USER MOD reduce.3.24.130724 H: found=0, std=0, add=1101, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1096 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 70 TYR OH : rot -122:sc= -0.268 USER MOD Set 1.2: A 115 HIS : no HE2:sc= -1.24 K(o=-1.5,f=-2.8!) USER MOD Set 2.1: A 28 SER OG : rot 170:sc= -1.61! USER MOD Set 2.2: A 83 GLN : amide:sc= -1.37 K(o=-3,f=-5.8!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= -0.218 X(o=-0.22,f=-0.085) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 CYS SG : rot -46:sc= -1.19 USER MOD Single : A 9 ASN : amide:sc= -0.19 K(o=-0.19,f=-1) USER MOD Single : A 14 ASN : amide:sc= 0.777 K(o=0.78,f=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 MET CE :methyl -109:sc= -0.927 (180deg=-3.55!) USER MOD Single : A 20 SER OG : rot 57:sc= -2.52! USER MOD Single : A 22 THR OG1 : rot 10:sc= 1.15 USER MOD Single : A 25 GLN : amide:sc= -1.93 K(o=-1.9,f=-7.2!) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 79:sc= 0.805 USER MOD Single : A 40 THR OG1 : rot -103:sc= -0.211 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot -108:sc= -0.136 USER MOD Single : A 47 HIS : no HE2:sc= -2.85! C(o=-2.8!,f=-5.3!) USER MOD Single : A 49 LYS NZ :NH3+ -120:sc= 0.00339 (180deg=-0.316) USER MOD Single : A 51 SER OG : rot 150:sc= -0.357 USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 22:sc= -0.431 USER MOD Single : A 60 ASN : amide:sc= -0.0153 K(o=-0.015,f=-0.62) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 HIS : no HD1:sc= -0.0916 X(o=-0.092,f=-0.18) USER MOD Single : A 73 ASN : amide:sc= -2.73! C(o=-2.7!,f=-6.5!) USER MOD Single : A 74 THR OG1 : rot -175:sc= -0.732 USER MOD Single : A 76 THR OG1 : rot 180:sc= -2.22! USER MOD Single : A 78 CYS SG : rot 170:sc= -3.83! USER MOD Single : A 86 LYS NZ :NH3+ -131:sc=-0.00562 (180deg=-0.776) USER MOD Single : A 88 THR OG1 : rot 63:sc= 0.191 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= -0.284 X(o=-0.28,f=0.2) USER MOD Single : A 108 SER OG : rot -104:sc= 0.0212 USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= -0.0956 USER MOD Single : A 112 ASN : amide:sc= -3.4 K(o=-3.4,f=-5.1!) USER MOD Single : A 114 CYS SG : rot 130:sc= -0.513 USER MOD Single : A 124 GLN : amide:sc= -1.13 K(o=-1.1,f=-4.3) USER MOD Single : A 131 ASN : amide:sc=-0.00149 K(o=-0.0015,f=-0.61) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 137 MET CE :methyl -137:sc= -0.0916 (180deg=-2.17!) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 142 GLN : amide:sc= 0 X(o=0,f=-0.063) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.809 -14.155 -16.664 1.00 0.00 N ATOM 2 CA GLY A 1 4.391 -13.432 -17.819 1.00 0.00 C ATOM 3 C GLY A 1 3.403 -12.475 -18.511 1.00 0.00 C ATOM 4 O GLY A 1 3.029 -12.680 -19.665 1.00 0.00 O ATOM 0 H1 GLY A 1 4.528 -14.780 -16.247 1.00 0.00 H new ATOM 0 H2 GLY A 1 3.491 -13.469 -15.950 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.999 -14.724 -16.983 1.00 0.00 H new ATOM 0 HA2 GLY A 1 5.258 -12.864 -17.481 1.00 0.00 H new ATOM 0 HA3 GLY A 1 4.750 -14.159 -18.548 1.00 0.00 H new ATOM 9 N SER A 2 2.923 -11.513 -17.722 1.00 0.00 N ATOM 10 CA SER A 2 1.928 -10.494 -18.124 1.00 0.00 C ATOM 11 C SER A 2 1.692 -9.507 -16.972 1.00 0.00 C ATOM 12 O SER A 2 2.210 -9.715 -15.874 1.00 0.00 O ATOM 13 CB SER A 2 0.592 -11.154 -18.486 1.00 0.00 C ATOM 14 OG SER A 2 0.086 -10.532 -19.666 1.00 0.00 O ATOM 0 H SER A 2 3.220 -11.410 -16.752 1.00 0.00 H new ATOM 0 HA SER A 2 2.318 -9.967 -18.994 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.729 -12.223 -18.650 1.00 0.00 H new ATOM 0 HB3 SER A 2 -0.118 -11.046 -17.666 1.00 0.00 H new ATOM 0 HG SER A 2 -0.768 -10.944 -19.912 1.00 0.00 H new ATOM 20 N HIS A 3 1.071 -8.375 -17.304 1.00 0.00 N ATOM 21 CA HIS A 3 0.739 -7.273 -16.369 1.00 0.00 C ATOM 22 C HIS A 3 -0.152 -6.205 -17.032 1.00 0.00 C ATOM 23 O HIS A 3 0.322 -5.291 -17.698 1.00 0.00 O ATOM 24 CB HIS A 3 1.983 -6.628 -15.730 1.00 0.00 C ATOM 25 CG HIS A 3 3.126 -6.350 -16.731 1.00 0.00 C ATOM 26 ND1 HIS A 3 4.080 -7.207 -17.039 1.00 0.00 N ATOM 27 CD2 HIS A 3 3.275 -5.268 -17.486 1.00 0.00 C ATOM 28 CE1 HIS A 3 4.822 -6.666 -18.010 1.00 0.00 C ATOM 29 NE2 HIS A 3 4.322 -5.469 -18.286 1.00 0.00 N ATOM 0 H HIS A 3 0.771 -8.183 -18.260 1.00 0.00 H new ATOM 0 HA HIS A 3 0.172 -7.734 -15.561 1.00 0.00 H new ATOM 0 HB2 HIS A 3 1.692 -5.691 -15.256 1.00 0.00 H new ATOM 0 HB3 HIS A 3 2.355 -7.282 -14.941 1.00 0.00 H new ATOM 0 HD2 HIS A 3 2.658 -4.382 -17.457 1.00 0.00 H new ATOM 0 HE1 HIS A 3 5.677 -7.123 -18.486 1.00 0.00 H new ATOM 0 HE2 HIS A 3 4.676 -4.818 -18.986 1.00 0.00 H new ATOM 37 N MET A 4 -1.459 -6.428 -16.925 1.00 0.00 N ATOM 38 CA MET A 4 -2.510 -5.557 -17.495 1.00 0.00 C ATOM 39 C MET A 4 -3.903 -6.066 -17.091 1.00 0.00 C ATOM 40 O MET A 4 -4.196 -7.254 -17.212 1.00 0.00 O ATOM 41 CB MET A 4 -2.404 -5.532 -19.027 1.00 0.00 C ATOM 42 CG MET A 4 -3.399 -4.578 -19.689 1.00 0.00 C ATOM 43 SD MET A 4 -3.288 -4.617 -21.514 1.00 0.00 S ATOM 44 CE MET A 4 -2.003 -3.411 -21.763 1.00 0.00 C ATOM 0 H MET A 4 -1.837 -7.236 -16.430 1.00 0.00 H new ATOM 0 HA MET A 4 -2.369 -4.549 -17.105 1.00 0.00 H new ATOM 0 HB2 MET A 4 -1.392 -5.243 -19.309 1.00 0.00 H new ATOM 0 HB3 MET A 4 -2.566 -6.539 -19.412 1.00 0.00 H new ATOM 0 HG2 MET A 4 -4.411 -4.842 -19.383 1.00 0.00 H new ATOM 0 HG3 MET A 4 -3.215 -3.563 -19.338 1.00 0.00 H new ATOM 0 HE1 MET A 4 -1.804 -3.306 -22.830 1.00 0.00 H new ATOM 0 HE2 MET A 4 -2.321 -2.451 -21.357 1.00 0.00 H new ATOM 0 HE3 MET A 4 -1.095 -3.736 -21.255 1.00 0.00 H new ATOM 54 N GLY A 5 -4.704 -5.135 -16.558 1.00 0.00 N ATOM 55 CA GLY A 5 -6.118 -5.414 -16.225 1.00 0.00 C ATOM 56 C GLY A 5 -6.758 -4.308 -15.380 1.00 0.00 C ATOM 57 O GLY A 5 -7.699 -3.639 -15.800 1.00 0.00 O ATOM 0 H GLY A 5 -4.404 -4.183 -16.346 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -6.687 -5.536 -17.147 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -6.180 -6.359 -15.685 1.00 0.00 H new ATOM 61 N ALA A 6 -6.204 -4.153 -14.183 1.00 0.00 N ATOM 62 CA ALA A 6 -6.614 -3.111 -13.222 1.00 0.00 C ATOM 63 C ALA A 6 -5.615 -1.950 -13.279 1.00 0.00 C ATOM 64 O ALA A 6 -4.496 -2.140 -13.742 1.00 0.00 O ATOM 65 CB ALA A 6 -6.655 -3.689 -11.808 1.00 0.00 C ATOM 0 H ALA A 6 -5.450 -4.748 -13.840 1.00 0.00 H new ATOM 0 HA ALA A 6 -7.609 -2.751 -13.483 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -6.959 -2.912 -11.106 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -7.370 -4.511 -11.771 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -5.666 -4.057 -11.536 1.00 0.00 H new ATOM 71 N ALA A 7 -6.046 -0.776 -12.827 1.00 0.00 N ATOM 72 CA ALA A 7 -5.271 0.481 -12.895 1.00 0.00 C ATOM 73 C ALA A 7 -6.059 1.608 -12.206 1.00 0.00 C ATOM 74 O ALA A 7 -7.123 2.013 -12.673 1.00 0.00 O ATOM 75 CB ALA A 7 -4.992 0.842 -14.364 1.00 0.00 C ATOM 0 H ALA A 7 -6.961 -0.658 -12.392 1.00 0.00 H new ATOM 0 HA ALA A 7 -4.318 0.351 -12.381 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -4.421 1.769 -14.409 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -4.421 0.041 -14.833 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -5.936 0.972 -14.892 1.00 0.00 H new ATOM 81 N CYS A 8 -5.701 1.848 -10.947 1.00 0.00 N ATOM 82 CA CYS A 8 -6.318 2.922 -10.140 1.00 0.00 C ATOM 83 C CYS A 8 -5.275 3.946 -9.664 1.00 0.00 C ATOM 84 O CYS A 8 -4.075 3.706 -9.748 1.00 0.00 O ATOM 85 CB CYS A 8 -7.060 2.309 -8.945 1.00 0.00 C ATOM 86 SG CYS A 8 -5.954 1.486 -7.743 1.00 0.00 S ATOM 0 H CYS A 8 -4.985 1.316 -10.453 1.00 0.00 H new ATOM 0 HA CYS A 8 -7.029 3.456 -10.770 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -7.620 3.093 -8.434 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -7.788 1.585 -9.312 1.00 0.00 H new ATOM 0 HG CYS A 8 -5.102 0.737 -8.379 1.00 0.00 H new ATOM 92 N ASN A 9 -5.748 4.983 -8.984 1.00 0.00 N ATOM 93 CA ASN A 9 -4.870 6.036 -8.446 1.00 0.00 C ATOM 94 C ASN A 9 -4.843 5.989 -6.920 1.00 0.00 C ATOM 95 O ASN A 9 -5.885 5.883 -6.266 1.00 0.00 O ATOM 96 CB ASN A 9 -5.372 7.405 -8.886 1.00 0.00 C ATOM 97 CG ASN A 9 -4.400 8.109 -9.829 1.00 0.00 C ATOM 98 OD1 ASN A 9 -3.198 7.877 -9.872 1.00 0.00 O ATOM 99 ND2 ASN A 9 -4.949 8.971 -10.648 1.00 0.00 N ATOM 0 H ASN A 9 -6.739 5.125 -8.787 1.00 0.00 H new ATOM 0 HA ASN A 9 -3.864 5.866 -8.829 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -6.336 7.293 -9.381 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -5.536 8.028 -8.007 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -4.374 9.460 -11.334 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -5.951 9.153 -10.600 1.00 0.00 H new ATOM 106 N VAL A 10 -3.623 6.014 -6.400 1.00 0.00 N ATOM 107 CA VAL A 10 -3.366 5.948 -4.949 1.00 0.00 C ATOM 108 C VAL A 10 -2.263 6.952 -4.578 1.00 0.00 C ATOM 109 O VAL A 10 -1.402 7.296 -5.390 1.00 0.00 O ATOM 110 CB VAL A 10 -3.067 4.513 -4.426 1.00 0.00 C ATOM 111 CG1 VAL A 10 -3.961 3.430 -5.041 1.00 0.00 C ATOM 112 CG2 VAL A 10 -1.608 4.064 -4.499 1.00 0.00 C ATOM 0 H VAL A 10 -2.776 6.081 -6.965 1.00 0.00 H new ATOM 0 HA VAL A 10 -4.288 6.229 -4.440 1.00 0.00 H new ATOM 0 HB VAL A 10 -3.309 4.618 -3.368 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -3.692 2.458 -4.627 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -5.004 3.646 -4.812 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -3.823 3.415 -6.122 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -1.519 3.050 -4.108 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -1.273 4.084 -5.536 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -0.990 4.737 -3.905 1.00 0.00 H new ATOM 122 N LEU A 11 -2.244 7.300 -3.303 1.00 0.00 N ATOM 123 CA LEU A 11 -1.233 8.209 -2.762 1.00 0.00 C ATOM 124 C LEU A 11 -0.114 7.411 -2.083 1.00 0.00 C ATOM 125 O LEU A 11 -0.331 6.733 -1.081 1.00 0.00 O ATOM 126 CB LEU A 11 -1.939 9.218 -1.850 1.00 0.00 C ATOM 127 CG LEU A 11 -1.077 10.401 -1.400 1.00 0.00 C ATOM 128 CD1 LEU A 11 -0.329 11.032 -2.568 1.00 0.00 C ATOM 129 CD2 LEU A 11 -1.984 11.477 -0.811 1.00 0.00 C ATOM 0 H LEU A 11 -2.919 6.967 -2.615 1.00 0.00 H new ATOM 0 HA LEU A 11 -0.737 8.778 -3.548 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -2.815 9.604 -2.371 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -2.300 8.694 -0.965 1.00 0.00 H new ATOM 0 HG LEU A 11 -0.357 10.026 -0.672 1.00 0.00 H new ATOM 0 HD11 LEU A 11 0.271 11.867 -2.207 1.00 0.00 H new ATOM 0 HD12 LEU A 11 0.323 10.289 -3.027 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -1.045 11.392 -3.307 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -1.380 12.325 -0.487 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -2.696 11.807 -1.568 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -2.525 11.069 0.043 1.00 0.00 H new ATOM 141 N PHE A 12 0.968 7.298 -2.845 1.00 0.00 N ATOM 142 CA PHE A 12 2.208 6.621 -2.431 1.00 0.00 C ATOM 143 C PHE A 12 2.832 7.419 -1.292 1.00 0.00 C ATOM 144 O PHE A 12 3.061 8.625 -1.401 1.00 0.00 O ATOM 145 CB PHE A 12 3.200 6.608 -3.594 1.00 0.00 C ATOM 146 CG PHE A 12 4.580 6.030 -3.269 1.00 0.00 C ATOM 147 CD1 PHE A 12 5.544 6.816 -2.645 1.00 0.00 C ATOM 148 CD2 PHE A 12 4.859 4.706 -3.584 1.00 0.00 C ATOM 149 CE1 PHE A 12 6.780 6.279 -2.326 1.00 0.00 C ATOM 150 CE2 PHE A 12 6.099 4.170 -3.267 1.00 0.00 C ATOM 151 CZ PHE A 12 7.061 4.953 -2.639 1.00 0.00 C ATOM 0 H PHE A 12 1.016 7.680 -3.789 1.00 0.00 H new ATOM 0 HA PHE A 12 1.982 5.600 -2.122 1.00 0.00 H new ATOM 0 HB2 PHE A 12 2.767 6.034 -4.413 1.00 0.00 H new ATOM 0 HB3 PHE A 12 3.327 7.629 -3.953 1.00 0.00 H new ATOM 0 HD1 PHE A 12 5.328 7.847 -2.409 1.00 0.00 H new ATOM 0 HD2 PHE A 12 4.114 4.096 -4.074 1.00 0.00 H new ATOM 0 HE1 PHE A 12 7.524 6.888 -1.835 1.00 0.00 H new ATOM 0 HE2 PHE A 12 6.318 3.140 -3.509 1.00 0.00 H new ATOM 0 HZ PHE A 12 8.025 4.532 -2.394 1.00 0.00 H new ATOM 161 N ILE A 13 3.240 6.651 -0.301 1.00 0.00 N ATOM 162 CA ILE A 13 3.904 7.252 0.856 1.00 0.00 C ATOM 163 C ILE A 13 5.384 6.851 0.857 1.00 0.00 C ATOM 164 O ILE A 13 6.228 7.637 0.430 1.00 0.00 O ATOM 165 CB ILE A 13 3.139 6.908 2.144 1.00 0.00 C ATOM 166 CG1 ILE A 13 1.628 7.221 2.111 1.00 0.00 C ATOM 167 CG2 ILE A 13 3.832 7.593 3.312 1.00 0.00 C ATOM 168 CD1 ILE A 13 1.229 8.581 1.525 1.00 0.00 C ATOM 0 H ILE A 13 3.132 5.637 -0.264 1.00 0.00 H new ATOM 0 HA ILE A 13 3.887 8.340 0.798 1.00 0.00 H new ATOM 0 HB ILE A 13 3.171 5.824 2.257 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.129 6.441 1.536 1.00 0.00 H new ATOM 0 HG13 ILE A 13 1.244 7.161 3.129 1.00 0.00 H new ATOM 0 HG21 ILE A 13 3.303 7.360 4.236 1.00 0.00 H new ATOM 0 HG22 ILE A 13 4.860 7.239 3.384 1.00 0.00 H new ATOM 0 HG23 ILE A 13 3.830 8.672 3.154 1.00 0.00 H new ATOM 0 HD11 ILE A 13 0.145 8.686 1.555 1.00 0.00 H new ATOM 0 HD12 ILE A 13 1.687 9.378 2.110 1.00 0.00 H new ATOM 0 HD13 ILE A 13 1.571 8.647 0.492 1.00 0.00 H new ATOM 180 N ASN A 14 5.657 5.665 1.396 1.00 0.00 N ATOM 181 CA ASN A 14 7.004 5.076 1.493 1.00 0.00 C ATOM 182 C ASN A 14 6.942 3.671 2.098 1.00 0.00 C ATOM 183 O ASN A 14 5.908 3.250 2.626 1.00 0.00 O ATOM 184 CB ASN A 14 7.924 5.951 2.354 1.00 0.00 C ATOM 185 CG ASN A 14 9.177 6.301 1.553 1.00 0.00 C ATOM 186 OD1 ASN A 14 10.238 5.719 1.718 1.00 0.00 O ATOM 187 ND2 ASN A 14 9.036 7.191 0.597 1.00 0.00 N ATOM 0 H ASN A 14 4.932 5.065 1.790 1.00 0.00 H new ATOM 0 HA ASN A 14 7.407 5.016 0.482 1.00 0.00 H new ATOM 0 HB2 ASN A 14 7.404 6.861 2.655 1.00 0.00 H new ATOM 0 HB3 ASN A 14 8.197 5.423 3.268 1.00 0.00 H new ATOM 0 HD21 ASN A 14 9.819 7.405 -0.021 1.00 0.00 H new ATOM 0 HD22 ASN A 14 8.143 7.668 0.472 1.00 0.00 H new ATOM 194 N SER A 15 8.041 2.952 1.905 1.00 0.00 N ATOM 195 CA SER A 15 8.204 1.604 2.468 1.00 0.00 C ATOM 196 C SER A 15 8.996 1.703 3.770 1.00 0.00 C ATOM 197 O SER A 15 9.974 2.439 3.905 1.00 0.00 O ATOM 198 CB SER A 15 8.934 0.666 1.507 1.00 0.00 C ATOM 199 OG SER A 15 10.307 1.022 1.335 1.00 0.00 O ATOM 0 H SER A 15 8.840 3.276 1.361 1.00 0.00 H new ATOM 0 HA SER A 15 7.211 1.191 2.647 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.871 -0.355 1.883 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.434 0.681 0.539 1.00 0.00 H new ATOM 0 HG SER A 15 10.733 0.394 0.714 1.00 0.00 H new ATOM 205 N VAL A 16 8.452 1.015 4.752 1.00 0.00 N ATOM 206 CA VAL A 16 9.012 1.001 6.111 1.00 0.00 C ATOM 207 C VAL A 16 9.191 -0.442 6.576 1.00 0.00 C ATOM 208 O VAL A 16 8.253 -1.241 6.570 1.00 0.00 O ATOM 209 CB VAL A 16 8.194 1.883 7.070 1.00 0.00 C ATOM 210 CG1 VAL A 16 8.303 3.354 6.654 1.00 0.00 C ATOM 211 CG2 VAL A 16 6.719 1.512 7.092 1.00 0.00 C ATOM 0 H VAL A 16 7.611 0.447 4.644 1.00 0.00 H new ATOM 0 HA VAL A 16 10.004 1.453 6.107 1.00 0.00 H new ATOM 0 HB VAL A 16 8.609 1.722 8.065 1.00 0.00 H new ATOM 0 HG11 VAL A 16 7.720 3.970 7.339 1.00 0.00 H new ATOM 0 HG12 VAL A 16 9.347 3.665 6.685 1.00 0.00 H new ATOM 0 HG13 VAL A 16 7.919 3.475 5.641 1.00 0.00 H new ATOM 0 HG21 VAL A 16 6.190 2.166 7.785 1.00 0.00 H new ATOM 0 HG22 VAL A 16 6.300 1.627 6.092 1.00 0.00 H new ATOM 0 HG23 VAL A 16 6.609 0.477 7.414 1.00 0.00 H new ATOM 221 N GLU A 17 10.468 -0.804 6.625 1.00 0.00 N ATOM 222 CA GLU A 17 10.906 -2.161 6.998 1.00 0.00 C ATOM 223 C GLU A 17 10.316 -2.556 8.351 1.00 0.00 C ATOM 224 O GLU A 17 10.657 -2.009 9.396 1.00 0.00 O ATOM 225 CB GLU A 17 12.432 -2.250 7.036 1.00 0.00 C ATOM 226 CG GLU A 17 12.968 -3.084 5.870 1.00 0.00 C ATOM 227 CD GLU A 17 13.719 -4.318 6.375 1.00 0.00 C ATOM 228 OE1 GLU A 17 14.765 -4.122 7.031 1.00 0.00 O ATOM 229 OE2 GLU A 17 13.219 -5.434 6.114 1.00 0.00 O ATOM 0 H GLU A 17 11.237 -0.170 6.408 1.00 0.00 H new ATOM 0 HA GLU A 17 10.544 -2.857 6.241 1.00 0.00 H new ATOM 0 HB2 GLU A 17 12.858 -1.248 6.996 1.00 0.00 H new ATOM 0 HB3 GLU A 17 12.749 -2.694 7.980 1.00 0.00 H new ATOM 0 HG2 GLU A 17 12.142 -3.394 5.230 1.00 0.00 H new ATOM 0 HG3 GLU A 17 13.633 -2.475 5.258 1.00 0.00 H new ATOM 236 N MET A 18 9.321 -3.423 8.248 1.00 0.00 N ATOM 237 CA MET A 18 8.574 -3.876 9.429 1.00 0.00 C ATOM 238 C MET A 18 8.835 -5.351 9.739 1.00 0.00 C ATOM 239 O MET A 18 8.018 -6.009 10.378 1.00 0.00 O ATOM 240 CB MET A 18 7.089 -3.607 9.188 1.00 0.00 C ATOM 241 CG MET A 18 6.512 -2.854 10.384 1.00 0.00 C ATOM 242 SD MET A 18 7.291 -1.212 10.606 1.00 0.00 S ATOM 243 CE MET A 18 8.198 -1.472 12.117 1.00 0.00 C