USER MOD reduce.3.24.130724 H: found=0, std=0, add=1272, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1272 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 99 MET CE :methyl -179:sc= -1.4 (180deg=-1.41) USER MOD Set 1.2: A 124 MET CE :methyl -154:sc= -0.122 (180deg=0) USER MOD Set 2.1: A 31 SER OG : rot -60:sc= 0.786 USER MOD Set 2.2: A 62 THR OG1 : rot 47:sc= 2.24 USER MOD Set 3.1: A 10 ASN : amide:sc= -8.2! C(o=-40!,f=-39!) USER MOD Set 3.2: A 48 GLN : amide:sc= -17.4! C(o=-40!,f=-39!) USER MOD Set 3.3: A 50 GLN : amide:sc= -14! C(o=-40!,f=-37!) USER MOD Single : A 1 THR N :NH3+ 135:sc= 0.0464 (180deg=0) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0.00259 USER MOD Single : A 4 TYR OH : rot 180:sc= -0.0718 USER MOD Single : A 9 SER OG : rot 166:sc= 0.209 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -2.51 K(o=-2.5,f=-6.4!) USER MOD Single : A 19 ASN : amide:sc= -2.01! K(o=-2!,f=-0.6) USER MOD Single : A 23 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0258) USER MOD Single : A 32 HIS : no HD1:sc= -2.15! C(o=-2.2!,f=-4.5!) USER MOD Single : A 35 THR OG1 : rot 145:sc= 0.168 USER MOD Single : A 37 SER OG : rot -58:sc= 0.694 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot -160:sc= -2.29! USER MOD Single : A 53 TYR OH : rot 22:sc= 1.64 USER MOD Single : A 55 ASN : amide:sc= -11.7! C(o=-12!,f=-12!) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 71 ASN : amide:sc= -3.77! K(o=-3.8!,f=-1.7) USER MOD Single : A 72 HIS : no HD1:sc= -17.5! C(o=-18!,f=-21!) USER MOD Single : A 73 THR OG1 : rot -4:sc= -0.707! USER MOD Single : A 74 GLN : amide:sc= -4.02! C(o=-4!,f=-5.6!) USER MOD Single : A 79 GLN : amide:sc= -0.782 K(o=-0.78,f=-0.0023) USER MOD Single : A 80 GLN : amide:sc= -7.92! C(o=-7.9!,f=-6.1!) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot -130:sc= -0.697 USER MOD Single : A 103 ASN : amide:sc= -4.17! K(o=-4.2!,f=-0.58) USER MOD Single : A 107 ASN : amide:sc= -3.69! K(o=-3.7!,f=-0.099) USER MOD Single : A 108 THR OG1 : rot 135:sc= -1.56! USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 HIS : no HD1:sc= -1.4 K(o=-1.4,f=-4.7!) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 MET CE :methyl -117:sc= -2.92 (180deg=-4.53!) USER MOD Single : A 119 LYS NZ :NH3+ 164:sc= -0.0393 (180deg=-0.307) USER MOD Single : A 120 ASN : amide:sc= -3.86! C(o=-3.9!,f=-5.6!) USER MOD Single : A 142 MET CE :methyl 163:sc= -0.139 (180deg=-0.573) USER MOD Single : A 145 GLN : amide:sc= -11.9! C(o=-12!,f=-6.4!) USER MOD Single : A 148 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 149 THR OG1 : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 1.192 -13.470 -9.289 1.00 0.73 N ATOM 2 CA THR A 1 0.465 -12.786 -8.190 1.00 0.53 C ATOM 3 C THR A 1 0.657 -11.273 -8.263 1.00 0.47 C ATOM 4 O THR A 1 1.671 -10.790 -8.764 1.00 0.70 O ATOM 5 CB THR A 1 0.985 -13.324 -6.854 1.00 0.54 C ATOM 6 OG1 THR A 1 0.820 -14.729 -6.782 1.00 0.58 O ATOM 7 CG2 THR A 1 0.291 -12.723 -5.650 1.00 0.81 C ATOM 0 H1 THR A 1 1.699 -14.295 -8.909 1.00 0.73 H new ATOM 0 H2 THR A 1 0.513 -13.784 -10.012 1.00 0.73 H new ATOM 0 H3 THR A 1 1.874 -12.811 -9.717 1.00 0.73 H new ATOM 0 HA THR A 1 -0.602 -12.986 -8.284 1.00 0.53 H new ATOM 0 HB THR A 1 2.038 -13.044 -6.824 1.00 0.54 H new ATOM 0 HG1 THR A 1 1.159 -15.055 -5.922 1.00 0.58 H new ATOM 0 HG21 THR A 1 0.709 -13.150 -4.738 1.00 0.81 H new ATOM 0 HG22 THR A 1 0.439 -11.643 -5.646 1.00 0.81 H new ATOM 0 HG23 THR A 1 -0.775 -12.943 -5.697 1.00 0.81 H new ATOM 17 N VAL A 2 -0.330 -10.532 -7.767 1.00 0.44 N ATOM 18 CA VAL A 2 -0.274 -9.074 -7.781 1.00 0.42 C ATOM 19 C VAL A 2 0.043 -8.512 -6.400 1.00 0.38 C ATOM 20 O VAL A 2 -0.408 -9.040 -5.382 1.00 0.43 O ATOM 21 CB VAL A 2 -1.605 -8.471 -8.266 1.00 0.51 C ATOM 22 CG1 VAL A 2 -1.602 -6.963 -8.096 1.00 1.29 C ATOM 23 CG2 VAL A 2 -1.865 -8.838 -9.716 1.00 0.85 C ATOM 0 H VAL A 2 -1.178 -10.917 -7.351 1.00 0.44 H new ATOM 0 HA VAL A 2 0.524 -8.800 -8.471 1.00 0.42 H new ATOM 0 HB VAL A 2 -2.407 -8.887 -7.657 1.00 0.51 H new ATOM 0 HG11 VAL A 2 -2.551 -6.556 -8.444 1.00 1.29 H new ATOM 0 HG12 VAL A 2 -1.466 -6.716 -7.043 1.00 1.29 H new ATOM 0 HG13 VAL A 2 -0.787 -6.533 -8.678 1.00 1.29 H new ATOM 0 HG21 VAL A 2 -2.811 -8.402 -10.038 1.00 0.85 H new ATOM 0 HG22 VAL A 2 -1.057 -8.454 -10.339 1.00 0.85 H new ATOM 0 HG23 VAL A 2 -1.914 -9.923 -9.814 1.00 0.85 H new ATOM 33 N ALA A 3 0.805 -7.420 -6.374 1.00 0.38 N ATOM 34 CA ALA A 3 1.163 -6.770 -5.122 1.00 0.40 C ATOM 35 C ALA A 3 0.326 -5.511 -4.918 1.00 0.40 C ATOM 36 O ALA A 3 0.627 -4.452 -5.471 1.00 0.65 O ATOM 37 CB ALA A 3 2.647 -6.435 -5.104 1.00 0.43 C ATOM 0 H ALA A 3 1.184 -6.970 -7.207 1.00 0.38 H new ATOM 0 HA ALA A 3 0.956 -7.457 -4.302 1.00 0.40 H new ATOM 0 HB1 ALA A 3 2.899 -5.949 -4.161 1.00 0.43 H new ATOM 0 HB2 ALA A 3 3.228 -7.351 -5.207 1.00 0.43 H new ATOM 0 HB3 ALA A 3 2.879 -5.764 -5.931 1.00 0.43 H new ATOM 43 N TYR A 4 -0.722 -5.641 -4.117 1.00 0.25 N ATOM 44 CA TYR A 4 -1.623 -4.535 -3.817 1.00 0.24 C ATOM 45 C TYR A 4 -1.067 -3.718 -2.652 1.00 0.27 C ATOM 46 O TYR A 4 -1.418 -3.948 -1.494 1.00 0.35 O ATOM 47 CB TYR A 4 -3.000 -5.094 -3.485 1.00 0.25 C ATOM 48 CG TYR A 4 -3.500 -6.086 -4.513 1.00 0.27 C ATOM 49 CD1 TYR A 4 -3.078 -7.411 -4.495 1.00 0.55 C ATOM 50 CD2 TYR A 4 -4.378 -5.695 -5.514 1.00 0.62 C ATOM 51 CE1 TYR A 4 -3.517 -8.315 -5.440 1.00 0.61 C ATOM 52 CE2 TYR A 4 -4.822 -6.595 -6.462 1.00 0.66 C ATOM 53 CZ TYR A 4 -4.390 -7.902 -6.421 1.00 0.45 C ATOM 54 OH TYR A 4 -4.832 -8.799 -7.368 1.00 0.55 O ATOM 0 H TYR A 4 -0.972 -6.516 -3.656 1.00 0.25 H new ATOM 0 HA TYR A 4 -1.710 -3.876 -4.681 1.00 0.24 H new ATOM 0 HB2 TYR A 4 -2.964 -5.578 -2.509 1.00 0.25 H new ATOM 0 HB3 TYR A 4 -3.711 -4.271 -3.407 1.00 0.25 H new ATOM 0 HD1 TYR A 4 -2.394 -7.738 -3.726 1.00 0.55 H new ATOM 0 HD2 TYR A 4 -4.719 -4.671 -5.552 1.00 0.62 H new ATOM 0 HE1 TYR A 4 -3.178 -9.340 -5.410 1.00 0.61 H new ATOM 0 HE2 TYR A 4 -5.506 -6.275 -7.234 1.00 0.66 H new ATOM 0 HH TYR A 4 -5.443 -8.347 -7.987 1.00 0.55 H new ATOM 64 N ILE A 5 -0.165 -2.792 -2.968 1.00 0.28 N ATOM 65 CA ILE A 5 0.488 -1.967 -1.954 1.00 0.34 C ATOM 66 C ILE A 5 -0.212 -0.623 -1.754 1.00 0.34 C ATOM 67 O ILE A 5 -0.965 -0.164 -2.614 1.00 0.39 O ATOM 68 CB ILE A 5 1.957 -1.700 -2.340 1.00 0.41 C ATOM 69 CG1 ILE A 5 2.597 -2.979 -2.884 1.00 0.44 C ATOM 70 CG2 ILE A 5 2.738 -1.176 -1.144 1.00 0.53 C ATOM 71 CD1 ILE A 5 4.027 -2.793 -3.349 1.00 0.95 C ATOM 0 H ILE A 5 0.132 -2.593 -3.923 1.00 0.28 H new ATOM 0 HA ILE A 5 0.433 -2.527 -1.020 1.00 0.34 H new ATOM 0 HB ILE A 5 1.981 -0.939 -3.120 1.00 0.41 H new ATOM 0 HG12 ILE A 5 2.573 -3.745 -2.109 1.00 0.44 H new ATOM 0 HG13 ILE A 5 1.998 -3.349 -3.717 1.00 0.44 H new ATOM 0 HG21 ILE A 5 3.772 -0.994 -1.436 1.00 0.53 H new ATOM 0 HG22 ILE A 5 2.290 -0.245 -0.796 1.00 0.53 H new ATOM 0 HG23 ILE A 5 2.712 -1.913 -0.341 1.00 0.53 H new ATOM 0 HD11 ILE A 5 4.415 -3.741 -3.721 1.00 0.95 H new ATOM 0 HD12 ILE A 5 4.057 -2.051 -4.147 1.00 0.95 H new ATOM 0 HD13 ILE A 5 4.640 -2.453 -2.514 1.00 0.95 H new ATOM 83 N ALA A 6 0.069 0.005 -0.613 1.00 0.40 N ATOM 84 CA ALA A 6 -0.499 1.308 -0.281 1.00 0.44 C ATOM 85 C ALA A 6 0.624 2.310 -0.013 1.00 0.42 C ATOM 86 O ALA A 6 1.534 2.033 0.769 1.00 0.58 O ATOM 87 CB ALA A 6 -1.417 1.194 0.928 1.00 0.53 C ATOM 0 H ALA A 6 0.692 -0.372 0.101 1.00 0.40 H new ATOM 0 HA ALA A 6 -1.091 1.663 -1.125 1.00 0.44 H new ATOM 0 HB1 ALA A 6 -1.833 2.174 1.163 1.00 0.53 H new ATOM 0 HB2 ALA A 6 -2.227 0.500 0.705 1.00 0.53 H new ATOM 0 HB3 ALA A 6 -0.849 0.826 1.783 1.00 0.53 H new ATOM 93 N ILE A 7 0.572 3.460 -0.679 1.00 0.41 N ATOM 94 CA ILE A 7 1.608 4.478 -0.518 1.00 0.40 C ATOM 95 C ILE A 7 1.051 5.773 0.065 1.00 0.44 C ATOM 96 O ILE A 7 -0.138 6.065 -0.060 1.00 0.52 O ATOM 97 CB ILE A 7 2.285 4.785 -1.868 1.00 0.50 C ATOM 98 CG1 ILE A 7 2.709 3.483 -2.553 1.00 0.65 C ATOM 99 CG2 ILE A 7 3.490 5.698 -1.666 1.00 0.53 C ATOM 100 CD1 ILE A 7 3.270 3.677 -3.944 1.00 0.99 C ATOM 0 H ILE A 7 -0.171 3.710 -1.331 1.00 0.41 H new ATOM 0 HA ILE A 7 2.341 4.072 0.179 1.00 0.40 H new ATOM 0 HB ILE A 7 1.569 5.300 -2.508 1.00 0.50 H new ATOM 0 HG12 ILE A 7 3.458 2.986 -1.936 1.00 0.65 H new ATOM 0 HG13 ILE A 7 1.849 2.816 -2.609 1.00 0.65 H new ATOM 0 HG21 ILE A 7 3.956 5.904 -2.630 1.00 0.53 H new ATOM 0 HG22 ILE A 7 3.165 6.634 -1.212 1.00 0.53 H new ATOM 0 HG23 ILE A 7 4.211 5.209 -1.012 1.00 0.53 H new ATOM 0 HD11 ILE A 7 3.547 2.710 -4.363 1.00 0.99 H new ATOM 0 HD12 ILE A 7 2.517 4.144 -4.578 1.00 0.99 H new ATOM 0 HD13 ILE A 7 4.151 4.317 -3.895 1.00 0.99 H new ATOM 112 N GLY A 8 1.930 6.548 0.699 1.00 0.50 N ATOM 113 CA GLY A 8 1.533 7.812 1.290 1.00 0.61 C ATOM 114 C GLY A 8 2.653 8.837 1.252 1.00 0.62 C ATOM 115 O GLY A 8 3.814 8.481 1.042 1.00 0.90 O ATOM 0 H GLY A 8 2.917 6.318 0.813 1.00 0.50 H new ATOM 0 HA2 GLY A 8 0.666 8.204 0.759 1.00 0.61 H new ATOM 0 HA3 GLY A 8 1.227 7.648 2.323 1.00 0.61 H new ATOM 119 N SER A 9 2.308 10.109 1.446 1.00 0.56 N ATOM 120 CA SER A 9 3.294 11.189 1.424 1.00 0.63 C ATOM 121 C SER A 9 2.639 12.534 1.707 1.00 0.66 C ATOM 122 O SER A 9 1.628 12.874 1.096 1.00 0.77 O ATOM 123 CB SER A 9 3.995 11.236 0.069 1.00 0.77 C ATOM 124 OG SER A 9 3.057 11.187 -0.990 1.00 1.58 O ATOM 0 H SER A 9 1.352 10.418 1.620 1.00 0.56 H new ATOM 0 HA SER A 9 4.028 10.989 2.205 1.00 0.63 H new ATOM 0 HB2 SER A 9 4.587 12.148 -0.007 1.00 0.77 H new ATOM 0 HB3 SER A 9 4.688 10.399 -0.015 1.00 0.77 H new ATOM 0 HG SER A 9 3.497 11.440 -1.828 1.00 1.58 H new ATOM 130 N ASN A 10 3.211 13.299 2.637 1.00 0.69 N ATOM 131 CA ASN A 10 2.644 14.597 2.984 1.00 0.79 C ATOM 132 C ASN A 10 3.693 15.644 3.373 1.00 0.83 C ATOM 133 O ASN A 10 3.834 16.667 2.703 1.00 0.98 O ATOM 134 CB ASN A 10 1.638 14.440 4.127 1.00 0.99 C ATOM 135 CG ASN A 10 2.036 13.381 5.140 1.00 1.05 C ATOM 136 OD1 ASN A 10 3.217 13.131 5.370 1.00 2.01 O ATOM 137 ND2 ASN A 10 1.042 12.774 5.783 1.00 1.01 N ATOM 0 H ASN A 10 4.053 13.046 3.155 1.00 0.69 H new ATOM 0 HA ASN A 10 2.152 14.963 2.083 1.00 0.79 H new ATOM 0 HB2 ASN A 10 1.527 15.397 4.637 1.00 0.99 H new ATOM 0 HB3 ASN A 10 0.663 14.186 3.711 1.00 0.99 H new ATOM 0 HD21 ASN A 10 1.248 12.074 6.495 1.00 1.01 H new ATOM 0 HD22 ASN A 10 0.074 13.009 5.564 1.00 1.01 H new ATOM 144 N LEU A 11 4.383 15.408 4.480 1.00 0.83 N ATOM 145 CA LEU A 11 5.373 16.359 4.990 1.00 0.95 C ATOM 146 C LEU A 11 6.652 16.393 4.151 1.00 0.93 C ATOM 147 O LEU A 11 7.623 17.052 4.525 1.00 1.38 O ATOM 148 CB LEU A 11 5.686 16.052 6.472 1.00 1.12 C ATOM 149 CG LEU A 11 6.577 14.834 6.771 1.00 0.90 C ATOM 150 CD1 LEU A 11 6.185 13.640 5.921 1.00 1.77 C ATOM 151 CD2 LEU A 11 8.051 15.169 6.594 1.00 1.54 C ATOM 0 H LEU A 11 4.278 14.566 5.046 1.00 0.83 H new ATOM 0 HA LEU A 11 4.936 17.355 4.915 1.00 0.95 H new ATOM 0 HB2 LEU A 11 6.162 16.932 6.905 1.00 1.12 H new ATOM 0 HB3 LEU A 11 4.739 15.913 6.994 1.00 1.12 H new ATOM 0 HG LEU A 11 6.420 14.564 7.815 1.00 0.90 H new ATOM 0 HD11 LEU A 11 6.834 12.797 6.157 1.00 1.77 H new ATOM 0 HD12 LEU A 11 5.149 13.370 6.128 1.00 1.77 H new ATOM 0 HD13 LEU A 11 6.290 13.894 4.866 1.00 1.77 H new ATOM 0 HD21 LEU A 11 8.653 14.287 6.813 1.00 1.54 H new ATOM 0 HD22 LEU A 11 8.231 15.486 5.567 1.00 1.54 H new ATOM 0 HD23 LEU A 11 8.326 15.974 7.276 1.00 1.54 H new ATOM 163 N ALA A 12 6.655 15.704 3.012 1.00 0.84 N ATOM 164 CA ALA A 12 7.832 15.692 2.150 1.00 0.91 C ATOM 165 C ALA A 12 7.464 15.437 0.691 1.00 0.95 C ATOM 166 O ALA A 12 7.720 14.356 0.159 1.00 1.72 O ATOM 167 CB ALA A 12 8.831 14.655 2.637 1.00 0.97 C ATOM 0 H ALA A 12 5.867 15.154 2.669 1.00 0.84 H new ATOM 0 HA ALA A 12 8.291 16.679 2.203 1.00 0.91 H new ATOM 0 HB1 ALA A 12 9.704 14.657 1.985 1.00 0.97 H new ATOM 0 HB2 ALA A 12 9.138 14.895 3.655 1.00 0.97 H new ATOM 0 HB3 ALA A 12 8.368 13.668 2.621 1.00 0.97 H new ATOM 173 N SER A 13 6.872 16.440 0.054 1.00 0.81 N ATOM 174 CA SER A 13 6.474 16.337 -1.348 1.00 0.79 C ATOM 175 C SER A 13 5.602 15.105 -1.577 1.00 0.71 C ATOM 176 O SER A 13 6.103 14.031 -1.907 1.00 0.71 O ATOM 177 CB SER A 13 7.709 16.278 -2.250 1.00 0.89 C ATOM 178 OG SER A 13 8.511 17.435 -2.089 1.00 1.47 O ATOM 0 H SER A 13 6.656 17.338 0.487 1.00 0.81 H new ATOM 0 HA SER A 13 5.893 17.224 -1.600 1.00 0.79 H new ATOM 0 HB2 SER A 13 8.294 15.390 -2.013 1.00 0.89 H new ATOM 0 HB3 SER A 13 7.399 16.188 -3.291 1.00 0.89 H new ATOM 0 HG SER A 13 9.295 17.374 -2.674 1.00 1.47 H new ATOM 184 N PRO A 14 4.277 15.242 -1.396 1.00 0.69 N ATOM 185 CA PRO A 14 3.336 14.133 -1.575 1.00 0.66 C ATOM 186 C PRO A 14 3.332 13.574 -2.999 1.00 0.67 C ATOM 187 O PRO A 14 3.014 12.406 -3.214 1.00 0.66 O ATOM 188 CB PRO A 14 1.972 14.757 -1.250 1.00 0.68 C ATOM 189 CG PRO A 14 2.284 15.982 -0.461 1.00 0.80 C ATOM 190 CD PRO A 14 3.594 16.483 -0.993 1.00 0.78 C ATOM 0 HA PRO A 14 3.600 13.286 -0.942 1.00 0.66 H new ATOM 0 HB2 PRO A 14 1.424 15.003 -2.160 1.00 0.68 H new ATOM 0 HB3 PRO A 14 1.349 14.068 -0.679 1.00 0.68 H new ATOM 0 HG2 PRO A 14 1.502 16.732 -0.576 1.00 0.80 H new ATOM 0 HG3 PRO A 14 2.354 15.756 0.603 1.00 0.80 H new ATOM 0 HD2 PRO A 14 3.456 17.161 -1.835 1.00 0.78 H new ATOM 0 HD3 PRO A 14 4.157 17.027 -0.235 1.00 0.78 H new ATOM 198 N LEU A 15 3.664 14.419 -3.969 1.00 0.73 N ATOM 199 CA LEU A 15 3.675 14.007 -5.372 1.00 0.78 C ATOM 200 C LEU A 15 4.998 13.358 -5.781 1.00 0.73 C ATOM 201 O LEU A 15 5.022 12.471 -6.634 1.00 0.79 O ATOM 202 CB LEU A 15 3.394 15.211 -6.275 1.00 0.92 C ATOM 203 CG LEU A 15 3.363 14.907 -7.774 1.00 0.98 C ATOM 204 CD1 LEU A 15 2.233 13.941 -8.104 1.00 1.00 C ATOM 205 CD2 LEU A 15 3.215 16.193 -8.574 1.00 1.15 C ATOM 0 H LEU A 15 3.929 15.392 -3.812 1.00 0.73 H new ATOM 0 HA LEU A 15 2.891 13.259 -5.491 1.00 0.78 H new ATOM 0 HB2 LEU A 15 2.436 15.644 -5.988 1.00 0.92 H new ATOM 0 HB3 LEU A 15 4.155 15.969 -6.090 1.00 0.92 H new ATOM 0 HG LEU A 15 4.307 14.435 -8.048 1.00 0.98 H new ATOM 0 HD11 LEU A 15 2.229 13.738 -9.175 1.00 1.00 H new ATOM 0 HD12 LEU A 15 2.380 13.009 -7.559 1.00 1.00 H new ATOM 0 HD13 LEU A 15 1.280 14.384 -7.815 1.00 1.00 H new ATOM 0 HD21 LEU A 15 3.195 15.959 -9.638 1.00 1.15 H new ATOM 0 HD22 LEU A 15 2.287 16.691 -8.294 1.00 1.15 H new ATOM 0 HD23 LEU A 15 4.058 16.852 -8.363 1.00 1.15 H new ATOM 217 N GLU A 16 6.098 13.818 -5.193 1.00 0.71 N ATOM 218 CA GLU A 16 7.420 13.298 -5.526 1.00 0.71 C ATOM 219 C GLU A 16 7.678 11.920 -4.924 1.00 0.63 C ATOM 220 O GLU A 16 8.477 11.147 -5.456 1.00 0.65 O ATOM 221 CB GLU A 16 8.484 14.284 -5.062 1.00 0.81 C ATOM 222 CG GLU A 16 8.545 15.540 -5.912 1.00 0.95 C ATOM 223 CD GLU A 16 9.034 15.266 -7.322 1.00 1.57 C ATOM 224 OE1 GLU A 16 10.177 14.784 -7.472 1.00 2.35 O ATOM 225 OE2 GLU A 16 8.273 15.531 -8.274 1.00 2.01 O ATOM 0 H GLU A 16 6.100 14.550 -4.483 1.00 0.71 H new ATOM 0 HA GLU A 16 7.465 13.181 -6.609 1.00 0.71 H new ATOM 0 HB2 GLU A 16 8.286 14.563 -4.027 1.00 0.81 H new ATOM 0 HB3 GLU A 16 9.457 13.794 -5.079 1.00 0.81 H new ATOM 0 HG2 GLU A 16 7.555 15.993 -5.956 1.00 0.95 H new ATOM 0 HG3 GLU A 16 9.206 16.265 -5.436 1.00 0.95 H new ATOM 232 N GLN A 17 7.016 11.615 -3.818 1.00 0.59 N ATOM 233 CA GLN A 17 7.197 10.326 -3.157 1.00 0.56 C ATOM 234 C GLN A 17 6.593 9.189 -3.976 1.00 0.55 C ATOM 235 O GLN A 17 6.949 8.026 -3.790 1.00 0.61 O ATOM 236 CB GLN A 17 6.567 10.351 -1.766 1.00 0.62 C ATOM 237 CG GLN A 17 7.189 11.378 -0.835 1.00 0.71 C ATOM 238 CD GLN A 17 8.642 11.082 -0.530 1.00 1.20 C ATOM 239 OE1 GLN A 17 8.971 10.031 0.019 1.00 1.99 O ATOM 240 NE2 GLN A 17 9.521 12.011 -0.880 1.00 1.63 N ATOM 0 H GLN A 17 6.351 12.237 -3.359 1.00 0.59 H new ATOM 0 HA GLN A 17 8.269 10.149 -3.067 1.00 0.56 H new ATOM 0 HB2 GLN A 17 5.501 10.559 -1.863 1.00 0.62 H new ATOM 0 HB3 GLN A 17 6.660 9.362 -1.317 1.00 0.62 H new ATOM 0 HG2 GLN A 17 7.110 12.367 -1.286 1.00 0.71 H new ATOM 0 HG3 GLN A 17 6.624 11.407 0.097 1.00 0.71 H new ATOM 0 HE21 GLN A 17 9.204 12.868 -1.333 1.00 1.63 H new ATOM 0 HE22 GLN A 17 10.514 11.869 -0.696 1.00 1.63 H new ATOM 249 N VAL A 18 5.672 9.528 -4.871 1.00 0.56 N ATOM 250 CA VAL A 18 5.010 8.528 -5.705 1.00 0.62 C ATOM 251 C VAL A 18 5.787 8.246 -6.988 1.00 0.60 C ATOM 252 O VAL A 18 5.756 7.127 -7.500 1.00 0.64 O ATOM 253 CB VAL A 18 3.574 8.965 -6.061 1.00 0.76 C ATOM 254 CG1 VAL A 18 2.891 7.925 -6.940 1.00 0.82 C ATOM 255 CG2 VAL A 18 2.766 9.212 -4.797 1.00 0.83 C ATOM 0 H VAL A 18 5.366 10.486 -5.039 1.00 0.56 H new ATOM 0 HA VAL A 18 4.973 7.610 -5.118 1.00 0.62 H new ATOM 0 HB VAL A 18 3.631 9.897 -6.624 1.00 0.76 H new ATOM 0 HG11 VAL A 18 1.880 8.256 -7.177 1.00 0.82 H new ATOM 0 HG12 VAL A 18 3.458 7.800 -7.863 1.00 0.82 H new ATOM 0 HG13 VAL A 18 2.846 6.974 -6.410 1.00 0.82 H new ATOM 0 HG21 VAL A 18 1.755 9.520 -5.066 1.00 0.83 H new ATOM 0 HG22 VAL A 18 2.722 8.296 -4.208 1.00 0.83 H new ATOM 0 HG23 VAL A 18 3.240 9.998 -4.210 1.00 0.83 H new ATOM 265 N ASN A 19 6.485 9.252 -7.511 1.00 0.60 N ATOM 266 CA ASN A 19 7.256 9.072 -8.738 1.00 0.64 C ATOM 267 C ASN A 19 8.245 7.917 -8.606 1.00 0.56 C ATOM 268 O ASN A 19 8.368 7.091 -9.509 1.00 0.63 O ATOM 269 CB ASN A 19 8.004 10.352 -9.114 1.00 0.72 C ATOM 270 CG ASN A 19 7.067 11.485 -9.481 1.00 0.82 C ATOM 271 OD1 ASN A 19 6.181 11.327 -10.322 1.00 0.92 O ATOM 272 ND2 ASN A 19 7.271 12.642 -8.867 1.00 0.84 N ATOM 0 H ASN A 19 6.533 10.189 -7.110 1.00 0.60 H new ATOM 0 HA ASN A 19 6.547 8.835 -9.531 1.00 0.64 H new ATOM 0 HB2 ASN A 19 8.632 10.661 -8.278 1.00 0.72 H new ATOM 0 HB3 ASN A 19 8.668 10.148 -9.954 1.00 0.72 H new ATOM 0 HD21 ASN A 19 6.682 13.446 -9.085 1.00 0.84 H new ATOM 0 HD22 ASN A 19 8.017 12.728 -8.177 1.00 0.84 H new ATOM 279 N ALA A 20 8.949 7.864 -7.480 1.00 0.47 N ATOM 280 CA ALA A 20 9.927 6.808 -7.243 1.00 0.42 C ATOM 281 C ALA A 20 9.280 5.577 -6.615 1.00 0.35 C ATOM 282 O ALA A 20 9.786 4.468 -6.757 1.00 0.36 O ATOM 283 CB ALA A 20 11.058 7.318 -6.364 1.00 0.43 C ATOM 0 H ALA A 20 8.861 8.538 -6.719 1.00 0.47 H new ATOM 0 HA ALA A 20 10.337 6.513 -8.209 1.00 0.42 