A 46 -15.034 15.536 9.425 1.00 0.00 N ATOM 682 CA GLU A 46 -15.189 16.731 10.241 1.00 0.00 C ATOM 683 C GLU A 46 -14.995 17.979 9.386 1.00 0.00 C ATOM 684 O GLU A 46 -15.513 19.045 9.706 1.00 0.00 O ATOM 685 CB GLU A 46 -14.192 16.724 11.403 1.00 0.00 C ATOM 686 CG GLU A 46 -12.742 16.854 10.964 1.00 0.00 C ATOM 687 CD GLU A 46 -11.996 17.933 11.725 1.00 0.00 C ATOM 688 OE1 GLU A 46 -11.673 17.709 12.910 1.00 0.00 O ATOM 689 OE2 GLU A 46 -11.734 19.002 11.134 1.00 0.00 O ATOM 0 H GLU A 46 -14.329 14.881 9.762 1.00 0.00 H new ATOM 0 HA GLU A 46 -16.198 16.739 10.654 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -14.432 17.543 12.081 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -14.310 15.798 11.966 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -12.236 15.899 11.106 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -12.708 17.077 9.898 1.00 0.00 H new ATOM 696 N VAL A 47 -14.254 17.824 8.286 1.00 0.00 N ATOM 697 CA VAL A 47 -13.998 18.922 7.363 1.00 0.00 C ATOM 698 C VAL A 47 -14.987 18.876 6.203 1.00 0.00 C ATOM 699 O VAL A 47 -15.562 19.896 5.824 1.00 0.00 O ATOM 700 CB VAL A 47 -12.533 18.899 6.846 1.00 0.00 C ATOM 701 CG1 VAL A 47 -12.432 19.177 5.347 1.00 0.00 C ATOM 702 CG2 VAL A 47 -11.707 19.917 7.609 1.00 0.00 C ATOM 0 H VAL A 47 -13.820 16.941 8.016 1.00 0.00 H new ATOM 0 HA VAL A 47 -14.137 19.859 7.903 1.00 0.00 H new ATOM 0 HB VAL A 47 -12.148 17.893 7.014 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -11.386 19.148 5.041 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -12.991 18.419 4.798 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -12.846 20.162 5.131 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -10.680 19.899 7.245 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -12.127 20.912 7.460 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -11.719 19.673 8.671 1.00 0.00 H new ATOM 712 N PHE A 48 -15.188 17.685 5.644 1.00 0.00 N ATOM 713 CA PHE A 48 -16.116 17.508 4.530 1.00 0.00 C ATOM 714 C PHE A 48 -17.444 18.203 4.819 1.00 0.00 C ATOM 715 O PHE A 48 -18.035 18.829 3.939 1.00 0.00 O ATOM 716 CB PHE A 48 -16.351 16.020 4.261 1.00 0.00 C ATOM 717 CG PHE A 48 -17.476 15.747 3.299 1.00 0.00 C ATOM 718 CD1 PHE A 48 -17.386 16.149 1.976 1.00 0.00 C ATOM 719 CD2 PHE A 48 -18.621 15.091 3.721 1.00 0.00 C ATOM 720 CE1 PHE A 48 -18.418 15.900 1.091 1.00 0.00 C ATOM 721 CE2 PHE A 48 -19.657 14.840 2.840 1.00 0.00 C ATOM 722 CZ PHE A 48 -19.555 15.246 1.524 1.00 0.00 C ATOM 0 H PHE A 48 -14.721 16.829 5.944 1.00 0.00 H new ATOM 0 HA PHE A 48 -15.672 17.960 3.643 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -15.434 15.582 3.867 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -16.563 15.519 5.205 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -16.500 16.662 1.633 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -18.705 14.772 4.749 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -18.335 16.217 0.062 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -20.544 14.327 3.181 1.00 0.00 H new ATOM 0 HZ PHE A 48 -20.363 15.052 0.834 1.00 0.00 H new ATOM 732 N ASN A 49 -17.904 18.089 6.059 1.00 0.00 N ATOM 733 CA ASN A 49 -19.159 18.708 6.463 1.00 0.00 C ATOM 734 C ASN A 49 -18.913 19.992 7.254 1.00 0.00 C ATOM 735 O ASN A 49 -19.815 20.502 7.917 1.00 0.00 O ATOM 736 CB ASN A 49 -19.986 17.733 7.302 1.00 0.00 C ATOM 737 CG ASN A 49 -20.120 16.373 6.643 1.00 0.00 C ATOM 738 OD1 ASN A 49 -20.878 16.205 5.689 1.00 0.00 O ATOM 739 ND2 ASN A 49 -19.382 15.393 7.152 1.00 0.00 N ATOM 0 H ASN A 49 -17.428 17.575 6.800 1.00 0.00 H new ATOM 0 HA ASN A 49 -19.711 18.963 5.559 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -19.521 17.615 8.281 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -20.978 18.152 7.469 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -19.431 14.457 6.751 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -18.766 15.577 7.944 1.00 0.00 H new ATOM 746 N LYS A 50 -17.687 20.508 7.189 1.00 0.00 N ATOM 747 CA LYS A 50 -17.339 21.731 7.916 1.00 0.00 C ATOM 748 C LYS A 50 -17.565 22.981 7.069 1.00 0.00 C ATOM 749 O LYS A 50 -17.680 22.905 5.845 1.00 0.00 O ATOM 750 CB LYS A 50 -15.881 21.682 8.366 1.00 0.00 C ATOM 751 CG LYS A 50 -15.584 22.545 9.582 1.00 0.00 C ATOM 752 CD LYS A 50 -14.158 22.343 10.072 1.00 0.00 C ATOM 753 CE LYS A 50 -13.450 23.668 10.303 1.00 0.00 C ATOM 754 NZ LYS A 50 -12.764 23.710 11.624 1.00 0.00 N ATOM 0 H LYS A 50 -16.923 20.104 6.646 1.00 0.00 H new ATOM 0 HA LYS A 50 -17.994 21.787 8.786 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -15.615 20.649 8.591 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -15.245 22.002 7.541 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -15.739 23.594 9.332 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -16.283 22.302 10.382 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -14.170 21.770 10.999 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -13.602 21.756 9.341 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -12.720 23.832 9.510 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -14.174 24.481 10.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -12.294 24.630 11.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -13.463 23.579 12.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -12.055 22.950 11.671 1.00 0.00 H new ATOM 768 N GLU A 51 -17.610 24.135 7.735 1.00 0.00 N ATOM 769 CA GLU A 51 -17.803 25.410 7.053 1.00 0.00 C ATOM 770 C GLU A 51 -16.466 26.025 6.703 1.00 0.00 C ATOM 771 O GLU A 51 -16.317 26.628 5.639 1.00 0.00 O ATOM 772 CB GLU A 51 -18.625 26.370 7.915 1.00 0.00 C ATOM 773 CG GLU A 51 -19.990 25.823 8.301 1.00 0.00 C ATOM 774 CD GLU A 51 -20.949 26.911 8.745 1.00 0.00 C ATOM 775 OE1 GLU A 51 -20.631 27.621 9.723 1.00 0.00 O ATOM 776 OE2 GLU A 51 -22.018 27.053 8.115 1.00 0.00 O ATOM 0 H GLU A 51 -17.515 24.211 8.748 1.00 0.00 H new ATOM 0 HA GLU A 51 -18.355 25.226 6.131 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -18.066 26.601 8.822 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -18.758 27.307 7.375 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -20.418 25.291 7.451 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -19.872 25.097 9.105 1.00 0.00 H new ATOM 783 N ASP A 52 -15.476 25.835 7.565 1.00 0.00 N ATOM 784 CA ASP A 52 -14.154 26.348 7.271 1.00 0.00 C ATOM 785 C ASP A 52 -13.428 25.383 6.357 1.00 0.00 C ATOM 786 O ASP A 52 -12.223 25.502 6.140 1.00 0.00 O ATOM 787 CB ASP A 52 -13.329 26.599 8.528 1.00 0.00 C ATOM 788 CG ASP A 52 -14.132 27.259 9.632 1.00 0.00 C ATOM 789 OD1 ASP A 52 -15.166 26.688 10.037 1.00 0.00 O ATOM 790 OD2 ASP A 52 -13.726 28.347 10.092 1.00 0.00 O ATOM 0 H ASP A 52 -15.563 25.340 8.453 1.00 0.00 H new ATOM 0 HA ASP A 52 -14.280 27.311 6.777 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -12.930 25.652 8.891 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -12.476 27.230 8.278 1.00 0.00 H new ATOM 795 N ALA A 53 -14.183 24.450 5.785 1.00 0.00 N ATOM 796 CA ALA A 53 -13.634 23.495 4.853 1.00 0.00 C ATOM 797 C ALA A 53 -13.425 24.200 3.534 1.00 0.00 C ATOM 798 O ALA A 53 -13.889 23.767 2.484 1.00 0.00 O ATOM 799 CB ALA A 53 -14.549 22.293 4.704 1.00 0.00 C ATOM 0 H ALA A 53 -15.182 24.342 5.958 1.00 0.00 H new ATOM 0 HA ALA A 53 -12.681 23.115 5.220 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -14.112 21.589 3.996 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -14.671 21.806 5.672 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -15.522 22.620 4.337 1.00 0.00 H new ATOM 805 N THR A 54 -12.734 25.319 3.634 1.00 0.00 N ATOM 806 CA THR A 54 -12.428 26.165 2.507 1.00 0.00 C ATOM 807 C THR A 54 -11.078 25.793 1.915 1.00 0.00 C ATOM 808 O THR A 54 -10.847 24.650 1.520 1.00 0.00 O ATOM 809 CB THR A 54 -12.470 27.629 2.960 1.00 0.00 C ATOM 810 OG1 THR A 54 -11.344 27.943 3.761 1.00 0.00 O ATOM 811 CG2 THR A 54 -13.710 27.966 3.764 1.00 0.00 C ATOM 0 H THR A 54 -12.365 25.668 4.519 1.00 0.00 H new ATOM 0 HA THR A 54 -13.169 26.024 1.721 1.00 0.00 H new ATOM 0 HB THR A 54 -12.475 28.216 2.041 1.00 0.00 H new ATOM 0 HG1 THR A 54 -11.027 28.844 3.541 1.00 0.00 H new ATOM 0 HG21 THR A 54 -13.681 29.016 4.055 1.00 0.00 H new ATOM 0 HG22 THR A 54 -14.597 27.782 3.158 1.00 0.00 H new ATOM 0 HG23 THR A 54 -13.745 27.343 4.657 1.00 0.00 H new ATOM 819 N GLU A 55 -10.206 26.760 1.846 1.00 0.00 N ATOM 820 CA GLU A 55 -8.873 26.558 1.289 1.00 0.00 C ATOM 821 C GLU A 55 -7.864 26.119 2.352 1.00 0.00 C ATOM 822 O GLU A 55 -6.799 25.597 2.020 1.00 0.00 O ATOM 823 CB GLU A 55 -8.385 27.842 0.614 1.00 0.00 C ATOM 824 CG GLU A 55 -7.729 27.609 -0.735 1.00 0.00 C ATOM 825 CD GLU A 55 -7.175 28.882 -1.343 1.00 0.00 C ATOM 826 OE1 GLU A 55 -7.981 29.753 -1.732 1.00 0.00 O ATOM 827 OE2 GLU A 55 -5.936 29.009 -1.430 1.00 0.00 O ATOM 0 H GLU A 55 -10.386 27.711 2.169 1.00 0.00 H new ATOM 0 HA GLU A 55 -8.948 25.758 0.553 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -9.230 28.519 0.486 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -7.674 28.341 1.273 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -6.923 26.884 -0.622 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -8.457 27.172 -1.418 1.00 0.00 H new ATOM 834 N GLU A 56 -8.178 26.359 3.622 1.00 0.00 N ATOM 835 