USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1167 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 107 ASN :FLIP amide:sc= -1.2 F(o=-6.2!,f=-2.8) USER MOD Set 1.2: A 112 THR OG1 : rot 170:sc= -1.55! USER MOD Set 2.1: A 40 TYR OH : rot 96:sc= 0.866 USER MOD Set 2.2: A 55 ASN : amide:sc= -0.511 K(o=0.36,f=-7.5!) USER MOD Set 3.1: A 19 ASN : amide:sc= -1.63 K(o=-1.7,f=-7.1!) USER MOD Set 3.2: A 23 LYS NZ :NH3+ -164:sc= -0.0434 (180deg=-0.305) USER MOD Set 4.1: A 10 ASN : amide:sc= -5.02! C(o=-6!,f=-9.7!) USER MOD Set 4.2: A 48 GLN :FLIP amide:sc= -0.988 F(o=-7.1,f=-6) USER MOD Single : A 1 THR N :NH3+ 151:sc= 0.00908 (180deg=0) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0.0113 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 78:sc= -1.78 USER MOD Single : A 13 SER OG : rot 170:sc= -0.451 USER MOD Single : A 17 GLN :FLIP amide:sc= -9.35! C(o=-11!,f=-9.3!) USER MOD Single : A 31 SER OG : rot 160:sc= -2.46! USER MOD Single : A 32 HIS : no HD1:sc= -2.36! X(o=-2.4!,f=-1.9) USER MOD Single : A 35 THR OG1 : rot 4:sc= -2.12! USER MOD Single : A 37 SER OG : rot 126:sc= 0.0431 USER MOD Single : A 38 SER OG : rot -59:sc= -0.365 USER MOD Single : A 42 THR OG1 : rot 166:sc= -2.19! USER MOD Single : A 50 GLN : amide:sc= -0.379 X(o=-0.38,f=-0.29) USER MOD Single : A 53 TYR OH : rot 180:sc= -0.0445 USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.959 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 71 ASN :FLIP amide:sc= -0.807 F(o=-2.6!,f=-0.81) USER MOD Single : A 72 HIS : no HD1:sc= -0.0568 K(o=-0.057,f=-2.9!) USER MOD Single : A 73 THR OG1 : rot -18:sc= -4.11! USER MOD Single : A 74 GLN : amide:sc=-0.00244 K(o=-0.0024,f=-1.9!) USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 GLN : amide:sc= -0.0775 X(o=-0.077,f=-0.077) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 MET CE :methyl -119:sc= -3.9! (180deg=-4.75!) USER MOD Single : A 103 ASN :FLIP amide:sc= -0.682 F(o=-2.6!,f=-0.68) USER MOD Single : A 108 THR OG1 : rot 160:sc= -1.22 USER MOD Single : A 115 HIS : no HE2:sc= -5.77! C(o=-5.8!,f=-13!) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc= -5.18! C(o=-5.2!,f=-7.4!) USER MOD Single : A 124 MET CE :methyl -114:sc= -0.544 (180deg=-3.32!) USER MOD Single : A 142 MET CE :methyl -158:sc= -2.12 (180deg=-3.76!) USER MOD Single : A 145 GLN :FLIP amide:sc= -0.649 F(o=-7.1!,f=-0.65) USER MOD Single : A 148 HIS :FLIP no HD1:sc= -0.0684 F(o=-0.62,f=-0.068) USER MOD Single : A 149 THR OG1 : rot -75:sc= 1.24 USER MOD Single : A 154 LYS NZ :NH3+ -130:sc= 0.662 (180deg=-0.208) USER MOD Single : A 156 ASN :FLIP amide:sc= -1.89 F(o=-7.8!,f=-1.9) USER MOD Single : A 157 LYS NZ :NH3+ -124:sc= -0.3! (180deg=-1.03) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 3.720 -9.770 -14.450 1.00 0.82 N ATOM 2 CA THR A 1 2.781 -10.094 -13.346 1.00 0.59 C ATOM 3 C THR A 1 2.256 -8.827 -12.678 1.00 0.52 C ATOM 4 O THR A 1 3.030 -8.025 -12.152 1.00 0.52 O ATOM 5 CB THR A 1 3.514 -10.968 -12.327 1.00 0.64 C ATOM 6 OG1 THR A 1 3.976 -12.163 -12.933 1.00 0.92 O ATOM 7 CG2 THR A 1 2.653 -11.356 -11.142 1.00 0.62 C ATOM 0 H1 THR A 1 4.409 -10.542 -14.557 1.00 0.82 H new ATOM 0 H2 THR A 1 3.188 -9.655 -15.336 1.00 0.82 H new ATOM 0 H3 THR A 1 4.222 -8.886 -14.231 1.00 0.82 H new ATOM 0 HA THR A 1 1.921 -10.629 -13.750 1.00 0.59 H new ATOM 0 HB THR A 1 4.345 -10.360 -11.968 1.00 0.64 H new ATOM 0 HG1 THR A 1 4.444 -12.708 -12.266 1.00 0.92 H new ATOM 0 HG21 THR A 1 3.233 -11.975 -10.458 1.00 0.62 H new ATOM 0 HG22 THR A 1 2.320 -10.457 -10.624 1.00 0.62 H new ATOM 0 HG23 THR A 1 1.785 -11.916 -11.491 1.00 0.62 H new ATOM 17 N VAL A 2 0.937 -8.655 -12.703 1.00 0.54 N ATOM 18 CA VAL A 2 0.311 -7.485 -12.099 1.00 0.54 C ATOM 19 C