ATOM 0 H MET A 18 9.007 -3.830 7.367 1.00 0.00 H new ATOM 0 HA MET A 18 8.912 -3.322 10.305 1.00 0.00 H new ATOM 0 HB2 MET A 18 6.957 -3.023 8.277 1.00 0.00 H new ATOM 0 HB3 MET A 18 6.556 -4.547 9.044 1.00 0.00 H new ATOM 0 HG2 MET A 18 5.438 -2.730 10.249 1.00 0.00 H new ATOM 0 HG3 MET A 18 6.653 -3.447 11.288 1.00 0.00 H new ATOM 0 HE1 MET A 18 7.725 -0.914 12.926 1.00 0.00 H new ATOM 0 HE2 MET A 18 8.200 -2.534 12.362 1.00 0.00 H new ATOM 0 HE3 MET A 18 9.224 -1.127 11.990 1.00 0.00 H new ATOM 253 N GLU A 19 9.964 -5.846 9.219 1.00 0.00 N ATOM 254 CA GLU A 19 10.389 -7.255 9.308 1.00 0.00 C ATOM 255 C GLU A 19 9.280 -8.216 8.850 1.00 0.00 C ATOM 256 O GLU A 19 8.218 -7.793 8.390 1.00 0.00 O ATOM 257 CB GLU A 19 10.876 -7.618 10.716 1.00 0.00 C ATOM 258 CG GLU A 19 12.273 -7.070 11.006 1.00 0.00 C ATOM 259 CD GLU A 19 13.003 -7.920 12.054 1.00 0.00 C ATOM 260 OE1 GLU A 19 12.351 -8.338 13.040 1.00 0.00 O ATOM 261 OE2 GLU A 19 14.210 -8.147 11.832 1.00 0.00 O ATOM 0 H GLU A 19 10.629 -5.264 8.709 1.00 0.00 H new ATOM 0 HA GLU A 19 11.232 -7.369 8.626 1.00 0.00 H new ATOM 0 HB2 GLU A 19 10.175 -7.227 11.453 1.00 0.00 H new ATOM 0 HB3 GLU A 19 10.883 -8.702 10.827 1.00 0.00 H new ATOM 0 HG2 GLU A 19 12.855 -7.048 10.085 1.00 0.00 H new ATOM 0 HG3 GLU A 19 12.196 -6.042 11.359 1.00 0.00 H new ATOM 268 N SER A 20 9.564 -9.512 8.867 1.00 0.00 N ATOM 269 CA SER A 20 8.523 -10.498 8.515 1.00 0.00 C ATOM 270 C SER A 20 7.603 -10.783 9.716 1.00 0.00 C ATOM 271 O SER A 20 7.359 -11.929 10.079 1.00 0.00 O ATOM 272 CB SER A 20 9.131 -11.785 7.946 1.00 0.00 C ATOM 273 OG SER A 20 9.827 -12.444 8.997 1.00 0.00 O ATOM 0 H SER A 20 10.472 -9.907 9.111 1.00 0.00 H new ATOM 0 HA SER A 20 7.909 -10.063 7.726 1.00 0.00 H new ATOM 0 HB2 SER A 20 8.350 -12.430 7.543 1.00 0.00 H new ATOM 0 HB3 SER A 20 9.810 -11.555 7.125 1.00 0.00 H new ATOM 0 HG SER A 20 9.210 -12.619 9.738 1.00 0.00 H new ATOM 279 N LEU A 21 7.048 -9.709 10.287 1.00 0.00 N ATOM 280 CA LEU A 21 6.131 -9.799 11.442 1.00 0.00 C ATOM 281 C LEU A 21 4.990 -10.804 11.177 1.00 0.00 C ATOM 282 O LEU A 21 5.156 -11.990 11.447 1.00 0.00 O ATOM 283 CB LEU A 21 5.646 -8.392 11.845 1.00 0.00 C ATOM 284 CG LEU A 21 6.359 -7.706 13.028 1.00 0.00 C ATOM 285 CD1 LEU A 21 6.086 -8.410 14.358 1.00 0.00 C ATOM 286 CD2 LEU A 21 7.874 -7.603 12.860 1.00 0.00 C ATOM 0 H LEU A 21 7.217 -8.755 9.968 1.00 0.00 H new ATOM 0 HA LEU A 21 6.669 -10.199 12.301 1.00 0.00 H new ATOM 0 HB2 LEU A 21 5.737 -7.742 10.975 1.00 0.00 H new ATOM 0 HB3 LEU A 21 4.585 -8.457 12.084 1.00 0.00 H new ATOM 0 HG LEU A 21 5.938 -6.701 13.037 1.00 0.00 H new ATOM 0 HD11 LEU A 21 6.610 -7.889 15.160 1.00 0.00 H new ATOM 0 HD12 LEU A 21 5.015 -8.403 14.560 1.00 0.00 H new ATOM 0 HD13 LEU A 21 6.438 -9.440 14.304 1.00 0.00 H new ATOM 0 HD21 LEU A 21 8.304 -7.109 13.732 1.00 0.00 H new ATOM 0 HD22 LEU A 21 8.298 -8.602 12.763 1.00 0.00 H new ATOM 0 HD23 LEU A 21 8.102 -7.024 11.965 1.00 0.00 H new ATOM 298 N THR A 22 3.935 -10.374 10.485 1.00 0.00 N ATOM 299 CA THR A 22 2.813 -11.244 10.043 1.00 0.00 C ATOM 300 C THR A 22 1.952 -10.507 9.005 1.00 0.00 C ATOM 301 O THR A 22 2.184 -10.621 7.806 1.00 0.00 O ATOM 302 CB THR A 22 2.026 -11.821 11.251 1.00 0.00 C ATOM 303 OG1 THR A 22 2.794 -12.872 11.830 1.00 0.00 O ATOM 304 CG2 THR A 22 0.640 -12.410 10.956 1.00 0.00 C ATOM 0 H THR A 22 3.822 -9.400 10.205 1.00 0.00 H new ATOM 0 HA THR A 22 3.210 -12.124 9.536 1.00 0.00 H new ATOM 0 HB THR A 22 1.862 -10.960 11.898 1.00 0.00 H new ATOM 0 HG1 THR A 22 3.692 -12.876 11.437 1.00 0.00 H new ATOM 0 HG21 THR A 22 0.197 -12.778 11.881 1.00 0.00 H new ATOM 0 HG22 THR A 22 -0.000 -11.638 10.529 1.00 0.00 H new ATOM 0 HG23 THR A 22 0.738 -13.233 10.248 1.00 0.00 H new ATOM 312 N GLY A 23 1.051 -9.661 9.520 1.00 0.00 N ATOM 313 CA GLY A 23 0.108 -8.892 8.688 1.00 0.00 C ATOM 314 C GLY A 23 -0.655 -7.866 9.538 1.00 0.00 C ATOM 315 O GLY A 23 -0.229 -6.707 9.531 1.00 0.00 O ATOM 0 H GLY A 23 0.953 -9.488 10.520 1.00 0.00 H new ATOM 0 HA2 GLY A 23 0.651 -8.381 7.893 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -0.597 -9.570 8.208 1.00 0.00 H new ATOM 319 N PRO A 24 -1.600 -8.305 10.396 1.00 0.00 N ATOM 320 CA PRO A 24 -2.358 -7.414 11.307 1.00 0.00 C ATOM 321 C PRO A 24 -1.533 -6.888 12.503 1.00 0.00 C ATOM 322 O PRO A 24 -1.920 -6.974 13.666 1.00 0.00 O ATOM 323 CB PRO A 24 -3.566 -8.261 11.726 1.00 0.00 C ATOM 324 CG PRO A 24 -3.006 -9.682 11.758 1.00 0.00 C ATOM 325 CD PRO A 24 -2.059 -9.703 10.560 1.00 0.00 C ATOM 0 HA PRO A 24 -2.652 -6.487 10.814 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -3.951 -7.958 12.700 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -4.388 -8.169 11.016 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -2.482 -9.889 12.691 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -3.794 -10.429 11.663 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -1.218 -10.374 10.736 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -2.568 -10.057 9.663 1.00 0.00 H new ATOM 333 N GLN A 25 -0.344 -6.393 12.176 1.00 0.00 N ATOM 334 CA GLN A 25 0.668 -5.860 13.120 1.00 0.00 C ATOM 335 C GLN A 25 1.755 -5.038 12.419 1.00 0.00 C ATOM 336 O GLN A 25 1.915 -3.860 12.716 1.00 0.00 O ATOM 337 CB GLN A 25 1.326 -6.983 13.934 1.00 0.00 C ATOM 338 CG GLN A 25 1.912 -8.094 13.052 1.00 0.00 C ATOM 339 CD GLN A 25 2.326 -9.312 13.861 1.00 0.00 C ATOM 340 OE1 GLN A 25 3.447 -9.780 13.797 1.00 0.00 O ATOM 341 NE2 GLN A 25 1.368 -9.943 14.492 1.00 0.00 N ATOM 0 H GLN A 25 -0.032 -6.344 11.206 1.00 0.00 H new ATOM 0 HA GLN A 25 0.124 -5.198 13.793 1.00 0.00 H new ATOM 0 HB2 GLN A 25 2.118 -6.561 14.552 1.00 0.00 H new ATOM 0 HB3 GLN A 25 0.589 -7.414 14.611 1.00 0.00 H new ATOM 0 HG2 GLN A 25 1.175 -8.389 12.305 1.00 0.00 H new ATOM 0 HG3 GLN A 25 2.776 -7.708 12.511 1.00 0.00 H new ATOM 0 HE21 GLN A 25 0.433 -9.537 14.537 1.00 0.00 H new ATOM 0 HE22 GLN A 25 1.556 -10.840 14.939 1.00 0.00 H new ATOM 350 N ALA A 26 2.289 -5.585 11.330 1.00 0.00 N ATOM 351 CA ALA A 26 3.317 -4.910 10.527 1.00 0.00 C ATOM 352 C ALA A 26 2.722 -3.755 9.711 1.00 0.00 C ATOM 353 O ALA A 26 3.365 -2.725 9.576 1.00 0.00 O ATOM 354 CB ALA A 26 4.028 -5.945 9.668 1.00 0.00 C ATOM 0 H ALA A 26 2.026 -6.505 10.976 1.00 0.00 H new ATOM 0 HA ALA A 26 4.056 -4.449 11.182 1.00 0.00 H new ATOM 0 HB1 ALA A 26 4.794 -5.455 9.067 1.00 0.00 H new ATOM 0 HB2 ALA A 26 4.494 -6.693 10.310 1.00 0.00 H new ATOM 0 HB3 ALA A 26 3.306 -6.430 9.011 1.00 0.00 H new ATOM 360 N ILE A 27 1.415 -3.832 9.456 1.00 0.00 N ATOM 361 CA ILE A 27 0.640 -2.720 8.875 1.00 0.00 C ATOM 362 C ILE A 27 0.480 -1.612 9.936 1.00 0.00 C ATOM 363 O ILE A 27 0.836 -0.485 9.643 1.00 0.00 O ATOM 364 CB ILE A 27 -0.699 -3.213 8.295 1.00 0.00 C ATOM 365 CG1 ILE A 27 -0.435 -4.304 7.248 1.00 0.00 C ATOM 366 CG2 ILE A 27 -1.468 -2.058 7.628 1.00 0.00 C ATOM 367 CD1 ILE A 27 -1.652 -5.196 6.986 1.00 0.00 C ATOM 0 H ILE A 27 0.858 -4.665 9.644 1.00 0.00 H new ATOM 0 HA ILE A 27 1.177 -2.293 8.028 1.00 0.00 H new ATOM 0 HB ILE A 27 -1.299 -3.611 9.113 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -0.129 -3.835 6.313 1.00 0.00 H new ATOM 0 HG13 ILE A 27 0.397 -4.924 7.581 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.410 -2.432 7.226 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -1.671 -1.282 8.366 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -0.868 -1.641 6.819 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -1.399 -5.946 6.237 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -1.945 -5.692 7.911 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -2.479 -4.586 6.624 1.00 0.00 H new ATOM 379 N SER A 28 0.315 -1.977 11.209 1.00 0.00 N ATOM 380 CA SER A 28 0.230 -0.985 12.303 1.00 0.00 C ATOM 381 C SER A 28 1.583 -0.385 12.671 1.00 0.00 C ATOM 382 O SER A 28 1.751 0.818 12.559 1.00 0.00 O ATOM 383 CB SER A 28 -0.414 -1.524 13.577 1.00 0.00 C ATOM 384 OG SER A 28 -1.783 -1.138 13.522 1.00 0.00 O ATOM 0 H SER A 28 0.237 -2.947 11.516 1.00 0.00 H new ATOM 0 HA SER A 28 -0.413 -0.209 11.889 1.00 0.00 H new ATOM 0 HB2 SER A 28 -0.317 -2.608 13.634 1.00 0.00 H new ATOM 0 HB3 SER A 28 0.071 -1.114 14.463 1.00 0.00 H new ATOM 0 HG SER A 28 -2.280 -1.593 14.234 1.00 0.00 H new ATOM 390 N LYS A 29 2.585 -1.233 12.864 1.00 0.00 N ATOM 391 CA LYS A 29 3.966 -0.790 13.125 1.00 0.00 C ATOM 392 C LYS A 29 4.582 0.013 11.967 1.00 0.00 C ATOM 393 O LYS A 29 5.523 0.762 12.184 1.00 0.00 O ATOM 394 CB LYS A 29 4.817 -1.998 13.512 1.00 0.00 C ATOM 395 CG LYS A 29 5.187 -1.935 14.995 1.00 0.00 C ATOM 396 CD LYS A 29 5.754 -3.280 15.455 1.00 0.00 C ATOM 397 CE LYS A 29 7.275 -3.283 15.637 1.00 0.00 C ATOM 398 NZ LYS A 29 7.662 -2.827 16.981 1.00 0.00 N ATOM 0 H LYS A 29 2.473 -2.247 12.846 1.00 0.00 H new ATOM 0 HA LYS A 29 3.941 -0.088 13.959 1.00 0.00 H new ATOM 0 HB2 LYS A 29 4.270 -2.918 13.306 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.722 -2.023 12.905 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.921 -1.147 15.161 1.00 0.00 H new ATOM 0 HG3 LYS A 29 4.307 -1.681 15.586 1.00 0.00 H new ATOM 0 HD2 LYS A 29 5.284 -3.557 16.399 1.00 0.00 H new ATOM 0 HD3 LYS A 29 5.483 -4.045 14.727 1.00 0.00 H new ATOM 0 HE2 LYS A 29 7.660 -4.289 15.469 1.00 0.00 H new ATOM 0 HE3 LYS A 29 7.733 -2.637 14.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 8.698 -2.842 17.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 7.316 -1.858 17.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 7.246 -3.458 17.695 1.00 0.00 H new ATOM 412 N ALA A 30 3.969 -0.089 10.786 1.00 0.00 N ATOM 413 CA ALA A 30 4.313 0.691 9.587 1.00 0.00 C ATOM 414 C ALA A 30 3.469 1.959 9.435 1.00 0.00 C ATOM 415 O ALA A 30 4.005 3.056 9.450 1.00 0.00 O ATOM 416 CB ALA A 30 4.077 -0.170 8.359 1.00 0.00 C ATOM 0 H ALA A 30 3.196 -0.735 10.629 1.00 0.00 H new ATOM 0 HA ALA A 30 5.356 0.989 9.690 1.00 0.00 H new ATOM 0 HB1 ALA A 30 4.329 0.397 7.463 1.00 0.00 H new ATOM 0 HB2 ALA A 30 4.704 -1.060 8.413 1.00 0.00 H new ATOM 0 HB3 ALA A 30 3.029 -0.466 8.318 1.00 0.00 H new ATOM 422 N VAL A 31 2.156 1.818 9.574 1.00 0.00 N ATOM 423 CA VAL A 31 1.191 2.932 9.493 1.00 0.00 C ATOM 424 C VAL A 31 1.404 3.907 10.668 1.00 0.00 C ATOM 425 O VAL A 31 1.366 5.120 10.488 1.00 0.00 O ATOM 426 CB VAL A 31 -0.245 2.373 9.458 1.00 0.00 C ATOM 427 CG1 VAL A 31 -1.270 3.489 9.636 1.00 0.00 C ATOM 428 CG2 VAL A 31 -0.560 1.651 8.144 1.00 0.00 C ATOM 0 H VAL A 31 1.715 0.915 9.749 1.00 0.00 H new ATOM 0 HA VAL A 31 1.353 3.494 8.573 1.00 0.00 H new ATOM 0 HB VAL A 31 -0.307 1.660 10.280 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -2.275 3.068 9.607 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -1.110 3.981 10.596 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -1.159 4.217 8.832 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -1.583 1.276 8.171 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -0.450 2.346 7.312 1.00 0.00 H new ATOM 0 HG23 VAL A 31 0.129 0.816 8.013 1.00 0.00 H new ATOM 438 N ALA A 32 1.685 3.358 11.842 1.00 0.00 N ATOM 439 CA ALA A 32 1.933 4.127 13.076 1.00 0.00 C ATOM 440 C ALA A 32 3.332 4.756 13.086 1.00 0.00 C ATOM 441 O ALA A 32 3.526 5.798 13.706 1.00 0.00 O ATOM 442 CB ALA A 32 1.727 3.267 14.324 1.00 0.00 C ATOM 0 H ALA A 32 1.750 2.349 11.977 1.00 0.00 H new ATOM 0 HA ALA A 32 1.202 4.935 13.093 1.00 0.00 H new ATOM 0 HB1 ALA A 32 1.918 3.866 15.214 1.00 0.00 H new ATOM 0 HB2 ALA A 32 0.701 2.900 14.347 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.415 2.422 14.301 1.00 0.00 H new ATOM 448 N GLU A 33 4.252 4.176 12.315 1.00 0.00 N ATOM 449 CA GLU A 33 5.592 4.765 12.135 1.00 0.00 C ATOM 450 C GLU A 33 5.659 5.714 10.925 1.00 0.00 C ATOM 451 O GLU A 33 6.662 6.385 10.724 1.00 0.00 O ATOM 452 CB GLU A 33 6.666 3.665 12.103 1.00 0.00 C ATOM 453 CG GLU A 33 6.926 2.993 10.750 1.00 0.00 C ATOM 454 CD GLU A 33 8.212 3.531 10.130 1.00 0.00 C ATOM 455 OE1 GLU A 33 8.107 4.549 9.413 1.00 0.00 O ATOM 456 OE2 GLU A 33 9.260 2.889 10.356 1.00 0.00 O ATOM 0 H GLU A 33 4.102 3.305 11.806 1.00 0.00 H new ATOM 0 HA GLU A 33 5.802 5.394 13.000 1.00 0.00 H new ATOM 0 HB2 GLU A 33 7.604 4.095 12.455 1.00 0.00 H new ATOM 0 HB3 GLU A 33 6.382 2.892 12.817 1.00 0.00 H new ATOM 0 HG2 GLU A 33 7.001 1.914 10.881 1.00 0.00 H new ATOM 0 HG3 GLU A 33 6.087 3.175 10.079 1.00 0.00 H new ATOM 463 N THR A 34 4.608 5.713 10.109 1.00 0.00 N ATOM 464 CA THR A 34 4.532 6.522 8.880 1.00 0.00 C ATOM 465 C THR A 34 3.550 7.697 9.004 1.00 0.00 C ATOM 466 O THR A 34 3.772 8.749 8.411 1.00 0.00 O ATOM 467 CB THR A 34 4.237 5.599 7.691 1.00 0.00 C ATOM 468 OG1 THR A 34 5.292 4.643 7.582 1.00 0.00 O ATOM 469 CG2 THR A 34 4.193 6.354 6.375 1.00 0.00 C ATOM 0 H THR A 34 3.775 5.149 10.277 1.00 0.00 H new ATOM 0 HA THR A 34 5.497 6.999 8.707 1.00 0.00 H new ATOM 0 HB THR A 34 3.267 5.137 7.872 1.00 0.00 H new ATOM 0 HG1 THR A 34 5.163 3.936 8.248 1.00 0.00 H new ATOM 0 HG21 THR A 34 3.981 5.658 5.563 1.00 0.00 H new ATOM 0 HG22 THR A 34 3.411 7.112 6.416 1.00 0.00 H new ATOM 0 HG23 THR A 34 5.155 6.835 6.199 1.00 0.00 H new ATOM 477 N LEU A 35 2.576 7.569 9.903 1.00 0.00 N ATOM 478 CA LEU A 35 1.647 8.668 10.220 1.00 0.00 C ATOM 479 C LEU A 35 2.339 9.822 10.950 1.00 0.00 C ATOM 480 O LEU A 35 2.115 10.989 10.641 1.00 0.00 O ATOM 481 CB LEU A 35 0.466 8.205 11.083 1.00 0.00 C ATOM 482 CG LEU A 35 -0.897 8.281 10.382 1.00 0.00 C ATOM 483 CD1 LEU A 35 -1.101 9.573 9.589 1.00 0.00 C ATOM 484 CD2 LEU A 35 -1.113 7.068 9.495 1.00 0.00 C ATOM 0 H LEU A 35 2.404 6.713 10.431 1.00 0.00 H new ATOM 0 HA LEU A 35 1.280 9.013 9.253 1.00 0.00 H new ATOM 0 HB2 LEU A 35 0.643 7.177 11.398 1.00 0.00 H new ATOM 0 HB3 LEU A 35 0.431 8.813 11.987 1.00 0.00 H new ATOM 0 HG LEU A 35 -1.647 8.286 11.173 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -2.085 9.560 9.119 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -1.031 10.428 10.262 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -0.333 9.653 8.820 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -2.085 7.142 9.008 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -0.330 7.027 8.738 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -1.079 6.163 10.102 1.00 0.00 H new ATOM 496 N VAL A 36 3.249 9.430 11.836 1.00 0.00 N ATOM 497 CA VAL A 36 4.073 10.372 12.606 1.00 0.00 C ATOM 498 C VAL A 36 5.520 10.407 12.082 1.00 0.00 C ATOM 499 O VAL A 36 6.312 11.179 12.613 1.00 0.00 O ATOM 500 CB VAL A 36 3.976 10.026 14.109 1.00 0.00 C ATOM 501 CG1 VAL A 36 4.789 8.792 14.531 1.00 0.00 C ATOM 502 CG2 VAL A 36 4.285 11.245 14.984 1.00 0.00 C ATOM 0 H VAL A 36 3.441 8.450 12.045 1.00 0.00 H new ATOM 0 HA VAL A 36 3.692 11.385 12.476 1.00 0.00 H new ATOM 0 HB VAL A 36 2.937 9.742 14.275 1.00 0.00 H new ATOM 0 HG11 VAL A 36 4.664 8.622 15.600 1.00 0.00 H new ATOM 0 HG12 VAL A 36 4.437 7.919 13.981 1.00 0.00 H new ATOM 0 HG13 VAL A 36 5.844 8.958 14.311 1.00 0.00 H new ATOM 0 HG21 VAL A 36 4.208 10.967 16.035 1.00 0.00 H new ATOM 0 HG22 VAL A 36 5.295 11.596 14.775 1.00 0.00 H new ATOM 0 HG23 VAL A 36 3.572 12.040 14.766 1.00 0.00 H new ATOM 512 N ALA A 37 5.817 9.650 11.014 1.00 0.00 N ATOM 513 CA ALA A 37 7.166 9.540 10.413 1.00 0.00 C ATOM 514 C ALA A 37 7.774 10.937 10.285 1.00 0.00 C ATOM 515 O ALA A 37 7.125 11.843 9.771 1.00 0.00 O ATOM 516 CB ALA A 37 7.101 8.918 9.016 1.00 0.00 C ATOM 0 H ALA A 37 5.118 9.085 10.532 1.00 0.00 H new ATOM 0 HA ALA A 37 7.773 8.905 11.058 1.00 0.00 H new ATOM 0 HB1 ALA A 37 8.107 8.850 8.601 1.00 0.00 H new ATOM 0 HB2 ALA A 37 6.668 7.920 9.082 1.00 0.00 H new ATOM 0 HB3 ALA A 37 6.482 9.540 8.369 1.00 0.00 H new ATOM 522 N ASP A 38 8.726 11.163 11.179 1.00 0.00 N ATOM 523 CA ASP A 38 9.350 12.483 11.334 1.00 0.00 C ATOM 524 C ASP A 38 10.851 12.430 11.024 1.00 0.00 C ATOM 525 O ASP A 38 11.585 11.747 11.737 1.00 0.00 O ATOM 526 CB ASP A 38 8.997 13.163 12.669 1.00 0.00 C ATOM 527 CG ASP A 38 8.913 12.244 13.896 1.00 0.00 C ATOM 528 OD1 ASP A 38 9.928 11.576 14.187 1.00 0.00 O ATOM 529 OD2 ASP A 38 7.849 12.262 14.550 1.00 0.00 O ATOM 0 H ASP A 38 9.089 10.451 11.813 1.00 0.00 H new ATOM 0 HA ASP A 38 8.915 13.143 10.583 1.00 0.00 H new ATOM 0 HB2 ASP A 38 9.742 13.934 12.868 1.00 0.00 H new ATOM 0 HB3 ASP A 38 8.038 13.668 12.553 1.00 