H new ATOM 0 HB1 ALA A 20 11.779 6.517 -6.197 1.00 0.43 H new ATOM 0 HB2 ALA A 20 11.553 8.155 -6.857 1.00 0.43 H new ATOM 0 HB3 ALA A 20 10.654 7.648 -5.407 1.00 0.43 H new ATOM 289 N ALA A 21 8.168 5.778 -5.920 1.00 0.36 N ATOM 290 CA ALA A 21 7.464 4.672 -5.271 1.00 0.39 C ATOM 291 C ALA A 21 6.988 3.644 -6.291 1.00 0.41 C ATOM 292 O ALA A 21 7.059 2.438 -6.051 1.00 0.44 O ATOM 293 CB ALA A 21 6.289 5.198 -4.465 1.00 0.46 C ATOM 0 H ALA A 21 7.733 6.691 -5.790 1.00 0.36 H new ATOM 0 HA ALA A 21 8.164 4.177 -4.598 1.00 0.39 H new ATOM 0 HB1 ALA A 21 5.774 4.365 -3.987 1.00 0.46 H new ATOM 0 HB2 ALA A 21 6.651 5.887 -3.702 1.00 0.46 H new ATOM 0 HB3 ALA A 21 5.598 5.720 -5.127 1.00 0.46 H new ATOM 299 N LEU A 22 6.496 4.126 -7.428 1.00 0.47 N ATOM 300 CA LEU A 22 6.001 3.248 -8.484 1.00 0.53 C ATOM 301 C LEU A 22 7.136 2.775 -9.374 1.00 0.50 C ATOM 302 O LEU A 22 7.303 1.582 -9.623 1.00 0.64 O ATOM 303 CB LEU A 22 4.966 3.986 -9.340 1.00 0.70 C ATOM 304 CG LEU A 22 3.951 4.819 -8.562 1.00 0.81 C ATOM 305 CD1 LEU A 22 2.830 5.294 -9.473 1.00 1.28 C ATOM 306 CD2 LEU A 22 3.401 4.020 -7.397 1.00 1.35 C ATOM 0 H LEU A 22 6.429 5.121 -7.642 1.00 0.47 H new ATOM 0 HA LEU A 22 5.539 2.382 -8.011 1.00 0.53 H new ATOM 0 HB2 LEU A 22 5.493 4.641 -10.034 1.00 0.70 H new ATOM 0 HB3 LEU A 22 4.426 3.253 -9.940 1.00 0.70 H new ATOM 0 HG LEU A 22 4.455 5.701 -8.167 1.00 0.81 H new ATOM 0 HD11 LEU A 22 2.119 5.886 -8.897 1.00 1.28 H new ATOM 0 HD12 LEU A 22 3.246 5.906 -10.273 1.00 1.28 H new ATOM 0 HD13 LEU A 22 2.320 4.432 -9.903 1.00 1.28 H new ATOM 0 HD21 LEU A 22 2.678 4.625 -6.850 1.00 1.35 H new ATOM 0 HD22 LEU A 22 2.912 3.121 -7.771 1.00 1.35 H new ATOM 0 HD23 LEU A 22 4.217 3.739 -6.731 1.00 1.35 H new ATOM 318 N LYS A 23 7.898 3.738 -9.855 1.00 0.45 N ATOM 319 CA LYS A 23 9.029 3.469 -10.744 1.00 0.49 C ATOM 320 C LYS A 23 10.014 2.481 -10.133 1.00 0.43 C ATOM 321 O LYS A 23 10.582 1.647 -10.840 1.00 0.51 O ATOM 322 CB LYS A 23 9.741 4.775 -11.097 1.00 0.56 C ATOM 323 CG LYS A 23 9.068 5.566 -12.215 1.00 0.93 C ATOM 324 CD LYS A 23 7.559 5.643 -12.032 1.00 1.62 C ATOM 325 CE LYS A 23 6.929 6.656 -12.972 1.00 2.52 C ATOM 326 NZ LYS A 23 7.182 6.325 -14.401 1.00 3.23 N ATOM 0 H LYS A 23 7.758 4.727 -9.646 1.00 0.45 H new ATOM 0 HA LYS A 23 8.632 3.014 -11.652 1.00 0.49 H new ATOM 0 HB2 LYS A 23 9.795 5.400 -10.206 1.00 0.56 H new ATOM 0 HB3 LYS A 23 10.766 4.550 -11.391 1.00 0.56 H new ATOM 0 HG2 LYS A 23 9.481 6.574 -12.245 1.00 0.93 H new ATOM 0 HG3 LYS A 23 9.293 5.101 -13.175 1.00 0.93 H new ATOM 0 HD2 LYS A 23 7.121 4.661 -12.209 1.00 1.62 H new ATOM 0 HD3 LYS A 23 7.331 5.913 -11.001 1.00 1.62 H new ATOM 0 HE2 LYS A 23 5.854 6.696 -12.794 1.00 2.52 H new ATOM 0 HE3 LYS A 23 7.325 7.648 -12.754 1.00 2.52 H new ATOM 0 HZ1 LYS A 23 6.638 6.971 -15.008 1.00 3.23 H new ATOM 0 HZ2 LYS A 23 8.196 6.428 -14.607 1.00 3.23 H new ATOM 0 HZ3 LYS A 23 6.888 5.345 -14.588 1.00 3.23 H new ATOM 340 N ALA A 24 10.219 2.575 -8.826 1.00 0.37 N ATOM 341 CA ALA A 24 11.143 1.677 -8.139 1.00 0.41 C ATOM 342 C ALA A 24 10.783 0.224 -8.413 1.00 0.41 C ATOM 343 O ALA A 24 11.659 -0.635 -8.509 1.00 0.43 O ATOM 344 CB ALA A 24 11.144 1.945 -6.643 1.00 0.46 C ATOM 0 H ALA A 24 9.762 3.258 -8.222 1.00 0.37 H new ATOM 0 HA ALA A 24 12.145 1.866 -8.524 1.00 0.41 H new ATOM 0 HB1 ALA A 24 11.839 1.264 -6.152 1.00 0.46 H new ATOM 0 HB2 ALA A 24 11.452 2.974 -6.458 1.00 0.46 H new ATOM 0 HB3 ALA A 24 10.141 1.789 -6.245 1.00 0.46 H new ATOM 350 N LEU A 25 9.488 -0.041 -8.548 1.00 0.43 N ATOM 351 CA LEU A 25 9.009 -1.391 -8.823 1.00 0.48 C ATOM 352 C LEU A 25 9.328 -1.793 -10.256 1.00 0.49 C ATOM 353 O LEU A 25 9.536 -2.969 -10.548 1.00 0.57 O ATOM 354 CB LEU A 25 7.502 -1.487 -8.573 1.00 0.53 C ATOM 355 CG LEU A 25 7.064 -1.259 -7.124 1.00 0.70 C ATOM 356 CD1 LEU A 25 5.549 -1.301 -7.014 1.00 0.95 C ATOM 357 CD2 LEU A 25 7.694 -2.299 -6.208 1.00 1.00 C ATOM 0 H LEU A 25 8.752 0.661 -8.472 1.00 0.43 H new ATOM 0 HA LEU A 25 9.521 -2.077 -8.148 1.00 0.48 H new ATOM 0 HB2 LEU A 25 6.998 -0.757 -9.207 1.00 0.53 H new ATOM 0 HB3 LEU A 25 7.160 -2.473 -8.888 1.00 0.53 H new ATOM 0 HG LEU A 25 7.405 -0.272 -6.811 1.00 0.70 H new ATOM 0 HD11 LEU A 25 5.255 -1.137 -5.977 1.00 0.95 H new ATOM 0 HD12 LEU A 25 5.117 -0.521 -7.641 1.00 0.95 H new ATOM 0 HD13 LEU A 25 5.187 -2.275 -7.344 1.00 0.95 H new ATOM 0 HD21 LEU A 25 7.372 -2.122 -5.182 1.00 1.00 H new ATOM 0 HD22 LEU A 25 7.382 -3.296 -6.520 1.00 1.00 H new ATOM 0 HD23 LEU A 25 8.780 -2.225 -6.266 1.00 1.00 H new ATOM 369 N GLY A 26 9.367 -0.807 -11.149 1.00 0.47 N ATOM 370 CA GLY A 26 9.665 -1.082 -12.542 1.00 0.53 C ATOM 371 C GLY A 26 11.065 -1.637 -12.738 1.00 0.50 C ATOM 372 O GLY A 26 11.421 -2.066 -13.836 1.00 0.64 O ATOM 0 H GLY A 26 9.198 0.175 -10.932 1.00 0.47 H new ATOM 0 HA2 GLY A 26 8.937 -1.794 -12.932 1.00 0.53 H new ATOM 0 HA3 GLY A 26 9.557 -0.165 -13.121 1.00 0.53 H new ATOM 376 N ASP A 27 11.862 -1.628 -11.669 1.00 0.43 N ATOM 377 CA ASP A 27 13.231 -2.133 -11.727 1.00 0.46 C ATOM 378 C ASP A 27 13.396 -3.352 -10.819 1.00 0.41 C ATOM 379 O ASP A 27 14.252 -4.206 -11.057 1.00 0.56 O ATOM 380 CB ASP A 27 14.217 -1.037 -11.313 1.00 0.59 C ATOM 381 CG ASP A 27 15.664 -1.439 -11.522 1.00 1.05 C ATOM 382 OD1 ASP A 27 15.909 -2.534 -12.069 1.00 1.50 O ATOM 383 OD2 ASP A 27 16.557 -0.650 -11.145 1.00 1.48 O ATOM 0 H ASP A 27 11.582 -1.276 -10.753 1.00 0.43 H new ATOM 0 HA ASP A 27 13.442 -2.433 -12.753 1.00 0.46 H new ATOM 0 HB2 ASP A 27 14.010 -0.133 -11.885 1.00 0.59 H new ATOM 0 HB3 ASP A 27 14.061 -0.792 -10.262 1.00 0.59 H new ATOM 388 N ILE A 28 12.569 -3.422 -9.778 1.00 0.37 N ATOM 389 CA ILE A 28 12.611 -4.530 -8.827 1.00 0.36 C ATOM 390 C ILE A 28 12.650 -5.882 -9.543 1.00 0.42 C ATOM 391 O ILE A 28 11.985 -6.070 -10.563 1.00 0.47 O ATOM 392 CB ILE A 28 11.393 -4.489 -7.875 1.00 0.41 C ATOM 393 CG1 ILE A 28 11.469 -3.263 -6.956 1.00 0.45 C ATOM 394 CG2 ILE A 28 11.298 -5.766 -7.055 1.00 0.47 C ATOM 395 CD1 ILE A 28 12.708 -3.225 -6.087 1.00 1.27 C ATOM 0 H ILE A 28 11.858 -2.720 -9.571 1.00 0.37 H new ATOM 0 HA ILE A 28 13.526 -4.416 -8.245 1.00 0.36 H new ATOM 0 HB ILE A 28 10.492 -4.411 -8.483 1.00 0.41 H new ATOM 0 HG12 ILE A 28 11.437 -2.361 -7.567 1.00 0.45 H new ATOM 0 HG13 ILE A 28 10.587 -3.246 -6.316 1.00 0.45 H new ATOM 0 HG21 ILE A 28 10.433 -5.711 -6.394 1.00 0.47 H new ATOM 0 HG22 ILE A 28 11.190 -6.620 -7.723 1.00 0.47 H new ATOM 0 HG23 ILE A 28 12.203 -5.884 -6.459 1.00 0.47 H new ATOM 0 HD11 ILE A 28 12.690 -2.329 -5.466 1.00 1.27 H new ATOM 0 HD12 ILE A 28 12.732 -4.108 -5.449 1.00 1.27 H new ATOM 0 HD13 ILE A 28 13.596 -3.210 -6.719 1.00 1.27 H new ATOM 407 N PRO A 29 13.434 -6.847 -9.017 1.00 0.49 N ATOM 408 CA PRO A 29 13.552 -8.183 -9.614 1.00 0.65 C ATOM 409 C PRO A 29 12.241 -8.958 -9.562 1.00 0.73 C ATOM 410 O PRO A 29 11.571 -8.994 -8.530 1.00 0.77 O ATOM 411 CB PRO A 29 14.616 -8.871 -8.754 1.00 0.75 C ATOM 412 CG PRO A 29 14.590 -8.140 -7.458 1.00 0.74 C ATOM 413 CD PRO A 29 14.261 -6.715 -7.801 1.00 0.51 C ATOM 0 HA PRO A 29 13.811 -8.133 -10.671 1.00 0.65 H new ATOM 0 HB2 PRO A 29 14.390 -9.928 -8.616 1.00 0.75 H new ATOM 0 HB3 PRO A 29 15.599 -8.814 -9.221 1.00 0.75 H new ATOM 0 HG2 PRO A 29 13.844 -8.563 -6.785 1.00 0.74 H new ATOM 0 HG3 PRO A 29 15.552 -8.208 -6.951 1.00 0.74 H new ATOM 0 HD2 PRO A 29 13.718 -6.221 -6.995 1.00 0.51 H new ATOM 0 HD3 PRO A 29 15.160 -6.127 -7.986 1.00 0.51 H new ATOM 421 N GLU A 30 11.887 -9.579 -10.682 1.00 0.83 N ATOM 422 CA GLU A 30 10.658 -10.360 -10.776 1.00 0.95 C ATOM 423 C GLU A 30 9.453 -9.534 -10.342 1.00 0.84 C ATOM 424 O GLU A 30 8.539 -10.044 -9.701 1.00 1.18 O ATOM 425 CB GLU A 30 10.768 -11.621 -9.918 1.00 1.17 C ATOM 426 CG GLU A 30 11.936 -12.514 -10.302 1.00 1.47 C ATOM 427 CD GLU A 30 11.765 -13.151 -11.671 1.00 2.16 C ATOM 428 OE1 GLU A 30 11.692 -12.408 -12.671 1.00 2.84 O ATOM 429 OE2 GLU A 30 11.703 -14.398 -11.739 1.00 2.65 O ATOM 0 H GLU A 30 12.436 -9.557 -11.541 1.00 0.83 H new ATOM 0 HA GLU A 30 10.517 -10.649 -11.817 1.00 0.95 H new ATOM 0 HB2 GLU A 30 10.870 -11.332 -8.872 1.00 1.17 H new ATOM 0 HB3 GLU A 30 9.842 -12.190 -10.002 1.00 1.17 H new ATOM 0 HG2 GLU A 30 12.855 -11.927 -10.291 1.00 1.47 H new ATOM 0 HG3 GLU A 30 12.050 -13.298 -9.553 1.00 1.47 H new ATOM 436 N SER A 31 9.466 -8.255 -10.700 1.00 0.60 N ATOM 437 CA SER A 31 8.375 -7.350 -10.349 1.00 0.54 C ATOM 438 C SER A 31 8.196 -6.287 -11.427 1.00 0.47 C ATOM 439 O SER A 31 9.144 -5.586 -11.787 1.00 0.59 O ATOM 440 CB SER A 31 8.646 -6.687 -8.999 1.00 0.57 C ATOM 441 OG SER A 31 8.766 -7.653 -7.970 1.00 1.37 O ATOM 0 H SER A 31 10.219 -7.820 -11.233 1.00 0.60 H new ATOM 0 HA SER A 31 7.456 -7.932 -10.276 1.00 0.54 H new ATOM 0 HB2 SER A 31 9.561 -6.098 -9.057 1.00 0.57 H new ATOM 0 HB3 SER A 31 7.837 -5.996 -8.761 1.00 0.57 H new ATOM 0 HG SER A 31 7.931 -8.161 -7.899 1.00 1.37 H new ATOM 447 N HIS A 32 6.976 -6.172 -11.940 1.00 0.38 N ATOM 448 CA HIS A 32 6.671 -5.198 -12.982 1.00 0.42 C ATOM 449 C HIS A 32 5.257 -4.652 -12.814 1.00 0.39 C ATOM 450 O HIS A 32 4.283 -5.392 -12.934 1.00 0.39 O ATOM 451 CB HIS A 32 6.814 -5.829 -14.368 1.00 0.52 C ATOM 452 CG HIS A 32 8.195 -6.323 -14.677 1.00 1.10 C ATOM 453 ND1 HIS A 32 8.807 -7.344 -13.979 1.00 1.90 N ATOM 454 CD2 HIS A 32 9.085 -5.931 -15.619 1.00 1.90 C ATOM 455 CE1 HIS A 32 10.012 -7.556 -14.478 1.00 2.46 C ATOM 456 NE2 HIS A 32 10.205 -6.713 -15.475 1.00 2.42 N ATOM 0 H HIS A 32 6.181 -6.742 -11.651 1.00 0.38 H new ATOM 0 HA HIS A 32 7.381 -4.377 -12.889 1.00 0.42 H new ATOM 0 HB2 HIS A 32 6.115 -6.662 -14.450 1.00 0.52 H new ATOM 0 HB3 HIS A 32 6.525 -5.095 -15.121 1.00 0.52 H new ATOM 0 HD2 HIS A 32 8.941 -5.148 -16.349 1.00 1.90 H new ATOM 0 HE1 HIS A 32 10.719 -8.294 -14.129 1.00 2.46 H new ATOM 0 HE2 HIS A 32 11.048 -6.652 -16.046 1.00 2.42 H new ATOM 465 N ILE A 33 5.149 -3.359 -12.534 1.00 0.42 N ATOM 466 CA ILE A 33 3.847 -2.728 -12.347 1.00 0.42 C ATOM 467 C ILE A 33 2.983 -2.833 -13.597 1.00 0.41 C ATOM 468 O ILE A 33 3.445 -2.593 -14.714 1.00 0.48 O ATOM 469 CB ILE A 33 3.996 -1.251 -11.934 1.00 0.51 C ATOM 470 CG1 ILE A 33 4.496 -1.171 -10.493 1.00 0.61 C ATOM 471 CG2 ILE A 33 2.677 -0.506 -12.092 1.00 0.79 C ATOM 472 CD1 ILE A 33 4.649 0.246 -9.976 1.00 0.70 C ATOM 0 H ILE A 33 5.944 -2.728 -12.432 1.00 0.42 H new ATOM 0 HA ILE A 33 3.348 -3.268 -11.542 1.00 0.42 H new ATOM 0 HB ILE A 33 4.724 -0.773 -12.589 1.00 0.51 H new ATOM 0 HG12 ILE A 33 3.803 -1.710 -9.847 1.00 0.61 H new ATOM 0 HG13 ILE A 33 5.458 -1.679 -10.423 1.00 0.61 H new ATOM 0 HG21 ILE A 33 2.809 0.534 -11.794 1.00 0.79 H new ATOM 0 HG22 ILE A 33 2.358 -0.548 -13.133 1.00 0.79 H new ATOM 0 HG23 ILE A 33 1.919 -0.971 -11.462 1.00 0.79 H new ATOM 0 HD11 ILE A 33 5.008 0.221 -8.947 1.00 0.70 H new ATOM 0 HD12 ILE A 33 5.365 0.785 -10.597 1.00 0.70 H new ATOM 0 HD13 ILE A 33 3.685 0.753 -10.012 1.00 0.70 H new ATOM 484 N LEU A 34 1.721 -3.198 -13.392 1.00 0.39 N ATOM 485 CA LEU A 34 0.770 -3.346 -14.485 1.00 0.40 C ATOM 486 C LEU A 34 -0.188 -2.154 -14.522 1.00 0.37 C ATOM 487 O LEU A 34 -0.175 -1.368 -15.470 1.00 0.50 O ATOM 488 CB LEU A 34 -0.007 -4.659 -14.316 1.00 0.43 C ATOM 489 CG LEU A 34 -0.667 -5.217 -15.585 1.00 0.66 C ATOM 490 CD1 LEU A 34 -1.734 -4.274 -16.117 1.00 1.42 C ATOM 491 CD2 LEU A 34 0.382 -5.489 -16.653 1.00 1.39 C ATOM 0 H LEU A 34 1.332 -3.398 -12.470 1.00 0.39 H new ATOM 0 HA LEU A 34 1.312 -3.375 -15.430 1.00 0.40 H new ATOM 0 HB2 LEU A 34 0.674 -5.413 -13.923 1.00 0.43 H new ATOM 0 HB3 LEU A 34 -0.782 -4.506 -13.564 1.00 0.43 H new ATOM 0 HG LEU A 34 -1.154 -6.156 -15.322 1.00 0.66 H new ATOM 0 HD11 LEU A 34 -2.181 -4.700 -17.016 1.00 1.42 H new ATOM 0 HD12 LEU A 34 -2.505 -4.133 -15.360 1.00 1.42 H new ATOM 0 HD13 LEU A 34 -1.282 -3.312 -16.358 1.00 1.42 H new ATOM 0 HD21 LEU A 34 -0.102 -5.884 -17.546 1.00 1.39 H new ATOM 0 HD22 LEU A 34 0.898 -4.562 -16.900 1.00 1.39 H new ATOM 0 HD23 LEU A 34 1.102 -6.217 -16.279 1.00 1.39 H new ATOM 503 N THR A 35 -1.014 -2.022 -13.484 1.00 0.30 N ATOM 504 CA THR A 35 -1.974 -0.921 -13.399 1.00 0.33 C ATOM 505 C THR A 35 -1.722 -0.074 -12.155 1.00 0.34 C ATOM 506 O THR A 35 -1.256 -0.580 -11.134 1.00 0.44 O ATOM 507 CB THR A 35 -3.406 -1.454 -13.381 1.00 0.39 C ATOM 508 OG1 THR A 35 -3.574 -2.413 -12.354 1.00 0.97 O ATOM 509 CG2 THR A 35 -3.831 -2.092 -14.685 1.00 0.93 C ATOM 0 H THR A 35 -1.038 -2.663 -12.691 1.00 0.30 H new ATOM 0 HA THR A 35 -1.841 -0.295 -14.281 1.00 0.33 H new ATOM 0 HB THR A 35 -4.033 -0.579 -13.208 1.00 0.39 H new ATOM 0 HG1 THR A 35 -4.476 -2.335 -11.978 1.00 0.97 H new ATOM 0 HG21 THR A 35 -4.858 -2.447 -14.599 1.00 0.93 H new ATOM 0 HG22 THR A 35 -3.768 -1.357 -15.487 1.00 0.93 H new ATOM 0 HG23 THR A 35 -3.174 -2.932 -14.910 1.00 0.93 H new ATOM 517 N VAL A 36 -2.036 1.215 -12.248 1.00 0.33 N ATOM 518 CA VAL A 36 -1.844 2.133 -11.130 1.00 0.39 C ATOM 519 C VAL A 36 -3.108 2.941 -10.854 1.00 0.36 C ATOM 520 O VAL A 36 -3.777 3.400 -11.780 1.00 0.38 O ATOM 521 CB VAL A 36 -0.677 3.104 -11.401 1.00 0.51 C ATOM 522 CG1 VAL A 36 -0.441 4.011 -10.203 1.00 1.05 C ATOM 523 CG2 VAL A 36 0.587 2.335 -11.755 1.00 1.21 C ATOM 0 H VAL A 36 -2.425 1.647 -13.086 1.00 0.33 H new ATOM 0 HA VAL A 36 -1.610 1.524 -10.257 1.00 0.39 H new ATOM 0 HB VAL A 36 -0.944 3.731 -12.252 1.00 0.51 H new ATOM 0 HG11 VAL A 36 0.387 4.688 -10.416 1.00 1.05 H new ATOM 0 HG12 VAL A 36 -1.342 4.591 -10.003 1.00 1.05 H new ATOM 0 HG13 VAL A 36 -0.198 3.405 -9.330 1.00 1.05 H new ATOM 0 HG21 VAL A 36 1.399 3.037 -11.943 1.00 1.21 H new ATOM 0 HG22 VAL A 36 0.858 1.679 -10.927 1.00 1.21 H new ATOM 0 HG23 VAL A 36 0.411 1.737 -12.649 1.00 1.21 H new ATOM 533 N SER A 37 -3.425 3.119 -9.572 1.00 0.35 N ATOM 534 CA SER A 37 -4.603 3.881 -9.173 1.00 0.35 C ATOM 535 C SER A 37 -4.350 5.376 -9.344 1.00 0.40 C ATOM 536 O SER A 37 -3.370 5.777 -9.973 1.00 0.72 O ATOM 537 CB SER A 37 -4.963 3.578 -7.715 1.00 0.36 C ATOM 538 OG SER A 37 -3.949 4.032 -6.837 1.00 1.35 O ATOM 0 H SER A 37 -2.882 2.745 -8.794 1.00 0.35 H new ATOM 0 HA SER A 37 -5.436 3.588 -9.812 1.00 0.35 H new ATOM 0 HB2 SER A 37 -5.909 4.058 -7.463 1.00 0.36 H new ATOM 0 HB3 SER A 37 -5.106 2.505 -7.587 1.00 0.36 H new ATOM 0 HG SER A 37 -3.097 3.609 -7.075 1.00 1.35 H new ATOM 544 N SER A 38 -5.223 6.198 -8.772 1.00 0.43 N ATOM 545 CA SER A 38 -5.070 7.644 -8.858 1.00 0.45 C ATOM 546 C SER A 38 -4.454 8.179 -7.572 1.00 0.47 C ATOM 547 O SER A 38 -4.039 7.406 -6.709 1.00 0.70 O ATOM 548 CB SER A 38 -6.421 8.314 -9.116 1.00 0.50 C ATOM 549 OG SER A 38 -7.000 7.850 -10.322 1.00 1.19 O ATOM 0 H SER A 38 -6.040 5.889 -8.246 1.00 0.43 H new ATOM 0 HA SER A 38 -4.407 7.875 -9.692 1.00 0.45 H new ATOM 0 HB2 SER A 38 -7.095 8.111 -8.284 1.00 0.50 H new ATOM 0 HB3 SER A 38 -6.291 9.395 -9.164 1.00 0.50 H new ATOM 0 HG SER A 38 -7.863 8.293 -10.462 1.00 1.19 H new ATOM 555 N PHE A 39 -4.401 9.498 -7.441 1.00 0.38 N ATOM 556 CA PHE A 39 -3.835 10.112 -6.247 1.00 0.43 C ATOM 557 C PHE A 39 -4.949 10.725 -5.411 1.00 0.40 C ATOM 558 O PHE A 39 -5.620 11.660 -5.846 1.00 0.65 O ATOM 559 CB PHE A 39 -2.797 11.176 -6.620 1.00 0.59 C ATOM 560 CG PHE A 39 -1.887 10.772 -7.751 1.00 1.42 C ATOM 561 CD1 PHE A 39 -2.351 10.750 -9.057 1.00 1.93 C ATOM 562 CD2 PHE A 39 -0.567 10.424 -7.508 1.00 2.21 C ATOM 563 CE1 PHE A 39 -1.518 10.384 -10.098 1.00 2.75 C ATOM 564 CE2 PHE A 39 0.271 10.057 -8.546 1.00 3.01 C ATOM 565 CZ PHE A 39 -0.209 10.023 -9.838 1.00 3.17 C ATOM 0 H PHE A 39 -4.740 10.159 -8.140 1.00 0.38 H new ATOM 0 HA PHE A 39 -3.330 9.343 -5.662 1.00 0.43 H new ATOM 0 HB2 PHE A 39 -3.315 12.095 -6.894 1.00 0.59 H new ATOM 0 HB3 PHE A 39 -2.191 11.402 -5.742 1.00 0.59 H new ATOM 0 HD1 PHE A 39 -3.376 11.022 -9.264 1.00 1.93 H new ATOM 0 HD2 PHE A 39 -0.189 10.440 -6.497 1.00 2.21 H new ATOM 0 HE1 PHE A 39 -1.889 10.380 -11.112 1.00 2.75 H new ATOM 0 HE2 PHE A 39 1.300 9.798 -8.344 1.00 3.01 H new ATOM 0 HZ PHE A 39 0.437 9.715 -10.647 1.00 3.17 H new ATOM 575 N TYR A 40 -5.157 10.179 -4.219 1.00 0.38 N ATOM 576 CA TYR A 40 -6.213 10.662 -3.337 1.00 0.37 C ATOM 577 C TYR A 40 -5.646 11.271 -2.062 1.00 0.40 C ATOM 578 O TYR A 40 -4.744 10.714 -1.440 1.00 0.53 O ATOM 579 CB TYR A 40 -7.169 9.522 -2.971 1.00 0.44 C ATOM 580 CG TYR A 40 -7.805 8.833 -4.159 1.00 0.49 C ATOM 581 CD1 TYR A 40 -7.067 7.997 -4.993 1.00 0.49 C ATOM 582 CD2 TYR A 40 -9.152 9.020 -4.448 1.00 0.59 C ATOM 583 CE1 TYR A 40 -7.653 7.373 -6.076 1.00 0.57 C ATOM 584 CE2 TYR A 40 -9.742 8.397 -5.531 1.00 0.67 C ATOM 585 CZ TYR A 40 -8.990 7.575 -6.342 1.00 0.66 C ATOM 586 OH TYR A 40 -9.575 6.954 -7.419 1.00 0.76 O ATOM 0 H TYR A 40 -4.611 9.405 -3.842 1.00 0.38 H new ATOM 0 HA TYR A 40 -6.756 11.437 -3.878 1.00 0.37 H new ATOM 0 HB2 TYR A 40 -6.624 8.781 -2.386 1.00 0.44 H new ATOM 0 HB3 TYR A 40 -7.958 9.917 -2.331 1.00 0.44 H new ATOM 0 HD1 TYR A 40 -6.019 7.834 -4.789 1.00 0.49 H new ATOM 0 HD2 TYR A 40 -9.747 9.663 -3.816 1.00 0.59 H new ATOM 0 HE1 TYR A 40 -7.065 6.728 -6.713 1.00 0.57 H new ATOM 0 HE2 TYR A 40 -10.790 8.554 -5.741 1.00 0.67 H new ATOM 0 HH TYR A 40 -10.522 7.201 -7.464 1.00 0.76 H new ATOM 596 N ARG A 41 -6.207 12.407 -1.662 1.00 0.43 N ATOM 597 CA ARG A 41 -5.787 13.085 -0.444 1.00 0.50 C ATOM 598 C ARG A 41 -6.516 12.476 0.750 1.00 0.54 C ATOM 599 O ARG A 41 -7.670 12.065 0.629 1.00 0.67 O ATOM 600 CB ARG A 41 -6.095 14.581 -0.531 1.00 0.66 C ATOM 601 CG ARG A 41 -5.600 15.371 0.664 1.00 0.69 C ATOM 602 CD ARG A 41 -6.179 16.778 0.694 1.00 0.94 C ATOM 603 NE ARG A 41 -5.744 17.581 -0.446 1.00 1.56 N ATOM 604 CZ ARG A 41 -6.085 18.855 -0.621 1.00 2.07 C ATOM 605 NH1 ARG A 41 -6.871 19.462 0.259 1.00 2.32 N ATOM 606 NH2 ARG A 41 -5.643 19.522 -1.676 1.00 2.95 N ATOM 0 H ARG A 41 -6.957 12.878 -2.167 1.00 0.43 H new ATOM 0 HA ARG A 41 -4.711 12.959 -0.321 1.00 0.50 H new ATOM 0 HB2 ARG A 41 -5.642 14.985 -1.436 1.00 0.66 H new ATOM 0 HB3 ARG A 41 -7.172 14.717 -0.625 1.00 0.66 H new ATOM 0 HG2 ARG A 41 -5.869 14.848 1.582 1.00 0.69 H new ATOM 0 HG3 ARG A 41 -4.512 15.427 0.637 1.00 0.69 H new ATOM 0 HD2 ARG A 41 -7.267 16.720 0.701 1.00 0.94 H new ATOM 0 HD3 ARG A 41 -5.880 17.272 1.619 1.00 0.94 H new ATOM 0 HE ARG A 41 -5.146 17.141 -1.146 1.00 1.56 H new ATOM 0 HH11 ARG A 41 -7.215 18.952 1.072 1.00 2.32 H new ATOM 0 HH12 ARG A 41 -7.131 20.439 0.122 1.00 2.32 H new ATOM 0 HH21 ARG A 41 -5.040 19.059 -2.356 1.00 2.95 H new ATOM 0 HH22 ARG A 41 -5.905 20.499 -1.809 1.00 2.95 H new ATOM 620 N THR A 42 -5.847 12.399 1.897 1.00 0.61 N ATOM 621 CA THR A 42 -6.465 11.813 3.080 1.00 0.73 C ATOM 622 C THR A 42 -5.720 12.173 4.359 1.00 0.84 C ATOM 623 O THR A 42 -4.505 12.368 4.349 1.00 1.10 O ATOM 624 CB THR A 42 -6.513 10.296 2.934 1.00 0.81 C ATOM 625 OG1 THR A 42 -7.055 9.691 4.093 1.00 1.30 O ATOM 626 CG2 THR A 42 -5.155 9.678 2.690 1.00 1.28 C ATOM 0 H THR A 42 -4.891 12.730 2.031 1.00 0.61 H new ATOM 0 HA THR A 42 -7.473 12.221 3.157 1.00 0.73 H new ATOM 0 HB THR A 42 -7.144 10.113 2.064 1.00 0.81 H new ATOM 0 HG1 THR A 42 -6.794 8.747 4.122 1.00 1.30 H new ATOM 0 HG21 THR A 42 -5.259 8.597 2.595 1.00 1.28 H new ATOM 0 HG22 THR A 42 -4.730 10.084 1.772 1.00 1.28 H new ATOM 0 HG23 THR A 42 -4.495 9.907 3.527 1.00 1.28 H new ATOM 634 N PRO A 43 -6.447 12.248 5.490 1.00 0.74 N ATOM 635 CA PRO A 43 -5.854 12.566 6.791 1.00 0.86 C ATOM 636 C PRO A 43 -5.045 11.394 7.346 1.00 0.90 C ATOM 637 O PRO A 43 -5.597 10.326 7.615 1.00 0.94 O ATOM 638 CB PRO A 43 -7.071 12.837 7.674 1.00 0.98 C ATOM 639 CG PRO A 43 -8.158 12.015 7.073 1.00 0.87 C ATOM 640 CD PRO A 43 -7.905 12.012 5.590 1.00 0.71 C ATOM 0 HA PRO A 43 -5.157 13.402 6.736 1.00 0.86 H new ATOM 0 HB2 PRO A 43 -6.882 12.550 8.709 1.00 0.98 H new ATOM 0 HB3 PRO A 43 -7.330 13.896 7.679 1.00 0.98 H new ATOM 0 HG2 PRO A 43 -8.147 11.001 7.473 1.00 0.87 H new ATOM 0 HG3 PRO A 43 -9.137 12.436 7.301 1.00 0.87 H new ATOM 0 HD2 PRO A 43 -8.191 11.063 5.136 1.00 0.71 H new ATOM 0 HD3 PRO A 43 -8.474 12.792 5.084 1.00 0.71 H new ATOM 648 N PRO A 44 -3.723 11.573 7.526 1.00 0.98 N ATOM 649 CA PRO A 44 -2.850 10.515 8.049 1.00 1.12 C ATOM 650 C PRO A 44 -3.338 9.982 9.390 1.00 1.19 C ATOM 651 O PRO A 44 -4.251 10.543 9.997 1.00 2.06 O ATOM 652 CB PRO A 44 -1.493 11.205 8.207 1.00 1.28 C ATOM 653 CG PRO A 44 -1.541 12.367 7.276 1.00 1.18 C ATOM 654 CD PRO A 44 -2.976 12.809 7.232 1.00 1.03 C ATOM 0 HA PRO A 44 -2.820 9.649 7.388 1.00 1.12 H new ATOM 0 HB2 PRO A 44 -1.332 11.529 9.235 1.00 1.28 H new ATOM 0 HB3 PRO A 44 -0.675 10.530 7.954 1.00 1.28 H new ATOM 0 HG2 PRO A 44 -0.896 13.173 7.626 1.00 1.18 H new ATOM 0 HG3 PRO A 44 -1.190 12.085 6.283 1.00 1.18 H new ATOM 0 HD2 PRO A 44 -3.180 13.586 7.968 1.00 1.03 H new ATOM 0 HD3 PRO A 44 -3.241 13.216 6.256 1.00 1.03 H new ATOM 662 N LEU A 45 -2.732 8.891 9.847 1.00 0.99 N ATOM 663 CA LEU A 45 -3.121 8.287 11.112 1.00 1.03 C ATOM 664 C LEU A 45 -1.915 7.686 11.821 1.00 1.08 C ATOM 665 O LEU A 45 -1.425 6.621 11.449 1.00 1.32 O ATOM 666 CB LEU A 45 -4.196 7.226 10.864 1.00 1.15 C ATOM 667 CG LEU A 45 -4.899 6.680 12.110 1.00 1.53 C ATOM 668 CD1 LEU A 45 -6.257 6.108 11.738 1.00 1.83 C ATOM 669 CD2 LEU A 45 -4.054 5.609 12.782 1.00 2.21 C ATOM 0 H LEU A 45 -1.974 8.411 9.362 1.00 0.99 H new ATOM 0 HA LEU A 45 -3.531 9.060 11.762 1.00 1.03 H new ATOM 0 HB2 LEU A 45 -4.951 7.650 10.201 1.00 1.15 H new ATOM 0 HB3 LEU A 45 -3.739 6.391 10.334 1.00 1.15 H new ATOM 0 HG LEU A 45 -5.037 7.503 12.811 1.00 1.53 H new ATOM 0 HD11 LEU A 45 -6.747 5.723 12.632 1.00 1.83 H new ATOM 0 HD12 LEU A 45 -6.873 6.891 11.295 1.00 1.83 H new ATOM 0 HD13 LEU A 45 -6.127 5.299 11.019 1.00 1.83 H new ATOM 0 HD21 LEU A 45 -4.574 5.236 13.665 1.00 2.21 H new ATOM 0 HD22 LEU A 45 -3.886 4.788 12.085 1.00 2.21 H new ATOM 0 HD23 LEU A 45 -3.095 6.035 13.078 1.00 2.21 H new ATOM 681 N GLY A 46 -1.438 8.389 12.845 1.00 1.09 N ATOM 682 CA GLY A 46 -0.288 7.932 13.600 1.00 1.18 C ATOM 683 C GLY A 46 0.652 9.073 13.959 1.00 1.11 C ATOM 684 O GLY A 46 0.200 10.175 14.266 1.00 1.19 O ATOM 0 H GLY A 46 -1.832 9.273 13.166 1.00 1.09 H new ATOM 0 HA2 GLY A 46 -0.626 7.441 14.512 1.00 1.18 H new ATOM 0 HA3 GLY A 46 0.254 7.186 13.018 1.00 1.18 H new ATOM 688 N PRO A 47 1.969 8.826 13.975 1.00 1.12 N ATOM 689 CA PRO A 47 2.967 9.815 14.333 1.00 1.16 C ATOM 690 C PRO A 47 3.769 10.361 13.145 1.00 1.14 C ATOM 691 O PRO A 47 4.546 9.631 12.528 1.00 1.99 O ATOM 692 CB PRO A 47 3.884 8.981 15.213 1.00 1.36 C ATOM 693 CG PRO A 47 3.794 7.578 14.667 1.00 1.39 C ATOM 694 CD PRO A 47 2.618 7.544 13.713 1.00 1.26 C ATOM 0 HA PRO A 47 2.523 10.703 14.782 1.00 1.16 H new ATOM 0 HB2 PRO A 47 4.908 9.352 15.176 1.00 1.36 H new ATOM 0 HB3 PRO A 47 3.569 9.018 16.256 1.00 1.36 H new ATOM 0 HG2 PRO A 47 4.715 7.306 14.152 1.00 1.39 H new ATOM 0 HG3 PRO A 47 3.656 6.859 15.474 1.00 1.39 H new ATOM 0 HD2 PRO A 47 2.939 7.455 12.675 1.00 1.26 H new ATOM 0 HD3 PRO A 47 1.954 6.703 13.915 1.00 1.26 H new ATOM 702 N GLN A 48 3.612 11.657 12.862 1.00 0.95 N ATOM 703 CA GLN A 48 4.358 12.316 11.783 1.00 0.84 C ATOM 704 C GLN A 48 3.934 13.778 11.635 1.00 0.90 C ATOM 705 O GLN A 48 4.786 14.663 11.524 1.00 1.04 O ATOM 706 CB GLN A 48 4.237 11.552 10.446 1.00 0.83 C ATOM 707 CG GLN A 48 3.572 12.317 9.306 1.00 1.00 C ATOM 708 CD GLN A 48 2.054 12.238 9.297 1.00 1.29 C ATOM 709 OE1 GLN A 48 1.418 12.681 8.345 1.00 2.23 O ATOM 710 NE2 GLN A 48 1.456 11.693 10.348 1.00 1.15 N ATOM 0 H GLN A 48 2.974 12.273 13.366 1.00 0.95 H new ATOM 0 HA GLN A 48 5.412 12.301 12.060 1.00 0.84 H new ATOM 0 HB2 GLN A 48 5.236 11.255 10.126 1.00 0.83 H new ATOM 0 HB3 GLN A 48 3.673 10.636 10.622 1.00 0.83 H new ATOM 0 HG2 GLN A 48 3.869 13.364 9.366 1.00 1.00 H new ATOM 0 HG3 GLN A 48 3.949 11.933 8.358 1.00 1.00 H new ATOM 0 HE21 GLN A 48 2.014 11.334 11.123 1.00 1.15 H new ATOM 0 HE22 GLN A 48 0.438 11.633 10.381 1.00 1.15 H new ATOM 719 N ASP A 49 2.624 14.022 11.651 1.00 0.99 N ATOM 720 CA ASP A 49 2.068 15.375 11.533 1.00 1.16 C ATOM 721 C ASP A 49 0.566 15.295 11.296 1.00 1.20 C ATOM 722 O ASP A 49 -0.201 16.149 11.745 1.00 1.33 O ATOM 723 CB ASP A 49 2.730 16.148 10.388 1.00 1.28 C ATOM 724 CG ASP A 49 2.216 17.570 10.279 1.00 1.51 C ATOM 725 OD1 ASP A 49 2.360 18.331 11.261 1.00 1.81 O ATOM 726 OD2 ASP A 49 1.672 17.926 9.213 1.00 1.70 O ATOM 0 H ASP A 49 1.918 13.292 11.746 1.00 0.99 H new ATOM 0 HA ASP A 49 2.266 15.907 12.464 1.00 1.16 H new ATOM 0 HB2 ASP A 49 3.809 16.165 10.541 1.00 1.28 H new ATOM 0 HB3 ASP A 49 2.549 15.626 9.448 1.00 1.28 H new ATOM 731 N GLN A 50 0.172 14.245 10.592 1.00 1.19 N ATOM 732 CA GLN A 50 -1.226 13.981 10.271 1.00 1.31 C ATOM 733 C GLN A 50 -1.860 15.072 9.395 1.00 1.33 C ATOM 734 O GLN A 50 -3.035 15.392 9.571 1.00 1.40 O ATOM 735 CB GLN A 50 -2.034 13.836 11.554 1.00 1.42 C ATOM 736 CG GLN A 50 -1.399 12.911 12.579 1.00 1.67 C ATOM 737 CD GLN A 50 -1.467 11.450 12.182 1.00 1.43 C ATOM 738 OE1 GLN A 50 -2.550 10.887 12.047 1.00 2.03 O ATOM 739 NE2 GLN A 50 -0.302 10.836 11.994 1.00 1.24 N ATOM 0 H GLN A 50 0.817 13.546 10.224 1.00 1.19 H new ATOM 0 HA GLN A 50 -1.244 13.054 9.698 1.00 1.31 H new ATOM 0 HB2 GLN A 50 -2.168 14.821 12.001 1.00 1.42 H new ATOM 0 HB3 GLN A 50 -3.027 13.461 11.306 1.00 1.42 H new ATOM 0 HG2 GLN A 50 -0.356 13.195 12.720 1.00 1.67 H new ATOM 0 HG3 GLN A 50 -1.898 13.044 13.539 1.00 1.67 H new ATOM 0 HE21 GLN A 50 0.571 11.349 12.119 1.00 1.24 H new ATOM 0 HE22 GLN A 50 -0.282 9.852 11.725 1.00 1.24 H new ATOM 748 N PRO A 51 -1.119 15.659 8.433 1.00 1.35 N ATOM 749 CA PRO A 51 -1.679 16.697 7.562 1.00 1.46 C ATOM 750 C PRO A 51 -2.705 16.123 6.582 1.00 1.54 C ATOM 751 O PRO A 51 -3.908 16.145 6.847 1.00 2.26 O ATOM 752 CB PRO A 51 -0.463 17.255 6.823 1.00 1.52 C ATOM 753 CG PRO A 51 0.570 16.179 6.876 1.00 1.53 C ATOM 754 CD PRO A 51 0.293 15.366 8.111 1.00 1.37 C ATOM 0 HA PRO A 51 -2.218 17.459 8.125 1.00 1.46 H new ATOM 0 HB2 PRO A 51 -0.713 17.508 5.793 1.00 1.52 H new ATOM 0 HB3 PRO A 51 -0.102 18.168 7.296 1.00 1.52 H new ATOM 0 HG2 PRO A 51 0.523 15.554 5.984 1.00 1.53 H new ATOM 0 HG3 PRO A 51 1.572 16.607 6.912 1.00 1.53 H new ATOM 0 HD2 PRO A 51 0.447 14.302 7.930 1.00 1.37 H new ATOM 0 HD3 PRO A 51 0.955 15.649 8.930 1.00 1.37 H new ATOM 762 N ASP A 52 -2.218 15.602 5.461 1.00 1.24 N ATOM 763 CA ASP A 52 -3.068 15.010 4.438 1.00 1.23 C ATOM 764 C ASP A 52 -2.206 14.421 3.326 1.00 0.91 C ATOM 765 O ASP A 52 -2.031 15.032 2.271 1.00 1.55 O ATOM 766 CB ASP A 52 -4.036 16.053 3.870 1.00 1.67 C ATOM 767 CG ASP A 52 -3.329 17.303 3.378 1.00 2.16 C ATOM 768 OD1 ASP A 52 -2.638 17.951 4.191 1.00 2.56 O ATOM 769 OD2 ASP A 52 -3.464 17.630 2.181 1.00 2.69 O ATOM 0 H ASP A 52 -1.223 15.579 5.237 1.00 1.24 H new ATOM 0 HA ASP A 52 -3.657 14.212 4.890 1.00 1.23 H new ATOM 0 HB2 ASP A 52 -4.598 15.611 3.047 1.00 1.67 H new ATOM 0 HB3 ASP A 52 -4.759 16.328 4.638 1.00 1.67 H new ATOM 774 N TYR A 53 -1.644 13.243 3.583 1.00 0.76 N ATOM 775 CA TYR A 53 -0.772 12.590 2.614 1.00 1.08 C ATOM 776 C TYR A 53 -1.526 12.165 1.362 1.00 0.87 C ATOM 777 O TYR A 53 -2.749 12.292 1.282 1.00 0.98 O ATOM 778 CB TYR A 53 -0.053 11.390 3.248 1.00 1.83 C ATOM 779 CG TYR A 53 -0.934 10.198 3.563 1.00 2.62 C ATOM 780 CD1 TYR A 53 -1.391 9.364 2.550 1.00 3.26 C ATOM 781 CD2 TYR A 53 -1.336 9.923 4.866 1.00 3.32 C ATOM 782 CE1 TYR A 53 -2.215 8.290 2.826 1.00 4.34 C ATOM 783 CE2 TYR A 53 -2.159 8.849 5.148 1.00 4.46 C ATOM 784 CZ TYR A 53 -2.516 7.986 4.157 1.00 4.90 C ATOM 785 OH TYR A 53 -3.415 6.967 4.401 1.00 6.13 O ATOM 0 H TYR A 53 -1.777 12.724 4.451 1.00 0.76 H new ATOM 0 HA TYR A 53 -0.024 13.322 2.309 1.00 1.08 H new ATOM 0 HB2 TYR A 53 0.741 11.066 2.575 1.00 1.83 H new ATOM 0 HB3 TYR A 53 0.426 11.720 4.170 1.00 1.83 H new ATOM 0 HD1 TYR A 53 -1.097 9.559 1.529 1.00 3.26 H new ATOM 0 HD2 TYR A 53 -0.999 10.560 5.671 1.00 3.32 H new ATOM 0 HE1 TYR A 53 -2.622 7.693 2.023 1.00 4.34 H new ATOM 0 HE2 TYR A 53 -2.519 8.694 6.154 1.00 4.46 H new ATOM 0 HH TYR A 53 -3.456 6.373 3.622 1.00 6.13 H new ATOM 795 N LEU A 54 -0.779 11.665 0.385 1.00 0.72 N ATOM 796 CA LEU A 54 -1.356 11.216 -0.878 1.00 0.59 C ATOM 797 C LEU A 54 -1.298 9.697 -0.980 1.00 0.61 C ATOM 798 O LEU A 54 -0.229 9.099 -0.856 1.00 0.88 O ATOM 799 CB LEU A 54 -0.603 11.845 -2.055 1.00 0.60 C ATOM 800 CG LEU A 54 -1.254 11.659 -3.423 1.00 0.54 C ATOM 801 CD1 LEU A 54 -2.546 12.456 -3.512 1.00 0.92 C ATOM 802 CD2 LEU A 54 -0.286 12.071 -4.522 1.00 1.10 C ATOM 0 H LEU A 54 0.234 11.560 0.443 1.00 0.72 H new ATOM 0 HA LEU A 54 -2.399 11.531 -0.912 1.00 0.59 H new ATOM 0 HB2 LEU A 54 -0.494 12.913 -1.866 1.00 0.60 H new ATOM 0 HB3 LEU A 54 0.401 11.423 -2.089 1.00 0.60 H new ATOM 0 HG LEU A 54 -1.499 10.605 -3.556 1.00 0.54 H new ATOM 0 HD11 LEU A 54 -2.996 12.311 -4.494 1.00 0.92 H new ATOM 0 HD12 LEU A 54 -3.238 12.115 -2.742 1.00 0.92 H new ATOM 0 HD13 LEU A 54 -2.332 13.514 -3.364 1.00 0.92 H new ATOM 0 HD21 LEU A 54 -0.760 11.935 -5.494 1.00 1.10 H new ATOM 0 HD22 LEU A 54 -0.015 13.119 -4.394 1.00 1.10 H new ATOM 0 HD23 LEU A 54 0.611 11.455 -4.466 1.00 1.10 H new ATOM 814 N ASN A 55 -2.451 9.081 -1.203 1.00 0.50 N ATOM 815 CA ASN A 55 -2.531 7.631 -1.314 1.00 0.58 C ATOM 816 C ASN A 55 -2.702 7.204 -2.764 1.00 0.57 C ATOM 817 O ASN A 55 -3.236 7.953 -3.582 1.00 0.70 O ATOM 818 CB ASN A 55 -3.701 7.105 -0.483 1.00 0.82 C ATOM 819 CG ASN A 55 -5.044 7.552 -1.025 1.00 1.80 C ATOM 820 OD1 ASN A 55 -5.448 7.155 -2.118 1.00 2.63 O ATOM 821 ND2 ASN A 55 -5.739 8.386 -0.265 1.00 2.49 N ATOM 0 H ASN A 55 -3.344 9.563 -1.311 1.00 0.50 H new ATOM 0 HA ASN A 55 -1.599 7.211 -0.936 1.00 0.58 H new ATOM 0 HB2 ASN A 55 -3.666 6.016 -0.461 1.00 0.82 H new ATOM 0 HB3 ASN A 55 -3.595 7.449 0.546 1.00 0.82 H new ATOM 0 HD21 ASN A 55 -6.648 8.725 -0.579 1.00 2.49 H new ATOM 0 HD22 ASN A 55 -5.365 8.689 0.634 1.00 2.49 H new ATOM 828 N ALA A 56 -2.253 5.992 -3.073 1.00 0.51 N ATOM 829 CA ALA A 56 -2.364 5.463 -4.428 1.00 0.57 C ATOM 830 C ALA A 56 -1.901 4.014 -4.501 1.00 0.54 C ATOM 831 O ALA A 56 -0.701 3.742 -4.551 1.00 0.75 O ATOM 832 CB ALA A 56 -1.558 6.317 -5.395 1.00 0.61 C ATOM 0 H ALA A 56 -1.810 5.359 -2.406 1.00 0.51 H new ATOM 0 HA ALA A 56 -3.416 5.495 -4.711 1.00 0.57 H new ATOM 0 HB1 ALA A 56 -1.650 5.911 -6.402 1.00 0.61 H new ATOM 0 HB2 ALA A 56 -1.936 7.339 -5.380 1.00 0.61 H new ATOM 0 HB3 ALA A 56 -0.510 6.314 -5.097 1.00 0.61 H new ATOM 838 N ALA A 57 -2.853 3.083 -4.530 1.00 0.31 N ATOM 839 CA ALA A 57 -2.518 1.671 -4.622 1.00 0.29 C ATOM 840 C ALA A 57 -1.991 1.352 -6.014 1.00 0.29 C ATOM 841 O ALA A 57 -2.018 2.205 -6.902 1.00 0.39 O ATOM 842 CB ALA A 57 -3.739 0.824 -4.307 1.00 0.33 C ATOM 0 H ALA A 57 -3.853 3.282 -4.491 1.00 0.31 H new ATOM 0 HA ALA A 57 -1.740 1.440 -3.894 1.00 0.29 H new ATOM 0 HB1 ALA A 57 -3.478 -0.232 -4.379 1.00 0.33 H new ATOM 0 HB2 ALA A 57 -4.084 1.045 -3.297 1.00 0.33 H new ATOM 0 HB3 ALA A 57 -4.532 1.050 -5.019 1.00 0.33 H new ATOM 848 N VAL A 58 -1.513 0.129 -6.212 1.00 0.26 N ATOM 849 CA VAL A 58 -0.991 -0.264 -7.515 1.00 0.27 C ATOM 850 C VAL A 58 -0.834 -1.775 -7.638 1.00 0.27 C ATOM 851 O VAL A 58 -0.121 -2.402 -6.857 1.00 0.28 O ATOM 852 CB VAL A 58 0.358 0.420 -7.799 1.00 0.31 C ATOM 853 CG1 VAL A 58 1.346 0.152 -6.675 1.00 1.20 C ATOM 854 CG2 VAL A 58 0.925 -0.034 -9.137 1.00 0.98 C ATOM 0 H VAL A 58 -1.476 -0.598 -5.498 1.00 0.26 H new ATOM 0 HA VAL A 58 -1.722 0.062 -8.255 1.00 0.27 H new ATOM 0 HB VAL A 58 0.187 1.495 -7.852 1.00 0.31 H new ATOM 0 HG11 VAL A 58 2.292 0.645 -6.897 1.00 1.20 H new ATOM 0 HG12 VAL A 58 0.946 0.540 -5.738 1.00 1.20 H new ATOM 0 HG13 VAL A 58 1.509 -0.922 -6.582 1.00 1.20 H new ATOM 0 HG21 VAL A 58 1.879 0.463 -9.316 1.00 0.98 H new ATOM 0 HG22 VAL A 58 1.076 -1.113 -9.121 1.00 0.98 H new ATOM 0 HG23 VAL A 58 0.227 0.223 -9.934 1.00 0.98 H new ATOM 864 N ALA A 59 -1.513 -2.353 -8.626 1.00 0.28 N ATOM 865 CA ALA A 59 -1.448 -3.787 -8.848 1.00 0.29 C ATOM 866 C ALA A 59 -0.141 -4.169 -9.533 1.00 0.31 C ATOM 867 O ALA A 59 -0.054 -4.222 -10.759 1.00 0.50 O ATOM 868 CB ALA A 59 -2.633 -4.243 -9.685 1.00 0.31 C ATOM 0 H ALA A 59 -2.111 -1.849 -9.281 1.00 0.28 H new ATOM 0 HA ALA A 59 -1.486 -4.286 -7.880 1.00 0.29 H new ATOM 0 HB1 ALA A 59 -2.573 -5.320 -9.845 1.00 0.31 H new ATOM 0 HB2 ALA A 59 -3.560 -4.005 -9.164 1.00 0.31 H new ATOM 0 HB3 ALA A 59 -2.617 -3.732 -10.648 1.00 0.31 H new ATOM 874 N LEU A 60 0.874 -4.429 -8.716 1.00 0.28 N ATOM 875 CA LEU A 60 2.193 -4.806 -9.209 1.00 0.28 C ATOM 876 C LEU A 60 2.193 -6.228 -9.747 1.00 0.30 C ATOM 877 O LEU A 60 1.910 -7.178 -9.018 1.00 0.33 O ATOM 878 CB LEU A 60 3.226 -4.681 -8.081 1.00 0.29 C ATOM 879 CG LEU A 60 4.626 -5.225 -8.399 1.00 0.29 C ATOM 880 CD1 LEU A 60 5.237 -4.484 -9.576 1.00 0.35 C ATOM 881 CD2 LEU A 60 5.525 -5.112 -7.176 1.00 0.31 C ATOM 0 H LEU A 60 0.806 -4.385 -7.699 1.00 0.28 H new ATOM 0 HA LEU A 60 2.456 -4.132 -10.024 1.00 0.28 H new ATOM 0 HB2 LEU A 60 3.317 -3.629 -7.812 1.00 0.29 H new ATOM 0 HB3 LEU A 60 2.844 -5.203 -7.204 1.00 0.29 H new ATOM 0 HG LEU A 60 4.533 -6.277 -8.670 1.00 0.29 H new ATOM 0 HD11 LEU A 60 6.229 -4.886 -9.784 1.00 0.35 H new ATOM 0 HD12 LEU A 60 4.603 -4.610 -10.454 1.00 0.35 H new ATOM 0 HD13 LEU A 60 5.318 -3.424 -9.336 1.00 0.35 H new ATOM 0 HD21 LEU A 60 6.515 -5.501 -7.415 1.00 0.31 H new ATOM 0 HD22 LEU A 60 5.608 -4.066 -6.881 1.00 0.31 H new ATOM 0 HD23 LEU A 60 5.097 -5.688 -6.355 1.00 0.31 H new ATOM 893 N GLU A 61 2.538 -6.374 -11.020 1.00 0.32 N ATOM 894 CA GLU A 61 2.605 -7.688 -11.633 1.00 0.36 C ATOM 895 C GLU A 61 3.961 -8.282 -11.306 1.00 0.34 C ATOM 896 O GLU A 61 4.946 -8.032 -12.001 1.00 0.36 O ATOM 897 CB GLU A 61 2.400 -7.577 -13.147 1.00 0.43 C ATOM 898 CG GLU A 61 1.931 -8.867 -13.811 1.00 0.52 C ATOM 899 CD GLU A 61 3.035 -9.893 -13.998 1.00 1.37 C ATOM 900 OE1 GLU A 61 4.216 -9.549 -13.786 1.00 1.88 O ATOM 901 OE2 GLU A 61 2.717 -11.038 -14.379 1.00 2.11 O ATOM 0 H GLU A 61 2.774 -5.601 -11.643 1.00 0.32 H new ATOM 0 HA GLU A 61 1.817 -8.334 -11.247 1.00 0.36 H new ATOM 0 HB2 GLU A 61 1.670 -6.793 -13.347 1.00 0.43 H new ATOM 0 HB3 GLU A 61 3.337 -7.265 -13.607 1.00 0.43 H new ATOM 0 HG2 GLU A 61 1.136 -9.307 -13.209 1.00 0.52 H new ATOM 0 HG3 GLU A 61 1.500 -8.629 -14.783 1.00 0.52 H new ATOM 908 N THR A 62 4.018 -9.026 -10.212 1.00 0.34 N ATOM 909 CA THR A 62 5.272 -9.603 -9.760 1.00 0.35 C ATOM 910 C THR A 62 5.158 -11.093 -9.473 1.00 0.39 C ATOM 911 O THR A 62 4.112 -11.589 -9.056 1.00 0.61 O ATOM 912 CB THR A 62 5.736 -8.877 -8.497 1.00 0.40 C ATOM 913 OG1 THR A 62 6.855 -9.526 -7.923 1.00 0.43 O ATOM 914 CG2 THR A 62 4.662 -8.787 -7.433 1.00 0.52 C ATOM 0 H THR A 62 3.213 -9.243 -9.624 1.00 0.34 H new ATOM 0 HA THR A 62 5.998 -9.481 -10.564 1.00 0.35 H new ATOM 0 HB THR A 62 5.992 -7.869 -8.822 1.00 0.40 H new ATOM 0 HG1 THR A 62 7.510 -9.728 -8.623 1.00 0.43 H new ATOM 0 HG21 THR A 62 5.055 -8.261 -6.563 1.00 0.52 H new ATOM 0 HG22 THR A 62 3.803 -8.244 -7.828 1.00 0.52 H new ATOM 0 HG23 THR A 62 4.354 -9.791 -7.141 1.00 0.52 H new ATOM 922 N SER A 63 6.267 -11.786 -9.674 1.00 0.37 N ATOM 923 CA SER A 63 6.348 -13.211 -9.414 1.00 0.48 C ATOM 924 C SER A 63 7.376 -13.447 -8.320 1.00 0.42 C ATOM 925 O SER A 63 7.713 -14.585 -7.994 1.00 0.45 O ATOM 926 CB SER A 63 6.738 -13.971 -10.683 1.00 0.69 C ATOM 927 OG SER A 63 5.788 -13.766 -11.713 1.00 1.22 O ATOM 0 H SER A 63 7.134 -11.376 -10.021 1.00 0.37 H new ATOM 0 HA SER A 63 5.373 -13.578 -9.092 1.00 0.48 H new ATOM 0 HB2 SER A 63 7.721 -13.642 -11.020 1.00 0.69 H new ATOM 0 HB3 SER A 63 6.816 -15.036 -10.463 1.00 0.69 H new ATOM 0 HG SER A 63 6.061 -14.261 -12.513 1.00 1.22 H new ATOM 933 N LEU A 64 7.869 -12.343 -7.760 1.00 0.37 N ATOM 934 CA LEU A 64 8.865 -12.396 -6.698 1.00 0.35 C ATOM 935 C LEU A 64 8.300 -13.136 -5.490 1.00 0.50 C ATOM 936 O LEU A 64 7.082 -13.200 -5.309 1.00 0.82 O ATOM 937 CB LEU A 64 9.293 -10.968 -6.317 1.00 0.49 C ATOM 938 CG LEU A 64 10.673 -10.827 -5.654 1.00 0.48 C ATOM 939 CD1 LEU A 64 10.645 -11.307 -4.213 1.00 0.90 C ATOM 940 CD2 LEU A 64 11.730 -11.584 -6.448 1.00 0.84 C ATOM 0 H LEU A 64 7.592 -11.399 -8.028 1.00 0.37 H new ATOM 0 HA LEU A 64 9.743 -12.938 -7.050 1.00 0.35 H new ATOM 0 HB2 LEU A 64 9.282 -10.355 -7.218 1.00 0.49 H new ATOM 0 HB3 LEU A 64 8.544 -10.555 -5.641 1.00 0.49 H new ATOM 0 HG LEU A 64 10.933 -9.768 -5.650 1.00 0.48 H new ATOM 0 HD11 LEU A 64 11.636 -11.194 -3.773 1.00 0.90 H new ATOM 0 HD12 LEU A 64 9.926 -10.715 -3.646 1.00 0.90 H new ATOM 0 HD13 LEU A 64 10.353 -12.357 -4.185 1.00 0.90 H new ATOM 0 HD21 LEU A 64 12.699 -11.472 -5.963 1.00 0.84 H new ATOM 0 HD22 LEU A 64 11.466 -12.641 -6.491 1.00 0.84 H new ATOM 0 HD23 LEU A 64 11.782 -11.182 -7.460 1.00 0.84 H new ATOM 952 N ALA A 65 9.183 -13.689 -4.668 1.00 0.58 N ATOM 953 CA ALA A 65 8.768 -14.418 -3.478 1.00 0.89 C ATOM 954 C ALA A 65 7.850 -13.559 -2.620 1.00 0.60 C ATOM 955 O ALA A 65 8.152 -12.399 -2.357 1.00 0.59 O ATOM 956 CB ALA A 65 9.985 -14.861 -2.677 1.00 1.41 C ATOM 0 H ALA A 65 10.193 -13.646 -4.805 1.00 0.58 H new ATOM 0 HA ALA A 65 8.217 -15.305 -3.790 1.00 0.89 H new ATOM 0 HB1 ALA A 65 9.659 -15.405 -1.790 1.00 1.41 H new ATOM 0 HB2 ALA A 65 10.609 -15.510 -3.292 1.00 1.41 H new ATOM 0 HB3 ALA A 65 10.560 -13.986 -2.375 1.00 1.41 H new ATOM 962 N PRO A 66 6.709 -14.110 -2.181 1.00 0.50 N ATOM 963 CA PRO A 66 5.747 -13.369 -1.360 1.00 0.40 C ATOM 964 C PRO A 66 6.349 -12.839 -0.074 1.00 0.41 C ATOM 965 O PRO A 66 5.786 -11.946 0.551 1.00 0.62 O ATOM 966 CB PRO A 66 4.669 -14.402 -1.025 1.00 0.47 C ATOM 967 CG PRO A 66 5.254 -15.730 -1.364 1.00 0.75 C ATOM 968 CD PRO A 66 6.254 -15.483 -2.455 1.00 0.64 C ATOM 0 HA PRO A 66 5.379 -12.493 -1.895 1.00 0.40 H new ATOM 0 HB2 PRO A 66 4.396 -14.353 0.029 1.00 0.47 H new ATOM 0 HB3 PRO A 66 3.760 -14.218 -1.598 1.00 0.47 H new ATOM 0 HG2 PRO A 66 5.732 -16.178 -0.493 1.00 0.75 H new ATOM 0 HG3 PRO A 66 4.480 -16.423 -1.695 1.00 0.75 H new ATOM 0 HD2 PRO A 66 7.077 -16.196 -2.417 1.00 0.64 H new ATOM 0 HD3 PRO A 66 5.803 -15.569 -3.443 1.00 0.64 H new ATOM 976 N GLU A 67 7.486 -13.392 0.325 1.00 0.40 N ATOM 977 CA GLU A 67 8.136 -12.964 1.549 1.00 0.44 C ATOM 978 C GLU A 67 9.142 -11.858 1.280 1.00 0.37 C ATOM 979 O GLU A 67 9.319 -10.965 2.105 1.00 0.40 O ATOM 980 CB GLU A 67 8.818 -14.147 2.237 1.00 0.57 C ATOM 981 CG GLU A 67 9.836 -14.849 1.360 1.00 0.65 C ATOM 982 CD GLU A 67 10.475 -16.042 2.045 1.00 0.80 C ATOM 983 OE1 GLU A 67 11.110 -15.848 3.102 1.00 1.28 O ATOM 984 OE2 GLU A 67 10.338 -17.169 1.524 1.00 1.19 O ATOM 0 H GLU A 67 7.972 -14.133 -0.180 1.00 0.40 H new ATOM 0 HA GLU A 67 7.368 -12.568 2.213 1.00 0.44 H new ATOM 0 HB2 GLU A 67 9.311 -13.796 3.143 1.00 0.57 H new ATOM 0 HB3 GLU A 67 8.058 -14.865 2.546 1.00 0.57 H new ATOM 0 HG2 GLU A 67 9.352 -15.179 0.441 1.00 0.65 H new ATOM 0 HG3 GLU A 67 10.613 -14.140 1.074 1.00 0.65 H new ATOM 991 N GLU A 68 9.801 -11.913 0.126 1.00 0.34 N ATOM 992 CA GLU A 68 10.786 -10.893 -0.220 1.00 0.31 C ATOM 993 C GLU A 68 10.146 -9.711 -0.935 1.00 0.29 C ATOM 994 O GLU A 68 10.678 -8.605 -0.904 1.00 0.30 O ATOM 995 CB GLU A 68 11.913 -11.467 -1.073 1.00 0.37 C ATOM 996 CG GLU A 68 12.972 -10.431 -1.423 1.00 0.34 C ATOM 997 CD GLU A 68 14.113 -11.010 -2.237 1.00 0.53 C ATOM 998 OE1 GLU A 68 14.083 -12.226 -2.524 1.00 1.21 O ATOM 999 OE2 GLU A 68 15.038 -10.248 -2.589 1.00 1.02 O ATOM 0 H GLU A 68 9.674 -12.642 -0.576 1.00 0.34 H new ATOM 0 HA GLU A 68 11.209 -10.538 0.720 1.00 0.31 H new ATOM 0 HB2 GLU A 68 12.382 -12.294 -0.539 1.00 0.37 H new ATOM 0 HB3 GLU A 68 11.495 -11.877 -1.992 1.00 0.37 H new ATOM 0 HG2 GLU A 68 12.508 -9.619 -1.982 1.00 0.34 H new ATOM 0 HG3 GLU A 68 13.369 -9.999 -0.504 1.00 0.34 H new ATOM 1006 N LEU A 69 9.017 -9.951 -1.589 1.00 0.32 N ATOM 1007 CA LEU A 69 8.322 -8.898 -2.321 1.00 0.36 C ATOM 1008 C LEU A 69 8.165 -7.672 -1.433 1.00 0.35 C ATOM 1009 O LEU A 69 8.725 -6.619 -1.722 1.00 0.41 O ATOM 1010 CB LEU A 69 6.974 -9.421 -2.827 1.00 0.42 C ATOM 1011 CG LEU A 69 6.128 -8.468 -3.687 1.00 0.54 C ATOM 1012 CD1 LEU A 69 5.687 -7.242 -2.907 1.00 1.08 C ATOM 1013 CD2 LEU A 69 6.892 -8.059 -4.936 1.00 1.51 C ATOM 0 H LEU A 69 8.563 -10.864 -1.628 1.00 0.32 H new ATOM 0 HA LEU A 69 8.906 -8.601 -3.192 1.00 0.36 H new ATOM 0 HB2 LEU A 69 7.159 -10.325 -3.407 1.00 0.42 H new ATOM 0 HB3 LEU A 69 6.379 -9.713 -1.962 1.00 0.42 H new ATOM 0 HG LEU A 69 5.228 -9.007 -3.984 1.00 0.54 H new ATOM 0 HD11 LEU A 69 5.092 -6.595 -3.552 1.00 1.08 H new ATOM 0 HD12 LEU A 69 5.088 -7.552 -2.051 1.00 1.08 H new ATOM 0 HD13 LEU A 69 6.565 -6.698 -2.558 1.00 1.08 H new ATOM 0 HD21 LEU A 69 6.278 -7.384 -5.533 1.00 1.51 H new ATOM 0 HD22 LEU A 69 7.814 -7.553 -4.649 1.00 1.51 H new ATOM 0 HD23 LEU A 69 7.132 -8.946 -5.522 1.00 1.51 H new ATOM 1025 N LEU A 70 7.433 -7.814 -0.336 1.00 0.33 N ATOM 1026 CA LEU A 70 7.264 -6.699 0.586 1.00 0.39 C ATOM 1027 C LEU A 70 8.628 -6.264 1.102 1.00 0.42 C ATOM 1028 O LEU A 70 8.933 -5.074 1.164 1.00 0.61 O ATOM 1029 CB LEU A 70 6.351 -7.084 1.754 1.00 0.44 C ATOM 1030 CG LEU A 70 6.224 -6.049 2.882 1.00 0.58 C ATOM 1031 CD1 LEU A 70 4.925 -6.253 3.644 1.00 1.16 C ATOM 1032 CD2 LEU A 70 7.401 -6.144 3.843 1.00 1.01 C ATOM 0 H LEU A 70 6.955 -8.673 -0.066 1.00 0.33 H new ATOM 0 HA LEU A 70 6.793 -5.872 0.055 1.00 0.39 H new ATOM 0 HB2 LEU A 70 5.355 -7.285 1.359 1.00 0.44 H new ATOM 0 HB3 LEU A 70 6.718 -8.016 2.183 1.00 0.44 H new ATOM 0 HG LEU A 70 6.223 -5.058 2.428 1.00 0.58 H new ATOM 0 HD11 LEU A 70 4.850 -5.512 4.440 1.00 1.16 H new ATOM 0 HD12 LEU A 70 4.082 -6.140 2.962 1.00 1.16 H new ATOM 0 HD13 LEU A 70 4.910 -7.253 4.077 1.00 1.16 H new ATOM 0 HD21 LEU A 70 7.287 -5.401 4.632 1.00 1.01 H new ATOM 0 HD22 LEU A 70 7.431 -7.140 4.284 1.00 1.01 H new ATOM 0 HD23 LEU A 70 8.329 -5.959 3.301 1.00 1.01 H new ATOM 1044 N ASN A 71 9.442 -7.246 1.471 1.00 0.31 N ATOM 1045 CA ASN A 71 10.782 -6.986 1.988 1.00 0.35 C ATOM 1046 C ASN A 71 11.549 -5.999 1.111 1.00 0.38 C ATOM 1047 O ASN A 71 12.215 -5.103 1.628 1.00 0.45 O ATOM 1048 CB ASN A 71 11.577 -8.288 2.119 1.00 0.36 C ATOM 1049 CG ASN A 71 11.056 -9.194 3.222 1.00 1.06 C ATOM 1050 OD1 ASN A 71 11.616 -10.262 3.473 1.00 1.87 O ATOM 1051 ND2 ASN A 71 9.976 -8.785 3.884 1.00 1.53 N ATOM 0 H ASN A 71 9.197 -8.235 1.422 1.00 0.31 H new ATOM 0 HA ASN A 71 10.661 -6.539 2.975 1.00 0.35 H new ATOM 0 HB2 ASN A 71 11.544 -8.824 1.170 1.00 0.36 H new ATOM 0 HB3 ASN A 71 12.623 -8.051 2.315 1.00 0.36 H new ATOM 0 HD21 ASN A 71 9.585 -9.363 4.628 1.00 1.53 H new ATOM 0 HD22 ASN A 71 9.540 -7.894 3.647 1.00 1.53 H new ATOM 1058 N HIS A 72 11.460 -6.155 -0.211 1.00 0.35 N ATOM 1059 CA HIS A 72 12.160 -5.259 -1.114 1.00 0.42 C ATOM 1060 C HIS A 72 11.371 -3.972 -1.294 1.00 0.41 C ATOM 1061 O HIS A 72 11.953 -2.887 -1.334 1.00 0.43 O ATOM 1062 CB HIS A 72 12.450 -5.930 -2.458 1.00 0.51 C ATOM 1063 CG HIS A 72 11.251 -6.212 -3.306 1.00 1.07 C ATOM 1064 ND1 HIS A 72 10.352 -5.245 -3.698 1.00 2.09 N ATOM 1065 CD2 HIS A 72 10.825 -7.367 -3.869 1.00 1.39 C ATOM 1066 CE1 HIS A 72 9.426 -5.792 -4.463 1.00 2.99 C ATOM 1067 NE2 HIS A 72 9.692 -7.079 -4.583 1.00 2.56 N ATOM 0 H HIS A 72 10.916 -6.886 -0.670 1.00 0.35 H new ATOM 0 HA HIS A 72 13.123 -5.011 -0.669 1.00 0.42 H new ATOM 0 HB2 HIS A 72 13.132 -5.294 -3.023 1.00 0.51 H new ATOM 0 HB3 HIS A 72 12.971 -6.869 -2.271 1.00 0.51 H new ATOM 0 HD2 HIS A 72 11.292 -8.336 -3.773 1.00 1.39 H new ATOM 0 HE1 HIS A 72 8.592 -5.274 -4.914 1.00 2.99 H new ATOM 0 HE2 HIS A 72 9.143 -7.750 -5.120 1.00 2.56 H new ATOM 1076 N THR A 73 10.041 -4.080 -1.370 1.00 0.45 N ATOM 1077 CA THR A 73 9.213 -2.884 -1.502 1.00 0.49 C ATOM 1078 C THR A 73 9.523 -1.938 -0.348 1.00 0.46 C ATOM 1079 O THR A 73 9.285 -0.733 -0.427 1.00 0.47 O ATOM 1080 CB THR A 73 7.719 -3.221 -1.510 1.00 0.58 C ATOM 1081 OG1 THR A 73 7.337 -3.865 -0.310 1.00 0.62 O ATOM 1082 CG2 THR A 73 7.302 -4.108 -2.661 1.00 0.66 C ATOM 0 H THR A 73 9.528 -4.961 -1.343 1.00 0.45 H new ATOM 0 HA THR A 73 9.445 -2.410 -2.456 1.00 0.49 H new ATOM 0 HB THR A 73 7.217 -2.260 -1.618 1.00 0.58 H new ATOM 0 HG1 THR A 73 8.130 -4.021 0.244 1.00 0.62 H new ATOM 0 HG21 THR A 73 6.231 -4.304 -2.600 1.00 0.66 H new ATOM 0 HG22 THR A 73 7.527 -3.610 -3.604 1.00 0.66 H new ATOM 0 HG23 THR A 73 7.847 -5.051 -2.610 1.00 0.66 H new ATOM 1090 N GLN A 74 10.077 -2.508 0.721 1.00 0.49 N ATOM 1091 CA GLN A 74 10.453 -1.746 1.904 1.00 0.49 C ATOM 1092 C GLN A 74 11.645 -0.844 1.604 1.00 0.43 C ATOM 1093 O GLN A 74 11.661 0.326 1.987 1.00 0.45 O ATOM 1094 CB GLN A 74 10.798 -2.692 3.059 1.00 0.60 C ATOM 1095 CG GLN A 74 9.612 -3.488 3.582 1.00 0.65 C ATOM 1096 CD GLN A 74 8.542 -2.628 4.238 1.00 0.87 C ATOM 1097 OE1 GLN A 74 7.499 -3.132 4.649 1.00 1.66 O ATOM 1098 NE2 GLN A 74 8.792 -1.327 4.348 1.00 1.05 N ATOM 0 H GLN A 74 10.276 -3.506 0.789 1.00 0.49 H new ATOM 0 HA GLN A 74 9.605 -1.125 2.193 1.00 0.49 H new ATOM 0 HB2 GLN A 74 11.571 -3.386 2.728 1.00 0.60 H new ATOM 0 HB3 GLN A 74 11.221 -2.110 3.878 1.00 0.60 H new ATOM 0 HG2 GLN A 74 9.165 -4.042 2.757 1.00 0.65 H new ATOM 0 HG3 GLN A 74 9.968 -4.223 4.304 1.00 0.65 H new ATOM 0 HE21 GLN A 74 9.669 -0.945 3.995 1.00 1.05 H new ATOM 0 HE22 GLN A 74 8.107 -0.711 4.785 1.00 1.05 H new ATOM 1107 N ARG A 75 12.640 -1.400 0.915 1.00 0.44 N ATOM 1108 CA ARG A 75 13.835 -0.645 0.557 1.00 0.46 C ATOM 1109 C ARG A 75 13.473 0.617 -0.214 1.00 0.43 C ATOM 1110 O ARG A 75 14.091 1.664 -0.028 1.00 0.52 O ATOM 1111 CB ARG A 75 14.799 -1.507 -0.267 1.00 0.59 C ATOM 1112 CG ARG A 75 15.586 -2.516 0.556 1.00 1.17 C ATOM 1113 CD ARG A 75 14.685 -3.588 1.144 1.00 1.93 C ATOM 1114 NE ARG A 75 15.425 -4.539 1.974 1.00 2.51 N ATOM 1115 CZ ARG A 75 16.045 -4.207 3.104 1.00 2.97 C ATOM 1116 NH1 ARG A 75 16.010 -2.958 3.546 1.00 3.08 N ATOM 1117 NH2 ARG A 75 16.698 -5.130 3.795 1.00 3.82 N ATOM 0 H ARG A 75 12.641 -2.369 0.595 1.00 0.44 H new ATOM 0 HA ARG A 75 14.332 -0.354 1.482 1.00 0.46 H new ATOM 0 HB2 ARG A 75 14.232 -2.040 -1.030 1.00 0.59 H new ATOM 0 HB3 ARG A 75 15.499 -0.854 -0.788 1.00 0.59 H new ATOM 0 HG2 ARG A 75 16.346 -2.983 -0.071 1.00 1.17 H new ATOM 0 HG3 ARG A 75 16.110 -2.000 1.360 1.00 1.17 H new ATOM 0 HD2 ARG A 75 13.905 -3.117 1.742 1.00 1.93 H new ATOM 0 HD3 ARG A 75 14.187 -4.124 0.336 1.00 1.93 H new ATOM 0 HE ARG A 75 15.468 -5.511 1.669 1.00 2.51 H new ATOM 0 HH11 ARG A 75 15.506 -2.245 3.019 1.00 3.08 H new ATOM 0 HH12 ARG A 75 16.487 -2.710 4.413 1.00 3.08 H new ATOM 0 HH21 ARG A 75 16.725 -6.093 3.461 1.00 3.82 H new ATOM 0 HH22 ARG A 75 17.174 -4.877 4.661 1.00 3.82 H new ATOM 1131 N ILE A 76 12.464 0.512 -1.075 1.00 0.43 N ATOM 1132 CA ILE A 76 12.011 1.649 -1.870 1.00 0.48 C ATOM 1133 C ILE A 76 11.776 2.870 -0.987 1.00 0.49 C ATOM 1134 O ILE A 76 12.099 3.996 -1.368 1.00 0.60 O ATOM 1135 CB ILE A 76 10.710 1.317 -2.624 1.00 0.53 C ATOM 1136 CG1 ILE A 76 10.937 0.140 -3.576 1.00 0.62 C ATOM 1137 CG2 ILE A 76 10.211 2.541 -3.379 1.00 0.64 C ATOM 1138 CD1 ILE A 76 9.682 -0.317 -4.288 1.00 1.42 C ATOM 0 H ILE A 76 11.944 -0.350 -1.240 1.00 0.43 H new ATOM 0 HA ILE A 76 12.796 1.870 -2.593 1.00 0.48 H new ATOM 0 HB ILE A 76 9.946 1.029 -1.902 1.00 0.53 H new ATOM 0 HG12 ILE A 76 11.683 0.423 -4.319 1.00 0.62 H new ATOM 0 HG13 ILE A 76 11.350 -0.697 -3.013 1.00 0.62 H new ATOM 0 HG21 ILE A 76 9.291 2.292 -3.908 1.00 0.64 H new ATOM 0 HG22 ILE A 76 10.017 3.349 -2.674 1.00 0.64 H new ATOM 0 HG23 ILE A 76 10.967 2.859 -4.097 1.00 0.64 H new ATOM 0 HD11 ILE A 76 9.920 -1.153 -4.945 1.00 1.42 H new ATOM 0 HD12 ILE A 76 8.941 -0.632 -3.553 1.00 1.42 H new ATOM 0 HD13 ILE A 76 9.279 0.505 -4.879 1.00 1.42 H new ATOM 1150 N GLU A 77 11.209 2.636 0.190 1.00 0.45 N ATOM 1151 CA GLU A 77 10.926 3.708 1.135 1.00 0.52 C ATOM 1152 C GLU A 77 12.205 4.439 1.517 1.00 0.52 C ATOM 1153 O GLU A 77 12.249 5.670 1.539 1.00 0.71 O ATOM 1154 CB GLU A 77 10.257 3.134 2.382 1.00 0.59 C ATOM 1155 CG GLU A 77 9.740 4.183 3.349 1.00 0.95 C ATOM 1156 CD GLU A 77 9.137 3.568 4.596 1.00 1.15 C ATOM 1157 OE1 GLU A 77 9.846 2.803 5.283 1.00 1.59 O ATOM 1158 OE2 GLU A 77 7.957 3.851 4.886 1.00 1.52 O ATOM 0 H GLU A 77 10.935 1.708 0.514 1.00 0.45 H new ATOM 0 HA GLU A 77 10.252 4.422 0.662 1.00 0.52 H new ATOM 0 HB2 GLU A 77 9.427 2.498 2.075 1.00 0.59 H new ATOM 0 HB3 GLU A 77 10.971 2.496 2.903 1.00 0.59 H new ATOM 0 HG2 GLU A 77 10.557 4.847 3.632 1.00 0.95 H new ATOM 0 HG3 GLU A 77 8.990 4.796 2.850 1.00 0.95 H new ATOM 1165 N LEU A 78 13.246 3.669 1.810 1.00 0.47 N ATOM 1166 CA LEU A 78 14.536 4.236 2.185 1.00 0.56 C ATOM 1167 C LEU A 78 15.229 4.833 0.966 1.00 0.57 C ATOM 1168 O LEU A 78 16.015 5.773 1.084 1.00 0.66 O ATOM 1169 CB LEU A 78 15.422 3.164 2.822 1.00 0.63 C ATOM 1170 CG LEU A 78 14.846 2.502 4.076 1.00 0.71 C ATOM 1171 CD1 LEU A 78 15.801 1.443 4.605 1.00 0.83 C ATOM 1172 CD2 LEU A 78 14.559 3.542 5.149 1.00 0.84 C ATOM 0 H LEU A 78 13.222 2.649 1.795 1.00 0.47 H new ATOM 0 HA LEU A 78 14.366 5.029 2.913 1.00 0.56 H new ATOM 0 HB2 LEU A 78 15.619 2.390 2.080 1.00 0.63 H new ATOM 0 HB3 LEU A 78 16.382 3.613 3.076 1.00 0.63 H new ATOM 0 HG LEU A 78 13.907 2.019 3.807 1.00 0.71 H new ATOM 0 HD11 LEU A 78 15.376 0.982 5.497 1.00 0.83 H new ATOM 0 HD12 LEU A 78 15.957 0.680 3.842 1.00 0.83 H new ATOM 0 HD13 LEU A 78 16.755 1.906 4.856 1.00 0.83 H new ATOM 0 HD21 LEU A 78 14.150 3.051 6.032 1.00 0.84 H new ATOM 0 HD22 LEU A 78 15.483 4.055 5.415 1.00 0.84 H new ATOM 0 HD23 LEU A 78 13.838 4.266 4.770 1.00 0.84 H new ATOM 1184 N GLN A 79 14.928 4.281 -0.207 1.00 0.56 N ATOM 1185 CA GLN A 79 15.518 4.763 -1.447 1.00 0.63 C ATOM 1186 C GLN A 79 14.880 6.075 -1.876 1.00 0.66 C ATOM 1187 O GLN A 79 15.491 6.866 -2.597 1.00 0.84 O ATOM 1188 CB GLN A 79 15.373 3.720 -2.554 1.00 0.67 C ATOM 1189 CG GLN A 79 16.095 2.422 -2.247 1.00 0.93 C ATOM 1190 CD GLN A 79 16.099 1.468 -3.423 1.00 1.22 C ATOM 1191 OE1 GLN A 79 16.624 1.784 -4.492 1.00 1.95 O ATOM 1192 NE2 GLN A 79 15.510 0.297 -3.234 1.00 1.30 N ATOM 0 H GLN A 79 14.280 3.502 -0.322 1.00 0.56 H new ATOM 0 HA GLN A 79 16.579 4.937 -1.269 1.00 0.63 H new ATOM 0 HB2 GLN A 79 14.315 3.512 -2.712 1.00 0.67 H new ATOM 0 HB3 GLN A 79 15.760 4.132 -3.486 1.00 0.67 H new ATOM 0 HG2 GLN A 79 17.123 2.641 -1.958 1.00 0.93 H new ATOM 0 HG3 GLN A 79 15.620 1.939 -1.393 1.00 0.93 H new ATOM 0 HE21 GLN A 79 15.088 0.078 -2.332 1.00 1.30 H new ATOM 0 HE22 GLN A 79 15.478 -0.386 -3.991 1.00 1.30 H new ATOM 1201 N GLN A 80 13.653 6.312 -1.422 1.00 0.54 N ATOM 1202 CA GLN A 80 12.951 7.541 -1.753 1.00 0.59 C ATOM 1203 C GLN A 80 13.395 8.651 -0.813 1.00 0.68 C ATOM 1204 O GLN A 80 13.190 9.834 -1.081 1.00 0.78 O ATOM 1205 CB GLN A 80 11.439 7.332 -1.659 1.00 0.54 C ATOM 1206 CG GLN A 80 10.625 8.575 -1.977 1.00 0.99 C ATOM 1207 CD GLN A 80 10.861 9.090 -3.384 1.00 0.98 C ATOM 1208 OE1 GLN A 80 11.964 9.517 -3.727 1.00 1.68 O ATOM 1209 NE2 GLN A 80 9.824 9.046 -4.209 1.00 0.74 N ATOM 0 H GLN A 80 13.129 5.671 -0.827 1.00 0.54 H new ATOM 0 HA GLN A 80 13.192 7.826 -2.777 1.00 0.59 H new ATOM 0 HB2 GLN A 80 11.149 6.535 -2.343 1.00 0.54 H new ATOM 0 HB3 GLN A 80 11.191 6.994 -0.653 1.00 0.54 H new ATOM 0 HG2 GLN A 80 9.566 8.352 -1.850 1.00 0.99 H new ATOM 0 HG3 GLN A 80 10.874 9.359 -1.262 1.00 0.99 H new ATOM 0 HE21 GLN A 80 8.928 8.684 -3.883 1.00 0.74 H new ATOM 0 HE22 GLN A 80 9.922 9.374 -5.170 1.00 0.74 H new ATOM 1218 N GLY A 81 14.015 8.250 0.293 1.00 0.74 N ATOM 1219 CA GLY A 81 14.494 9.204 1.262 1.00 0.88 C ATOM 1220 C GLY A 81 13.563 9.346 2.441 1.00 0.89 C ATOM 1221 O GLY A 81 13.360 10.455 2.937 1.00 0.99 O ATOM 0 H GLY A 81 14.192 7.274 0.531 1.00 0.74 H new ATOM 0 HA2 GLY A 81 15.478 8.896 1.615 1.00 0.88 H new ATOM 0 HA3 GLY A 81 14.617 10.175 0.781 1.00 0.88 H new ATOM 1225 N ARG A 82 12.987 8.231 2.901 1.00 0.95 N ATOM 1226 CA ARG A 82 12.081 8.290 4.036 1.00 1.07 C ATOM 1227 C ARG A 82 12.789 8.961 5.202 1.00 1.09 C ATOM 1228 O ARG A 82 14.011 8.890 5.324 1.00 1.50 O ATOM 1229 CB ARG A 82 11.584 6.898 4.437 1.00 1.34 C ATOM 1230 CG ARG A 82 12.257 6.320 5.673 1.00 1.78 C ATOM 1231 CD ARG A 82 11.415 5.212 6.282 1.00 2.05 C ATOM 1232 NE ARG A 82 11.997 4.703 7.522 1.00 2.68 N ATOM 1233 CZ ARG A 82 11.416 3.786 8.290 1.00 3.14 C ATOM 1234 NH1 ARG A 82 10.226 3.296 7.964 1.00 3.20 N ATOM 1235 NH2 ARG A 82 12.022 3.362 9.390 1.00 3.90 N ATOM 0 H ARG A 82 13.131 7.300 2.511 1.00 0.95 H new ATOM 0 HA ARG A 82 11.205 8.872 3.752 1.00 1.07 H new ATOM 0 HB2 ARG A 82 10.509 6.946 4.613 1.00 1.34 H new ATOM 0 HB3 ARG A 82 11.740 6.216 3.601 1.00 1.34 H new ATOM 0 HG2 ARG A 82 13.240 5.931 5.408 1.00 1.78 H new ATOM 0 HG3 ARG A 82 12.414 7.109 6.409 1.00 1.78 H new ATOM 0 HD2 ARG A 82 10.411 5.586 6.480 1.00 2.05 H new ATOM 0 HD3 ARG A 82 11.316 4.396 5.566 1.00 2.05 H new ATOM 0 HE ARG A 82 12.901 5.073 7.815 1.00 2.68 H new ATOM 0 HH11 ARG A 82 9.753 3.623 7.121 1.00 3.20 H new ATOM 0 HH12 ARG A 82 9.784 2.593 8.556 1.00 3.20 H new ATOM 0 HH21 ARG A 82 12.934 3.739 9.647 1.00 3.90 H new ATOM 0 HH22 ARG A 82 11.576 2.659 9.979 1.00 3.90 H new ATOM 1249 N VAL A 83 12.022 9.637 6.037 1.00 1.01 N ATOM 1250 CA VAL A 83 12.589 10.347 7.167 1.00 1.24 C ATOM 1251 C VAL A 83 12.506 9.520 8.445 1.00 1.17 C ATOM 1252 O VAL A 83 11.425 9.132 8.886 1.00 1.65 O ATOM 1253 CB VAL A 83 11.886 11.697 7.343 1.00 1.94 C ATOM 1254 CG1 VAL A 83 12.611 12.552 8.370 1.00 2.77 C ATOM 1255 CG2 VAL A 83 11.800 12.398 5.993 1.00 2.45 C ATOM 0 H VAL A 83 11.008 9.709 5.954 1.00 1.01 H new ATOM 0 HA VAL A 83 13.645 10.523 6.964 1.00 1.24 H new ATOM 0 HB VAL A 83 10.875 11.534 7.717 1.00 1.94 H new ATOM 0 HG11 VAL A 83 12.095 13.506 8.479 1.00 2.77 H new ATOM 0 HG12 VAL A 83 12.625 12.035 9.329 1.00 2.77 H new ATOM 0 HG13 VAL A 83 13.634 12.729 8.039 1.00 2.77 H new ATOM 0 HG21 VAL A 83 11.300 13.359 6.113 1.00 2.45 H new ATOM 0 HG22 VAL A 83 12.805 12.558 5.601 1.00 2.45 H new ATOM 0 HG23 VAL A 83 11.233 11.779 5.297 1.00 2.45 H new ATOM 1265 N ARG A 84 13.675 9.245 9.016 1.00 1.26 N ATOM 1266 CA ARG A 84 