VAL A 2 0.342 -7.572 -10.576 1.00 0.44 C ATOM 20 O VAL A 2 -0.427 -8.316 -9.966 1.00 0.45 O ATOM 21 CB VAL A 2 -1.148 -7.321 -12.569 1.00 0.65 C ATOM 22 CG1 VAL A 2 -1.747 -6.036 -12.016 1.00 1.49 C ATOM 23 CG2 VAL A 2 -1.223 -7.340 -14.088 1.00 1.42 C ATOM 0 H VAL A 2 0.284 -9.309 -13.134 1.00 0.54 H new ATOM 0 HA VAL A 2 0.884 -6.616 -12.421 1.00 0.54 H new ATOM 0 HB VAL A 2 -1.730 -8.160 -12.187 1.00 0.65 H new ATOM 0 HG11 VAL A 2 -2.777 -5.938 -12.359 1.00 1.49 H new ATOM 0 HG12 VAL A 2 -1.728 -6.065 -10.927 1.00 1.49 H new ATOM 0 HG13 VAL A 2 -1.165 -5.183 -12.366 1.00 1.49 H new ATOM 0 HG21 VAL A 2 -2.260 -7.223 -14.403 1.00 1.42 H new ATOM 0 HG22 VAL A 2 -0.627 -6.522 -14.492 1.00 1.42 H new ATOM 0 HG23 VAL A 2 -0.836 -8.289 -14.460 1.00 1.42 H new ATOM 33 N ALA A 3 1.246 -6.809 -9.974 1.00 0.43 N ATOM 34 CA ALA A 3 1.399 -6.789 -8.524 1.00 0.40 C ATOM 35 C ALA A 3 0.507 -5.730 -7.881 1.00 0.33 C ATOM 36 O ALA A 3 0.462 -4.583 -8.335 1.00 0.37 O ATOM 37 CB ALA A 3 2.856 -6.543 -8.168 1.00 0.48 C ATOM 0 H ALA A 3 1.888 -6.192 -10.471 1.00 0.43 H new ATOM 0 HA ALA A 3 1.089 -7.758 -8.134 1.00 0.40 H new ATOM 0 HB1 ALA A 3 2.968 -6.528 -7.084 1.00 0.48 H new ATOM 0 HB2 ALA A 3 3.472 -7.339 -8.586 1.00 0.48 H new ATOM 0 HB3 ALA A 3 3.174 -5.585 -8.579 1.00 0.48 H new ATOM 43 N TYR A 4 -0.210 -6.122 -6.824 1.00 0.38 N ATOM 44 CA TYR A 4 -1.108 -5.206 -6.128 1.00 0.48 C ATOM 45 C TYR A 4 -0.540 -4.764 -4.789 1.00 0.46 C ATOM 46 O TYR A 4 -0.566 -5.512 -3.810 1.00 0.72 O ATOM 47 CB TYR A 4 -2.472 -5.860 -5.926 1.00 0.79 C ATOM 48 CG TYR A 4 -3.203 -6.175 -7.215 1.00 2.03 C ATOM 49 CD1 TYR A 4 -2.680 -7.072 -8.138 1.00 3.01 C ATOM 50 CD2 TYR A 4 -4.418 -5.568 -7.509 1.00 2.70 C ATOM 51 CE1 TYR A 4 -3.345 -7.355 -9.317 1.00 4.21 C ATOM 52 CE2 TYR A 4 -5.090 -5.847 -8.685 1.00 3.83 C ATOM 53 CZ TYR A 4 -4.550 -6.741 -9.583 1.00 4.50 C ATOM 54 OH TYR A 4 -5.216 -7.021 -10.754 1.00 5.73 O ATOM 0 H TYR A 4 -0.184 -7.065 -6.435 1.00 0.38 H new ATOM 0 HA TYR A 4 -1.218 -4.318 -6.750 1.00 0.48 H new ATOM 0 HB2 TYR A 4 -2.341 -6.782 -5.360 1.00 0.79 H new ATOM 0 HB3 TYR A 4 -3.093 -5.200 -5.320 1.00 0.79 H new ATOM 0 HD1 TYR A 4 -1.737 -7.557 -7.931 1.00 3.01 H new ATOM 0 HD2 TYR A 4 -4.845 -4.867 -6.807 1.00 2.70 H new ATOM 0 HE1 TYR A 4 -2.923 -8.053 -10.025 1.00 4.21 H new ATOM 0 HE2 TYR A 4 -6.033 -5.366 -8.898 1.00 3.83 H new ATOM 0 HH TYR A 4 -6.049 -6.507 -10.787 1.00 5.73 H new ATOM 64 N ILE A 5 -0.019 -3.541 -4.770 1.00 0.40 N ATOM 65 CA ILE A 5 0.576 -2.957 -3.576 1.00 0.45 C ATOM 66 C ILE A 5 -0.273 -1.816 -3.018 1.00 0.44 C ATOM 67 O ILE A 5 -0.950 -1.102 -3.760 1.00 0.57 O ATOM 68 CB ILE A 5 1.979 -2.395 -3.880 1.00 0.55 C ATOM 69 CG1 ILE A 5 2.492 -2.944 -5.213 1.00 0.52 C ATOM 70 CG2 ILE A 5 2.940 -2.733 -2.748 1.00 0.93 C ATOM 71 CD1 ILE A 5 3.879 -2.468 -5.566 1.00 0.79 C ATOM 0 H ILE A 5 0.002 -2.927 -5.584 1.00 0.40 H new ATOM 0 HA ILE A 5 0.637 -3.759 -2.840 1.00 0.45 H new ATOM 0 HB ILE A 5 1.914 -1.310 -3.960 1.00 0.55 H new ATOM 0 HG12 ILE A 5 2.489 -4.033 -5.173 1.00 0.52 H new ATOM 0 HG13 ILE A 5 1.804 -2.652 -6.006 1.00 0.52 H new ATOM 0 HG21 ILE A 5 3.927 -2.330 -2.976 1.00 0.93 H new ATOM 0 HG22 ILE A 5 2.575 -2.296 -1.818 1.00 0.93 H new ATOM 0 HG23 ILE A 5 3.007 -3.815 -2.638 1.00 0.93 H new ATOM 0 HD11 ILE A 5 4.178 -2.896 -6.523 1.00 0.79 H new ATOM 0 HD12 ILE A 5 3.883 -1.380 -5.638 1.00 0.79 H new ATOM 0 HD13 ILE A 5 4.580 -2.783 -4.793 1.00 0.79 H new ATOM 83 N ALA A 6 -0.201 -1.638 -1.708 1.00 0.48 N ATOM 84 CA ALA A 6 -0.921 -0.567 -1.023 1.00 0.51 C ATOM 85 C ALA A 6 0.079 0.401 -0.398 1.00 0.46 C ATOM 86 O ALA A 6 0.858 0.016 0.471 1.00 0.58 O ATOM 87 CB ALA A 6 -1.847 -1.137 0.042 1.00 0.71 C ATOM 0 H ALA A 6 