CA GLU A 56 -7.262 26.011 4.706 1.00 0.00 C ATOM 836 C GLU A 56 -7.563 24.655 5.359 1.00 0.00 C ATOM 837 O GLU A 56 -6.658 23.844 5.548 1.00 0.00 O ATOM 838 CB GLU A 56 -7.263 27.117 5.770 1.00 0.00 C ATOM 839 CG GLU A 56 -8.419 27.033 6.755 1.00 0.00 C ATOM 840 CD GLU A 56 -8.455 28.208 7.713 1.00 0.00 C ATOM 841 OE1 GLU A 56 -8.440 29.363 7.237 1.00 0.00 O ATOM 842 OE2 GLU A 56 -8.498 27.973 8.940 1.00 0.00 O ATOM 0 H GLU A 56 -9.052 26.789 3.925 1.00 0.00 H new ATOM 0 HA GLU A 56 -6.274 25.921 4.254 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -6.325 27.074 6.323 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -7.295 28.086 5.271 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -9.359 26.989 6.204 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -8.340 26.107 7.324 1.00 0.00 H new ATOM 849 N GLU A 57 -8.817 24.430 5.748 1.00 0.00 N ATOM 850 CA GLU A 57 -9.188 23.189 6.434 1.00 0.00 C ATOM 851 C GLU A 57 -9.191 21.959 5.522 1.00 0.00 C ATOM 852 O GLU A 57 -8.655 20.915 5.893 1.00 0.00 O ATOM 853 CB GLU A 57 -10.554 23.342 7.101 1.00 0.00 C ATOM 854 CG GLU A 57 -10.649 22.650 8.452 1.00 0.00 C ATOM 855 CD GLU A 57 -10.179 23.532 9.592 1.00 0.00 C ATOM 856 OE1 GLU A 57 -10.551 24.724 9.614 1.00 0.00 O ATOM 857 OE2 GLU A 57 -9.439 23.030 10.465 1.00 0.00 O ATOM 0 H GLU A 57 -9.588 25.082 5.603 1.00 0.00 H new ATOM 0 HA GLU A 57 -8.417 23.017 7.186 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -10.771 24.403 7.229 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -11.320 22.937 6.440 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -11.682 22.350 8.631 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -10.052 21.739 8.432 1.00 0.00 H new ATOM 864 N ILE A 58 -9.803 22.065 4.347 1.00 0.00 N ATOM 865 CA ILE A 58 -9.869 20.930 3.425 1.00 0.00 C ATOM 866 C ILE A 58 -8.496 20.322 3.205 1.00 0.00 C ATOM 867 O ILE A 58 -8.255 19.168 3.549 1.00 0.00 O ATOM 868 CB ILE A 58 -10.451 21.331 2.061 1.00 0.00 C ATOM 869 CG1 ILE A 58 -11.761 22.088 2.255 1.00 0.00 C ATOM 870 CG2 ILE A 58 -10.663 20.097 1.191 1.00 0.00 C ATOM 871 CD1 ILE A 58 -12.511 22.360 0.969 1.00 0.00 C ATOM 0 H ILE A 58 -10.257 22.914 4.011 1.00 0.00 H new ATOM 0 HA ILE A 58 -10.528 20.196 3.890 1.00 0.00 H new ATOM 0 HB ILE A 58 -9.744 21.987 1.553 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -12.404 21.516 2.924 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -11.551 23.037 2.749 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -11.076 20.397 0.228 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -9.709 19.593 1.036 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -11.356 19.417 1.687 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -13.431 22.901 1.192 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -11.889 22.960 0.305 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -12.755 21.415 0.483 1.00 0.00 H new ATOM 883 N ASN A 59 -7.598 21.111 2.632 1.00 0.00 N ATOM 884 CA ASN A 59 -6.237 20.654 2.365 1.00 0.00 C ATOM 885 C ASN A 59 -5.657 19.969 3.596 1.00 0.00 C ATOM 886 O ASN A 59 -5.170 18.840 3.523 1.00 0.00 O ATOM 887 CB ASN A 59 -5.340 21.826 1.953 1.00 0.00 C ATOM 888 CG ASN A 59 -5.626 23.097 2.734 1.00 0.00 C ATOM 889 OD1 ASN A 59 -6.770 23.385 3.084 1.00 0.00 O ATOM 890 ND2 ASN A 59 -4.580 23.868 3.011 1.00 0.00 N ATOM 0 H ASN A 59 -7.785 22.071 2.342 1.00 0.00 H new ATOM 0 HA ASN A 59 -6.276 19.939 1.543 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -4.297 21.545 2.096 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -5.474 22.022 0.889 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -4.709 24.735 3.532 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -3.648 23.593 2.702 1.00 0.00 H new ATOM 897 N LEU A 60 -5.726 20.658 4.726 1.00 0.00 N ATOM 898 CA LEU A 60 -5.223 20.119 5.982 1.00 0.00 C ATOM 899 C LEU A 60 -5.939 18.818 6.331 1.00 0.00 C ATOM 900 O LEU A 60 -5.366 17.938 6.974 1.00 0.00 O ATOM 901 CB LEU A 60 -5.411 21.135 7.111 1.00 0.00 C ATOM 902 CG LEU A 60 -4.639 22.446 6.942 1.00 0.00 C ATOM 903 CD1 LEU A 60 -5.218 23.526 7.843 1.00 0.00 C ATOM 904 CD2 LEU A 60 -3.162 22.235 7.240 1.00 0.00 C ATOM 0 H LEU A 60 -6.126 21.593 4.799 1.00 0.00 H new ATOM 0 HA LEU A 60 -4.159 19.913 5.864 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -6.473 21.366 7.198 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -5.108 20.672 8.050 1.00 0.00 H new ATOM 0 HG LEU A 60 -4.738 22.774 5.907 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -4.657 24.451 7.709 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -6.263 23.695 7.583 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -5.150 23.207 8.883 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -2.627 23.177 7.115 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -3.044 21.884 8.265 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -2.755 21.493 6.553 1.00 0.00 H new ATOM 916 N ALA A 61 -7.197 18.703 5.910 1.00 0.00 N ATOM 917 CA ALA A 61 -7.988 17.508 6.189 1.00 0.00 C ATOM 918 C ALA A 61 -7.835 16.455 5.089 1.00 0.00 C ATOM 919 O ALA A 61 -8.149 15.283 5.296 1.00 0.00 O ATOM 920 CB ALA A 61 -9.450 17.885 6.355 1.00 0.00 C ATOM 0 H ALA A 61 -7.688 19.420 5.376 1.00 0.00 H new ATOM 0 HA ALA A 61 -7.617 17.070 7.115 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -10.035 16.989 6.563 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -9.553 18.586 7.183 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -9.812 18.350 5.438 1.00 0.00 H new ATOM 926 N LYS A 62 -7.365 16.879 3.921 1.00 0.00 N ATOM 927 CA LYS A 62 -7.185 15.977 2.789 1.00 0.00 C ATOM 928 C LYS A 62 -5.775 15.388 2.767 1.00 0.00 C ATOM 929 O LYS A 62 -5.563 14.274 2.289 1.00 0.00 O ATOM 930 CB LYS A 62 -7.475 16.723 1.477 1.00 0.00 C ATOM 931 CG LYS A 62 -6.247 17.341 0.821 1.00 0.00 C ATOM 932 CD LYS A 62 -6.616 18.113 -0.434 1.00 0.00 C ATOM 933 CE LYS A 62 -5.526 18.018 -1.489 1.00 0.00 C ATOM 934 NZ LYS A 62 -5.767 18.952 -2.623 1.00 0.00 N ATOM 0 H LYS A 62 -7.101 17.846 3.733 1.00 0.00 H new ATOM 0 HA LYS A 62 -7.888 15.150 2.895 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -7.938 16.031 0.774 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -8.202 17.511 1.674 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -5.752 18.008 1.527 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -5.533 16.556 0.570 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -7.550 17.725 -0.839 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -6.788 19.159 -0.181 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -4.561 18.241 -1.034 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -5.473 16.996 -1.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -4.908 19.021 -3.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -6.552 18.596 -3.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -6.010 19.893 -2.252 1.00 0.00 H new ATOM 948 N GLU A 63 -4.814 16.152 3.276 1.00 0.00 N ATOM 949 CA GLU A 63 -3.420 15.719 3.307 1.00 0.00 C ATOM 950 C GLU A 63 -3.262 14.354 3.974 1.00 0.00 C ATOM 951 O GLU A 63 -2.278 13.652 3.737 1.00 0.00 O ATOM 952 CB GLU A 63 -2.564 16.754 4.040 1.00 0.00 C ATOM 953 CG GLU A 63 -1.127 16.814 3.546 1.00 0.00 C ATOM 954 CD GLU A 63 -0.378 18.020 4.079 1.00 0.00 C ATOM 955 OE1 GLU A 63 -0.614 19.137 3.573 1.00 0.00 O ATOM 956 OE2 GLU A 63 0.445 17.847 5.003 1.00 0.00 O ATOM 0 H GLU A 63 -4.975 17.077 3.674 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.083 15.627 2.274 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -3.020 17.737 3.926 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -2.564 16.524 5.106 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -0.605 15.905 3.846 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -1.122 16.840 2.456 1.00 0.00 H new ATOM 963 N SER A 64 -4.228 13.978 4.805 1.00 0.00 N ATOM 964 CA SER A 64 -4.181 12.700 5.493 1.00 0.00 C ATOM 965 C SER A 64 -4.989 11.658 4.734 1.00 0.00 C ATOM 966 O SER A 64 -4.660 10.474 4.753 1.00 0.00 O ATOM 967 CB SER A 64 -4.710 12.847 6.923 1.00 0.00 C ATOM 968 OG SER A 64 -5.196 14.157 7.159 1.00 0.00 O ATOM 0 H SER A 64 -5.051 14.542 5.016 1.00 0.00 H new ATOM 0 HA SER A 64 -3.144 12.368 5.538 1.00 0.00 H new ATOM 0 HB2 SER A 64 -5.508 12.124 7.094 1.00 0.00 H new ATOM 0 HB3 SER A 64 -3.915 12.618 7.633 1.00 0.00 H new ATOM 0 HG SER A 64 -4.520 14.674 7.645 1.00 0.00 H new ATOM 974 N LEU A 65 -6.039 12.115 4.051 1.00 0.00 N ATOM 975 CA LEU A 65 -6.890 11.231 3.273 1.00 0.00 C ATOM 976 C LEU A 65 -6.105 10.667 2.109 1.00 0.00 C ATOM 977 O LEU A 65 -6.232 9.492 1.763 1.00 0.00 O ATOM 978 CB LEU A 65 -8.118 11.988 2.770 1.00 0.00 C ATOM 979 CG LEU A 65 -9.454 11.284 3.003 1.00 0.00 C ATOM 980 CD1 LEU A 65 -9.579 10.831 4.451 1.00 0.00 C ATOM 981 CD2 LEU A 65 -10.604 12.203 2.630 1.00 0.00 C ATOM 0 H LEU A 65 -6.316 13.096 4.024 1.00 0.00 H new ATOM 0 HA LEU A 65 -7.228 10.410 3.905 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.149 12.963 3.257 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -8.002 12.169 1.701 1.00 0.00 H new ATOM 0 HG LEU A 65 -9.494 10.400 2.367 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -10.538 10.332 4.595 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -8.771 10.139 4.687 