USER MOD reduce.3.24.130724 H: found=0, std=0, add=662, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 662 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 57 GLN : amide:sc= 1.04 K(o=1.8,f=-2.7!) USER MOD Set 1.2: A 88 GLN : amide:sc= 0.726 K(o=1.8,f=-3.9!) USER MOD Set 2.1: A 19 ASN : amide:sc= 1.91 K(o=3.8,f=-5.5) USER MOD Set 2.2: A 31 GLN : amide:sc= 1.9 K(o=3.8,f=-3.9!) USER MOD Single : A 17 HIS : no HD1:sc= -0.0419 X(o=-0.042,f=-0.043) USER MOD Single : A 21 LYS NZ :NH3+ -130:sc= 1.24 (180deg=0.068) USER MOD Single : A 25 GLN : amide:sc= 1.13 K(o=1.1,f=-0.72) USER MOD Single : A 28 SER OG : rot -92:sc= 1.32 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 HIS : no HE2:sc= -0.548 K(o=-0.55,f=-1.5) USER MOD Single : A 38 THR OG1 : rot -20:sc= -2.39! USER MOD Single : A 41 SER OG : rot -149:sc= 1.4 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 MET CE :methyl 180:sc= -0.327 (180deg=-0.327) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 CYS SG : rot 3:sc= -0.246 USER MOD Single : A 51 GLN : amide:sc= -0.164 X(o=-0.16,f=-0.33) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 MET CE :methyl -134:sc= 0 (180deg=-0.0995) USER MOD Single : A 65 GLN : amide:sc= -0.132 X(o=-0.13,f=-0.13) USER MOD Single : A 68 ASN : amide:sc= 1.16 K(o=1.2,f=-0.069) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot 180:sc= -2.58! USER MOD Single : A 75 GLN : amide:sc= -0.0627 K(o=-0.063,f=-1) USER MOD Single : A 78 MET CE :methyl 154:sc= -0.378 (180deg=-0.767) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= -0.472 K(o=-0.47,f=-1.2) USER MOD Single : A 90 GLN : amide:sc= -0.132 K(o=-0.13,f=-3.7!) USER MOD Single : B 358 ASN : amide:sc= -2.41! C(o=-2.4!,f=-4.8!) USER MOD Single : B 365 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 13 N HIS A 17 -6.523 12.229 12.270 1.00 10.00 N ATOM 14 CA HIS A 17 -5.986 11.193 11.401 1.00 10.00 C ATOM 15 C HIS A 17 -6.975 10.860 10.290 1.00 10.00 C ATOM 16 O HIS A 17 -8.173 11.131 10.407 1.00 10.00 O ATOM 17 CB HIS A 17 -5.668 9.929 12.207 1.00 10.00 C ATOM 18 CG HIS A 17 -4.619 10.119 13.263 1.00 10.00 C ATOM 19 ND1 HIS A 17 -4.946 10.211 14.595 1.00 10.00 N ATOM 20 CD2 HIS A 17 -3.275 10.221 13.132 1.00 10.00 C ATOM 21 CE1 HIS A 17 -3.801 10.363 15.240 1.00 10.00 C ATOM 22 NE2 HIS A 17 -2.758 10.372 14.398 1.00 10.00 N ATOM 0 HA HIS A 17 -5.066 11.569 10.953 1.00 10.00 H new ATOM 0 HB2 HIS A 17 -6.583 9.574 12.680 1.00 10.00 H new ATOM 0 HB3 HIS A 17 -5.340 9.148 11.521 1.00 10.00 H new ATOM 0 HD2 HIS A 17 -2.715 10.190 12.209 1.00 10.00 H new ATOM 0 HE1 HIS A 17 -3.717 10.467 16.312 1.00 10.00 H new ATOM 0 HE2 HIS A 17 -1.774 10.471 14.647 1.00 10.00 H new ATOM 30 N ILE A 18 -6.464 10.280 9.212 1.00 10.00 N ATOM 31 CA ILE A 18 -7.294 9.892 8.080 1.00 10.00 C ATOM 32 C ILE A 18 -7.450 8.375 8.070 1.00 10.00 C ATOM 33 O ILE A 18 -6.492 7.645 8.325 1.00 10.00 O ATOM 34 CB ILE A 18 -6.700 10.385 6.735 1.00 10.00 C ATOM 35 CG1 ILE A 18 -7.631 10.036 5.570 1.00 10.00 C ATOM 36 CG2 ILE A 18 -5.310 9.805 6.504 1.00 10.00 C ATOM 37 CD1 ILE A 18 -7.219 10.663 4.254 1.00 10.00 C ATOM 0 H ILE A 18 -5.473 10.067 9.098 1.00 10.00 H new ATOM 0 HA ILE A 18 -8.271 10.363 8.191 1.00 10.00 H new ATOM 0 HB ILE A 18 -6.608 11.470 6.788 1.00 10.00 H new ATOM 0 HG12 ILE A 18 -7.662 8.953 5.453 1.00 10.00 H new ATOM 0 HG13 ILE A 18 -8.643 10.359 5.815 1.00 10.00 H new ATOM 0 HG21 ILE A 18 -4.918 10.167 5.554 1.00 10.00 H new ATOM 0 HG22 ILE A 18 -4.647 10.115 7.312 1.00 10.00 H new ATOM 0 HG23 ILE A 18 -5.369 8.717 6.481 1.00 10.00 H new ATOM 0 HD11 ILE A 18 -7.924 10.372 3.476 1.00 10.00 H new ATOM 0 HD12 ILE A 18 -7.216 11.748 4.353 1.00 10.00 H new ATOM 0 HD13 ILE A 18 -6.220 10.321 3.985 1.00 10.00 H new ATOM 49 N ASN A 19 -8.656 7.905 7.806 1.00 10.00 N ATOM 50 CA ASN A 19 -8.921 6.476 7.800 1.00 10.00 C ATOM 51 C ASN A 19 -8.992 5.918 6.391 1.00 10.00 C ATOM 52 O ASN A 19 -10.014 6.036 5.719 1.00 10.00 O ATOM 53 CB ASN A 19 -10.228 6.179 8.532 1.00 10.00 C ATOM 54 CG ASN A 19 -10.224 6.696 9.956 1.00 10.00 C ATOM 55 OD1 ASN A 19 -9.779 6.009 10.875 1.00 10.00 O ATOM 56 ND2 ASN A 19 -10.717 7.910 10.146 1.00 10.00 N ATOM 0 H ASN A 19 -9.465 8.489 7.594 1.00 10.00 H new ATOM 0 HA ASN A 19 -8.091 5.991 8.313 1.00 10.00 H new ATOM 0 HB2 ASN A 19 -11.057 6.631 7.987 1.00 10.00 H new ATOM 0 HB3 ASN A 19 -10.400 5.103 8.540 1.00 10.00 H new ATOM 0 HD21 ASN A 19 -10.738 8.311 11.084 1.00 10.00 H new ATOM 0 HD22 ASN A 19 -11.076 8.444 9.355 1.00 10.00 H new ATOM 63 N LEU A 20 -7.906 5.312 5.949 1.00 10.00 N ATOM 64 CA LEU A 20 -7.852 4.711 4.628 1.00 10.00 C ATOM 65 C LEU A 20 -8.196 3.231 4.734 1.00 10.00 C ATOM 66 O LEU A 20 -8.095 2.644 5.807 1.00 10.00 O ATOM 67 CB LEU A 20 -6.463 4.891 4.010 1.00 10.00 C ATOM 68 CG LEU A 20 -6.008 6.342 3.845 1.00 10.00 C ATOM 69 CD1 LEU A 20 -4.584 6.396 3.320 1.00 10.00 C ATOM 70 CD2 LEU A 20 -6.950 7.094 2.915 1.00 10.00 C ATOM 0 H LEU A 20 -7.045 5.222 6.488 1.00 10.00 H new ATOM 0 HA LEU A 20 -8.576 5.206 3.981 1.00 10.00 H new ATOM 0 HB2 LEU A 20 -5.736 4.367 4.630 1.00 10.00 H new ATOM 0 HB3 LEU A 20 -6.453 4.410 3.032 1.00 10.00 H new ATOM 0 HG LEU A 20 -6.033 6.825 4.822 1.00 10.00 H new ATOM 0 HD11 LEU A 20 -4.276 7.436 3.209 1.00 10.00 H new ATOM 0 HD12 LEU A 20 -3.918 5.894 4.022 1.00 10.00 H new ATOM 0 HD13 LEU A 20 -4.534 5.897 2.352 1.00 10.00 H new ATOM 0 HD21 LEU A 20 -6.611 8.125 2.809 1.00 10.00 H new ATOM 0 HD22 LEU A 20 -6.957 6.612 1.937 1.00 10.00 H new ATOM 0 HD23 LEU A 20 -7.957 7.084 3.332 1.00 10.00 H new ATOM 82 N LYS A 21 -8.609 2.631 3.632 1.00 10.00 N ATOM 83 CA LYS A 21 -8.962 1.220 3.626 1.00 10.00 C ATOM 84 C LYS A 21 -8.096 0.453 2.642 1.00 10.00 C ATOM 85 O LYS A 21 -7.875 0.899 1.520 1.00 10.00 O ATOM 86 CB LYS A 21 -10.434 1.035 3.253 1.00 10.00 C ATOM 87 CG LYS A 21 -11.403 1.410 4.360 1.00 10.00 C ATOM 88 CD LYS A 21 -12.841 1.344 3.873 1.00 10.00 C ATOM 89 CE LYS A 21 -13.827 1.656 4.986 1.00 10.00 C ATOM 90 NZ LYS A 21 -15.193 1.900 4.456 1.00 10.00 N ATOM 0 H LYS A 21 -8.709 3.097 2.730 1.00 10.00 H new ATOM 0 HA LYS A 21 -8.793 0.831 4.630 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -10.654 1.638 2.372 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -10.600 -0.006 2.976 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -11.271 0.736 5.207 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -11.182 2.416 4.716 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -12.981 2.050 3.055 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -13.045 0.350 3.474 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -13.853 0.826 5.692 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -13.488 2.533 5.537 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -15.566 2.787 4.852 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -15.155 1.972 3.419 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -15.816 1.112 4.726 1.00 10.00 H new ATOM 104 N VAL A 22 -7.592 -0.688 3.072 1.00 10.00 N ATOM 105 CA VAL A 22 -6.775 -1.526 2.213 1.00 10.00 C ATOM 106 C VAL A 22 -7.412 -2.902 2.104 1.00 10.00 C ATOM 107 O VAL A 22 -7.460 -3.657 3.076 1.00 10.00 O ATOM 108 CB VAL A 22 -5.325 -1.646 2.732 1.00 10.00 C ATOM 109 CG1 VAL A 22 -4.532 -2.652 1.913 1.00 10.00 C ATOM 110 CG2 VAL A 22 -4.642 -0.286 2.709 1.00 10.00 C ATOM 0 H VAL A 22 -7.734 -1.057 4.012 1.00 10.00 H new ATOM 0 HA VAL A 22 -6.725 -1.060 1.229 1.00 10.00 H new ATOM 0 HB VAL A 22 -5.362 -2.004 3.761 1.00 10.00 H new ATOM 0 HG11 VAL A 22 -3.515 -2.716 2.301 1.00 10.00 H new ATOM 0 HG12 VAL A 22 -5.008 -3.631 1.979 1.00 10.00 H new ATOM 0 HG13 VAL A 22 -4.504 -2.332 0.871 1.00 10.00 H new ATOM 0 HG21 VAL A 22 -3.621 -0.385 3.077 1.00 10.00 H new ATOM 0 HG22 VAL A 22 -4.624 0.095 1.688 1.00 10.00 H new ATOM 0 HG23 VAL A 22 -5.191 0.408 3.345 1.00 10.00 H new ATOM 120 N ALA A 23 -7.928 -3.207 0.924 1.00 10.00 N ATOM 121 CA ALA A 23 -8.583 -4.481 0.691 1.00 10.00 C ATOM 122 C ALA A 23 -7.693 -5.407 -0.122 1.00 10.00 C ATOM 123 O ALA A 23 -7.056 -4.985 -1.089 1.00 10.00 O ATOM 124 CB ALA A 23 -9.917 -4.269 -0.012 1.00 10.00 C ATOM 0 H ALA A 23 -7.905 -2.588 0.113 1.00 10.00 H new ATOM 0 HA ALA A 23 -8.769 -4.952 1.656 1.00 10.00 H new ATOM 0 HB1 ALA A 23 -10.397 -5.233 -0.180 1.00 10.00 H new ATOM 0 HB2 ALA A 23 -10.561 -3.647 0.609 1.00 10.00 H new ATOM 0 HB3 ALA A 23 -9.749 -3.775 -0.969 1.00 10.00 H new ATOM 130 N GLY A 24 -7.649 -6.665 0.285 1.00 10.00 N ATOM 131 CA GLY A 24 -6.841 -7.642 -0.414 1.00 10.00 C ATOM 132 C GLY A 24 -7.597 -8.297 -1.551 1.00 10.00 C ATOM 133 O GLY A 24 -8.638 -7.803 -1.983 1.00 10.00 O ATOM 0 H GLY A 24 -8.160 -7.029 1.089 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -5.946 -7.158 -0.805 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -6.509 -8.407 0.288 1.00 10.00 H new ATOM 137 N GLN A 25 -7.080 -9.421 -2.030 1.00 10.00 N ATOM 138 CA GLN A 25 -7.712 -10.149 -3.122 1.00 10.00 C ATOM 139 C GLN A 25 -8.747 -11.125 -2.575 1.00 10.00 C ATOM 140 O GLN A 25 -9.581 -11.649 -3.316 1.00 10.00 O ATOM 141 CB GLN A 25 -6.655 -10.896 -3.941 1.00 10.00 C ATOM 142 CG GLN A 25 -5.722 -9.971 -4.708 1.00 10.00 C ATOM 143 CD GLN A 25 -6.414 -9.281 -5.868 1.00 10.00 C ATOM 144 OE1 GLN A 25 -7.254 -9.874 -6.547 1.00 10.00 O ATOM 145 NE2 GLN A 25 -6.076 -8.022 -6.103 1.00 10.00 N ATOM 0 H GLN A 25 -6.223 -9.849 -1.679 1.00 10.00 H new ATOM 0 HA GLN A 25 -8.217 -9.436 -3.773 1.00 10.00 H new ATOM 0 HB2 GLN A 25 -6.065 -11.523 -3.273 1.00 10.00 H new ATOM 0 HB3 GLN A 25 -7.155 -11.562 -4.645 1.00 10.00 H new ATOM 0 