0.355 -2.228 -1.089 1.00 0.48 H new ATOM 0 HA ALA A 6 -1.533 -0.031 -1.749 1.00 0.51 H new ATOM 0 HB1 ALA A 6 -2.373 -0.323 0.540 1.00 0.71 H new ATOM 0 HB2 ALA A 6 -2.571 -1.805 -0.425 1.00 0.71 H new ATOM 0 HB3 ALA A 6 -1.261 -1.692 0.775 1.00 0.71 H new ATOM 93 N ILE A 7 0.078 1.647 -0.864 1.00 0.44 N ATOM 94 CA ILE A 7 1.020 2.650 -0.368 1.00 0.43 C ATOM 95 C ILE A 7 0.404 3.556 0.700 1.00 0.49 C ATOM 96 O ILE A 7 -0.776 3.898 0.632 1.00 0.58 O ATOM 97 CB ILE A 7 1.542 3.517 -1.530 1.00 0.47 C ATOM 98 CG1 ILE A 7 2.579 4.525 -1.032 1.00 1.19 C ATOM 99 CG2 ILE A 7 0.386 4.234 -2.217 1.00 1.41 C ATOM 100 CD1 ILE A 7 3.207 5.338 -2.145 1.00 1.42 C ATOM 0 H ILE A 7 -0.562 1.987 -1.582 1.00 0.44 H new ATOM 0 HA ILE A 7 1.844 2.104 0.092 1.00 0.43 H new ATOM 0 HB ILE A 7 2.026 2.863 -2.256 1.00 0.47 H new ATOM 0 HG12 ILE A 7 2.106 5.201 -0.320 1.00 1.19 H new ATOM 0 HG13 ILE A 7 3.363 3.993 -0.493 1.00 1.19 H new ATOM 0 HG21 ILE A 7 0.770 4.843 -3.036 1.00 1.41 H new ATOM 0 HG22 ILE A 7 -0.316 3.499 -2.610 1.00 1.41 H new ATOM 0 HG23 ILE A 7 -0.124 4.874 -1.497 1.00 1.41 H new ATOM 0 HD11 ILE A 7 3.933 6.033 -1.723 1.00 1.42 H new ATOM 0 HD12 ILE A 7 3.709 4.670 -2.845 1.00 1.42 H new ATOM 0 HD13 ILE A 7 2.432 5.897 -2.669 1.00 1.42 H new ATOM 112 N GLY A 8 1.224 3.945 1.680 1.00 0.57 N ATOM 113 CA GLY A 8 0.765 4.816 2.752 1.00 0.69 C ATOM 114 C GLY A 8 1.818 5.838 3.161 1.00 0.68 C ATOM 115 O GLY A 8 3.011 5.536 3.152 1.00 0.77 O ATOM 0 H GLY A 8 2.204 3.669 1.749 1.00 0.57 H new ATOM 0 HA2 GLY A 8 -0.138 5.337 2.432 1.00 0.69 H new ATOM 0 HA3 GLY A 8 0.494 4.211 3.617 1.00 0.69 H new ATOM 119 N SER A 9 1.384 7.053 3.509 1.00 0.70 N ATOM 120 CA SER A 9 2.313 8.115 3.908 1.00 0.75 C ATOM 121 C SER A 9 1.667 9.102 4.889 1.00 0.87 C ATOM 122 O SER A 9 0.446 9.296 4.885 1.00 0.92 O ATOM 123 CB SER A 9 2.797 8.865 2.670 1.00 0.76 C ATOM 124 OG SER A 9 3.502 8.002 1.795 1.00 1.67 O ATOM 0 H SER A 9 0.401 7.325 3.523 1.00 0.70 H new ATOM 0 HA SER A 9 3.156 7.646 4.415 1.00 0.75 H new ATOM 0 HB2 SER A 9 1.945 9.300 2.148 1.00 0.76 H new ATOM 0 HB3 SER A 9 3.442 9.690 2.970 1.00 0.76 H new ATOM 0 HG SER A 9 2.864 7.454 1.292 1.00 1.67 H new ATOM 130 N ASN A 10 2.503 9.732 5.722 1.00 1.03 N ATOM 131 CA ASN A 10 2.029 10.707 6.707 1.00 1.23 C ATOM 132 C ASN A 10 3.185 11.546 7.253 1.00 1.30 C ATOM 133 O ASN A 10 4.123 11.008 7.844 1.00 2.00 O ATOM 134 CB ASN A 10 1.335 9.993 7.867 1.00 1.55 C ATOM 135 CG ASN A 10 0.738 10.958 8.875 1.00 2.18 C ATOM 136 OD1 ASN A 10 1.408 11.879 9.346 1.00 2.66 O ATOM 137 ND2 ASN A 10 -0.523 10.743 9.226 1.00 3.02 N ATOM 0 H ASN A 10 3.512 9.583 5.732 1.00 1.03 H new ATOM 0 HA ASN A 10 1.322 11.367 6.206 1.00 1.23 H new ATOM 0 HB2 ASN A 10 0.547 9.351 7.474 1.00 1.55 H new ATOM 0 HB3 ASN A 10 2.052 9.345 8.371 1.00 1.55 H new ATOM 0 HD21 ASN A 10 -0.973 11.352 9.910 1.00 3.02 H new ATOM 0 HD22 ASN A 10 -1.043 9.969 8.812 1.00 3.02 H new ATOM 144 N LEU A 11 3.103 12.865 7.066 1.00 1.21 N ATOM 145 CA LEU A 11 4.137 13.782 7.552 1.00 1.31 C ATOM 146 C LEU A 11 3.809 15.237 7.209 1.00 1.49 C ATOM 147 O LEU A 11 4.651 15.956 6.669 1.00 1.96 O ATOM 148 CB LEU A 11 5.515 13.397 6.994 1.00 1.36 C ATOM 149 CG LEU A 11 5.546 12.929 5.533 1.00 1.66 C ATOM 150 CD1 LEU A 11 5.119 14.041 4.589 1.00 2.11 C ATOM 151 CD2 LEU A 11 6.936 12.431 5.171 1.00 2.45 C ATOM 0 H LEU A 11 2.331 13.323 6.581 1.00 1.21 H new ATOM 0 HA LEU A 11 4.164 13.694 8.638 1.00 1.31 H new ATOM 0 HB2 LEU A 11 6.177 14.257 7.093 1.00 1.36 H new ATOM 0 HB3 LEU A 11 5.928 12.604 7.617 1.00 1.36 H new ATOM 0 HG LEU A 11 4.836 12.109 5.425 1.00 1.66 H new ATOM 0 HD11 LEU A 11 5.151 13.679 3.562 1.00 2.11 H new ATOM 0 HD12 LEU A 11 4.104 14.354 4.831 1.00 2.11 H new