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -9.518 11.697 5.110 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -11.550 11.689 2.801 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -10.564 13.103 3.243 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -10.524 12.477 1.578 1.00 0.00 H new ATOM 993 N GLU A 66 -5.275 11.515 1.523 1.00 0.00 N ATOM 994 CA GLU A 66 -4.443 11.107 0.409 1.00 0.00 C ATOM 995 C GLU A 66 -3.552 9.948 0.834 1.00 0.00 C ATOM 996 O GLU A 66 -3.290 9.028 0.060 1.00 0.00 O ATOM 997 CB GLU A 66 -3.595 12.278 -0.090 1.00 0.00 C ATOM 998 CG GLU A 66 -4.174 12.958 -1.317 1.00 0.00 C ATOM 999 CD GLU A 66 -3.153 13.805 -2.052 1.00 0.00 C ATOM 1000 OE1 GLU A 66 -2.602 14.740 -1.434 1.00 0.00 O ATOM 1001 OE2 GLU A 66 -2.905 13.533 -3.246 1.00 0.00 O ATOM 0 H GLU A 66 -5.162 12.489 1.802 1.00 0.00 H new ATOM 0 HA GLU A 66 -5.085 10.783 -0.410 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -3.494 13.012 0.710 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -2.592 11.919 -0.321 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -4.568 12.201 -1.995 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -5.013 13.586 -1.018 1.00 0.00 H new ATOM 1008 N GLY A 67 -3.118 9.995 2.089 1.00 0.00 N ATOM 1009 CA GLY A 67 -2.288 8.941 2.635 1.00 0.00 C ATOM 1010 C GLY A 67 -3.063 8.075 3.611 1.00 0.00 C ATOM 1011 O GLY A 67 -2.479 7.325 4.394 1.00 0.00 O ATOM 0 H GLY A 67 -3.329 10.751 2.741 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.903 8.323 1.824 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.427 9.379 3.139 1.00 0.00 H new ATOM 1015 N ALA A 68 -4.391 8.181 3.556 1.00 0.00 N ATOM 1016 CA ALA A 68 -5.269 7.413 4.423 1.00 0.00 C ATOM 1017 C ALA A 68 -5.744 6.164 3.708 1.00 0.00 C ATOM 1018 O ALA A 68 -5.397 5.044 4.085 1.00 0.00 O ATOM 1019 CB ALA A 68 -6.463 8.252 4.841 1.00 0.00 C ATOM 0 H ALA A 68 -4.881 8.800 2.911 1.00 0.00 H new ATOM 0 HA ALA A 68 -4.712 7.124 5.314 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -7.112 7.664 5.490 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -6.117 9.135 5.378 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -7.019 8.560 3.956 1.00 0.00 H new ATOM 1025 N ILE A 69 -6.526 6.370 2.656 1.00 0.00 N ATOM 1026 CA ILE A 69 -7.029 5.268 1.869 1.00 0.00 C ATOM 1027 C ILE A 69 -5.880 4.633 1.129 1.00 0.00 C ATOM 1028 O ILE A 69 -5.765 3.410 1.047 1.00 0.00 O ATOM 1029 CB ILE A 69 -8.080 5.725 0.841 1.00 0.00 C ATOM 1030 CG1 ILE A 69 -7.518 6.848 -0.039 1.00 0.00 C ATOM 1031 CG2 ILE A 69 -9.351 6.176 1.535 1.00 0.00 C ATOM 1032 CD1 ILE A 69 -8.521 7.396 -1.031 1.00 0.00 C ATOM 0 H ILE A 69 -6.822 7.292 2.334 1.00 0.00 H new ATOM 0 HA ILE A 69 -7.503 4.561 2.549 1.00 0.00 H new ATOM 0 HB ILE A 69 -8.325 4.876 0.202 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -7.170 7.660 0.600 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -6.650 6.474 -0.581 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -10.079 6.494 0.789 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -9.762 5.349 2.114 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -9.126 7.009 2.201 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -8.056 8.187 -1.620 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -8.851 6.596 -1.694 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -9.379 7.800 -0.495 1.00 0.00 H new ATOM 1044 N ALA A 70 -5.018 5.490 0.597 1.00 0.00 N ATOM 1045 CA ALA A 70 -3.851 5.034 -0.135 1.00 0.00 C ATOM 1046 C ALA A 70 -3.113 3.959 0.655 1.00 0.00 C ATOM 1047 O ALA A 70 -2.481 3.073 0.080 1.00 0.00 O ATOM 1048 CB ALA A 70 -2.942 6.207 -0.449 1.00 0.00 C ATOM 0 H ALA A 70 -5.108 6.504 0.661 1.00 0.00 H new ATOM 0 HA ALA A 70 -4.174 4.592 -1.078 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -2.069 5.854 -0.998 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -3.483 6.934 -1.055 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -2.620 6.677 0.480 1.00 0.00 H new ATOM 1054 N ARG A 71 -3.227 4.031 1.979 1.00 0.00 N ATOM 1055 CA ARG A 71 -2.601 3.052 2.853 1.00 0.00 C ATOM 1056 C ARG A 71 -3.406 1.758 2.828 1.00 0.00 C ATOM 1057 O ARG A 71 -2.921 0.724 2.369 1.00 0.00 O ATOM 1058 CB ARG A 71 -2.505 3.592 4.283 1.00 0.00 C ATOM 1059 CG ARG A 71 -1.091 3.954 4.702 1.00 0.00 C ATOM 1060 CD ARG A 71 -0.490 5.007 3.785 1.00 0.00 C ATOM 1061 NE ARG A 71 0.954 4.841 3.632 1.00 0.00 N ATOM 1062 CZ ARG A 71 1.672 5.434 2.681 1.00 0.00 C ATOM 1063 NH1 ARG A 71 1.085 6.232 1.797 1.00 0.00 N ATOM 1064 NH2 ARG A 71 2.980 5.229 2.613 1.00 0.00 N ATOM 0 H ARG A 71 -3.748 4.759 2.467 1.00 0.00 H new ATOM 0 HA ARG A 71 -1.590 2.852 2.496 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -3.139 4.474 4.373 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -2.899 2.845 4.972 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -1.098 4.324 5.727 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -0.467 3.060 4.690 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -0.967 4.950 2.807 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -0.700 5.999 4.185 1.00 0.00 H new ATOM 0 HE ARG A 71 1.440 4.235 4.293 1.00 0.00 H new ATOM 0 HH11 ARG A 71 0.079 6.393 1.845 1.00 0.00 H new ATOM 0 HH12 ARG A 71 1.640 6.684 1.070 1.00 0.00 H new ATOM 0 HH21 ARG A 71 3.436 4.617 3.289 1.00 0.00 H new ATOM 0 HH22 ARG A 71 3.530 5.683 1.884 1.00 0.00 H new ATOM 1078 N PHE A 72 -4.648 1.827 3.314 1.00 0.00 N ATOM 1079 CA PHE A 72 -5.534 0.671 3.338 1.00 0.00 C ATOM 1080 C PHE A 72 -5.455 -0.141 2.046 1.00 0.00 C ATOM 1081 O PHE A 72 -5.329 -1.365 2.081 1.00 0.00 O ATOM 1082 CB PHE A 72 -6.964 1.140 3.548 1.00 0.00 C ATOM 1083 CG PHE A 72 -7.801 0.156 4.294 1.00 0.00 C ATOM 1084 CD1 PHE A 72 -7.884 -1.159 3.875 1.00 0.00 C ATOM 1085 CD2 PHE A 72 -8.504 0.546 5.416 1.00 0.00 C ATOM 1086 CE1 PHE A 72 -8.656 -2.067 4.562 1.00 0.00 C ATOM 1087 CE2 PHE A 72 -9.278 -0.358 6.108 1.00 0.00 C ATOM 1088 CZ PHE A 72 -9.356 -1.665 5.683 1.00 0.00 C ATOM 0 H PHE A 72 -5.060 2.678 3.697 1.00 0.00 H new ATOM 0 HA PHE A 72 -5.216 0.025 4.157 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -6.954 2.085 4.092 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -7.422 1.335 2.578 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -7.337 -1.477 2.999 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -8.446 1.570 5.754 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -8.715 -3.092 4.226 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -9.824 -0.042 6.984 1.00 0.00 H new ATOM 0 HZ PHE A 72 -9.963 -2.375 6.225 1.00 0.00 H new ATOM 1098 N ASN A 73 -5.542 0.548 0.909 1.00 0.00 N ATOM 1099 CA ASN A 73 -5.492 -0.109 -0.397 1.00 0.00 C ATOM 1100 C ASN A 73 -4.424 -1.198 -0.429 1.00 0.00 C ATOM 1101 O ASN A 73 -4.642 -2.282 -0.970 1.00 0.00 O ATOM 1102 CB ASN A 73 -5.221 0.919 -1.498 1.00 0.00 C ATOM 1103 CG ASN A 73 -6.449 1.740 -1.836 1.00 0.00 C ATOM 1104 OD1 ASN A 73 -7.395 1.243 -2.448 1.00 0.00 O ATOM 1105 ND2 ASN A 73 -6.441 3.007 -1.439 1.00 0.00 N ATOM 0 H ASN A 73 -5.648 1.562 0.866 1.00 0.00 H new ATOM 0 HA ASN A 73 -6.461 -0.577 -0.572 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -4.418 1.585 -1.180 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -4.873 0.405 -2.394 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -7.240 3.609 -1.639 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -5.636 3.378 -0.934 1.00 0.00 H new ATOM 1112 N SER A 74 -3.272 -0.903 0.160 1.00 0.00 N ATOM 1113 CA SER A 74 -2.172 -1.858 0.205 1.00 0.00 C ATOM 1114 C SER A 74 -1.989 -2.422 1.613 1.00 0.00 C ATOM 1115 O SER A 74 -0.865 -2.548 2.098 1.00 0.00 O ATOM 1116 CB SER A 74 -0.875 -1.195 -0.266 1.00 0.00 C ATOM 1117 OG SER A 74 -1.006 -0.701 -1.587 1.00 0.00 O ATOM 0 H SER A 74 -3.075 -0.011 0.613 1.00 0.00 H new ATOM 0 HA SER A 74 -2.416 -2.683 -0.464 1.00 0.00 H new ATOM 0 HB2 SER A 74 -0.615 -0.378 0.407 1.00 0.00 H new ATOM 0 HB3 SER A 74 -0.058 -1.915 -0.223 1.00 0.00 H new ATOM 0 HG SER A 74 -0.250 -1.011 -2.128 1.00 0.00 H new ATOM 1123 N LEU A 75 -3.098 -2.757 2.268 1.00 0.00 N ATOM 1124 CA LEU A 75 -3.048 -3.305 3.622 1.00 0.00 C ATOM 1125 C LEU A 75 -3.638 -4.714 3.682 1.00 0.00 C ATOM 1126 O LEU A 75 -3.243 -5.527 4.518 1.00 0.00 O ATOM 1127 CB LEU A 75 -3.787 -2.385 4.597 1.00 0.00 C ATOM 1128 CG LEU A 75 -2.889 -1.622 5.574 1.00 0.00 C ATOM 1129 CD1 LEU A 75 -2.518 -0.260 5.009 1.00 0.00 C ATOM 1130 CD2 LEU A 75 -3.572 -1.470 6.922 1.00 0.00 C ATOM 0 H LEU A 75 -4.039 -2.659 1.886 1.00 0.00 H new ATOM 0 HA LEU A 75 -1.999 -3.368 3.913 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.368 -1.664 4.023 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -4.496 -2.982 5.170 1.00 0.00 H new ATOM 0 HG LEU A 75 -1.974 -2.197 5.715 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -1.880 0.267 5.718 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -1.984 -0.390 4.067 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.424 0.321 4.836 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -2.917 -0.925 7.602 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -4.505 -0.920 6.797 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -3.785 -2.456 7.335 1.00 0.00 H new ATOM 1142 N LEU A 76 -4.578 -4.999 2.785 1.00 0.00 N ATOM 1143 CA LEU A 76 -5.229 -6.306 2.724 1.00 0.00 C ATOM 1144 C LEU A 