0.00 H new ATOM 534 N PRO A 39 11.228 13.044 9.893 1.00 0.00 N ATOM 535 CA PRO A 39 10.342 13.768 8.951 1.00 0.00 C ATOM 536 C PRO A 39 9.469 12.840 8.086 1.00 0.00 C ATOM 537 O PRO A 39 9.779 11.660 7.928 1.00 0.00 O ATOM 538 CB PRO A 39 11.294 14.627 8.120 1.00 0.00 C ATOM 539 CG PRO A 39 12.577 13.797 8.076 1.00 0.00 C ATOM 540 CD PRO A 39 12.634 13.124 9.450 1.00 0.00 C ATOM 0 HA PRO A 39 9.602 14.366 9.483 1.00 0.00 H new ATOM 0 HB2 PRO A 39 10.900 14.810 7.120 1.00 0.00 H new ATOM 0 HB3 PRO A 39 11.461 15.601 8.580 1.00 0.00 H new ATOM 0 HG2 PRO A 39 12.548 13.061 7.273 1.00 0.00 H new ATOM 0 HG3 PRO A 39 13.452 14.424 7.903 1.00 0.00 H new ATOM 0 HD2 PRO A 39 13.085 12.134 9.386 1.00 0.00 H new ATOM 0 HD3 PRO A 39 13.236 13.704 10.149 1.00 0.00 H new ATOM 548 N THR A 40 8.315 13.365 7.679 1.00 0.00 N ATOM 549 CA THR A 40 7.346 12.582 6.880 1.00 0.00 C ATOM 550 C THR A 40 7.692 12.613 5.380 1.00 0.00 C ATOM 551 O THR A 40 8.121 13.659 4.883 1.00 0.00 O ATOM 552 CB THR A 40 5.880 12.961 7.192 1.00 0.00 C ATOM 553 OG1 THR A 40 5.077 11.799 6.981 1.00 0.00 O ATOM 554 CG2 THR A 40 5.296 14.133 6.386 1.00 0.00 C ATOM 0 H THR A 40 8.020 14.320 7.882 1.00 0.00 H new ATOM 0 HA THR A 40 7.436 11.540 7.185 1.00 0.00 H new ATOM 0 HB THR A 40 5.873 13.311 8.224 1.00 0.00 H new ATOM 0 HG1 THR A 40 4.604 11.879 6.127 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.264 14.306 6.691 1.00 0.00 H new ATOM 0 HG22 THR A 40 5.885 15.031 6.572 1.00 0.00 H new ATOM 0 HG23 THR A 40 5.325 13.894 5.323 1.00 0.00 H new ATOM 562 N PRO A 41 7.586 11.470 4.692 1.00 0.00 N ATOM 563 CA PRO A 41 7.808 11.411 3.241 1.00 0.00 C ATOM 564 C PRO A 41 6.674 12.099 2.476 1.00 0.00 C ATOM 565 O PRO A 41 5.545 12.237 2.950 1.00 0.00 O ATOM 566 CB PRO A 41 7.938 9.922 2.915 1.00 0.00 C ATOM 567 CG PRO A 41 7.093 9.249 3.996 1.00 0.00 C ATOM 568 CD PRO A 41 7.307 10.124 5.231 1.00 0.00 C ATOM 0 HA PRO A 41 8.705 11.949 2.935 1.00 0.00 H new ATOM 0 HB2 PRO A 41 7.567 9.695 1.915 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.976 9.591 2.952 1.00 0.00 H new ATOM 0 HG2 PRO A 41 6.041 9.209 3.713 1.00 0.00 H new ATOM 0 HG3 PRO A 41 7.415 8.223 4.173 1.00 0.00 H new ATOM 0 HD2 PRO A 41 6.425 10.129 5.871 1.00 0.00 H new ATOM 0 HD3 PRO A 41 8.137 9.759 5.836 1.00 0.00 H new ATOM 576 N THR A 42 7.059 12.582 1.304 1.00 0.00 N ATOM 577 CA THR A 42 6.164 13.333 0.403 1.00 0.00 C ATOM 578 C THR A 42 5.208 12.345 -0.275 1.00 0.00 C ATOM 579 O THR A 42 5.604 11.299 -0.793 1.00 0.00 O ATOM 580 CB THR A 42 6.936 14.154 -0.651 1.00 0.00 C ATOM 581 OG1 THR A 42 7.547 13.301 -1.620 1.00 0.00 O ATOM 582 CG2 THR A 42 8.022 15.034 -0.022 1.00 0.00 C ATOM 0 H THR A 42 8.005 12.469 0.939 1.00 0.00 H new ATOM 0 HA THR A 42 5.604 14.053 0.999 1.00 0.00 H new ATOM 0 HB THR A 42 6.199 14.797 -1.132 1.00 0.00 H new ATOM 0 HG1 THR A 42 8.028 13.845 -2.278 1.00 0.00 H new ATOM 0 HG21 THR A 42 8.537 15.592 -0.804 1.00 0.00 H new ATOM 0 HG22 THR A 42 7.564 15.731 0.679 1.00 0.00 H new ATOM 0 HG23 THR A 42 8.739 14.405 0.507 1.00 0.00 H new ATOM 590 N ALA A 43 3.932 12.598 -0.042 1.00 0.00 N ATOM 591 CA ALA A 43 2.849 11.798 -0.625 1.00 0.00 C ATOM 592 C ALA A 43 2.705 12.102 -2.124 1.00 0.00 C ATOM 593 O ALA A 43 2.346 13.211 -2.519 1.00 0.00 O ATOM 594 CB ALA A 43 1.592 12.141 0.169 1.00 0.00 C ATOM 0 H ALA A 43 3.609 13.360 0.554 1.00 0.00 H new ATOM 0 HA ALA A 43 3.047 10.728 -0.561 1.00 0.00 H new ATOM 0 HB1 ALA A 43 0.748 11.572 -0.222 1.00 0.00 H new ATOM 0 HB2 ALA A 43 1.744 11.889 1.218 1.00 0.00 H new ATOM 0 HB3 ALA A 43 1.384 13.207 0.079 1.00 0.00 H new ATOM 600 N THR A 44 3.027 11.103 -2.938 1.00 0.00 N ATOM 601 CA THR A 44 2.927 11.226 -4.408 1.00 0.00 C ATOM 602 C THR A 44 1.827 10.355 -5.035 1.00 0.00 C ATOM 603 O THR A 44 1.623 9.201 -4.659 1.00 0.00 O ATOM 604 CB THR A 44 4.284 10.956 -5.060 1.00 0.00 C ATOM 605 OG1 THR A 44 4.158 11.227 -6.454 1.00 0.00 O ATOM 606 CG2 THR A 44 4.816 9.539 -4.814 1.00 0.00 C ATOM 0 H THR A 44 3.361 10.195 -2.616 1.00 0.00 H new ATOM 0 HA THR A 44 2.629 12.255 -4.607 1.00 0.00 H new ATOM 0 HB THR A 44 5.023 11.612 -4.600 1.00 0.00 H new ATOM 0 HG1 THR A 44 4.165 10.384 -6.953 1.00 0.00 H new ATOM 0 HG21 THR A 44 5.781 9.422 -5.307 1.00 0.00 H new ATOM 0 HG22 THR A 44 4.933 9.375 -3.743 1.00 0.00 H new ATOM 0 HG23 THR A 44 4.112 8.811 -5.218 1.00 0.00 H new ATOM 614 N ILE A 45 1.158 10.912 -6.037 1.00 0.00 N ATOM 615 CA ILE A 45 0.045 10.218 -6.720 1.00 0.00 C ATOM 616 C ILE A 45 0.639 9.232 -7.743 1.00 0.00 C ATOM 617 O ILE A 45 1.350 9.603 -8.684 1.00 0.00 O ATOM 618 CB ILE A 45 -0.947 11.188 -7.397 1.00 0.00 C ATOM 619 CG1 ILE A 45 -1.363 12.387 -6.522 1.00 0.00 C ATOM 620 CG2 ILE A 45 -2.168 10.437 -7.951 1.00 0.00 C ATOM 621 CD1 ILE A 45 -2.114 12.085 -5.224 1.00 0.00 C ATOM 0 H ILE A 45 1.358 11.843 -6.403 1.00 0.00 H new ATOM 0 HA ILE A 45 -0.536 9.682 -5.969 1.00 0.00 H new ATOM 0 HB ILE A 45 -0.401 11.627 -8.232 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -0.463 12.947 -6.268 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -1.987 13.045 -7.127 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -2.849 11.146 -8.422 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -1.841 9.704 -8.688 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -2.682 9.927 -7.136 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -2.343 13.019 -4.711 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -3.041 11.560 -5.454 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -1.493 11.461 -4.581 1.00 0.00 H new ATOM 633 N VAL A 46 0.410 7.969 -7.420 1.00 0.00 N ATOM 634 CA VAL A 46 0.838 6.816 -8.234 1.00 0.00 C ATOM 635 C VAL A 46 -0.369 5.996 -8.710 1.00 0.00 C ATOM 636 O VAL A 46 -1.428 5.983 -8.081 1.00 0.00 O ATOM 637 CB VAL A 46 1.833 5.904 -7.490 1.00 0.00 C ATOM 638 CG1 VAL A 46 3.143 6.630 -7.206 1.00 0.00 C ATOM 639 CG2 VAL A 46 1.268 5.348 -6.184 1.00 0.00 C ATOM 0 H VAL A 46 -0.087 7.699 -6.571 1.00 0.00 H new ATOM 0 HA VAL A 46 1.354 7.228 -9.101 1.00 0.00 H new ATOM 0 HB VAL A 46 2.020 5.063 -8.157 1.00 0.00 H new ATOM 0 HG11 VAL A 46 3.824 5.960 -6.680 1.00 0.00 H new ATOM 0 HG12 VAL A 46 3.596 6.944 -8.146 1.00 0.00 H new ATOM 0 HG13 VAL A 46 2.947 7.506 -6.588 1.00 0.00 H new ATOM 0 HG21 VAL A 46 2.014 4.714 -5.706 1.00 0.00 H new ATOM 0 HG22 VAL A 46 1.012 6.172 -5.518 1.00 0.00 H new ATOM 0 HG23 VAL A 46 0.374 4.761 -6.395 1.00 0.00 H new ATOM 649 N HIS A 47 -0.132 5.242 -9.771 1.00 0.00 N ATOM 650 CA HIS A 47 -1.161 4.351 -10.318 1.00 0.00 C ATOM 651 C HIS A 47 -0.871 2.889 -9.953 1.00 0.00 C ATOM 652 O HIS A 47 0.150 2.321 -10.341 1.00 0.00 O ATOM 653 CB HIS A 47 -1.226 4.566 -11.822 1.00 0.00 C ATOM 654 CG HIS A 47 -2.655 4.482 -12.346 1.00 0.00 C ATOM 655 ND1 HIS A 47 -3.519 5.478 -12.351 1.00 0.00 N ATOM 656 CD2 HIS A 47 -3.176 3.447 -12.977 1.00 0.00 C ATOM 657 CE1 HIS A 47 -4.611 5.061 -12.995 1.00 0.00 C ATOM 658 NE2 HIS A 47 -4.391 3.813 -13.381 1.00 0.00 N ATOM 0 H HIS A 47 0.756 5.224 -10.273 1.00 0.00 H new ATOM 0 HA HIS A 47 -2.133 4.585 -9.884 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -0.806 5.541 -12.068 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -0.611 3.818 -12.323 1.00 0.00 H new ATOM 0 HD1 HIS A 47 -3.378 6.400 -11.938 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -2.707 2.487 -13.135 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -5.509 5.635 -13.169 1.00 0.00 H new ATOM 666 N PHE A 48 -1.758 2.385 -9.105 1.00 0.00 N ATOM 667 CA PHE A 48 -1.717 1.022 -8.547 1.00 0.00 C ATOM 668 C PHE A 48 -2.433 0.060 -9.507 1.00 0.00 C ATOM 669 O PHE A 48 -3.661 0.043 -9.627 1.00 0.00 O ATOM 670 CB PHE A 48 -2.404 1.024 -7.179 1.00 0.00 C ATOM 671 CG PHE A 48 -1.953 -0.106 -6.250 1.00 0.00 C ATOM 672 CD1 PHE A 48 -2.422 -1.400 -6.420 1.00 0.00 C ATOM 673 CD2 PHE A 48 -1.077 0.172 -5.208 1.00 0.00 C ATOM 674 CE1 PHE A 48 -2.013 -2.407 -5.553 1.00 0.00 C ATOM 675 CE2 PHE A 48 -0.648 -0.833 -4.358 1.00 0.00 C ATOM 676 CZ PHE A 48 -1.122 -2.129 -4.523 1.00 0.00 C ATOM 0 H PHE A 48 -2.556 2.925 -8.770 1.00 0.00 H new ATOM 0 HA PHE A 48 -0.685 0.693 -8.427 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -2.213 1.979 -6.690 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -3.482 0.951 -7.326 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -3.105 -1.625 -7.226 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -0.727 1.183 -5.060 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -2.390 -3.411 -5.681 1.00 0.00 H new ATOM 0 HE2 PHE A 48 0.054 -0.610 -3.568 1.00 0.00 H new ATOM 0 HZ PHE A 48 -0.800 -2.915 -3.856 1.00 0.00 H new ATOM 686 N LYS A 49 -1.604 -0.640 -10.266 1.00 0.00 N ATOM 687 CA LYS A 49 -2.056 -1.658 -11.230 1.00 0.00 C ATOM 688 C LYS A 49 -1.959 -3.042 -10.580 1.00 0.00 C ATOM 689 O LYS A 49 -0.918 -3.426 -10.049 1.00 0.00 O ATOM 690 CB LYS A 49 -1.241 -1.570 -12.532 1.00 0.00 C ATOM 691 CG LYS A 49 -1.586 -2.714 -13.497 1.00 0.00 C ATOM 692 CD LYS A 49 -1.726 -2.283 -14.957 1.00 0.00 C ATOM 693 CE LYS A 49 -0.428 -2.444 -15.737 1.00 0.00 C ATOM 694 NZ LYS A 49 -0.693 -2.200 -17.160 1.00 0.00 N ATOM 0 H LYS A 49 -0.591 -0.525 -10.238 1.00 0.00 H new ATOM 0 HA LYS A 49 -3.097 -1.479 -11.499 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -1.434 -0.614 -13.018 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -0.177 -1.600 -12.298 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -0.812 -3.478 -13.428 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -2.519 -3.176 -13.175 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -2.509 -2.873 -15.434 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -2.044 -1.241 -14.997 1.00 0.00 H new ATOM 0 HE2 LYS A 49 0.322 -1.744 -15.368 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -0.025 -3.447 -15.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -0.452 -3.050 -17.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -1.700 -1.977 -17.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -0.115 -1.400 -17.489 1.00 0.00 H new ATOM 708 N VAL A 50 -3.101 -3.718 -10.586 1.00 0.00 N ATOM 709 CA VAL A 50 -3.225 -5.081 -10.034 1.00 0.00 C ATOM 710 C VAL A 50 -3.526 -6.057 -11.177 1.00 0.00 C ATOM 711 O VAL A 50 -4.520 -5.955 -11.894 1.00 0.00 O ATOM 712 CB VAL A 50 -4.290 -5.173 -8.927 1.00 0.00 C ATOM 713 CG1 VAL A 50 -4.288 -6.548 -8.248 1.00 0.00 C ATOM 714 CG2 VAL A 50 -4.097 -4.100 -7.855 1.00 0.00 C ATOM 0 H VAL A 50 -3.970 -3.347 -10.970 1.00 0.00 H new ATOM 0 HA VAL A 50 -2.279 -5.348 -9.563 1.00 0.00 H new ATOM 0 HB VAL A 50 -5.248 -5.015 -9.423 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -5.054 -6.572 -7.473 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -4.497 -7.320 -8.989 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -3.312 -6.731 -7.799 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -4.871 -4.203 -7.094 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -3.116 -4.219 -7.394 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -4.166 -3.113 -8.312 1.00 0.00 H new ATOM 724 N SER A 51 -2.494 -6.823 -11.468 1.00 0.00 N ATOM 725 CA SER A 51 -2.503 -7.860 -12.515 1.00 0.00 C ATOM 726 C SER A 51 -2.241 -9.222 -11.874 1.00 0.00 C ATOM 727 O SER A 51 -1.849 -9.274 -10.709 1.00 0.00 O ATOM 728 CB SER A 51 -1.415 -7.533 -13.531 1.00 0.00 C ATOM 729 OG SER A 51 -1.809 -6.325 -14.178 1.00 0.00 O ATOM 0 H SER A 51 -1.601 -6.751 -10.981 1.00 0.00 H new ATOM 0 HA SER A 51 -3.470 -7.889 -13.018 1.00 0.00 H new ATOM 0 HB2 SER A 51 -0.450 -7.412 -13.039 1.00 0.00 H new ATOM 0 HB3 SER A 51 -1.305 -8.341 -14.254 1.00 0.00 H new ATOM 0 HG SER A 51 -1.012 -5.826 -14.453 1.00 0.00 H new ATOM 735 N ALA A 52 -2.540 -10.280 -12.630 1.00 0.00 N ATOM 736 CA ALA A 52 -2.389 -11.688 -12.203 1.00 0.00 C ATOM 737 C ALA A 52 -1.010 -11.939 -11.567 1.00 0.00 C ATOM 738 O ALA A 52 0.011 -11.936 -12.249 1.00 0.00 O ATOM 739 CB ALA A 52 -2.599 -12.600 -13.418 1.00 0.00 C ATOM 0 H ALA A 52 -2.903 -10.189 -13.579 1.00 0.00 H new ATOM 0 HA ALA A 52 -3.137 -11.909 -11.442 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -2.490 -13.641 -13.115 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -3.599 -12.443 -13.822 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -1.858 -12.365 -14.182 1.00 0.00 H new ATOM 745 N GLN A 53 -1.020 -11.860 -10.233 1.00 0.00 N ATOM 746 CA GLN A 53 0.183 -11.849 -9.372 1.00 0.00 C ATOM 747 C GLN A 53 1.241 -10.827 -9.863 1.00 0.00 C ATOM 748 O GLN A 53 2.342 -11.168 -10.291 1.00 0.00 O ATOM 749 CB GLN A 53 0.713 -13.285 -9.275 1.00 0.00 C ATOM 750 CG GLN A 53 1.891 -13.442 -8.309 1.00 0.00 C ATOM 751 CD GLN A 53 3.024 -14.185 -9.015 1.00 0.00 C ATOM 752 OE1 GLN A 53 4.008 -13.619 -9.472 1.00 0.00 O ATOM 753 NE2 GLN A 53 2.919 -15.492 -9.055 1.00 0.00 N ATOM 0 H GLN A 53 -1.887 -11.800 -9.699 1.00 0.00 H new ATOM 0 HA GLN A 53 -0.075 -11.507 -8.369 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -0.097 -13.941 -8.956 1.00 0.00 H new ATOM 0 HB3 GLN A 53 1.021 -13.617 -10.266 1.00 0.00 H new ATOM 0 HG2 GLN A 53 2.235 -12.463 -7.974 1.00 0.00 H new ATOM 0 HG3 GLN A 53 1.578 -13.991 -7.421 1.00 0.00 H new ATOM 0 HE21 GLN A 53 2.093 -15.949 -8.670 1.00 0.00 H new ATOM 0 HE22 GLN A 53 3.664 -16.051 -9.471 1.00 0.00 H new ATOM 762 N GLY A 54 0.870 -9.545 -9.775 1.00 0.00 N ATOM 763 CA GLY A 54 1.766 -8.450 -10.195 1.00 0.00 C ATOM 764 C GLY A 54 1.137 -7.085 -9.929 1.00 0.00 C ATOM 765 O GLY A 54 -0.024 -6.847 -10.257 1.00 0.00 O ATOM 0 H GLY A 54 -0.035 -9.237 -9.421 1.00 0.00 H new ATOM 0 HA2 GLY A 54 2.713 -8.527 -9.660 1.00 0.00 H new ATOM 0 HA3 GLY A 54 1.991 -8.548 -11.257 1.00 0.00 H new ATOM 769 N ILE A 55 1.864 -6.307 -9.142 1.00 0.00 N ATOM 770 CA ILE A 55 1.446 -4.951 -8.747 1.00 0.00 C ATOM 771 C ILE A 55 2.458 -3.952 -9.323 1.00 0.00 C ATOM 772 O ILE A 55 3.666 -4.160 -9.279 1.00 0.00 O ATOM 773 CB ILE A 55 1.372 -4.838 -7.208 1.00 0.00 C ATOM 774 CG1 ILE A 55 0.518 -5.936 -6.542 1.00 0.00 C ATOM 775 CG2 ILE A 55 0.956 -3.436 -6.752 1.00 0.00 C ATOM 776 CD1 ILE A 55 -0.932 -6.025 -7.027 1.00 0.00 C ATOM 0 H ILE A 55 2.764 -6.589 -8.753 1.00 0.00 H new ATOM 0 HA ILE A 55 0.452 -4.733 -9.138 1.00 0.00 H new ATOM 0 HB ILE A 55 2.390 -5.008 -6.859 1.00 0.00 H new ATOM 0 HG12 ILE A 55 0.999 -6.899 -6.711 1.00 0.00 H new ATOM 0 HG13 ILE A 55 0.513 -5.766 -5.465 1.00 0.00 H new ATOM 0 HG21 ILE A 55 0.917 -3.404 -5.663 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.682 -2.706 -7.111 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -0.028 -3.199 -7.157 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -1.444 -6.828 -6.497 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -1.439 -5.080 -6.833 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -0.946 -6.231 -8.097 1.00 0.00 H new ATOM 788 N THR A 56 1.928 -2.879 -9.877 1.00 0.00 N ATOM 789 CA THR A 56 2.753 -1.809 -10.469 1.00 0.00 C ATOM 790 C THR A 56 2.291 -0.443 -9.959 1.00 0.00 C ATOM 791 O THR A 56 1.117 -0.256 -9.644 1.00 0.00 O ATOM 792 CB THR A 56 2.748 -1.945 -12.000 1.00 0.00 C ATOM 793 OG1 THR A 56 3.350 -3.207 -12.301 1.00 0.00 O ATOM 794 CG2 THR A 56 3.498 -0.834 -12.745 1.00 0.00 C ATOM 0 H THR A 56 0.924 -2.712 -9.936 1.00 0.00 H new ATOM 0 HA THR A 56 3.792 -1.904 -10.155 1.00 0.00 H new ATOM 0 HB THR A 56 1.715 -1.866 -12.339 1.00 0.00 H new ATOM 0 HG1 THR A 56 3.367 -3.338 -13.272 1.00 0.00 H new ATOM 0 HG21 THR A 56 3.441 -1.013 -13.819 1.00 0.00 H new ATOM 0 HG22 THR A 56 3.044 0.130 -12.513 1.00 0.00 H new ATOM 0 HG23 THR A 56 4.542 -0.828 -12.433 1.00 0.00 H new ATOM 802 N LEU A 57 3.295 0.385 -9.699 1.00 0.00 N ATOM 803 CA LEU A 57 3.118 1.758 -9.197 1.00 0.00 C ATOM 804 C LEU A 57 3.871 2.769 -10.055 1.00 0.00 C ATOM 805 O LEU A 57 5.101 2.754 -10.119 1.00 0.00 O ATOM 806 CB LEU A 57 3.575 1.836 -7.741 1.00 0.00 C ATOM 807 CG LEU A 57 2.618 1.032 -6.867 1.00 0.00 C ATOM 808 CD1 LEU A 57 3.325 0.620 -5.585 1.00 0.00 C ATOM 809 CD2 LEU A 57 1.377 1.866 -6.562 1.00 0.00 C ATOM 0 H LEU A 57 4.273 0.126 -9.830 1.00 0.00 H new ATOM 0 HA LEU A 57 2.059 2.011 -9.254 1.00 0.00 H new ATOM 0 HB2 LEU A 57 4.588 1.446 -7.645 1.00 0.00 H new ATOM 0 HB3 LEU A 57 3.601 2.875 -7.411 1.00 0.00 H new ATOM 0 HG LEU A 57 2.305 0.131 -7.394 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.641 