ATOM 0 HD13 LEU A 11 5.795 14.889 4.696 1.00 2.11 H new ATOM 0 HD21 LEU A 11 6.945 12.102 4.132 1.00 2.45 H new ATOM 0 HD22 LEU A 11 7.657 13.238 5.302 1.00 2.45 H new ATOM 0 HD23 LEU A 11 7.203 11.596 5.819 1.00 2.45 H new ATOM 163 N ALA A 12 2.582 15.656 7.530 1.00 1.57 N ATOM 164 CA ALA A 12 2.118 17.022 7.258 1.00 1.79 C ATOM 165 C ALA A 12 1.788 17.190 5.779 1.00 1.71 C ATOM 166 O ALA A 12 0.713 17.668 5.421 1.00 2.29 O ATOM 167 CB ALA A 12 3.150 18.052 7.702 1.00 2.08 C ATOM 0 H ALA A 12 1.886 15.064 7.983 1.00 1.57 H new ATOM 0 HA ALA A 12 1.209 17.191 7.835 1.00 1.79 H new ATOM 0 HB1 ALA A 12 2.779 19.054 7.488 1.00 2.08 H new ATOM 0 HB2 ALA A 12 3.327 17.951 8.773 1.00 2.08 H new ATOM 0 HB3 ALA A 12 4.083 17.888 7.163 1.00 2.08 H new ATOM 173 N SER A 13 2.716 16.766 4.929 1.00 1.54 N ATOM 174 CA SER A 13 2.535 16.832 3.486 1.00 1.42 C ATOM 175 C SER A 13 2.685 15.432 2.894 1.00 1.10 C ATOM 176 O SER A 13 3.655 15.145 2.194 1.00 1.17 O ATOM 177 CB SER A 13 3.553 17.788 2.859 1.00 1.72 C ATOM 178 OG SER A 13 3.397 17.851 1.453 1.00 2.45 O ATOM 0 H SER A 13 3.610 16.369 5.220 1.00 1.54 H new ATOM 0 HA SER A 13 1.537 17.211 3.268 1.00 1.42 H new ATOM 0 HB2 SER A 13 3.432 18.784 3.286 1.00 1.72 H new ATOM 0 HB3 SER A 13 4.563 17.458 3.101 1.00 1.72 H new ATOM 0 HG SER A 13 3.944 18.581 1.096 1.00 2.45 H new ATOM 184 N PRO A 14 1.728 14.533 3.194 1.00 0.96 N ATOM 185 CA PRO A 14 1.753 13.145 2.720 1.00 0.92 C ATOM 186 C PRO A 14 1.978 13.026 1.219 1.00 0.86 C ATOM 187 O PRO A 14 2.402 11.979 0.734 1.00 0.90 O ATOM 188 CB PRO A 14 0.368 12.597 3.097 1.00 1.18 C ATOM 189 CG PRO A 14 -0.435 13.780 3.528 1.00 1.23 C ATOM 190 CD PRO A 14 0.552 14.785 4.037 1.00 1.14 C ATOM 0 HA PRO A 14 2.581 12.596 3.168 1.00 0.92 H new ATOM 0 HB2 PRO A 14 -0.098 12.096 2.249 1.00 1.18 H new ATOM 0 HB3 PRO A 14 0.443 11.862 3.899 1.00 1.18 H new ATOM 0 HG2 PRO A 14 -1.011 14.185 2.696 1.00 1.23 H new ATOM 0 HG3 PRO A 14 -1.148 13.505 4.305 1.00 1.23 H new ATOM 0 HD2 PRO A 14 0.185 15.805 3.927 1.00 1.14 H new ATOM 0 HD3 PRO A 14 0.772 14.638 5.094 1.00 1.14 H new ATOM 198 N LEU A 15 1.694 14.095 0.482 1.00 0.89 N ATOM 199 CA LEU A 15 1.875 14.085 -0.964 1.00 0.90 C ATOM 200 C LEU A 15 3.345 13.879 -1.324 1.00 0.84 C ATOM 201 O LEU A 15 3.668 13.267 -2.343 1.00 0.84 O ATOM 202 CB LEU A 15 1.365 15.392 -1.577 1.00 1.07 C ATOM 203 CG LEU A 15 1.473 15.482 -3.102 1.00 1.33 C ATOM 204 CD1 LEU A 15 0.648 14.389 -3.764 1.00 1.67 C ATOM 205 CD2 LEU A 15 1.028 16.855 -3.587 1.00 1.72 C ATOM 0 H LEU A 15 1.340 14.974 0.860 1.00 0.89 H new ATOM 0 HA LEU A 15 1.297 13.255 -1.371 1.00 0.90 H new ATOM 0 HB2 LEU A 15 0.321 15.524 -1.294 1.00 1.07 H new ATOM 0 HB3 LEU A 15 1.921 16.221 -1.140 1.00 1.07 H new ATOM 0 HG LEU A 15 2.517 15.339 -3.381 1.00 1.33 H new ATOM 0 HD11 LEU A 15 0.738 14.471 -4.847 1.00 1.67 H new ATOM 0 HD12 LEU A 15 1.012 13.413 -3.442 1.00 1.67 H new ATOM 0 HD13 LEU A 15 -0.398 14.499 -3.478 1.00 1.67 H new ATOM 0 HD21 LEU A 15 1.111 16.902 -4.673 1.00 1.72 H new ATOM 0 HD22 LEU A 15 -0.008 17.026 -3.295 1.00 1.72 H new ATOM 0 HD23 LEU A 15 1.662 17.621 -3.141 1.00 1.72 H new ATOM 217 N GLU A 16 4.233 14.398 -0.481 1.00 0.86 N ATOM 218 CA GLU A 16 5.667 14.277 -0.706 1.00 0.88 C ATOM 219 C GLU A 16 6.161 12.866 -0.397 1.00 0.76 C ATOM 220 O GLU A 16 6.924 12.285 -1.168 1.00 0.75 O ATOM 221 CB GLU A 16 6.426 15.290 0.153 1.00 1.05 C ATOM 222 CG GLU A 16 6.051 16.737 -0.135 1.00 1.40 C ATOM 223 CD GLU A 16 6.816 17.724 0.726 1.00 1.82 C ATOM 224 OE1 GLU A 16 7.646 17.277 1.547 1.00 2.49 O ATOM 225 OE2 GLU A 16 6.588 18.944 0.579 1.00 2.16 O ATOM 0 H GLU A 16 3.982 14.908 0.366 1.00 0.86 H new ATOM 0 HA GLU A 16 5.856 14.482 -1.760 1.00 0.88 H new ATOM 