HG2 GLN A 25 -5.322 -9.219 -4.028 1.00 10.00 H new ATOM 0 HG3 GLN A 25 -4.875 -10.545 -5.084 1.00 10.00 H new ATOM 0 HE21 GLN A 25 -5.376 -7.564 -5.519 1.00 10.00 H new ATOM 0 HE22 GLN A 25 -6.516 -7.510 -6.868 1.00 10.00 H new ATOM 154 N ASP A 26 -8.673 -11.360 -1.271 1.00 10.00 N ATOM 155 CA ASP A 26 -9.586 -12.268 -0.584 1.00 10.00 C ATOM 156 C ASP A 26 -10.799 -11.513 -0.031 1.00 10.00 C ATOM 157 O ASP A 26 -11.783 -11.301 -0.744 1.00 10.00 O ATOM 158 CB ASP A 26 -8.841 -13.001 0.543 1.00 10.00 C ATOM 159 CG ASP A 26 -7.949 -12.073 1.348 1.00 10.00 C ATOM 160 OD1 ASP A 26 -6.892 -11.661 0.832 1.00 10.00 O ATOM 161 OD2 ASP A 26 -8.314 -11.733 2.494 1.00 10.00 O ATOM 0 H ASP A 26 -7.980 -10.928 -0.660 1.00 10.00 H new ATOM 0 HA ASP A 26 -9.953 -13.002 -1.301 1.00 10.00 H new ATOM 0 HB2 ASP A 26 -9.566 -13.471 1.208 1.00 10.00 H new ATOM 0 HB3 ASP A 26 -8.236 -13.800 0.115 1.00 10.00 H new ATOM 166 N GLY A 27 -10.729 -11.109 1.232 1.00 10.00 N ATOM 167 CA GLY A 27 -11.821 -10.382 1.849 1.00 10.00 C ATOM 168 C GLY A 27 -11.367 -9.619 3.075 1.00 10.00 C ATOM 169 O GLY A 27 -12.163 -9.328 3.970 1.00 10.00 O ATOM 0 H GLY A 27 -9.929 -11.274 1.843 1.00 10.00 H new ATOM 0 HA2 GLY A 27 -12.249 -9.687 1.126 1.00 10.00 H new ATOM 0 HA3 GLY A 27 -12.611 -11.080 2.127 1.00 10.00 H new ATOM 173 N SER A 28 -10.081 -9.302 3.115 1.00 10.00 N ATOM 174 CA SER A 28 -9.504 -8.570 4.231 1.00 10.00 C ATOM 175 C SER A 28 -9.641 -7.072 4.006 1.00 10.00 C ATOM 176 O SER A 28 -9.294 -6.573 2.934 1.00 10.00 O ATOM 177 CB SER A 28 -8.033 -8.955 4.381 1.00 10.00 C ATOM 178 OG SER A 28 -7.461 -9.264 3.119 1.00 10.00 O ATOM 0 H SER A 28 -9.414 -9.543 2.382 1.00 10.00 H new ATOM 0 HA SER A 28 -10.037 -8.827 5.146 1.00 10.00 H new ATOM 0 HB2 SER A 28 -7.483 -8.135 4.843 1.00 10.00 H new ATOM 0 HB3 SER A 28 -7.943 -9.814 5.046 1.00 10.00 H new ATOM 0 HG SER A 28 -7.543 -10.226 2.949 1.00 10.00 H new ATOM 184 N VAL A 29 -10.167 -6.355 5.000 1.00 10.00 N ATOM 185 CA VAL A 29 -10.334 -4.912 4.871 1.00 10.00 C ATOM 186 C VAL A 29 -9.722 -4.193 6.063 1.00 10.00 C ATOM 187 O VAL A 29 -10.409 -3.888 7.038 1.00 10.00 O ATOM 188 CB VAL A 29 -11.817 -4.495 4.741 1.00 10.00 C ATOM 189 CG1 VAL A 29 -11.923 -3.053 4.261 1.00 10.00 C ATOM 190 CG2 VAL A 29 -12.571 -5.429 3.801 1.00 10.00 C ATOM 0 H VAL A 29 -10.480 -6.745 5.889 1.00 10.00 H new ATOM 0 HA VAL A 29 -9.819 -4.625 3.954 1.00 10.00 H new ATOM 0 HB VAL A 29 -12.276 -4.570 5.727 1.00 10.00 H new ATOM 0 HG11 VAL A 29 -12.973 -2.775 4.175 1.00 10.00 H new ATOM 0 HG12 VAL A 29 -11.431 -2.394 4.976 1.00 10.00 H new ATOM 0 HG13 VAL A 29 -11.441 -2.957 3.288 1.00 10.00 H new ATOM 0 HG21 VAL A 29 -13.611 -5.111 3.729 1.00 10.00 H new ATOM 0 HG22 VAL A 29 -12.113 -5.398 2.812 1.00 10.00 H new ATOM 0 HG23 VAL A 29 -12.529 -6.447 4.188 1.00 10.00 H new ATOM 200 N VAL A 30 -8.430 -3.926 5.983 1.00 10.00 N ATOM 201 CA VAL A 30 -7.738 -3.246 7.065 1.00 10.00 C ATOM 202 C VAL A 30 -7.938 -1.739 6.962 1.00 10.00 C ATOM 203 O VAL A 30 -8.024 -1.181 5.865 1.00 10.00 O ATOM 204 CB VAL A 30 -6.232 -3.586 7.088 1.00 10.00 C ATOM 205 CG1 VAL A 30 -6.030 -5.077 7.306 1.00 10.00 C ATOM 206 CG2 VAL A 30 -5.546 -3.140 5.807 1.00 10.00 C ATOM 0 H VAL A 30 -7.842 -4.168 5.186 1.00 10.00 H new ATOM 0 HA VAL A 30 -8.170 -3.599 8.001 1.00 10.00 H new ATOM 0 HB VAL A 30 -5.778 -3.044 7.917 1.00 10.00 H new ATOM 0 HG11 VAL A 30 -4.963 -5.301 7.320 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -6.475 -5.369 8.257 1.00 10.00 H new ATOM 0 HG13 VAL A 30 -6.507 -5.631 6.497 1.00 10.00 H new ATOM 0 HG21 VAL A 30 -4.487 -3.393 5.854 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -6.002 -3.644 4.955 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -5.656 -2.062 5.692 1.00 10.00 H new ATOM 216 N GLN A 31 -8.029 -1.093 8.110 1.00 10.00 N ATOM 217 CA GLN A 31 -8.234 0.342 8.169 1.00 10.00 C ATOM 218 C GLN A 31 -6.953 1.044 8.596 1.00 10.00 C ATOM 219 O GLN A 31 -6.480 0.877 9.719 1.00 10.00 O ATOM 220 CB GLN A 31 -9.370 0.659 9.145 1.00 10.00 C ATOM 221 CG GLN A 31 -9.743 2.130 9.220 1.00 10.00 C ATOM 222 CD GLN A 31 -10.911 2.371 10.155 1.00 10.00 C ATOM 223 OE1 GLN A 31 -11.787 1.520 10.304 1.00 10.00 O ATOM 224 NE2 GLN A 31 -10.931 3.520 10.803 1.00 10.00 N ATOM 0 H GLN A 31 -7.963 -1.545 9.022 1.00 10.00 H new ATOM 0 HA GLN A 31 -8.506 0.704 7.178 1.00 10.00 H new ATOM 0 HB2 GLN A 31 -10.252 0.088 8.855 1.00 10.00 H new ATOM 0 HB3 GLN A 31 -9.083 0.319 10.140 1.00 10.00 H new ATOM 0 HG2 GLN A 31 -8.882 2.706 9.559 1.00 10.00 H new ATOM 0 HG3 GLN A 31 -9.996 2.492 8.223 1.00 10.00 H new ATOM 0 HE21 GLN A 31 -10.187 4.202 10.654 1.00 10.00 H new ATOM 0 HE22 GLN A 31 -11.690 3.726 11.453 1.00 10.00 H new ATOM 233 N PHE A 32 -6.394 1.825 7.697 1.00 10.00 N ATOM 234 CA PHE A 32 -5.167 2.543 7.974 1.00 10.00 C ATOM 235 C PHE A 32 -5.474 3.944 8.471 1.00 10.00 C ATOM 236 O PHE A 32 -5.812 4.832 7.691 1.00 10.00 O ATOM 237 CB PHE A 32 -4.292 2.606 6.725 1.00 10.00 C ATOM 238 CG PHE A 32 -3.260 1.515 6.659 1.00 10.00 C ATOM 239 CD1 PHE A 32 -3.498 0.358 5.934 1.00 10.00 C ATOM 240 CD2 PHE A 32 -2.052 1.650 7.318 1.00 10.00 C ATOM 241 CE1 PHE A 32 -2.548 -0.644 5.869 1.00 10.00 C ATOM 242 CE2 PHE A 32 -1.097 0.652 7.258 1.00 10.00 C ATOM 243 CZ PHE A 32 -1.346 -0.496 6.533 1.00 10.00 C ATOM 0 H PHE A 32 -6.772 1.980 6.762 1.00 10.00 H new ATOM 0 HA PHE A 32 -4.623 2.008 8.753 1.00 10.00 H new ATOM 0 HB2 PHE A 32 -4.928 2.547 5.842 1.00 10.00 H new ATOM 0 HB3 PHE A 32 -3.790 3.573 6.692 1.00 10.00 H new ATOM 0 HD1 PHE A 32 -4.437 0.238 5.414 1.00 10.00 H new ATOM 0 HD2 PHE A 32 -1.852 2.546 7.887 1.00 10.00 H new ATOM 0 HE1 PHE A 32 -2.745 -1.541 5.300 1.00 10.00 H new ATOM 0 HE2 PHE A 32 -0.158 0.770 7.778 1.00 10.00 H new ATOM 0 HZ PHE A 32 -0.602 -1.277 6.485 1.00 10.00 H new ATOM 253 N LYS A 33 -5.366 4.129 9.773 1.00 10.00 N ATOM 254 CA LYS A 33 -5.621 5.417 10.394 1.00 10.00 C ATOM 255 C LYS A 33 -4.294 6.132 10.613 1.00 10.00 C ATOM 256 O LYS A 33 -3.681 6.024 11.669 1.00 10.00 O ATOM 257 CB LYS A 33 -6.374 5.226 11.717 1.00 10.00 C ATOM 258 CG LYS A 33 -6.673 6.524 12.451 1.00 10.00 C ATOM 259 CD LYS A 33 -7.332 6.262 13.795 1.00 10.00 C ATOM 260 CE LYS A 33 -7.267 7.486 14.695 1.00 10.00 C ATOM 261 NZ LYS A 33 -7.983 7.274 15.983 1.00 10.00 N ATOM 0 H LYS A 33 -5.100 3.394 10.429 1.00 10.00 H new ATOM 0 HA LYS A 33 -6.247 6.027 9.743 1.00 10.00 H new ATOM 0 HB2 LYS A 33 -7.312 4.709 11.518 1.00 10.00 H new ATOM 0 HB3 LYS A 33 -5.786 4.579 12.368 1.00 10.00 H new ATOM 0 HG2 LYS A 33 -5.748 7.081 12.600 1.00 10.00 H new ATOM 0 HG3 LYS A 33 -7.325 7.148 11.840 1.00 10.00 H new ATOM 0 HD2 LYS A 33 -8.373 5.977 13.642 1.00 10.00 H new ATOM 0 HD3 LYS A 33 -6.840 5.422 14.285 1.00 10.00 H new ATOM 0 HE2 LYS A 33 -6.224 7.732 14.897 1.00 10.00 H new ATOM 0 HE3 LYS A 33 -7.701 8.340 14.176 1.00 10.00 H new ATOM 0 HZ1 LYS A 33 -7.913 8.133 16.565 1.00 10.00 H new ATOM 0 HZ2 LYS A 33 -8.984 7.065 15.793 1.00 10.00 H new ATOM 0 HZ3 LYS A 33 -7.553 6.475 16.492 1.00 10.00 H new ATOM 275 N ILE A 34 -3.843 6.840 9.595 1.00 10.00 N ATOM 276 CA ILE A 34 -2.569 7.541 9.658 1.00 10.00 C ATOM 277 C ILE A 34 -2.753 9.040 9.469 1.00 10.00 C ATOM 278 O ILE A 34 -3.875 9.523 9.326 1.00 10.00 O ATOM 279 CB ILE A 34 -1.593 7.009 8.585 1.00 10.00 C ATOM 280 CG1 ILE A 34 -2.160 7.231 7.178 1.00 10.00 C ATOM 281 CG2 ILE A 34 -1.314 5.532 8.816 1.00 10.00 C ATOM 282 CD1 ILE A 34 -1.169 6.938 6.070 1.00 10.00 C ATOM 0 H ILE A 34 -4.340 6.947 8.711 1.00 10.00 H new ATOM 0 HA ILE A 34 -2.150 7.359 10.648 1.00 10.00 H new ATOM 0 HB ILE A 34 -0.657 7.561 8.667 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -3.038 6.598 7.045 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -2.496 8.264 7.090 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -0.625 5.168 8.054 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -0.869 5.396 9.802 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -2.247 4.972 8.758 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -1.640 7.117 5.104 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -0.301 7.589 6.177 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -0.852 5.897 6.132 1.00 10.00 H new ATOM 294 N LYS A 35 -1.652 9.776 9.481 1.00 10.00 N ATOM 295 CA LYS A 35 -1.709 11.214 9.286 1.00 10.00 C ATOM 296 C LYS A 35 -1.752 11.507 7.793 1.00 10.00 C ATOM 297 O LYS A 35 -1.208 10.747 6.988 1.00 10.00 O ATOM 298 CB LYS A 35 -0.511 11.905 9.944 1.00 10.00 C ATOM 299 CG LYS A 35 -0.422 11.676 11.447 1.00 10.00 C ATOM 300 CD LYS A 35 0.654 12.541 12.084 1.00 10.00 C ATOM 301 CE LYS A 35 0.670 12.391 13.596 1.00 10.00 C ATOM 302 NZ LYS A 35 1.531 13.410 14.252 1.00 10.00 N ATOM 0 H LYS A 35 -0.714 9.402 9.623 1.00 10.00 H new ATOM 0 HA LYS A 35 -2.609 11.607 9.759 1.00 10.00 H new ATOM 0 HB2 LYS A 35 0.406 11.547 9.476 1.00 10.00 H new ATOM 0 HB3 LYS A 35 -0.570 12.976 9.751 1.00 10.00 H new ATOM 0 HG2 LYS A 35 -1.386 11.896 11.907 1.00 10.00 H new ATOM 0 HG3 LYS A 35 -0.208 10.625 11.643 1.00 10.00 H new ATOM 0 HD2 LYS A 35 1.629 12.267 11.680 1.00 10.00 H new ATOM 0 HD3 LYS A 35 0.484 13.586 11.823 1.00 10.00 H new ATOM 0 HE2 LYS A 35 -0.347 12.476 13.979 1.00 10.00 H new ATOM 0 HE3 LYS A 35 1.026 11.394 13.857 1.00 10.00 H new ATOM 0 HZ1 LYS A 35 1.512 13.269 15.282 1.00 10.00 H new ATOM 0 HZ2 LYS A 35 2.508 13.313 13.908 1.00 10.00 H new ATOM 0 HZ3 LYS A 35 1.177 14.361 14.026 1.00 10.00 H new ATOM 316 N ARG A 36 -2.383 12.612 7.417 1.00 10.00 N ATOM 317 CA ARG A 36 -2.512 12.974 6.007 1.00 10.00 C ATOM 318 C ARG