0.045 -4.961 1.00 0.00 H new ATOM 0 HD12 LEU A 57 4.194 0.009 -5.829 1.00 0.00 H new ATOM 0 HD13 LEU A 57 3.648 1.510 -5.045 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.695 1.289 -5.937 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.670 2.775 -6.036 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.879 2.131 -7.494 1.00 0.00 H new ATOM 821 N THR A 58 3.075 3.469 -10.850 1.00 0.00 N ATOM 822 CA THR A 58 3.581 4.484 -11.794 1.00 0.00 C ATOM 823 C THR A 58 3.448 5.895 -11.205 1.00 0.00 C ATOM 824 O THR A 58 2.366 6.346 -10.832 1.00 0.00 O ATOM 825 CB THR A 58 2.859 4.407 -13.148 1.00 0.00 C ATOM 826 OG1 THR A 58 1.476 4.685 -12.957 1.00 0.00 O ATOM 827 CG2 THR A 58 3.012 3.041 -13.825 1.00 0.00 C ATOM 0 H THR A 58 2.061 3.358 -10.867 1.00 0.00 H new ATOM 0 HA THR A 58 4.637 4.271 -11.961 1.00 0.00 H new ATOM 0 HB THR A 58 3.319 5.146 -13.804 1.00 0.00 H new ATOM 0 HG1 THR A 58 1.355 5.188 -12.124 1.00 0.00 H new ATOM 0 HG21 THR A 58 2.482 3.045 -14.777 1.00 0.00 H new ATOM 0 HG22 THR A 58 4.069 2.838 -13.999 1.00 0.00 H new ATOM 0 HG23 THR A 58 2.595 2.267 -13.181 1.00 0.00 H new ATOM 835 N ASP A 59 4.608 6.470 -10.915 1.00 0.00 N ATOM 836 CA ASP A 59 4.709 7.846 -10.402 1.00 0.00 C ATOM 837 C ASP A 59 4.541 8.905 -11.495 1.00 0.00 C ATOM 838 O ASP A 59 5.400 9.040 -12.365 1.00 0.00 O ATOM 839 CB ASP A 59 6.051 8.029 -9.695 1.00 0.00 C ATOM 840 CG ASP A 59 5.858 8.277 -8.204 1.00 0.00 C ATOM 841 OD1 ASP A 59 4.980 9.115 -7.914 1.00 0.00 O ATOM 842 OD2 ASP A 59 6.636 7.718 -7.406 1.00 0.00 O ATOM 0 H ASP A 59 5.508 6.004 -11.026 1.00 0.00 H new ATOM 0 HA ASP A 59 3.888 7.991 -9.699 1.00 0.00 H new ATOM 0 HB2 ASP A 59 6.667 7.142 -9.842 1.00 0.00 H new ATOM 0 HB3 ASP A 59 6.588 8.867 -10.139 1.00 0.00 H new ATOM 847 N ASN A 60 3.446 9.653 -11.394 1.00 0.00 N ATOM 848 CA ASN A 60 3.163 10.753 -12.343 1.00 0.00 C ATOM 849 C ASN A 60 2.925 12.115 -11.662 1.00 0.00 C ATOM 850 O ASN A 60 2.592 13.116 -12.292 1.00 0.00 O ATOM 851 CB ASN A 60 1.960 10.368 -13.209 1.00 0.00 C ATOM 852 CG ASN A 60 2.118 10.826 -14.663 1.00 0.00 C ATOM 853 OD1 ASN A 60 2.967 11.621 -15.043 1.00 0.00 O ATOM 854 ND2 ASN A 60 1.328 10.245 -15.535 1.00 0.00 N ATOM 0 H ASN A 60 2.736 9.527 -10.672 1.00 0.00 H new ATOM 0 HA ASN A 60 4.053 10.885 -12.958 1.00 0.00 H new ATOM 0 HB2 ASN A 60 1.829 9.286 -13.184 1.00 0.00 H new ATOM 0 HB3 ASN A 60 1.056 10.809 -12.788 1.00 0.00 H new ATOM 0 HD21 ASN A 60 1.422 10.456 -16.528 1.00 0.00 H new ATOM 0 HD22 ASN A 60 0.620 9.582 -15.219 1.00 0.00 H new ATOM 861 N GLN A 61 3.128 12.120 -10.347 1.00 0.00 N ATOM 862 CA GLN A 61 2.982 13.306 -9.479 1.00 0.00 C ATOM 863 C GLN A 61 4.160 13.483 -8.505 1.00 0.00 C ATOM 864 O GLN A 61 4.085 14.229 -7.533 1.00 0.00 O ATOM 865 CB GLN A 61 1.658 13.177 -8.727 1.00 0.00 C ATOM 866 CG GLN A 61 0.482 13.727 -9.540 1.00 0.00 C ATOM 867 CD GLN A 61 0.187 15.172 -9.136 1.00 0.00 C ATOM 868 OE1 GLN A 61 -0.581 15.448 -8.225 1.00 0.00 O ATOM 869 NE2 GLN A 61 0.796 16.123 -9.806 1.00 0.00 N ATOM 0 H GLN A 61 3.406 11.283 -9.834 1.00 0.00 H new ATOM 0 HA GLN A 61 2.984 14.201 -10.102 1.00 0.00 H new ATOM 0 HB2 GLN A 61 1.476 12.129 -8.490 1.00 0.00 H new ATOM 0 HB3 GLN A 61 1.725 13.711 -7.779 1.00 0.00 H new ATOM 0 HG2 GLN A 61 0.713 13.680 -10.604 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -0.401 13.109 -9.378 1.00 0.00 H new ATOM 0 HE21 GLN A 61 1.435 15.884 -10.564 1.00 0.00 H new ATOM 0 HE22 GLN A 61 0.630 17.101 -9.568 1.00 0.00 H new ATOM 878 N ARG A 62 5.277 12.851 -8.863 1.00 0.00 N ATOM 879 CA ARG A 62 6.537 12.940 -8.100 1.00 0.00 C ATOM 880 C ARG A 62 7.657 13.660 -8.868 1.00 0.00 C ATOM 881 O ARG A 62 8.739 13.868 -8.322 1.00 0.00 O ATOM 882 CB ARG A 62 6.976 11.529 -7.704 1.00 0.00 C ATOM 883 CG ARG A 62 7.995 11.556 -6.568 1.00 0.00 C ATOM 884 CD ARG A 62 8.085 10.199 -5.878 1.00 0.00 C ATOM 885 NE ARG A 62 9.399 10.020 -5.248 1.00 0.00 N ATOM 886 CZ ARG A 62 9.960 10.726 -4.260 1.00 0.00 C ATOM 887 NH1 ARG A 62 9.342 11.718 -3.630 1.00 0.00 N ATOM 888 NH2 ARG A 62 11.183 10.411 -3.875 1.00 0.00 N ATOM 0 H ARG A 62 5.341 12.259 -9.691 1.00 0.00 H new ATOM 0 HA ARG A 62 6.347 13.543 -7.212 1.00 0.00 H new ATOM 0 HB2 ARG A 62 6.105 10.949 -7.399 1.00 0.00 H new ATOM 0 HB3 ARG A 62 7.408 11.025 -8.569 1.00 0.00 H new ATOM 0 HG2 ARG A 62 8.974 11.834 -6.960 1.00 0.00 H new ATOM 0 HG3 ARG A 62 7.714 12.319 -5.842 1.00 0.00 H new ATOM 0 HD2 ARG A 62 7.301 10.116 -5.125 1.00 0.00 H new ATOM 0 HD3 ARG A 62 7.914 9.405 -6.604 1.00 0.00 H new ATOM 0 HE ARG A 62 9.961 9.252 -5.614 1.00 0.00 H new ATOM 0 HH11 ARG A 62 8.391 11.975 -3.893 1.00 0.00 H new ATOM 0 HH12 ARG A 62 9.819 12.223 -2.883 1.00 0.00 H new ATOM 0 HH21 ARG A 62 11.679 9.644 -4.329 1.00 0.00 H new ATOM 0 HH22 ARG A 62 11.632 10.935 -3.124 1.00 0.00 H new ATOM 902 N LYS A 63 7.429 13.888 -10.167 1.00 0.00 N ATOM 903 CA LYS A 63 8.346 14.549 -11.125 1.00 0.00 C ATOM 904 C LYS A 63 9.404 13.559 -11.640 1.00 0.00 C ATOM 905 O LYS A 63 9.436 13.257 -12.830 1.00 0.00 O ATOM 906 CB LYS A 63 9.015 15.781 -10.499 1.00 0.00 C ATOM 907 CG LYS A 63 8.901 17.057 -11.323 1.00 0.00 C ATOM 908 CD LYS A 63 9.267 18.219 -10.399 1.00 0.00 C ATOM 909 CE LYS A 63 10.524 18.953 -10.861 1.00 0.00 C ATOM 910 NZ LYS A 63 11.017 19.820 -9.782 1.00 0.00 N ATOM 0 H LYS A 63 6.555 13.604 -10.609 1.00 0.00 H new ATOM 0 HA LYS A 63 7.751 14.888 -11.973 1.00 0.00 H new ATOM 0 HB2 LYS A 63 8.574 15.958 -9.518 1.00 0.00 H new ATOM 0 HB3 LYS A 63 10.071 15.562 -10.339 1.00 0.00 H new ATOM 0 HG2 LYS A 63 9.570 17.022 -12.183 1.00 0.00 H new ATOM 0 HG3 LYS A 63 7.889 17.177 -11.711 1.00 0.00 H new ATOM 0 HD2 LYS A 63 8.435 18.921 -10.355 1.00 0.00 H new ATOM 0 HD3 LYS A 63 9.420 17.842 -9.388 1.00 0.00 H new ATOM 0 HE2 LYS A 63 11.293 18.234 -11.143 1.00 0.00 H new ATOM 0 HE3 LYS A 63 10.304 19.548 -11.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 11.873 20.318 -10.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 10.284 20.515 -9.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 11.243 19.242 -8.948 1.00 0.00 H new ATOM 924 N LEU A 64 10.083 12.900 -10.702 1.00 0.00 N ATOM 925 CA LEU A 64 11.048 11.830 -11.002 1.00 0.00 C ATOM 926 C LEU A 64 10.324 10.497 -11.210 1.00 0.00 C ATOM 927 O LEU A 64 9.768 9.923 -10.272 1.00 0.00 O ATOM 928 CB LEU A 64 12.106 11.719 -9.902 1.00 0.00 C ATOM 929 CG LEU A 64 13.285 12.650 -10.188 1.00 0.00 C ATOM 930 CD1 LEU A 64 13.535 13.581 -9.001 1.00 0.00 C ATOM 931 CD2 LEU A 64 14.535 11.823 -10.495 1.00 0.00 C ATOM 0 H LEU A 64 9.982 13.091 -9.705 1.00 0.00 H new ATOM 0 HA LEU A 64 11.563 12.084 -11.928 1.00 0.00 H new ATOM 0 HB2 LEU A 64 11.663 11.971 -8.938 1.00 0.00 H new ATOM 0 HB3 LEU A 64 12.458 10.690 -9.832 1.00 0.00 H new ATOM 0 HG LEU A 64 13.047 13.265 -11.056 1.00 0.00 H new ATOM 0 HD11 LEU A 64 14.378 14.236 -9.223 1.00 0.00 H new ATOM 0 HD12 LEU A 64 12.646 14.184 -8.818 1.00 0.00 H new ATOM 0 HD13 LEU A 64 13.760 12.988 -8.115 1.00 0.00 H new ATOM 0 HD21 LEU A 64 15.372 12.491 -10.698 1.00 0.00 H new ATOM 0 HD22 LEU A 64 14.773 11.192 -9.639 1.00 0.00 H new ATOM 0 HD23 LEU A 64 14.351 11.196 -11.367 1.00 0.00 H new ATOM 943 N PHE A 65 10.178 10.163 -12.489 1.00 0.00 N ATOM 944 CA PHE A 65 9.515 8.928 -12.958 1.00 0.00 C ATOM 945 C PHE A 65 9.979 7.697 -12.161 1.00 0.00 C ATOM 946 O PHE A 65 11.162 7.367 -12.116 1.00 0.00 O ATOM 947 CB PHE A 65 9.790 8.752 -14.455 1.00 0.00 C ATOM 948 CG PHE A 65 9.079 7.524 -15.030 1.00 0.00 C ATOM 949 CD1 PHE A 65 7.720 7.588 -15.315 1.00 0.00 C ATOM 950 CD2 PHE A 65 9.791 6.358 -15.286 1.00 0.00 C ATOM 951 CE1 PHE A 65 7.074 6.488 -15.858 1.00 0.00 C ATOM 952 CE2 PHE A 65 9.142 5.256 -15.829 1.00 0.00 C ATOM 953 CZ PHE A 65 7.784 5.319 -16.118 1.00 0.00 C ATOM 0 H PHE A 65 10.520 10.748 -13.251 1.00 0.00 H new ATOM 0 HA PHE A 65 8.441 9.020 -12.794 1.00 0.00 H new ATOM 0 HB2 PHE A 65 9.463 9.643 -14.991 1.00 0.00 H new ATOM 0 HB3 PHE A 65 10.864 8.658 -14.617 1.00 0.00 H new ATOM 0 HD1 PHE A 65 7.168 8.494 -15.114 1.00 0.00 H new ATOM 0 HD2 PHE A 65 10.847 6.309 -15.063 1.00 0.00 H new ATOM 0 HE1 PHE A 65 6.018 6.538 -16.080 1.00 0.00 H new ATOM 0 HE2 PHE A 65 9.694 4.349 -16.027 1.00 0.00 H new ATOM 0 HZ PHE A 65 7.281 4.463 -16.543 1.00 0.00 H new ATOM 963 N PHE A 66 9.032 7.183 -11.390 1.00 0.00 N ATOM 964 CA PHE A 66 9.262 6.053 -10.473 1.00 0.00 C ATOM 965 C PHE A 66 8.264 4.923 -10.732 1.00 0.00 C ATOM 966 O PHE A 66 7.073 5.043 -10.436 1.00 0.00 O ATOM 967 CB PHE A 66 9.147 6.556 -9.033 1.00 0.00 C ATOM 968 CG PHE A 66 10.443 6.382 -8.255 1.00 0.00 C ATOM 969 CD1 PHE A 66 11.442 7.345 -8.346 1.00 0.00 C ATOM 970 CD2 PHE A 66 10.596 5.281 -7.422 1.00 0.00 C ATOM 971 CE1 PHE A 66 12.597 7.206 -7.593 1.00 0.00 C ATOM 972 CE2 PHE A 66 11.752 5.145 -6.667 1.00 0.00 C ATOM 973 CZ PHE A 66 12.751 6.108 -6.751 1.00 0.00 C ATOM 0 H PHE A 66 8.074 7.533 -11.376 1.00 0.00 H new ATOM 0 HA PHE A 66 10.260 5.650 -10.642 1.00 0.00 H new ATOM 0 HB2 PHE A 66 8.869 7.610 -9.040 1.00 0.00 H new ATOM 0 HB3 PHE A 66 8.346 6.018 -8.526 1.00 0.00 H new ATOM 0 HD1 PHE A 66 11.319 8.196 -8.999 1.00 0.00 H new ATOM 0 HD2 PHE A 66 9.818 4.534 -7.362 1.00 0.00 H new ATOM 0 HE1 PHE A 66 13.378 7.949 -7.659 1.00 0.00 H new ATOM 0 HE2 PHE A 66 11.875 4.293 -6.015 1.00 0.00 H new ATOM 0 HZ PHE A 66 13.650 6.004 -6.161 1.00 0.00 H new ATOM 983 N ARG A 67 8.756 3.917 -11.443 1.00 0.00 N ATOM 984 CA ARG A 67 7.933 2.750 -11.795 1.00 0.00 C ATOM 985 C ARG A 67 8.463 1.493 -11.102 1.00 0.00 C ATOM 986 O ARG A 67 9.624 1.115 -11.247 1.00 0.00 O ATOM 987 CB ARG A 67 7.883 2.558 -13.309 1.00 0.00 C ATOM 988 CG ARG A 67 6.548 1.905 -13.670 1.00 0.00 C ATOM 989 CD ARG A 67 6.701 0.608 -14.470 1.00 0.00 C ATOM 990 NE ARG A 67 7.267 0.843 -15.812 1.00 0.00 N ATOM 991 CZ ARG A 67 6.697 1.485 -16.839 1.00 0.00 C ATOM 992 NH1 ARG A 67 5.479 2.007 -16.762 1.00 0.00 N ATOM 993 NH2 ARG A 67 7.350 1.601 -17.982 1.00 0.00 N ATOM 0 H ARG A 67 9.715 3.878 -11.789 1.00 0.00 H new ATOM 0 HA ARG A 67 6.916 2.929 -11.446 1.00 0.00 H new ATOM 0 HB2 ARG A 67 7.985 3.517 -13.816 1.00 0.00 H new ATOM 0 HB3 ARG A 67 8.712 1.933 -13.639 1.00 0.00 H new ATOM 0 HG2 ARG A 67 5.995 1.695 -12.754 1.00 0.00 H new ATOM 0 HG3 ARG A 67 5.951 2.611 -14.248 1.00 0.00 H new ATOM 0 HD2 ARG A 67 7.344 -0.081 -13.922 1.00 0.00 H new ATOM 0 HD3 ARG A 67 5.728 0.127 -14.567 1.00 0.00 H new ATOM 0 HE ARG A 67 8.203 0.473 -15.977 1.00 0.00 H new ATOM 0 HH11 ARG A 67 4.943 1.926 -15.898 1.00 0.00 H new ATOM 0 HH12 ARG A 67 5.079 2.489 -17.567 1.00 0.00 H new ATOM 0 HH21 ARG A 67 8.284 1.202 -18.079 1.00 0.00 H new ATOM 0 HH22 ARG A 67 6.920 2.089 -18.768 1.00 0.00 H new ATOM 1007 N ARG A 68 7.613 0.989 -10.217 1.00 0.00 N ATOM 1008 CA ARG A 68 7.901 -0.227 -9.436 1.00 0.00 C ATOM 1009 C ARG A 68 6.951 -1.383 -9.763 1.00 0.00 C ATOM 1010 O ARG A 68 5.793 -1.167 -10.124 1.00 0.00 O ATOM 1011 CB ARG A 68 7.831 0.107 -7.947 1.00 0.00 C ATOM 1012 CG ARG A 68 9.188 -0.189 -7.317 1.00 0.00 C ATOM 1013 CD ARG A 68 9.689 1.031 -6.543 1.00 0.00 C ATOM 1014 NE ARG A 68 11.003 1.435 -7.066 1.00 0.00 N ATOM 1015 CZ ARG A 68 12.192 0.892 -6.776 1.00 0.00 C ATOM 1016 NH1 ARG A 68 12.324 -0.116 -5.922 1.00 0.00 N ATOM 1017 NH2 ARG A 68 13.280 1.373 -7.350 1.00 0.00 N ATOM 0 H ARG A 68 6.704 1.404 -10.014 1.00 0.00 H new ATOM 0 HA ARG A 68 8.902 -0.563 -9.705 1.00 0.00 H new ATOM 0 HB2 ARG A 68 7.570 1.156 -7.807 1.00 0.00 H new ATOM 0 HB3 ARG A 68 7.053 -0.483 -7.463 1.00 0.00 H new ATOM 0 HG2 ARG A 68 9.107 -1.045 -6.647 1.00 0.00 H new ATOM 0 HG3 ARG A 68 9.906 -0.457 -8.092 1.00 0.00 H new ATOM 0 HD2 ARG A 68 8.979 1.853 -6.638 1.00 0.00 H new ATOM 0 HD3 ARG A 68 9.764 0.796 -5.481 1.00 0.00 H new ATOM 0 HE ARG A 68 11.009 2.216 -7.723 1.00 0.00 H new ATOM 0 HH11 ARG A 68 11.502 -0.504 -5.460 1.00 0.00 H new ATOM 0 HH12 ARG A 68 13.248 -0.502 -5.728 1.00 0.00 H new ATOM 0 HH21 ARG A 68 13.209 2.150 -8.007 1.00 0.00 H new ATOM 0 HH22 ARG A 68 14.191 0.967 -7.137 1.00 0.00 H new ATOM 1031 N HIS A 69 7.475 -2.589 -9.563 1.00 0.00 N ATOM 1032 CA HIS A 69 6.731 -3.842 -9.794 1.00 0.00 C ATOM 1033 C HIS A 69 6.901 -4.797 -8.601 1.00 0.00 C ATOM 1034 O HIS A 69 8.010 -5.188 -8.242 1.00 0.00 O ATOM 1035 CB HIS A 69 7.094 -4.502 -11.134 1.00 0.00 C ATOM 1036 CG HIS A 69 8.413 -5.303 -11.154 1.00 0.00 C ATOM 1037 ND1 HIS A 69 9.602 -4.883 -10.758 1.00 0.00 N ATOM 1038 CD2 HIS A 69 8.481 -6.614 -11.356 1.00 0.00 C ATOM 1039 CE1 HIS A 69 10.414 -5.943 -10.697 1.00 0.00 C ATOM 1040 NE2 HIS A 69 9.719 -7.010 -11.067 1.00 0.00 N ATOM 0 H HIS A 69 8.430 -2.735 -9.235 1.00 0.00 H new ATOM 0 HA HIS A 69 5.673 -3.592 -9.870 1.00 0.00 H new ATOM 0 HB2 HIS A 69 6.281 -5.170 -11.420 1.00 0.00 H new ATOM 0 HB3 HIS A 69 7.152 -3.725 -11.896 1.00 0.00 H new ATOM 0 HD2 HIS A 69 7.674 -7.247 -11.695 1.00 0.00 H new ATOM 0 HE1 HIS A 69 11.452 -5.932 -10.399 1.00 0.00 H new ATOM 0 HE2 HIS A 69 10.071 -7.966 -11.121 1.00 0.00 H new ATOM 1048 N TYR A 70 5.809 -4.935 -7.870 1.00 0.00 N ATOM 1049 CA TYR A 70 5.720 -5.792 -6.677 1.00 0.00 C ATOM 1050 C TYR A 70 4.770 -6.971 -6.934 1.00 0.00 C ATOM 1051 O TYR A 70 3.556 -6.782 -6.944 1.00 0.00 O ATOM 1052 CB TYR A 70 5.241 -4.969 -5.478 1.00 0.00 C ATOM 1053 CG TYR A 70 6.237 -3.860 -5.147 1.00 0.00 C ATOM 1054 CD1 TYR A 70 7.532 -4.186 -4.765 1.00 0.00 C ATOM 1055 CD2 TYR A 70 5.828 -2.533 -5.192 1.00 0.00 C ATOM 1056 CE1 TYR A 70 8.421 -3.187 -4.407 1.00 0.00 C ATOM 1057 CE2 TYR A 70 6.713 -1.530 -4.829 1.00 0.00 C ATOM 1058 CZ TYR A 70 8.008 -1.862 -4.442 1.00 0.00 C ATOM 1059 OH TYR A 70 8.875 -0.881 -4.102 1.00 0.00 O ATOM 0 H TYR A 70 4.937 -4.450 -8.084 1.00 0.00 H new ATOM 0 HA TYR A 70 6.709 -6.192 -6.456 1.00 0.00 H new ATOM 0 HB2 TYR A 70 4.266 -4.534 -5.696 1.00 0.00 H new ATOM 0 HB3 TYR A 70 5.114 -5.619 -4.613 1.00 0.00 H new ATOM 0 HD1 TYR A 70 7.846 -5.219 -4.747 1.00 0.00 H new ATOM 0 HD2 TYR A 70 4.826 -2.284 -5.508 1.00 0.00 H new ATOM 0 HE1 TYR A 70 9.427 -3.436 -4.103 1.00 0.00 H new ATOM 0 HE2 TYR A 70 6.399 -0.497 -4.846 1.00 0.00 H new ATOM 0 HH TYR A 70 8.505 -0.360 -3.359 1.00 0.00 H new ATOM 1069 N PRO A 71 5.293 -8.146 -7.285 1.00 0.00 N ATOM 1070 CA PRO A 71 4.427 -9.312 -7.539 1.00 0.00 C ATOM 1071 C PRO A 71 3.747 -9.739 -6.232 1.00 0.00 C ATOM 1072 O PRO A 71 4.356 -9.684 -5.168 1.00 0.00 O ATOM 1073 CB PRO A 71 5.347 -10.368 -8.155 1.00 0.00 C ATOM 1074 CG PRO A 71 6.783 -9.939 -7.829 1.00 0.00 C ATOM 1075 CD PRO A 71 6.724 -8.461 -7.446 1.00 0.00 C ATOM 0 HA PRO A 71 3.604 -9.116 -8.226 1.00 0.00 H new ATOM 0 HB2 PRO A 71 5.134 -11.355 -7.744 1.00 0.00 H new ATOM 0 HB3 PRO A 71 5.197 -10.432 -9.233 1.00 0.00 H new ATOM 0 HG2 PRO A 71 7.189 -10.535 -7.011 1.00 0.00 H new ATOM 0 HG3 PRO A 71 7.437 -10.090 -8.688 1.00 0.00 H new ATOM 0 HD2 PRO A 71 7.272 -8.274 -6.523 1.00 0.00 H new ATOM 0 HD3 PRO A 71 7.177 -7.838 -8.217 1.00 0.00 H new ATOM 1083 N LEU A 72 2.465 -10.098 -6.300 1.00 0.00 N ATOM 1084 CA LEU A 72 1.695 -10.563 -5.117 1.00 0.00 C ATOM 1085 C LEU A 72 2.377 -11.676 -4.304 1.00 0.00 C ATOM 1086 O LEU A 72 2.190 -11.751 -3.095 1.00 0.00 O ATOM 1087 CB LEU A 72 0.294 -11.039 -5.498 1.00 0.00 C ATOM 1088 CG LEU A 72 -0.780 -10.024 -5.101 1.00 0.00 C ATOM 1089 CD1 LEU A 72 -1.458 -9.479 -6.354 1.00 0.00 C ATOM 1090 CD2 LEU A 72 -1.819 -10.683 -4.194 1.00 0.00 C ATOM 0 H LEU A 72 1.923 -10.080 -7.164 1.00 0.00 H new ATOM 0 HA LEU A 72 1.640 -9.678 -4.484 1.00 0.00 H new ATOM 0 HB2 LEU A 72 0.249 -11.213 -6.573 1.00 0.00 H new ATOM 0 HB3 LEU A 72 0.090 -11.993 -5.012 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.310 -9.204 -4.558 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.223 -8.756 -6.069 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -0.716 -8.992 -6.987 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -1.921 -10.299 -6.903 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.578 -9.951 -3.918 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -2.290 -11.512 -4.722 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -1.331 -11.057 -3.294 1.00 0.00 H new ATOM 1102 N ASN A 73 3.313 -12.369 -4.960 1.00 0.00 N ATOM 1103 CA ASN A 73 4.217 -13.363 -4.344 1.00 0.00 C ATOM 1104 C ASN A 73 4.924 -12.820 -3.082 1.00 0.00 C ATOM 1105 O