0 HB2 GLU A 16 6.235 15.077 1.205 1.00 1.05 H new ATOM 0 HB3 GLU A 16 7.496 15.162 -0.009 1.00 1.05 H new ATOM 0 HG2 GLU A 16 6.241 16.955 -1.186 1.00 1.40 H new ATOM 0 HG3 GLU A 16 4.982 16.870 0.030 1.00 1.40 H new ATOM 232 N GLN A 17 5.726 12.320 0.735 1.00 0.73 N ATOM 233 CA GLN A 17 6.134 10.979 1.139 1.00 0.71 C ATOM 234 C GLN A 17 5.613 9.935 0.159 1.00 0.57 C ATOM 235 O GLN A 17 6.383 9.134 -0.372 1.00 0.51 O ATOM 236 CB GLN A 17 5.644 10.670 2.553 1.00 0.86 C ATOM 237 CG GLN A 17 6.162 9.351 3.104 1.00 1.20 C ATOM 238 CD GLN A 17 7.677 9.317 3.251 1.00 1.35 C ATOM 239 OE1 GLN A 17 8.338 10.435 2.965 1.00 2.20 O flip ATOM 240 NE2 GLN A 17 8.250 8.298 3.633 1.00 1.36 N flip ATOM 0 H GLN A 17 5.093 12.784 1.387 1.00 0.73 H new ATOM 0 HA GLN A 17 7.223 10.942 1.133 1.00 0.71 H new ATOM 0 HB2 GLN A 17 5.950 11.477 3.219 1.00 0.86 H new ATOM 0 HB3 GLN A 17 4.554 10.651 2.555 1.00 0.86 H new ATOM 0 HG2 GLN A 17 5.705 9.166 4.076 1.00 1.20 H new ATOM 0 HG3 GLN A 17 5.849 8.541 2.445 1.00 1.20 H new ATOM 0 HE21 GLN A 17 7.711 7.458 3.843 1.00 1.36 H new ATOM 0 HE22 GLN A 17 9.264 8.293 3.739 1.00 1.36 H new ATOM 249 N VAL A 18 4.306 9.953 -0.082 1.00 0.57 N ATOM 250 CA VAL A 18 3.697 9.012 -1.017 1.00 0.53 C ATOM 251 C VAL A 18 4.481 9.004 -2.323 1.00 0.49 C ATOM 252 O VAL A 18 4.686 7.958 -2.936 1.00 0.51 O ATOM 253 CB VAL A 18 2.220 9.364 -1.304 1.00 0.62 C ATOM 254 CG1 VAL A 18 2.104 10.741 -1.941 1.00 1.10 C ATOM 255 CG2 VAL A 18 1.578 8.309 -2.189 1.00 1.25 C ATOM 0 H VAL A 18 3.652 10.603 0.353 1.00 0.57 H new ATOM 0 HA VAL A 18 3.724 8.024 -0.558 1.00 0.53 H new ATOM 0 HB VAL A 18 1.687 9.384 -0.353 1.00 0.62 H new ATOM 0 HG11 VAL A 18 1.055 10.966 -2.133 1.00 1.10 H new ATOM 0 HG12 VAL A 18 2.518 11.490 -1.266 1.00 1.10 H new ATOM 0 HG13 VAL A 18 2.656 10.755 -2.881 1.00 1.10 H new ATOM 0 HG21 VAL A 18 0.538 8.577 -2.378 1.00 1.25 H new ATOM 0 HG22 VAL A 18 2.116 8.251 -3.135 1.00 1.25 H new ATOM 0 HG23 VAL A 18 1.618 7.341 -1.689 1.00 1.25 H new ATOM 265 N ASN A 19 4.936 10.188 -2.723 1.00 0.52 N ATOM 266 CA ASN A 19 5.719 10.351 -3.939 1.00 0.57 C ATOM 267 C ASN A 19 7.021 9.568 -3.844 1.00 0.50 C ATOM 268 O ASN A 19 7.469 8.969 -4.820 1.00 0.52 O ATOM 269 CB ASN A 19 6.021 11.830 -4.157 1.00 0.72 C ATOM 270 CG ASN A 19 6.759 12.092 -5.452 1.00 1.26 C ATOM 271 OD1 ASN A 19 7.860 11.588 -5.669 1.00 1.96 O ATOM 272 ND2 ASN A 19 6.156 12.888 -6.323 1.00 1.71 N ATOM 0 H ASN A 19 4.772 11.057 -2.214 1.00 0.52 H new ATOM 0 HA ASN A 19 5.144 9.968 -4.782 1.00 0.57 H new ATOM 0 HB2 ASN A 19 5.087 12.391 -4.157 1.00 0.72 H new ATOM 0 HB3 ASN A 19 6.616 12.202 -3.323 1.00 0.72 H new ATOM 0 HD21 ASN A 19 6.605 13.103 -7.213 1.00 1.71 H new ATOM 0 HD22 ASN A 19 5.243 13.285 -6.103 1.00 1.71 H new ATOM 279 N ALA A 20 7.621 9.579 -2.657 1.00 0.49 N ATOM 280 CA ALA A 20 8.871 8.868 -2.419 1.00 0.49 C ATOM 281 C ALA A 20 8.766 7.429 -2.904 1.00 0.42 C ATOM 282 O ALA A 20 9.576 6.968 -3.714 1.00 0.48 O ATOM 283 CB ALA A 20 9.226 8.907 -0.939 1.00 0.57 C ATOM 0 H ALA A 20 7.259 10.075 -1.843 1.00 0.49 H new ATOM 0 HA ALA A 20 9.664 9.362 -2.980 1.00 0.49 H new ATOM 0 HB1 ALA A 20 10.162 8.372 -0.775 1.00 0.57 H new ATOM 0 HB2 ALA A 20 9.339 9.943 -0.619 1.00 0.57 H new ATOM 0 HB3 ALA A 20 8.432 8.434 -0.362 1.00 0.57 H new ATOM 289 N ALA A 21 7.746 6.728 -2.424 1.00 0.41 N ATOM 290 CA ALA A 21 7.527 5.348 -2.832 1.00 0.45 C ATOM 291 C ALA A 21 7.123 5.306 -4.297 1.00 0.36 C ATOM 292 O ALA A 21 7.333 4.309 -4.982 1.00 0.40 O ATOM 293 CB ALA A 21 6.463 4.688 -1.969 1.00 0.64 C ATOM 0 H ALA A 21 7.063 7.089 -1.758 1.00 0.41 H new ATOM 0 HA ALA A 21 8.456 4.793 -2.700 1.00 0.45 H new ATOM 0 HB1 ALA A 21 6.318 3.658 -2.294 1.00 0.64 H new ATOM 0 HB2 