76 -4.357 -7.314 1.991 1.00 0.00 C ATOM 1145 O LEU A 76 -4.817 -8.004 1.080 1.00 0.00 O ATOM 1146 CB LEU A 76 -6.584 -6.191 2.016 1.00 0.00 C ATOM 1147 CG LEU A 76 -6.612 -5.306 0.757 1.00 0.00 C ATOM 1148 CD1 LEU A 76 -6.903 -3.859 1.130 1.00 0.00 C ATOM 1149 CD2 LEU A 76 -5.307 -5.413 -0.035 1.00 0.00 C ATOM 0 H LEU A 76 -4.909 -4.336 2.084 1.00 0.00 H new ATOM 0 HA LEU A 76 -5.382 -6.653 3.746 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -6.914 -7.193 1.740 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -7.312 -5.800 2.727 1.00 0.00 H new ATOM 0 HG LEU A 76 -7.414 -5.667 0.113 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -6.919 -3.247 0.228 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -7.871 -3.799 1.627 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -6.127 -3.494 1.803 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -5.363 -4.775 -0.917 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -4.474 -5.094 0.591 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -5.153 -6.447 -0.345 1.00 0.00 H new ATOM 1161 N ILE A 77 -3.091 -7.380 2.372 1.00 0.00 N ATOM 1162 CA ILE A 77 -2.155 -8.289 1.722 1.00 0.00 C ATOM 1163 C ILE A 77 -2.191 -8.046 0.235 1.00 0.00 C ATOM 1164 O ILE A 77 -2.490 -8.950 -0.545 1.00 0.00 O ATOM 1165 CB ILE A 77 -2.495 -9.765 2.016 1.00 0.00 C ATOM 1166 CG1 ILE A 77 -2.969 -9.926 3.464 1.00 0.00 C ATOM 1167 CG2 ILE A 77 -1.295 -10.658 1.735 1.00 0.00 C ATOM 1168 CD1 ILE A 77 -2.019 -9.348 4.490 1.00 0.00 C ATOM 0 H ILE A 77 -2.688 -6.820 3.123 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.157 -8.096 2.116 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.306 -10.072 1.355 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.941 -9.446 3.573 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -3.112 -10.986 3.673 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -1.555 -11.695 1.948 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.009 -10.564 0.687 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -0.460 -10.356 2.368 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -2.426 -9.502 5.490 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -1.052 -9.845 4.411 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -1.894 -8.280 4.309 1.00 0.00 H new ATOM 1180 N GLU A 78 -1.906 -6.793 -0.137 1.00 0.00 N ATOM 1181 CA GLU A 78 -1.916 -6.369 -1.530 1.00 0.00 C ATOM 1182 C GLU A 78 -2.045 -7.563 -2.455 1.00 0.00 C ATOM 1183 O GLU A 78 -1.189 -8.447 -2.473 1.00 0.00 O ATOM 1184 CB GLU A 78 -0.664 -5.556 -1.859 1.00 0.00 C ATOM 1185 CG GLU A 78 -0.970 -4.108 -2.205 1.00 0.00 C ATOM 1186 CD GLU A 78 -0.738 -3.796 -3.671 1.00 0.00 C ATOM 1187 OE1 GLU A 78 -1.549 -4.245 -4.509 1.00 0.00 O ATOM 1188 OE2 GLU A 78 0.253 -3.103 -3.981 1.00 0.00 O ATOM 0 H GLU A 78 -1.664 -6.052 0.521 1.00 0.00 H new ATOM 0 HA GLU A 78 -2.784 -5.728 -1.684 1.00 0.00 H new ATOM 0 HB2 GLU A 78 0.015 -5.584 -1.007 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -0.145 -6.022 -2.696 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -2.007 -3.889 -1.951 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.347 -3.453 -1.595 1.00 0.00 H new ATOM 1195 N GLU A 79 -3.145 -7.585 -3.189 1.00 0.00 N ATOM 1196 CA GLU A 79 -3.466 -8.667 -4.115 1.00 0.00 C ATOM 1197 C GLU A 79 -2.221 -9.293 -4.754 1.00 0.00 C ATOM 1198 O GLU A 79 -2.234 -10.470 -5.116 1.00 0.00 O ATOM 1199 CB GLU A 79 -4.428 -8.145 -5.181 1.00 0.00 C ATOM 1200 CG GLU A 79 -5.559 -7.305 -4.596 1.00 0.00 C ATOM 1201 CD GLU A 79 -6.906 -7.627 -5.214 1.00 0.00 C ATOM 1202 OE1 GLU A 79 -7.240 -8.827 -5.316 1.00 0.00 O ATOM 1203 OE2 GLU A 79 -7.627 -6.681 -5.595 1.00 0.00 O ATOM 0 H GLU A 79 -3.849 -6.847 -3.161 1.00 0.00 H new ATOM 0 HA GLU A 79 -3.942 -9.466 -3.546 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -3.873 -7.546 -5.903 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -4.852 -8.989 -5.726 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -5.609 -7.469 -3.520 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -5.337 -6.249 -4.747 1.00 0.00 H new ATOM 1210 N SER A 80 -1.143 -8.519 -4.880 1.00 0.00 N ATOM 1211 CA SER A 80 0.090 -9.034 -5.460 1.00 0.00 C ATOM 1212 C SER A 80 1.323 -8.605 -4.657 1.00 0.00 C ATOM 1213 O SER A 80 2.368 -8.316 -5.239 1.00 0.00 O ATOM 1214 CB SER A 80 0.225 -8.562 -6.908 1.00 0.00 C ATOM 1215 OG SER A 80 0.008 -7.165 -7.014 1.00 0.00 O ATOM 0 H SER A 80 -1.101 -7.542 -4.590 1.00 0.00 H new ATOM 0 HA SER A 80 0.036 -10.122 -5.431 1.00 0.00 H new ATOM 0 HB2 SER A 80 1.219 -8.808 -7.282 1.00 0.00 H new ATOM 0 HB3 SER A 80 -0.492 -9.093 -7.535 1.00 0.00 H new ATOM 0 HG SER A 80 0.102 -6.889 -7.950 1.00 0.00 H new ATOM 1221 N THR A 81 1.217 -8.563 -3.322 1.00 0.00 N ATOM 1222 CA THR A 81 2.353 -8.169 -2.496 1.00 0.00 C ATOM 1223 C THR A 81 3.418 -9.260 -2.438 1.00 0.00 C ATOM 1224 O THR A 81 4.562 -8.991 -2.071 1.00 0.00 O ATOM 1225 CB THR A 81 1.888 -7.840 -1.088 1.00 0.00 C ATOM 1226 OG1 THR A 81 2.953 -7.280 -0.345 1.00 0.00 O ATOM 1227 CG2 THR A 81 1.366 -9.049 -0.340 1.00 0.00 C ATOM 0 H THR A 81 0.370 -8.794 -2.803 1.00 0.00 H new ATOM 0 HA THR A 81 2.798 -7.286 -2.954 1.00 0.00 H new ATOM 0 HB THR A 81 1.068 -7.130 -1.194 1.00 0.00 H new ATOM 0 HG1 THR A 81 3.806 -7.525 -0.761 1.00 0.00 H new ATOM 0 HG21 THR A 81 1.049 -8.750 0.659 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.518 -9.472 -0.878 1.00 0.00 H new ATOM 0 HG23 THR A 81 2.155 -9.797 -0.262 1.00 0.00 H new ATOM 1235 N GLY A 82 3.036 -10.488 -2.791 1.00 0.00 N ATOM 1236 CA GLY A 82 3.970 -11.606 -2.765 1.00 0.00 C ATOM 1237 C GLY A 82 5.383 -11.213 -3.162 1.00 0.00 C ATOM 1238 O GLY A 82 6.356 -11.738 -2.622 1.00 0.00 O ATOM 0 H GLY A 82 2.093 -10.729 -3.096 1.00 0.00 H new ATOM 0 HA2 GLY A 82 3.987 -12.034 -1.763 1.00 0.00 H new ATOM 0 HA3 GLY A 82 3.613 -12.385 -3.439 1.00 0.00 H new ATOM 1242 N ASP A 83 5.493 -10.280 -4.101 1.00 0.00 N ATOM 1243 CA ASP A 83 6.795 -9.810 -4.563 1.00 0.00 C ATOM 1244 C ASP A 83 7.404 -8.836 -3.559 1.00 0.00 C ATOM 1245 O ASP A 83 7.376 -7.622 -3.759 1.00 0.00 O ATOM 1246 CB ASP A 83 6.662 -9.137 -5.930 1.00 0.00 C ATOM 1247 CG ASP A 83 5.891 -9.987 -6.921 1.00 0.00 C ATOM 1248 OD1 ASP A 83 6.356 -11.103 -7.233 1.00 0.00 O ATOM 1249 OD2 ASP A 83 4.822 -9.536 -7.384 1.00 0.00 O ATOM 0 H ASP A 83 4.697 -9.834 -4.557 1.00 0.00 H new ATOM 0 HA ASP A 83 7.456 -10.672 -4.655 1.00 0.00 H new ATOM 0 HB2 ASP A 83 6.160 -8.177 -5.812 1.00 0.00 H new ATOM 0 HB3 ASP A 83 7.655 -8.931 -6.328 1.00 0.00 H new ATOM 1254 N PHE A 84 7.952 -9.379 -2.476 1.00 0.00 N ATOM 1255 CA PHE A 84 8.568 -8.564 -1.436 1.00 0.00 C ATOM 1256 C PHE A 84 9.735 -7.758 -1.990 1.00 0.00 C ATOM 1257 O PHE A 84 9.794 -6.540 -1.830 1.00 0.00 O ATOM 1258 CB PHE A 84 9.054 -9.451 -0.290 1.00 0.00 C ATOM 1259 CG PHE A 84 8.033 -9.667 0.792 1.00 0.00 C ATOM 1260 CD1 PHE A 84 7.197 -8.638 1.198 1.00 0.00 C ATOM 1261 CD2 PHE A 84 7.910 -10.903 1.402 1.00 0.00 C ATOM 1262 CE1 PHE A 84 6.262 -8.839 2.194 1.00 0.00 C ATOM 1263 CE2 PHE A 84 6.976 -11.109 2.398 1.00 0.00 C ATOM 1264 CZ PHE A 84 6.152 -10.078 2.795 1.00 0.00 C ATOM 0 H PHE A 84 7.982 -10.383 -2.296 1.00 0.00 H new ATOM 0 HA PHE A 84 7.815 -7.870 -1.063 1.00 0.00 H new ATOM 0 HB2 PHE A 84 9.350 -10.419 -0.694 1.00 0.00 H new ATOM 0 HB3 PHE A 84 9.945 -9.003 0.150 1.00 0.00 H new ATOM 0 HD1 PHE A 84 7.278 -7.668 0.730 1.00 0.00 H new ATOM 0 HD2 PHE A 84 8.552 -11.716 1.096 1.00 0.00 H new ATOM 0 HE1 PHE A 84 5.618 -8.029 2.503 1.00 0.00 H new ATOM 0 HE2 PHE A 84 6.891 -12.079 2.866 1.00 0.00 H new ATOM 0 HZ PHE A 84 5.422 -10.238 3.574 1.00 0.00 H new ATOM 1274 N ASN A 85 10.662 -8.447 -2.643 1.00 0.00 N ATOM 1275 CA ASN A 85 11.830 -7.794 -3.219 1.00 0.00 C ATOM 1276 C ASN A 85 11.414 -6.770 -4.270 1.00 0.00 C ATOM 1277 O ASN A 85 12.188 -5.879 -4.619 1.00 0.00 O ATOM 1278 CB ASN A 85 12.765 -8.827 -3.852 1.00 0.00 C ATOM 1279 CG ASN A 85 13.101 -9.969 -2.913 1.00 0.00 C ATOM 1280 OD1 ASN A 85 14.114 -9.936 -2.216 1.00 0.00 O ATOM 1281 ND2 ASN A 85 12.256 -10.994 -2.898 1.00 0.00 N ATOM 0 H ASN A 85 10.628 -9.456 -2.787 1.00 0.00 H new ATOM 0 HA ASN A 85 12.357 -7.280 -2.415 1.00 0.00 H new ATOM 0 HB2 ASN A 85 12.300 -9.228 -4.752 1.00 0.00 H new ATOM 0 HB3 ASN A 85 13.687 -8.334 -4.162 1.00 0.00 H new ATOM 0 HD21 ASN A 85 12.436 -11.794 -2.292 1.00 0.00 H new ATOM 0 HD22 ASN A 85 11.427 -10.980 -3.492 1.00 0.00 H new ATOM 1288 N GLY A 86 10.193 -6.908 -4.777 1.00 0.00 N ATOM 1289 CA GLY A 86 9.708 -5.992 -5.789 1.00 0.00 C ATOM 1290 C GLY A 86 10.206 -6.351 -7.175 1.00 0.00 C ATOM 1291 O GLY A 86 9.830 -5.714 -8.160 1.00 0.00 O ATOM 0 H GLY A 86 9.533 -7.637 -4.505 1.00 0.00 H new ATOM 0 HA2 GLY A 86 8.618 -5.994 -5.785 1.00 0.00 H new ATOM 0 HA3 GLY A 86 10.026 -4.979 -5.542 1.00 0.00 H new ATOM 1295 N ASN A 87 11.053 -7.376 -7.256 1.00 0.00 N ATOM 1296 CA ASN A 87 11.597 -7.811 -8.541 1.00 0.00 C ATOM 1297 C ASN A 87 10.820 -9.005 -9.093 1.00 0.00 C ATOM 1298 O ASN A 87 10.790 -9.227 -10.304 1.00 0.00 O ATOM 1299 CB ASN A 87 13.085 -8.163 -8.420 1.00 0.00 C ATOM 1300 CG ASN A 87 13.430 -8.833 -7.105 1.00 0.00 C ATOM 1301 OD1 ASN A 87 14.166 -8.279 -6.289 1.00 0.00 O ATOM 1302 ND2 ASN A 87 12.903 -10.032 -6.895 1.00 0.00 N ATOM 0 H ASN A 87 11.375 -7.917 -6.454 1.00 0.00 H new