ASN A 73 5.392 -13.593 -2.249 1.00 0.00 O ATOM 1106 CB ASN A 73 5.261 -13.822 -5.384 1.00 0.00 C ATOM 1107 CG ASN A 73 6.460 -12.882 -5.600 1.00 0.00 C ATOM 1108 OD1 ASN A 73 6.401 -11.669 -5.485 1.00 0.00 O ATOM 1109 ND2 ASN A 73 7.613 -13.437 -5.884 1.00 0.00 N ATOM 0 H ASN A 73 3.472 -12.256 -5.961 1.00 0.00 H new ATOM 0 HA ASN A 73 3.609 -14.209 -4.025 1.00 0.00 H new ATOM 0 HB2 ASN A 73 5.640 -14.798 -5.081 1.00 0.00 H new ATOM 0 HB3 ASN A 73 4.756 -13.959 -6.340 1.00 0.00 H new ATOM 0 HD21 ASN A 73 8.443 -12.856 -6.005 1.00 0.00 H new ATOM 0 HD22 ASN A 73 7.681 -14.450 -5.984 1.00 0.00 H new ATOM 1116 N THR A 74 5.138 -11.501 -3.087 1.00 0.00 N ATOM 1117 CA THR A 74 5.765 -10.722 -2.009 1.00 0.00 C ATOM 1118 C THR A 74 4.711 -10.148 -1.054 1.00 0.00 C ATOM 1119 O THR A 74 4.799 -10.358 0.151 1.00 0.00 O ATOM 1120 CB THR A 74 6.713 -9.642 -2.582 1.00 0.00 C ATOM 1121 OG1 THR A 74 7.525 -9.148 -1.530 1.00 0.00 O ATOM 1122 CG2 THR A 74 6.091 -8.397 -3.225 1.00 0.00 C ATOM 0 H THR A 74 4.867 -10.918 -3.879 1.00 0.00 H new ATOM 0 HA THR A 74 6.385 -11.393 -1.414 1.00 0.00 H new ATOM 0 HB THR A 74 7.227 -10.175 -3.381 1.00 0.00 H new ATOM 0 HG1 THR A 74 8.076 -8.409 -1.862 1.00 0.00 H new ATOM 0 HG21 THR A 74 6.882 -7.736 -3.578 1.00 0.00 H new ATOM 0 HG22 THR A 74 5.466 -8.696 -4.066 1.00 0.00 H new ATOM 0 HG23 THR A 74 5.482 -7.873 -2.489 1.00 0.00 H new ATOM 1130 N VAL A 75 3.656 -9.565 -1.620 1.00 0.00 N ATOM 1131 CA VAL A 75 2.558 -8.928 -0.864 1.00 0.00 C ATOM 1132 C VAL A 75 1.688 -10.046 -0.255 1.00 0.00 C ATOM 1133 O VAL A 75 0.718 -10.509 -0.848 1.00 0.00 O ATOM 1134 CB VAL A 75 1.755 -7.984 -1.784 1.00 0.00 C ATOM 1135 CG1 VAL A 75 0.600 -7.312 -1.041 1.00 0.00 C ATOM 1136 CG2 VAL A 75 2.635 -6.886 -2.395 1.00 0.00 C ATOM 0 H VAL A 75 3.530 -9.516 -2.631 1.00 0.00 H new ATOM 0 HA VAL A 75 2.946 -8.310 -0.054 1.00 0.00 H new ATOM 0 HB VAL A 75 1.361 -8.617 -2.580 1.00 0.00 H new ATOM 0 HG11 VAL A 75 0.060 -6.656 -1.724 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -0.079 -8.074 -0.658 1.00 0.00 H new ATOM 0 HG13 VAL A 75 0.994 -6.726 -0.210 1.00 0.00 H new ATOM 0 HG21 VAL A 75 2.027 -6.246 -3.035 1.00 0.00 H new ATOM 0 HG22 VAL A 75 3.076 -6.288 -1.598 1.00 0.00 H new ATOM 0 HG23 VAL A 75 3.428 -7.343 -2.987 1.00 0.00 H new ATOM 1146 N THR A 76 2.133 -10.486 0.916 1.00 0.00 N ATOM 1147 CA THR A 76 1.489 -11.573 1.682 1.00 0.00 C ATOM 1148 C THR A 76 0.169 -11.091 2.295 1.00 0.00 C ATOM 1149 O THR A 76 -0.857 -11.755 2.213 1.00 0.00 O ATOM 1150 CB THR A 76 2.407 -12.137 2.785 1.00 0.00 C ATOM 1151 OG1 THR A 76 2.672 -11.152 3.787 1.00 0.00 O ATOM 1152 CG2 THR A 76 3.734 -12.656 2.223 1.00 0.00 C ATOM 0 H THR A 76 2.959 -10.101 1.374 1.00 0.00 H new ATOM 0 HA THR A 76 1.288 -12.380 0.978 1.00 0.00 H new ATOM 0 HB THR A 76 1.873 -12.975 3.232 1.00 0.00 H new ATOM 0 HG1 THR A 76 3.255 -11.535 4.476 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.347 -13.043 3.037 1.00 0.00 H new ATOM 0 HG22 THR A 76 3.538 -13.453 1.505 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.262 -11.842 1.727 1.00 0.00 H new ATOM 1160 N PHE A 77 0.248 -9.936 2.945 1.00 0.00 N ATOM 1161 CA PHE A 77 -0.900 -9.299 3.602 1.00 0.00 C ATOM 1162 C PHE A 77 -1.024 -7.856 3.117 1.00 0.00 C ATOM 1163 O PHE A 77 -0.078 -7.089 3.281 1.00 0.00 O ATOM 1164 CB PHE A 77 -0.606 -9.281 5.098 1.00 0.00 C ATOM 1165 CG PHE A 77 -1.840 -9.593 5.926 1.00 0.00 C ATOM 1166 CD1 PHE A 77 -2.750 -8.597 6.256 1.00 0.00 C ATOM 1167 CD2 PHE A 77 -2.015 -10.893 6.373 1.00 0.00 C ATOM 1168 CE1 PHE A 77 -3.846 -8.909 7.043 1.00 0.00 C ATOM 1169 CE2 PHE A 77 -3.112 -11.204 7.159 1.00 0.00 C ATOM 1170 CZ PHE A 77 -4.029 -10.213 7.491 1.00 0.00 C ATOM 0 H PHE A 77 1.115 -9.406 3.035 1.00 0.00 H new ATOM 0 HA PHE A 77 -1.821 -9.838 3.379 1.00 0.00 H new ATOM 0 HB2 PHE A 77 0.174 -10.008 5.323 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -0.219 -8.302 5.379 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -2.604 -7.587 5.902 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -1.300 -11.659 6.110 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -4.557 -8.141 7.308 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -3.255 -12.214 7.513 1.00 0.00 H new ATOM 0 HZ PHE A 77 -4.887 -10.457 8.100 1.00 0.00 H new ATOM 1180 N CYS A 78 -2.229 -7.500 2.686 1.00 0.00 N ATOM 1181 CA CYS A 78 -2.554 -6.139 2.219 1.00 0.00 C ATOM 1182 C CYS A 78 -3.946 -5.730 2.703 1.00 0.00 C ATOM 1183 O CYS A 78 -4.976 -6.113 2.151 1.00 0.00 O ATOM 1184 CB CYS A 78 -2.468 -6.030 0.694 1.00 0.00 C ATOM 1185 SG CYS A 78 -2.630 -4.298 0.119 1.00 0.00 S ATOM 0 H CYS A 78 -3.019 -8.144 2.647 1.00 0.00 H new ATOM 0 HA CYS A 78 -1.815 -5.458 2.642 1.00 0.00 H new ATOM 0 HB2 CYS A 78 -1.515 -6.437 0.355 1.00 0.00 H new ATOM 0 HB3 CYS A 78 -3.253 -6.637 0.242 1.00 0.00 H new ATOM 0 HG CYS A 78 -2.339 -4.232 -1.146 1.00 0.00 H new ATOM 1191 N ASP A 79 -3.923 -5.050 3.839 1.00 0.00 N ATOM 1192 CA ASP A 79 -5.156 -4.602 4.504 1.00 0.00 C ATOM 1193 C ASP A 79 -4.996 -3.149 4.968 1.00 0.00 C ATOM 1194 O ASP A 79 -3.898 -2.587 4.938 1.00 0.00 O ATOM 1195 CB ASP A 79 -5.508 -5.576 5.642 1.00 0.00 C ATOM 1196 CG ASP A 79 -6.968 -5.451 6.097 1.00 0.00 C ATOM 1197 OD1 ASP A 79 -7.856 -5.845 5.314 1.00 0.00 O ATOM 1198 OD2 ASP A 79 -7.174 -4.883 7.189 1.00 0.00 O ATOM 0 H ASP A 79 -3.066 -4.791 4.328 1.00 0.00 H new ATOM 0 HA ASP A 79 -5.996 -4.614 3.810 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -5.321 -6.598 5.311 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -4.850 -5.390 6.491 1.00 0.00 H new ATOM 1203 N LEU A 80 -6.126 -2.536 5.308 1.00 0.00 N ATOM 1204 CA LEU A 80 -6.137 -1.190 5.904 1.00 0.00 C ATOM 1205 C LEU A 80 -5.305 -1.162 7.185 1.00 0.00 C ATOM 1206 O LEU A 80 -4.872 -2.189 7.712 1.00 0.00 O ATOM 1207 CB LEU A 80 -7.559 -0.721 6.257 1.00 0.00 C ATOM 1208 CG LEU A 80 -8.329 0.013 5.155 1.00 0.00 C ATOM 1209 CD1 LEU A 80 -7.584 1.239 4.629 1.00 0.00 C ATOM 1210 CD2 LEU A 80 -8.705 -0.943 4.035 1.00 0.00 C ATOM 0 H LEU A 80 -7.052 -2.945 5.183 1.00 0.00 H new ATOM 0 HA LEU A 80 -5.716 -0.521 5.154 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -8.141 -1.592 6.558 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -7.496 -0.065 7.125 1.00 0.00 H new ATOM 0 HG LEU A 80 -9.248 0.391 5.603 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -8.177 1.719 3.850 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -7.419 1.942 5.445 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -6.623 0.931 4.216 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -9.251 -0.402 3.263 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -7.801 -1.374 3.606 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -9.333 -1.740 4.433 1.00 0.00 H new ATOM 1222 N ASP A 81 -5.064 0.051 7.647 1.00 0.00 N ATOM 1223 CA ASP A 81 -4.336 0.245 8.901 1.00 0.00 C ATOM 1224 C ASP A 81 -5.168 -0.225 10.114 1.00 0.00 C ATOM 1225 O ASP A 81 -6.244 0.326 10.351 1.00 0.00 O ATOM 1226 CB ASP A 81 -3.954 1.717 8.956 1.00 0.00 C ATOM 1227 CG ASP A 81 -4.981 2.683 9.528 1.00 0.00 C ATOM 1228 OD1 ASP A 81 -6.007 2.896 8.856 1.00 0.00 O ATOM 1229 OD2 ASP A 81 -4.775 3.035 10.708 1.00 0.00 O ATOM 0 H ASP A 81 -5.355 0.912 7.184 1.00 0.00 H new ATOM 0 HA ASP A 81 -3.433 -0.365 8.942 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -3.041 1.807 9.545 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -3.713 2.041 7.944 1.00 0.00 H new ATOM 1234 N PRO A 82 -4.622 -1.133 10.933 1.00 0.00 N ATOM 1235 CA PRO A 82 -5.281 -1.547 12.185 1.00 0.00 C ATOM 1236 C PRO A 82 -5.163 -0.504 13.311 1.00 0.00 C ATOM 1237 O PRO A 82 -5.672 -0.725 14.404 1.00 0.00 O ATOM 1238 CB PRO A 82 -4.662 -2.899 12.543 1.00 0.00 C ATOM 1239 CG PRO A 82 -3.349 -2.996 11.765 1.00 0.00 C ATOM 1240 CD PRO A 82 -3.399 -1.912 10.686 1.00 0.00 C ATOM 0 HA PRO A 82 -6.359 -1.633 12.050 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -4.483 -2.972 13.616 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -5.333 -3.716 12.275 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -2.495 -2.846 12.426 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -3.236 -3.983 11.317 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -2.516 -1.274 10.735 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -3.416 -2.356 9.691 1.00 0.00 H new ATOM 1248 N GLN A 83 -4.787 0.717 12.929 1.00 0.00 N ATOM 1249 CA GLN A 83 -4.698 1.864 13.845 1.00 0.00 C ATOM 1250 C GLN A 83 -5.841 2.871 13.644 1.00 0.00 C ATOM 1251 O GLN A 83 -5.812 3.955 14.221 1.00 0.00 O ATOM 1252 CB GLN A 83 -3.337 2.537 13.641 1.00 0.00 C ATOM 1253 CG GLN A 83 -2.545 2.574 14.951 1.00 0.00 C ATOM 1254 CD GLN A 83 -2.119 1.183 15.438 1.00 0.00 C ATOM 1255 OE1 GLN A 83 -2.874 0.227 15.581 1.00 0.00 O ATOM 1256 NE2 GLN A 83 -0.840 1.020 15.670 1.00 0.00 N ATOM 0 H GLN A 83 -4.533 0.944 11.968 1.00 0.00 H new ATOM 0 HA GLN A 83 -4.795 1.501 14.868 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -2.769 1.997 12.883 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -3.480 3.551 13.269 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -1.657 3.192 14.814 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -3.151 3.052 15.721 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -0.197 1.804 15.556 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -0.487 0.109 15.964 1.00 0.00 H new ATOM 1265 N GLU A 84 -6.868 2.457 12.892 1.00 0.00 N ATOM 1266 CA GLU A 84 -8.051 3.280 12.551 1.00 0.00 C ATOM 1267 C GLU A 84 -7.732 4.767 12.288 1.00 0.00 C ATOM 1268 O GLU A 84 -8.276 5.684 12.901 1.00 0.00 O ATOM 1269 CB GLU A 84 -9.110 3.110 13.643 1.00 0.00 C ATOM 1270 CG GLU A 84 -10.174 2.080 13.262 1.00 0.00 C ATOM 1271 CD GLU A 84 -11.555 2.740 13.312 1.00 0.00 C ATOM 1272 OE1 GLU A 84 -12.000 3.053 14.437 1.00 0.00 O ATOM 1273 OE2 GLU A 84 -12.151 2.885 12.221 1.00 0.00 O ATOM 0 H GLU A 84 -6.907 1.520 12.491 1.00 0.00 H new ATOM 0 HA GLU A 84 -8.437 2.915 11.599 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -8.627 2.804 14.571 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -9.589 4.070 13.835 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -9.980 1.691 12.262 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -10.138 1.232 13.946 1.00 0.00 H new ATOM 1280 N ARG A 85 -6.713 4.942 11.460 1.00 0.00 N ATOM 1281 CA ARG A 85 -6.152 6.245 11.073 1.00 0.00 C ATOM 1282 C ARG A 85 -6.123 6.412 9.553 1.00 0.00 C ATOM 1283 O ARG A 85 -6.467 5.519 8.777 1.00 0.00 O ATOM 1284 CB ARG A 85 -4.742 6.415 11.652 1.00 0.00 C ATOM 1285 CG ARG A 85 -4.778 6.882 13.108 1.00 0.00 C ATOM 1286 CD ARG A 85 -4.016 8.201 13.276 1.00 0.00 C ATOM 1287 NE ARG A 85 -4.915 9.326 13.605 1.00 0.00 N ATOM 1288 CZ ARG A 85 -5.606 9.504 14.738 1.00 0.00 C ATOM 1289 NH1 ARG A 85 -5.560 8.627 15.734 1.00 0.00 N ATOM 1290 NH2 ARG A 85 -6.368 10.575 14.898 1.00 0.00 N ATOM 0 H ARG A 85 -6.231 4.159 11.019 1.00 0.00 H new ATOM 0 HA ARG A 85 -6.800 7.020 11.484 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -4.206 5.468 11.587 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -4.188 7.137 11.052 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -5.812 7.011 13.428 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -4.339 6.119 13.750 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -3.271 8.091 14.064 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -3.476 8.426 12.356 1.00 0.00 H new ATOM 0 HE ARG A 85 -5.021 10.046 12.891 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -4.986 7.788 15.649 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -6.099 8.792 16.584 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -6.432 11.271 14.155 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -6.891 10.704 15.764 1.00 0.00 H new ATOM 1304 N LYS A 86 -5.739 7.612 9.152 1.00 0.00 N ATOM 1305 CA LYS A 86 -5.726 8.044 7.743 1.00 0.00 C ATOM 1306 C LYS A 86 -4.421 8.810 7.518 1.00 0.00 C ATOM 1307 O LYS A 86 -3.893 9.387 8.465 1.00 0.00 O ATOM 1308 CB LYS A 86 -6.931 8.960 7.494 1.00 0.00 C ATOM 1309 CG LYS A 86 -8.242 8.251 7.857 1.00 0.00 C ATOM 1310 CD LYS A 86 -9.498 9.093 7.660 1.00 0.00 C ATOM 1311 CE LYS A 86 -10.036 9.680 8.966 1.00 0.00 C ATOM 1312 NZ LYS A 86 -11.397 10.186 8.727 1.00 0.00 N ATOM 0 H LYS A 86 -5.420 8.334 9.798 1.00 0.00 H new ATOM 0 HA LYS A 86 -5.788 7.196 7.061 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -6.829 9.870 8.085 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -6.954 9.261 6.447 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -8.329 7.347 7.254 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -8.192 7.936 8.899 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -9.279 9.905 6.966 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -10.271 8.479 7.198 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -10.047 8.919 9.747 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -9.389 10.485 9.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -11.479 11.152 9.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -11.590 10.194 7.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -12.085 9.570 9.204 1.00 0.00 H new ATOM 1326 N TRP A 87 -3.911 8.778 6.291 1.00 0.00 N ATOM 1327 CA TRP A 87 -2.724 9.577 5.927 1.00 0.00 C ATOM 1328 C TRP A 87 -2.972 11.082 6.149 1.00 0.00 C ATOM 1329 O TRP A 87 -4.110 11.550 6.229 1.00 0.00 O ATOM 1330 CB TRP A 87 -2.342 9.284 4.473 1.00 0.00 C ATOM 1331 CG TRP A 87 -1.158 10.116 3.956 1.00 0.00 C ATOM 1332 CD1 TRP A 87 -1.226 11.095 3.058 1.00 0.00 C ATOM 1333 CD2 TRP A 87 0.151 10.043 4.390 1.00 0.00 C ATOM 1334 NE1 TRP A 87 -0.019 11.640 2.908 1.00 0.00 N ATOM 1335 CE2 TRP A 87 0.851 11.028 3.702 1.00 0.00 C ATOM 1336 CE3 TRP A 87 0.811 9.188 5.261 1.00 0.00 C ATOM 1337 CZ2 TRP A 87 2.225 11.149 3.863 1.00 0.00 C ATOM 1338 CZ3 TRP A 87 2.173 9.360 5.471 1.00 0.00 C ATOM 1339 CH2 TRP A 87 2.881 10.326 4.770 1.00 0.00 C ATOM 0 H TRP A 87 -4.291 8.215 5.530 1.00 0.00 H new ATOM 0 HA TRP A 87 -1.894 9.294 6.575 1.00 0.00 H new ATOM 0 HB2 TRP A 87 -2.097 8.226 4.379 1.00 0.00 H new ATOM 0 HB3 TRP A 87 -3.208 9.469 3.837 1.00 0.00 H new ATOM 0 HD1 TRP A 87 -2.119 11.400 2.533 1.00 0.00 H new ATOM 0 HE1 TRP A 87 0.203 12.411 2.278 1.00 0.00 H new ATOM 0 HE3 TRP A 87 0.274 8.400 5.768 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 2.779 11.877 3.288 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 2.686 8.736 6.187 1.00 0.00 H new ATOM 0 HH2 TRP A 87 3.943 10.438 4.930 1.00 0.00 H new ATOM 1350 N THR A 88 -1.871 11.820 6.179 1.00 0.00 N ATOM 1351 CA THR A 88 -1.873 13.276 6.412 1.00 0.00 C ATOM 1352 C THR A 88 -1.658 14.035 5.089 1.00 0.00 C ATOM 1353 O THR A 88 -0.769 14.876 4.992 1.00 0.00 O ATOM 1354 CB THR A 88 -0.779 13.657 7.429 1.00 0.00 C ATOM 1355 OG1 THR A 88 0.510 13.286 6.936 1.00 0.00 O ATOM 1356 CG2 THR A 88 -1.004 13.032 8.805 1.00 0.00 C ATOM 0 H THR A 88 -0.938 11.431 6.042 1.00 0.00 H new ATOM 0 HA THR A 88 -2.844 13.558 6.820 1.00 0.00 H new ATOM 0 HB THR A 88 -0.832 14.739 7.552 1.00 0.00 H new ATOM 0 HG1 THR A 88 0.700 13.782 6.113 1.00 0.00 H new ATOM 0 HG21 THR A 88 -0.202 13.336 9.478 1.00 0.00 H new ATOM 0 HG22 THR A 88 -1.961 13.368 9.205 1.00 0.00 H new ATOM 0 HG23 THR A 88 -1.010 11.946 8.715 1.00 0.00 H new ATOM 1364 N LYS A 89 -2.622 13.903 4.172 1.00 0.00 N ATOM 1365 CA LYS A 89 -2.587 14.557 2.840 1.00 0.00 C ATOM 1366 C LYS A 89 -2.020 15.993 2.844 1.00 0.00 C ATOM 1367 O LYS A 89 -0.829 16.189 2.616 1.00 0.00 O ATOM 1368 CB LYS A 89 -3.979 14.540 2.204 1.00 0.00 C ATOM 1369 CG LYS A 89 -4.338 13.185 1.592 1.00 0.00 C ATOM 1370 CD LYS A 89 -5.664 13.233 0.827 1.00 0.00 C ATOM 1371 CE LYS A 89 -5.654 14.250 -0.320 1.00 0.00 C ATOM 1372 NZ LYS A 89 -6.869 14.135 -1.134 1.00 0.00 N ATOM 0 H LYS A 89 -3.458 13.338 4.324 1.00 0.00 H new ATOM 0 HA LYS A 89 -1.890 13.968 2.244 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -4.721 14.800 2.959 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -4.029 15.307 1.431 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -3.542 12.870 0.918 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -4.402 12.436 2.382 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -5.883 12.243 0.426 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -6.468 13.482 1.519 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -5.577 15.259 0.085 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -4.776 14.089 -0.