ALA A 21 6.782 4.698 -0.927 1.00 0.64 H new ATOM 0 HB3 ALA A 21 5.525 5.234 -2.067 1.00 0.64 H new ATOM 299 N LEU A 22 6.550 6.412 -4.770 1.00 0.40 N ATOM 300 CA LEU A 22 6.126 6.524 -6.159 1.00 0.47 C ATOM 301 C LEU A 22 7.331 6.722 -7.069 1.00 0.44 C ATOM 302 O LEU A 22 7.262 6.464 -8.272 1.00 0.53 O ATOM 303 CB LEU A 22 5.134 7.680 -6.324 1.00 0.64 C ATOM 304 CG LEU A 22 3.754 7.449 -5.701 1.00 1.16 C ATOM 305 CD1 LEU A 22 2.862 8.663 -5.915 1.00 1.74 C ATOM 306 CD2 LEU A 22 3.105 6.203 -6.287 1.00 1.73 C ATOM 0 H LEU A 22 6.370 7.244 -4.207 1.00 0.40 H new ATOM 0 HA LEU A 22 5.627 5.598 -6.444 1.00 0.47 H new ATOM 0 HB2 LEU A 22 5.569 8.577 -5.882 1.00 0.64 H new ATOM 0 HB3 LEU A 22 5.006 7.879 -7.388 1.00 0.64 H new ATOM 0 HG LEU A 22 3.882 7.299 -4.629 1.00 1.16 H new ATOM 0 HD11 LEU A 22 1.886 8.481 -5.466 1.00 1.74 H new ATOM 0 HD12 LEU A 22 3.318 9.536 -5.449 1.00 1.74 H new ATOM 0 HD13 LEU A 22 2.742 8.843 -6.983 1.00 1.74 H new ATOM 0 HD21 LEU A 22 2.125 6.055 -5.832 1.00 1.73 H new ATOM 0 HD22 LEU A 22 2.991 6.325 -7.364 1.00 1.73 H new ATOM 0 HD23 LEU A 22 3.734 5.336 -6.085 1.00 1.73 H new ATOM 318 N LYS A 23 8.442 7.163 -6.484 1.00 0.43 N ATOM 319 CA LYS A 23 9.671 7.372 -7.239 1.00 0.52 C ATOM 320 C LYS A 23 10.291 6.030 -7.592 1.00 0.47 C ATOM 321 O LYS A 23 10.678 5.791 -8.737 1.00 0.56 O ATOM 322 CB LYS A 23 10.665 8.214 -6.435 1.00 0.61 C ATOM 323 CG LYS A 23 10.222 9.653 -6.225 1.00 1.13 C ATOM 324 CD LYS A 23 11.243 10.435 -5.415 1.00 1.51 C ATOM 325 CE LYS A 23 10.841 11.894 -5.265 1.00 2.12 C ATOM 326 NZ LYS A 23 10.723 12.576 -6.582 1.00 2.74 N ATOM 0 H LYS A 23 8.515 7.382 -5.490 1.00 0.43 H new ATOM 0 HA LYS A 23 9.429 7.910 -8.155 1.00 0.52 H new ATOM 0 HB2 LYS A 23 10.820 7.746 -5.463 1.00 0.61 H new ATOM 0 HB3 LYS A 23 11.627 8.211 -6.947 1.00 0.61 H new ATOM 0 HG2 LYS A 23 10.076 10.135 -7.192 1.00 1.13 H new ATOM 0 HG3 LYS A 23 9.260 9.668 -5.713 1.00 1.13 H new ATOM 0 HD2 LYS A 23 11.349 9.983 -4.429 1.00 1.51 H new ATOM 0 HD3 LYS A 23 12.217 10.374 -5.900 1.00 1.51 H new ATOM 0 HE2 LYS A 23 9.889 11.956 -4.738 1.00 2.12 H new ATOM 0 HE3 LYS A 23 11.579 12.413 -4.653 1.00 2.12 H new ATOM 0 HZ1 LYS A 23 10.718 13.606 -6.440 1.00 2.74 H new ATOM 0 HZ2 LYS A 23 11.530 12.313 -7.183 1.00 2.74 H new ATOM 0 HZ3 LYS A 23 9.838 12.286 -7.045 1.00 2.74 H new ATOM 340 N ALA A 24 10.371 5.150 -6.598 1.00 0.40 N ATOM 341 CA ALA A 24 10.926 3.821 -6.802 1.00 0.43 C ATOM 342 C ALA A 24 9.921 2.923 -7.507 1.00 0.38 C ATOM 343 O ALA A 24 10.268 2.203 -8.442 1.00 0.46 O ATOM 344 CB ALA A 24 11.344 3.206 -5.476 1.00 0.51 C ATOM 0 H ALA A 24 10.058 5.336 -5.645 1.00 0.40 H new ATOM 0 HA ALA A 24 11.809 3.915 -7.434 1.00 0.43 H new ATOM 0 HB1 ALA A 24 11.757 2.212 -5.650 1.00 0.51 H new ATOM 0 HB2 ALA A 24 12.099 3.835 -5.005 1.00 0.51 H new ATOM 0 HB3 ALA A 24 10.476 3.129 -4.821 1.00 0.51 H new ATOM 350 N LEU A 25 8.669 2.977 -7.059 1.00 0.43 N ATOM 351 CA LEU A 25 7.612 2.171 -7.655 1.00 0.40 C ATOM 352 C LEU A 25 7.401 2.574 -9.108 1.00 0.37 C ATOM 353 O LEU A 25 7.265 1.720 -9.985 1.00 0.45 O ATOM 354 CB LEU A 25 6.301 2.326 -6.883 1.00 0.47 C ATOM 355 CG LEU A 25 5.224 1.310 -7.238 1.00 0.56 C ATOM 356 CD1 LEU A 25 5.670 -0.084 -6.836 1.00 0.96 C ATOM 357 CD2 LEU A 25 3.918 1.667 -6.556 1.00 1.04 C ATOM 0 H LEU A 25 8.364 3.570 -6.287 1.00 0.43 H new ATOM 0 HA LEU A 25 7.919 1.126 -7.609 1.00 0.40 H new ATOM 0 HB2 LEU A 25 6.513 2.251 -5.817 1.00 0.47 H new ATOM 0 HB3 LEU A 25 5.908 3.327 -7.060 1.00 0.47 H new ATOM 0 HG LEU A 25 5.065 1.328 -8.316 1.00 0.56 H new ATOM 0 HD11 LEU A 25 4.893 -0.803 -7.094 1.00 0.96 H new ATOM 0 HD12 LEU A 25 6.589 -0.338 -7.364 1.00 0.96 H new ATOM 0 HD13 LEU A 25 5.849 -0.113 -5.761 1.00 