ATOM 0 HA ASN A 87 11.493 -6.979 -9.237 1.00 0.00 H new ATOM 0 HB2 ASN A 87 13.365 -8.822 -9.242 1.00 0.00 H new ATOM 0 HB3 ASN A 87 13.677 -7.254 -8.525 1.00 0.00 H new ATOM 0 HD21 ASN A 87 13.103 -10.532 -6.029 1.00 0.00 H new ATOM 0 HD22 ASN A 87 12.298 -10.454 -7.600 1.00 0.00 H new ATOM 1309 N GLY A 88 10.182 -9.764 -8.206 1.00 0.00 N ATOM 1310 CA GLY A 88 9.405 -10.912 -8.641 1.00 0.00 C ATOM 1311 C GLY A 88 9.976 -12.238 -8.172 1.00 0.00 C ATOM 1312 O GLY A 88 10.436 -13.043 -8.982 1.00 0.00 O ATOM 0 H GLY A 88 10.189 -9.606 -7.198 1.00 0.00 H new ATOM 0 HA2 GLY A 88 8.385 -10.813 -8.270 1.00 0.00 H new ATOM 0 HA3 GLY A 88 9.350 -10.913 -9.730 1.00 0.00 H new ATOM 1316 N LYS A 89 9.932 -12.475 -6.865 1.00 0.00 N ATOM 1317 CA LYS A 89 10.433 -13.721 -6.296 1.00 0.00 C ATOM 1318 C LYS A 89 9.818 -13.964 -4.919 1.00 0.00 C ATOM 1319 O LYS A 89 10.034 -13.189 -3.987 1.00 0.00 O ATOM 1320 CB LYS A 89 11.965 -13.706 -6.212 1.00 0.00 C ATOM 1321 CG LYS A 89 12.522 -12.881 -5.062 1.00 0.00 C ATOM 1322 CD LYS A 89 14.040 -12.806 -5.121 1.00 0.00 C ATOM 1323 CE LYS A 89 14.644 -12.602 -3.740 1.00 0.00 C ATOM 1324 NZ LYS A 89 15.884 -13.405 -3.553 1.00 0.00 N ATOM 0 H LYS A 89 9.554 -11.820 -6.180 1.00 0.00 H new ATOM 0 HA LYS A 89 10.140 -14.540 -6.953 1.00 0.00 H new ATOM 0 HB2 LYS A 89 12.322 -14.731 -6.114 1.00 0.00 H new ATOM 0 HB3 LYS A 89 12.365 -13.318 -7.149 1.00 0.00 H new ATOM 0 HG2 LYS A 89 12.104 -11.875 -5.098 1.00 0.00 H new ATOM 0 HG3 LYS A 89 12.214 -13.321 -4.113 1.00 0.00 H new ATOM 0 HD2 LYS A 89 14.434 -13.723 -5.559 1.00 0.00 H new ATOM 0 HD3 LYS A 89 14.339 -11.987 -5.774 1.00 0.00 H new ATOM 0 HE2 LYS A 89 14.870 -11.546 -3.595 1.00 0.00 H new ATOM 0 HE3 LYS A 89 13.914 -12.879 -2.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 16.265 -13.238 -2.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 15.664 -14.415 -3.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 16.590 -13.123 -4.262 1.00 0.00 H new ATOM 1338 N ILE A 90 9.041 -15.035 -4.802 1.00 0.00 N ATOM 1339 CA ILE A 90 8.387 -15.366 -3.541 1.00 0.00 C ATOM 1340 C ILE A 90 8.899 -16.689 -2.982 1.00 0.00 C ATOM 1341 O ILE A 90 8.463 -17.762 -3.397 1.00 0.00 O ATOM 1342 CB ILE A 90 6.850 -15.446 -3.691 1.00 0.00 C ATOM 1343 CG1 ILE A 90 6.381 -14.710 -4.951 1.00 0.00 C ATOM 1344 CG2 ILE A 90 6.172 -14.871 -2.456 1.00 0.00 C ATOM 1345 CD1 ILE A 90 6.832 -13.268 -5.017 1.00 0.00 C ATOM 0 H ILE A 90 8.849 -15.687 -5.562 1.00 0.00 H new ATOM 0 HA ILE A 90 8.631 -14.560 -2.849 1.00 0.00 H new ATOM 0 HB ILE A 90 6.571 -16.495 -3.791 1.00 0.00 H new ATOM 0 HG12 ILE A 90 6.753 -15.238 -5.829 1.00 0.00 H new ATOM 0 HG13 ILE A 90 5.292 -14.743 -4.996 1.00 0.00 H new ATOM 0 HG21 ILE A 90 5.090 -14.933 -2.573 1.00 0.00 H new ATOM 0 HG22 ILE A 90 6.475 -15.440 -1.577 1.00 0.00 H new ATOM 0 HG23 ILE A 90 6.465 -13.828 -2.332 1.00 0.00 H new ATOM 0 HD11 ILE A 90 6.462 -12.813 -5.936 1.00 0.00 H new ATOM 0 HD12 ILE A 90 6.438 -12.724 -4.159 1.00 0.00 H new ATOM 0 HD13 ILE A 90 7.921 -13.226 -5.004 1.00 0.00 H new ATOM 1357 N ASP A 91 9.824 -16.601 -2.032 1.00 0.00 N ATOM 1358 CA ASP A 91 10.397 -17.788 -1.407 1.00 0.00 C ATOM 1359 C ASP A 91 11.352 -17.398 -0.286 1.00 0.00 C ATOM 1360 O ASP A 91 11.199 -17.837 0.854 1.00 0.00 O ATOM 1361 CB ASP A 91 11.129 -18.639 -2.446 1.00 0.00 C ATOM 1362 CG ASP A 91 11.008 -20.124 -2.167 1.00 0.00 C ATOM 1363 OD1 ASP A 91 10.878 -20.497 -0.982 1.00 0.00 O ATOM 1364 OD2 ASP A 91 11.044 -20.915 -3.133 1.00 0.00 O ATOM 0 H ASP A 91 10.193 -15.719 -1.678 1.00 0.00 H new ATOM 0 HA ASP A 91 9.583 -18.375 -0.982 1.00 0.00 H new ATOM 0 HB2 ASP A 91 10.727 -18.424 -3.436 1.00 0.00 H new ATOM 0 HB3 ASP A 91 12.183 -18.360 -2.463 1.00 0.00 H new ATOM 1369 N ILE A 92 12.330 -16.566 -0.616 1.00 0.00 N ATOM 1370 CA ILE A 92 13.304 -16.108 0.366 1.00 0.00 C ATOM 1371 C ILE A 92 12.930 -14.732 0.908 1.00 0.00 C ATOM 1372 O ILE A 92 13.438 -14.303 1.944 1.00 0.00 O ATOM 1373 CB ILE A 92 14.723 -16.044 -0.230 1.00 0.00 C ATOM 1374 CG1 ILE A 92 15.746 -15.749 0.881 1.00 0.00 C ATOM 1375 CG2 ILE A 92 14.782 -15.007 -1.347 1.00 0.00 C ATOM 1376 CD1 ILE A 92 16.567 -14.493 0.669 1.00 0.00 C ATOM 0 H ILE A 92 12.470 -16.194 -1.555 1.00 0.00 H new ATOM 0 HA ILE A 92 13.295 -16.833 1.179 1.00 0.00 H new ATOM 0 HB ILE A 92 14.976 -17.009 -0.668 1.00 0.00 H new ATOM 0 HG12 ILE A 92 15.217 -15.665 1.830 1.00 0.00 H new ATOM 0 HG13 ILE A 92 16.423 -16.599 0.968 1.00 0.00 H new ATOM 0 HG21 ILE A 92 15.791 -14.973 -1.759 1.00 0.00 H new ATOM 0 HG22 ILE A 92 14.078 -15.279 -2.133 1.00 0.00 H new ATOM 0 HG23 ILE A 92 14.520 -14.027 -0.948 1.00 0.00 H new ATOM 0 HD11 ILE A 92 17.260 -14.366 1.501 1.00 0.00 H new ATOM 0 HD12 ILE A 92 17.129 -14.578 -0.261 1.00 0.00 H new ATOM 0 HD13 ILE A 92 15.904 -13.630 0.615 1.00 0.00 H new ATOM 1388 N GLY A 93 12.036 -14.044 0.201 1.00 0.00 N ATOM 1389 CA GLY A 93 11.608 -12.727 0.630 1.00 0.00 C ATOM 1390 C GLY A 93 10.730 -12.766 1.868 1.00 0.00 C ATOM 1391 O GLY A 93 10.334 -11.723 2.389 1.00 0.00 O ATOM 0 H GLY A 93 11.602 -14.377 -0.660 1.00 0.00 H new ATOM 0 HA2 GLY A 93 12.486 -12.113 0.832 1.00 0.00 H new ATOM 0 HA3 GLY A 93 11.062 -12.245 -0.181 1.00 0.00 H new ATOM 1395 N ASP A 94 10.421 -13.967 2.345 1.00 0.00 N ATOM 1396 CA ASP A 94 9.584 -14.117 3.529 1.00 0.00 C ATOM 1397 C ASP A 94 10.441 -14.241 4.784 1.00 0.00 C ATOM 1398 O ASP A 94 10.119 -13.671 5.827 1.00 0.00 O ATOM 1399 CB ASP A 94 8.671 -15.337 3.394 1.00 0.00 C ATOM 1400 CG ASP A 94 9.408 -16.565 2.897 1.00 0.00 C ATOM 1401 OD1 ASP A 94 10.341 -17.020 3.590 1.00 0.00 O ATOM 1402 OD2 ASP A 94 9.050 -17.073 1.813 1.00 0.00 O ATOM 0 H ASP A 94 10.735 -14.845 1.933 1.00 0.00 H new ATOM 0 HA ASP A 94 8.964 -13.225 3.618 1.00 0.00 H new ATOM 0 HB2 ASP A 94 8.218 -15.556 4.361 1.00 0.00 H new ATOM 0 HB3 ASP A 94 7.858 -15.103 2.707 1.00 0.00 H new ATOM 1407 N LEU A 95 11.531 -14.992 4.677 1.00 0.00 N ATOM 1408 CA LEU A 95 12.434 -15.194 5.806 1.00 0.00 C ATOM 1409 C LEU A 95 13.786 -14.529 5.563 1.00 0.00 C ATOM 1410 O LEU A 95 14.810 -14.993 6.067 1.00 0.00 O ATOM 1411 CB LEU A 95 12.627 -16.689 6.065 1.00 0.00 C ATOM 1412 CG LEU A 95 11.530 -17.349 6.900 1.00 0.00 C ATOM 1413 CD1 LEU A 95 11.415 -18.827 6.559 1.00 0.00 C ATOM 1414 CD2 LEU A 95 11.806 -17.163 8.385 1.00 0.00 C ATOM 0 H LEU A 95 11.812 -15.471 3.821 1.00 0.00 H new ATOM 0 HA LEU A 95 11.982 -14.731 6.683 1.00 0.00 H new ATOM 0 HB2 LEU A 95 12.691 -17.203 5.106 1.00 0.00 H new ATOM 0 HB3 LEU A 95 13.583 -16.834 6.569 1.00 0.00 H new ATOM 0 HG LEU A 95 10.581 -16.868 6.663 1.00 0.00 H new ATOM 0 HD11 LEU A 95 10.629 -19.280 7.163 1.00 0.00 H new ATOM 0 HD12 LEU A 95 11.170 -18.939 5.503 1.00 0.00 H new ATOM 0 HD13 LEU A 95 12.363 -19.323 6.766 1.00 0.00 H new ATOM 0 HD21 LEU A 95 11.015 -17.639 8.965 1.00 0.00 H new ATOM 0 HD22 LEU A 95 12.764 -17.618 8.637 1.00 0.00 H new ATOM 0 HD23 LEU A 95 11.837 -16.099 8.619 1.00 0.00 H new ATOM 1426 N ALA A 96 13.794 -13.449 4.787 1.00 0.00 N ATOM 1427 CA ALA A 96 15.038 -12.745 4.488 1.00 0.00 C ATOM 1428 C ALA A 96 14.803 -11.290 4.081 1.00 0.00 C ATOM 1429 O ALA A 96 15.636 -10.428 4.350 1.00 0.00 O ATOM 1430 CB ALA A 96 15.801 -13.476 3.395 1.00 0.00 C ATOM 0 H ALA A 96 12.962 -13.045 4.357 1.00 0.00 H new ATOM 0 HA ALA A 96 15.629 -12.732 5.404 1.00 0.00 H new ATOM 0 HB1 ALA A 96 16.727 -12.943 3.179 1.00 0.00 H new ATOM 0 HB2 ALA A 96 16.033 -14.488 3.728 1.00 0.00 H new ATOM 0 HB3 ALA A 96 15.190 -13.522 2.493 1.00 0.00 H new ATOM 1436 N MET A 97 13.682 -11.021 3.419 1.00 0.00 N ATOM 1437 CA MET A 97 13.372 -9.665 2.971 1.00 0.00 C ATOM 1438 C MET A 97 12.580 -8.887 4.018 1.00 0.00 C ATOM 1439 O MET A 97 13.092 -7.954 4.635 1.00 0.00 O ATOM 1440 CB MET A 97 12.573 -9.705 1.668 1.00 0.00 C ATOM 1441 CG MET A 97 13.422 -9.841 0.417 1.00 0.00 C ATOM 1442 SD MET A 97 14.673 -8.548 0.275 1.00 0.00 S ATOM 1443 CE MET A 97 13.684 -7.192 -0.351 1.00 0.00 C ATOM 0 H MET A 97 12.976 -11.718 3.181 1.00 0.00 H new ATOM 0 HA MET A 97 14.322 -9.156 2.810 1.00 0.00 H new ATOM 0 HB2 MET A 97 11.873 -10.540 1.710 1.00 0.00 H new ATOM 0 HB3 MET A 97 11.979 -8.794 1.592 1.00 0.00 H new ATOM 0 HG2 MET A 97 13.912 -10.815 0.420 1.00 0.00 H new ATOM 0 HG3 MET A 97 12.775 -9.812 -0.460 1.00 0.00 H new ATOM 0 HE1 MET A 97 14.094 -6.851 -1.302 1.00 0.00 H new ATOM 0 HE2 MET A 97 12.657 -7.528 -0.498 1.00 0.00 H new ATOM 0 HE3 MET A 97 13.698 -6.370 0.365 1.00 0.00 H new ATOM 1453 N VAL A 98 11.315 -9.255 4.182 1.00 0.00 N ATOM 1454 CA VAL A 98 10.431 -8.573 5.121 1.00 0.00 C ATOM 1455 C VAL A 98 10.984 -8.564 6.550 1.00 0.00 C ATOM 1456 O VAL A 98 11.419 -7.523 7.041 1.00 0.00 O ATOM 1457 CB VAL A 98 9.005 -9.189 5.097 1.00 0.00 C ATOM 1458 CG1 VAL A 98 9.059 -10.709 5.056 1.00 0.00 C ATOM 1459 CG2 VAL A 98 8.164 -8.720 6.283 1.00 0.00 C ATOM 0 H VAL A 98 10.877 -10.024 3.675 1.00 0.00 H new ATOM 0 HA VAL A 98 10.372 -7.536 4.791 1.00 0.00 H new ATOM 0 HB VAL A 98 8.524 -8.836 4.184 1.00 0.00 H new ATOM 0 HG11 VAL A 98 8.045 -11.109 5.040 1.00 0.00 H new ATOM 0 HG12 VAL A 98 9.590 -11.030 4.160 1.00 0.00 H new ATOM 0 HG13 VAL A 98 9.581 -11.078 5.939 1.00 0.00 H new ATOM 0 HG21 VAL A 98 7.174 -9.173 6.229 1.00 0.00 H new ATOM 0 HG22 VAL A 98 8.649 -9.017 7.213 1.00 0.00 H new ATOM 0 HG23 