A 36 -1.166 13.353 5.386 1.00 10.00 C ATOM 319 O ARG A 36 -1.044 13.446 4.163 1.00 10.00 O ATOM 320 CB ARG A 36 -3.523 14.114 5.839 1.00 10.00 C ATOM 321 CG ARG A 36 -4.946 13.711 6.202 1.00 10.00 C ATOM 322 CD ARG A 36 -5.940 14.837 5.968 1.00 10.00 C ATOM 323 NE ARG A 36 -6.238 15.030 4.547 1.00 10.00 N ATOM 324 CZ ARG A 36 -7.400 14.703 3.969 1.00 10.00 C ATOM 325 NH1 ARG A 36 -8.388 14.176 4.675 1.00 10.00 N ATOM 326 NH2 ARG A 36 -7.586 14.916 2.674 1.00 10.00 N ATOM 0 H ARG A 36 -2.813 13.273 8.064 1.00 10.00 H new ATOM 0 HA ARG A 36 -2.877 12.095 5.476 1.00 10.00 H new ATOM 0 HB2 ARG A 36 -3.220 14.955 6.463 1.00 10.00 H new ATOM 0 HB3 ARG A 36 -3.502 14.460 4.806 1.00 10.00 H new ATOM 0 HG2 ARG A 36 -5.238 12.843 5.611 1.00 10.00 H new ATOM 0 HG3 ARG A 36 -4.981 13.410 7.249 1.00 10.00 H new ATOM 0 HD2 ARG A 36 -6.864 14.620 6.504 1.00 10.00 H new ATOM 0 HD3 ARG A 36 -5.541 15.763 6.382 1.00 10.00 H new ATOM 0 HE ARG A 36 -5.512 15.441 3.959 1.00 10.00 H new ATOM 0 HH11 ARG A 36 -8.270 14.014 5.675 1.00 10.00 H new ATOM 0 HH12 ARG A 36 -9.267 13.932 4.219 1.00 10.00 H new ATOM 0 HH21 ARG A 36 -6.842 15.331 2.113 1.00 10.00 H new ATOM 0 HH22 ARG A 36 -8.473 14.665 2.238 1.00 10.00 H new ATOM 340 N HIS A 37 -0.156 13.548 6.224 1.00 10.00 N ATOM 341 CA HIS A 37 1.176 13.908 5.745 1.00 10.00 C ATOM 342 C HIS A 37 2.165 12.752 5.929 1.00 10.00 C ATOM 343 O HIS A 37 3.379 12.939 5.842 1.00 10.00 O ATOM 344 CB HIS A 37 1.692 15.170 6.453 1.00 10.00 C ATOM 345 CG HIS A 37 1.673 15.094 7.953 1.00 10.00 C ATOM 346 ND1 HIS A 37 2.751 14.627 8.666 1.00 10.00 N ATOM 347 CD2 HIS A 37 0.694 15.452 8.815 1.00 10.00 C ATOM 348 CE1 HIS A 37 2.405 14.715 9.939 1.00 10.00 C ATOM 349 NE2 HIS A 37 1.167 15.210 10.079 1.00 10.00 N ATOM 0 H HIS A 37 -0.232 13.464 7.238 1.00 10.00 H new ATOM 0 HA HIS A 37 1.095 14.118 4.679 1.00 10.00 H new ATOM 0 HB2 HIS A 37 2.713 15.364 6.124 1.00 10.00 H new ATOM 0 HB3 HIS A 37 1.089 16.021 6.137 1.00 10.00 H new ATOM 0 HD1 HIS A 37 3.635 14.284 8.291 1.00 10.00 H new ATOM 0 HD2 HIS A 37 -0.275 15.852 8.557 1.00 10.00 H new ATOM 0 HE1 HIS A 37 3.040 14.425 10.763 1.00 10.00 H new ATOM 357 N THR A 38 1.639 11.560 6.179 1.00 10.00 N ATOM 358 CA THR A 38 2.475 10.382 6.364 1.00 10.00 C ATOM 359 C THR A 38 2.650 9.639 5.041 1.00 10.00 C ATOM 360 O THR A 38 1.668 9.265 4.402 1.00 10.00 O ATOM 361 CB THR A 38 1.865 9.437 7.418 1.00 10.00 C ATOM 362 OG1 THR A 38 1.630 10.164 8.629 1.00 10.00 O ATOM 363 CG2 THR A 38 2.783 8.259 7.706 1.00 10.00 C ATOM 0 H THR A 38 0.637 11.384 6.258 1.00 10.00 H new ATOM 0 HA THR A 38 3.451 10.714 6.717 1.00 10.00 H new ATOM 0 HB THR A 38 0.926 9.048 7.023 1.00 10.00 H new ATOM 0 HG1 THR A 38 2.182 10.974 8.637 1.00 10.00 H new ATOM 0 HG21 THR A 38 2.322 7.613 8.453 1.00 10.00 H new ATOM 0 HG22 THR A 38 2.947 7.693 6.789 1.00 10.00 H new ATOM 0 HG23 THR A 38 3.738 8.625 8.082 1.00 10.00 H new ATOM 371 N PRO A 39 3.909 9.448 4.601 1.00 10.00 N ATOM 372 CA PRO A 39 4.227 8.753 3.345 1.00 10.00 C ATOM 373 C PRO A 39 3.553 7.389 3.223 1.00 10.00 C ATOM 374 O PRO A 39 3.619 6.565 4.139 1.00 10.00 O ATOM 375 CB PRO A 39 5.748 8.585 3.408 1.00 10.00 C ATOM 376 CG PRO A 39 6.217 9.692 4.282 1.00 10.00 C ATOM 377 CD PRO A 39 5.127 9.913 5.294 1.00 10.00 C ATOM 0 HA PRO A 39 3.872 9.315 2.481 1.00 10.00 H new ATOM 0 HB2 PRO A 39 6.022 7.613 3.819 1.00 10.00 H new ATOM 0 HB3 PRO A 39 6.194 8.648 2.416 1.00 10.00 H new ATOM 0 HG2 PRO A 39 7.156 9.432 4.771 1.00 10.00 H new ATOM 0 HG3 PRO A 39 6.400 10.596 3.702 1.00 10.00 H new ATOM 0 HD2 PRO A 39 5.308 9.348 6.208 1.00 10.00 H new ATOM 0 HD3 PRO A 39 5.051 10.963 5.578 1.00 10.00 H new ATOM 385 N LEU A 40 2.927 7.152 2.073 1.00 10.00 N ATOM 386 CA LEU A 40 2.232 5.894 1.812 1.00 10.00 C ATOM 387 C LEU A 40 3.223 4.743 1.677 1.00 10.00 C ATOM 388 O LEU A 40 2.836 3.573 1.673 1.00 10.00 O ATOM 389 CB LEU A 40 1.373 6.013 0.550 1.00 10.00 C ATOM 390 CG LEU A 40 0.177 6.961 0.669 1.00 10.00 C ATOM 391 CD1 LEU A 40 -0.469 7.171 -0.690 1.00 10.00 C ATOM 392 CD2 LEU A 40 -0.840 6.421 1.663 1.00 10.00 C ATOM 0 H LEU A 40 2.887 7.819 1.303 1.00 10.00 H new ATOM 0 HA LEU A 40 1.580 5.681 2.659 1.00 10.00 H new ATOM 0 HB2 LEU A 40 2.005 6.351 -0.271 1.00 10.00 H new ATOM 0 HB3 LEU A 40 1.007 5.022 0.283 1.00 10.00 H new ATOM 0 HG LEU A 40 0.536 7.923 1.036 1.00 10.00 H new ATOM 0 HD11 LEU A 40 -1.318 7.847 -0.589 1.00 10.00 H new ATOM 0 HD12 LEU A 40 0.259 7.603 -1.376 1.00 10.00 H new ATOM 0 HD13 LEU A 40 -0.813 6.213 -1.081 1.00 10.00 H new ATOM 0 HD21 LEU A 40 -1.682 7.110 1.733 1.00 10.00 H new ATOM 0 HD22 LEU A 40 -1.195 5.447 1.327 1.00 10.00 H new ATOM 0 HD23 LEU A 40 -0.373 6.319 2.642 1.00 10.00 H new ATOM 404 N SER A 41 4.501 5.086 1.565 1.00 10.00 N ATOM 405 CA SER A 41 5.558 4.097 1.458 1.00 10.00 C ATOM 406 C SER A 41 5.582 3.225 2.710 1.00 10.00 C ATOM 407 O SER A 41 5.793 2.013 2.645 1.00 10.00 O ATOM 408 CB SER A 41 6.891 4.817 1.276 1.00 10.00 C ATOM 409 OG SER A 41 6.694 6.224 1.295 1.00 10.00 O ATOM 0 H SER A 41 4.829 6.052 1.546 1.00 10.00 H new ATOM 0 HA SER A 41 5.379 3.451 0.598 1.00 10.00 H new ATOM 0 HB2 SER A 41 7.580 4.528 2.069 1.00 10.00 H new ATOM 0 HB3 SER A 41 7.348 4.519 0.332 1.00 10.00 H new ATOM 0 HG SER A 41 7.368 6.656 0.730 1.00 10.00 H new ATOM 415 N LYS A 42 5.324 3.858 3.850 1.00 10.00 N ATOM 416 CA LYS A 42 5.296 3.162 5.128 1.00 10.00 C ATOM 417 C LYS A 42 4.052 2.282 5.193 1.00 10.00 C ATOM 418 O LYS A 42 4.082 1.177 5.729 1.00 10.00 O ATOM 419 CB LYS A 42 5.283 4.168 6.287 1.00 10.00 C ATOM 420 CG LYS A 42 6.226 5.347 6.094 1.00 10.00 C ATOM 421 CD LYS A 42 7.657 4.997 6.472 1.00 10.00 C ATOM 422 CE LYS A 42 8.615 6.119 6.100 1.00 10.00 C ATOM 423 NZ LYS A 42 9.744 6.218 7.055 1.00 10.00 N ATOM 0 H LYS A 42 5.131 4.858 3.913 1.00 10.00 H new ATOM 0 HA LYS A 42 6.189 2.544 5.217 1.00 10.00 H new ATOM 0 HB2 LYS A 42 4.268 4.545 6.416 1.00 10.00 H new ATOM 0 HB3 LYS A 42 5.550 3.649 7.208 1.00 10.00 H new ATOM 0 HG2 LYS A 42 6.194 5.671 5.054 1.00 10.00 H new ATOM 0 HG3 LYS A 42 5.886 6.187 6.700 1.00 10.00 H new ATOM 0 HD2 LYS A 42 7.716 4.805 7.543 1.00 10.00 H new ATOM 0 HD3 LYS A 42 7.955 4.078 5.967 1.00 10.00 H new ATOM 0 HE2 LYS A 42 9.002 5.948 5.096 1.00 10.00 H new ATOM 0 HE3 LYS A 42 8.075 7.065 6.076 1.00 10.00 H new ATOM 0 HZ1 LYS A 42 10.375 6.994 6.768 1.00 10.00 H new ATOM 0 HZ2 LYS A 42 9.376 6.406 8.009 1.00 10.00 H new ATOM 0 HZ3 LYS A 42 10.275 5.324 7.059 1.00 10.00 H new ATOM 437 N LEU A 43 2.969 2.788 4.612 1.00 10.00 N ATOM 438 CA LEU A 43 1.691 2.080 4.572 1.00 10.00 C ATOM 439 C LEU A 43 1.832 0.775 3.793 1.00 10.00 C ATOM 440 O LEU A 43 1.378 -0.282 4.239 1.00 10.00 O ATOM 441 CB LEU A 43 0.623 2.981 3.924 1.00 10.00 C ATOM 442 CG LEU A 43 -0.795 2.403 3.847 1.00 10.00 C ATOM 443 CD1 LEU A 43 -1.821 3.513 4.024 1.00 10.00 C ATOM 444 CD2 LEU A 43 -1.016 1.685 2.520 1.00 10.00 C ATOM 0 H LEU A 43 2.951 3.700 4.155 1.00 10.00 H new ATOM 0 HA LEU A 43 1.383 1.839 5.589 1.00 10.00 H new ATOM 0 HB2 LEU A 43 0.581 3.917 4.480 1.00 10.00 H new ATOM 0 HB3 LEU A 43 0.949 3.225 2.913 1.00 10.00 H new ATOM 0 HG LEU A 43 -0.916 1.677 4.651 1.00 10.00 H new ATOM 0 HD11 LEU A 43 -2.825 3.093 3.968 1.00 10.00 H new ATOM 0 HD12 LEU A 43 -1.680 3.987 4.995 1.00 10.00 H new ATOM 0 HD13 LEU A 43 -1.694 4.255 3.236 1.00 10.00 H new ATOM 0 HD21 LEU A 43 -2.029 1.283 2.488 1.00 10.00 H new ATOM 0 HD22 LEU A 43 -0.878 2.388 1.699 1.00 10.00 H new ATOM 0 HD23 LEU A 43 -0.299 0.870 2.424 1.00 10.00 H new ATOM 456 N MET A 44 2.475 0.859 2.634 1.00 10.00 N ATOM 457 CA MET A 44 2.681 -0.305 1.778 1.00 10.00 C ATOM 458 C MET A 44 3.511 -1.366 2.491 1.00 10.00 C ATOM 459 O MET A 44 3.173 -2.553 2.471 1.00 10.00 O ATOM 460 CB MET A 44 3.368 0.103 0.470 1.00 10.00 C ATOM 461 CG MET A 44 2.506 0.981 -0.424 1.00 10.00 C ATOM 462 SD MET A 44 3.195 1.183 -2.080 1.00 10.00 S ATOM 463 CE MET A 44 4.636 2.186 -1.732 1.00 10.00 C ATOM 0 H MET A 44 2.865 1.726 2.263 1.00 10.00 H new ATOM 0 HA MET A 44 1.703 -0.727 1.547 1.00 10.00 H new ATOM 0 HB2 MET A 44 4.291 0.633 0.705 1.00 10.00 H new ATOM 0 HB3 MET A 44 3.648 -0.796 -0.079 1.00 10.00 H new ATOM 0 HG2 MET A 44 1.509 0.546 -0.501 1.00 10.00 H new ATOM 0 HG3 MET A 44 2.391 1.961 0.039 1.00 10.00 H new ATOM 0 HE1 MET A 44 5.167 2.395 -2.661 1.00 10.00 H new ATOM 0 HE2 MET A 44 4.324 3.124 -1.274 1.00 10.00 H new ATOM 0 HE3 MET A 44 5.296 1.651 -1.049 1.00 10.00 H new ATOM 473 N LYS A 45 4.587 -0.934 3.138 1.00 10.00 N ATOM 474 CA LYS A 45 5.464 -1.847 3.856 1.00 10.00 C ATOM 475 C LYS A 45 4.754 -2.455 5.060 1.00 10.00 C ATOM 476 O LYS A 45 4.972 -3.618 5.389 1.00 10.00 O ATOM 477 CB LYS A 45 6.741 -1.131 4.301 1.00 10.00 C ATOM 478 CG LYS A 45 7.612 -0.669 3.141 1.00 10.00 C ATOM 479 CD LYS A 45 9.052 -0.438 3.573 1.00 10.00 C ATOM 480 CE LYS A 45 9.154 0.641 4.640 1.00 10.00 C ATOM 481 NZ LYS A 45 10.559 0.868 5.073 1.00 10.00 N ATOM 0 H LYS A 45 4.872 0.044 3.179 1.00 10.00 H new ATOM 0 HA LYS A 45 5.735 -2.654 3.175 1.00 10.00 H new ATOM 0 HB2 LYS A 45 6.471 -0.268 4.909 1.00 10.00 H new ATOM 0 HB3 LYS A 45 7.321 -1.800 4.937 1.00 10.00 H new ATOM 0 HG2 LYS A 45 7.586 -1.415 2.347 1.00 10.00 H new ATOM 0 HG3 LYS A 45 7.205 0.253 2.725 1.00 10.00 H new ATOM 0 HD2 LYS A 45 9.471 -1.369 3.956 1.00 10.00 H new ATOM 0 HD3 LYS A 45 9.650 -0.152 2.708 1.00 10.00 H new ATOM 0 HE2 LYS A 45 8.739 1.572 4.254 1.00 10.00 H new ATOM 0 HE3 LYS A 45 8.551 0.356 5.502 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 10.582 1.611 5.801 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 