13.787 8.448 10.232 1.00 1.64 C ATOM 1267 C ARG A 84 12.950 9.020 11.371 1.00 1.64 C ATOM 1268 O ARG A 84 13.100 10.182 11.747 1.00 2.28 O ATOM 1269 CB ARG A 84 15.252 8.353 10.659 1.00 2.64 C ATOM 1270 CG ARG A 84 16.142 7.705 9.613 1.00 3.46 C ATOM 1271 CD ARG A 84 17.597 7.682 10.052 1.00 4.08 C ATOM 1272 NE ARG A 84 17.777 6.987 11.324 1.00 4.79 N ATOM 1273 CZ ARG A 84 17.505 5.699 11.511 1.00 5.36 C ATOM 1274 NH1 ARG A 84 17.049 4.958 10.509 1.00 5.36 N ATOM 1275 NH2 ARG A 84 17.692 5.145 12.702 1.00 6.26 N ATOM 0 H ARG A 84 14.570 9.568 8.649 1.00 1.26 H new ATOM 0 HA ARG A 84 13.402 7.453 10.009 1.00 1.64 H new ATOM 0 HB2 ARG A 84 15.626 9.354 10.875 1.00 2.64 H new ATOM 0 HB3 ARG A 84 15.317 7.782 11.585 1.00 2.64 H new ATOM 0 HG2 ARG A 84 15.802 6.687 9.426 1.00 3.46 H new ATOM 0 HG3 ARG A 84 16.054 8.249 8.672 1.00 3.46 H new ATOM 0 HD2 ARG A 84 18.199 7.195 9.285 1.00 4.08 H new ATOM 0 HD3 ARG A 84 17.964 8.704 10.143 1.00 4.08 H new ATOM 0 HE ARG A 84 18.133 7.522 12.116 1.00 4.79 H new ATOM 0 HH11 ARG A 84 16.906 5.376 9.590 1.00 5.36 H new ATOM 0 HH12 ARG A 84 16.842 3.970 10.658 1.00 5.36 H new ATOM 0 HH21 ARG A 84 18.045 5.707 13.476 1.00 6.26 H new ATOM 0 HH22 ARG A 84 17.483 4.157 12.843 1.00 6.26 H new ATOM 1289 N LYS A 85 12.080 8.172 11.916 1.00 1.79 N ATOM 1290 CA LYS A 85 11.204 8.541 13.025 1.00 2.53 C ATOM 1291 C LYS A 85 10.233 7.402 13.308 1.00 2.61 C ATOM 1292 O LYS A 85 10.062 6.512 12.473 1.00 3.08 O ATOM 1293 CB LYS A 85 10.429 9.823 12.708 1.00 3.13 C ATOM 1294 CG LYS A 85 9.610 10.354 13.878 1.00 3.58 C ATOM 1295 CD LYS A 85 10.495 10.716 15.061 1.00 4.39 C ATOM 1296 CE LYS A 85 9.678 11.257 16.224 1.00 5.02 C ATOM 1297 NZ LYS A 85 10.533 11.605 17.393 1.00 5.50 N ATOM 0 H LYS A 85 11.963 7.209 11.601 1.00 1.79 H new ATOM 0 HA LYS A 85 11.818 8.725 13.906 1.00 2.53 H new ATOM 0 HB2 LYS A 85 11.133 10.592 12.391 1.00 3.13 H new ATOM 0 HB3 LYS A 85 9.762 9.634 11.866 1.00 3.13 H new ATOM 0 HG2 LYS A 85 9.048 11.232 13.561 1.00 3.58 H new ATOM 0 HG3 LYS A 85 8.882 9.603 14.184 1.00 3.58 H new ATOM 0 HD2 LYS A 85 11.051 9.836 15.384 1.00 4.39 H new ATOM 0 HD3 LYS A 85 11.229 11.461 14.753 1.00 4.39 H new ATOM 0 HE2 LYS A 85 9.129 12.141 15.901 1.00 5.02 H new ATOM 0 HE3 LYS A 85 8.939 10.514 16.524 1.00 5.02 H new ATOM 0 HZ1 LYS A 85 9.937 11.970 18.163 1.00 5.50 H new ATOM 0 HZ2 LYS A 85 11.038 10.756 17.719 1.00 5.50 H new ATOM 0 HZ3 LYS A 85 11.222 12.332 17.115 1.00 5.50 H new ATOM 1311 N ALA A 86 9.601 7.421 14.476 1.00 2.48 N ATOM 1312 CA ALA A 86 8.655 6.372 14.832 1.00 2.58 C ATOM 1313 C ALA A 86 7.555 6.264 13.784 1.00 2.00 C ATOM 1314 O ALA A 86 6.742 7.176 13.623 1.00 1.95 O ATOM 1315 CB ALA A 86 8.057 6.644 16.205 1.00 3.19 C ATOM 0 H ALA A 86 9.725 8.143 15.185 1.00 2.48 H new ATOM 0 HA ALA A 86 9.189 5.422 14.867 1.00 2.58 H new ATOM 0 HB1 ALA A 86 7.352 5.852 16.458 1.00 3.19 H new ATOM 0 HB2 ALA A 86 8.853 6.673 16.949 1.00 3.19 H new ATOM 0 HB3 ALA A 86 7.537 7.602 16.192 1.00 3.19 H new ATOM 1321 N GLU A 87 7.539 5.145 13.071 1.00 2.01 N ATOM 1322 CA GLU A 87 6.543 4.905 12.034 1.00 1.67 C ATOM 1323 C GLU A 87 5.794 3.604 12.296 1.00 1.90 C ATOM 1324 O GLU A 87 6.096 2.570 11.698 1.00 2.39 O ATOM 1325 CB GLU A 87 7.215 4.875 10.659 1.00 2.04 C ATOM 1326 CG GLU A 87 6.255 4.634 9.507 1.00 2.47 C ATOM 1327 CD GLU A 87 6.952 4.657 8.161 1.00 3.23 C ATOM 1328 OE1 GLU A 87 7.511 5.714 7.801 1.00 3.80 O ATOM 1329 OE2 GLU A 87 6.935 3.621 7.465 1.00 3.66 O ATOM 0 H GLU A 87 8.209 4.385 13.193 1.00 2.01 H new ATOM 0 HA GLU A 87 5.818 5.719 12.051 1.00 1.67 H new ATOM 0 HB2 GLU A 87 7.730 5.822 10.497 1.00 2.04 H new ATOM 0 HB3 GLU A 87 7.975 4.094 10.654 1.00 2.04 H new ATOM 0 HG2 GLU A 87 5.763 3.671 9.642 1.00 2.47 H new ATOM 0 HG3 GLU A 87 5.475 5.395 9.522 1.00 2.47 H new ATOM 1336 N ARG A 88 4.821 3.655 13.199 1.00 1.97 N ATOM 1337 CA ARG A 88 4.040 2.475 13.540 1.00 2.47 C ATOM 1338 C ARG A 88 2.754 2.414 12.720 1.00 2.28 C ATOM 1339 O ARG A 88 2.495 1.431 12.026 1.00 2.54 O ATOM 1340 CB ARG A 88 3.698 2.479 15.033 1.00 2.97 C ATOM 1341 CG ARG A 88 4.917 2.547 15.941 1.00 3.30 C ATOM 1342 CD ARG A 88 5.797 1.313 15.798 1.00 3.95 C ATOM 1343 NE ARG A 88 6.950 1.351 16.698 1.00 4.47 N ATOM 1344 CZ ARG A 88 6.855 1.365 18.026 1.00 5.01 C ATOM 1345 NH1 ARG A 88 5.665 1.322 18.613 1.00 5.17 N ATOM 1346 NH2 ARG A 88 7.952 1.413 18.769 1.00 5.74 N ATOM 0 H ARG A 88 4.556 4.499 13.706 1.00 1.97 H new ATOM 0 HA ARG A 88 4.642 1.596 13.309 1.00 2.47 H new ATOM 0 HB2 ARG A 88 3.050 3.329 15.246 1.00 2.97 H new ATOM 0 HB3 ARG A 88 3.130 1.579 15.269 1.00 2.97 H new ATOM 0 HG2 ARG A 88 5.498 3.438 15.703 1.00 3.30 H new ATOM 0 HG3 ARG A 88 4.594 2.645 16.977 1.00 3.30 H new ATOM 0 HD2 ARG A 88 5.206 0.421 16.005 1.00 3.95 H new ATOM 0 HD3 ARG A 88 6.144 1.234 14.768 1.00 3.95 H new ATOM 0 HE ARG A 88 7.882 1.368 16.283 1.00 4.47 H new ATOM 0 HH11 ARG A 88 4.818 1.278 18.046 1.00 5.17 H new ATOM 0 HH12 ARG A 88 5.598 1.333 19.631 1.00 5.17 H new ATOM 0 HH21 ARG A 88 8.869 1.439 18.323 1.00 5.74 H new ATOM 0 HH22 ARG A 88 7.879 1.424 19.786 1.00 5.74 H new ATOM 1360 N TRP A 89 1.955 3.472 12.811 1.00 1.98 N ATOM 1361 CA TRP A 89 0.690 3.546 12.083 1.00 1.91 C ATOM 1362 C TRP A 89 0.697 4.713 11.099 1.00 1.60 C ATOM 1363 O TRP A 89 0.084 4.643 10.032 1.00 1.71 O ATOM 1364 CB TRP A 89 -0.479 3.709 13.063 1.00 2.11 C ATOM 1365 CG TRP A 89 -0.741 2.503 13.921 1.00 2.00 C ATOM 1366 CD1 TRP A 89 0.172 1.588 14.367 1.00 2.28 C ATOM 1367 CD2 TRP A 89 -2.007 2.092 14.451 1.00 2.29 C ATOM 1368 NE1 TRP A 89 -0.451 0.629 15.129 1.00 2.69 N ATOM 1369 CE2 TRP A 89 -1.789 0.917 15.196 1.00 2.74 C ATOM 1370 CE3 TRP A 89 -3.305 2.600 14.363 1.00 2.65 C ATOM 1371 CZ2 TRP A 89 -2.819 0.247 15.850 1.00 3.44 C ATOM 1372 CZ3 TRP A 89 -4.327 1.936 15.012 1.00 3.33 C ATOM 1373 CH2 TRP A 89 -4.081 0.769 15.748 1.00 3.70 C ATOM 0 H TRP A 89 2.160 4.292 13.382 1.00 1.98 H new ATOM 0 HA TRP A 89 0.567 2.617 11.526 1.00 1.91 H new ATOM 0 HB2 TRP A 89 -0.279 4.564 13.709 1.00 2.11 H new ATOM 0 HB3 TRP A 89 -1.382 3.941 12.498 1.00 2.11 H new ATOM 0 HD1 TRP A 89 1.230 1.615 14.152 1.00 2.28 H new ATOM 0 HE1 TRP A 89 0.008 -0.167 15.572 1.00 2.69 H new ATOM 0 HE3 TRP A 89 -3.506 3.497 13.797 1.00 2.65 H new ATOM 0 HZ2 TRP A 89 -2.630 -0.652 16.417 1.00 3.44 H new ATOM 0 HZ3 TRP A 89 -5.334 2.323 14.951 1.00 3.33 H new ATOM 0 HH2 TRP A 89 -4.902 0.272 16.244 1.00 3.70 H new ATOM 1384 N GLY A 90 1.383 5.786 11.473 1.00 1.35 N ATOM 1385 CA GLY A 90 1.453 6.967 10.627 1.00 1.15 C ATOM 1386 C GLY A 90 2.247 6.744 9.353 1.00 1.08 C ATOM 1387 O GLY A 90 2.919 5.723 9.207 1.00 1.29 O ATOM 0 H GLY A 90 1.895 5.861 12.352 1.00 1.35 H new ATOM 0 HA2 GLY A 90 0.442 7.280 10.367 1.00 1.15 H new ATOM 0 HA3 GLY A 90 1.905 7.783 11.191 1.00 1.15 H new ATOM 1391 N PRO A 91 2.183 7.695 8.401 1.00 0.96 N ATOM 1392 CA PRO A 91 2.896 7.593 7.129 1.00 1.07 C ATOM 1393 C PRO A 91 4.359 8.028 7.229 1.00 1.17 C ATOM 1394 O PRO A 91 5.266 7.220 7.029 1.00 1.60 O ATOM 1395 CB PRO A 91 2.110 8.538 6.224 1.00 1.09 C ATOM 1396 CG PRO A 91 1.567 9.586 7.136 1.00 1.09 C ATOM 1397 CD PRO A 91 1.396 8.943 8.491 1.00 0.91 C ATOM 0 HA PRO A 91 2.945 6.566 6.767 1.00 1.07 H new ATOM 0 HB2 PRO A 91 2.751 8.975 5.458 1.00 1.09 H new ATOM 0 HB3 PRO A 91 1.308 8.012 5.706 1.00 1.09 H new ATOM 0 HG2 PRO A 91 2.247 10.436 7.195 1.00 1.09 H new ATOM 0 HG3 PRO A 91 0.614 9.965 6.765 1.00 1.09 H new ATOM 0 HD2 PRO A 91 1.764 9.589 9.288 1.00 0.91 H new ATOM 0 HD3 PRO A 91 0.347 8.738 8.705 1.00 0.91 H new ATOM 1405 N ARG A 92 4.579 9.307 7.531 1.00 0.93 N ATOM 1406 CA ARG A 92 5.925 9.856 7.648 1.00 1.03 C ATOM 1407 C ARG A 92 6.635 9.876 6.298 1.00 1.13 C ATOM 1408 O ARG A 92 7.572 9.112 6.060 1.00 1.95 O ATOM 1409 CB ARG A 92 6.753 9.087 8.692 1.00 1.21 C ATOM 1410 CG ARG A 92 8.214 9.530 8.790 1.00 1.04 C ATOM 1411 CD ARG A 92 8.376 11.012 8.474 1.00 1.71 C ATOM 1412 NE ARG A 92 9.227 11.706 9.435 1.00 2.57 N ATOM 1413 CZ ARG A 92 8.910 11.882 10.715 1.00 3.53 C ATOM 1414 NH1 ARG A 92 7.771 11.400 11.196 1.00 3.96 N ATOM 1415 NH2 ARG A 92 9.734 12.539 11.519 1.00 4.39 N ATOM 0 H ARG A 92 3.835 9.985 7.700 1.00 0.93 H new ATOM 0 HA ARG A 92 5.829 10.886 7.990 1.00 1.03 H new ATOM 0 HB2 ARG A 92 6.284 9.205 9.669 1.00 1.21 H new ATOM 0 HB3 ARG A 92 6.723 8.024 8.451 1.00 1.21 H new ATOM 0 HG2 ARG A 92 8.589 9.329 9.794 1.00 1.04 H new ATOM 0 HG3 ARG A 92 8.820 8.942 8.100 1.00 1.04 H new ATOM 0 HD2 ARG A 92 8.799 11.122 7.476 1.00 1.71 H new ATOM 0 HD3 ARG A 92 7.394 11.485 8.458 1.00 1.71 H new ATOM 0 HE ARG A 92 10.118 12.078 9.106 1.00 2.57 H new ATOM 0 HH11 ARG A 92 7.133 10.891 10.583 1.00 3.96 H new ATOM 0 HH12 ARG A 92 7.533 11.538 12.178 1.00 3.96 H new ATOM 0 HH21 ARG A 92 10.612 12.910 11.156 1.00 4.39 H new ATOM 0 HH22 ARG A 92 9.490 12.673 12.500 1.00 4.39 H new ATOM 1429 N THR A 93 6.174 10.773 5.429 1.00 0.94 N ATOM 1430 CA THR A 93 6.732 10.950 4.095 1.00 0.91 C ATOM 1431 C THR A 93 6.288 9.824 3.186 1.00 0.83 C ATOM 1432 O THR A 93 5.888 10.057 2.049 1.00 1.08 O ATOM 1433 CB THR A 93 8.262 11.037 4.141 1.00 1.02 C ATOM 1434 OG1 THR A 93 8.679 12.076 5.008 1.00 1.52 O ATOM 1435 CG2 THR A 93 8.889 11.294 2.789 1.00 1.47 C ATOM 0 H THR A 93 5.397 11.401 5.635 1.00 0.94 H new ATOM 0 HA THR A 93 6.358 11.891 3.693 1.00 0.91 H new ATOM 0 HB THR A 93 8.594 10.063 4.500 1.00 1.02 H new ATOM 0 HG1 THR A 93 9.334 12.642 4.549 1.00 1.52 H new ATOM 0 HG21 THR A 93 9.973 11.344 2.894 1.00 1.47 H new ATOM 0 HG22 THR A 93 8.627 10.485 2.107 1.00 1.47 H new ATOM 0 HG23 THR A 93 8.519 12.239 2.390 1.00 1.47 H new ATOM 1443 N LEU A 94 6.335 8.600 3.697 1.00 0.68 N ATOM 1444 CA LEU A 94 5.898 7.459 2.912 1.00 0.64 C ATOM 1445 C LEU A 94 5.897 6.173 3.729 1.00 0.56 C ATOM 1446 O LEU A 94 6.533 6.082 4.781 1.00 0.71 O ATOM 1447 CB LEU A 94 6.759 7.280 1.653 1.00 0.72 C ATOM 1448 CG LEU A 94 8.212 6.863 1.888 1.00 1.00 C ATOM 1449 CD1 LEU A 94 8.892 6.554 0.565 1.00 1.44 C ATOM 1450 CD2 LEU A 94 8.974 7.952 2.627 1.00 1.87 C ATOM 0 H LEU A 94 6.666 8.376 4.636 1.00 0.68 H new ATOM 0 HA LEU A 94 4.873 7.667 2.606 1.00 0.64 H new ATOM 0 HB2 LEU A 94 6.286 6.532 1.017 1.00 0.72 H new ATOM 0 HB3 LEU A 94 6.756 8.218 1.099 1.00 0.72 H new ATOM 0 HG LEU A 94 8.213 5.964 2.504 1.00 1.00 H new ATOM 0 HD11 LEU A 94 9.925 6.259 0.747 1.00 1.44 H new ATOM 0 HD12 LEU A 94 8.365 5.741 0.066 1.00 1.44 H new ATOM 0 HD13 LEU A 94 8.874 7.441 -0.069 1.00 1.44 H new ATOM 0 HD21 LEU A 94 10.005 7.633 2.783 1.00 1.87 H new ATOM 0 HD22 LEU A 94 8.963 8.868 2.037 1.00 1.87 H new ATOM 0 HD23 LEU A 94 8.501 8.136 3.592 1.00 1.87 H new ATOM 1462 N ASP A 95 5.165 5.185 3.228 1.00 0.52 N ATOM 1463 CA ASP A 95 5.044 3.886 3.876 1.00 0.53 C ATOM 1464 C ASP A 95 4.375 2.894 2.932 1.00 0.46 C ATOM 1465 O ASP A 95 3.151 2.756 2.926 1.00 0.59 O ATOM 1466 CB ASP A 95 4.238 4.014 5.174 1.00 0.73 C ATOM 1467 CG ASP A 95 4.069 2.688 5.895 1.00 1.16 C ATOM 1468 OD1 ASP A 95 3.424 1.779 5.333 1.00 1.64 O ATOM 1469 OD2 ASP A 95 4.582 2.559 7.027 1.00 1.72 O ATOM 0 H ASP A 95 4.637 5.263 2.359 1.00 0.52 H new ATOM 0 HA ASP A 95 6.041 3.519 4.122 1.00 0.53 H new ATOM 0 HB2 ASP A 95 4.735 4.722 5.837 1.00 0.73 H new ATOM 0 HB3 ASP A 95 3.255 4.427 4.947 1.00 0.73 H new ATOM 1474 N LEU A 96 5.182 2.215 2.122 1.00 0.38 N ATOM 1475 CA LEU A 96 4.655 1.248 1.165 1.00 0.36 C ATOM 1476 C LEU A 96 4.863 -0.185 1.659 1.00 0.40 C ATOM 1477 O LEU A 96 5.974 -0.714 1.637 1.00 0.53 O ATOM 1478 CB LEU A 96 5.290 1.446 -0.226 1.00 0.43 C ATOM 1479 CG LEU A 96 6.785 1.131 -0.345 1.00 0.52 C ATOM 1480 CD1 LEU A 96 7.209 1.139 -1.805 1.00 0.97 C ATOM 1481 CD2 LEU A 96 7.616 2.129 0.447 1.00 0.89 C ATOM 0 H LEU A 96 6.197 2.315 2.109 1.00 0.38 H new ATOM 0 HA LEU A 96 3.582 1.420 1.075 1.00 0.36 H new ATOM 0 HB2 LEU A 96 4.752 0.822 -0.939 1.00 0.43 H new ATOM 0 HB3 LEU A 96 5.134 2.482 -0.528 1.00 0.43 H new ATOM 0 HG LEU A 96 6.957 0.138 0.070 1.00 0.52 H new ATOM 0 HD11 LEU A 96 8.273 0.914 -1.876 1.00 0.97 H new ATOM 0 HD12 LEU A 96 6.642 0.387 -2.353 1.00 0.97 H new ATOM 0 HD13 LEU A 96 7.017 2.122 -2.234 1.00 0.97 H new ATOM 0 HD21 LEU A 96 8.673 1.883 0.346 1.00 0.89 H new ATOM 0 HD22 LEU A 96 7.439 3.134 0.065 1.00 0.89 H new ATOM 0 HD23 LEU A 96 7.332 2.085 1.498 1.00 0.89 H new ATOM 1493 N ASP A 97 3.777 -0.805 2.114 1.00 0.38 N ATOM 1494 CA ASP A 97 3.826 -2.174 2.619 1.00 0.44 C ATOM 1495 C ASP A 97 2.752 -3.031 1.959 1.00 0.39 C ATOM 1496 O ASP A 97 1.694 -2.528 1.582 1.00 0.40 O ATOM 1497 CB ASP A 97 3.633 -2.194 4.138 1.00 0.55 C ATOM 1498 CG ASP A 97 4.727 -1.447 4.876 1.00 1.14 C ATOM 1499 OD1 ASP A 97 4.929 -0.249 4.586 1.00 1.45 O ATOM 1500 OD2 ASP A 97 5.377 -2.057 5.750 1.00 1.93 O ATOM 0 H ASP A 97 2.850 -0.380 2.143 1.00 0.38 H new ATOM 0 HA ASP A 97 4.806 -2.585 2.377 1.00 0.44 H new ATOM 0 HB2 ASP A 97 2.667 -1.752 4.383 1.00 0.55 H new ATOM 0 HB3 ASP A 97 3.607 -3.227 4.483 1.00 0.55 H new ATOM 1505 N ILE A 98 3.027 -4.324 1.827 1.00 0.39 N ATOM 1506 CA ILE A 98 2.072 -5.240 1.217 1.00 0.36 C ATOM 1507 C ILE A 98 0.789 -5.318 2.031 1.00 0.35 C ATOM 1508 O ILE A 98 0.804 -5.660 3.214 1.00 0.53 O ATOM 1509 CB ILE A 98 2.660 -6.660 1.034 1.00 0.36 C ATOM 1510 CG1 ILE A 98 3.563 -6.708 -0.196 1.00 0.48 C ATOM 1511 CG2 ILE A 98 1.552 -7.701 0.919 1.00 0.44 C ATOM 1512 CD1 ILE A 98 2.907 -6.181 -1.457 1.00 1.20 C ATOM 0 H ILE A 98 3.898 -4.759 2.132 1.00 0.39 H new ATOM 0 HA ILE A 98 1.845 -4.838 0.230 1.00 0.36 H new ATOM 0 HB ILE A 98 3.256 -6.895 1.916 1.00 0.36 H new ATOM 0 HG12 ILE A 98 4.464 -6.128 0.003 1.00 0.48 H new ATOM 0 HG13 ILE A 98 3.878 -7.738 -0.364 1.00 0.48 H new ATOM 0 HG21 ILE A 98 1.993 -8.689 0.791 1.00 0.44 H new ATOM 0 HG22 ILE A 98 0.946 -7.689 1.825 1.00 0.44 H new ATOM 0 HG23 ILE A 98 0.924 -7.470 0.059 1.00 0.44 H new ATOM 0 HD11 ILE A 98 3.610 -6.247 -2.288 1.00 1.20 H new ATOM 0 HD12 ILE A 98 2.022 -6.776 -1.682 1.00 1.20 H new ATOM 0 HD13 ILE A 98 2.617 -5.141 -1.309 1.00 1.20 H new ATOM 1524 N MET A 99 -0.324 -5.007 1.376 1.00 0.32 N ATOM 1525 CA MET A 99 -1.631 -5.045 2.017 1.00 0.36 C ATOM 1526 C MET A 99 -2.465 -6.172 1.423 1.00 0.33 C ATOM 1527 O MET A 99 -3.405 -6.665 2.044 1.00 0.37 O ATOM 1528 CB MET A 99 -2.346 -3.704 1.845 1.00 0.43 C ATOM 1529 CG MET A 99 -1.503 -2.516 2.278 1.00 0.68 C ATOM 1530 SD MET A 99 -0.906 -2.667 3.974 1.00 1.56 S ATOM 1531 CE MET A 99 0.116 -1.204 4.106 1.00 2.37 C ATOM 0 H MET A 99 -0.346 -4.724 0.396 1.00 0.32 H new ATOM 0 HA MET A 99 -1.498 -5.229 3.083 1.00 0.36 H new ATOM 0 HB2 MET A 99 -2.626 -3.580 0.799 1.00 0.43 H new ATOM 0 HB3 MET A 99 -3.270 -3.716 2.423 1.00 0.43 H new ATOM 0 HG2 MET A 99 -0.651 -2.415 1.605 1.00 0.68 H new ATOM 0 HG3 MET A 99 -2.093 -1.604 2.185 1.00 0.68 H new ATOM 0 HE1 MET A 99 0.571 -1.166 5.096 1.00 2.37 H new ATOM 0 HE2 MET A 99 0.899 -1.237 3.348 1.00 2.37 H new ATOM 0 HE3 MET A 99 -0.498 -0.316 3.955 1.00 2.37 H new ATOM 1541 N LEU A 100 -2.091 -6.581 0.216 1.00 0.30 N ATOM 1542 CA LEU A 100 -2.772 -7.662 -0.482 1.00 0.30 C ATOM 1543 C LEU A 100 -1.815 -8.323 -1.464 1.00 0.31 C ATOM 1544 O LEU A 100 -1.128 -7.643 -2.222 1.00 0.58 O ATOM 1545 CB LEU A 100 -4.022 -7.146 -1.205 1.00 0.30 C ATOM 1546 CG LEU A 100 -5.344 -7.670 -0.643 1.00 0.37 C ATOM 1547 CD1 LEU A 100 -6.525 -7.049 -1.370 1.00 0.40 C ATOM 1548 CD2 LEU A 100 -5.395 -9.188 -0.741 1.00 0.43 C ATOM 0 H LEU A 100 -1.312 -6.175 -0.302 1.00 0.30 H new ATOM 0 HA LEU A 100 -3.095 -8.402 0.250 1.00 0.30 H new ATOM 0 HB2 LEU A 100 -4.029 -6.057 -1.159 1.00 0.30 H new ATOM 0 HB3 LEU A 100 -3.956 -7.420 -2.258 1.00 0.30 H new ATOM 0 HG LEU A 100 -5.406 -7.386 0.408 1.00 0.37 H new ATOM 0 HD11 LEU A 100 -7.454 -7.437 -0.953 1.00 0.40 H new ATOM 0 HD12 LEU A 100 -6.498 -5.966 -1.250 1.00 0.40 H new ATOM 0 HD13 LEU A 100 -6.472 -7.298 -2.430 1.00 0.40 H new ATOM 0 HD21 LEU A 100 -6.342 -9.547 -0.337 1.00 0.43 H new ATOM 0 HD22 LEU A 100 -5.309 -9.488 -1.785 1.00 0.43 H new ATOM 0 HD23 LEU A 100 -4.571 -9.617 -0.171 1.00 0.43 H new ATOM 1560 N PHE A 101 -1.755 -9.648 -1.429 1.00 0.36 N ATOM 1561 CA PHE A 101 -0.860 -10.385 -2.309 1.00 0.36 C ATOM 1562 C PHE A 101 -1.486 -11.708 -2.737 1.00 0.38 C ATOM 1563 O PHE A 101 -1.262 -12.742 -2.108 1.00 0.88 O ATOM 1564 CB PHE A 101 0.472 -10.647 -1.603 1.00 0.46 C ATOM 1565 CG PHE A 101 1.551 -11.128 -2.528 1.00 0.70 C ATOM 1566 CD1 PHE A 101 2.190 -10.246 -3.388 1.00 1.13 C ATOM 1567 CD2 PHE A 101 1.928 -12.458 -2.538 1.00 1.10 C ATOM 1568 CE1 PHE A 101 3.183 -10.687 -4.242 1.00 1.59 C ATOM 1569 CE2 PHE A 101 2.919 -12.905 -3.390 1.00 1.59 C ATOM 1570 CZ PHE A 101 3.548 -12.019 -4.244 1.00 1.75 C ATOM 0 H PHE A 101 -2.312 -10.231 -0.804 1.00 0.36 H new ATOM 0 HA PHE A 101 -0.684 -9.781 -3.199 1.00 0.36 H new ATOM 0 HB2 PHE A 101 0.803 -9.730 -1.116 1.00 0.46 H new ATOM 0 HB3 PHE A 101 0.319 -11.388 -0.818 1.00 0.46 H new ATOM 0 HD1 PHE A 101 1.908 -9.203 -3.390 1.00 1.13 H new ATOM 0 HD2 PHE A 101 1.442 -13.156 -1.872 1.00 1.10 H new ATOM 0 HE1 PHE A 101 3.673 -9.991 -4.907 1.00 1.59 H new ATOM 0 HE2 PHE A 101 3.202 -13.947 -3.389 1.00 1.59 H new ATOM 0 HZ PHE A 101 4.323 -12.367 -4.911 1.00 1.75 H new ATOM 1580 N GLY A 102 -2.272 -11.668 -3.811 1.00 0.58 N ATOM 1581 CA GLY A 102 -2.917 -12.870 -4.301 1.00 0.60 C ATOM 1582 C GLY A 102 -3.822 -13.497 -3.260 1.00 0.73 C ATOM 1583 O GLY A 102 -4.970 -13.081 -3.096 1.00 1.49 O ATOM 0 H GLY A 102 -2.472 -10.824 -4.348 1.00 0.58 H new ATOM 0 HA2 GLY A 102 -3.500 -12.631 -5.191 1.00 0.60 H new ATOM 0 HA3 GLY A 102 -2.157 -13.591 -4.602 1.00 0.60 H new ATOM 1587 N ASN A 103 -3.303 -14.494 -2.547 1.00 0.56 N ATOM 1588 CA ASN A 103 -4.073 -15.170 -1.510 1.00 0.58 C ATOM 1589 C ASN A 103 -3.189 -16.097 -0.676 1.00 0.52 C ATOM 1590 O ASN A 103 -3.692 -16.984 0.015 1.00 0.67 O ATOM 1591 CB ASN A 103 -5.232 -15.961 -2.129 1.00 0.76 C ATOM 1592 CG ASN A 103 -4.776 -17.068 -3.066 1.00 0.85 C ATOM 1593 OD1 ASN A 103 -5.601 -17.800 -3.615 1.00 1.55 O ATOM 1594 ND2 