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -6.839 14.834 -1.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -6.928 13.178 -1.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -7.703 14.312 -0.539 1.00 0.00 H new ATOM 1386 N THR A 90 -2.839 16.932 3.304 1.00 0.00 N ATOM 1387 CA THR A 90 -2.422 18.341 3.487 1.00 0.00 C ATOM 1388 C THR A 90 -2.328 18.649 4.995 1.00 0.00 C ATOM 1389 O THR A 90 -2.572 19.766 5.442 1.00 0.00 O ATOM 1390 CB THR A 90 -3.412 19.261 2.738 1.00 0.00 C ATOM 1391 OG1 THR A 90 -3.568 18.768 1.402 1.00 0.00 O ATOM 1392 CG2 THR A 90 -2.969 20.727 2.657 1.00 0.00 C ATOM 0 H THR A 90 -3.809 16.752 3.563 1.00 0.00 H new ATOM 0 HA THR A 90 -1.434 18.520 3.063 1.00 0.00 H new ATOM 0 HB THR A 90 -4.342 19.242 3.306 1.00 0.00 H new ATOM 0 HG1 THR A 90 -4.195 19.341 0.913 1.00 0.00 H new ATOM 0 HG21 THR A 90 -3.719 21.304 2.116 1.00 0.00 H new ATOM 0 HG22 THR A 90 -2.858 21.130 3.664 1.00 0.00 H new ATOM 0 HG23 THR A 90 -2.015 20.790 2.133 1.00 0.00 H new ATOM 1400 N ASP A 91 -1.947 17.623 5.770 1.00 0.00 N ATOM 1401 CA ASP A 91 -1.800 17.682 7.240 1.00 0.00 C ATOM 1402 C ASP A 91 -3.077 18.231 7.915 1.00 0.00 C ATOM 1403 O ASP A 91 -3.213 19.430 8.144 1.00 0.00 O ATOM 1404 CB ASP A 91 -0.562 18.543 7.551 1.00 0.00 C ATOM 1405 CG ASP A 91 0.055 18.321 8.932 1.00 0.00 C ATOM 1406 OD1 ASP A 91 -0.677 17.872 9.843 1.00 0.00 O ATOM 1407 OD2 ASP A 91 1.282 18.541 9.025 1.00 0.00 O ATOM 0 H ASP A 91 -1.726 16.704 5.387 1.00 0.00 H new ATOM 0 HA ASP A 91 -1.661 16.681 7.647 1.00 0.00 H new ATOM 0 HB2 ASP A 91 0.198 18.345 6.795 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -0.837 19.594 7.458 1.00 0.00 H new ATOM 1412 N GLY A 92 -4.013 17.310 8.188 1.00 0.00 N ATOM 1413 CA GLY A 92 -5.348 17.650 8.729 1.00 0.00 C ATOM 1414 C GLY A 92 -6.126 18.618 7.820 1.00 0.00 C ATOM 1415 O GLY A 92 -6.141 19.824 8.045 1.00 0.00 O ATOM 0 H GLY A 92 -3.872 16.310 8.042 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -5.927 16.736 8.859 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -5.233 18.098 9.716 1.00 0.00 H new ATOM 1419 N SER A 93 -6.769 18.025 6.816 1.00 0.00 N ATOM 1420 CA SER A 93 -7.580 18.735 5.792 1.00 0.00 C ATOM 1421 C SER A 93 -8.322 17.773 4.853 1.00 0.00 C ATOM 1422 O SER A 93 -9.540 17.848 4.709 1.00 0.00 O ATOM 1423 CB SER A 93 -6.713 19.659 4.928 1.00 0.00 C ATOM 1424 OG SER A 93 -7.179 21.003 5.041 1.00 0.00 O ATOM 0 H SER A 93 -6.749 17.015 6.676 1.00 0.00 H new ATOM 0 HA SER A 93 -8.308 19.317 6.356 1.00 0.00 H new ATOM 0 HB2 SER A 93 -5.672 19.597 5.245 1.00 0.00 H new ATOM 0 HB3 SER A 93 -6.749 19.338 3.887 1.00 0.00 H new ATOM 0 HG SER A 93 -6.621 21.590 4.489 1.00 0.00 H new ATOM 1430 N GLY A 94 -7.577 16.767 4.369 1.00 0.00 N ATOM 1431 CA GLY A 94 -8.091 15.754 3.427 1.00 0.00 C ATOM 1432 C GLY A 94 -7.894 14.347 4.018 1.00 0.00 C ATOM 1433 O GLY A 94 -6.786 13.820 3.904 1.00 0.00 O ATOM 0 H GLY A 94 -6.598 16.631 4.619 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -9.148 15.931 3.229 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -7.571 15.834 2.473 1.00 0.00 H new ATOM 1437 N PRO A 95 -8.860 13.835 4.796 1.00 0.00 N ATOM 1438 CA PRO A 95 -8.753 12.494 5.394 1.00 0.00 C ATOM 1439 C PRO A 95 -8.987 11.399 4.347 1.00 0.00 C ATOM 1440 O PRO A 95 -10.020 11.347 3.683 1.00 0.00 O ATOM 1441 CB PRO A 95 -9.782 12.499 6.524 1.00 0.00 C ATOM 1442 CG PRO A 95 -10.873 13.443 6.027 1.00 0.00 C ATOM 1443 CD PRO A 95 -10.096 14.508 5.252 1.00 0.00 C ATOM 0 HA PRO A 95 -7.758 12.273 5.781 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -10.174 11.499 6.711 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -9.346 12.850 7.459 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -11.591 12.927 5.390 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -11.435 13.878 6.854 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -10.675 14.881 4.407 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -9.867 15.366 5.884 1.00 0.00 H new ATOM 1451 N ALA A 96 -7.942 10.611 4.145 1.00 0.00 N ATOM 1452 CA ALA A 96 -7.935 9.537 3.139 1.00 0.00 C ATOM 1453 C ALA A 96 -7.359 8.268 3.760 1.00 0.00 C ATOM 1454 O ALA A 96 -6.191 8.230 4.151 1.00 0.00 O ATOM 1455 CB ALA A 96 -7.108 9.972 1.931 1.00 0.00 C ATOM 0 H ALA A 96 -7.071 10.691 4.669 1.00 0.00 H new ATOM 0 HA ALA A 96 -8.953 9.333 2.805 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -7.104 9.175 1.187 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -7.544 10.872 1.497 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -6.085 10.180 2.246 1.00 0.00 H new ATOM 1461 N LYS A 97 -8.276 7.344 4.053 1.00 0.00 N ATOM 1462 CA LYS A 97 -7.926 6.027 4.618 1.00 0.00 C ATOM 1463 C LYS A 97 -6.655 5.454 3.986 1.00 0.00 C ATOM 1464 O LYS A 97 -6.480 5.485 2.764 1.00 0.00 O ATOM 1465 CB LYS A 97 -9.065 5.021 4.450 1.00 0.00 C ATOM 1466 CG LYS A 97 -9.887 4.919 5.734 1.00 0.00 C ATOM 1467 CD LYS A 97 -10.763 3.665 5.694 1.00 0.00 C ATOM 1468 CE LYS A 97 -11.269 3.275 7.087 1.00 0.00 C ATOM 1469 NZ LYS A 97 -12.301 4.182 7.607 1.00 0.00 N ATOM 0 H LYS A 97 -9.277 7.480 3.909 1.00 0.00 H new ATOM 0 HA LYS A 97 -7.748 6.191 5.681 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -9.707 5.326 3.624 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -8.658 4.043 4.194 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -9.224 4.883 6.598 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -10.511 5.805 5.848 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -11.613 3.837 5.034 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -10.193 2.838 5.270 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -11.671 2.263 7.049 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -10.428 3.258 7.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -12.600 3.863 8.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -11.915 5.145 7.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -13.120 4.180 6.966 1.00 0.00 H new ATOM 1483 N LEU A 98 -5.742 5.099 4.878 1.00 0.00 N ATOM 1484 CA LEU A 98 -4.443 4.578 4.447 1.00 0.00 C ATOM 1485 C LEU A 98 -4.334 3.087 4.771 1.00 0.00 C ATOM 1486 O LEU A 98 -4.862 2.579 5.764 1.00 0.00 O ATOM 1487 CB LEU A 98 -3.270 5.402 4.999 1.00 0.00 C ATOM 1488 CG LEU A 98 -2.645 4.878 6.293 1.00 0.00 C ATOM 1489 CD1 LEU A 98 -1.245 5.469 6.417 1.00 0.00 C ATOM 1490 CD2 LEU A 98 -3.517 5.223 7.498 1.00 0.00 C ATOM 0 H LEU A 98 -5.868 5.158 5.888 1.00 0.00 H new ATOM 0 HA LEU A 98 -4.378 4.681 3.364 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -2.493 5.452 4.236 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -3.615 6.422 5.170 1.00 0.00 H new ATOM 0 HG LEU A 98 -2.575 3.791 6.265 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -0.778 5.109 7.334 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -0.644 5.164 5.560 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -1.310 6.557 6.446 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -3.051 4.840 8.406 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -3.622 6.305 7.573 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -4.501 4.771 7.376 1.00 0.00 H new ATOM 1502 N PHE A 99 -3.614 2.437 3.881 1.00 0.00 N ATOM 1503 CA PHE A 99 -3.438 0.984 3.870 1.00 0.00 C ATOM 1504 C PHE A 99 -2.007 0.635 3.467 1.00 0.00 C ATOM 1505 O PHE A 99 -1.363 1.337 2.684 1.00 0.00 O ATOM 1506 CB PHE A 99 -4.453 0.363 2.903 1.00 0.00 C ATOM 1507 CG PHE A 99 -4.207 0.720 1.439 1.00 0.00 C ATOM 1508 CD1 PHE A 99 -4.540 1.972 0.933 1.00 0.00 C ATOM 1509 CD2 PHE A 99 -3.659 -0.246 0.606 1.00 0.00 C ATOM 1510 CE1 PHE A 99 -4.347 2.254 -0.410 1.00 0.00 C ATOM 1511 CE2 PHE A 99 -3.451 0.036 -0.733 1.00 0.00 C ATOM 1512 CZ PHE A 99 -3.795 1.285 -1.244 1.00 0.00 C ATOM 0 H PHE A 99 -3.119 2.908 3.123 1.00 0.00 H new ATOM 0 HA PHE A 99 -3.612 0.580 4.867 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -4.428 -0.721 3.012 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -5.455 0.689 3.184 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -4.950 2.726 1.588 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.396 -1.216 1.002 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -4.623 3.220 -0.807 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -3.022 -0.713 -1.382 1.00 0.00 H new ATOM 0 HZ PHE A 99 -3.633 1.503 -2.289 1.00 0.00 H new ATOM 1522 N GLY A 100 -1.551 -0.430 4.119 1.00 0.00 N ATOM 1523 CA GLY A 100 -0.209 -0.969 3.911 1.00 0.00 C ATOM 1524 C GLY A 100 -0.219 -2.486 3.772 1.00 0.00 C ATOM 1525 O GLY A 100 -1.116 -3.178 4.258 1.00 0.00 O ATOM 0 H GLY A 100 -2.101 -0.945 4.807 1.00 0.00 H new ATOM 0 HA2 GLY A 100 0.225 -0.526 3.015 1.00 0.00 H new ATOM 0 HA3 GLY A 100 0.429 -0.686 4.748 1.00 0.00 H new ATOM 1529 N PHE A 101 0.817 -2.953 3.099 1.00 0.00 N ATOM 1530 CA PHE A 101 1.059 -4.388 2.934 1.00 0.00 C ATOM 1531 C PHE A 101 2.483 -4.797 3.306 1.00 0.00 C ATOM 1532 O PHE A 101 3.419 -4.009 3.171 1.00 0.00 O ATOM 1533 CB PHE A 101 0.726 -4.831 1.507 1.00 0.00 C ATOM 1534 CG PHE A 101 1.491 -4.127 0.399 1.00 0.00 C ATOM 1535 CD1 PHE A 101 2.857 -4.335 0.249 1.00 0.00 C ATOM 1536 CD2 PHE A 101 0.805 -3.294 -0.473 1.00 0.00 C ATOM 1537 CE1 PHE A 101 3.548 -3.680 -0.751 1.00 0.00 C ATOM 1538 CE2 PHE A 101 1.492 -2.665 -1.494 1.00 0.00 C ATOM 1539 CZ PHE A 101 2.866 -2.842 -1.628 1.00 0.00 C ATOM 0 H PHE A 101 1.514 -2.358 2.651 1.00 0.00 H new ATOM 0 HA PHE A 101 0.395 -4.899 3.631 1.00 0.00 H new ATOM 0 HB2 PHE A 101 0.912 -5.902 1.427 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -0.340 -4.679 1.339 1.00 0.00 H new ATOM 0 HD1 PHE A 101 3.377 -5.008 0.914 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -0.257 -3.138 -0.355 1.00 0.00 H new ATOM 0 HE1 PHE A 101 4.614 -3.818 -0.852 1.00 0.00 H new ATOM 0 HE2 PHE A 101 0.961 -2.034 -2.191 1.00 0.00 H new ATOM 0 HZ PHE A 101 3.403 -2.329 -2.412 1.00 0.00 H new ATOM 1549 N VAL A 102 2.609 -6.079 3.616 1.00 0.00 N ATOM 1550 CA VAL A 102 3.911 -6.706 3.911 1.00 0.00 C ATOM 1551 C VAL A 102 4.444 -7.533 2.738 1.00 0.00 C ATOM 1552 O VAL A 102 3.870 -8.543 2.334 1.00 0.00 O ATOM 1553 CB VAL A 102 3.927 -7.493 5.229 1.00 0.00 C ATOM 1554 CG1 VAL A 102 3.805 -6.497 6.370 1.00 0.00 C ATOM 1555 CG2 VAL A 102 2.805 -8.519 5.369 1.00 0.00 C ATOM 0 H VAL A 102 1.819 -6.722 3.673 1.00 0.00 H new ATOM 0 HA VAL A 102 4.604 -5.877 4.053 1.00 0.00 H new ATOM 0 HB VAL A 102 4.861 -8.054 5.247 1.00 0.00 H new ATOM 0 HG11 VAL A 102 3.814 -7.030 7.321 1.00 0.00 H new ATOM 0 HG12 VAL A 102 4.643 -5.801 6.337 1.00 0.00 H new ATOM 0 HG13 VAL A 102 2.870 -5.945 6.272 1.00 0.00 H new ATOM 0 HG21 VAL A 102 2.894 -9.027 6.329 1.00 0.00 H new ATOM 0 HG22 VAL A 102 1.841 -8.014 5.314 1.00 0.00 H new ATOM 0 HG23 VAL A 102 2.878 -9.250 4.564 1.00 0.00 H new ATOM 1565 N ALA A 103 5.475 -6.957 2.137 1.00 0.00 N ATOM 1566 CA ALA A 103 6.164 -7.535 0.977 1.00 0.00 C ATOM 1567 C ALA A 103 7.336 -8.423 1.430 1.00 0.00 C ATOM 1568 O ALA A 103 8.320 -7.935 1.989 1.00 0.00 O ATOM 1569 CB ALA A 103 6.626 -6.398 0.059 1.00 0.00 C ATOM 0 H ALA A 103 5.866 -6.065 2.439 1.00 0.00 H new ATOM 0 HA ALA A 103 5.482 -8.177 0.419 1.00 0.00 H new ATOM 0 HB1 ALA A 103 7.140 -6.815 -0.807 1.00 0.00 H new ATOM 0 HB2 ALA A 103 5.761 -5.825 -0.274 1.00 0.00 H new ATOM 0 HB3 ALA A 103 7.307 -5.744 0.604 1.00 0.00 H new ATOM 1575 N ARG A 104 7.087 -9.725 1.338 1.00 0.00 N ATOM 1576 CA ARG A 104 8.026 -10.814 1.653 1.00 0.00 C ATOM 1577 C ARG A 104 8.490 -11.495 0.352 1.00 0.00 C ATOM 1578 O ARG A 104 8.066 -12.580 -0.044 1.00 0.00 O ATOM 1579 CB ARG A 104 7.278 -11.774 2.583 1.00 0.00 C ATOM 1580 CG ARG A 104 8.152 -12.824 3.268 1.00 0.00 C ATOM 1581 CD ARG A 104 7.945 -14.182 2.610 1.00 0.00 C ATOM 1582 NE ARG A 104 8.462 -15.230 3.500 1.00 0.00 N ATOM 1583 CZ ARG A 104 8.535 -16.526 3.200 1.00 0.00 C ATOM 1584 NH1 ARG A 104 8.403 -16.958 1.951 1.00 0.00 N ATOM 1585 NH2 ARG A 104 8.886 -17.394 4.133 1.00 0.00 N ATOM 0 H ARG A 104 6.181 -10.075 1.027 1.00 0.00 H new ATOM 0 HA ARG A 104 8.928 -10.454 2.147 1.00 0.00 H new ATOM 0 HB2 ARG A 104 6.770 -11.190 3.350 1.00 0.00 H new ATOM 0 HB3 ARG A 104 6.506 -12.285 2.008 1.00 0.00 H new ATOM 0 HG2 ARG A 104 9.201 -12.535 3.203 1.00 0.00 H new ATOM 0 HG3 ARG A 104 7.903 -12.882 4.327 1.00 0.00 H new ATOM 0 HD2 ARG A 104 6.886 -14.346 2.411 1.00 0.00 H new ATOM 0 HD3 ARG A 104 8.459 -14.217 1.649 1.00 0.00 H new ATOM 0 HE ARG A 104 8.792 -14.942 4.421 1.00 0.00 H new ATOM 0 HH11 ARG A 104 8.242 -16.292 1.195 1.00 0.00 H new ATOM 0 HH12 ARG A 104 8.463 -17.956 1.747 1.00 0.00 H new ATOM 0 HH21 ARG A 104 9.099 -17.070 5.076 1.00 0.00 H new ATOM 0 HH22 ARG A 104 8.944 -18.388 3.909 1.00 0.00 H new ATOM 1599 N LYS A 105 9.465 -10.846 -0.268 1.00 0.00 N ATOM 1600 CA LYS A 105 10.069 -11.348 -1.517 1.00 0.00 C ATOM 1601 C LYS A 105 11.336 -12.118 -1.157 1.00 0.00 C ATOM 1602 O LYS A 105 12.088 -11.703 -0.272 1.00 0.00 O ATOM 1603 CB LYS A 105 10.335 -10.220 -2.527 1.00 0.00 C ATOM 1604 CG LYS A 105 11.312 -9.142 -2.050 1.00 0.00 C ATOM 1605 CD LYS A 105 12.699 -9.385 -2.642 1.00 0.00 C ATOM 1606 CE LYS A 105 13.721 -8.440 -2.012 1.00 0.00 C ATOM 1607 NZ LYS A 105 14.920 -8.367 -2.855 1.00 0.00 N ATOM 0 H LYS A 105 9.863 -9.968 0.066 1.00 0.00 H new ATOM 0 HA LYS A 105 9.370 -12.018 -2.018 1.00 0.00 H new ATOM 0 HB2 LYS A 105 10.723 -10.660 -3.446 1.00 0.00 H new ATOM 0 HB3 LYS A 105 9.386 -9.745 -2.776 1.00 0.00 H new ATOM 0 HG2 LYS A 105 10.950 -8.157 -2.346 1.00 0.00 H new ATOM 0 HG3 LYS A 105 11.368 -9.148 -0.961 1.00 0.00 H new ATOM 0 HD2 LYS A 105 12.998 -10.419 -2.472 1.00 0.00 H new ATOM 0 HD3 LYS A 105 12.672 -9.234 -3.721 1.00 0.00 H new ATOM 0 HE2 LYS A 105 13.287 -7.447 -1.895 1.00 0.00 H new ATOM 0 HE3 LYS A 105 13.988 -8.791 -1.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 15.611 -7.723 -2.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 15.339 -9.314 -2.