10.948 -0.013 5.465 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 11.130 1.165 4.256 1.00 10.00 H new ATOM 495 N ALA A 46 3.896 -1.669 5.706 1.00 10.00 N ATOM 496 CA ALA A 46 3.150 -2.143 6.868 1.00 10.00 C ATOM 497 C ALA A 46 2.251 -3.319 6.490 1.00 10.00 C ATOM 498 O ALA A 46 2.192 -4.326 7.200 1.00 10.00 O ATOM 499 CB ALA A 46 2.334 -1.011 7.476 1.00 10.00 C ATOM 0 H ALA A 46 3.701 -0.703 5.445 1.00 10.00 H new ATOM 0 HA ALA A 46 3.863 -2.490 7.616 1.00 10.00 H new ATOM 0 HB1 ALA A 46 1.784 -1.382 8.341 1.00 10.00 H new ATOM 0 HB2 ALA A 46 3.002 -0.208 7.788 1.00 10.00 H new ATOM 0 HB3 ALA A 46 1.631 -0.631 6.735 1.00 10.00 H new ATOM 505 N TYR A 47 1.559 -3.193 5.363 1.00 10.00 N ATOM 506 CA TYR A 47 0.684 -4.257 4.889 1.00 10.00 C ATOM 507 C TYR A 47 1.524 -5.455 4.456 1.00 10.00 C ATOM 508 O TYR A 47 1.153 -6.609 4.680 1.00 10.00 O ATOM 509 CB TYR A 47 -0.185 -3.762 3.728 1.00 10.00 C ATOM 510 CG TYR A 47 -1.266 -4.740 3.317 1.00 10.00 C ATOM 511 CD1 TYR A 47 -1.183 -5.438 2.118 1.00 10.00 C ATOM 512 CD2 TYR A 47 -2.367 -4.971 4.133 1.00 10.00 C ATOM 513 CE1 TYR A 47 -2.164 -6.336 1.745 1.00 10.00 C ATOM 514 CE2 TYR A 47 -3.354 -5.865 3.766 1.00 10.00 C ATOM 515 CZ TYR A 47 -3.247 -6.546 2.573 1.00 10.00 C ATOM 516 OH TYR A 47 -4.222 -7.446 2.207 1.00 10.00 O ATOM 0 H TYR A 47 1.587 -2.368 4.764 1.00 10.00 H new ATOM 0 HA TYR A 47 0.022 -4.561 5.700 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -0.650 -2.818 4.011 1.00 10.00 H new ATOM 0 HB3 TYR A 47 0.454 -3.558 2.869 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -0.337 -5.275 1.467 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -2.452 -4.442 5.071 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -2.084 -6.871 0.810 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -4.205 -6.029 4.411 1.00 10.00 H new ATOM 0 HH TYR A 47 -4.915 -7.478 2.900 1.00 10.00 H new ATOM 526 N CYS A 48 2.672 -5.159 3.855 1.00 10.00 N ATOM 527 CA CYS A 48 3.597 -6.184 3.392 1.00 10.00 C ATOM 528 C CYS A 48 4.084 -7.036 4.563 1.00 10.00 C ATOM 529 O CYS A 48 4.167 -8.263 4.465 1.00 10.00 O ATOM 530 CB CYS A 48 4.782 -5.520 2.685 1.00 10.00 C ATOM 531 SG CYS A 48 6.169 -6.627 2.351 1.00 10.00 S ATOM 0 H CYS A 48 2.985 -4.205 3.676 1.00 10.00 H new ATOM 0 HA CYS A 48 3.081 -6.838 2.689 1.00 10.00 H new ATOM 0 HB2 CYS A 48 4.436 -5.097 1.742 1.00 10.00 H new ATOM 0 HB3 CYS A 48 5.135 -4.690 3.296 1.00 10.00 H new ATOM 0 HG CYS A 48 5.868 -7.830 2.743 1.00 10.00 H new ATOM 537 N GLU A 49 4.396 -6.370 5.668 1.00 10.00 N ATOM 538 CA GLU A 49 4.865 -7.035 6.877 1.00 10.00 C ATOM 539 C GLU A 49 3.826 -8.025 7.389 1.00 10.00 C ATOM 540 O GLU A 49 4.158 -9.120 7.837 1.00 10.00 O ATOM 541 CB GLU A 49 5.160 -5.990 7.952 1.00 10.00 C ATOM 542 CG GLU A 49 6.523 -5.338 7.816 1.00 10.00 C ATOM 543 CD GLU A 49 7.634 -6.236 8.304 1.00 10.00 C ATOM 544 OE1 GLU A 49 8.057 -6.076 9.468 1.00 10.00 O ATOM 545 OE2 GLU A 49 8.087 -7.107 7.533 1.00 10.00 O ATOM 0 H GLU A 49 4.331 -5.355 5.751 1.00 10.00 H new ATOM 0 HA GLU A 49 5.775 -7.586 6.641 1.00 10.00 H new ATOM 0 HB2 GLU A 49 4.393 -5.217 7.914 1.00 10.00 H new ATOM 0 HB3 GLU A 49 5.089 -6.461 8.932 1.00 10.00 H new ATOM 0 HG2 GLU A 49 6.698 -5.080 6.772 1.00 10.00 H new ATOM 0 HG3 GLU A 49 6.536 -4.406 8.381 1.00 10.00 H new ATOM 552 N ARG A 50 2.565 -7.635 7.297 1.00 10.00 N ATOM 553 CA ARG A 50 1.469 -8.476 7.758 1.00 10.00 C ATOM 554 C ARG A 50 1.265 -9.683 6.855 1.00 10.00 C ATOM 555 O ARG A 50 0.868 -10.751 7.317 1.00 10.00 O ATOM 556 CB ARG A 50 0.182 -7.668 7.832 1.00 10.00 C ATOM 557 CG ARG A 50 0.171 -6.668 8.970 1.00 10.00 C ATOM 558 CD ARG A 50 -1.073 -5.807 8.930 1.00 10.00 C ATOM 559 NE ARG A 50 -1.346 -5.193 10.224 1.00 10.00 N ATOM 560 CZ ARG A 50 -2.567 -4.972 10.693 1.00 10.00 C ATOM 561 NH1 ARG A 50 -3.626 -5.317 9.974 1.00 10.00 N ATOM 562 NH2 ARG A 50 -2.731 -4.408 11.878 1.00 10.00 N ATOM 0 H ARG A 50 2.273 -6.739 6.906 1.00 10.00 H new ATOM 0 HA ARG A 50 1.731 -8.839 8.752 1.00 10.00 H new ATOM 0 HB2 ARG A 50 0.038 -7.139 6.890 1.00 10.00 H new ATOM 0 HB3 ARG A 50 -0.661 -8.349 7.947 1.00 10.00 H new ATOM 0 HG2 ARG A 50 0.220 -7.196 9.922 1.00 10.00 H new ATOM 0 HG3 ARG A 50 1.057 -6.035 8.910 1.00 10.00 H new ATOM 0 HD2 ARG A 50 -0.953 -5.029 8.176 1.00 10.00 H new ATOM 0 HD3 ARG A 50 -1.926 -6.414 8.628 1.00 10.00 H new ATOM 0 HE ARG A 50 -0.552 -4.917 10.802 1.00 10.00 H new ATOM 0 HH11 ARG A 50 -3.502 -5.752 9.060 1.00 10.00 H new ATOM 0 HH12 ARG A 50 -4.565 -5.147 10.335 1.00 10.00 H new ATOM 0 HH21 ARG A 50 -1.918 -4.142 12.433 1.00 10.00 H new ATOM 0 HH22 ARG A 50 -3.671 -4.239 12.237 1.00 10.00 H new ATOM 576 N GLN A 51 1.524 -9.511 5.569 1.00 10.00 N ATOM 577 CA GLN A 51 1.361 -10.599 4.616 1.00 10.00 C ATOM 578 C GLN A 51 2.519 -11.584 4.716 1.00 10.00 C ATOM 579 O GLN A 51 2.349 -12.782 4.499 1.00 10.00 O ATOM 580 CB GLN A 51 1.264 -10.054 3.191 1.00 10.00 C ATOM 581 CG GLN A 51 0.037 -9.189 2.950 1.00 10.00 C ATOM 582 CD GLN A 51 -1.263 -9.925 3.209 1.00 10.00 C ATOM 583 OE1 GLN A 51 -1.762 -9.951 4.335 1.00 10.00 O ATOM 584 NE2 GLN A 51 -1.823 -10.524 2.171 1.00 10.00 N ATOM 0 H GLN A 51 1.846 -8.633 5.161 1.00 10.00 H new ATOM 0 HA GLN A 51 0.436 -11.122 4.858 1.00 10.00 H new ATOM 0 HB2 GLN A 51 2.158 -9.470 2.973 1.00 10.00 H new ATOM 0 HB3 GLN A 51 1.251 -10.890 2.492 1.00 10.00 H new ATOM 0 HG2 GLN A 51 0.086 -8.310 3.593 1.00 10.00 H new ATOM 0 HG3 GLN A 51 0.047 -8.831 1.920 1.00 10.00 H new ATOM 0 HE21 GLN A 51 -1.377 -10.479 1.255 1.00 10.00 H new ATOM 0 HE22 GLN A 51 -2.700 -11.031 2.287 1.00 10.00 H new ATOM 593 N GLY A 52 3.692 -11.071 5.061 1.00 10.00 N ATOM 594 CA GLY A 52 4.865 -11.917 5.171 1.00 10.00 C ATOM 595 C GLY A 52 5.519 -12.120 3.825 1.00 10.00 C ATOM 596 O GLY A 52 6.043 -13.194 3.524 1.00 10.00 O ATOM 0 H GLY A 52 3.853 -10.085 5.267 1.00 10.00 H new ATOM 0 HA2 GLY A 52 5.578 -11.466 5.861 1.00 10.00 H new ATOM 0 HA3 GLY A 52 4.582 -12.883 5.590 1.00 10.00 H new ATOM 600 N LEU A 53 5.475 -11.081 3.010 1.00 10.00 N ATOM 601 CA LEU A 53 6.053 -11.119 1.677 1.00 10.00 C ATOM 602 C LEU A 53 6.984 -9.928 1.483 1.00 10.00 C ATOM 603 O LEU A 53 7.519 -9.392 2.453 1.00 10.00 O ATOM 604 CB LEU A 53 4.940 -11.097 0.625 1.00 10.00 C ATOM 605 CG LEU A 53 3.921 -12.232 0.735 1.00 10.00 C ATOM 606 CD1 LEU A 53 2.684 -11.915 -0.088 1.00 10.00 C ATOM 607 CD2 LEU A 53 4.534 -13.548 0.282 1.00 10.00 C ATOM 0 H LEU A 53 5.040 -10.191 3.251 1.00 10.00 H new ATOM 0 HA LEU A 53 6.627 -12.038 1.562 1.00 10.00 H new ATOM 0 HB2 LEU A 53 4.411 -10.147 0.698 1.00 10.00 H new ATOM 0 HB3 LEU A 53 5.396 -11.133 -0.364 1.00 10.00 H new ATOM 0 HG LEU A 53 3.628 -12.330 1.780 1.00 10.00 H new ATOM 0 HD11 LEU A 53 1.969 -12.733 0.001 1.00 10.00 H new ATOM 0 HD12 LEU A 53 2.230 -10.994 0.278 1.00 10.00 H new ATOM 0 HD13 LEU A 53 2.965 -11.791 -1.134 1.00 10.00 H new ATOM 0 HD21 LEU A 53 3.793 -14.343 0.368 1.00 10.00 H new ATOM 0 HD22 LEU A 53 4.855 -13.462 -0.756 1.00 10.00 H new ATOM 0 HD23 LEU A 53 5.394 -13.784 0.909 1.00 10.00 H new ATOM 619 N SER A 54 7.171 -9.518 0.240 1.00 10.00 N ATOM 620 CA SER A 54 8.028 -8.387 -0.067 1.00 10.00 C ATOM 621 C SER A 54 7.234 -7.321 -0.814 1.00 10.00 C ATOM 622 O SER A 54 6.322 -7.638 -1.583 1.00 10.00 O ATOM 623 CB SER A 54 9.233 -8.839 -0.900 1.00 10.00 C ATOM 624 OG SER A 54 10.109 -7.757 -1.168 1.00 10.00 O ATOM 0 H SER A 54 6.739 -9.954 -0.575 1.00 10.00 H new ATOM 0 HA SER A 54 8.397 -7.962 0.866 1.00 10.00 H new ATOM 0 HB2 SER A 54 9.772 -9.623 -0.368 1.00 10.00 H new ATOM 0 HB3 SER A 54 8.887 -9.271 -1.839 1.00 10.00 H new ATOM 0 HG SER A 54 10.869 -8.075 -1.699 1.00 10.00 H new ATOM 630 N MET A 55 7.582 -6.059 -0.584 1.00 10.00 N ATOM 631 CA MET A 55 6.910 -4.940 -1.238 1.00 10.00 C ATOM 632 C MET A 55 7.174 -4.970 -2.741 1.00 10.00 C ATOM 633 O MET A 55 6.468 -4.341 -3.526 1.00 10.00 O ATOM 634 CB MET A 55 7.392 -3.613 -0.643 1.00 10.00 C ATOM 635 CG MET A 55 6.474 -2.437 -0.944 1.00 10.00 C ATOM 636 SD MET A 55 7.270 -0.840 -0.668 1.00 10.00 S ATOM 637 CE MET A 55 8.311 -0.723 -2.124 1.00 10.00 C ATOM 0 H MET A 55 8.329 -5.784 0.054 1.00 10.00 H new ATOM 0 HA MET A 55 5.837 -5.031 -1.070 1.00 10.00 H new ATOM 0 HB2 MET A 55 7.485 -3.722 0.438 1.00 10.00 H new ATOM 0 HB3 MET A 55 8.388 -3.393 -1.028 1.00 10.00 H new ATOM 0 HG2 MET A 55 6.141 -2.498 -1.980 1.00 10.00 H new ATOM 0 HG3 MET A 55 5.584 -2.507 -0.319 1.00 10.00 H new ATOM 0 HE1 MET A 55 9.311 -0.402 -1.832 1.00 10.00 H new ATOM 0 HE2 MET A 55 8.370 -1.698 -2.608 1.00 10.00 H new ATOM 0 HE3 MET A 55 7.885 0.002 -2.818 1.00 10.00 H new ATOM 647 N ARG A 56 8.192 -5.723 -3.132 1.00 10.00 N ATOM 648 CA ARG A 56 8.558 -5.851 -4.532 1.00 10.00 C ATOM 649 C ARG A 56 7.660 -6.876 -5.233 1.00 10.00 C ATOM 650 O ARG A 56 7.650 -6.969 -6.458 1.00 10.00 O ATOM 651 CB ARG A 56 10.028 -6.265 -4.646 1.00 10.00 C ATOM 652 CG ARG A 56 10.677 -5.908 -5.974 1.00 10.00 C ATOM 653 CD ARG A 56 12.181 -6.123 -5.924 1.00 10.00 C ATOM 654 NE ARG A 56 12.848 -5.668 -7.142 1.00 10.00 N ATOM 655 CZ ARG A 56 14.124 -5.288 -7.199 1.00 10.00 C ATOM 656 NH1 ARG A 56 14.873 -5.296 -6.103 1.00 10.00 N ATOM 657 NH2 ARG A 56 14.645 -4.889 -8.349 1.00 10.00 N ATOM 0 H ARG A 56 8.781 -6.257 -2.493 1.00 10.00 H new ATOM 0 HA ARG A 56 8.420 -4.887 -5.021 1.00 10.00 H new ATOM 0 HB2 ARG A 56 10.590 -5.791 -3.841 1.00 10.00 H new ATOM 0 HB3 ARG A 56 10.103 -7.342 -4.496 1.00 10.00 H new ATOM 0 HG2 ARG A 56 10.246 -6.517 -6.768 1.00 10.00 H new ATOM 0 HG3 ARG A 56 10.463 -4.868 -6.219 1.00 10.00 H new