VAL A 98 8.068 -7.635 6.254 1.00 0.00 H new ATOM 1469 N SER A 99 10.951 -9.709 7.224 1.00 0.00 N ATOM 1470 CA SER A 99 11.421 -9.801 8.603 1.00 0.00 C ATOM 1471 C SER A 99 12.879 -9.377 8.771 1.00 0.00 C ATOM 1472 O SER A 99 13.382 -9.325 9.894 1.00 0.00 O ATOM 1473 CB SER A 99 11.232 -11.221 9.135 1.00 0.00 C ATOM 1474 OG SER A 99 11.374 -12.179 8.101 1.00 0.00 O ATOM 0 H SER A 99 10.604 -10.587 6.838 1.00 0.00 H new ATOM 0 HA SER A 99 10.817 -9.102 9.181 1.00 0.00 H new ATOM 0 HB2 SER A 99 11.962 -11.418 9.920 1.00 0.00 H new ATOM 0 HB3 SER A 99 10.245 -11.314 9.588 1.00 0.00 H new ATOM 0 HG SER A 99 11.250 -13.079 8.469 1.00 0.00 H new ATOM 1480 N LYS A 100 13.566 -9.095 7.673 1.00 0.00 N ATOM 1481 CA LYS A 100 14.965 -8.704 7.754 1.00 0.00 C ATOM 1482 C LYS A 100 15.150 -7.389 8.503 1.00 0.00 C ATOM 1483 O LYS A 100 16.236 -7.113 9.014 1.00 0.00 O ATOM 1484 CB LYS A 100 15.589 -8.672 6.347 1.00 0.00 C ATOM 1485 CG LYS A 100 16.313 -7.385 5.976 1.00 0.00 C ATOM 1486 CD LYS A 100 15.370 -6.393 5.321 1.00 0.00 C ATOM 1487 CE LYS A 100 15.932 -4.983 5.349 1.00 0.00 C ATOM 1488 NZ LYS A 100 17.188 -4.870 4.556 1.00 0.00 N ATOM 0 H LYS A 100 13.184 -9.129 6.728 1.00 0.00 H new ATOM 0 HA LYS A 100 15.496 -9.455 8.339 1.00 0.00 H new ATOM 0 HB2 LYS A 100 16.292 -9.500 6.262 1.00 0.00 H new ATOM 0 HB3 LYS A 100 14.800 -8.848 5.615 1.00 0.00 H new ATOM 0 HG2 LYS A 100 16.749 -6.940 6.870 1.00 0.00 H new ATOM 0 HG3 LYS A 100 17.136 -7.610 5.298 1.00 0.00 H new ATOM 0 HD2 LYS A 100 15.187 -6.692 4.289 1.00 0.00 H new ATOM 0 HD3 LYS A 100 14.408 -6.412 5.834 1.00 0.00 H new ATOM 0 HE2 LYS A 100 15.190 -4.289 4.955 1.00 0.00 H new ATOM 0 HE3 LYS A 100 16.126 -4.690 6.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 17.531 -3.889 4.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 17.910 -5.501 4.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 17.001 -5.141 3.569 1.00 0.00 H new ATOM 1502 N ASN A 101 14.097 -6.592 8.595 1.00 0.00 N ATOM 1503 CA ASN A 101 14.181 -5.332 9.318 1.00 0.00 C ATOM 1504 C ASN A 101 13.178 -5.312 10.465 1.00 0.00 C ATOM 1505 O ASN A 101 13.509 -4.902 11.577 1.00 0.00 O ATOM 1506 CB ASN A 101 13.963 -4.143 8.379 1.00 0.00 C ATOM 1507 CG ASN A 101 12.630 -4.190 7.666 1.00 0.00 C ATOM 1508 OD1 ASN A 101 11.589 -3.904 8.253 1.00 0.00 O ATOM 1509 ND2 ASN A 101 12.660 -4.542 6.385 1.00 0.00 N ATOM 0 H ASN A 101 13.185 -6.791 8.184 1.00 0.00 H new ATOM 0 HA ASN A 101 15.184 -5.243 9.736 1.00 0.00 H new ATOM 0 HB2 ASN A 101 14.030 -3.218 8.951 1.00 0.00 H new ATOM 0 HB3 ASN A 101 14.764 -4.119 7.640 1.00 0.00 H new ATOM 0 HD21 ASN A 101 11.794 -4.583 5.847 1.00 0.00 H new ATOM 0 HD22 ASN A 101 13.549 -4.771 5.940 1.00 0.00 H new ATOM 1516 N ILE A 102 11.954 -5.768 10.197 1.00 0.00 N ATOM 1517 CA ILE A 102 10.913 -5.810 11.216 1.00 0.00 C ATOM 1518 C ILE A 102 10.775 -4.475 11.931 1.00 0.00 C ATOM 1519 O ILE A 102 11.571 -4.131 12.804 1.00 0.00 O ATOM 1520 CB ILE A 102 11.163 -6.920 12.255 1.00 0.00 C ATOM 1521 CG1 ILE A 102 11.162 -8.292 11.572 1.00 0.00 C ATOM 1522 CG2 ILE A 102 10.112 -6.863 13.360 1.00 0.00 C ATOM 1523 CD1 ILE A 102 9.776 -8.868 11.337 1.00 0.00 C ATOM 0 H ILE A 102 11.662 -6.113 9.282 1.00 0.00 H new ATOM 0 HA ILE A 102 9.984 -6.030 10.690 1.00 0.00 H new ATOM 0 HB ILE A 102 12.141 -6.762 12.710 1.00 0.00 H new ATOM 0 HG12 ILE A 102 11.676 -8.209 10.615 1.00 0.00 H new ATOM 0 HG13 ILE A 102 11.735 -8.990 12.182 1.00 0.00 H new ATOM 0 HG21 ILE A 102 10.303 -7.654 14.085 1.00 0.00 H new ATOM 0 HG22 ILE A 102 10.160 -5.895 13.858 1.00 0.00 H new ATOM 0 HG23 ILE A 102 9.121 -7.000 12.927 1.00 0.00 H new ATOM 0 HD11 ILE A 102 9.863 -9.839 10.850 1.00 0.00 H new ATOM 0 HD12 ILE A 102 9.264 -8.986 12.292 1.00 0.00 H new ATOM 0 HD13 ILE A 102 9.205 -8.193 10.700 1.00 0.00 H new ATOM 1535 N GLY A 103 9.743 -3.743 11.561 1.00 0.00 N ATOM 1536 CA GLY A 103 9.486 -2.456 12.178 1.00 0.00 C ATOM 1537 C GLY A 103 10.065 -1.288 11.400 1.00 0.00 C ATOM 1538 O GLY A 103 10.038 -0.150 11.872 1.00 0.00 O ATOM 0 H GLY A 103 9.073 -4.014 10.841 1.00 0.00 H new ATOM 0 HA2 GLY A 103 8.409 -2.318 12.278 1.00 0.00 H new ATOM 0 HA3 GLY A 103 9.903 -2.454 13.185 1.00 0.00 H new ATOM 1542 N SER A 104 10.594 -1.560 10.211 1.00 0.00 N ATOM 1543 CA SER A 104 11.180 -0.510 9.383 1.00 0.00 C ATOM 1544 C SER A 104 10.118 0.182 8.537 1.00 0.00 C ATOM 1545 O SER A 104 9.362 -0.466 7.815 1.00 0.00 O ATOM 1546 CB SER A 104 12.266 -1.094 8.479 1.00 0.00 C ATOM 1547 OG SER A 104 13.369 -0.211 8.369 1.00 0.00 O ATOM 0 H SER A 104 10.629 -2.493 9.800 1.00 0.00 H new ATOM 0 HA SER A 104 11.625 0.232 10.047 1.00 0.00 H new ATOM 0 HB2 SER A 104 12.601 -2.051 8.880 1.00 0.00 H new ATOM 0 HB3 SER A 104 11.853 -1.290 7.489 1.00 0.00 H new ATOM 0 HG SER A 104 14.050 -0.609 7.787 1.00 0.00 H new ATOM 1553 N THR A 105 10.071 1.507 8.630 1.00 0.00 N ATOM 1554 CA THR A 105 9.106 2.293 7.873 1.00 0.00 C ATOM 1555 C THR A 105 9.715 2.792 6.566 1.00 0.00 C ATOM 1556 O THR A 105 9.006 3.008 5.583 1.00 0.00 O ATOM 1557 CB THR A 105 8.616 3.477 8.708 1.00 0.00 C ATOM 1558 OG1 THR A 105 8.676 3.173 10.092 1.00 0.00 O ATOM 1559 CG2 THR A 105 7.194 3.885 8.391 1.00 0.00 C ATOM 0 H THR A 105 10.691 2.059 9.223 1.00 0.00 H new ATOM 0 HA THR A 105 8.258 1.651 7.634 1.00 0.00 H new ATOM 0 HB THR A 105 9.280 4.304 8.455 1.00 0.00 H new ATOM 0 HG1 THR A 105 7.866 2.688 10.356 1.00 0.00 H new ATOM 0 HG21 THR A 105 6.909 4.730 9.018 1.00 0.00 H new ATOM 0 HG22 THR A 105 7.123 4.172 7.342 1.00 0.00 H new ATOM 0 HG23 THR A 105 6.524 3.048 8.584 1.00 0.00 H new ATOM 1567 N THR A 106 11.034 2.969 6.558 1.00 0.00 N ATOM 1568 CA THR A 106 11.734 3.438 5.368 1.00 0.00 C ATOM 1569 C THR A 106 11.496 2.493 4.195 1.00 0.00 C ATOM 1570 O THR A 106 10.790 2.831 3.245 1.00 0.00 O ATOM 1571 CB THR A 106 13.233 3.559 5.647 1.00 0.00 C ATOM 1572 OG1 THR A 106 13.791 2.294 5.953 1.00 0.00 O ATOM 1573 CG2 THR A 106 13.556 4.492 6.794 1.00 0.00 C ATOM 0 H THR A 106 11.638 2.795 7.362 1.00 0.00 H new ATOM 0 HA THR A 106 11.342 4.421 5.107 1.00 0.00 H new ATOM 0 HB THR A 106 13.663 3.970 4.733 1.00 0.00 H new ATOM 0 HG1 THR A 106 14.750 2.393 6.126 1.00 0.00 H new ATOM 0 HG21 THR A 106 14.636 4.531 6.938 1.00 0.00 H new ATOM 0 HG22 THR A 106 13.183 5.491 6.567 1.00 0.00 H new ATOM 0 HG23 THR A 106 13.082 4.127 7.705 1.00 0.00 H new ATOM 1581 N ASN A 107 12.086 1.304 4.270 1.00 0.00 N ATOM 1582 CA ASN A 107 11.931 0.307 3.217 1.00 0.00 C ATOM 1583 C ASN A 107 10.597 -0.418 3.360 1.00 0.00 C ATOM 1584 O ASN A 107 10.542 -1.554 3.831 1.00 0.00 O ATOM 1585 CB ASN A 107 13.083 -0.700 3.264 1.00 0.00 C ATOM 1586 CG ASN A 107 13.004 -1.721 2.147 1.00 0.00 C ATOM 1587 OD1 ASN A 107 13.584 -1.535 1.077 1.00 0.00 O ATOM 1588 ND2 ASN A 107 12.283 -2.809 2.390 1.00 0.00 N ATOM 0 H ASN A 107 12.675 1.008 5.048 1.00 0.00 H new ATOM 0 HA ASN A 107 11.949 0.818 2.254 1.00 0.00 H new ATOM 0 HB2 ASN A 107 14.031 -0.166 3.198 1.00 0.00 H new ATOM 0 HB3 ASN A 107 13.073 -1.215 4.225 1.00 0.00 H new ATOM 0 HD21 ASN A 107 12.193 -3.531 1.676 1.00 0.00 H new ATOM 0 HD22 ASN A 107 11.819 -2.922 3.291 1.00 0.00 H new ATOM 1595 N THR A 108 9.523 0.253 2.959 1.00 0.00 N ATOM 1596 CA THR A 108 8.185 -0.321 3.048 1.00 0.00 C ATOM 1597 C THR A 108 7.841 -1.145 1.811 1.00 0.00 C ATOM 1598 O THR A 108 6.758 -1.723 1.727 1.00 0.00 O ATOM 1599 CB THR A 108 7.148 0.784 3.245 1.00 0.00 C ATOM 1600 OG1 THR A 108 7.610 2.009 2.705 1.00 0.00 O ATOM 1601 CG2 THR A 108 6.807 1.019 4.699 1.00 0.00 C ATOM 0 H THR A 108 9.553 1.195 2.569 1.00 0.00 H new ATOM 0 HA THR A 108 8.170 -0.989 3.909 1.00 0.00 H new ATOM 0 HB THR A 108 6.252 0.442 2.726 1.00 0.00 H new ATOM 0 HG1 THR A 108 6.931 2.703 2.840 1.00 0.00 H new ATOM 0 HG21 THR A 108 6.066 1.815 4.775 1.00 0.00 H new ATOM 0 HG22 THR A 108 6.402 0.104 5.130 1.00 0.00 H new ATOM 0 HG23 THR A 108 7.707 1.308 5.242 1.00 0.00 H new ATOM 1609 N SER A 109 8.763 -1.201 0.852 1.00 0.00 N ATOM 1610 CA SER A 109 8.547 -1.961 -0.375 1.00 0.00 C ATOM 1611 C SER A 109 8.000 -3.354 -0.068 1.00 0.00 C ATOM 1612 O SER A 109 7.305 -3.954 -0.889 1.00 0.00 O ATOM 1613 CB SER A 109 9.851 -2.077 -1.165 1.00 0.00 C ATOM 1614 OG SER A 109 9.616 -2.584 -2.468 1.00 0.00 O ATOM 0 H SER A 109 9.666 -0.729 0.902 1.00 0.00 H new ATOM 0 HA SER A 109 7.811 -1.427 -0.976 1.00 0.00 H new ATOM 0 HB2 SER A 109 10.327 -1.099 -1.233 1.00 0.00 H new ATOM 0 HB3 SER A 109 10.543 -2.732 -0.636 1.00 0.00 H new ATOM 0 HG SER A 109 10.465 -2.647 -2.953 1.00 0.00 H new ATOM 1620 N LEU A 110 8.318 -3.865 1.119 1.00 0.00 N ATOM 1621 CA LEU A 110 7.857 -5.185 1.530 1.00 0.00 C ATOM 1622 C LEU A 110 6.467 -5.118 2.147 1.00 0.00 C ATOM 1623 O LEU A 110 5.500 -5.583 1.546 1.00 0.00 O ATOM 1624 CB LEU A 110 8.831 -5.806 2.529 1.00 0.00 C ATOM 1625 CG LEU A 110 10.307 -5.603 2.204 1.00 0.00 C ATOM 1626 CD1 LEU A 110 11.135 -5.636 3.481 1.00 0.00 C ATOM 1627 CD2 LEU A 110 10.777 -6.665 1.219 1.00 0.00 C ATOM 0 H LEU A 110 8.893 -3.384 1.811 1.00 0.00 H new ATOM 0 HA LEU A 110 7.810 -5.809 0.637 1.00 0.00 H new ATOM 0 HB2 LEU A 110 8.631 -5.388 3.516 1.00 0.00 H new ATOM 0 HB3 LEU A 110 8.632 -6.876 2.590 1.00 0.00 H new ATOM 0 HG LEU A 110 10.439 -4.626 1.739 1.00 0.00 H new ATOM 0 HD11 LEU A 110 12.187 -5.490 3.236 1.00 0.00 H new ATOM 0 HD12 