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 14.661 -8.012 -3.798 1.00 0.00 H new ATOM 1621 N GLN A 106 11.388 -13.338 -1.688 1.00 0.00 N ATOM 1622 CA GLN A 106 12.487 -14.298 -1.441 1.00 0.00 C ATOM 1623 C GLN A 106 12.603 -14.633 0.061 1.00 0.00 C ATOM 1624 O GLN A 106 13.630 -15.132 0.510 1.00 0.00 O ATOM 1625 CB GLN A 106 13.786 -13.673 -1.983 1.00 0.00 C ATOM 1626 CG GLN A 106 14.632 -14.636 -2.817 1.00 0.00 C ATOM 1627 CD GLN A 106 15.656 -15.429 -2.002 1.00 0.00 C ATOM 1628 OE1 GLN A 106 15.371 -16.231 -1.128 1.00 0.00 O ATOM 1629 NE2 GLN A 106 16.896 -15.351 -2.424 1.00 0.00 N ATOM 0 H GLN A 106 10.666 -13.701 -2.310 1.00 0.00 H new ATOM 0 HA GLN A 106 12.289 -15.240 -1.952 1.00 0.00 H new ATOM 0 HB2 GLN A 106 13.534 -12.805 -2.592 1.00 0.00 H new ATOM 0 HB3 GLN A 106 14.382 -13.313 -1.145 1.00 0.00 H new ATOM 0 HG2 GLN A 106 13.970 -15.335 -3.329 1.00 0.00 H new ATOM 0 HG3 GLN A 106 15.156 -14.070 -3.587 1.00 0.00 H new ATOM 0 HE21 GLN A 106 17.145 -14.684 -3.154 1.00 0.00 H new ATOM 0 HE22 GLN A 106 17.611 -15.957 -2.022 1.00 0.00 H new ATOM 1638 N GLY A 107 11.500 -14.397 0.804 1.00 0.00 N ATOM 1639 CA GLY A 107 11.414 -14.482 2.275 1.00 0.00 C ATOM 1640 C GLY A 107 12.765 -14.403 2.976 1.00 0.00 C ATOM 1641 O GLY A 107 13.254 -15.425 3.448 1.00 0.00 O ATOM 0 H GLY A 107 10.612 -14.132 0.378 1.00 0.00 H new ATOM 0 HA2 GLY A 107 10.778 -13.675 2.640 1.00 0.00 H new ATOM 0 HA3 GLY A 107 10.928 -15.419 2.548 1.00 0.00 H new ATOM 1645 N SER A 108 13.407 -13.250 2.766 1.00 0.00 N ATOM 1646 CA SER A 108 14.787 -12.974 3.211 1.00 0.00 C ATOM 1647 C SER A 108 14.852 -13.044 4.739 1.00 0.00 C ATOM 1648 O SER A 108 14.488 -12.081 5.412 1.00 0.00 O ATOM 1649 CB SER A 108 15.201 -11.586 2.709 1.00 0.00 C ATOM 1650 OG SER A 108 16.621 -11.445 2.792 1.00 0.00 O ATOM 0 H SER A 108 12.980 -12.465 2.274 1.00 0.00 H new ATOM 0 HA SER A 108 15.474 -13.716 2.804 1.00 0.00 H new ATOM 0 HB2 SER A 108 14.872 -11.449 1.679 1.00 0.00 H new ATOM 0 HB3 SER A 108 14.714 -10.814 3.304 1.00 0.00 H new ATOM 0 HG SER A 108 16.849 -10.878 3.558 1.00 0.00 H new ATOM 1656 N THR A 109 14.963 -14.293 5.194 1.00 0.00 N ATOM 1657 CA THR A 109 14.902 -14.753 6.598 1.00 0.00 C ATOM 1658 C THR A 109 13.618 -14.258 7.286 1.00 0.00 C ATOM 1659 O THR A 109 12.568 -14.899 7.223 1.00 0.00 O ATOM 1660 CB THR A 109 16.224 -14.401 7.309 1.00 0.00 C ATOM 1661 OG1 THR A 109 17.273 -15.073 6.607 1.00 0.00 O ATOM 1662 CG2 THR A 109 16.275 -14.805 8.788 1.00 0.00 C ATOM 0 H THR A 109 15.109 -15.072 4.552 1.00 0.00 H new ATOM 0 HA THR A 109 14.821 -15.839 6.650 1.00 0.00 H new ATOM 0 HB THR A 109 16.326 -13.316 7.295 1.00 0.00 H new ATOM 0 HG1 THR A 109 18.133 -14.870 7.031 1.00 0.00 H new ATOM 0 HG21 THR A 109 17.239 -14.521 9.210 1.00 0.00 H new ATOM 0 HG22 THR A 109 15.477 -14.298 9.331 1.00 0.00 H new ATOM 0 HG23 THR A 109 16.145 -15.884 8.875 1.00 0.00 H new ATOM 1670 N THR A 110 13.708 -13.042 7.814 1.00 0.00 N ATOM 1671 CA THR A 110 12.649 -12.345 8.560 1.00 0.00 C ATOM 1672 C THR A 110 12.709 -10.810 8.406 1.00 0.00 C ATOM 1673 O THR A 110 12.597 -10.047 9.367 1.00 0.00 O ATOM 1674 CB THR A 110 12.669 -12.772 10.040 1.00 0.00 C ATOM 1675 OG1 THR A 110 14.007 -12.715 10.533 1.00 0.00 O ATOM 1676 CG2 THR A 110 12.067 -14.164 10.282 1.00 0.00 C ATOM 0 H THR A 110 14.558 -12.484 7.734 1.00 0.00 H new ATOM 0 HA THR A 110 11.696 -12.645 8.123 1.00 0.00 H new ATOM 0 HB THR A 110 12.036 -12.071 10.584 1.00 0.00 H new ATOM 0 HG1 THR A 110 14.020 -12.985 11.475 1.00 0.00 H new ATOM 0 HG21 THR A 110 12.113 -14.401 11.345 1.00 0.00 H new ATOM 0 HG22 THR A 110 11.028 -14.173 9.953 1.00 0.00 H new ATOM 0 HG23 THR A 110 12.632 -14.908 9.720 1.00 0.00 H new ATOM 1684 N ASP A 111 12.770 -10.358 7.153 1.00 0.00 N ATOM 1685 CA ASP A 111 12.934 -8.926 6.823 1.00 0.00 C ATOM 1686 C ASP A 111 12.060 -8.454 5.652 1.00 0.00 C ATOM 1687 O ASP A 111 12.465 -8.460 4.492 1.00 0.00 O ATOM 1688 CB ASP A 111 14.414 -8.515 6.669 1.00 0.00 C ATOM 1689 CG ASP A 111 15.435 -9.633 6.399 1.00 0.00 C ATOM 1690 OD1 ASP A 111 15.629 -10.466 7.315 1.00 0.00 O ATOM 1691 OD2 ASP A 111 16.057 -9.588 5.315 1.00 0.00 O ATOM 0 H ASP A 111 12.708 -10.965 6.335 1.00 0.00 H new ATOM 0 HA ASP A 111 12.555 -8.389 7.692 1.00 0.00 H new ATOM 0 HB2 ASP A 111 14.480 -7.794 5.854 1.00 0.00 H new ATOM 0 HB3 ASP A 111 14.716 -7.996 7.579 1.00 0.00 H new ATOM 1696 N ASN A 112 10.834 -8.093 6.016 1.00 0.00 N ATOM 1697 CA ASN A 112 9.833 -7.576 5.065 1.00 0.00 C ATOM 1698 C ASN A 112 9.701 -6.057 5.138 1.00 0.00 C ATOM 1699 O ASN A 112 9.971 -5.415 6.157 1.00 0.00 O ATOM 1700 CB ASN A 112 8.453 -8.201 5.293 1.00 0.00 C ATOM 1701 CG ASN A 112 8.443 -9.701 5.017 1.00 0.00 C ATOM 1702 OD1 ASN A 112 9.380 -10.286 4.492 1.00 0.00 O ATOM 1703 ND2 ASN A 112 7.418 -10.375 5.486 1.00 0.00 N ATOM 0 H ASN A 112 10.498 -8.147 6.977 1.00 0.00 H new ATOM 0 HA ASN A 112 10.196 -7.854 4.075 1.00 0.00 H new ATOM 0 HB2 ASN A 112 8.141 -8.021 6.322 1.00 0.00 H new ATOM 0 HB3 ASN A 112 7.724 -7.711 4.648 1.00 0.00 H new ATOM 0 HD21 ASN A 112 7.400 -11.392 5.414 1.00 0.00 H new ATOM 0 HD22 ASN A 112 6.640 -9.881 5.923 1.00 0.00 H new ATOM 1710 N VAL A 113 9.222 -5.526 4.023 1.00 0.00 N ATOM 1711 CA VAL A 113 8.946 -4.088 3.921 1.00 0.00 C ATOM 1712 C VAL A 113 7.427 -3.869 3.865 1.00 0.00 C ATOM 1713 O VAL A 113 6.702 -4.590 3.175 1.00 0.00 O ATOM 1714 CB VAL A 113 9.754 -3.511 2.742 1.00 0.00 C ATOM 1715 CG1 VAL A 113 9.028 -3.404 1.395 1.00 0.00 C ATOM 1716 CG2 VAL A 113 10.397 -2.193 3.165 1.00 0.00 C ATOM 0 H VAL A 113 9.015 -6.059 3.178 1.00 0.00 H new ATOM 0 HA VAL A 113 9.278 -3.533 4.799 1.00 0.00 H new ATOM 0 HB VAL A 113 10.521 -4.255 2.524 1.00 0.00 H new ATOM 0 HG11 VAL A 113 9.704 -2.984 0.650 1.00 0.00 H new ATOM 0 HG12 VAL A 113 8.706 -4.395 1.075 1.00 0.00 H new ATOM 0 HG13 VAL A 113 8.158 -2.757 1.501 1.00 0.00 H new ATOM 0 HG21 VAL A 113 10.969 -1.783 2.332 1.00 0.00 H new ATOM 0 HG22 VAL A 113 9.620 -1.485 3.454 1.00 0.00 H new ATOM 0 HG23 VAL A 113 11.062 -2.368 4.011 1.00 0.00 H new ATOM 1726 N CYS A 114 6.980 -2.897 4.643 1.00 0.00 N ATOM 1727 CA CYS A 114 5.561 -2.528 4.632 1.00 0.00 C ATOM 1728 C CYS A 114 5.387 -1.168 3.959 1.00 0.00 C ATOM 1729 O CYS A 114 6.033 -0.187 4.316 1.00 0.00 O ATOM 1730 CB CYS A 114 5.006 -2.548 6.052 1.00 0.00 C ATOM 1731 SG CYS A 114 3.177 -2.522 6.099 1.00 0.00 S ATOM 0 H CYS A 114 7.561 -2.354 5.282 1.00 0.00 H new ATOM 0 HA CYS A 114 4.992 -3.255 4.053 1.00 0.00 H new ATOM 0 HB2 CYS A 114 5.365 -3.440 6.565 1.00 0.00 H new ATOM 0 HB3 CYS A 114 5.391 -1.688 6.600 1.00 0.00 H new ATOM 0 HG CYS A 114 2.749 -3.472 6.877 1.00 0.00 H new ATOM 1737 N HIS A 115 4.750 -1.243 2.801 1.00 0.00 N ATOM 1738 CA HIS A 115 4.476 -0.043 1.990 1.00 0.00 C ATOM 1739 C HIS A 115 3.231 0.684 2.481 1.00 0.00 C ATOM 1740 O HIS A 115 2.291 0.044 2.940 1.00 0.00 O ATOM 1741 CB HIS A 115 4.276 -0.413 0.529 1.00 0.00 C ATOM 1742 CG HIS A 115 5.618 -0.470 -0.203 1.00 0.00 C ATOM 1743 ND1 HIS A 115 6.409 -1.523 -0.268 1.00 0.00 N ATOM 1744 CD2 HIS A 115 6.139 0.520 -0.914 1.00 0.00 C ATOM 1745 CE1 HIS A 115 7.440 -1.194 -1.051 1.00 0.00 C ATOM 1746 NE2 HIS A 115 7.278 0.066 -1.432 1.00 0.00 N ATOM 0 H HIS A 115 4.410 -2.114 2.393 1.00 0.00 H new ATOM 0 HA HIS A 115 5.340 0.614 2.090 1.00 0.00 H new ATOM 0 HB2 HIS A 115 3.776 -1.379 0.459 1.00 0.00 H new ATOM 0 HB3 HIS A 115 3.625 0.318 0.049 1.00 0.00 H new ATOM 0 HD1 HIS A 115 6.261 -2.421 0.193 1.00 0.00 H new ATOM 0 HD2 HIS A 115 5.720 1.506 -1.047 1.00 0.00 H new ATOM 0 HE1 HIS A 115 8.261 -1.840 -1.325 1.00 0.00 H new ATOM 1754 N LEU A 116 3.285 2.003 2.394 1.00 0.00 N ATOM 1755 CA LEU A 116 2.149 2.857 2.763 1.00 0.00 C ATOM 1756 C LEU A 116 1.479 3.522 1.568 1.00 0.00 C ATOM 1757 O LEU A 116 2.139 3.990 0.638 1.00 0.00 O ATOM 1758 CB LEU A 116 2.584 3.921 3.775 1.00 0.00 C ATOM 1759 CG LEU A 116 2.571 3.466 5.237 1.00 0.00 C ATOM 1760 CD1 LEU A 116 1.197 2.919 5.599 1.00 0.00 C ATOM 1761 CD2 LEU A 116 3.670 2.458 5.558 1.00 0.00 C ATOM 0 H LEU A 116 4.105 2.516 2.070 1.00 0.00 H new ATOM 0 HA LEU A 116 1.408 2.197 3.213 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.591 4.252 3.522 1.00 0.00 H new ATOM 0 HB3 LEU A 116 1.929 4.787 3.674 1.00 0.00 H new ATOM 0 HG LEU A 116 2.781 4.342 5.851 1.00 0.00 H new ATOM 0 HD11 LEU A 116 1.196 2.598 6.641 1.00 0.00 H new ATOM 0 HD12 LEU A 116 0.447 3.697 5.459 1.00 0.00 H new ATOM 0 HD13 LEU A 116 0.963 2.070 4.957 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.608 2.174 6.609 1.00 0.00 H new ATOM 0 HD22 LEU A 116 3.545 1.572 4.935 1.00 0.00 H new ATOM 0 HD23 LEU A 116 4.644 2.906 5.360 1.00 0.00 H new ATOM 1773 N PHE A 117 0.156 3.545 1.665 1.00 0.00 N ATOM 1774 CA PHE A 117 -0.714 4.085 0.612 1.00 0.00 C ATOM 1775 C PHE A 117 -1.974 4.712 1.198 1.00 0.00 C ATOM 1776 O PHE A 117 -2.579 4.169 2.115 1.00 0.00 O ATOM 1777 CB PHE A 117 -1.139 2.950 -0.318 1.00 0.00 C ATOM 1778 CG PHE A 117 0.026 2.339 -1.079 1.00 0.00 C ATOM 1779 CD1 PHE A 117 0.580 3.066 -2.124 1.00 0.00 C ATOM 1780 CD2 PHE A 117 0.561 1.112 -0.708 1.00 0.00 C ATOM 1781 CE1 PHE A 117 1.656 2.564 -2.826 1.00 0.00 C ATOM 1782 CE2 PHE A 117 1.649 0.621 -1.408 1.00 0.00 C ATOM 1783 CZ PHE A 117 2.199 1.336 -2.459 1.00 0.00 C ATOM 0 H PHE A 117 -0.351 3.190 2.476 1.00 0.00 H new ATOM 0 HA PHE A 117 -0.154 4.850 0.074 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -1.631 2.173 0.267 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -1.874 3.327 -1.030 1.00 0.00 H new ATOM 0 HD1 PHE A 117 0.167 4.028 -2.388 1.00 0.00 H new ATOM 0 HD2 PHE A 117 0.136 0.552 0.111 1.00 0.00 H new ATOM 0 HE1 PHE A 117 2.074 3.119 -3.653 1.00 0.00 H new ATOM 0 HE2 PHE A 117 2.075 -0.332 -1.131 1.00 0.00 H new ATOM 0 HZ PHE A 117 3.050 0.941 -2.994 1.00 0.00 H new ATOM 1793 N ALA A 118 -2.358 5.837 0.621 1.00 0.00 N ATOM 1794 CA ALA A 118 -3.603 6.539 0.975 1.00 0.00 C ATOM 1795 C ALA A 118 -4.530 6.636 -0.237 1.00 0.00 C ATOM 1796 O ALA A 118 -4.083 6.656 -1.385 1.00 0.00 O ATOM 1797 CB ALA A 118 -3.274 7.947 1.457 1.00 0.00 C ATOM 0 H ALA A 118 -1.820 6.301 -0.111 1.00 0.00 H new ATOM 0 HA ALA A 118 -4.104 5.977 1.764 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -4.196 8.467 1.719 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -2.628 7.890 2.333 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -2.763 8.493 0.664 1.00 0.00 H new ATOM 1803 N GLU A 119 -5.830 6.638 0.034 1.00 0.00 N ATOM 1804 CA GLU A 119 -6.837 6.870 -1.020 1.00 0.00 C ATOM 1805 C GLU A 119 -6.620 8.256 -1.661 1.00 0.00 C ATOM 1806 O GLU A 119 -6.448 9.258 -0.975 1.00 0.00 O ATOM 1807 CB GLU A 119 -8.248 6.780 -0.430 1.00 0.00 C ATOM 1808 CG GLU A 119 -9.311 6.973 -1.518 1.00 0.00 C ATOM 1809 CD GLU A 119 -10.560 7.659 -0.970 1.00 0.00 C ATOM 1810 OE1 GLU A 119 -10.494 8.892 -0.793 1.00 0.00 O ATOM 1811 OE2 GLU A 119 -11.545 6.931 -0.734 1.00 0.00 O ATOM 0 H GLU A 119 -6.219 6.484 0.964 1.00 0.00 H new ATOM 0 HA GLU A 119 -6.727 6.104 -1.787 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -8.385 5.811 0.049 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -8.372 7.538 0.343 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -8.896 7.568 -2.331 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -9.582 6.004 -1.938 1.00 0.00 H new ATOM 1818 N LEU A 120 -6.643 8.263 -2.988 1.00 0.00 N ATOM 1819 CA LEU A 120 -6.614 9.518 -3.763 1.00 0.00 C ATOM 1820 C LEU A 120 -7.974 9.789 -4.420 1.00 0.00 C ATOM 1821 O LEU A 120 -8.589 10.829 -4.195 1.00 0.00 O ATOM 1822 CB LEU A 120 -5.447 9.487 -4.770 1.00 0.00 C ATOM 1823 CG LEU A 120 -5.299 10.647 -5.777 1.00 0.00 C ATOM 1824 CD1 LEU A 120 -6.114 10.409 -7.049 1.00 0.00 C ATOM 1825 CD2 LEU A 120 -5.637 12.027 -5.198 1.00 0.00 C ATOM 0 H LEU A 120 -6.682 7.419 -3.559 1.00 0.00 H new ATOM 0 HA LEU A 120 -6.434 10.357 -3.091 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -4.521 9.426 -4.199 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -5.530 8.563 -5.342 1.00 0.00 H new ATOM 0 HG LEU A 120 -4.238 10.657 -6.025 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -5.980 11.250 -7.729 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -5.774 9.493 -7.533 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -7.169 10.314 -6.793 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -5.508 12.787 -5.969 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -6.671 12.033 -4.852 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -4.973 12.243 -4.361 1.00 0.00 H new ATOM 1837 N ASP A 121 -8.434 8.825 -5.214 1.00 0.00 N ATOM 1838 CA ASP A 121 -9.727 8.954 -5.898 1.00 0.00 C ATOM 1839 C ASP A 121 -10.883 8.610 -4.945 1.00 0.00 C ATOM 1840 O ASP A 121 -10.880 7.523 -4.366 1.00 0.00 O ATOM 1841 CB ASP A 121 -9.796 8.108 -7.178 1.00 0.00 C ATOM 1842 CG ASP A 121 -9.135 8.770 -8.397 1.00 0.00 C ATOM 1843 OD1 ASP A 121 -9.020 10.014 -8.406 1.00 0.00 O ATOM 1844 OD2 ASP A 121 -8.781 8.006 -9.320 1.00 0.00 O ATOM 0 H ASP A 121 -7.940 7.953 -5.401 1.00 0.00 H new ATOM 0 HA ASP A 121 -9.828 9.996 -6.203 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -9.316 7.147 -6.993 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -10.841 7.902 -7.410 1.00 0.00 H new ATOM 1849 N PRO A 122 -11.902 9.475 -4.872 1.00 0.00 N ATOM 1850 CA PRO A 122 -13.129 9.189 -4.105 1.00 0.00 C ATOM 1851 C PRO A 122 -13.986 8.068 -4.725 1.00 0.00 C ATOM 1852 O PRO A 122 -14.809 7.473 -4.043 1.00 0.00 O ATOM 1853 CB PRO A 122 -13.853 10.532 -4.022 1.00 0.00 C ATOM 1854 CG PRO A 122 -13.442 11.239 -5.313 1.00 0.00 C ATOM 1855 CD PRO A 122 -11.991 10.798 -5.525 1.00 0.00 C ATOM 0 HA PRO A 122 -12.903 8.795 -3.114 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -14.934 10.402 -3.962 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -13.550 11.097 -3.141 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -14.076 10.945 -6.149 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -13.521 12.322 -5.219 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -11.748 10.733 -6.586 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -11.293 11.507 -5.080 1.00 0.00 H new ATOM 1863 N ASP A 123 -13.619 7.654 -5.941 1.00 0.00 N ATOM 1864 CA ASP A 123 -14.268 6.543 -6.665 1.00 0.00 C ATOM 1865 C ASP A 123 -13.532 5.204 -6.475 1.00 0.00 C ATOM 1866 O ASP A 123 -13.842 4.216 -7.137 1.00 0.00 O ATOM 1867 CB ASP A 123 -14.306 6.920 -8.150 1.00 0.00 C ATOM 1868 CG ASP A 123 -15.721 6.965 -8.744 1.00 0.00 C ATOM 1869 OD1 ASP A 123 -16.697 6.901 -7.964 1.00 0.00 O ATOM 1870 OD2 ASP A 123 -15.787 7.174 -9.973 1.00 0.00 O ATOM 0 H ASP A 123 -12.854 8.082 -6.462 1.00 0.00 H new ATOM 0 HA ASP A 123 -15.272 6.398 -6.266 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -13.837 7.895 -8.279 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -13.709 6.202 -8.712 1.00 0.00 H new ATOM 1875 N GLN A 124 -12.610 5.193 -5.511 1.00 0.00 N ATOM 1876 CA GLN A 124 -11.771 4.037 -5.158 1.00 0.00 C ATOM 1877 C GLN A 124 -11.125 4.212 -3.771 1.00 0.00 C ATOM 1878 O GLN A 124 -10.003 4.714 -3.657 1.00 0.00 O ATOM 1879 CB GLN A 124 -10.707 3.737 -6.227 1.00 0.00 C ATOM 1880 CG GLN A 124 -11.088 2.510 -7.064 1.00 0.00 C ATOM 1881 CD GLN A 124 -11.347 1.245 -6.232 1.00 0.00 C ATOM 1882 OE1 GLN A 124 -11.028 1.125 -5.053 1.00 0.00 O ATOM 1883 NE2 GLN A 124 -12.015 0.284 -6.821 1.00 0.00 N ATOM 0 H GLN A 124 -12.417 6.012 -4.934 1.00 0.00 H new ATOM 0 HA GLN A 124 -12.435 3.173 -5.116 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -10.590 4.602 -6.879 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -9.744 3.567 -5.746 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -11.982 2.741 -7.644 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -10.289 2.307 -7.777 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -12.284 0.376 -7.801 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -12.266 -0.556 -6.300 1.00 0.00 H new ATOM 1892 N PRO A 125 -11.896 3.927 -2.712 1.00 0.00 N ATOM 1893 CA PRO A 125 -11.389 3.986 -1.332 1.00 0.00 C ATOM 1894 C PRO A 125 -10.368 2.883 -1.070 1.00 0.00 C ATOM 1895 O PRO A 125 -10.433 1.799 -1.643 1.00 0.00 O ATOM 1896 CB PRO A 125 -12.623 3.892 -0.431 1.00 0.00 C ATOM 1897 CG PRO A 125 -13.649 3.151 -1.283 1.00 0.00 C ATOM 1898 CD PRO A 125 -13.335 3.588 -2.717 1.00 0.00 C ATOM 0 HA PRO A 125 -10.849 4.911 -1.133 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -12.404 3.351 0.490 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -12.983 4.880 -0.143 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -13.557 2.071 -1.167 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -14.668 3.417 -1.000 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -13.549 2.790 -3.428 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -13.941 4.446 -3.009 1.00 0.00 H new ATOM 1906 N ALA A 126 -9.524 3.141 -0.079 1.00 0.00 N ATOM 1907 CA ALA A 126 -8.472 2.198 0.339 1.00 0.00 C ATOM 1908 C ALA A 126 -9.049 0.830 0.747 1.00 0.00 C ATOM 1909 O ALA A 126 -8.576 -0.194 0.272 1.00 0.00 O ATOM 1910 CB ALA A 126 -7.699 2.846 1.480 1.00 0.00 C ATOM 0 H ALA A 126 -9.542 4.005 0.462 1.00 0.00 H new ATOM 0 HA ALA A 126 -7.805 1.995 -0.499 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -6.910 2.172 1.814 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -7.256 3.780 1.135 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -8.377 3.050 2.309 1.00 0.00 H new ATOM 1916 N ALA A 127 -10.199 0.853 1.426 1.00 0.00 N ATOM 1917 CA ALA A 127 -11.012 -0.348 1.716 1.00 0.00 C ATOM 1918 C ALA A 127 -11.393 -1.166 0.471 1.00 0.00 C ATOM 1919 O ALA A 127 -11.037 -2.337 0.398 1.00 0.00 O ATOM 1920 CB ALA A 127 -12.259 0.041 2.514 1.00 0.00 C ATOM 0 H ALA A 127 -10.603 1.713 1.797 1.00 0.00 H new ATOM 0 HA ALA A 127 -10.380 -1.006 2.313 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -12.851 -0.851 2.722 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -11.960 0.505 3.454 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -12.856 0.746 1.935 1.00 0.00 H new ATOM 1926 N ALA A 128 -11.844 -0.487 -0.581 1.00 0.00 N ATOM 1927 CA ALA A 128 -12.130 -1.123 -1.886 1.00 0.00 C ATOM 1928 C ALA A 128 -10.866 -1.643 -2.600 1.00 0.00 C ATOM 1929 O ALA A 128 -10.890 -2.714 -3.201 1.00 0.00 O ATOM 1930 CB ALA A 128 -12.904 -0.158 -2.786 1.00 0.00 C ATOM 0 H ALA A 128 -12.024 0.517 -0.564 1.00 0.00 H new ATOM 0 HA ALA A 128 -12.744 -2.000 -1.681 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -13.108 -0.638 -3.743 