ATOM 0 HD2 ARG A 56 12.593 -5.591 -5.067 1.00 10.00 H new ATOM 0 HD3 ARG A 56 12.389 -7.182 -5.772 1.00 10.00 H new ATOM 0 HE ARG A 56 12.302 -5.639 -8.003 1.00 10.00 H new ATOM 0 HH11 ARG A 56 14.472 -5.594 -5.214 1.00 10.00 H new ATOM 0 HH12 ARG A 56 15.849 -5.005 -6.150 1.00 10.00 H new ATOM 0 HH21 ARG A 56 14.070 -4.873 -9.191 1.00 10.00 H new ATOM 0 HH22 ARG A 56 15.622 -4.598 -8.393 1.00 10.00 H new ATOM 671 N GLN A 57 6.884 -7.614 -4.448 1.00 10.00 N ATOM 672 CA GLN A 57 5.995 -8.637 -4.987 1.00 10.00 C ATOM 673 C GLN A 57 4.582 -8.097 -5.192 1.00 10.00 C ATOM 674 O GLN A 57 3.916 -8.422 -6.175 1.00 10.00 O ATOM 675 CB GLN A 57 5.965 -9.845 -4.045 1.00 10.00 C ATOM 676 CG GLN A 57 5.034 -10.958 -4.500 1.00 10.00 C ATOM 677 CD GLN A 57 4.940 -12.089 -3.495 1.00 10.00 C ATOM 678 OE1 GLN A 57 5.877 -12.343 -2.737 1.00 10.00 O ATOM 679 NE2 GLN A 57 3.811 -12.776 -3.485 1.00 10.00 N ATOM 0 H GLN A 57 6.852 -7.523 -3.433 1.00 10.00 H new ATOM 0 HA GLN A 57 6.379 -8.942 -5.960 1.00 10.00 H new ATOM 0 HB2 GLN A 57 6.975 -10.245 -3.951 1.00 10.00 H new ATOM 0 HB3 GLN A 57 5.660 -9.512 -3.053 1.00 10.00 H new ATOM 0 HG2 GLN A 57 4.039 -10.547 -4.672 1.00 10.00 H new ATOM 0 HG3 GLN A 57 5.385 -11.353 -5.453 1.00 10.00 H new ATOM 0 HE21 GLN A 57 3.060 -12.532 -4.130 1.00 10.00 H new ATOM 0 HE22 GLN A 57 3.691 -13.550 -2.832 1.00 10.00 H new ATOM 688 N ILE A 58 4.125 -7.268 -4.268 1.00 10.00 N ATOM 689 CA ILE A 58 2.783 -6.708 -4.353 1.00 10.00 C ATOM 690 C ILE A 58 2.796 -5.302 -4.948 1.00 10.00 C ATOM 691 O ILE A 58 3.830 -4.638 -4.979 1.00 10.00 O ATOM 692 CB ILE A 58 2.091 -6.681 -2.972 1.00 10.00 C ATOM 693 CG1 ILE A 58 3.012 -6.058 -1.916 1.00 10.00 C ATOM 694 CG2 ILE A 58 1.674 -8.088 -2.563 1.00 10.00 C ATOM 695 CD1 ILE A 58 2.406 -6.021 -0.527 1.00 10.00 C ATOM 0 H ILE A 58 4.660 -6.968 -3.453 1.00 10.00 H new ATOM 0 HA ILE A 58 2.215 -7.361 -5.016 1.00 10.00 H new ATOM 0 HB ILE A 58 1.196 -6.063 -3.045 1.00 10.00 H new ATOM 0 HG12 ILE A 58 3.944 -6.622 -1.881 1.00 10.00 H new ATOM 0 HG13 ILE A 58 3.265 -5.042 -2.220 1.00 10.00 H new ATOM 0 HG21 ILE A 58 1.188 -8.054 -1.588 1.00 10.00 H new ATOM 0 HG22 ILE A 58 0.980 -8.491 -3.301 1.00 10.00 H new ATOM 0 HG23 ILE A 58 2.555 -8.727 -2.507 1.00 10.00 H new ATOM 0 HD11 ILE A 58 3.114 -5.567 0.167 1.00 10.00 H new ATOM 0 HD12 ILE A 58 1.489 -5.433 -0.546 1.00 10.00 H new ATOM 0 HD13 ILE A 58 2.179 -7.036 -0.202 1.00 10.00 H new ATOM 707 N ARG A 59 1.644 -4.868 -5.443 1.00 10.00 N ATOM 708 CA ARG A 59 1.501 -3.545 -6.039 1.00 10.00 C ATOM 709 C ARG A 59 0.273 -2.847 -5.475 1.00 10.00 C ATOM 710 O ARG A 59 -0.784 -3.461 -5.338 1.00 10.00 O ATOM 711 CB ARG A 59 1.376 -3.644 -7.566 1.00 10.00 C ATOM 712 CG ARG A 59 2.612 -4.199 -8.255 1.00 10.00 C ATOM 713 CD ARG A 59 3.809 -3.271 -8.107 1.00 10.00 C ATOM 714 NE ARG A 59 4.988 -3.791 -8.802 1.00 10.00 N ATOM 715 CZ ARG A 59 5.866 -4.634 -8.257 1.00 10.00 C ATOM 716 NH1 ARG A 59 5.716 -5.041 -7.000 1.00 10.00 N ATOM 717 NH2 ARG A 59 6.900 -5.069 -8.969 1.00 10.00 N ATOM 0 H ARG A 59 0.786 -5.420 -5.443 1.00 10.00 H new ATOM 0 HA ARG A 59 2.393 -2.967 -5.797 1.00 10.00 H new ATOM 0 HB2 ARG A 59 0.522 -4.277 -7.810 1.00 10.00 H new ATOM 0 HB3 ARG A 59 1.163 -2.653 -7.967 1.00 10.00 H new ATOM 0 HG2 ARG A 59 2.855 -5.175 -7.834 1.00 10.00 H new ATOM 0 HG3 ARG A 59 2.400 -4.352 -9.313 1.00 10.00 H new ATOM 0 HD2 ARG A 59 3.558 -2.287 -8.503 1.00 10.00 H new ATOM 0 HD3 ARG A 59 4.039 -3.139 -7.050 1.00 10.00 H new ATOM 0 HE ARG A 59 5.148 -3.490 -9.763 1.00 10.00 H new ATOM 0 HH11 ARG A 59 4.926 -4.708 -6.447 1.00 10.00 H new ATOM 0 HH12 ARG A 59 6.391 -5.686 -6.589 1.00 10.00 H new ATOM 0 HH21 ARG A 59 7.022 -4.758 -9.933 1.00 10.00 H new ATOM 0 HH22 ARG A 59 7.571 -5.714 -8.552 1.00 10.00 H new ATOM 731 N PHE A 60 0.412 -1.570 -5.149 1.00 10.00 N ATOM 732 CA PHE A 60 -0.696 -0.802 -4.598 1.00 10.00 C ATOM 733 C PHE A 60 -1.209 0.196 -5.626 1.00 10.00 C ATOM 734 O PHE A 60 -0.427 0.936 -6.229 1.00 10.00 O ATOM 735 CB PHE A 60 -0.267 -0.069 -3.326 1.00 10.00 C ATOM 736 CG PHE A 60 -0.066 -0.970 -2.140 1.00 10.00 C ATOM 737 CD1 PHE A 60 1.005 -1.848 -2.094 1.00 10.00 C ATOM 738 CD2 PHE A 60 -0.946 -0.937 -1.071 1.00 10.00 C ATOM 739 CE1 PHE A 60 1.193 -2.676 -1.005 1.00 10.00 C ATOM 740 CE2 PHE A 60 -0.763 -1.762 0.021 1.00 10.00 C ATOM 741 CZ PHE A 60 0.308 -2.633 0.053 1.00 10.00 C ATOM 0 H PHE A 60 1.279 -1.044 -5.256 1.00 10.00 H new ATOM 0 HA PHE A 60 -1.499 -1.495 -4.345 1.00 10.00 H new ATOM 0 HB2 PHE A 60 0.661 0.467 -3.523 1.00 10.00 H new ATOM 0 HB3 PHE A 60 -1.020 0.679 -3.078 1.00 10.00 H new ATOM 0 HD1 PHE A 60 1.701 -1.885 -2.919 1.00 10.00 H new ATOM 0 HD2 PHE A 60 -1.785 -0.258 -1.092 1.00 10.00 H new ATOM 0 HE1 PHE A 60 2.031 -3.356 -0.981 1.00 10.00 H new ATOM 0 HE2 PHE A 60 -1.456 -1.726 0.848 1.00 10.00 H new ATOM 0 HZ PHE A 60 0.453 -3.280 0.905 1.00 10.00 H new ATOM 751 N ARG A 61 -2.517 0.203 -5.833 1.00 10.00 N ATOM 752 CA ARG A 61 -3.139 1.103 -6.794 1.00 10.00 C ATOM 753 C ARG A 61 -4.262 1.907 -6.156 1.00 10.00 C ATOM 754 O ARG A 61 -4.998 1.406 -5.303 1.00 10.00 O ATOM 755 CB ARG A 61 -3.715 0.325 -7.975 1.00 10.00 C ATOM 756 CG ARG A 61 -2.676 -0.349 -8.853 1.00 10.00 C ATOM 757 CD ARG A 61 -3.334 -1.007 -10.053 1.00 10.00 C ATOM 758 NE ARG A 61 -2.406 -1.834 -10.817 1.00 10.00 N ATOM 759 CZ ARG A 61 -2.795 -2.812 -11.632 1.00 10.00 C ATOM 760 NH1 ARG A 61 -4.089 -3.078 -11.773 1.00 10.00 N ATOM 761 NH2 ARG A 61 -1.897 -3.525 -12.307 1.00 10.00 N ATOM 0 H ARG A 61 -3.172 -0.408 -5.345 1.00 10.00 H new ATOM 0 HA ARG A 61 -2.360 1.782 -7.140 1.00 10.00 H new ATOM 0 HB2 ARG A 61 -4.398 -0.434 -7.595 1.00 10.00 H new ATOM 0 HB3 ARG A 61 -4.305 1.006 -8.589 1.00 10.00 H new ATOM 0 HG2 ARG A 61 -1.945 0.386 -9.190 1.00 10.00 H new ATOM 0 HG3 ARG A 61 -2.133 -1.096 -8.274 1.00 10.00 H new ATOM 0 HD2 ARG A 61 -4.168 -1.621 -9.714 1.00 10.00 H new ATOM 0 HD3 ARG A 61 -3.749 -0.237 -10.703 1.00 10.00 H new ATOM 0 HE ARG A 61 -1.407 -1.653 -10.722 1.00 10.00 H new ATOM 0 HH11 ARG A 61 -4.781 -2.534 -11.258 1.00 10.00 H new ATOM 0 HH12 ARG A 61 -4.391 -3.827 -12.397 1.00 10.00 H new ATOM 0 HH21 ARG A 61 -0.903 -3.324 -12.202 1.00 10.00 H new ATOM 0 HH22 ARG A 61 -2.203 -4.273 -12.930 1.00 10.00 H new ATOM 775 N PHE A 62 -4.389 3.147 -6.594 1.00 10.00 N ATOM 776 CA PHE A 62 -5.427 4.041 -6.110 1.00 10.00 C ATOM 777 C PHE A 62 -6.066 4.750 -7.297 1.00 10.00 C ATOM 778 O PHE A 62 -5.392 5.484 -8.021 1.00 10.00 O ATOM 779 CB PHE A 62 -4.853 5.065 -5.124 1.00 10.00 C ATOM 780 CG PHE A 62 -5.844 6.121 -4.711 1.00 10.00 C ATOM 781 CD1 PHE A 62 -6.923 5.801 -3.899 1.00 10.00 C ATOM 782 CD2 PHE A 62 -5.701 7.431 -5.144 1.00 10.00 C ATOM 783 CE1 PHE A 62 -7.837 6.768 -3.529 1.00 10.00 C ATOM 784 CE2 PHE A 62 -6.613 8.401 -4.774 1.00 10.00 C ATOM 785 CZ PHE A 62 -7.684 8.070 -3.968 1.00 10.00 C ATOM 0 H PHE A 62 -3.776 3.563 -7.295 1.00 10.00 H new ATOM 0 HA PHE A 62 -6.181 3.457 -5.581 1.00 10.00 H new ATOM 0 HB2 PHE A 62 -4.499 4.543 -4.235 1.00 10.00 H new ATOM 0 HB3 PHE A 62 -3.987 5.548 -5.577 1.00 10.00 H new ATOM 0 HD1 PHE A 62 -7.049 4.786 -3.553 1.00 10.00 H new ATOM 0 HD2 PHE A 62 -4.867 7.696 -5.778 1.00 10.00 H new ATOM 0 HE1 PHE A 62 -8.672 6.507 -2.896 1.00 10.00 H new ATOM 0 HE2 PHE A 62 -6.488 9.418 -5.115 1.00 10.00 H new ATOM 0 HZ PHE A 62 -8.400 8.826 -3.681 1.00 10.00 H new ATOM 795 N ASP A 63 -7.355 4.496 -7.510 1.00 10.00 N ATOM 796 CA ASP A 63 -8.104 5.103 -8.617 1.00 10.00 C ATOM 797 C ASP A 63 -7.505 4.676 -9.963 1.00 10.00 C ATOM 798 O ASP A 63 -7.575 5.400 -10.957 1.00 10.00 O ATOM 799 CB ASP A 63 -8.108 6.637 -8.492 1.00 10.00 C ATOM 800 CG ASP A 63 -9.194 7.307 -9.316 1.00 10.00 C ATOM 801 OD1 ASP A 63 -9.997 6.597 -9.955 1.00 10.00 O ATOM 802 OD2 ASP A 63 -9.252 8.558 -9.325 1.00 10.00 O ATOM 0 H ASP A 63 -7.910 3.869 -6.927 1.00 10.00 H new ATOM 0 HA ASP A 63 -9.135 4.753 -8.569 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -8.238 6.908 -7.444 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -7.137 7.022 -8.803 1.00 10.00 H new ATOM 807 N GLY A 64 -6.903 3.492 -9.979 1.00 10.00 N ATOM 808 CA GLY A 64 -6.302 2.973 -11.193 1.00 10.00 C ATOM 809 C GLY A 64 -4.842 3.357 -11.335 1.00 10.00 C ATOM 810 O GLY A 64 -4.108 2.751 -12.114 1.00 10.00 O ATOM 0 H GLY A 64 -6.820 2.879 -9.168 1.00 10.00 H new ATOM 0 HA2 GLY A 64 -6.390 1.887 -11.201 1.00 10.00 H new ATOM 0 HA3 GLY A 64 -6.856 3.344 -12.055 1.00 10.00 H new ATOM 814 N GLN A 65 -4.419 4.355 -10.575 1.00 10.00 N ATOM 815 CA GLN A 65 -3.043 4.824 -10.627 1.00 10.00 C ATOM 816 C GLN A 65 -2.198 4.156 -9.548 1.00 10.00 C ATOM 817 O GLN A 65 -2.652 3.984 -8.419 1.00 10.00 O ATOM 818 CB GLN A 65 -2.993 6.341 -10.445 1.00 10.00 C ATOM 819 CG GLN A 65 -3.695 7.125 -11.543 1.00 10.00 C ATOM 820 CD GLN A 65 -3.165 6.799 -12.922 1.00 10.00 C ATOM 821 OE1 GLN A 65 -3.734 5.979 -13.645 1.00 10.00 O ATOM 822 NE2 GLN A 65 -2.065 7.431 -13.290 1.00 10.00 N ATOM 0 H GLN A 65 -5.011 4.857 -9.913 1.00 10.00 H new ATOM 0 HA GLN A 65 -2.636 4.562 -11.604 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -3.445 6.596 -9.487 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -1.950 6.656 -10.399 1.00 10.00 H new ATOM 0 HG2 GLN A 65 -4.764 6.913 -11.509 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -3.576 8.192 -11.355 1.00 10.00 H new ATOM 0 HE21 GLN A 65 -1.627 8.102 -12.659 1.00 10.00 H new ATOM 0 HE22 GLN A 65 -1.653 7.248 -14.205 1.00 10.00 H new ATOM 831 N PRO A 66 -0.968 3.747 -9.890 1.00 10.00 N ATOM 832 CA PRO A 66 -0.056 3.120 -8.934 