LEU A 110 10.804 -4.841 4.150 1.00 0.00 H new ATOM 0 HD13 LEU A 110 11.007 -6.600 3.973 1.00 0.00 H new ATOM 0 HD21 LEU A 110 11.832 -6.511 0.994 1.00 0.00 H new ATOM 0 HD22 LEU A 110 10.640 -7.654 1.657 1.00 0.00 H new ATOM 0 HD23 LEU A 110 10.195 -6.592 0.300 1.00 0.00 H new ATOM 1639 N ASP A 111 6.384 -4.543 3.356 1.00 0.00 N ATOM 1640 CA ASP A 111 5.137 -4.404 4.094 1.00 0.00 C ATOM 1641 C ASP A 111 3.918 -4.516 3.197 1.00 0.00 C ATOM 1642 O ASP A 111 3.349 -3.510 2.782 1.00 0.00 O ATOM 1643 CB ASP A 111 5.105 -3.062 4.830 1.00 0.00 C ATOM 1644 CG ASP A 111 6.264 -2.894 5.790 1.00 0.00 C ATOM 1645 OD1 ASP A 111 6.302 -3.620 6.804 1.00 0.00 O ATOM 1646 OD2 ASP A 111 7.132 -2.036 5.530 1.00 0.00 O ATOM 0 H ASP A 111 7.193 -4.161 3.846 1.00 0.00 H new ATOM 0 HA ASP A 111 5.099 -5.225 4.810 1.00 0.00 H new ATOM 0 HB2 ASP A 111 5.122 -2.252 4.101 1.00 0.00 H new ATOM 0 HB3 ASP A 111 4.168 -2.976 5.380 1.00 0.00 H new ATOM 1651 N LEU A 112 3.499 -5.746 2.928 1.00 0.00 N ATOM 1652 CA LEU A 112 2.316 -5.971 2.113 1.00 0.00 C ATOM 1653 C LEU A 112 1.168 -5.150 2.684 1.00 0.00 C ATOM 1654 O LEU A 112 0.237 -4.765 1.978 1.00 0.00 O ATOM 1655 CB LEU A 112 1.963 -7.457 2.103 1.00 0.00 C ATOM 1656 CG LEU A 112 2.149 -8.167 3.440 1.00 0.00 C ATOM 1657 CD1 LEU A 112 0.860 -8.847 3.870 1.00 0.00 C ATOM 1658 CD2 LEU A 112 3.293 -9.177 3.360 1.00 0.00 C ATOM 0 H LEU A 112 3.957 -6.595 3.260 1.00 0.00 H new ATOM 0 HA LEU A 112 2.506 -5.662 1.085 1.00 0.00 H new ATOM 0 HB2 LEU A 112 0.925 -7.567 1.790 1.00 0.00 H new ATOM 0 HB3 LEU A 112 2.577 -7.957 1.354 1.00 0.00 H new ATOM 0 HG LEU A 112 2.407 -7.420 4.191 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.014 -9.348 4.826 1.00 0.00 H new ATOM 0 HD12 LEU A 112 0.072 -8.101 3.974 1.00 0.00 H new ATOM 0 HD13 LEU A 112 0.568 -9.581 3.119 1.00 0.00 H new ATOM 0 HD21 LEU A 112 3.409 -9.672 4.324 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.069 -9.920 2.595 1.00 0.00 H new ATOM 0 HD23 LEU A 112 4.218 -8.660 3.104 1.00 0.00 H new ATOM 1670 N ASN A 113 1.280 -4.871 3.981 1.00 0.00 N ATOM 1671 CA ASN A 113 0.312 -4.080 4.703 1.00 0.00 C ATOM 1672 C ASN A 113 0.579 -2.595 4.488 1.00 0.00 C ATOM 1673 O ASN A 113 -0.341 -1.787 4.398 1.00 0.00 O ATOM 1674 CB ASN A 113 0.439 -4.408 6.183 1.00 0.00 C ATOM 1675 CG ASN A 113 -0.811 -4.070 6.972 1.00 0.00 C ATOM 1676 OD1 ASN A 113 -1.930 -4.242 6.490 1.00 0.00 O ATOM 1677 ND2 ASN A 113 -0.624 -3.592 8.197 1.00 0.00 N ATOM 0 H ASN A 113 2.057 -5.196 4.557 1.00 0.00 H new ATOM 0 HA ASN A 113 -0.692 -4.308 4.345 1.00 0.00 H new ATOM 0 HB2 ASN A 113 0.659 -5.470 6.297 1.00 0.00 H new ATOM 0 HB3 ASN A 113 1.285 -3.861 6.600 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -1.427 -3.351 8.779 1.00 0.00 H new ATOM 0 HD22 ASN A 113 0.322 -3.466 8.556 1.00 0.00 H new ATOM 1684 N LYS A 114 1.863 -2.256 4.421 1.00 0.00 N ATOM 1685 CA LYS A 114 2.303 -0.879 4.234 1.00 0.00 C ATOM 1686 C LYS A 114 2.035 -0.050 5.481 1.00 0.00 C ATOM 1687 O LYS A 114 1.835 1.161 5.400 1.00 0.00 O ATOM 1688 CB LYS A 114 1.615 -0.232 3.033 1.00 0.00 C ATOM 1689 CG LYS A 114 1.885 -0.939 1.714 1.00 0.00 C ATOM 1690 CD LYS A 114 2.358 0.031 0.641 1.00 0.00 C ATOM 1691 CE LYS A 114 1.348 1.144 0.403 1.00 0.00 C ATOM 1692 NZ LYS A 114 0.770 1.086 -0.969 1.00 0.00 N ATOM 0 H LYS A 114 2.627 -2.928 4.495 1.00 0.00 H new ATOM 0 HA LYS A 114 3.376 -0.906 4.047 1.00 0.00 H new ATOM 0 HB2 LYS A 114 0.540 -0.212 3.210 1.00 0.00 H new ATOM 0 HB3 LYS A 114 1.944 0.804 2.953 1.00 0.00 H new ATOM 0 HG2 LYS A 114 2.639 -1.712 1.863 1.00 0.00 H new ATOM 0 HG3 LYS A 114 0.977 -1.440 1.377 1.00 0.00 H new ATOM 0 HD2 LYS A 114 3.313 0.464 0.938 1.00 0.00 H new ATOM 0 HD3 LYS A 114 2.529 -0.511 -0.289 1.00 0.00 H new ATOM 0 HE2 LYS A 114 0.546 1.070 1.138 1.00 0.00 H new ATOM 0 HE3 LYS A 114 1.830 2.110 0.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 0.802 2.032 -1.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 1.321 0.422 -1.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -0.217 0.763 -0.916 1.00 0.00 H new ATOM 1706 N ASP A 115 2.040 -0.704 6.638 1.00 0.00 N ATOM 1707 CA ASP A 115 1.806 -0.007 7.893 1.00 0.00 C ATOM 1708 C ASP A 115 2.989 0.899 8.225 1.00 0.00 C ATOM 1709 O ASP A 115 2.881 1.799 9.058 1.00 0.00 O ATOM 1710 CB ASP A 115 1.567 -1.012 9.025 1.00 0.00 C ATOM 1711 CG ASP A 115 1.386 -0.339 10.372 1.00 0.00 C ATOM 1712 OD1 ASP A 115 0.931 0.824 10.398 1.00 0.00 O ATOM 1713 OD2 ASP A 115 1.699 -0.976 11.401 1.00 0.00 O ATOM 0 H ASP A 115 2.202 -1.707 6.731 1.00 0.00 H new ATOM 0 HA ASP A 115 0.915 0.612 7.786 1.00 0.00 H new ATOM 0 HB2 ASP A 115 0.682 -1.606 8.798 1.00 0.00 H new ATOM 0 HB3 ASP A 115 2.409 -1.702 9.078 1.00 0.00 H new ATOM 1718 N GLY A 116 4.123 0.651 7.570 1.00 0.00 N ATOM 1719 CA GLY A 116 5.312 1.447 7.813 1.00 0.00 C ATOM 1720 C GLY A 116 6.242 0.764 8.786 1.00 0.00 C ATOM 1721 O GLY A 116 6.953 1.415 9.551 1.00 0.00 O ATOM 0 H GLY A 116 4.237 -0.088 6.876 1.00 0.00 H new ATOM 0 HA2 GLY A 116 5.833 1.623 6.872 1.00 0.00 H new ATOM 0 HA3 GLY A 116 5.025 2.423 8.205 1.00 0.00 H new ATOM 1725 N SER A 117 6.216 -0.562 8.765 1.00 0.00 N ATOM 1726 CA SER A 117 7.039 -1.366 9.660 1.00 0.00 C ATOM 1727 C SER A 117 6.860 -2.836 9.371 1.00 0.00 C ATOM 1728 O SER A 117 5.739 -3.345 9.373 1.00 0.00 O ATOM 1729 CB SER A 117 6.656 -1.099 11.120 1.00 0.00 C ATOM 1730 OG SER A 117 5.651 -0.105 11.221 1.00 0.00 O ATOM 0 H SER A 117 5.629 -1.107 8.133 1.00 0.00 H new ATOM 0 HA SER A 117 8.080 -1.089 9.496 1.00 0.00 H new ATOM 0 HB2 SER A 117 6.303 -2.022 11.579 1.00 0.00 H new ATOM 0 HB3 SER A 117 7.538 -0.783 11.677 1.00 0.00 H new ATOM 0 HG SER A 117 5.429 0.041 12.164 1.00 0.00 H new ATOM 1736 N ILE A 118 7.965 -3.526 9.161 1.00 0.00 N ATOM 1737 CA ILE A 118 7.901 -4.943 8.920 1.00 0.00 C ATOM 1738 C ILE A 118 7.411 -5.618 10.181 1.00 0.00 C ATOM 1739 O ILE A 118 8.118 -5.720 11.180 1.00 0.00 O ATOM 1740 CB ILE A 118 9.258 -5.508 8.469 1.00 0.00 C ATOM 1741 CG1 ILE A 118 9.533 -5.098 7.019 1.00 0.00 C ATOM 1742 CG2 ILE A 118 9.300 -7.022 8.619 1.00 0.00 C ATOM 1743 CD1 ILE A 118 8.379 -5.367 6.077 1.00 0.00 C ATOM 0 H ILE A 118 8.904 -3.128 9.153 1.00 0.00 H new ATOM 0 HA ILE A 118 7.206 -5.140 8.104 1.00 0.00 H new ATOM 0 HB ILE A 118 10.037 -5.093 9.109 1.00 0.00 H new ATOM 0 HG12 ILE A 118 9.772 -4.035 6.991 1.00 0.00 H new ATOM 0 HG13 ILE A 118 10.413 -5.632 6.661 1.00 0.00 H new ATOM 0 HG21 ILE A 118 10.271 -7.393 8.292 1.00 0.00 H new ATOM 0 HG22 ILE A 118 9.142 -7.289 9.664 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.516 -7.470 8.008 1.00 0.00 H new ATOM 0 HD11 ILE A 118 8.650 -5.050 5.070 1.00 0.00 H new ATOM 0 HD12 ILE A 118 8.153 -6.433 6.073 1.00 0.00 H new ATOM 0 HD13 ILE A 118 7.502 -4.811 6.408 1.00 0.00 H new ATOM 1755 N ASP A 119 6.170 -6.028 10.127 1.00 0.00 N ATOM 1756 CA ASP A 119 5.530 -6.651 11.276 1.00 0.00 C ATOM 1757 C ASP A 119 4.752 -7.904 10.890 1.00 0.00 C ATOM 1758 O ASP A 119 5.031 -8.539 9.877 1.00 0.00 O ATOM 1759 CB ASP A 119 4.608 -5.640 11.962 1.00 0.00 C ATOM 1760 CG ASP A 119 4.800 -5.610 13.467 1.00 0.00 C ATOM 1761 OD1 ASP A 119 4.480 -6.621 14.126 1.00 0.00 O ATOM 1762 OD2 ASP A 119 5.271 -4.575 13.984 1.00 0.00 O ATOM 0 H ASP A 119 5.575 -5.945 9.303 1.00 0.00 H new ATOM 0 HA ASP A 119 6.313 -6.961 11.968 1.00 0.00 H new ATOM 0 HB2 ASP A 119 4.796 -4.647 11.555 1.00 0.00 H new ATOM 0 HB3 ASP A 119 3.571 -5.887 11.736 1.00 0.00 H new ATOM 1767 N GLU A 120 3.779 -8.255 11.722 1.00 0.00 N ATOM 1768 CA GLU A 120 2.957 -9.438 11.491 1.00 0.00 C ATOM 1769 C GLU A 120 1.992 -9.232 10.328 1.00 0.00 C ATOM 1770 O GLU A 120 1.615 -10.187 9.649 1.00 0.00 O ATOM 1771 CB GLU A 120 2.174 -9.793 12.757 1.00 0.00 C ATOM 1772 CG GLU A 120 3.052 -10.278 13.899 1.00 0.00 C ATOM 1773 CD GLU A 120 3.100 -11.791 13.993 1.00 0.00 C ATOM 1774 OE1 GLU A 120 2.067 -12.398 14.347 1.00 0.00 O ATOM 1775 OE2 GLU A 120 4.172 -12.369 13.713 1.00 0.00 O ATOM 0 H GLU A 120 3.539 -7.735 12.566 1.00 0.00 H new ATOM 0 HA GLU A 120 3.626 -10.260 11.234 1.00 0.00 H new ATOM 0 HB2 GLU A 120 1.615 -8.917 13.086 1.00 0.00 H new ATOM 0 HB3 GLU A 120 1.444 -10.566 12.518 1.00 0.00 H new ATOM 0 HG2 GLU A 120 4.063 -9.893 13.764 1.00 0.00 H new ATOM 0 HG3 GLU A 120 2.678 -9.871 14.838 1.00 0.00 H new ATOM 1782 N TYR A 121 1.591 -7.985 10.102 1.00 0.00 N ATOM 1783 CA TYR A 121 0.666 -7.671 9.023 1.00 0.00 C ATOM 1784 C TYR A 121 1.236 -8.078 7.676 1.00 0.00 C ATOM 1785 O TYR A 121 0.487 -8.299 6.724 1.00 0.00 O ATOM 1786 CB TYR A 121 0.301 -6.179 8.999 1.00 0.00 C ATOM 1787 CG TYR A 121 0.797 -5.376 10.180 1.00 0.00 C ATOM 1788 CD1 TYR A 121 0.135 -5.410 11.400 1.00 0.00 C ATOM 1789 CD2 TYR A 121 1.926 -4.578 10.066 1.00 0.00 C ATOM 1790 CE1 TYR A 121 0.587 -4.671 12.476 1.00 0.00 C ATOM 1791 CE2 TYR A 121 2.384 -3.834 11.137 1.00 0.00 C ATOM 1792 CZ TYR A 121 1.712 -3.884 12.340 1.00 0.00 C ATOM 1793 OH TYR A 121 2.163 -3.145 13.409 1.00 0.00 O ATOM 0 H TYR A 121 1.892 -7.179 10.650 1.00 0.00 H new ATOM 0 HA TYR A 121 -0.242 -8.243 9.213 1.00 0.00 H new ATOM 0 HB2 TYR A 121 0.702 -5.738 8.086 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -0.784 -6.088 8.948 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -0.747 -6.024 11.509 1.00 0.00 H new ATOM 0 HD2 TYR A 121 2.455 -4.537 9.126 1.00 0.00 H new ATOM 0 HE1 TYR A 121 0.062 -4.709 13.419 1.00 0.00 H new ATOM 0 HE2 TYR A 121 3.264 -3.217 11.032 1.00 0.00 H new ATOM 0 HH TYR A 121 2.182 -2.196 13.166 1.00 0.00 H new ATOM 1803 N GLU A 122 2.559 -8.171 7.582 1.00 0.00 N ATOM 1804 CA GLU A 122 3.173 -8.547 6.319 1.00 0.00 C ATOM 1805 C GLU A 122 3.416 -10.053 6.229 1.00 0.00 C ATOM 1806 O GLU A 122 2.677 -10.774 5.560 1.00 0.00 O ATOM 1807 CB GLU A 122 4.491 -7.788 6.083 1.00 0.00 C ATOM 1808 CG GLU A 122 4.857 -6.793 7.171 1.00 0.00 C ATOM 1809 CD GLU A 122 3.894 -5.626 7.243 1.00 0.00 C ATOM 1810 OE1 GLU A 122 2.773 -5.747 6.707 1.00 0.00 O ATOM 1811 OE2 GLU A 122 4.261 -4.589 7.833 1.00 0.00 O ATOM 0 H GLU A 122 3.211 -7.995 8.347 1.00 0.00 H new ATOM 0 HA GLU A 122 2.467 -8.269 5.537 1.00 0.00 H new ATOM 0 HB2 GLU A 122 5.299 -8.513 5.987 1.00 0.00 H new ATOM 0 HB3 GLU A 122 4.423 -7.258 5.133 1.00 0.00 H new ATOM 0 HG2 GLU A 122 4.875 -7.304 8.134 1.00 0.00 H new ATOM 0 HG3 GLU A 122 5.864 -6.417 6.990 1.00 0.00 H new ATOM 1818 N ILE A 123 4.466 -10.506 6.900 1.00 0.00 N ATOM 1819 CA ILE A 123 4.849 -11.926 6.911 1.00 0.00 C ATOM 1820 C ILE A 123 3.627 -12.844 6.871 1.00 0.00 C ATOM 1821 O ILE A 123 3.648 -13.896 6.233 1.00 0.00 O ATOM 1822 CB ILE A 123 5.709 -12.320 8.146 1.00 0.00 C ATOM 1823 CG1 ILE A 123 5.797 -11.178 9.175 1.00 0.00 C ATOM 1824 CG2 ILE A 123 7.099 -12.764 7.701 1.00 0.00 C ATOM 1825 CD1 ILE A 123 6.930 -10.198 8.933 1.00 0.00 C ATOM 0 H ILE A 123 5.080 -9.908 7.453 1.00 0.00 H new ATOM 0 HA ILE A 123 5.449 -12.058 6.011 1.00 0.00 H new ATOM 0 HB ILE A 123 5.216 -13.156 8.642 1.00 0.00 H new ATOM 0 HG12 ILE A 123 4.854 -10.631 9.173 1.00 0.00 H new ATOM 0 HG13 ILE A 123 5.913 -11.610 10.169 1.00 0.00 H new ATOM 0 HG21 ILE A 123 7.691 -13.037 8.575 1.00 0.00 H new ATOM 0 HG22 ILE A 123 7.011 -13.625 7.039 1.00 0.00 H new ATOM 0 HG23 ILE A 123 7.590 -11.947 7.171 1.00 0.00 H new ATOM 0 HD11 ILE A 123 6.916 -9.428 9.704 1.00 0.00 H new ATOM 0 HD12 ILE A 123 7.882 -10.727 8.966 1.00 0.00 H new ATOM 0 HD13 ILE A 123 6.807 -9.734 7.955 1.00 0.00 H new ATOM 1837 N SER A 124 2.566 -12.438 7.560 1.00 0.00 N ATOM 1838 CA SER A 124 1.331 -13.219 7.620 1.00 0.00 C ATOM 1839 C SER A 124 0.923 -13.761 6.248 1.00 0.00 C ATOM 1840 O SER A 124 0.219 -14.766 6.158 1.00 0.00 O ATOM 1841 CB SER A 124 0.198 -12.367 8.195 1.00 0.00 C ATOM 1842 OG SER A 124 0.203 -12.401 9.611 1.00 0.00 O ATOM 0 H SER A 124 2.535 -11.566 8.089 1.00 0.00 H new ATOM 0 HA SER A 124 1.520 -14.073 8.271 1.00 0.00 H new ATOM 0 HB2 SER A 124 0.303 -11.338 7.852 1.00 0.00 H new ATOM 0 HB3 SER A 124 -0.760 -12.731 7.823 1.00 0.00 H new ATOM 0 HG SER A 124 -0.710 -12.540 9.938 1.00 0.00 H new ATOM 1848 N PHE A 125 1.356 -13.091 5.184 1.00 0.00 N ATOM 1849 CA PHE A 125 1.015 -13.517 3.830 1.00 0.00 C ATOM 1850 C PHE A 125 1.775 -14.778 3.424 1.00 0.00 C ATOM 1851 O PHE A 125 1.195 -15.859 3.331 1.00 0.00 O ATOM 1852 CB PHE A 125 1.302 -12.395 2.830 1.00 0.00 C ATOM 1853 CG PHE A 125 0.859 -12.710 1.427 1.00 0.00 C ATOM 1854 CD1 PHE A 125 -0.288 -13.454 1.194 1.00 0.00 C ATOM 1855 CD2 PHE A 125 1.592 -12.261 0.339 1.00 0.00 C ATOM 1856 CE1 PHE A 125 -0.695 -13.743 -0.095 1.00 0.00 C ATOM 1857 CE2 PHE A 125 1.189 -12.547 -0.952 1.00 0.00 C ATOM 1858 CZ PHE A 125 0.045 -13.288 -1.169 1.00 0.00 C ATOM 0 H PHE A 125 1.940 -12.256 5.232 1.00 0.00 H new ATOM 0 HA PHE A 125 -0.050 -13.748 3.821 1.00 0.00 H new ATOM 0 HB2 PHE A 125 0.803 -11.486 3.164 1.00 0.00 H new ATOM 0 HB3 PHE A 125 2.372 -12.188 2.826 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -0.870 -13.812 2.030 1.00 0.00 H new ATOM 0 HD2 PHE A 125 2.488 -11.681 0.502 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -1.590 -14.324 -0.262 1.00 0.00 H new ATOM 0 HE2 PHE A 125 1.769 -12.191 -1.790 1.00 0.00 H new ATOM 0 HZ PHE A 125 -0.271 -13.512 -2.177 1.00 0.00 H new ATOM 1868 N ILE A 126 3.072 -14.629 3.166 1.00 0.00 N ATOM 1869 CA ILE A 126 3.904 -15.755 2.748 1.00 0.00 C ATOM 1870 C ILE A 126 4.346 -16.607 3.933 1.00 0.00 C ATOM 1871 O ILE A 126 4.414 -17.832 3.830 1.00 0.00 O ATOM 1872 CB ILE A 126 5.147 -15.274 1.972 1.00 0.00 C ATOM 1873 CG1 ILE A 126 4.744 -14.279 0.880 1.00 0.00 C ATOM 1874 CG2 ILE A 126 5.880 -16.460 1.363 1.00 0.00 C ATOM 1875 CD1 ILE A 126 5.726 -13.142 0.704 1.00 0.00 C ATOM 0 H ILE A 126 3.569 -13.741 3.239 1.00 0.00 H new ATOM 0 HA ILE A 126 3.287 -16.369 2.092 1.00 0.00 H new ATOM 0 HB ILE A 126 5.817 -14.770 2.668 1.00 0.00 H new ATOM 0 HG12 ILE A 126 4.644 -14.811 -0.066 1.00 0.00 H new ATOM 0 HG13 ILE A 126 3.763 -13.867 1.119 1.00 0.00 H new ATOM 0 HG21 ILE A 126 6.755 -16.106 0.818 1.00 0.00 H new ATOM 0 HG22 ILE A 126 6.196 -17.139 2.155 1.00 0.00 H new ATOM 0 HG23 ILE A 126 5.215 -16.986 0.678 1.00 0.00 H new ATOM 0 HD11 ILE A 126 5.376 -12.478 -0.086 1.00 0.00 H new ATOM 0 HD12 ILE A 126 5.808 -12.585 1.637 1.00 0.00 H new ATOM 0 HD13 ILE A 126 6.703 -13.543 0.434 1.00 0.00 H new ATOM 1887 N ASN A 127 4.645 -15.963 5.057 1.00 0.00 N ATOM 1888 CA ASN A 127 5.078 -16.683 6.252 1.00 0.00 C ATOM 1889 C ASN A 127 4.109 -17.815 6.586 1.00 0.00 C ATOM 1890 O ASN A 127 4.518 -18.881 7.047 1.00 0.00 O ATOM 1891 CB ASN A 127 5.193 -15.729 7.441 1.00 0.00 C ATOM 1892 CG ASN A 127 6.196 -16.206 8.472 1.00 0.00 C ATOM 1893 OD1 ASN A 127 6.932 -17.167 8.242 1.00 0.00 O ATOM 1894 ND2 ASN A 127 6.231 -15.536 9.618 1.00 0.00 N ATOM 0 H ASN A 127 4.596 -14.950 5.166 1.00 0.00 H new ATOM 0 HA ASN A 127 6.058 -17.113 6.048 1.00 0.00 H new ATOM 0 HB2 ASN A 127 5.486 -14.742 7.084 1.00 0.00 H new ATOM 0 HB3 ASN A 127 4.216 -15.621 7.912 1.00 0.00 H new ATOM 0 HD21 ASN A 127 6.886 -15.811 10.350 1.00 0.00 H new ATOM 0 HD22 ASN A 127 5.603 -14.746 9.766 1.00 0.00 H new ATOM 1901 N HIS A 128 2.824 -17.576 6.346 1.00 0.00 N ATOM 1902 CA HIS A 128 1.798 -18.576 6.616 1.00 0.00 C ATOM 1903 C HIS A 128 1.513 -19.411 5.372 1.00 0.00 C ATOM 1904 O HIS A 128 1.536 -20.640 5.422 1.00 0.00 O ATOM 1905 CB HIS A 128 0.512 -17.903 7.101 1.00 0.00 C ATOM 1906 CG HIS A 128 0.434 -17.766 8.590 1.00 0.00 C ATOM 1907 ND1 HIS A 128 0.413 -16.546 9.233 1.00 0.00 N ATOM 1908 CD2 HIS A 128 0.372 -18.704 9.565 1.00 0.00 C ATOM 1909 CE1 HIS A 128 0.341 -16.740 10.538 1.00 0.00 C ATOM 1910 NE2 HIS A 128 0.315 -18.040 10.765 1.00 0.00 N ATOM 0 H HIS A 128 2.469 -16.699 5.965 1.00 0.00 H new ATOM 0 HA HIS A 128 2.168 -19.238 7.399 1.00 0.00 H new ATOM 0 HB2 HIS A 128 0.436 -16.914 6.649 1.00 0.00 H new ATOM 0 HB3 HIS A 128 -0.344 -18.480 6.752 1.00 0.00 H new ATOM 0 HD2 HIS A 128 0.368 -19.775 9.425 1.00 0.00 H new ATOM 0 HE1 HIS A 128 0.309 -15.966 11.291 1.00 0.00 H new ATOM 0 HE2 HIS A 128 0.261 -18.480 11.684 1.00 0.00 H new ATOM 1919 N ARG A 129 1.248 -18.736 4.255 1.00 0.00 N ATOM 1920 CA ARG A 129 0.963 -19.418 2.995 1.00 0.00 C ATOM 1921 C ARG A 129 1.989 -20.514 2.729 1.00 0.00 C ATOM 1922 O ARG A 129 1.683 -21.531 2.106 1.00 0.00 O ATOM 1923 CB ARG A 129 0.958 -18.418 1.836 1.00 0.00 C ATOM 1924 CG ARG A 129 -0.402 -17.790 1.580 1.00 0.00 C ATOM 1925 CD ARG A 129 -1.155 -18.523 0.481 1.00 0.00 C ATOM 1926 NE ARG A 129 -1.863 -17.602 -0.405 1.00 0.00 N ATOM 1927 CZ ARG A 129 -2.287 -17.926 -1.624 1.00 0.00 C ATOM 1928 NH1 ARG A 129 -2.081 -19.146 -2.105 1.00 0.00 N ATOM 1929 NH2 ARG A 129 -2.922 -17.028 -2.365 1.00 0.00 N ATOM 0 H ARG A 129 1.225 -17.718 4.197 1.00 0.00 H new ATOM 0 HA ARG A 129 -0.023 -19.876 3.074 1.00 0.00 H new ATOM 0 HB2 ARG A 129 1.680 -17.629 2.045 1.00 0.00 H new ATOM 0 HB3 ARG A 129 1.292 -18.923 0.930 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -0.990 -17.805 2.498 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -0.274 -16.744 1.300 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -0.454 -19.121 -0.102 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -1.868 -19.215 0.929 1.00 0.00 H new ATOM 0 HE ARG A 129 -2.043 -16.656 -0.070 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -1.595 -19.842 -1.539 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -2.409 -19.388 -3.040 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -3.085 -16.089 -2.000 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -3.247 -17.276 -3.299 1.00 0.00 H new ATOM 1943 N ILE A 130 3.205 -20.301 3.219 1.00 0.00 N ATOM 1944 CA ILE A 130 4.281 -21.267 3.052 1.00 0.00 C ATOM 1945 C ILE A 130 3.894 -22.615 3.659 1.00 0.00 C ATOM 1946 O ILE A 130 4.134 -23.667 3.068 1.00 0.00 O ATOM 1947 CB ILE A 130 5.586 -20.754 3.706 1.00 0.00 C ATOM 1948 CG1 ILE A 130 6.283 -19.754 2.786 1.00 0.00 C ATOM 1949 CG2 ILE A 130 6.528 -21.903 4.045 1.00 0.00 C ATOM 1950 CD1 ILE A 130 7.063 -18.694 3.535 1.00 0.00 C ATOM 0 H ILE A 130 3.470 -19.463 3.737 1.00 0.00 H new ATOM 0 HA ILE A 130 4.451 -21.396 1.983 1.00 0.00 H new ATOM 0 HB ILE A 130 5.318 -20.254 4.637 1.00 0.00 H new ATOM 0 HG12 ILE A 130 6.960 -20.292 2.122 1.00 0.00 H new ATOM 0 HG13 ILE A 130 5.537 -19.269 2.156 1.00 0.00 H new ATOM 0 HG21 ILE A 130 7.435 -21.507 4.503 1.00 0.00 H new ATOM 0 HG22 ILE A 130 6.037 -22.583 4.741 1.00 0.00 H new ATOM 0 HG23 ILE A 130 6.787 -22.442 3.134 1.00 0.00 H new ATOM 0 HD11 ILE A 130 7.533 -18.016 2.822 1.00 0.00 H new ATOM 0 HD12 ILE A 130 6.387 -18.131 4.179 1.00 0.00 H new ATOM 0 HD13 ILE A 130 7.831 -19.170 4.144 1.00 0.00 H new