ASN A 103 -3.469 -17.200 -3.260 1.00 0.90 N ATOM 0 H ASN A 103 -2.355 -14.850 -2.669 1.00 0.56 H new ATOM 0 HA ASN A 103 -4.480 -14.405 -0.849 1.00 0.58 H new ATOM 0 HB2 ASN A 103 -5.833 -16.396 -1.330 1.00 0.76 H new ATOM 0 HB3 ASN A 103 -5.878 -15.275 -2.677 1.00 0.76 H new ATOM 0 HD21 ASN A 103 -3.117 -17.927 -3.882 1.00 0.90 H new ATOM 0 HD22 ASN A 103 -2.817 -16.574 -2.787 1.00 0.90 H new ATOM 1601 N GLU A 104 -1.876 -15.889 -0.740 1.00 0.43 N ATOM 1602 CA GLU A 104 -0.943 -16.714 0.018 1.00 0.42 C ATOM 1603 C GLU A 104 -1.023 -16.405 1.498 1.00 0.42 C ATOM 1604 O GLU A 104 -1.732 -15.492 1.918 1.00 0.58 O ATOM 1605 CB GLU A 104 0.490 -16.527 -0.473 1.00 0.51 C ATOM 1606 CG GLU A 104 0.965 -15.080 -0.493 1.00 0.56 C ATOM 1607 CD GLU A 104 1.565 -14.627 0.823 1.00 1.57 C ATOM 1608 OE1 GLU A 104 1.607 -15.436 1.771 1.00 2.29 O ATOM 1609 OE2 GLU A 104 2.003 -13.461 0.901 1.00 2.14 O ATOM 0 H GLU A 104 -1.438 -15.161 -1.305 1.00 0.43 H new ATOM 0 HA GLU A 104 -1.230 -17.754 -0.140 1.00 0.42 H new ATOM 0 HB2 GLU A 104 1.158 -17.107 0.164 1.00 0.51 H new ATOM 0 HB3 GLU A 104 0.573 -16.938 -1.479 1.00 0.51 H new ATOM 0 HG2 GLU A 104 1.706 -14.959 -1.283 1.00 0.56 H new ATOM 0 HG3 GLU A 104 0.125 -14.433 -0.743 1.00 0.56 H new ATOM 1616 N VAL A 105 -0.293 -17.183 2.280 1.00 0.50 N ATOM 1617 CA VAL A 105 -0.270 -17.015 3.720 1.00 0.56 C ATOM 1618 C VAL A 105 1.083 -17.435 4.294 1.00 0.61 C ATOM 1619 O VAL A 105 1.267 -18.572 4.731 1.00 0.72 O ATOM 1620 CB VAL A 105 -1.398 -17.839 4.369 1.00 0.66 C ATOM 1621 CG1 VAL A 105 -1.244 -17.894 5.882 1.00 0.80 C ATOM 1622 CG2 VAL A 105 -2.758 -17.267 3.997 1.00 0.67 C ATOM 0 H VAL A 105 0.295 -17.942 1.936 1.00 0.50 H new ATOM 0 HA VAL A 105 -0.426 -15.960 3.944 1.00 0.56 H new ATOM 0 HB VAL A 105 -1.328 -18.857 3.987 1.00 0.66 H new ATOM 0 HG11 VAL A 105 -2.056 -18.483 6.309 1.00 0.80 H new ATOM 0 HG12 VAL A 105 -0.289 -18.356 6.134 1.00 0.80 H new ATOM 0 HG13 VAL A 105 -1.277 -16.883 6.288 1.00 0.80 H new ATOM 0 HG21 VAL A 105 -3.543 -17.862 4.464 1.00 0.67 H new ATOM 0 HG22 VAL A 105 -2.827 -16.237 4.346 1.00 0.67 H new ATOM 0 HG23 VAL A 105 -2.880 -17.292 2.914 1.00 0.67 H new ATOM 1632 N ILE A 106 2.029 -16.501 4.281 1.00 0.58 N ATOM 1633 CA ILE A 106 3.369 -16.755 4.796 1.00 0.64 C ATOM 1634 C ILE A 106 3.835 -15.587 5.656 1.00 0.61 C ATOM 1635 O ILE A 106 3.908 -14.451 5.191 1.00 0.57 O ATOM 1636 CB ILE A 106 4.403 -16.992 3.668 1.00 0.74 C ATOM 1637 CG1 ILE A 106 4.100 -18.284 2.901 1.00 0.76 C ATOM 1638 CG2 ILE A 106 5.815 -17.038 4.239 1.00 1.31 C ATOM 1639 CD1 ILE A 106 2.954 -18.162 1.919 1.00 1.45 C ATOM 0 H ILE A 106 1.891 -15.558 3.918 1.00 0.58 H new ATOM 0 HA ILE A 106 3.306 -17.665 5.393 1.00 0.64 H new ATOM 0 HB ILE A 106 4.332 -16.158 2.970 1.00 0.74 H new ATOM 0 HG12 ILE A 106 4.996 -18.593 2.362 1.00 0.76 H new ATOM 0 HG13 ILE A 106 3.870 -19.074 3.616 1.00 0.76 H new ATOM 0 HG21 ILE A 106 6.528 -17.205 3.432 1.00 1.31 H new ATOM 0 HG22 ILE A 106 6.039 -16.092 4.731 1.00 1.31 H new ATOM 0 HG23 ILE A 106 5.889 -17.850 4.963 1.00 1.31 H new ATOM 0 HD11 ILE A 106 2.802 -19.117 1.417 1.00 1.45 H new ATOM 0 HD12 ILE A 106 2.045 -17.884 2.453 1.00 1.45 H new ATOM 0 HD13 ILE A 106 3.189 -17.396 1.179 1.00 1.45 H new ATOM 1651 N ASN A 107 4.153 -15.874 6.910 1.00 0.84 N ATOM 1652 CA ASN A 107 4.619 -14.851 7.838 1.00 0.90 C ATOM 1653 C ASN A 107 6.101 -15.042 8.131 1.00 0.91 C ATOM 1654 O ASN A 107 6.490 -15.984 8.822 1.00 1.02 O ATOM 1655 CB ASN A 107 3.820 -14.906 9.144 1.00 1.09 C ATOM 1656 CG ASN A 107 2.335 -14.630 8.954 1.00 1.00 C ATOM 1657 OD1 ASN A 107 1.568 -14.651 9.915 1.00 1.28 O ATOM 1658 ND2 ASN A 107 1.919 -14.368 7.717 1.00 1.21 N ATOM 0 H ASN A 107 4.097 -16.810 7.310 1.00 0.84 H new ATOM 0 HA ASN A 107 4.470 -13.875 7.376 1.00 0.90 H new ATOM 0 HB2 ASN A 107 3.945 -15.890 9.597 1.00 1.09 H new ATOM 0 HB3 ASN A 107 4.231 -14.179 9.844 1.00 1.09 H new ATOM 0 HD21 ASN A 107 0.933 -14.175 7.541 1.00 1.21 H new ATOM 0 HD22 ASN A 107 2.586 -14.360 6.946 1.00 1.21 H new ATOM 1665 N THR A 108 6.925 -14.152 7.591 1.00 0.86 N ATOM 1666 CA THR A 108 8.369 -14.239 7.793 1.00 0.89 C ATOM 1667 C THR A 108 8.855 -13.220 8.825 1.00 0.91 C ATOM 1668 O THR A 108 8.545 -13.339 10.011 1.00 1.16 O ATOM 1669 CB THR A 108 9.100 -14.053 6.461 1.00 0.90 C ATOM 1670 OG1 THR A 108 8.735 -12.826 5.852 1.00 1.07 O ATOM 1671 CG2 THR A 108 8.818 -15.162 5.470 1.00 0.92 C ATOM 0 H THR A 108 6.623 -13.367 7.014 1.00 0.86 H new ATOM 0 HA THR A 108 8.595 -15.231 8.184 1.00 0.89 H new ATOM 0 HB THR A 108 10.162 -14.066 6.708 1.00 0.90 H new ATOM 0 HG1 THR A 108 9.539 -12.373 5.522 1.00 1.07 H new ATOM 0 HG21 THR A 108 9.365 -14.972 4.546 1.00 0.92 H new ATOM 0 HG22 THR A 108 9.136 -16.116 5.891 1.00 0.92 H new ATOM 0 HG23 THR A 108 7.749 -15.198 5.258 1.00 0.92 H new ATOM 1679 N GLU A 109 9.623 -12.228 8.378 1.00 0.83 N ATOM 1680 CA GLU A 109 10.153 -11.209 9.279 1.00 0.86 C ATOM 1681 C GLU A 109 9.397 -9.894 9.129 1.00 0.73 C ATOM 1682 O GLU A 109 8.587 -9.533 9.983 1.00 0.87 O ATOM 1683 CB GLU A 109 11.642 -10.990 9.006 1.00 0.95 C ATOM 1684 CG GLU A 109 12.485 -12.244 9.186 1.00 1.22 C ATOM 1685 CD GLU A 109 13.953 -12.012 8.881 1.00 1.93 C ATOM 1686 OE1 GLU A 109 14.313 -10.869 8.525 1.00 2.60 O ATOM 1687 OE2 GLU A 109 14.740 -12.972 8.997 1.00 2.37 O ATOM 0 H GLU A 109 9.891 -12.109 7.401 1.00 0.83 H new ATOM 0 HA GLU A 109 10.022 -11.561 10.302 1.00 0.86 H new ATOM 0 HB2 GLU A 109 11.766 -10.622 7.987 1.00 0.95 H new ATOM 0 HB3 GLU A 109 12.015 -10.213 9.673 1.00 0.95 H new ATOM 0 HG2 GLU A 109 12.383 -12.601 10.211 1.00 1.22 H new ATOM 0 HG3 GLU A 109 12.103 -13.030 8.535 1.00 1.22 H new ATOM 1694 N ARG A 110 9.667 -9.181 8.040 1.00 0.63 N ATOM 1695 CA ARG A 110 9.011 -7.904 7.783 1.00 0.64 C ATOM 1696 C ARG A 110 7.823 -8.081 6.847 1.00 0.66 C ATOM 1697 O ARG A 110 6.976 -7.196 6.731 1.00 0.77 O ATOM 1698 CB ARG A 110 10.004 -6.911 7.172 1.00 0.63 C ATOM 1699 CG ARG A 110 11.232 -6.663 8.036 1.00 0.86 C ATOM 1700 CD ARG A 110 12.176 -5.664 7.385 1.00 1.64 C ATOM 1701 NE ARG A 110 13.350 -5.395 8.213 1.00 2.22 N ATOM 1702 CZ ARG A 110 13.295 -4.828 9.416 1.00 2.77 C ATOM 1703 NH1 ARG A 110 12.129 -4.459 9.930 1.00 3.01 N ATOM 1704 NH2 ARG A 110 14.411 -4.627 10.106 1.00 3.68 N ATOM 0 H ARG A 110 10.334 -9.465 7.323 1.00 0.63 H new ATOM 0 HA ARG A 110 8.650 -7.514 8.734 1.00 0.64 H new ATOM 0 HB2 ARG A 110 10.325 -7.284 6.199 1.00 0.63 H new ATOM 0 HB3 ARG A 110 9.495 -5.963 6.998 1.00 0.63 H new ATOM 0 HG2 ARG A 110 10.922 -6.290 9.012 1.00 0.86 H new ATOM 0 HG3 ARG A 110 11.756 -7.604 8.205 1.00 0.86 H new ATOM 0 HD2 ARG A 110 12.497 -6.047 6.416 1.00 1.64 H new ATOM 0 HD3 ARG A 110 11.643 -4.731 7.198 1.00 1.64 H new ATOM 0 HE ARG A 110 14.265 -5.657 7.847 1.00 2.22 H new ATOM 0 HH11 ARG A 110 11.269 -4.609 9.403 1.00 3.01 H new ATOM 0 HH12 ARG A 110 12.093 -4.025 10.852 1.00 3.01 H new ATOM 0 HH21 ARG A 110 15.310 -4.907 9.714 1.00 3.68 H new ATOM 0 HH22 ARG A 110 14.369 -4.193 11.028 1.00 3.68 H new ATOM 1718 N LEU A 111 7.770 -9.225 6.173 1.00 0.62 N ATOM 1719 CA LEU A 111 6.686 -9.507 5.240 1.00 0.63 C ATOM 1720 C LEU A 111 5.400 -9.878 5.964 1.00 0.56 C ATOM 1721 O LEU A 111 5.407 -10.647 6.926 1.00 0.66 O ATOM 1722 CB LEU A 111 7.088 -10.629 4.266 1.00 0.73 C ATOM 1723 CG LEU A 111 5.994 -11.094 3.288 1.00 0.94 C ATOM 1724 CD1 LEU A 111 4.984 -12.000 3.970 1.00 1.15 C ATOM 1725 CD2 LEU A 111 5.282 -9.910 2.654 1.00 1.64 C ATOM 0 H LEU A 111 8.463 -9.969 6.255 1.00 0.62 H new ATOM 0 HA LEU A 111 6.499 -8.594 4.674 1.00 0.63 H new ATOM 0 HB2 LEU A 111 7.946 -10.290 3.686 1.00 0.73 H new ATOM 0 HB3 LEU A 111 7.417 -11.489 4.849 1.00 0.73 H new ATOM 0 HG LEU A 111 6.491 -11.664 2.503 1.00 0.94 H new ATOM 0 HD11 LEU A 111 4.227 -12.309 3.249 1.00 1.15 H new ATOM 0 HD12 LEU A 111 5.492 -12.881 4.362 1.00 1.15 H new ATOM 0 HD13 LEU A 111 4.507 -11.462 4.789 1.00 1.15 H new ATOM 0 HD21 LEU A 111 4.515 -10.271 1.968 1.00 1.64 H new ATOM 0 HD22 LEU A 111 4.817 -9.306 3.433 1.00 1.64 H new ATOM 0 HD23 LEU A 111 6.003 -9.303 2.105 1.00 1.64 H new ATOM 1737 N THR A 112 4.299 -9.337 5.465 1.00 0.46 N ATOM 1738 CA THR A 112 2.983 -9.602 6.008 1.00 0.42 C ATOM 1739 C THR A 112 1.966 -9.716 4.879 1.00 0.39 C ATOM 1740 O THR A 112 1.961 -8.904 3.953 1.00 0.43 O ATOM 1741 CB THR A 112 2.562 -8.489 6.965 1.00 0.45 C ATOM 1742 OG1 THR A 112 3.006 -7.229 6.499 1.00 0.65 O ATOM 1743 CG2 THR A 112 3.065 -8.672 8.381 1.00 0.68 C ATOM 0 H THR A 112 4.297 -8.700 4.669 1.00 0.46 H new ATOM 0 HA THR A 112 3.022 -10.542 6.558 1.00 0.42 H new ATOM 0 HB THR A 112 1.473 -8.537 6.989 1.00 0.45 H new ATOM 0 HG1 THR A 112 2.724 -6.530 7.126 1.00 0.65 H new ATOM 0 HG21 THR A 112 2.724 -7.841 8.999 1.00 0.68 H new ATOM 0 HG22 THR A 112 2.679 -9.607 8.786 1.00 0.68 H new ATOM 0 HG23 THR A 112 4.155 -8.699 8.379 1.00 0.68 H new ATOM 1751 N VAL A 113 1.091 -10.708 4.969 1.00 0.36 N ATOM 1752 CA VAL A 113 0.058 -10.898 3.963 1.00 0.38 C ATOM 1753 C VAL A 113 -1.127 -9.994 4.366 1.00 0.32 C ATOM 1754 O VAL A 113 -1.009 -9.321 5.388 1.00 0.30 O ATOM 1755 CB VAL A 113 -0.325 -12.403 3.869 1.00 0.45 C ATOM 1756 CG1 VAL A 113 -1.581 -12.720 4.661 1.00 1.52 C ATOM 1757 CG2 VAL A 113 -0.457 -12.844 2.420 1.00 1.18 C ATOM 0 H VAL A 113 1.076 -11.391 5.726 1.00 0.36 H new ATOM 0 HA VAL A 113 0.397 -10.617 2.966 1.00 0.38 H new ATOM 0 HB VAL A 113 0.487 -12.973 4.320 1.00 0.45 H new ATOM 0 HG11 VAL A 113 -1.812 -13.781 4.568 1.00 1.52 H new ATOM 0 HG12 VAL A 113 -1.421 -12.474 5.711 1.00 1.52 H new ATOM 0 HG13 VAL A 113 -2.413 -12.132 4.274 1.00 1.52 H new ATOM 0 HG21 VAL A 113 -0.725 -13.900 2.384 1.00 1.18 H new ATOM 0 HG22 VAL A 113 -1.233 -12.256 1.930 1.00 1.18 H new ATOM 0 HG23 VAL A 113 0.492 -12.693 1.906 1.00 1.18 H new ATOM 1767 N PRO A 114 -2.267 -9.919 3.613 1.00 0.35 N ATOM 1768 CA PRO A 114 -3.388 -9.053 3.970 1.00 0.36 C ATOM 1769 C PRO A 114 -3.420 -8.699 5.454 1.00 0.33 C ATOM 1770 O PRO A 114 -3.902 -9.468 6.288 1.00 0.35 O ATOM 1771 CB PRO A 114 -4.571 -9.911 3.557 1.00 0.43 C ATOM 1772 CG PRO A 114 -4.101 -10.592 2.306 1.00 0.46 C ATOM 1773 CD PRO A 114 -2.582 -10.636 2.365 1.00 0.42 C ATOM 0 HA PRO A 114 -3.354 -8.076 3.488 1.00 0.36 H new ATOM 0 HB2 PRO A 114 -4.831 -10.633 4.331 1.00 0.43 H new ATOM 0 HB3 PRO A 114 -5.459 -9.306 3.374 1.00 0.43 H new ATOM 0 HG2 PRO A 114 -4.513 -11.599 2.237 1.00 0.46 H new ATOM 0 HG3 PRO A 114 -4.437 -10.049 1.422 1.00 0.46 H new ATOM 0 HD2 PRO A 114 -2.210 -11.660 2.386 1.00 0.42 H new ATOM 0 HD3 PRO A 114 -2.132 -10.151 1.499 1.00 0.42 H new ATOM 1781 N HIS A 115 -2.870 -7.526 5.764 1.00 0.33 N ATOM 1782 CA HIS A 115 -2.781 -7.035 7.127 1.00 0.33 C ATOM 1783 C HIS A 115 -4.133 -6.555 7.627 1.00 0.34 C ATOM 1784 O HIS A 115 -4.719 -5.638 7.055 1.00 0.46 O ATOM 1785 CB HIS A 115 -1.773 -5.883 7.174 1.00 0.39 C ATOM 1786 CG HIS A 115 -1.483 -5.358 8.545 1.00 0.44 C ATOM 1787 ND1 HIS A 115 -2.464 -4.957 9.429 1.00 0.97 N ATOM 1788 CD2 HIS A 115 -0.303 -5.144 9.177 1.00 0.76 C ATOM 1789 CE1 HIS A 115 -1.901 -4.520 10.542 1.00 0.87 C ATOM 1790 NE2 HIS A 115 -0.591 -4.625 10.414 1.00 0.67 N ATOM 0 H HIS A 115 -2.474 -6.892 5.070 1.00 0.33 H new ATOM 0 HA HIS A 115 -2.454 -7.849 7.773 1.00 0.33 H new ATOM 0 HB2 HIS A 115 -0.839 -6.218 6.723 1.00 0.39 H new ATOM 0 HB3 HIS A 115 -2.148 -5.065 6.559 1.00 0.39 H new ATOM 0 HD2 HIS A 115 0.681 -5.345 8.780 1.00 0.76 H new ATOM 0 HE1 HIS A 115 -2.423 -4.142 11.408 1.00 0.87 H new ATOM 0 HE2 HIS A 115 0.096 -4.363 11.121 1.00 0.67 H new ATOM 1799 N TYR A 116 -4.609 -7.163 8.711 1.00 0.34 N ATOM 1800 CA TYR A 116 -5.881 -6.769 9.302 1.00 0.42 C ATOM 1801 C TYR A 116 -5.866 -5.271 9.583 1.00 0.43 C ATOM 1802 O TYR A 116 -5.419 -4.831 10.640 1.00 0.49 O ATOM 1803 CB TYR A 116 -6.147 -7.565 10.588 1.00 0.52 C ATOM 1804 CG TYR A 116 -4.897 -7.992 11.339 1.00 0.70 C ATOM 1805 CD1 TYR A 116 -3.851 -7.099 11.534 1.00 1.13 C ATOM 1806 CD2 TYR A 116 -4.756 -9.279 11.851 1.00 0.89 C ATOM 1807 CE1 TYR A 116 -2.706 -7.472 12.212 1.00 1.64 C ATOM 1808 CE2 TYR A 116 -3.615 -9.659 12.531 1.00 1.31 C ATOM 1809 CZ TYR A 116 -2.617 -8.801 12.722 1.00 1.68 C ATOM 1810 OH TYR A 116 -1.455 -9.126 13.386 1.00 2.22 O ATOM 0 H TYR A 116 -4.135 -7.926 9.194 1.00 0.34 H new ATOM 0 HA TYR A 116 -6.687 -6.989 8.602 1.00 0.42 H new ATOM 0 HB2 TYR A 116 -6.765 -6.961 11.252 1.00 0.52 H new ATOM 0 HB3 TYR A 116 -6.725 -8.454 10.336 1.00 0.52 H new ATOM 0 HD1 TYR A 116 -3.934 -6.094 11.148 1.00 1.13 H new ATOM 0 HD2 TYR A 116 -5.554 -9.994 11.714 1.00 0.89 H new ATOM 0 HE1 TYR A 116 -1.896 -6.772 12.353 1.00 1.64 H new ATOM 0 HE2 TYR A 116 -3.532 -10.666 12.912 1.00 1.31 H new ATOM 0 HH TYR A 116 -1.502 -10.056 13.692 1.00 2.22 H new ATOM 1820 N ASP A 117 -6.328 -4.494 8.605 1.00 0.42 N ATOM 1821 CA ASP A 117 -6.332 -3.044 8.719 1.00 0.50 C ATOM 1822 C ASP A 117 -6.974 -2.415 7.488 1.00 0.52 C ATOM 1823 O ASP A 117 -7.872 -1.578 7.590 1.00 0.73 O ATOM 1824 CB ASP A 117 -4.890 -2.545 8.837 1.00 0.52 C ATOM 1825 CG ASP A 117 -4.798 -1.151 9.426 1.00 0.67 C ATOM 1826 OD1 ASP A 117 -5.855 -0.573 9.756 1.00 1.07 O ATOM 1827 OD2 ASP A 117 -3.667 -0.637 9.559 1.00 0.87 O ATOM 0 H ASP A 117 -6.704 -4.849 7.726 1.00 0.42 H new ATOM 0 HA ASP A 117 -6.904 -2.762 9.603 1.00 0.50 H new ATOM 0 HB2 ASP A 117 -4.321 -3.236 9.459 1.00 0.52 H new ATOM 0 HB3 ASP A 117 -4.427 -2.549 7.850 1.00 0.52 H new ATOM 1832 N MET A 118 -6.479 -2.824 6.329 1.00 0.38 N ATOM 1833 CA MET A 118 -6.948 -2.323 5.040 1.00 0.39 C ATOM 1834 C MET A 118 -8.464 -2.331 4.922 1.00 0.38 C ATOM 1835 O MET A 118 -9.063 -1.385 4.415 1.00 0.45 O ATOM 1836 CB MET A 118 -6.366 -3.182 3.920 1.00 0.44 C ATOM 1837 CG MET A 118 -6.767 -4.646 3.999 1.00 0.48 C ATOM 1838 SD MET A 118 -6.118 -5.620 2.628 1.00 1.29 S ATOM 1839 CE MET A 118 -6.876 -4.785 1.236 1.00 2.05 C ATOM 0 H MET A 118 -5.735 -3.518 6.253 1.00 0.38 H new ATOM 0 HA MET A 118 -6.614 -1.289 4.959 1.00 0.39 H new ATOM 0 HB2 MET A 118 -6.688 -2.778 2.960 1.00 0.44 H new ATOM 0 HB3 MET A 118 -5.279 -3.111 3.947 1.00 0.44 H new ATOM 0 HG2 MET A 118 -6.409 -5.066 4.939 1.00 0.48 H new ATOM 0 HG3 MET A 118 -7.854 -4.721 4.010 1.00 0.48 H new ATOM 0 HE1 MET A 118 -7.543 -5.474 0.718 1.00 2.05 H new ATOM 0 HE2 MET A 118 -7.446 -3.927 1.593 1.00 2.05 H new ATOM 0 HE3 MET A 118 -6.101 -4.445 0.549 1.00 2.05 H new ATOM 1849 N LYS A 119 -9.067 -3.418 5.361 1.00 0.40 N ATOM 1850 CA LYS A 119 -10.505 -3.589 5.279 1.00 0.47 C ATOM 1851 C LYS A 119 -11.250 -2.580 6.143 1.00 0.50 C ATOM 1852 O LYS A 119 -12.241 -1.998 5.709 1.00 0.80 O ATOM 1853 CB LYS A 119 -10.854 -5.015 5.673 1.00 0.57 C ATOM 1854 CG LYS A 119 -10.160 -5.463 6.948 1.00 0.69 C ATOM 1855 CD LYS A 119 -10.521 -6.894 7.318 1.00 0.80 C ATOM 1856 CE LYS A 119 -10.010 -7.888 6.285 1.00 1.02 C ATOM 1857 NZ LYS A 119 -8.529 -7.835 6.147 1.00 1.93 N ATOM 0 H LYS A 119 -8.576 -4.206 5.784 1.00 0.40 H new ATOM 0 HA LYS A 119 -10.822 -3.406 4.252 1.00 0.47 H new ATOM 0 HB2 LYS A 119 -11.933 -5.096 5.805 1.00 0.57 H new ATOM 0 HB3 LYS A 119 -10.580 -5.688 4.861 1.00 0.57 H new ATOM 0 HG2 LYS A 119 -9.080 -5.382 6.821 1.00 0.69 H new ATOM 0 HG3 LYS A 119 -10.436 -4.796 7.765 1.00 0.69 H new ATOM 0 HD2 LYS A 119 -10.100 -7.135 8.294 1.00 0.80 H new ATOM 0 HD3 LYS A 119 -11.604 -6.985 7.406 1.00 0.80 H new ATOM 0 HE2 LYS A 119 -10.312 -8.896 6.571 1.00 1.02 H new ATOM 0 HE3 LYS A 119 -10.472 -7.678 5.320 1.00 1.02 H new ATOM 0 HZ1 LYS A 119 -8.196 -8.687 5.653 1.00 1.93 H new ATOM 0 HZ2 LYS A 119 -8.261 -6.991 5.601 1.00 1.93 H new ATOM 0 HZ3 LYS A 119 -8.094 -7.789 7.090 1.00 1.93 H new ATOM 1871 N ASN A 120 -10.767 -2.367 7.359 1.00 0.49 N ATOM 1872 CA ASN A 120 -11.401 -1.415 8.258 1.00 0.52 C ATOM 1873 C ASN A 120 -10.908 -0.001 7.967 1.00 0.56 C ATOM 1874 O ASN A 120 -10.842 0.843 8.860 1.00 0.74 O ATOM 1875 CB ASN A 120 -11.130 -1.801 9.715 1.00 0.53 C ATOM 1876 CG ASN A 120 -9.667 -1.722 10.100 1.00 1.17 C ATOM 1877 OD1 ASN A 120 -9.009 -0.699 9.913 1.00 2.11 O ATOM 1878 ND2 ASN A 120 -9.156 -2.810 10.660 1.00 1.30 N ATOM 0 H ASN A 120 -9.946 -2.836 7.742 1.00 0.49 H new ATOM 0 HA ASN A 120 -12.478 -1.439 8.094 1.00 0.52 H new ATOM 0 HB2 ASN A 120 -11.705 -1.146 10.369 1.00 0.53 H new ATOM 0 HB3 ASN A 120 -11.488 -2.816 9.886 1.00 0.53 H new ATOM 0 HD21 ASN A 120 -8.180 -2.821 10.955 1.00 1.30 H new ATOM 0 HD22 ASN A 120 -9.739 -3.636 10.795 1.00 1.30 H new ATOM 1885 N ARG A 121 -10.564 0.243 6.699 1.00 0.49 N ATOM 1886 CA ARG A 121 -10.067 1.546 6.263 1.00 0.58 C ATOM 1887 C ARG A 121 -10.390 1.784 4.787 1.00 0.63 C ATOM 1888 O ARG A 121 -10.489 0.839 4.004 1.00 1.07 O ATOM 1889 CB ARG A 121 -8.548 1.628 6.453 1.00 0.64 C ATOM 1890 CG ARG A 121 -8.082 1.470 7.892 1.00 0.91 C ATOM 1891 CD ARG A 121 -8.415 2.695 8.733 1.00 1.24 C ATOM 1892 NE ARG A 121 -7.977 2.543 10.116 1.00 1.84 N ATOM 1893 CZ ARG A 121 -8.191 3.452 11.061 1.00 2.55 C ATOM 1894 NH1 ARG A 121 -8.837 4.574 10.774 1.00 2.86 N ATOM 1895 NH2 ARG A 121 -7.760 3.239 12.297 1.00 3.50 N ATOM 0 H ARG A 121 -10.622 -0.451 5.954 1.00 0.49 H new ATOM 0 HA ARG A 121 -10.558 2.308 6.869 1.00 0.58 H new ATOM 0 HB2 ARG A 121 -8.077 0.856 5.845 1.00 0.64 H new ATOM 0 HB3 ARG A 121 -8.199 2.589 6.075 1.00 0.64 H new ATOM 0 HG2 ARG A 121 -8.551 0.589 8.331 1.00 0.91 H new ATOM 0 HG3 ARG A 121 -7.006 1.300 7.909 1.00 0.91 H new ATOM 0 HD2 ARG A 121 -7.941 3.574 8.297 1.00 1.24 H new ATOM 0 HD3 ARG A 121 -9.491 2.869 8.710 1.00 1.24 H new ATOM 0 HE ARG A 121 -7.478 1.691 10.372 1.00 1.84 H new ATOM 0 HH11 ARG A 121 -9.171 4.741 9.825 1.00 2.86 H new ATOM 0 HH12 ARG A 121 -8.999 5.270 11.502 1.00 2.86 H new ATOM 0 HH21 ARG A 121 -7.264 2.377 12.523 1.00 3.50 H new ATOM 0 HH22 ARG A 121 -7.925 3.937 13.022 1.00 3.50 H new ATOM 1909 N GLY A 122 -10.524 3.052 4.411 1.00 0.62 N ATOM 1910 CA GLY A 122 -10.799 3.396 3.026 1.00 0.61 C ATOM 1911 C GLY A 122 -9.533 3.773 2.296 1.00 0.56 C ATOM 1912 O GLY A 122 -9.561 4.153 1.129 1.00 0.70 O ATOM 0 H