1.00 10.00 C ATOM 833 C PRO A 66 0.497 4.134 -7.934 1.00 10.00 C ATOM 834 O PRO A 66 0.645 5.317 -8.249 1.00 10.00 O ATOM 835 CB PRO A 66 1.062 2.562 -9.819 1.00 10.00 C ATOM 836 CG PRO A 66 1.047 3.411 -11.042 1.00 10.00 C ATOM 837 CD PRO A 66 -0.378 3.853 -11.235 1.00 10.00 C ATOM 0 HA PRO A 66 -0.547 2.357 -8.329 1.00 10.00 H new ATOM 0 HB2 PRO A 66 2.027 2.614 -9.315 1.00 10.00 H new ATOM 0 HB3 PRO A 66 0.886 1.515 -10.064 1.00 10.00 H new ATOM 0 HG2 PRO A 66 1.708 4.270 -10.926 1.00 10.00 H new ATOM 0 HG3 PRO A 66 1.401 2.851 -11.908 1.00 10.00 H new ATOM 0 HD2 PRO A 66 -0.432 4.873 -11.615 1.00 10.00 H new ATOM 0 HD3 PRO A 66 -0.900 3.218 -11.951 1.00 10.00 H new ATOM 845 N ILE A 67 0.790 3.672 -6.728 1.00 10.00 N ATOM 846 CA ILE A 67 1.316 4.540 -5.686 1.00 10.00 C ATOM 847 C ILE A 67 2.841 4.475 -5.637 1.00 10.00 C ATOM 848 O ILE A 67 3.429 3.399 -5.769 1.00 10.00 O ATOM 849 CB ILE A 67 0.739 4.157 -4.305 1.00 10.00 C ATOM 850 CG1 ILE A 67 -0.789 4.232 -4.335 1.00 10.00 C ATOM 851 CG2 ILE A 67 1.294 5.066 -3.215 1.00 10.00 C ATOM 852 CD1 ILE A 67 -1.448 3.782 -3.046 1.00 10.00 C ATOM 0 H ILE A 67 0.672 2.699 -6.446 1.00 10.00 H new ATOM 0 HA ILE A 67 1.013 5.559 -5.927 1.00 10.00 H new ATOM 0 HB ILE A 67 1.038 3.134 -4.078 1.00 10.00 H new ATOM 0 HG12 ILE A 67 -1.089 5.258 -4.547 1.00 10.00 H new ATOM 0 HG13 ILE A 67 -1.158 3.616 -5.155 1.00 10.00 H new ATOM 0 HG21 ILE A 67 0.874 4.777 -2.252 1.00 10.00 H new ATOM 0 HG22 ILE A 67 2.379 4.972 -3.180 1.00 10.00 H new ATOM 0 HG23 ILE A 67 1.027 6.100 -3.432 1.00 10.00 H new ATOM 0 HD11 ILE A 67 -2.531 3.863 -3.143 1.00 10.00 H new ATOM 0 HD12 ILE A 67 -1.179 2.746 -2.842 1.00 10.00 H new ATOM 0 HD13 ILE A 67 -1.109 4.413 -2.224 1.00 10.00 H new ATOM 864 N ASN A 68 3.475 5.628 -5.461 1.00 10.00 N ATOM 865 CA ASN A 68 4.929 5.707 -5.388 1.00 10.00 C ATOM 866 C ASN A 68 5.378 5.735 -3.933 1.00 10.00 C ATOM 867 O ASN A 68 4.559 5.847 -3.022 1.00 10.00 O ATOM 868 CB ASN A 68 5.445 6.962 -6.106 1.00 10.00 C ATOM 869 CG ASN A 68 5.041 7.016 -7.566 1.00 10.00 C ATOM 870 OD1 ASN A 68 5.783 6.572 -8.444 1.00 10.00 O ATOM 871 ND2 ASN A 68 3.867 7.571 -7.834 1.00 10.00 N ATOM 0 H ASN A 68 3.002 6.526 -5.366 1.00 10.00 H new ATOM 0 HA ASN A 68 5.342 4.827 -5.881 1.00 10.00 H new ATOM 0 HB2 ASN A 68 5.065 7.848 -5.596 1.00 10.00 H new ATOM 0 HB3 ASN A 68 6.532 6.994 -6.034 1.00 10.00 H new ATOM 0 HD21 ASN A 68 3.546 7.644 -8.799 1.00 10.00 H new ATOM 0 HD22 ASN A 68 3.285 7.925 -7.075 1.00 10.00 H new ATOM 878 N GLU A 69 6.683 5.659 -3.715 1.00 10.00 N ATOM 879 CA GLU A 69 7.230 5.679 -2.363 1.00 10.00 C ATOM 880 C GLU A 69 7.400 7.114 -1.869 1.00 10.00 C ATOM 881 O GLU A 69 7.964 7.354 -0.801 1.00 10.00 O ATOM 882 CB GLU A 69 8.569 4.947 -2.321 1.00 10.00 C ATOM 883 CG GLU A 69 8.459 3.463 -2.623 1.00 10.00 C ATOM 884 CD GLU A 69 9.710 2.917 -3.272 1.00 10.00 C ATOM 885 OE1 GLU A 69 10.690 2.637 -2.549 1.00 10.00 O ATOM 886 OE2 GLU A 69 9.722 2.766 -4.512 1.00 10.00 O ATOM 0 H GLU A 69 7.382 5.583 -4.454 1.00 10.00 H new ATOM 0 HA GLU A 69 6.528 5.168 -1.704 1.00 10.00 H new ATOM 0 HB2 GLU A 69 9.248 5.406 -3.040 1.00 10.00 H new ATOM 0 HB3 GLU A 69 9.014 5.077 -1.334 1.00 10.00 H new ATOM 0 HG2 GLU A 69 8.265 2.919 -1.698 1.00 10.00 H new ATOM 0 HG3 GLU A 69 7.606 3.290 -3.280 1.00 10.00 H new ATOM 893 N THR A 70 6.911 8.058 -2.657 1.00 10.00 N ATOM 894 CA THR A 70 6.995 9.469 -2.316 1.00 10.00 C ATOM 895 C THR A 70 5.611 10.108 -2.276 1.00 10.00 C ATOM 896 O THR A 70 5.479 11.327 -2.184 1.00 10.00 O ATOM 897 CB THR A 70 7.867 10.221 -3.336 1.00 10.00 C ATOM 898 OG1 THR A 70 8.151 9.368 -4.458 1.00 10.00 O ATOM 899 CG2 THR A 70 9.166 10.681 -2.695 1.00 10.00 C ATOM 0 H THR A 70 6.447 7.870 -3.546 1.00 10.00 H new ATOM 0 HA THR A 70 7.447 9.540 -1.327 1.00 10.00 H new ATOM 0 HB THR A 70 7.320 11.099 -3.679 1.00 10.00 H new ATOM 0 HG1 THR A 70 8.705 9.852 -5.105 1.00 10.00 H new ATOM 0 HG21 THR A 70 9.768 11.211 -3.433 1.00 10.00 H new ATOM 0 HG22 THR A 70 8.944 11.348 -1.862 1.00 10.00 H new ATOM 0 HG23 THR A 70 9.718 9.815 -2.330 1.00 10.00 H new ATOM 907 N ASP A 71 4.584 9.269 -2.327 1.00 10.00 N ATOM 908 CA ASP A 71 3.208 9.750 -2.314 1.00 10.00 C ATOM 909 C ASP A 71 2.643 9.754 -0.900 1.00 10.00 C ATOM 910 O ASP A 71 3.012 8.925 -0.062 1.00 10.00 O ATOM 911 CB ASP A 71 2.318 8.885 -3.215 1.00 10.00 C ATOM 912 CG ASP A 71 2.463 9.212 -4.689 1.00 10.00 C ATOM 913 OD1 ASP A 71 2.327 10.398 -5.059 1.00 10.00 O ATOM 914 OD2 ASP A 71 2.698 8.277 -5.485 1.00 10.00 O ATOM 0 H ASP A 71 4.677 8.255 -2.378 1.00 10.00 H new ATOM 0 HA ASP A 71 3.216 10.771 -2.695 1.00 10.00 H new ATOM 0 HB2 ASP A 71 2.563 7.835 -3.057 1.00 10.00 H new ATOM 0 HB3 ASP A 71 1.277 9.017 -2.921 1.00 10.00 H new ATOM 919 N THR A 72 1.761 10.707 -0.641 1.00 10.00 N ATOM 920 CA THR A 72 1.104 10.841 0.650 1.00 10.00 C ATOM 921 C THR A 72 -0.404 10.955 0.435 1.00 10.00 C ATOM 922 O THR A 72 -0.844 11.251 -0.678 1.00 10.00 O ATOM 923 CB THR A 72 1.615 12.086 1.414 1.00 10.00 C ATOM 924 OG1 THR A 72 1.832 13.170 0.502 1.00 10.00 O ATOM 925 CG2 THR A 72 2.908 11.783 2.151 1.00 10.00 C ATOM 0 H THR A 72 1.480 11.412 -1.323 1.00 10.00 H new ATOM 0 HA THR A 72 1.334 9.960 1.249 1.00 10.00 H new ATOM 0 HB THR A 72 0.855 12.366 2.143 1.00 10.00 H new ATOM 0 HG1 THR A 72 2.153 13.953 0.995 1.00 10.00 H new ATOM 0 HG21 THR A 72 3.244 12.676 2.679 1.00 10.00 H new ATOM 0 HG22 THR A 72 2.738 10.980 2.868 1.00 10.00 H new ATOM 0 HG23 THR A 72 3.671 11.476 1.436 1.00 10.00 H new ATOM 933 N PRO A 73 -1.223 10.707 1.474 1.00 10.00 N ATOM 934 CA PRO A 73 -2.684 10.800 1.361 1.00 10.00 C ATOM 935 C PRO A 73 -3.125 12.153 0.810 1.00 10.00 C ATOM 936 O PRO A 73 -4.006 12.233 -0.046 1.00 10.00 O ATOM 937 CB PRO A 73 -3.168 10.625 2.802 1.00 10.00 C ATOM 938 CG PRO A 73 -2.085 9.857 3.473 1.00 10.00 C ATOM 939 CD PRO A 73 -0.801 10.296 2.826 1.00 10.00 C ATOM 0 HA PRO A 73 -3.091 10.059 0.673 1.00 10.00 H new ATOM 0 HB2 PRO A 73 -3.328 11.589 3.286 1.00 10.00 H new ATOM 0 HB3 PRO A 73 -4.116 10.088 2.839 1.00 10.00 H new ATOM 0 HG2 PRO A 73 -2.070 10.058 4.544 1.00 10.00 H new ATOM 0 HG3 PRO A 73 -2.235 8.784 3.352 1.00 10.00 H new ATOM 0 HD2 PRO A 73 -0.338 11.119 3.370 1.00 10.00 H new ATOM 0 HD3 PRO A 73 -0.072 9.487 2.791 1.00 10.00 H new ATOM 947 N ALA A 74 -2.490 13.213 1.294 1.00 10.00 N ATOM 948 CA ALA A 74 -2.807 14.563 0.853 1.00 10.00 C ATOM 949 C ALA A 74 -2.287 14.821 -0.557 1.00 10.00 C ATOM 950 O ALA A 74 -2.863 15.609 -1.304 1.00 10.00 O ATOM 951 CB ALA A 74 -2.227 15.578 1.822 1.00 10.00 C ATOM 0 H ALA A 74 -1.750 13.162 1.994 1.00 10.00 H new ATOM 0 HA ALA A 74 -3.892 14.667 0.834 1.00 10.00 H new ATOM 0 HB1 ALA A 74 -2.470 16.585 1.483 1.00 10.00 H new ATOM 0 HB2 ALA A 74 -2.650 15.417 2.814 1.00 10.00 H new ATOM 0 HB3 ALA A 74 -1.144 15.461 1.866 1.00 10.00 H new ATOM 957 N GLN A 75 -1.205 14.144 -0.920 1.00 10.00 N ATOM 958 CA GLN A 75 -0.607 14.309 -2.239 1.00 10.00 C ATOM 959 C GLN A 75 -1.508 13.733 -3.325 1.00 10.00 C ATOM 960 O GLN A 75 -1.683 14.335 -4.380 1.00 10.00 O ATOM 961 CB GLN A 75 0.759 13.624 -2.294 1.00 10.00 C ATOM 962 CG GLN A 75 1.664 14.153 -3.392 1.00 10.00 C ATOM 963 CD GLN A 75 2.212 15.529 -3.075 1.00 10.00 C ATOM 964 OE1 GLN A 75 2.428 15.874 -1.911 1.00 10.00 O ATOM 965 NE2 GLN A 75 2.437 16.324 -4.106 1.00 10.00 N ATOM 0 H GLN A 75 -0.723 13.475 -0.319 1.00 10.00 H new ATOM 0 HA GLN A 75 -0.484 15.377 -2.417 1.00 10.00 H new ATOM 0 HB2 GLN A 75 1.257 13.750 -1.333 1.00 10.00 H new ATOM 0 HB3 GLN A 75 0.613 12.554 -2.440 1.00 10.00 H new ATOM 0 HG2 GLN A 75 2.492 13.461 -3.542 1.00 10.00 H new ATOM 0 HG3 GLN A 75 1.109 14.193 -4.329 1.00 10.00 H new ATOM 0 HE21 GLN A 75 2.244 15.998 -5.053 1.00 10.00 H new ATOM 0 HE22 GLN A 75 2.804 17.264 -3.955 1.00 10.00 H new ATOM 974 N LEU A 76 -2.084 12.568 -3.056 1.00 10.00 N ATOM 975 CA LEU A 76 -2.960 11.911 -4.019 1.00 10.00 C ATOM 976 C LEU A 76 -4.408 12.363 -3.860 1.00 10.00 C ATOM 977 O LEU A 76 -5.300 11.825 -4.517 1.00 10.00 O ATOM 978 CB LEU A 76 -2.873 10.390 -3.868 1.00 10.00 C ATOM 979 CG LEU A 76 -1.545 9.758 -4.295 1.00 10.00 C ATOM 980 CD1 LEU A 76 -1.582 8.254 -4.081 1.00 10.00 C ATOM 981 CD2 LEU A 76 -1.240 10.081 -5.753 1.00 10.00 C ATOM 0 H LEU A 76 -1.961 12.059 -2.181 1.00 10.00 H new ATOM 0 HA LEU A 76 -2.623 12.196 -5.016 1.00 10.00 H new ATOM 0 HB2 LEU A 76 -3.057 10.135 -2.824 1.00 10.00 H new ATOM 0 HB3 LEU A 76 -3.674 9.938 -4.453 1.00 10.00 H new ATOM 0 HG LEU A 76 -0.750 10.178 -3.678 1.00 10.00 H new ATOM 0 HD11 LEU A 76 -0.631 7.819 -4.389 1.00 10.00 H new ATOM 0 HD12 LEU A 76 -1.754 8.041 -3.026 1.00 10.00 H new ATOM 0 HD13 LEU A 76 -2.388 7.822 -4.674 1.00 10.00 H new ATOM 0 HD21 LEU A 76 -0.292 9.623 -6.037 1.00 10.00 H new ATOM 0 HD22 LEU A 76 -2.036 9.690 -6.387 1.00 10.00 H new ATOM 0 HD23 LEU A 76 -1.173 11.162 -5.880 1.00 10.00 H new ATOM 993 N GLU A 77 -4.633 13.353 -2.993 1.00 10.00 N ATOM 994 CA GLU A 77 -5.975 13.883 -2.740 1.00 10.00 C ATOM 995 C GLU A 77 -6.917 12.779 -2.262 1.00 10.00 C ATOM 996 O GLU A 77 -8.075 12.701 -2.681 1.00 10.00 O ATOM 997 CB GLU A 77 -6.536 14.547 -4.002 1.00 10.00 C ATOM 998 CG GLU A 77 -5.843 15.849 -4.366 1.00 10.00 C ATOM 999 CD GLU A 77 -6.526 17.057 -3.762 1.00 10.00 C ATOM 1000 OE1 GLU A 77 -7.500 17.554 -4.368 1.00 10.00 O ATOM 1001 OE2 GLU A 77 -6.098 17.513 -2.684 1.00 10.00 O ATOM 0 H GLU A 77 -3.897 13.806 -2.451 1.00 10.00 H new ATOM 0 HA GLU A 77 -5.898 14.633 -1.953 1.00 10.00 H new ATOM 0 HB2 GLU A 77 -6.447 13.852 -4.837 1.00 10.00 H new ATOM 0 HB3 