0.96 H new ATOM 0 HD21 LEU A 25 3.157 0.932 -6.819 1.00 1.04 H new ATOM 0 HD22 LEU A 25 4.061 1.671 -5.475 1.00 1.04 H new ATOM 0 HD23 LEU A 25 3.595 2.656 -6.883 1.00 1.04 H new ATOM 369 N GLY A 26 7.386 3.884 -9.354 1.00 0.43 N ATOM 370 CA GLY A 26 7.206 4.381 -10.705 1.00 0.53 C ATOM 371 C GLY A 26 8.159 3.708 -11.666 1.00 0.56 C ATOM 372 O GLY A 26 7.764 3.277 -12.750 1.00 0.82 O ATOM 0 H GLY A 26 7.495 4.606 -8.642 1.00 0.43 H new ATOM 0 HA2 GLY A 26 6.179 4.207 -11.026 1.00 0.53 H new ATOM 0 HA3 GLY A 26 7.367 5.459 -10.723 1.00 0.53 H new ATOM 376 N ASP A 27 9.415 3.593 -11.249 1.00 0.59 N ATOM 377 CA ASP A 27 10.431 2.940 -12.057 1.00 0.76 C ATOM 378 C ASP A 27 11.180 1.909 -11.221 1.00 0.56 C ATOM 379 O ASP A 27 12.066 2.249 -10.436 1.00 0.81 O ATOM 380 CB ASP A 27 11.407 3.974 -12.616 1.00 1.35 C ATOM 381 CG ASP A 27 12.501 3.344 -13.455 1.00 2.02 C ATOM 382 OD1 ASP A 27 12.172 2.690 -14.467 1.00 2.42 O ATOM 383 OD2 ASP A 27 13.689 3.503 -13.099 1.00 2.61 O ATOM 0 H ASP A 27 9.752 3.946 -10.353 1.00 0.59 H new ATOM 0 HA ASP A 27 9.945 2.433 -12.890 1.00 0.76 H new ATOM 0 HB2 ASP A 27 10.859 4.696 -13.222 1.00 1.35 H new ATOM 0 HB3 ASP A 27 11.858 4.526 -11.792 1.00 1.35 H new ATOM 388 N ILE A 28 10.817 0.647 -11.404 1.00 0.51 N ATOM 389 CA ILE A 28 11.441 -0.455 -10.683 1.00 0.51 C ATOM 390 C ILE A 28 12.247 -1.315 -11.648 1.00 0.49 C ATOM 391 O ILE A 28 11.853 -1.468 -12.803 1.00 0.48 O ATOM 392 CB ILE A 28 10.376 -1.340 -9.997 1.00 0.71 C ATOM 393 CG1 ILE A 28 9.321 -0.468 -9.310 1.00 0.82 C ATOM 394 CG2 ILE A 28 11.013 -2.282 -8.988 1.00 0.83 C ATOM 395 CD1 ILE A 28 8.270 -1.258 -8.558 1.00 1.26 C ATOM 0 H ILE A 28 10.085 0.359 -12.053 1.00 0.51 H new ATOM 0 HA ILE A 28 12.096 -0.031 -9.922 1.00 0.51 H new ATOM 0 HB ILE A 28 9.893 -1.942 -10.767 1.00 0.71 H new ATOM 0 HG12 ILE A 28 9.819 0.209 -8.616 1.00 0.82 H new ATOM 0 HG13 ILE A 28 8.829 0.150 -10.061 1.00 0.82 H new ATOM 0 HG21 ILE A 28 10.240 -2.892 -8.521 1.00 0.83 H new ATOM 0 HG22 ILE A 28 11.729 -2.929 -9.496 1.00 0.83 H new ATOM 0 HG23 ILE A 28 11.528 -1.701 -8.223 1.00 0.83 H new ATOM 0 HD11 ILE A 28 7.559 -0.572 -8.099 1.00 1.26 H new ATOM 0 HD12 ILE A 28 7.745 -1.916 -9.250 1.00 1.26 H new ATOM 0 HD13 ILE A 28 8.750 -1.856 -7.783 1.00 1.26 H new ATOM 407 N PRO A 29 13.380 -1.889 -11.196 1.00 0.68 N ATOM 408 CA PRO A 29 14.233 -2.742 -12.012 1.00 0.83 C ATOM 409 C PRO A 29 13.516 -3.417 -13.184 1.00 0.70 C ATOM 410 O PRO A 29 14.035 -3.442 -14.300 1.00 0.88 O ATOM 411 CB PRO A 29 14.671 -3.774 -10.985 1.00 1.07 C ATOM 412 CG PRO A 29 14.823 -2.999 -9.711 1.00 1.14 C ATOM 413 CD PRO A 29 13.948 -1.768 -9.836 1.00 0.87 C ATOM 0 HA PRO A 29 15.032 -2.185 -12.502 1.00 0.83 H new ATOM 0 HB2 PRO A 29 13.931 -4.568 -10.880 1.00 1.07 H new ATOM 0 HB3 PRO A 29 15.609 -4.248 -11.275 1.00 1.07 H new ATOM 0 HG2 PRO A 29 14.521 -3.602 -8.854 1.00 1.14 H new ATOM 0 HG3 PRO A 29 15.864 -2.718 -9.552 1.00 1.14 H new ATOM 0 HD2 PRO A 29 13.168 -1.750 -9.075 1.00 0.87 H new ATOM 0 HD3 PRO A 29 14.526 -0.851 -9.722 1.00 0.87 H new ATOM 421 N GLU A 30 12.328 -3.971 -12.932 1.00 0.54 N ATOM 422 CA GLU A 30 11.571 -4.647 -13.985 1.00 0.58 C ATOM 423 C GLU A 30 10.071 -4.368 -13.884 1.00 0.60 C ATOM 424 O GLU A 30 9.279 -4.937 -14.634 1.00 1.01 O ATOM 425 CB GLU A 30 11.810 -6.157 -13.917 1.00 0.62 C ATOM 426 CG GLU A 30 13.278 -6.546 -13.921 1.00 0.63 C ATOM 427 CD GLU A 30 13.481 -8.049 -13.934 1.00 1.39 C ATOM 428 OE1 GLU A 30 13.013 -8.703 -14.888 1.00 1.66 O ATOM 429 OE2 GLU A 30 14.109 -8.570 -12.988 1.00 2.35 O ATOM 0 H GLU A 30 11.874 -3.965 -12.018 1.00 0.54 H new ATOM 0 HA GLU A 30 11.924 -4.254 -14.939 1.00 0.58 H new ATOM 0 HB2 GLU A 30 11.342 -6.549 -13.014 1.00 0.62 H new