GLY A 122 -10.447 3.850 5.042 1.00 0.62 H new ATOM 0 HA2 GLY A 122 -11.273 2.551 2.526 1.00 0.61 H new ATOM 0 HA3 GLY A 122 -11.505 4.226 2.988 1.00 0.61 H new ATOM 1916 N PHE A 123 -8.417 3.660 3.009 1.00 0.52 N ATOM 1917 CA PHE A 123 -7.104 3.983 2.473 1.00 0.58 C ATOM 1918 C PHE A 123 -6.547 2.839 1.635 1.00 0.42 C ATOM 1919 O PHE A 123 -6.005 3.053 0.553 1.00 0.43 O ATOM 1920 CB PHE A 123 -6.154 4.302 3.635 1.00 0.84 C ATOM 1921 CG PHE A 123 -4.690 4.277 3.281 1.00 1.19 C ATOM 1922 CD1 PHE A 123 -4.227 4.979 2.180 1.00 2.11 C ATOM 1923 CD2 PHE A 123 -3.781 3.557 4.041 1.00 1.62 C ATOM 1924 CE1 PHE A 123 -2.889 4.963 1.840 1.00 3.16 C ATOM 1925 CE2 PHE A 123 -2.442 3.539 3.705 1.00 2.59 C ATOM 1926 CZ PHE A 123 -1.983 4.217 2.654 1.00 3.31 C ATOM 0 H PHE A 123 -8.400 3.341 3.978 1.00 0.52 H new ATOM 0 HA PHE A 123 -7.197 4.851 1.820 1.00 0.58 H new ATOM 0 HB2 PHE A 123 -6.401 5.288 4.027 1.00 0.84 H new ATOM 0 HB3 PHE A 123 -6.331 3.586 4.437 1.00 0.84 H new ATOM 0 HD1 PHE A 123 -4.922 5.547 1.579 1.00 2.11 H new ATOM 0 HD2 PHE A 123 -4.124 3.005 4.904 1.00 1.62 H new ATOM 0 HE1 PHE A 123 -2.534 5.504 0.975 1.00 3.16 H new ATOM 0 HE2 PHE A 123 -1.753 2.964 4.306 1.00 2.59 H new ATOM 0 HZ PHE A 123 -0.929 4.203 2.418 1.00 3.31 H new ATOM 1936 N MET A 124 -6.657 1.631 2.160 1.00 0.37 N ATOM 1937 CA MET A 124 -6.137 0.453 1.478 1.00 0.38 C ATOM 1938 C MET A 124 -7.164 -0.207 0.550 1.00 0.38 C ATOM 1939 O MET A 124 -6.787 -0.893 -0.395 1.00 0.57 O ATOM 1940 CB MET A 124 -5.621 -0.548 2.505 1.00 0.50 C ATOM 1941 CG MET A 124 -4.559 0.043 3.425 1.00 0.90 C ATOM 1942 SD MET A 124 -3.889 -1.154 4.596 1.00 1.99 S ATOM 1943 CE MET A 124 -2.773 -0.117 5.538 1.00 2.44 C ATOM 0 H MET A 124 -7.102 1.437 3.057 1.00 0.37 H new ATOM 0 HA MET A 124 -5.318 0.785 0.839 1.00 0.38 H new ATOM 0 HB2 MET A 124 -6.456 -0.908 3.106 1.00 0.50 H new ATOM 0 HB3 MET A 124 -5.206 -1.412 1.986 1.00 0.50 H new ATOM 0 HG2 MET A 124 -3.746 0.444 2.820 1.00 0.90 H new ATOM 0 HG3 MET A 124 -4.989 0.879 3.976 1.00 0.90 H new ATOM 0 HE1 MET A 124 -1.975 -0.729 5.958 1.00 2.44 H new ATOM 0 HE2 MET A 124 -2.343 0.642 4.885 1.00 2.44 H new ATOM 0 HE3 MET A 124 -3.321 0.368 6.345 1.00 2.44 H new ATOM 1953 N LEU A 125 -8.451 -0.024 0.833 1.00 0.37 N ATOM 1954 CA LEU A 125 -9.507 -0.636 0.017 1.00 0.41 C ATOM 1955 C LEU A 125 -9.835 0.171 -1.237 1.00 0.34 C ATOM 1956 O LEU A 125 -9.741 -0.332 -2.359 1.00 0.40 O ATOM 1957 CB LEU A 125 -10.792 -0.803 0.833 1.00 0.53 C ATOM 1958 CG LEU A 125 -10.756 -1.864 1.934 1.00 0.61 C ATOM 1959 CD1 LEU A 125 -12.108 -1.946 2.626 1.00 0.85 C ATOM 1960 CD2 LEU A 125 -10.362 -3.219 1.368 1.00 0.76 C ATOM 0 H LEU A 125 -8.791 0.538 1.614 1.00 0.37 H new ATOM 0 HA LEU A 125 -9.119 -1.606 -0.293 1.00 0.41 H new ATOM 0 HB2 LEU A 125 -11.036 0.157 1.289 1.00 0.53 H new ATOM 0 HB3 LEU A 125 -11.604 -1.046 0.148 1.00 0.53 H new ATOM 0 HG LEU A 125 -10.004 -1.574 2.668 1.00 0.61 H new ATOM 0 HD11 LEU A 125 -12.071 -2.704 3.408 1.00 0.85 H new ATOM 0 HD12 LEU A 125 -12.349 -0.980 3.069 1.00 0.85 H new ATOM 0 HD13 LEU A 125 -12.874 -2.213 1.898 1.00 0.85 H new ATOM 0 HD21 LEU A 125 -10.343 -3.957 2.170 1.00 0.76 H new ATOM 0 HD22 LEU A 125 -11.087 -3.522 0.613 1.00 0.76 H new ATOM 0 HD23 LEU A 125 -9.373 -3.150 0.915 1.00 0.76 H new ATOM 1972 N TRP A 126 -10.275 1.406 -1.028 1.00 0.31 N ATOM 1973 CA TRP A 126 -10.689 2.294 -2.114 1.00 0.32 C ATOM 1974 C TRP A 126 -9.682 2.332 -3.276 1.00 0.29 C ATOM 1975 O TRP A 126 -10.044 2.011 -4.407 1.00 0.31 O ATOM 1976 CB TRP A 126 -10.944 3.693 -1.550 1.00 0.38 C ATOM 1977 CG TRP A 126 -11.366 4.707 -2.567 1.00 0.46 C ATOM 1978 CD1 TRP A 126 -10.916 5.986 -2.656 1.00 0.46 C ATOM 1979 CD2 TRP A 126 -12.321 4.538 -3.626 1.00 0.93 C ATOM 1980 NE1 TRP A 126 -11.526 6.631 -3.704 1.00 0.54 N ATOM 1981 CE2 TRP A 126 -12.391 5.763 -4.316 1.00 0.94 C ATOM 1982 CE3 TRP A 126 -13.120 3.475 -4.058 1.00 1.45 C ATOM 1983 CZ2 TRP A 126 -13.228 5.953 -5.414 1.00 1.42 C ATOM 1984 CZ3 TRP A 126 -13.951 3.665 -5.147 1.00 1.96 C ATOM 1985 CH2 TRP A 126 -13.997 4.896 -5.815 1.00 1.93 C ATOM 0 H TRP A 126 -10.356 1.823 -0.101 1.00 0.31 H new ATOM 0 HA TRP A 126 -11.611 1.897 -2.539 1.00 0.32 H new ATOM 0 HB2 TRP A 126 -11.714 3.626 -0.782 1.00 0.38 H new ATOM 0 HB3 TRP A 126 -10.036 4.044 -1.061 1.00 0.38 H new ATOM 0 HD1 TRP A 126 -10.184 6.431 -1.998 1.00 0.46 H new ATOM 0 HE1 TRP A 126 -11.362 7.599 -3.981 1.00 0.54 H new ATOM 0 HE3 TRP A 126 -13.089 2.522 -3.550 1.00 1.45 H new ATOM 0 HZ2 TRP A 126 -13.268 6.901 -5.930 1.00 1.42 H new ATOM 0 HZ3 TRP A 126 -14.574 2.852 -5.488 1.00 1.96 H new ATOM 0 HH2 TRP A 126 -14.654 5.012 -6.664 1.00 1.93 H new ATOM 1996 N PRO A 127 -8.411 2.726 -3.042 1.00 0.28 N ATOM 1997 CA PRO A 127 -7.403 2.789 -4.114 1.00 0.29 C ATOM 1998 C PRO A 127 -7.121 1.420 -4.733 1.00 0.28 C ATOM 1999 O PRO A 127 -7.007 1.289 -5.952 1.00 0.31 O ATOM 2000 CB PRO A 127 -6.152 3.322 -3.407 1.00 0.30 C ATOM 2001 CG PRO A 127 -6.668 3.978 -2.175 1.00 0.31 C ATOM 2002 CD PRO A 127 -7.849 3.154 -1.750 1.00 0.29 C ATOM 0 HA PRO A 127 -7.737 3.413 -4.943 1.00 0.29 H new ATOM 0 HB2 PRO A 127 -5.459 2.516 -3.166 1.00 0.30 H new ATOM 0 HB3 PRO A 127 -5.612 4.029 -4.036 1.00 0.30 H new ATOM 0 HG2 PRO A 127 -5.906 4.005 -1.396 1.00 0.31 H new ATOM 0 HG3 PRO A 127 -6.959 5.010 -2.372 1.00 0.31 H new ATOM 0 HD2 PRO A 127 -7.553 2.305 -1.134 1.00 0.29 H new ATOM 0 HD3 PRO A 127 -8.563 3.736 -1.168 1.00 0.29 H new ATOM 2010 N LEU A 128 -7.010 0.405 -3.883 1.00 0.25 N ATOM 2011 CA LEU A 128 -6.745 -0.961 -4.333 1.00 0.26 C ATOM 2012 C LEU A 128 -7.874 -1.457 -5.232 1.00 0.27 C ATOM 2013 O LEU A 128 -7.682 -2.329 -6.078 1.00 0.29 O ATOM 2014 CB LEU A 128 -6.636 -1.882 -3.121 1.00 0.26 C ATOM 2015 CG LEU A 128 -5.430 -2.807 -3.076 1.00 0.29 C ATOM 2016 CD1 LEU A 128 -4.165 -2.022 -2.771 1.00 0.30 C ATOM 2017 CD2 LEU A 128 -5.648 -3.889 -2.032 1.00 0.44 C ATOM 0 H LEU A 128 -7.100 0.502 -2.872 1.00 0.25 H new ATOM 0 HA LEU A 128 -5.812 -0.967 -4.896 1.00 0.26 H new ATOM 0 HB2 LEU A 128 -6.625 -1.264 -2.223 1.00 0.26 H new ATOM 0 HB3 LEU A 128 -7.537 -2.494 -3.076 1.00 0.26 H new ATOM 0 HG LEU A 128 -5.311 -3.277 -4.053 1.00 0.29 H new ATOM 0 HD11 LEU A 128 -3.313 -2.701 -2.743 1.00 0.30 H new ATOM 0 HD12 LEU A 128 -4.006 -1.272 -3.546 1.00 0.30 H new ATOM 0 HD13 LEU A 128 -4.267 -1.528 -1.805 1.00 0.30 H new ATOM 0 HD21 LEU A 128 -4.780 -4.548 -2.005 1.00 0.44 H new ATOM 0 HD22 LEU A 128 -5.785 -3.428 -1.054 1.00 0.44 H new ATOM 0 HD23 LEU A 128 -6.536 -4.468 -2.288 1.00 0.44 H new ATOM 2029 N PHE A 129 -9.053 -0.883 -5.023 1.00 0.28 N ATOM 2030 CA PHE A 129 -10.252 -1.237 -5.786 1.00 0.30 C ATOM 2031 C PHE A 129 -10.096 -0.857 -7.257 1.00 0.30 C ATOM 2032 O PHE A 129 -10.874 -1.280 -8.113 1.00 0.32 O ATOM 2033 CB PHE A 129 -11.471 -0.522 -5.185 1.00 0.36 C ATOM 2034 CG PHE A 129 -12.724 -0.612 -6.015 1.00 0.42 C ATOM 2035 CD1 PHE A 129 -13.283 -1.841 -6.328 1.00 0.47 C ATOM 2036 CD2 PHE A 129 -13.345 0.537 -6.477 1.00 0.48 C ATOM 2037 CE1 PHE A 129 -14.436 -1.922 -7.087 1.00 0.55 C ATOM 2038 CE2 PHE A 129 -14.500 0.462 -7.235 1.00 0.56 C ATOM 2039 CZ PHE A 129 -15.044 -0.770 -7.540 1.00 0.58 C ATOM 0 H PHE A 129 -9.209 -0.159 -4.321 1.00 0.28 H new ATOM 0 HA PHE A 129 -10.395 -2.316 -5.729 1.00 0.30 H new ATOM 0 HB2 PHE A 129 -11.673 -0.942 -4.200 1.00 0.36 H new ATOM 0 HB3 PHE A 129 -11.223 0.529 -5.038 1.00 0.36 H new ATOM 0 HD1 PHE A 129 -12.812 -2.747 -5.975 1.00 0.47 H new ATOM 0 HD2 PHE A 129 -12.922 1.503 -6.243 1.00 0.48 H new ATOM 0 HE1 PHE A 129 -14.860 -2.886 -7.325 1.00 0.55 H new ATOM 0 HE2 PHE A 129 -14.975 1.365 -7.588 1.00 0.56 H new ATOM 0 HZ PHE A 129 -15.945 -0.831 -8.133 1.00 0.58 H new ATOM 2049 N GLU A 130 -9.096 -0.041 -7.539 1.00 0.29 N ATOM 2050 CA GLU A 130 -8.846 0.420 -8.897 1.00 0.31 C ATOM 2051 C GLU A 130 -7.660 -0.298 -9.526 1.00 0.29 C ATOM 2052 O GLU A 130 -7.599 -0.451 -10.746 1.00 0.32 O ATOM 2053 CB GLU A 130 -8.614 1.931 -8.906 1.00 0.36 C ATOM 2054 CG GLU A 130 -8.413 2.509 -10.298 1.00 0.93 C ATOM 2055 CD GLU A 130 -8.246 4.015 -10.284 1.00 1.41 C ATOM 2056 OE1 GLU A 130 -9.167 4.710 -9.806 1.00 1.52 O ATOM 2057 OE2 GLU A 130 -7.193 4.499 -10.749 1.00 2.43 O ATOM 0 H GLU A 130 -8.441 0.318 -6.845 1.00 0.29 H new ATOM 0 HA GLU A 130 -9.728 0.188 -9.494 1.00 0.31 H new ATOM 0 HB2 GLU A 130 -9.466 2.423 -8.437 1.00 0.36 H new ATOM 0 HB3 GLU A 130 -7.739 2.159 -8.297 1.00 0.36 H new ATOM 0 HG2 GLU A 130 -7.533 2.054 -10.753 1.00 0.93 H new ATOM 0 HG3 GLU A 130 -9.267 2.247 -10.923 1.00 0.93 H new ATOM 2064 N ILE A 131 -6.709 -0.730 -8.702 1.00 0.26 N ATOM 2065 CA ILE A 131 -5.534 -1.413 -9.219 1.00 0.27 C ATOM 2066 C ILE A 131 -5.865 -2.852 -9.581 1.00 0.27 C ATOM 2067 O ILE A 131 -5.293 -3.408 -10.519 1.00 0.30 O ATOM 2068 CB ILE A 131 -4.377 -1.374 -8.202 1.00 0.27 C ATOM 2069 CG1 ILE A 131 -4.630 -2.320 -7.013 1.00 0.29 C ATOM 2070 CG2 ILE A 131 -4.204 0.052 -7.711 1.00 0.32 C ATOM 2071 CD1 ILE A 131 -3.497 -2.344 -6.012 1.00 0.59 C ATOM 0 H ILE A 131 -6.730 -0.620 -7.688 1.00 0.26 H new ATOM 0 HA ILE A 131 -5.215 -0.890 -10.120 1.00 0.27 H new ATOM 0 HB ILE A 131 -3.467 -1.715 -8.696 1.00 0.27 H new ATOM 0 HG12 ILE A 131 -5.546 -2.017 -6.506 1.00 0.29 H new ATOM 0 HG13 ILE A 131 -4.793 -3.330 -7.390 1.00 0.29 H new ATOM 0 HG21 ILE A 131 -3.387 0.092 -6.990 1.00 0.32 H new ATOM 0 HG22 ILE A 131 -3.975 0.702 -8.555 1.00 0.32 H new ATOM 0 HG23 ILE A 131 -5.125 0.387 -7.234 1.00 0.32 H new ATOM 0 HD11 ILE A 131 -3.742 -3.030 -5.202 1.00 0.59 H new ATOM 0 HD12 ILE A 131 -2.583 -2.676 -6.505 1.00 0.59 H new ATOM 0 HD13 ILE A 131 -3.348 -1.343 -5.607 1.00 0.59 H new ATOM 2083 N ALA A 132 -6.831 -3.417 -8.859 1.00 0.24 N ATOM 2084 CA ALA A 132 -7.305 -4.783 -9.105 1.00 0.25 C ATOM 2085 C ALA A 132 -8.093 -5.332 -7.916 1.00 0.23 C ATOM 2086 O ALA A 132 -7.525 -5.951 -7.019 1.00 0.28 O ATOM 2087 CB ALA A 132 -6.154 -5.723 -9.439 1.00 0.30 C ATOM 0 H ALA A 132 -7.307 -2.946 -8.090 1.00 0.24 H new ATOM 0 HA ALA A 132 -7.972 -4.730 -9.965 1.00 0.25 H new ATOM 0 HB1 ALA A 132 -6.543 -6.726 -9.615 1.00 0.30 H new ATOM 0 HB2 ALA A 132 -5.644 -5.369 -10.335 1.00 0.30 H new ATOM 0 HB3 ALA A 132 -5.451 -5.747 -8.606 1.00 0.30 H new ATOM 2093 N PRO A 133 -9.415 -5.108 -7.884 1.00 0.25 N ATOM 2094 CA PRO A 133 -10.271 -5.574 -6.800 1.00 0.31 C ATOM 2095 C PRO A 133 -10.936 -6.913 -7.106 1.00 0.35 C ATOM 2096 O PRO A 133 -11.772 -7.390 -6.339 1.00 0.45 O ATOM 2097 CB PRO A 133 -11.312 -4.472 -6.753 1.00 0.37 C ATOM 2098 CG PRO A 133 -11.516 -4.113 -8.191 1.00 0.37 C ATOM 2099 CD PRO A 133 -10.197 -4.366 -8.891 1.00 0.29 C ATOM 0 HA PRO A 133 -9.727 -5.746 -5.871 1.00 0.31 H new ATOM 0 HB2 PRO A 133 -12.238 -4.815 -6.291 1.00 0.37 H new ATOM 0 HB3 PRO A 133 -10.964 -3.617 -6.173 1.00 0.37 H new ATOM 0 HG2 PRO A 133 -12.310 -4.715 -8.632 1.00 0.37 H new ATOM 0 HG3 PRO A 133 -11.814 -3.069 -8.291 1.00 0.37 H new ATOM 0 HD2 PRO A 133 -10.331 -4.946 -9.804 1.00 0.29 H new ATOM 0 HD3 PRO A 133 -9.707 -3.435 -9.175 1.00 0.29 H new ATOM 2107 N GLU A 134 -10.571 -7.506 -8.236 1.00 0.32 N ATOM 2108 CA GLU A 134 -11.145 -8.780 -8.649 1.00 0.37 C ATOM 2109 C GLU A 134 -10.489 -9.956 -7.932 1.00 0.37 C ATOM 2110 O GLU A 134 -10.628 -11.101 -8.363 1.00 0.52 O ATOM 2111 CB GLU A 134 -11.009 -8.954 -10.163 1.00 0.44 C ATOM 2112 CG GLU A 134 -9.570 -8.944 -10.653 1.00 0.46 C ATOM 2113 CD GLU A 134 -9.459 -9.134 -12.153 1.00 0.54 C ATOM 2114 OE1 GLU A 134 -10.511 -9.277 -12.811 1.00 1.14 O ATOM 2115 OE2 GLU A 134 -8.322 -9.140 -12.671 1.00 0.87 O ATOM 0 H GLU A 134 -9.880 -7.125 -8.883 1.00 0.32 H new ATOM 0 HA GLU A 134 -12.200 -8.768 -8.376 1.00 0.37 H new ATOM 0 HB2 GLU A 134 -11.476 -9.894 -10.455 1.00 0.44 H new ATOM 0 HB3 GLU A 134 -11.559 -8.156 -10.662 1.00 0.44 H new ATOM 0 HG2 GLU A 134 -9.103 -7.999 -10.376 1.00 0.46 H new ATOM 0 HG3 GLU A 134 -9.014 -9.734 -10.149 1.00 0.46 H new ATOM 2122 N LEU A 135 -9.772 -9.682 -6.844 1.00 0.30 N ATOM 2123 CA LEU A 135 -9.115 -10.724 -6.101 1.00 0.35 C ATOM 2124 C LEU A 135 -10.063 -11.477 -5.206 1.00 0.34 C ATOM 2125 O LEU A 135 -11.215 -11.112 -5.056 1.00 0.39 O ATOM 2126 CB LEU A 135 -8.029 -10.156 -5.227 1.00 0.41 C ATOM 2127 CG LEU A 135 -8.342 -8.881 -4.497 1.00 0.69 C ATOM 2128 CD1 LEU A 135 -8.640 -9.202 -3.040 1.00 1.27 C ATOM 2129 CD2 LEU A 135 -7.172 -7.935 -4.601 1.00 1.41 C ATOM 0 H LEU A 135 -9.639 -8.743 -6.467 1.00 0.30 H new ATOM 0 HA LEU A 135 -8.702 -11.404 -6.846 1.00 0.35 H new ATOM 0 HB2 LEU A 135 -7.757 -10.911 -4.490 1.00 0.41 H new ATOM 0 HB3 LEU A 135 -7.149 -9.985 -5.847 1.00 0.41 H new ATOM 0 HG LEU A 135 -9.214 -8.402 -4.943 1.00 0.69 H new ATOM 0 HD11 LEU A 135 -8.868 -8.281 -2.504 1.00 1.27 H new ATOM 0 HD12 LEU A 135 -9.495 -9.876 -2.983 1.00 1.27 H new ATOM 0 HD13 LEU A 135 -7.771 -9.679 -2.587 1.00 1.27 H new ATOM 0 HD21 LEU A 135 -7.403 -7.011 -4.070 1.00 1.41 H new ATOM 0 HD22 LEU A 135 -6.290 -8.397 -4.158 1.00 1.41 H new ATOM 0 HD23 LEU A 135 -6.977 -7.712 -5.650 1.00 1.41 H new ATOM 2141 N VAL A 136 -9.526 -12.515 -4.592 1.00 0.36 N ATOM 2142 CA VAL A 136 -10.273 -13.339 -3.653 1.00 0.38 C ATOM 2143 C VAL A 136 -9.356 -13.884 -2.556 1.00 0.42 C ATOM 2144 O VAL A 136 -8.436 -14.653 -2.840 1.00 0.53 O ATOM 2145 CB VAL A 136 -11.015 -14.487 -4.364 1.00 0.41 C ATOM 2146 CG1 VAL A 136 -10.079 -15.237 -5.301 1.00 0.46 C ATOM 2147 CG2 VAL A 136 -11.636 -15.435 -3.351 1.00 0.44 C ATOM 0 H VAL A 136 -8.560 -12.813 -4.728 1.00 0.36 H new ATOM 0 HA VAL A 136 -11.025 -12.701 -3.189 1.00 0.38 H new ATOM 0 HB VAL A 136 -11.817 -14.054 -4.961 1.00 0.41 H new ATOM 0 HG11 VAL A 136 -10.625 -16.043 -5.792 1.00 0.46 H new ATOM 0 HG12 VAL A 136 -9.691 -14.551 -6.054 1.00 0.46 H new ATOM 0 HG13 VAL A 136 -9.250 -15.655 -4.730 1.00 0.46 H new ATOM 0 HG21 VAL A 136 -12.155 -16.238 -3.875 1.00 0.44 H new ATOM 0 HG22 VAL A 136 -10.853 -15.859 -2.722 1.00 0.44 H new ATOM 0 HG23 VAL A 136 -12.346 -14.889 -2.729 1.00 0.44 H new ATOM 2157 N PHE A 137 -9.608 -13.500 -1.307 1.00 0.46 N ATOM 2158 CA PHE A 137 -8.795 -13.974 -0.193 1.00 0.53 C ATOM 2159 C PHE A 137 -8.939 -15.482 -0.031 1.00 0.57 C ATOM 2160 O PHE A 137 -9.977 -16.049 -0.375 1.00 0.60 O ATOM 2161 CB PHE A 137 -9.208 -13.285 1.114 1.00 0.59 C ATOM 2162 CG PHE A 137 -8.803 -11.840 1.215 1.00 0.58 C ATOM 2163 CD1 PHE A 137 -9.049 -10.971 0.164 1.00 0.55 C ATOM 2164 CD2 PHE A 137 -8.175 -11.352 2.349 1.00 0.66 C ATOM 2165 CE1 PHE A 137 -8.677 -9.644 0.241 1.00 0.59 C ATOM 2166 CE2 PHE A 137 -7.802 -10.023 2.432 1.00 0.68 C ATOM 2167 CZ PHE A 137 -8.057 -9.171 1.428 1.00 0.64 C ATOM 0 H PHE A 137 -10.363 -12.867 -1.043 1.00 0.46 H new ATOM 0 HA PHE A 137 -7.755 -13.731 -0.412 1.00 0.53 H new ATOM 0 HB2 PHE A 137 -10.291 -13.353 1.219 1.00 0.59 H new ATOM 0 HB3 PHE A 137 -8.771 -13.830 1.951 1.00 0.59 H new ATOM 0 HD1 PHE A 137 -9.538 -11.337 -0.727 1.00 0.55 H new ATOM 0 HD2 PHE A 137 -7.975 -12.016 3.177 1.00 0.66 H new ATOM 0 HE1 PHE A 137 -8.855 -8.976 -0.589 1.00 0.59 H new ATOM 0 HE2 PHE A 137 -7.298 -9.666 3.318 1.00 0.68 H new ATOM 0 HZ PHE A 137 -7.792 -8.128 1.522 1.00 0.64 H new ATOM 2177 N PRO A 138 -7.909 -16.157 0.513 1.00 0.60 N ATOM 2178 CA PRO A 138 -7.954 -17.602 0.734 1.00 0.66 C ATOM 2179 C PRO A 138 -9.202 -17.986 1.519 1.00 0.73 C ATOM 2180 O PRO A 138 -9.669 -19.124 1.465 1.00 0.78 O ATOM 2181 CB PRO A 138 -6.691 -17.900 1.554 1.00 0.70 C ATOM 2182 CG PRO A 138 -6.146 -16.572 1.970 1.00 0.75 C ATOM 2183 CD PRO A 138 -6.643 -15.570 0.971 1.00 0.62 C ATOM 0 HA PRO A 138 -7.990 -18.165 -0.199 1.00 0.66 H new ATOM 0 HB2 PRO A 138 -6.926 -18.515 2.423 1.00 0.70 H new ATOM 0 HB3 PRO A 138 -5.962 -18.452 0.961 1.00 0.70 H new ATOM 0 HG2 PRO A 138 -6.480 -16.314 2.975 1.00 0.75 H new ATOM 0 HG3 PRO A 138 -5.056 -16.590 1.991 1.00 0.75 H new ATOM 0 HD2 PRO A 138 -6.793 -14.590 1.424 1.00 0.62 H new ATOM 0 HD3 PRO A 138 -5.940 -15.437 0.149 1.00 0.62 H new ATOM 2191 N ASP A 139 -9.733 -17.006 2.242 1.00 0.77 N ATOM 2192 CA ASP A 139 -10.932 -17.186 3.047 1.00 0.87 C ATOM 2193 C ASP A 139 -12.137 -17.462 2.156 1.00 0.80 C ATOM 2194 O ASP A 139 -12.826 -18.470 2.313 1.00 1.03 O ATOM 2195 CB ASP A 139 -11.191 -15.925 3.874 1.00 0.92 C ATOM 2196 CG ASP A 139 -12.227 -16.142 4.961 1.00 1.33 C ATOM 2197 OD1 ASP A 139 -12.739 -17.276 5.074 1.00 1.72 O ATOM 2198 OD2 ASP A 139 -12.529 -15.179 5.697 1.00 1.91 O ATOM 0 H ASP A 139 -9.343 -16.065 2.285 1.00 0.77 H new ATOM 0 HA ASP A 139 -10.781 -18.038 3.710 1.00 0.87 H new ATOM 0 HB2 ASP A 139 -10.257 -15.595 4.328 1.00 0.92 H new ATOM 0 HB3 ASP A 139 -11.525 -15.124 3.214 1.00 0.92 H new ATOM 2203 N GLY A 140 -12.383 -16.547 1.225 1.00 0.59 N ATOM 2204 CA GLY A 140 -13.504 -16.684 0.317 1.00 0.59 C ATOM 2205 C GLY A 140 -14.003 -15.340 -0.176 1.00 0.61 C ATOM 2206 O GLY A 140 -14.788 -15.268 -1.121 1.00 0.95 O ATOM 0 H GLY A 140 -11.821 -15.708 1.083 1.00 0.59 H new ATOM 0 HA2 GLY A 140 -13.208 -17.296 -0.535 1.00 0.59 H new ATOM 0 HA3 GLY A 140 -14.316 -17.210 0.820 1.00 0.59 H new ATOM 2210 N GLU A 141 -13.542 -14.272 0.471 1.00 0.51 N ATOM 2211 CA GLU A 141 -13.942 -12.920 0.100 1.00 0.62 C ATOM 2212 C GLU A 141 -13.113 -12.407 -1.061 1.00 0.53 C ATOM 2213 O GLU A 141 -12.245 -13.103 -1.575 1.00 0.59 O ATOM 2214 CB GLU A 141 -13.809 -11.967 1.285 1.00 0.86 C ATOM 2215 CG GLU A 141 -12.373 -11.624 1.642 1.00 1.38 C ATOM 2216 CD GLU A 141 -12.270 -10.756 2.882 1.00 2.15 C ATOM 2217 OE1 GLU A 141 -13.325 -10.423 3.463 1.00 2.53 O ATOM 2218 OE2 GLU A 141 -11.136 -10.410 3.274 1.00 2.76 O ATOM 0 H GLU A 141 -12.891 -14.318 1.255 1.00 0.51 H new ATOM 0 HA GLU A 141 -14.988 -12.961 -0.205 1.00 0.62 H new ATOM 0 HB2 GLU A 141 -14.347 -11.046 1.060 1.00 0.86 H new ATOM 0 HB3 GLU A 141 -14.292 -12.414 2.154 1.00 0.86 H new ATOM 0 HG2 GLU A 141 -11.812 -12.545 1.801 1.00 1.38 H new ATOM 0 HG3 GLU A 141 -11.907 -11.108 0.802 1.00 1.38 H new ATOM 2225 N MET A 142 -13.409 -11.188 -1.469 1.00 0.48 N ATOM 2226 CA MET A 142 -12.716 -10.553 -2.585 1.00 0.41 C ATOM 2227 C MET A 142 -12.504 -9.065 -2.316 1.00 0.37 C ATOM 2228 O MET A 142 -13.307 -8.463 -1.607 1.00 0.39 O ATOM 2229 CB MET A 142 -13.558 -10.720 -3.855 1.00 0.42 C ATOM 2230 CG MET A 142 -13.872 -12.168 -4.196 1.00 0.49 C ATOM 2231 SD MET A 142 -14.951 -12.328 -5.635 1.00 0.55 S ATOM 2232 CE MET A 142 -13.961 -11.528 -6.897 1.00 1.68 C ATOM 0 H MET A 142 -14.132 -10.609 -1.042 1.00 0.48 H new ATOM 0 HA MET A 142 -11.742 -11.026 -2.709 1.00 0.41 H new ATOM 0 HB2 MET A 142 -14.493 -10.174 -3.734 1.00 0.42 H new ATOM 0 HB3 MET A 142 -13.029 -10.265 -4.693 1.00 0.42 H new ATOM 0 HG2 MET A 142 -12.941 -12.703 -4.384 1.00 0.49 H new ATOM 0 HG3 MET A 142 -14.345 -12.645 -3.338 1.00 0.49 H new ATOM 0 HE1 MET A 142 -14.336 -11.803 -7.883 1.00 1.68 H new ATOM 0 HE2 MET A 142 -14.021 -10.446 -6.775 1.00 1.68 H new ATOM 0 HE3 MET A 142 -12.923 -11.847 -6.802 1.00 1.68 H new ATOM 2242 N LEU A 143 -11.447 -8.451 -2.889 1.00 0.38 N ATOM 2243 CA LEU A 143 -11.243 -7.007 -2.669 1.00 0.39 C ATOM 2244 C LEU A 143 -12.545 -6.273 -2.963 1.00 0.41 C ATOM 2245 O LEU A 143 -12.779 -5.163 -2.485 1.00 0.50 O ATOM 2246 CB LEU A 143 -10.117 -6.447 -3.547 1.00 0.44 C ATOM 2247 CG LEU A 143 -9.801 -4.953 -3.369 1.00 0.51 C ATOM 2248 CD1 LEU A 143 -9.701 -4.592 -1.895 1.00 1.38 C ATOM 2249 CD2 LEU A 143 -8.499 -4.609 -4.081 1.00 1.56 C ATOM 0 H LEU A 143 -10.752 -8.908 -3.480 1.00 0.38 H new ATOM 0 HA LEU A 143 -10.949 -6.857 -1.630 1.00 0.39 H new ATOM 0 HB2 LEU A 143 -9.209 -7.016 -3.346 1.00 0.44 H new ATOM 0 HB3 LEU A 143 -10.377 -6.621 -4.591 1.00 0.44 H new ATOM 0 HG LEU A 143 -10.614 -4.375 -3.808 1.00 0.51 H new ATOM 0 HD11 LEU A 143 -9.477 -3.530 -1.795 1.00 1.38 H new ATOM 0 HD12 LEU A 143 -10.648 -4.811 -1.402 1.00 1.38 H new ATOM 0 HD13 LEU A 143 -8.906 -5.176 -1.430 1.00 1.38 H new ATOM 0 HD21 LEU A 143 -8.282 -3.549 -3.950 1.00 1.56 H new ATOM 0 HD22 LEU A 143 -7.686 -5.200 -3.659 1.00 1.56 H new ATOM 0 HD23 LEU A 143 -8.596 -4.831 -5.144 1.00 1.56 H new ATOM 2261 N ARG A 144 -13.399 -6.934 -3.741 1.00 0.39 N ATOM 2262 CA ARG A 144 -14.698 -6.399 -4.104 1.00 0.47 C ATOM 2263 C ARG A 144 -15.697 -6.598 -2.966 1.00 0.49 C ATOM 2264 O ARG A 144 -16.405 -5.669 -2.577 1.00 0.56 O ATOM 2265 CB ARG A 144 -15.208 -7.094 -5.371 1.00 0.54 C ATOM 2266 CG ARG A 144 -16.660 -6.781 -5.693 1.00 0.77 C ATOM 2267 CD ARG A 144 -16.886 -5.286 -5.843 1.00 0.88 C ATOM 2268 NE ARG A 144 -16.116 -4.722 -6.949 1.00 1.47 N ATOM 2269 CZ ARG A 144 -16.279 -5.071 -8.224 1.00 2.12 C ATOM 2270 NH1 ARG A 144 -17.194 -5.973 -8.561 1.00 2.68 N ATOM 2271 NH2 ARG A 144 -15.527 -4.516 -9.163 1.00 2.83 N ATOM 0 H ARG A 144 -13.205 -7.855 -4.135 1.00 0.39 H new ATOM 0 HA ARG A 144 -14.595 -5.330 -4.293 1.00 0.47 H new ATOM 0 HB2 ARG A 144 -14.585 -6.797 -6.215 1.00 0.54 H new ATOM 0 HB3 ARG A 144 -15.094 -8.172 -5.255 1.00 0.54 H new ATOM 0 HG2 ARG A 144 -16.947 -7.288 -6.614 1.00 0.77 H new ATOM 0 HG3 ARG A 144 -17.301 -7.170 -4.902 1.00 0.77 H new ATOM 0 HD2 ARG A 144 -17.947 -5.095 -6.006 1.00 0.88 H new ATOM 0 HD3 ARG A 144 -16.610 -4.783 -4.916 1.00 0.88 H new ATOM 0 HE ARG A 144 -15.411 -4.018 -6.732 1.00 1.47 H new ATOM 0 HH11 ARG A 144 -17.776 -6.402 -7.842 1.00 2.68 H new ATOM 0 HH12 ARG A 144 -17.314 -6.236 -9.539 1.00 2.68 H new ATOM 0 HH21 ARG A 144 -14.824 -3.822 -8.909 1.00 2.83 H new ATOM 0 HH22 ARG A 144 -15.651 -4.783 -10.140 1.00 2.83 H new ATOM 2285 N GLN A 145 -15.743 -7.821 -2.439 1.00 0.47 N ATOM 2286 CA GLN A 145 -16.650 -8.154 -1.345 1.00 0.52 C ATOM 2287 C GLN A 145 -16.374 -7.285 -0.120 1.00 0.48 C ATOM 2288 O GLN A 145 -17.301 -6.744 0.483 1.00 0.56 O ATOM 2289 CB GLN A 145 -16.528 -9.645 -0.998 1.00 0.57 C ATOM 2290 CG GLN A 145 -17.315 -10.066 0.237 1.00 0.64 C ATOM 2291 CD GLN A 145 -16.562 -9.828 1.536 1.00 0.60 C ATOM 2292 OE1 GLN A 145 -17.111 -10.015 2.623 1.00 0.67 O ATOM 2293 NE2 GLN A 145 -15.300 -9.428 1.433 1.00 0.52 N ATOM 0 H GLN A 145 -15.161 -8.598 -2.754 1.00 0.47 H new ATOM 0 HA GLN A 145 -17.671 -7.953 -1.668 1.00 0.52 H new ATOM 0 HB2 GLN A 145 -16.868 -10.234 -1.850 1.00 0.57 H new ATOM 0 HB3 GLN A 145 -15.476 -9.886 -0.844 1.00 0.57 H new ATOM 0 HG2 GLN A 145 -18.257 -9.517 0.264 1.00 0.64 H new ATOM 0 HG3 GLN A 145 -17.565 -11.124 0.158 1.00 0.64 H new ATOM 0 HE21 GLN A 145 -14.884 -9.285 0.513 1.00 0.52 H new ATOM 0 HE22 GLN A 145 -14.747 -9.264 2.274 1.00 0.52 H new ATOM 2302 N ILE A 146 -15.100 -7.157 0.245 1.00 0.40 N ATOM 2303 CA ILE A 146 -14.715 -6.352 1.400 1.00 0.40 C ATOM 2304 C ILE A 146 -15.336 -4.958 1.336 1.00 0.43 C ATOM 2305 O ILE A 146 -15.685 -4.379 2.364 1.00 0.53 O ATOM 2306 CB ILE A 146 -13.185 -6.217 1.510 1.00 0.42 C ATOM 2307 CG1 ILE A 146 -12.539 -7.599 1.612 1.00 0.43 C ATOM 2308 CG2 ILE A 146 -12.812 -5.359 2.712 1.00 0.50 C ATOM 2309 CD1 ILE A 146 -11.029 -7.558 1.694 1.00 0.78 C ATOM 0 H ILE A 146 -14.320 -7.599 -0.241 1.00 0.40 H new ATOM 0 HA ILE A 146 -15.089 -6.872 2.282 1.00 0.40 H new ATOM 0 HB ILE A 146 -12.811 -5.726 0.611 1.00 0.42 H new ATOM 0 HG12 ILE A 146 -12.929 -8.109 2.493 1.00 0.43 H new ATOM 0 HG13 ILE A 146 -12.831 -8.192 0.746 1.00 0.43 H new ATOM 0 HG21 ILE A 146 -11.727 -5.274 2.775 1.00 0.50 H new ATOM 0 HG22 ILE A 146 -13.248 -4.366 2.600 1.00 0.50 H new ATOM 0 HG23 ILE A 146 -13.193 -5.822 3.622 1.00 0.50 H new ATOM 0 HD11 ILE A 146 -10.641 -8.574 1.764 1.00 0.78 H new ATOM 0 HD12 ILE A 146 -10.629 -7.078 0.801 1.00 0.78 H new ATOM 0 HD13 ILE A 146 -10.728 -6.993 2.576 1.00 0.78 H new ATOM 2321 N LEU A 147 -15.476 -4.421 0.126 1.00 0.42 N ATOM 2322 CA LEU A 147 -16.059 -3.098 -0.054 1.00 0.50 C ATOM 2323 C LEU A 147 -17.576 -3.149 0.084 1.00 0.59 C ATOM 2324 O LEU A 147 -18.209 -2.166 0.467 1.00 0.72 O ATOM 2325 CB LEU A 147 -15.680 -2.529 -1.423 1.00 0.55 C ATOM 2326 CG LEU A 147 -14.214 -2.130 -1.573 1.00 0.61 C ATOM 2327 CD1 LEU A 147 -13.931 -1.684 -2.997 1.00 0.76 C ATOM 2328 CD2 LEU A 147 -13.863 -1.024 -0.591 1.00 0.62 C ATOM 0 H LEU A 147 -15.194 -4.881 -0.740 1.00 0.42 H new ATOM 0 HA LEU A 147 -15.662 -2.446 0.724 1.00 0.50 H new ATOM 0 HB2 LEU A 147 -15.919 -3.269 -2.186 1.00 0.55 H new ATOM 0 HB3 LEU A 147 -16.301 -1.655 -1.621 1.00 0.55 H new ATOM 0 HG LEU A 147 -13.593 -2.998 -1.352 1.00 0.61 H new ATOM 0 HD11 LEU A 147 -12.882 -1.403 -3.088 1.00 0.76 H new ATOM 0 HD12 LEU A 147 -14.149 -2.501 -3.684 1.00 0.76 H new ATOM 0 HD13 LEU A 147 -14.559 -0.827 -3.242 1.00 0.76 H new ATOM 0 HD21 LEU A 147 -12.815 -0.751 -0.710 1.00 0.62 H new ATOM 0 HD22 LEU A 147 -14.489 -0.153 -0.785 1.00 0.62 H new ATOM 0 HD23 LEU A 147 -14.033 -1.374 0.427 1.00 0.62 H new ATOM 2340 N HIS A 148 -18.152 -4.304 -0.234 1.00 0.59 N ATOM 2341 CA HIS A 148 -19.596 -4.492 -0.150 1.00 0.73 C ATOM 2342 C HIS A 148 -20.070 -4.398 1.298 1.00 0.79 C ATOM 2343 O HIS A 148 -21.215 -4.028 1.561 1.00 0.90 O ATOM 2344 CB HIS A 148 -19.987 -5.848 -0.745 1.00 0.77 C ATOM 2345 CG HIS A 148 -21.455 -6.133 -0.684 1.00 0.93 C ATOM 2346 ND1 HIS A 148 -22.403 -5.343 -1.300 1.00 1.36 N ATOM 2347 CD2 HIS A 148 -22.138 -7.132 -0.076 1.00 1.58 C ATOM 2348 CE1 HIS A 148 -23.605 -5.842 -1.072 1.00 1.28 C ATOM 2349 NE2 HIS A 148 -23.471 -6.928 -0.332 1.00 1.34 N ATOM 0 H HIS A 148 -17.639 -5.126 -0.553 1.00 0.59 H new ATOM 0 HA HIS A 148 -20.079 -3.700 -0.722 1.00 0.73 H new ATOM 0 HB2 HIS A 148 -19.662 -5.886 -1.785 1.00 0.77 H new ATOM 0 HB3 HIS A 148 -19.451 -6.635 -0.215 1.00 0.77 H new ATOM 0 HD2 HIS A 148 -21.713 -7.939 0.503 1.00 1.58 H new ATOM 0 HE1 HIS A 148 -24.538 -5.432 -1.430 1.00 1.28 H new ATOM 0 HE2 HIS A 148 -24.235 -7.519 -0.004 1.00 1.34 H new ATOM 2358 N THR A 149 -19.186 -4.733 2.232 1.00 0.77 N ATOM 2359 CA THR A 149 -19.518 -4.687 3.652 1.00 0.88 C ATOM 2360 C THR A 149 -18.971 -3.416 4.297 1.00 0.86 C ATOM 2361 O THR A 149 -19.601 -2.837 5.181 1.00 0.94 O ATOM 2362 CB THR A 149 -18.966 -5.920 4.369 1.00 0.90 C ATOM 2363 OG1 THR A 149 -19.470 -7.107 3.783 1.00 1.10 O ATOM 2364 CG2 THR A 149 -19.307 -5.958 5.843 1.00 1.18 C ATOM 0 H THR A 149 -18.234 -5.039 2.031 1.00 0.77 H new ATOM 0 HA THR A 149 -20.604 -4.681 3.746 1.00 0.88 H new ATOM 0 HB THR A 149 -17.883 -5.855 4.264 1.00 0.90 H new ATOM 0 HG1 THR A 149 -19.105 -7.885 4.254 1.00 1.10 H new ATOM 0 HG21 THR A 149 -18.886 -6.858 6.291 1.00 1.18 H new ATOM 0 HG22 THR A 149 -18.891 -5.079 6.335 1.00 1.18 H new ATOM 0 HG23 THR A 149 -20.390 -5.965 5.966 1.00 1.18 H new ATOM 2372 N ARG A 150 -17.793 -2.989 3.849 1.00 0.86 N ATOM 2373 CA ARG A 150 -17.161 -1.787 4.380 1.00 0.93 C ATOM 2374 C ARG A 150 -17.735 -0.537 3.724 1.00 0.95 C ATOM 2375 O ARG A 150 -18.293 0.330 4.398 1.00 1.05 O ATOM 2376 CB ARG A 150 -15.646 -1.838 4.165 1.00 0.99 C ATOM 2377 CG ARG A 150 -14.956 -2.964 4.919 1.00 0.96 C ATOM 2378 CD ARG A 150 -15.102 -2.805 6.423 1.00 1.26 C ATOM 2379 NE ARG A 150 -14.518 -3.928 7.151 1.00 2.01 N ATOM 2380 CZ ARG A 150 -14.512 -4.023 8.477 1.00 2.55 C ATOM 2381 NH1 ARG A 150 -15.053 -3.066 9.217 1.00 2.55 N ATOM 2382 NH2 ARG A 150 -13.966 -5.079 9.065 1.00 3.55 N ATOM 0 H ARG A 150 -17.257 -3.459 3.119 1.00 0.86 H new ATOM 0 HA ARG A 150 -17.366 -1.744 5.450 1.00 0.93 H new ATOM 0 HB2 ARG A 150 -15.443 -1.949 3.100 1.00 0.99 H new ATOM 0 HB3 ARG A 150 -15.212 -0.887 4.475 1.00 0.99 H new ATOM 0 HG2 ARG A 150 -15.379 -3.920 4.611 1.00 0.96 H new ATOM 0 HG3 ARG A 150 -13.898 -2.984 4.656 1.00 0.96 H new ATOM 0 HD2 ARG A 150 -14.621 -1.879 6.738 1.00 1.26 H new ATOM 0 HD3 ARG A 150 -16.158 -2.718 6.678 1.00 1.26 H new ATOM 0 HE ARG A 150 -14.091 -4.681 6.612 1.00 2.01 H new ATOM 0 HH11 ARG A 150 -15.476 -2.253 8.769 1.00 2.55 H new ATOM 0 HH12 ARG A 150 -15.046 -3.143 10.234 1.00 2.55 H new ATOM 0 HH21 ARG A 150 -13.550 -5.819 8.500 1.00 3.55 H new ATOM 0 HH22 ARG A 150 -13.962 -5.151 10.082 1.00 3.55 H new ATOM 2396 N ALA A 151 -17.583 -0.449 2.404 1.00 0.94 N ATOM 2397 CA ALA A 151 -18.076 0.695 1.643 1.00 1.04 C ATOM 2398 C ALA A 151 -17.332 1.968 2.033 1.00 1.11 C ATOM 2399 O ALA A 151 -17.945 2.968 2.411 1.00 1.59 O ATOM 2400 CB ALA A 151 -19.577 0.866 1.839 1.00 1.61 C ATOM 0 H ALA A 151 -17.120 -1.160 1.838 1.00 0.94 H new ATOM 0 HA ALA A 151 -17.890 0.505 0.586 1.00 1.04 H new ATOM 0 HB1 ALA A 151 -19.924 1.724 1.263 1.00 1.61 H new ATOM 0 HB2 ALA A 151 -20.093 -0.032 1.499 1.00 1.61 H new ATOM 0 HB3 ALA A 151 -19.790 1.028 2.896 1.00 1.61 H new ATOM 2406 N PHE A 152 -16.006 1.921 1.940 1.00 1.09 N ATOM 2407 CA PHE A 152 -15.175 3.062 2.281 1.00 1.61 C ATOM 2408 C PHE A 152 -14.617 3.729 1.028 1.00 1.38 C ATOM 2409 O PHE A 152 -13.402 3.834 0.859 1.00 1.90 O ATOM 2410 CB PHE A 152 -14.028 2.634 3.204 1.00 2.51 C ATOM 2411 CG PHE A 152 -14.445 2.346 4.622 1.00 3.40 C ATOM 2412 CD1 PHE A 152 -15.596 1.623 4.897 1.00 3.42 C ATOM 2413 CD2 PHE A 152 -13.678 2.800 5.685 1.00 4.44 C ATOM 2414 CE1 PHE A 152 -15.973 1.361 6.201 1.00 4.40 C ATOM 2415 CE2 PHE A 152 -14.052 2.540 6.990 1.00 5.41 C ATOM 2416 CZ PHE A 152 -15.200 1.820 7.248 1.00 5.37 C ATOM 0 H PHE A 152 -15.486 1.100 1.630 1.00 1.09 H new ATOM 0 HA PHE A 152 -15.800 3.786 2.805 1.00 1.61 H new ATOM 0 HB2 PHE A 152 -13.557 1.743 2.789 1.00 2.51 H new ATOM 0 HB3 PHE A 152 -13.272 3.420 3.213 1.00 2.51 H new ATOM 0 HD1 PHE A 152 -16.205 1.260 4.082 1.00 3.42 H new ATOM 0 HD2 PHE A 152 -12.777 3.364 5.491 1.00 4.44 H new ATOM 0 HE1 PHE A 152 -16.872 0.797 6.400 1.00 4.40 H new ATOM 0 HE2 PHE A 152 -13.445 2.901 7.808 1.00 5.41 H new ATOM 0 HZ PHE A 152 -15.493 1.616 8.267 1.00 5.37 H new ATOM 2426 N ASP A 153 -15.514 4.196 0.162 1.00 1.04 N ATOM 2427 CA ASP A 153 -15.115 4.880 -1.063 1.00 1.18 C ATOM 2428 C ASP A 153 -14.617 6.284 -0.731 1.00 1.01 C ATOM 2429 O ASP A 153 -14.642 7.187 -1.568 1.00 1.40 O ATOM 2430 CB ASP A 153 -16.291 4.956 -2.041 1.00 1.46 C ATOM 2431 CG ASP A 153 -16.804 3.586 -2.443 1.00 2.05 C ATOM 2432 OD1 ASP A 153 -16.237 2.578 -1.968 1.00 2.54 O ATOM 2433 OD2 ASP A 153 -17.771 3.518 -3.231 1.00 2.52 O ATOM 0 H ASP A 153 -16.523 4.112 0.288 1.00 1.04 H new ATOM 0 HA ASP A 153 -14.310 4.316 -1.534 1.00 1.18 H new ATOM 0 HB2 ASP A 153 -17.102 5.524 -1.585 1.00 1.46 H new ATOM 0 HB3 ASP A 153 -15.982 5.501 -2.933 1.00 1.46 H new ATOM 2438 N LYS A 154 -14.178 6.445 0.514 1.00 0.68 N ATOM 2439 CA LYS A 154 -13.674 7.708 1.026 1.00 0.59 C ATOM 2440 C LYS A 154 -12.435 8.183 0.264 1.00 0.52 C ATOM 2441 O LYS A 154 -12.307 7.959 -0.939 1.00 0.67 O ATOM 2442 CB LYS A 154 -13.341 7.537 2.509 1.00 0.63 C ATOM 2443 CG LYS A 154 -14.557 7.253 3.376 1.00 0.79 C ATOM 2444 CD LYS A 154 -14.201 7.243 4.856 1.00 0.93 C ATOM 2445 CE LYS A 154 -13.190 6.155 5.187 1.00 0.94 C ATOM 2446 NZ LYS A 154 -12.823 6.160 6.630 1.00 1.77 N ATOM 0 H LYS A 154 -14.164 5.691 1.201 1.00 0.68 H new ATOM 0 HA LYS A 154 -14.444 8.467 0.891 1.00 0.59 H new ATOM 0 HB2 LYS A 154 -12.627 6.721 2.621 1.00 0.63 H new ATOM 0 HB3 LYS A 154 -12.851 8.441 2.870 1.00 0.63 H new ATOM 0 HG2 LYS A 154 -15.321 8.008 3.190 1.00 0.79 H new ATOM 0 HG3 LYS A 154 -14.986 6.290 3.098 1.00 0.79 H new ATOM 0 HD2 LYS A 154 -13.795 8.214 5.139 1.00 0.93 H new ATOM 0 HD3 LYS A 154 -15.105 7.091 5.446 1.00 0.93 H new ATOM 0 HE2 LYS A 154 -13.603 5.182 4.921 1.00 0.94 H new ATOM 0 HE3 LYS A 154 -12.293 6.297 4.584 1.00 0.94 H new ATOM 0 HZ1 LYS A 154 -12.133 5.405 6.815 1.00 1.77 H new ATOM 0 HZ2 LYS A 154 -12.405 7.079 6.879 1.00 1.77 H new ATOM 0 HZ3 LYS A 154 -13.674 5.999 7.205 1.00 1.77 H new ATOM 2460 N LEU A 155 -11.527 8.846 0.980 1.00 0.55 N ATOM 2461 CA LEU A 155 -10.298 9.363 0.391 1.00 0.57 C ATOM 2462 C LEU A 155 -10.592 10.355 -0.732 1.00 0.51 C ATOM 2463 O LEU A 155 -10.737 9.967 -1.892 1.00 0.61 O ATOM 2464 CB LEU A 155 -9.428 8.223 -0.150 1.00 0.67 C ATOM 2465 CG LEU A 155 -8.950 7.189 0.873 1.00 0.81 C ATOM 2466 CD1 LEU A 155 -7.906 6.287 0.240 1.00 1.81 C ATOM 2467 CD2 LEU A 155 -8.391 7.860 2.116 1.00 1.95 C ATOM 0 H LEU A 155 -11.624 9.037 1.977 1.00 0.55 H new ATOM 0 HA LEU A 155 -9.757 9.882 1.182 1.00 0.57 H new ATOM 0 HB2 LEU A 155 -9.990 7.702 -0.925 1.00 0.67 H new ATOM 0 HB3 LEU A 155 -8.552 8.659 -0.630 1.00 0.67 H new ATOM 0 HG LEU A 155 -9.806 6.587 1.180 1.00 0.81 H new ATOM 0 HD11 LEU A 155 -7.568 5.553 0.971 1.00 1.81 H new ATOM 0 HD12 LEU A 155 -8.341 5.773 -0.617 1.00 1.81 H new ATOM 0 HD13 LEU A 155 -7.058 6.887 -0.089 1.00 1.81 H new ATOM 0 HD21 LEU A 155 -8.060 7.099 2.823 1.00 1.95 H new ATOM 0 HD22 LEU A 155 -7.546 8.491 1.840 1.00 1.95 H new ATOM 0 HD23 LEU A 155 -9.165 8.472 2.578 1.00 1.95 H new ATOM 2479 N ASN A 156 -10.664 11.638 -0.384 1.00 0.54 N ATOM 2480 CA ASN A 156 -10.922 12.682 -1.372 1.00 0.54 C ATOM 2481 C ASN A 156 -9.650 13.005 -2.140 1.00 0.53 C ATOM 2482 O ASN A 156 -8.618 13.300 -1.547 1.00 0.75 O ATOM 2483 CB ASN A 156 -11.453 13.942 -0.693 1.00 0.63 C ATOM 2484 CG ASN A 156 -11.498 15.130 -1.630 1.00 1.07 C ATOM 2485 OD1 ASN A 156 -12.191 15.109 -2.649 1.00 2.09 O ATOM 2486 ND2 ASN A 156 -10.756 16.176 -1.290 1.00 1.34 N ATOM 0 H ASN A 156 -10.548 11.978 0.571 1.00 0.54 H new ATOM 0 HA ASN A 156 -11.675 12.316 -2.070 1.00 0.54 H new ATOM 0 HB2 ASN A 156 -12.454 13.749 -0.308 1.00 0.63 H new ATOM 0 HB3 ASN A 156 -10.823 14.182 0.163 1.00 0.63 H new ATOM 0 HD21 ASN A 156 -10.744 17.007 -1.882 1.00 1.34 H new ATOM 0 HD22 ASN A 156 -10.198 16.149 -0.437 1.00 1.34 H new ATOM 2493 N LYS A 157 -9.737 12.937 -3.462 1.00 0.46 N ATOM 2494 CA LYS A 157 -8.592 13.205 -4.333 1.00 0.46 C ATOM 2495 C LYS A 157 -7.876 14.503 -3.967 1.00 0.48 C ATOM 2496 O LYS A 157 -8.506 15.486 -3.576 1.00 0.64 O ATOM 2497 CB LYS A 157 -9.034 13.254 -5.797 1.00 0.54 C ATOM 2498 CG LYS A 157 -9.377 11.892 -6.375 1.00 0.60 C ATOM 2499 CD LYS A 157 -9.897 12.005 -7.798 1.00 1.33 C ATOM 2500 CE LYS A 157 -10.259 10.642 -8.367 1.00 1.77 C ATOM 2501 NZ LYS A 157 -10.774 10.741 -9.760 1.00 2.30 N ATOM 0 H LYS A 157 -10.594 12.697 -3.961 1.00 0.46 H new ATOM 0 HA LYS A 157 -7.887 12.386 -4.190 1.00 0.46 H new ATOM 0 HB2 LYS A 157 -9.904 13.905 -5.884 1.00 0.54 H new ATOM 0 HB3 LYS A 157 -8.239 13.702 -6.393 1.00 0.54 H new ATOM 0 HG2 LYS A 157 -8.492 11.256 -6.360 1.00 0.60 H new ATOM 0 HG3 LYS A 157 -10.128 11.409 -5.750 1.00 0.60 H new ATOM 0 HD2 LYS A 157 -10.773 12.653 -7.816 1.00 1.33 H new ATOM 0 HD3 LYS A 157 -9.141 12.474 -8.427 1.00 1.33 H new ATOM 0 HE2 LYS A 157 -9.381 9.997 -8.350 1.00 1.77 H new ATOM 0 HE3 LYS A 157 -11.012 10.173 -7.734 1.00 1.77 H new ATOM 0 HZ1 LYS A 157 -11.009 9.791 -10.111 1.00 2.30 H new ATOM 0 HZ2 LYS A 157 -11.627 11.336 -9.773 1.00 2.30 H new ATOM 0 HZ3 LYS A 157 -10.046 11.165 -10.370 1.00 2.30 H new ATOM 2515 N TRP A 158 -6.551 14.481 -4.107 1.00 0.45 N ATOM 2516 CA TRP A 158 -5.702 15.634 -3.813 1.00 0.54 C ATOM 2517 C TRP A 158 -6.331 16.928 -4.326 1.00 0.75 C ATOM 2518 O TRP A 158 -6.474 17.065 -5.560 1.00 1.21 O ATOM 2519 CB TRP A 158 -4.328 15.433 -4.456 1.00 0.62 C ATOM 2520 CG TRP A 158 -3.325 16.483 -4.083 1.00 0.71 C ATOM 2521 CD1 TRP A 158 -2.717 17.371 -4.924 1.00 0.98 C ATOM 2522 CD2 TRP A 158 -2.794 16.738 -2.778 1.00 0.72 C ATOM 2523 NE1 TRP A 158 -1.851 18.171 -4.218 1.00 1.04 N ATOM 2524 CE2 TRP A 158 -1.880 17.803 -2.900 1.00 0.89 C ATOM 2525 CE3 TRP A 158 -3.008 16.177 -1.517 1.00 0.81 C ATOM 2526 CZ2 TRP A 158 -1.181 18.313 -1.811 1.00 1.01 C ATOM 2527 CZ3 TRP A 158 -2.312 16.684 -0.435 1.00 1.03 C ATOM 2528 CH2 TRP A 158 -1.409 17.744 -0.588 1.00 1.07 C ATOM 2529 OXT TRP A 158 -6.675 17.791 -3.491 1.00 1.47 O ATOM 0 H TRP A 158 -6.036 13.661 -4.428 1.00 0.45 H new ATOM 0 HA TRP A 158 -5.595 15.716 -2.731 1.00 0.54 H new ATOM 0 HB2 TRP A 158 -3.941 14.456 -4.167 1.00 0.62 H new ATOM 0 HB3 TRP A 158 -4.443 15.422 -5.540 1.00 0.62 H new ATOM 0 HD1 TRP A 158 -2.891 17.435 -5.988 1.00 0.98 H new ATOM 0 HE1 TRP A 158 -1.279 18.918 -4.612 1.00 1.04 H new ATOM 0 HE3 TRP A 158 -3.705 15.362 -1.389 1.00 0.81 H new ATOM 0 HZ2 TRP A 158 -0.483 19.129 -1.927 1.00 1.01 H new ATOM 0 HZ3 TRP A 158 -2.467 16.256 0.544 1.00 1.03 H new ATOM 0 HH2 TRP A 158 -0.882 18.120 0.277 1.00 1.07 H new TER 2540 TRP A 158