GLU A 77 -7.599 14.739 -3.859 1.00 10.00 H new ATOM 0 HG2 GLU A 77 -4.808 15.813 -4.027 1.00 10.00 H new ATOM 0 HG3 GLU A 77 -5.819 15.953 -5.451 1.00 10.00 H new ATOM 1008 N MET A 78 -6.411 11.935 -1.372 1.00 10.00 N ATOM 1009 CA MET A 78 -7.187 10.828 -0.828 1.00 10.00 C ATOM 1010 C MET A 78 -8.000 11.296 0.368 1.00 10.00 C ATOM 1011 O MET A 78 -7.562 12.176 1.115 1.00 10.00 O ATOM 1012 CB MET A 78 -6.264 9.680 -0.407 1.00 10.00 C ATOM 1013 CG MET A 78 -5.353 9.198 -1.521 1.00 10.00 C ATOM 1014 SD MET A 78 -4.021 8.140 -0.925 1.00 10.00 S ATOM 1015 CE MET A 78 -4.920 6.640 -0.547 1.00 10.00 C ATOM 0 H MET A 78 -5.460 11.997 -1.009 1.00 10.00 H new ATOM 0 HA MET A 78 -7.863 10.469 -1.604 1.00 10.00 H new ATOM 0 HB2 MET A 78 -5.654 10.005 0.436 1.00 10.00 H new ATOM 0 HB3 MET A 78 -6.871 8.845 -0.058 1.00 10.00 H new ATOM 0 HG2 MET A 78 -5.944 8.652 -2.256 1.00 10.00 H new ATOM 0 HG3 MET A 78 -4.925 10.060 -2.033 1.00 10.00 H new ATOM 0 HE1 MET A 78 -4.247 5.785 -0.617 1.00 10.00 H new ATOM 0 HE2 MET A 78 -5.324 6.703 0.464 1.00 10.00 H new ATOM 0 HE3 MET A 78 -5.738 6.517 -1.257 1.00 10.00 H new ATOM 1025 N GLU A 79 -9.173 10.714 0.543 1.00 10.00 N ATOM 1026 CA GLU A 79 -10.045 11.073 1.649 1.00 10.00 C ATOM 1027 C GLU A 79 -10.308 9.864 2.535 1.00 10.00 C ATOM 1028 O GLU A 79 -9.768 8.782 2.302 1.00 10.00 O ATOM 1029 CB GLU A 79 -11.362 11.645 1.123 1.00 10.00 C ATOM 1030 CG GLU A 79 -11.286 13.124 0.781 1.00 10.00 C ATOM 1031 CD GLU A 79 -11.258 14.009 2.012 1.00 10.00 C ATOM 1032 OE1 GLU A 79 -12.266 14.704 2.266 1.00 10.00 O ATOM 1033 OE2 GLU A 79 -10.238 14.009 2.728 1.00 10.00 O ATOM 0 H GLU A 79 -9.545 9.988 -0.069 1.00 10.00 H new ATOM 0 HA GLU A 79 -9.548 11.837 2.247 1.00 10.00 H new ATOM 0 HB2 GLU A 79 -11.661 11.089 0.234 1.00 10.00 H new ATOM 0 HB3 GLU A 79 -12.140 11.493 1.871 1.00 10.00 H new ATOM 0 HG2 GLU A 79 -10.392 13.309 0.185 1.00 10.00 H new ATOM 0 HG3 GLU A 79 -12.143 13.394 0.164 1.00 10.00 H new ATOM 1040 N ASP A 80 -11.130 10.055 3.556 1.00 10.00 N ATOM 1041 CA ASP A 80 -11.459 8.980 4.481 1.00 10.00 C ATOM 1042 C ASP A 80 -12.319 7.925 3.802 1.00 10.00 C ATOM 1043 O ASP A 80 -13.140 8.240 2.937 1.00 10.00 O ATOM 1044 CB ASP A 80 -12.194 9.524 5.709 1.00 10.00 C ATOM 1045 CG ASP A 80 -11.257 10.044 6.779 1.00 10.00 C ATOM 1046 OD1 ASP A 80 -10.783 11.189 6.652 1.00 10.00 O ATOM 1047 OD2 ASP A 80 -11.006 9.317 7.765 1.00 10.00 O ATOM 0 H ASP A 80 -11.582 10.945 3.765 1.00 10.00 H new ATOM 0 HA ASP A 80 -10.523 8.523 4.801 1.00 10.00 H new ATOM 0 HB2 ASP A 80 -12.863 10.327 5.399 1.00 10.00 H new ATOM 0 HB3 ASP A 80 -12.817 8.735 6.131 1.00 10.00 H new ATOM 1052 N GLU A 81 -12.101 6.674 4.201 1.00 10.00 N ATOM 1053 CA GLU A 81 -12.832 5.520 3.681 1.00 10.00 C ATOM 1054 C GLU A 81 -12.418 5.167 2.254 1.00 10.00 C ATOM 1055 O GLU A 81 -13.073 4.357 1.600 1.00 10.00 O ATOM 1056 CB GLU A 81 -14.346 5.739 3.764 1.00 10.00 C ATOM 1057 CG GLU A 81 -14.857 5.879 5.187 1.00 10.00 C ATOM 1058 CD GLU A 81 -16.125 5.095 5.425 1.00 10.00 C ATOM 1059 OE1 GLU A 81 -17.216 5.612 5.109 1.00 10.00 O ATOM 1060 OE2 GLU A 81 -16.036 3.953 5.925 1.00 10.00 O ATOM 0 H GLU A 81 -11.403 6.430 4.903 1.00 10.00 H new ATOM 0 HA GLU A 81 -12.570 4.673 4.315 1.00 10.00 H new ATOM 0 HB2 GLU A 81 -14.607 6.636 3.202 1.00 10.00 H new ATOM 0 HB3 GLU A 81 -14.854 4.902 3.284 1.00 10.00 H new ATOM 0 HG2 GLU A 81 -14.088 5.540 5.881 1.00 10.00 H new ATOM 0 HG3 GLU A 81 -15.039 6.932 5.403 1.00 10.00 H new ATOM 1067 N ASP A 82 -11.331 5.760 1.775 1.00 10.00 N ATOM 1068 CA ASP A 82 -10.840 5.467 0.432 1.00 10.00 C ATOM 1069 C ASP A 82 -10.152 4.113 0.431 1.00 10.00 C ATOM 1070 O ASP A 82 -9.308 3.841 1.289 1.00 10.00 O ATOM 1071 CB ASP A 82 -9.881 6.552 -0.049 1.00 10.00 C ATOM 1072 CG ASP A 82 -10.517 7.444 -1.093 1.00 10.00 C ATOM 1073 OD1 ASP A 82 -11.435 6.969 -1.802 1.00 10.00 O ATOM 1074 OD2 ASP A 82 -10.108 8.621 -1.208 1.00 10.00 O ATOM 0 H ASP A 82 -10.775 6.442 2.291 1.00 10.00 H new ATOM 0 HA ASP A 82 -11.686 5.444 -0.254 1.00 10.00 H new ATOM 0 HB2 ASP A 82 -9.562 7.157 0.800 1.00 10.00 H new ATOM 0 HB3 ASP A 82 -8.986 6.088 -0.464 1.00 10.00 H new ATOM 1079 N THR A 83 -10.504 3.266 -0.523 1.00 10.00 N ATOM 1080 CA THR A 83 -9.938 1.929 -0.584 1.00 10.00 C ATOM 1081 C THR A 83 -8.797 1.807 -1.594 1.00 10.00 C ATOM 1082 O THR A 83 -8.927 2.184 -2.761 1.00 10.00 O ATOM 1083 CB THR A 83 -11.020 0.888 -0.921 1.00 10.00 C ATOM 1084 OG1 THR A 83 -12.204 1.138 -0.147 1.00 10.00 O ATOM 1085 CG2 THR A 83 -10.516 -0.520 -0.639 1.00 10.00 C ATOM 0 H THR A 83 -11.175 3.479 -1.261 1.00 10.00 H new ATOM 0 HA THR A 83 -9.528 1.735 0.407 1.00 10.00 H new ATOM 0 HB THR A 83 -11.256 0.972 -1.982 1.00 10.00 H new ATOM 0 HG1 THR A 83 -12.887 0.472 -0.370 1.00 10.00 H new ATOM 0 HG21 THR A 83 -11.296 -1.241 -0.884 1.00 10.00 H new ATOM 0 HG22 THR A 83 -9.634 -0.719 -1.247 1.00 10.00 H new ATOM 0 HG23 THR A 83 -10.257 -0.609 0.416 1.00 10.00 H new ATOM 1093 N ILE A 84 -7.679 1.278 -1.120 1.00 10.00 N ATOM 1094 CA ILE A 84 -6.509 1.048 -1.949 1.00 10.00 C ATOM 1095 C ILE A 84 -6.515 -0.407 -2.410 1.00 10.00 C ATOM 1096 O ILE A 84 -6.776 -1.311 -1.611 1.00 10.00 O ATOM 1097 CB ILE A 84 -5.204 1.339 -1.174 1.00 10.00 C ATOM 1098 CG1 ILE A 84 -5.259 2.730 -0.532 1.00 10.00 C ATOM 1099 CG2 ILE A 84 -3.997 1.222 -2.091 1.00 10.00 C ATOM 1100 CD1 ILE A 84 -4.086 3.029 0.384 1.00 10.00 C ATOM 0 H ILE A 84 -7.559 0.996 -0.147 1.00 10.00 H new ATOM 0 HA ILE A 84 -6.548 1.722 -2.805 1.00 10.00 H new ATOM 0 HB ILE A 84 -5.104 0.597 -0.382 1.00 10.00 H new ATOM 0 HG12 ILE A 84 -5.294 3.482 -1.320 1.00 10.00 H new ATOM 0 HG13 ILE A 84 -6.184 2.821 0.037 1.00 10.00 H new ATOM 0 HG21 ILE A 84 -3.089 1.431 -1.526 1.00 10.00 H new ATOM 0 HG22 ILE A 84 -3.946 0.212 -2.499 1.00 10.00 H new ATOM 0 HG23 ILE A 84 -4.089 1.939 -2.907 1.00 10.00 H new ATOM 0 HD11 ILE A 84 -4.195 4.030 0.800 1.00 10.00 H new ATOM 0 HD12 ILE A 84 -4.062 2.300 1.194 1.00 10.00 H new ATOM 0 HD13 ILE A 84 -3.157 2.972 -0.184 1.00 10.00 H new ATOM 1112 N ASP A 85 -6.243 -0.633 -3.685 1.00 10.00 N ATOM 1113 CA ASP A 85 -6.247 -1.982 -4.234 1.00 10.00 C ATOM 1114 C ASP A 85 -4.850 -2.580 -4.229 1.00 10.00 C ATOM 1115 O ASP A 85 -3.889 -1.944 -4.668 1.00 10.00 O ATOM 1116 CB ASP A 85 -6.805 -1.978 -5.659 1.00 10.00 C ATOM 1117 CG ASP A 85 -8.313 -1.826 -5.698 1.00 10.00 C ATOM 1118 OD1 ASP A 85 -9.023 -2.752 -5.252 1.00 10.00 O ATOM 1119 OD2 ASP A 85 -8.791 -0.783 -6.196 1.00 10.00 O ATOM 0 H ASP A 85 -6.017 0.098 -4.359 1.00 10.00 H new ATOM 0 HA ASP A 85 -6.887 -2.597 -3.601 1.00 10.00 H new ATOM 0 HB2 ASP A 85 -6.348 -1.164 -6.221 1.00 10.00 H new ATOM 0 HB3 ASP A 85 -6.525 -2.906 -6.157 1.00 10.00 H new ATOM 1124 N VAL A 86 -4.741 -3.799 -3.719 1.00 10.00 N ATOM 1125 CA VAL A 86 -3.465 -4.497 -3.658 1.00 10.00 C ATOM 1126 C VAL A 86 -3.432 -5.642 -4.667 1.00 10.00 C ATOM 1127 O VAL A 86 -4.229 -6.580 -4.589 1.00 10.00 O ATOM 1128 CB VAL A 86 -3.186 -5.058 -2.248 1.00 10.00 C ATOM 1129 CG1 VAL A 86 -1.775 -5.625 -2.161 1.00 10.00 C ATOM 1130 CG2 VAL A 86 -3.396 -3.985 -1.190 1.00 10.00 C ATOM 0 H VAL A 86 -5.526 -4.327 -3.339 1.00 10.00 H new ATOM 0 HA VAL A 86 -2.691 -3.769 -3.900 1.00 10.00 H new ATOM 0 HB VAL A 86 -3.892 -5.867 -2.061 1.00 10.00 H new ATOM 0 HG11 VAL A 86 -1.601 -6.015 -1.158 1.00 10.00 H new ATOM 0 HG12 VAL A 86 -1.661 -6.429 -2.888 1.00 10.00 H new ATOM 0 HG13 VAL A 86 -1.053 -4.837 -2.375 1.00 10.00 H new ATOM 0 HG21 VAL A 86 -3.194 -4.402 -0.204 1.00 10.00 H new ATOM 0 HG22 VAL A 86 -2.719 -3.152 -1.377 1.00 10.00 H new ATOM 0 HG23 VAL A 86 -4.426 -3.631 -1.230 1.00 10.00 H new ATOM 1140 N PHE A 87 -2.516 -5.553 -5.619 1.00 10.00 N ATOM 1141 CA PHE A 87 -2.374 -6.579 -6.642 1.00 10.00 C ATOM 1142 C PHE A 87 -1.057 -7.319 -6.460 1.00 10.00 C ATOM 1143 O PHE A 87 -0.208 -6.896 -5.676 1.00 10.00 O ATOM 1144 CB PHE A 87 -2.440 -5.959 -8.040 1.00 10.00 C ATOM 1145 CG PHE A 87 -3.807 -5.462 -8.410 1.00 10.00 C ATOM 1146 CD1 PHE A 87 -4.703 -6.290 -9.069 1.00 10.00 C ATOM 1147 CD2 PHE A 87 -4.197 -4.172 -8.099 1.00 10.00 C ATOM 1148 CE1 PHE A 87 -5.962 -5.838 -9.408 1.00 10.00 C ATOM 1149 CE2 PHE A 87 -5.455 -3.715 -8.438 1.00 10.00 C ATOM 1150 CZ PHE A 87 -6.339 -4.548 -9.091 1.00 10.00 C ATOM 0 H PHE A 87 -1.858 -4.779 -5.705 1.00 10.00 H new ATOM 0 HA PHE A 87 -3.197 -7.287 -6.539 1.00 10.00 H new ATOM 0 HB2 PHE A 87 -1.734 -5.131 -8.095 1.00 10.00 H new ATOM 0 HB3 PHE A 87 -2.121 -6.700 -8.773 1.00 10.00 H new ATOM 0 HD1 PHE A 87 -4.412 -7.300 -9.320 1.00 10.00 H new ATOM 0 HD2 PHE A 87 -3.510 -3.515 -7.586 1.00 10.00 H new ATOM 0 HE1 PHE A 87 -6.652 -6.492 -9.921 1.00 10.00 H new ATOM 0 HE2 PHE A 87 -5.747 -2.705 -8.192 1.00 10.00 H new ATOM 0 HZ PHE A 87 -7.324 -4.192 -9.354 1.00 10.00 H new ATOM 1160 N GLN A 88 -0.886 -8.417 -7.181 1.00 10.00 N ATOM 1161 CA GLN A 88 0.336 -9.199 -7.088 1.00 10.00 C ATOM 1162 C GLN A 88 1.040 -9.243 -8.436 1.00 10.00 C ATOM 1163 O GLN A 88 0.392 -9.323 -9.482 1.00 10.00 O ATOM 1164 CB GLN A 88 0.033 -10.615 -6.602 1.00 10.00 C ATOM 1165 CG GLN A 88 -0.433 -10.668 -5.156 1.00 10.00 C ATOM 1166 CD GLN A 88 0.236 -11.776 -4.368 1.00 10.00 C ATOM 1167 OE1 GLN A 88 1.361 -12.176 -4.669 1.00 10.00 O ATOM 1168 NE2 GLN A 88 -0.449 -12.279 -3.356 1.00 10.00 N ATOM 0 H GLN A 88 -1.577 -8.785 -7.835 1.00 10.00 H new ATOM 0 HA GLN A 88 0.996 -8.720 -6.364 1.00 10.00 H new ATOM 0 HB2 GLN A 88 -0.734 -11.054 -7.240 1.00 10.00 H new ATOM 0 HB3 GLN A 88 0.928 -11.228 -6.711 1.00 10.00 H new ATOM 0 HG2 GLN A 88 -0.227 -9.711 -4.677 1.00 10.00 H