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -13.845 0.111 -2.307 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -12.311 0.741 -2.950 1.00 0.00 H new ATOM 1936 N ILE A 129 -9.733 -1.008 -2.299 1.00 0.00 N ATOM 1937 CA ILE A 129 -8.392 -1.410 -2.770 1.00 0.00 C ATOM 1938 C ILE A 129 -7.770 -2.540 -1.922 1.00 0.00 C ATOM 1939 O ILE A 129 -6.889 -3.256 -2.388 1.00 0.00 O ATOM 1940 CB ILE A 129 -7.524 -0.141 -2.948 1.00 0.00 C ATOM 1941 CG1 ILE A 129 -8.005 0.675 -4.160 1.00 0.00 C ATOM 1942 CG2 ILE A 129 -6.009 -0.377 -3.032 1.00 0.00 C ATOM 1943 CD1 ILE A 129 -8.048 -0.099 -5.490 1.00 0.00 C ATOM 0 H ILE A 129 -9.714 -0.178 -1.706 1.00 0.00 H new ATOM 0 HA ILE A 129 -8.465 -1.879 -3.751 1.00 0.00 H new ATOM 0 HB ILE A 129 -7.667 0.421 -2.025 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -9.003 1.058 -3.948 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -7.351 1.538 -4.280 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -5.498 0.578 -3.156 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -5.664 -0.857 -2.116 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -5.788 -1.020 -3.884 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -8.399 0.560 -6.284 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -7.049 -0.460 -5.734 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -8.727 -0.947 -5.396 1.00 0.00 H new ATOM 1955 N VAL A 130 -8.368 -2.797 -0.767 1.00 0.00 N ATOM 1956 CA VAL A 130 -7.987 -3.879 0.155 1.00 0.00 C ATOM 1957 C VAL A 130 -8.932 -5.091 0.051 1.00 0.00 C ATOM 1958 O VAL A 130 -8.512 -6.226 0.251 1.00 0.00 O ATOM 1959 CB VAL A 130 -7.844 -3.250 1.549 1.00 0.00 C ATOM 1960 CG1 VAL A 130 -8.082 -4.211 2.716 1.00 0.00 C ATOM 1961 CG2 VAL A 130 -6.433 -2.665 1.656 1.00 0.00 C ATOM 0 H VAL A 130 -9.157 -2.246 -0.428 1.00 0.00 H new ATOM 0 HA VAL A 130 -7.026 -4.320 -0.108 1.00 0.00 H new ATOM 0 HB VAL A 130 -8.622 -2.492 1.636 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -7.959 -3.677 3.658 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -9.093 -4.613 2.656 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -7.363 -5.029 2.666 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -6.301 -2.210 2.638 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -5.699 -3.459 1.523 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -6.293 -1.908 0.884 1.00 0.00 H new ATOM 1971 N ASN A 131 -10.176 -4.827 -0.331 1.00 0.00 N ATOM 1972 CA ASN A 131 -11.185 -5.871 -0.575 1.00 0.00 C ATOM 1973 C ASN A 131 -10.883 -6.616 -1.886 1.00 0.00 C ATOM 1974 O ASN A 131 -10.921 -7.840 -1.935 1.00 0.00 O ATOM 1975 CB ASN A 131 -12.572 -5.229 -0.627 1.00 0.00 C ATOM 1976 CG ASN A 131 -13.643 -6.280 -0.332 1.00 0.00 C ATOM 1977 OD1 ASN A 131 -13.830 -7.252 -1.043 1.00 0.00 O ATOM 1978 ND2 ASN A 131 -14.339 -6.110 0.769 1.00 0.00 N ATOM 0 H ASN A 131 -10.523 -3.880 -0.483 1.00 0.00 H new ATOM 0 HA ASN A 131 -11.157 -6.597 0.237 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -12.635 -4.419 0.100 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -12.742 -4.789 -1.610 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -15.045 -6.796 1.037 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -14.173 -5.292 1.356 1.00 0.00 H new ATOM 1985 N PHE A 132 -10.381 -5.862 -2.863 1.00 0.00 N ATOM 1986 CA PHE A 132 -9.949 -6.393 -4.163 1.00 0.00 C ATOM 1987 C PHE A 132 -8.570 -7.068 -4.115 1.00 0.00 C ATOM 1988 O PHE A 132 -8.434 -8.208 -4.553 1.00 0.00 O ATOM 1989 CB PHE A 132 -10.000 -5.242 -5.172 1.00 0.00 C ATOM 1990 CG PHE A 132 -9.217 -5.519 -6.453 1.00 0.00 C ATOM 1991 CD1 PHE A 132 -9.447 -6.652 -7.223 1.00 0.00 C ATOM 1992 CD2 PHE A 132 -8.215 -4.624 -6.802 1.00 0.00 C ATOM 1993 CE1 PHE A 132 -8.683 -6.874 -8.359 1.00 0.00 C ATOM 1994 CE2 PHE A 132 -7.460 -4.853 -7.935 1.00 0.00 C ATOM 1995 CZ PHE A 132 -7.676 -5.987 -8.711 1.00 0.00 C ATOM 0 H PHE A 132 -10.260 -4.853 -2.777 1.00 0.00 H new ATOM 0 HA PHE A 132 -10.625 -7.192 -4.468 1.00 0.00 H new ATOM 0 HB2 PHE A 132 -11.040 -5.040 -5.428 1.00 0.00 H new ATOM 0 HB3 PHE A 132 -9.606 -4.340 -4.703 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -10.216 -7.355 -6.939 1.00 0.00 H new ATOM 0 HD2 PHE A 132 -8.027 -3.754 -6.191 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -8.873 -7.742 -8.973 1.00 0.00 H new ATOM 0 HE2 PHE A 132 -6.695 -4.146 -8.221 1.00 0.00 H new ATOM 0 HZ PHE A 132 -7.064 -6.176 -9.581 1.00 0.00 H new ATOM 2005 N VAL A 133 -7.585 -6.398 -3.517 1.00 0.00 N ATOM 2006 CA VAL A 133 -6.209 -6.931 -3.425 1.00 0.00 C ATOM 2007 C VAL A 133 -6.176 -8.278 -2.664 1.00 0.00 C ATOM 2008 O VAL A 133 -5.456 -9.199 -3.045 1.00 0.00 O ATOM 2009 CB VAL A 133 -5.286 -5.849 -2.833 1.00 0.00 C ATOM 2010 CG1 VAL A 133 -5.391 -5.710 -1.312 1.00 0.00 C ATOM 2011 CG2 VAL A 133 -3.843 -6.019 -3.312 1.00 0.00 C ATOM 0 H VAL A 133 -7.706 -5.482 -3.085 1.00 0.00 H new ATOM 0 HA VAL A 133 -5.830 -7.166 -4.420 1.00 0.00 H new ATOM 0 HB VAL A 133 -5.649 -4.898 -3.223 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -4.712 -4.929 -0.970 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -6.413 -5.446 -1.040 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -5.123 -6.656 -0.841 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -3.220 -5.239 -2.875 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -3.470 -6.996 -3.004 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -3.809 -5.944 -4.399 1.00 0.00 H new ATOM 2021 N SER A 134 -7.083 -8.382 -1.691 1.00 0.00 N ATOM 2022 CA SER A 134 -7.312 -9.603 -0.902 1.00 0.00 C ATOM 2023 C SER A 134 -8.192 -10.621 -1.648 1.00 0.00 C ATOM 2024 O SER A 134 -7.862 -11.798 -1.648 1.00 0.00 O ATOM 2025 CB SER A 134 -7.919 -9.257 0.457 1.00 0.00 C ATOM 2026 OG SER A 134 -7.736 -10.352 1.352 1.00 0.00 O ATOM 0 H SER A 134 -7.692 -7.609 -1.421 1.00 0.00 H new ATOM 0 HA SER A 134 -6.341 -10.074 -0.745 1.00 0.00 H new ATOM 0 HB2 SER A 134 -7.447 -8.361 0.860 1.00 0.00 H new ATOM 0 HB3 SER A 134 -8.981 -9.036 0.347 1.00 0.00 H new ATOM 0 HG SER A 134 -8.124 -10.130 2.224 1.00 0.00 H new ATOM 2032 N ARG A 135 -9.116 -10.153 -2.489 1.00 0.00 N ATOM 2033 CA ARG A 135 -9.934 -11.029 -3.362 1.00 0.00 C ATOM 2034 C ARG A 135 -9.155 -11.657 -4.530 1.00 0.00 C ATOM 2035 O ARG A 135 -9.564 -12.679 -5.077 1.00 0.00 O ATOM 2036 CB ARG A 135 -11.188 -10.323 -3.885 1.00 0.00 C ATOM 2037 CG ARG A 135 -12.377 -10.598 -2.960 1.00 0.00 C ATOM 2038 CD ARG A 135 -13.587 -9.728 -3.312 1.00 0.00 C ATOM 2039 NE ARG A 135 -14.571 -10.416 -4.170 1.00 0.00 N ATOM 2040 CZ ARG A 135 -15.499 -9.815 -4.923 1.00 0.00 C ATOM 2041 NH1 ARG A 135 -15.544 -8.494 -5.046 1.00 0.00 N ATOM 2042 NH2 ARG A 135 -16.385 -10.530 -5.600 1.00 0.00 N ATOM 0 H ARG A 135 -9.326 -9.160 -2.592 1.00 0.00 H new ATOM 0 HA ARG A 135 -10.238 -11.848 -2.710 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -11.009 -9.250 -3.949 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -11.415 -10.669 -4.893 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -12.654 -11.650 -3.028 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -12.084 -10.412 -1.927 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -14.077 -9.410 -2.392 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -13.242 -8.826 -3.818 1.00 0.00 H new ATOM 0 HE ARG A 135 -14.541 -11.435 -4.191 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -14.861 -7.913 -4.560 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -16.262 -8.060 -5.626 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -16.364 -11.549 -5.550 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -17.089 -10.062 -6.171 1.00 0.00 H new ATOM 2056 N VAL A 136 -8.068 -10.998 -4.929 1.00 0.00 N ATOM 2057 CA VAL A 136 -7.120 -11.488 -5.959 1.00 0.00 C ATOM 2058 C VAL A 136 -6.255 -12.653 -5.447 1.00 0.00 C ATOM 2059 O VAL A 136 -5.864 -13.526 -6.220 1.00 0.00 O ATOM 2060 CB VAL A 136 -6.287 -10.306 -6.493 1.00 0.00 C ATOM 2061 CG1 VAL A 136 -5.098 -10.682 -7.387 1.00 0.00 C ATOM 2062 CG2 VAL A 136 -7.205 -9.467 -7.367 1.00 0.00 C ATOM 0 H VAL A 136 -7.806 -10.090 -4.545 1.00 0.00 H new ATOM 0 HA VAL A 136 -7.687 -11.904 -6.792 1.00 0.00 H new ATOM 0 HB VAL A 136 -5.886 -9.806 -5.611 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -4.582 -9.776 -7.707 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -4.408 -11.314 -6.828 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -5.458 -11.223 -8.262 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -6.651 -8.617 -7.766 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -7.579 -10.075 -8.191 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -8.044 -9.106 -6.772 1.00 0.00 H new ATOM 2072 N MET A 137 -5.909 -12.584 -4.167 1.00 0.00 N ATOM 2073 CA MET A 137 -5.119 -13.629 -3.484 1.00 0.00 C ATOM 2074 C MET A 137 -5.962 -14.684 -2.745 1.00 0.00 C ATOM 2075 O MET A 137 -5.479 -15.776 -2.460 1.00 0.00 O ATOM 2076 CB MET A 137 -4.093 -12.996 -2.534 1.00 0.00 C ATOM 2077 CG MET A 137 -4.708 -12.057 -1.492 1.00 0.00 C ATOM 2078 SD MET A 137 -3.497 -11.337 -0.329 1.00 0.00 S ATOM 2079 CE MET A 137 -3.426 -12.683 0.832 1.00 0.00 C ATOM 0 H MET A 137 -6.164 -11.803 -3.562 1.00 0.00 H new ATOM 0 HA MET A 137 -4.603 -14.170 -4.277 1.00 0.00 H new ATOM 0 HB2 MET A 137 -3.552 -13.790 -2.019 1.00 0.00 H new ATOM 0 HB3 MET A 137 -3.362 -12.441 -3.122 1.00 0.00 H new ATOM 0 HG2 MET A 137 -5.225 -11.248 -2.008 1.00 0.00 H new ATOM 0 HG3 MET A 137 -5.460 -12.605 -0.924 1.00 0.00 H new ATOM 0 HE1 MET A 137 -3.436 -12.288 1.848 1.00 0.00 H new ATOM 0 HE2 MET A 137 -4.288 -13.334 0.687 1.00 0.00 H new ATOM 0 HE3 MET A 137 -2.510 -13.253 0.673 1.00 0.00 H new ATOM 2089 N LEU A 138 -7.180 -14.286 -2.376 1.00 0.00 N ATOM 2090 CA LEU A 138 -8.172 -15.072 -1.619 1.00 0.00 C ATOM 2091 C LEU A 138 -9.580 -14.475 -1.768 1.00 0.00 C ATOM 2092 O LEU A 138 -10.039 -13.634 -0.994 1.00 0.00 O ATOM 2093 CB LEU A 138 -7.781 -15.143 -0.134 1.00 0.00 C ATOM 2094 CG LEU A 138 -6.992 -16.410 0.209 1.00 0.00 C ATOM 2095 CD1 LEU A 138 -6.426 -16.298 1.624 1.00 0.00 C ATOM 2096 CD2 LEU A 138 -7.887 -17.650 0.108 1.00 0.00 C ATOM 0 H LEU A 138 -7.526 -13.355 -2.607 1.00 0.00 H new ATOM 0 HA LEU A 138 -8.184 -16.082 -2.029 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -7.184 -14.268 0.123 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -8.683 -15.105 0.477 1.00 0.00 H new ATOM 0 HG LEU A 138 -6.174 -16.513 -0.505 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -5.865 -17.201 1.864 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -5.765 -15.434 1.684 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -7.244 -16.179 2.335 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -7.307 -18.539 0.356 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -8.720 -17.555 0.804 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -8.272 -17.739 -0.908 1.00 0.00 H new ATOM 2108 N GLY A 139 -10.246 -14.959 -2.823 1.00 0.00 N ATOM 2109 CA GLY A 139 -11.621 -14.555 -3.169 1.00 0.00 C ATOM 2110 C GLY A 139 -12.622 -15.201 -2.206 1.00 0.00 C ATOM 2111 O GLY A 139 -12.966 -16.369 -2.380 1.00 0.00 O ATOM 0 H GLY A 139 -9.848 -15.644 -3.465 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -11.711 -13.470 -3.124 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -11.848 -14.851 -4.193 1.00 0.00 H new ATOM 2115 N SER A 140 -12.907 -14.483 -1.121 1.00 0.00 N ATOM 2116 CA SER A 140 -13.847 -14.928 -0.069 1.00 0.00 C ATOM 2117 C SER A 140 -14.070 -13.807 0.950 1.00 0.00 C ATOM 2118 O SER A 140 -13.143 -13.078 1.303 1.00 0.00 O ATOM 2119 CB SER A 140 -13.284 -16.144 0.679 1.00 0.00 C ATOM 2120 OG SER A 140 -14.352 -16.915 1.234 1.00 0.00 O ATOM 0 H SER A 140 -12.494 -13.569 -0.937 1.00 0.00 H new ATOM 0 HA SER A 140 -14.787 -15.192 -0.554 1.00 0.00 H new ATOM 0 HB2 SER A 140 -12.696 -16.760 -0.002 1.00 0.00 H new ATOM 0 HB3 SER A 140 -12.612 -15.815 1.472 1.00 0.00 H new ATOM 0 HG SER A 140 -13.984 -17.690 1.708 1.00 0.00 H new ATOM 2126 N GLY A 141 -15.311 -13.738 1.438 1.00 0.00 N ATOM 2127 CA GLY A 141 -15.718 -12.726 2.430 1.00 0.00 C ATOM 2128 C GLY A 141 -16.358 -13.413 3.635 1.00 0.00 C ATOM 2129 O GLY A 141 -17.580 -13.431 3.758 1.00 0.00 O ATOM 0 H GLY A 141 -16.060 -14.374 1.163 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -14.852 -12.146 2.748 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -16.423 -12.026 1.981 1.00 0.00 H new ATOM 2133 N GLN A 142 -15.513 -14.019 4.472 1.00 0.00 N ATOM 2134 CA GLN A 142 -15.954 -14.724 5.699 1.00 0.00 C ATOM 2135 C GLN A 142 -16.953 -13.891 6.529 1.00 0.00 C ATOM 2136 O GLN A 142 -17.985 -14.400 6.965 1.00 0.00 O ATOM 2137 CB GLN A 142 -14.732 -15.100 6.550 1.00 0.00 C ATOM 2138 CG GLN A 142 -15.105 -15.962 7.765 1.00 0.00 C ATOM 2139 CD GLN A 142 -14.707 -15.310 9.093 1.00 0.00 C ATOM 2140 OE1 GLN A 142 -13.599 -14.834 9.298 1.00 0.00 O ATOM 2141 NE2 GLN A 142 -15.608 -15.314 10.049 1.00 0.00 N ATOM 0 H GLN A 142 -14.504 -14.040 4.327 1.00 0.00 H new ATOM 0 HA GLN A 142 -16.477 -15.629 5.389 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -14.015 -15.640 5.932 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -14.237 -14.191 6.892 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -16.180 -16.144 7.761 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -14.617 -16.933 7.681 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -16.532 -15.711 9.878 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -15.384 -14.920 10.963 1.00 0.00 H new ATOM 2150 N LYS A 143 -16.635 -12.610 6.689 1.00 0.00 N ATOM 2151 CA LYS A 143 -17.530 -11.643 7.345 1.00 0.00 C ATOM 2152 C LYS A 143 -18.013 -10.653 6.273 1.00 0.00 C ATOM 2153 O LYS A 143 -17.211 -10.114 5.511 1.00 0.00 O ATOM 2154 CB LYS A 143 -16.741 -10.897 8.423 1.00 0.00 C ATOM 2155 CG LYS A 143 -17.639 -10.424 9.567 1.00 0.00 C ATOM 2156 CD LYS A 143 -17.589 -11.413 10.733 1.00 0.00 C ATOM 2157 CE LYS A 143 -18.403 -10.889 11.918 1.00 0.00 C ATOM 2158 NZ LYS A 143 -18.215 -11.733 13.106 1.00 0.00 N ATOM 0 H LYS A 143 -15.754 -12.207 6.371 1.00 0.00 H new ATOM 0 HA LYS A 143 -18.382 -12.142 7.807 1.00 0.00 H new ATOM 0 HB2 LYS A 143 -15.963 -11.549 8.819 1.00 0.00 H new ATOM 0 HB3 LYS A 143 -16.240 -10.038 7.976 1.00 0.00 H new ATOM 0 HG2 LYS A 143 -17.319 -9.438 9.905 1.00 0.00 H new ATOM 0 HG3 LYS A 143 -18.665 -10.322 9.213 1.00 0.00 H new ATOM 0 HD2 LYS A 143 -17.980 -12.379 10.415 1.00 0.00 H new ATOM 0 HD3 LYS A 143 -16.555 -11.573 11.037 1.00 0.00 H new ATOM 0 HE2 LYS A 143 -18.103 -9.866 12.144 1.00 0.00 H new ATOM 0 HE3 LYS A 143 -19.460 -10.860 11.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 -18.779 -11.354 13.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 -18.524 -12.703 12.895 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 -17.209 -11.740 13.372 1.00 0.00 H new ATOM 2172 N ARG A 144 -19.333 -10.467 6.229 1.00 0.00 N ATOM 2173 CA ARG A 144 -20.024 -9.618 5.221 1.00 0.00 C ATOM 2174 C ARG A 144 -19.889 -10.081 3.754 1.00 0.00 C ATOM 2175 O ARG A 144 -20.496 -9.411 2.887 1.00 0.00 O ATOM 2176 CB ARG A 144 -19.587 -8.149 5.275 1.00 0.00 C ATOM 2177 CG ARG A 144 -20.411 -7.287 6.222 1.00 0.00 C ATOM 2178 CD ARG A 144 -20.508 -5.888 5.602 1.00 0.00 C ATOM 2179 NE ARG A 144 -20.651 -4.847 6.631 1.00 0.00 N ATOM 2180 CZ ARG A 144 -21.648 -4.689 7.508 1.00 0.00 C ATOM 2181 NH1 ARG A 144 -22.715 -5.478 7.518 1.00 0.00 N ATOM 2182 NH2 ARG A 144 -21.585 -3.709 8.394 1.00 0.00 N ATOM 2183 OXT ARG A 144 -19.247 -11.127 3.529 1.00 99.99 O ATOM 0 H ARG A 144 -19.972 -10.901 6.895 1.00 0.00 H new ATOM 0 HA ARG A 144 -21.067 -9.727 5.517 1.00 0.00 H new ATOM 0 HB2 ARG A 144 -18.541 -8.104 5.578 1.00 0.00 H new ATOM 0 HB3 ARG A 144 -19.647 -7.727 4.272 1.00 0.00 H new ATOM 0 HG2 ARG A 144 -21.404 -7.714 6.363 1.00 0.00 H new ATOM 0 HG3 ARG A 144 -19.941 -7.240 7.205 1.00 0.00 H new ATOM 0 HD2 ARG A 144 -19.617 -5.691 5.006 1.00 0.00 H new ATOM 0 HD3 ARG A 144 -21.360 -5.849 4.923 1.00 0.00 H new ATOM 0 HE ARG A 144 -19.897 -4.162 6.682 1.00 0.00 H new ATOM 0 HH11 ARG A 144 -22.795 -6.237 6.841 1.00 0.00 H new ATOM 0 HH12 ARG A 144 -23.455 -5.326 8.203 1.00 0.00 H new ATOM 0 HH21 ARG A 144 -20.781 -3.082 8.404 1.00 0.00 H new ATOM 0 HH22 ARG A 144 -22.341 -3.581 9.067 1.00 0.00 H new TER 2197 ARG A 144