new ATOM 0 HG3 GLN A 88 -1.513 -10.811 -5.131 1.00 10.00 H new ATOM 0 HE21 GLN A 88 -1.379 -11.919 -3.140 1.00 10.00 H new ATOM 0 HE22 GLN A 88 -0.048 -13.027 -2.791 1.00 10.00 H new ATOM 1177 N GLN A 89 2.364 -9.178 -8.400 1.00 10.00 N ATOM 1178 CA GLN A 89 3.168 -9.201 -9.612 1.00 10.00 C ATOM 1179 C GLN A 89 3.067 -10.557 -10.306 1.00 10.00 C ATOM 1180 O GLN A 89 3.026 -11.602 -9.653 1.00 10.00 O ATOM 1181 CB GLN A 89 4.631 -8.879 -9.281 1.00 10.00 C ATOM 1182 CG GLN A 89 5.486 -8.579 -10.503 1.00 10.00 C ATOM 1183 CD GLN A 89 4.879 -7.512 -11.391 1.00 10.00 C ATOM 1184 OE1 GLN A 89 4.183 -6.610 -10.921 1.00 10.00 O ATOM 1185 NE2 GLN A 89 5.136 -7.609 -12.684 1.00 10.00 N ATOM 0 H GLN A 89 2.906 -9.109 -7.539 1.00 10.00 H new ATOM 0 HA GLN A 89 2.784 -8.442 -10.293 1.00 10.00 H new ATOM 0 HB2 GLN A 89 4.661 -8.022 -8.609 1.00 10.00 H new ATOM 0 HB3 GLN A 89 5.066 -9.721 -8.743 1.00 10.00 H new ATOM 0 HG2 GLN A 89 6.476 -8.257 -10.179 1.00 10.00 H new ATOM 0 HG3 GLN A 89 5.621 -9.493 -11.081 1.00 10.00 H new ATOM 0 HE21 GLN A 89 5.717 -8.371 -13.033 1.00 10.00 H new ATOM 0 HE22 GLN A 89 4.753 -6.922 -13.333 1.00 10.00 H new ATOM 1194 N GLN A 90 3.006 -10.524 -11.631 1.00 10.00 N ATOM 1195 CA GLN A 90 2.909 -11.730 -12.439 1.00 10.00 C ATOM 1196 C GLN A 90 4.168 -12.577 -12.292 1.00 10.00 C ATOM 1197 O GLN A 90 5.279 -12.051 -12.250 1.00 10.00 O ATOM 1198 CB GLN A 90 2.694 -11.367 -13.912 1.00 10.00 C ATOM 1199 CG GLN A 90 1.319 -10.782 -14.214 1.00 10.00 C ATOM 1200 CD GLN A 90 1.150 -9.366 -13.695 1.00 10.00 C ATOM 1201 OE1 GLN A 90 2.117 -8.615 -13.574 1.00 10.00 O ATOM 1202 NE2 GLN A 90 -0.080 -8.991 -13.382 1.00 10.00 N ATOM 0 H GLN A 90 3.022 -9.661 -12.174 1.00 10.00 H new ATOM 0 HA GLN A 90 2.055 -12.309 -12.088 1.00 10.00 H new ATOM 0 HB2 GLN A 90 3.457 -10.649 -14.213 1.00 10.00 H new ATOM 0 HB3 GLN A 90 2.839 -12.260 -14.520 1.00 10.00 H new ATOM 0 HG2 GLN A 90 1.156 -10.790 -15.292 1.00 10.00 H new ATOM 0 HG3 GLN A 90 0.554 -11.419 -13.771 1.00 10.00 H new ATOM 0 HE21 GLN A 90 -0.856 -9.643 -13.496 1.00 10.00 H new ATOM 0 HE22 GLN A 90 -0.252 -8.050 -13.027 1.00 10.00 H new ATOM 1247 N ASN B 358 -12.204 -9.073 7.738 1.00 10.00 N ATOM 1248 CA ASN B 358 -11.642 -8.554 8.972 1.00 10.00 C ATOM 1249 C ASN B 358 -11.247 -7.092 8.847 1.00 10.00 C ATOM 1250 O ASN B 358 -10.526 -6.715 7.927 1.00 10.00 O ATOM 1251 CB ASN B 358 -10.435 -9.404 9.409 1.00 10.00 C ATOM 1252 CG ASN B 358 -9.370 -9.558 8.324 1.00 10.00 C ATOM 1253 OD1 ASN B 358 -9.627 -9.380 7.133 1.00 10.00 O ATOM 1254 ND2 ASN B 358 -8.165 -9.915 8.730 1.00 10.00 N ATOM 0 HA ASN B 358 -12.416 -8.616 9.736 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -9.981 -8.950 10.290 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -10.786 -10.393 9.705 1.00 10.00 H new ATOM 0 HD21 ASN B 358 -7.417 -10.051 8.050 1.00 10.00 H new ATOM 0 HD22 ASN B 358 -7.982 -10.055 9.724 1.00 10.00 H new ATOM 1261 N ARG B 359 -11.734 -6.265 9.777 1.00 10.00 N ATOM 1262 CA ARG B 359 -11.384 -4.854 9.765 1.00 10.00 C ATOM 1263 C ARG B 359 -10.671 -4.484 11.066 1.00 10.00 C ATOM 1264 O ARG B 359 -11.229 -4.579 12.166 1.00 10.00 O ATOM 1265 CB ARG B 359 -12.645 -3.983 9.590 1.00 10.00 C ATOM 1266 CG ARG B 359 -13.825 -4.396 10.469 1.00 10.00 C ATOM 1267 CD ARG B 359 -14.290 -3.259 11.373 1.00 10.00 C ATOM 1268 NE ARG B 359 -14.903 -2.166 10.624 1.00 10.00 N ATOM 1269 CZ ARG B 359 -14.339 -0.968 10.453 1.00 10.00 C ATOM 1270 NH1 ARG B 359 -13.162 -0.698 11.010 1.00 10.00 N ATOM 1271 NH2 ARG B 359 -14.968 -0.033 9.745 1.00 10.00 N ATOM 0 H ARG B 359 -12.360 -6.547 10.532 1.00 10.00 H new ATOM 0 HA ARG B 359 -10.716 -4.669 8.924 1.00 10.00 H new ATOM 0 HB2 ARG B 359 -12.389 -2.947 9.810 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -12.955 -4.020 8.546 1.00 10.00 H new ATOM 0 HG2 ARG B 359 -14.653 -4.718 9.837 1.00 10.00 H new ATOM 0 HG3 ARG B 359 -13.539 -5.252 11.081 1.00 10.00 H new ATOM 0 HD2 ARG B 359 -15.006 -3.645 12.098 1.00 10.00 H new ATOM 0 HD3 ARG B 359 -13.440 -2.877 11.938 1.00 10.00 H new ATOM 0 HE ARG B 359 -15.819 -2.328 10.205 1.00 10.00 H new ATOM 0 HH11 ARG B 359 -12.688 -1.407 11.569 1.00 10.00 H new ATOM 0 HH12 ARG B 359 -12.733 0.218 10.878 1.00 10.00 H new ATOM 0 HH21 ARG B 359 -15.880 -0.232 9.334 1.00 10.00 H new ATOM 0 HH22 ARG B 359 -14.538 0.883 9.614 1.00 10.00 H new ATOM 1285 N ASP B 360 -9.432 -4.056 10.917 1.00 10.00 N ATOM 1286 CA ASP B 360 -8.586 -3.643 12.032 1.00 10.00 C ATOM 1287 C ASP B 360 -7.951 -2.292 11.723 1.00 10.00 C ATOM 1288 O ASP B 360 -7.585 -2.051 10.577 1.00 10.00 O ATOM 1289 CB ASP B 360 -7.550 -4.718 12.387 1.00 10.00 C ATOM 1290 CG ASP B 360 -6.225 -4.548 11.684 1.00 10.00 C ATOM 1291 OD1 ASP B 360 -6.125 -4.959 10.511 1.00 10.00 O ATOM 1292 OD2 ASP B 360 -5.275 -4.035 12.309 1.00 10.00 O ATOM 0 H ASP B 360 -8.974 -3.983 10.008 1.00 10.00 H new ATOM 0 HA ASP B 360 -9.205 -3.525 12.921 1.00 10.00 H new ATOM 0 HB2 ASP B 360 -7.383 -4.705 13.464 1.00 10.00 H new ATOM 0 HB3 ASP B 360 -7.958 -5.698 12.139 1.00 10.00 H new ATOM 1297 N PRO B 361 -7.805 -1.380 12.699 1.00 10.00 N ATOM 1298 CA PRO B 361 -7.228 -0.072 12.431 1.00 10.00 C ATOM 1299 C PRO B 361 -5.778 0.053 12.911 1.00 10.00 C ATOM 1300 O PRO B 361 -5.434 -0.266 14.055 1.00 10.00 O ATOM 1301 CB PRO B 361 -8.134 0.824 13.283 1.00 10.00 C ATOM 1302 CG PRO B 361 -8.544 -0.025 14.453 1.00 10.00 C ATOM 1303 CD PRO B 361 -8.287 -1.472 14.081 1.00 10.00 C ATOM 0 HA PRO B 361 -7.186 0.163 11.368 1.00 10.00 H new ATOM 0 HB2 PRO B 361 -7.605 1.718 13.612 1.00 10.00 H new ATOM 0 HB3 PRO B 361 -9.003 1.158 12.716 1.00 10.00 H new ATOM 0 HG2 PRO B 361 -7.976 0.248 15.342 1.00 10.00 H new ATOM 0 HG3 PRO B 361 -9.597 0.129 14.688 1.00 10.00 H new ATOM 0 HD2 PRO B 361 -7.547 -1.931 14.736 1.00 10.00 H new ATOM 0 HD3 PRO B 361 -9.193 -2.074 14.153 1.00 10.00 H new ATOM 1311 N ILE B 362 -4.941 0.530 11.992 1.00 10.00 N ATOM 1312 CA ILE B 362 -3.506 0.683 12.222 1.00 10.00 C ATOM 1313 C ILE B 362 -3.090 2.150 12.134 1.00 10.00 C ATOM 1314 O ILE B 362 -3.446 2.846 11.189 1.00 10.00 O ATOM 1315 CB ILE B 362 -2.693 -0.115 11.162 1.00 10.00 C ATOM 1316 CG1 ILE B 362 -3.432 -1.404 10.761 1.00 10.00 C ATOM 1317 CG2 ILE B 362 -1.290 -0.437 11.675 1.00 10.00 C ATOM 1318 CD1 ILE B 362 -3.126 -1.853 9.348 1.00 10.00 C ATOM 0 H ILE B 362 -5.241 0.823 11.062 1.00 10.00 H new ATOM 0 HA ILE B 362 -3.297 0.301 13.221 1.00 10.00 H new ATOM 0 HB ILE B 362 -2.594 0.512 10.276 1.00 10.00 H new ATOM 0 HG12 ILE B 362 -3.162 -2.200 11.455 1.00 10.00 H new ATOM 0 HG13 ILE B 362 -4.506 -1.245 10.860 1.00 10.00 H new ATOM 0 HG21 ILE B 362 -0.744 -0.995 10.915 1.00 10.00 H new ATOM 0 HG22 ILE B 362 -0.761 0.490 11.895 1.00 10.00 H new ATOM 0 HG23 ILE B 362 -1.363 -1.037 12.582 1.00 10.00 H new ATOM 0 HD11 ILE B 362 -3.679 -2.767 9.129 1.00 10.00 H new ATOM 0 HD12 ILE B 362 -3.422 -1.073 8.646 1.00 10.00 H new ATOM 0 HD13 ILE B 362 -2.057 -2.043 9.250 1.00 10.00 H new ATOM 1330 N VAL B 363 -2.342 2.623 13.127 1.00 10.00 N ATOM 1331 CA VAL B 363 -1.883 4.005 13.111 1.00 10.00 C ATOM 1332 C VAL B 363 -0.365 4.045 13.076 1.00 10.00 C ATOM 1333 O VAL B 363 0.305 3.454 13.927 1.00 10.00 O ATOM 1334 CB VAL B 363 -2.347 4.788 14.365 1.00 10.00 C ATOM 1335 CG1 VAL B 363 -1.989 6.264 14.245 1.00 10.00 C ATOM 1336 CG2 VAL B 363 -3.841 4.611 14.618 1.00 10.00 C ATOM 0 H VAL B 363 -2.046 2.080 13.938 1.00 10.00 H new ATOM 0 HA VAL B 363 -2.312 4.470 12.223 1.00 10.00 H new ATOM 0 HB VAL B 363 -1.818 4.375 15.224 1.00 10.00 H new ATOM 0 HG11 VAL B 363 -2.325 6.793 15.137 1.00 10.00 H new ATOM 0 HG12 VAL B 363 -0.909 6.369 14.145 1.00 10.00 H new ATOM 0 HG13 VAL B 363 -2.477 6.687 13.367 1.00 10.00 H new ATOM 0 HG21 VAL B 363 -4.129 5.175 15.505 1.00 10.00 H new ATOM 0 HG22 VAL B 363 -4.402 4.977 13.758 1.00 10.00 H new ATOM 0 HG23 VAL B 363 -4.061 3.555 14.772 1.00 10.00 H new ATOM 1346 N ILE B 364 0.167 4.731 12.082 1.00 10.00 N ATOM 1347 CA ILE B 364 1.603 4.890 11.956 1.00 10.00 C ATOM 1348 C ILE B 364 1.963 6.371 11.884 1.00 10.00 C ATOM 1349 O ILE B 364 1.330 7.149 11.168 1.00 10.00 O ATOM 1350 CB ILE B 364 2.207 4.114 10.757 1.00 10.00 C ATOM 1351 CG1 ILE B 364 3.695 3.875 10.991 1.00 10.00 C ATOM 1352 CG2 ILE B 364 2.001 4.848 9.446 1.00 10.00 C ATOM 1353 CD1 ILE B 364 4.243 2.709 10.204 1.00 10.00 C ATOM 0 H ILE B 364 -0.375 5.188 11.349 1.00 10.00 H new ATOM 0 HA ILE B 364 2.047 4.451 12.849 1.00 10.00 H new ATOM 0 HB ILE B 364 1.687 3.159 10.685 1.00 10.00 H new ATOM 0 HG12 ILE B 364 4.247 4.776 10.724 1.00 10.00 H new ATOM 0 HG13 ILE B 364 3.865 3.700 12.053 1.00 10.00 H new ATOM 0 HG21 ILE B 364 2.439 4.270 8.633 1.00 10.00 H new ATOM 0 HG22 ILE B 364 0.934 4.978 9.265 1.00 10.00 H new ATOM 0 HG23 ILE B 364 2.482 5.825 9.497 1.00 10.00 H new ATOM 0 HD11 ILE B 364 5.306 2.594 10.416 1.00 10.00 H new ATOM 0 HD12 ILE B 364 3.716 1.798 10.488 1.00 10.00 H new ATOM 0 HD13 ILE B 364 4.104 2.892 9.138 1.00 10.00 H new ATOM 1365 N SER B 365 2.933 6.769 12.673 1.00 10.00 N ATOM 1366 CA SER B 365 3.380 8.147 12.689 1.00 10.00 C ATOM 1367 C SER B 365 4.851 8.208 12.293 1.00 10.00 C ATOM 1368 O SER B 365 5.671 7.448 12.809 1.00 10.00 O ATOM 1369 CB SER B 365 3.149 8.741 14.079 1.00 10.00 C ATOM 1370 OG SER B 365 1.776 8.638 14.431 1.00 10.00 O ATOM 0 H SER B 365 3.432 6.156 13.317 1.00 10.00 H new ATOM 0 HA SER B 365 2.811 8.736 11.970 1.00 10.00 H new ATOM 0 HB2 SER B 365 3.761 8.217 14.813 1.00 10.00 H new ATOM 0 HB3 SER B 365 3.459 9.786 14.093 1.00 10.00 H new ATOM 0 HG SER B 365 1.638 9.019 15.323 1.00 10.00 H new