ATOM 0 HB3 GLU A 30 11.315 -6.632 -14.764 1.00 0.62 H new ATOM 0 HG2 GLU A 30 13.764 -6.110 -14.794 1.00 0.63 H new ATOM 0 HG3 GLU A 30 13.765 -6.125 -13.041 1.00 0.63 H new ATOM 436 N SER A 31 9.679 -3.507 -12.948 1.00 0.36 N ATOM 437 CA SER A 31 8.263 -3.183 -12.754 1.00 0.34 C ATOM 438 C SER A 31 7.907 -1.828 -13.360 1.00 0.36 C ATOM 439 O SER A 31 8.789 -1.041 -13.702 1.00 0.46 O ATOM 440 CB SER A 31 7.938 -3.168 -11.264 1.00 0.37 C ATOM 441 OG SER A 31 8.533 -4.269 -10.601 1.00 0.83 O ATOM 0 H SER A 31 10.315 -3.023 -12.315 1.00 0.36 H new ATOM 0 HA SER A 31 7.675 -3.948 -13.260 1.00 0.34 H new ATOM 0 HB2 SER A 31 8.293 -2.238 -10.821 1.00 0.37 H new ATOM 0 HB3 SER A 31 6.857 -3.196 -11.124 1.00 0.37 H new ATOM 0 HG SER A 31 8.592 -4.080 -9.641 1.00 0.83 H new ATOM 447 N HIS A 32 6.602 -1.553 -13.473 1.00 0.33 N ATOM 448 CA HIS A 32 6.141 -0.277 -14.019 1.00 0.39 C ATOM 449 C HIS A 32 4.709 0.032 -13.593 1.00 0.34 C ATOM 450 O HIS A 32 3.807 -0.795 -13.747 1.00 0.36 O ATOM 451 CB HIS A 32 6.249 -0.255 -15.545 1.00 0.51 C ATOM 452 CG HIS A 32 5.552 -1.388 -16.228 1.00 0.94 C ATOM 453 ND1 HIS A 32 5.913 -2.708 -16.059 1.00 1.83 N ATOM 454 CD2 HIS A 32 4.511 -1.393 -17.095 1.00 1.60 C ATOM 455 CE1 HIS A 32 5.125 -3.474 -16.794 1.00 2.29 C ATOM 456 NE2 HIS A 32 4.266 -2.702 -17.430 1.00 2.07 N ATOM 0 H HIS A 32 5.856 -2.191 -13.196 1.00 0.33 H new ATOM 0 HA HIS A 32 6.793 0.496 -13.612 1.00 0.39 H new ATOM 0 HB2 HIS A 32 5.837 0.685 -15.913 1.00 0.51 H new ATOM 0 HB3 HIS A 32 7.303 -0.272 -15.823 1.00 0.51 H new ATOM 0 HD2 HIS A 32 3.974 -0.528 -17.456 1.00 1.60 H new ATOM 0 HE1 HIS A 32 5.176 -4.551 -16.862 1.00 2.29 H new ATOM 0 HE2 HIS A 32 3.538 -3.025 -18.067 1.00 2.07 H new ATOM 465 N ILE A 33 4.522 1.234 -13.054 1.00 0.36 N ATOM 466 CA ILE A 33 3.218 1.693 -12.589 1.00 0.36 C ATOM 467 C ILE A 33 2.170 1.668 -13.697 1.00 0.38 C ATOM 468 O ILE A 33 2.467 1.924 -14.864 1.00 0.50 O ATOM 469 CB ILE A 33 3.323 3.115 -11.996 1.00 0.53 C ATOM 470 CG1 ILE A 33 3.745 3.039 -10.526 1.00 0.58 C ATOM 471 CG2 ILE A 33 2.012 3.882 -12.140 1.00 0.93 C ATOM 472 CD1 ILE A 33 2.755 2.305 -9.646 1.00 1.05 C ATOM 0 H ILE A 33 5.270 1.916 -12.928 1.00 0.36 H new ATOM 0 HA ILE A 33 2.895 1.000 -11.812 1.00 0.36 H new ATOM 0 HB ILE A 33 4.082 3.660 -12.557 1.00 0.53 H new ATOM 0 HG12 ILE A 33 4.713 2.543 -10.460 1.00 0.58 H new ATOM 0 HG13 ILE A 33 3.878 4.051 -10.143 1.00 0.58 H new ATOM 0 HG21 ILE A 33 2.124 4.878 -11.712 1.00 0.93 H new ATOM 0 HG22 ILE A 33 1.755 3.968 -13.196 1.00 0.93 H new ATOM 0 HG23 ILE A 33 1.219 3.349 -11.616 1.00 0.93 H new ATOM 0 HD11 ILE A 33 3.121 2.291 -8.619 1.00 1.05 H new ATOM 0 HD12 ILE A 33 1.791 2.813 -9.681 1.00 1.05 H new ATOM 0 HD13 ILE A 33 2.639 1.282 -10.003 1.00 1.05 H new ATOM 484 N LEU A 34 0.934 1.364 -13.306 1.00 0.38 N ATOM 485 CA LEU A 34 -0.184 1.308 -14.238 1.00 0.50 C ATOM 486 C LEU A 34 -1.438 1.914 -13.614 1.00 0.46 C ATOM 487 O LEU A 34 -2.058 2.809 -14.189 1.00 0.60 O ATOM 488 CB LEU A 34 -0.453 -0.138 -14.662 1.00 0.65 C ATOM 489 CG LEU A 34 0.541 -0.720 -15.671 1.00 1.01 C ATOM 490 CD1 LEU A 34 0.156 -2.145 -16.031 1.00 1.69 C ATOM 491 CD2 LEU A 34 0.608 0.145 -16.921 1.00 1.34 C ATOM 0 H LEU A 34 0.683 1.151 -12.341 1.00 0.38 H new ATOM 0 HA LEU A 34 0.079 1.891 -15.121 1.00 0.50 H new ATOM 0 HB2 LEU A 34 -0.451 -0.767 -13.772 1.00 0.65 H new ATOM 0 HB3 LEU A 34 -1.454 -0.194 -15.090 1.00 0.65 H new ATOM 0 HG LEU A 34 1.529 -0.732 -15.211 1.00 1.01 H new ATOM 0 HD11 LEU A 34 0.872 -2.545 -16.749 1.00 1.69 H new ATOM 0 HD12 LEU A 34 0.161 -2.761 -15.132 1.00 1.69 H new ATOM 0 HD13 LEU A 34 -0.841 -2.152 -16.471 1.00 1.69 H new ATOM 0 HD21 LEU A 34 1.320 -0.287 -17.624 1.00 1.34 H new ATOM 0 HD22 LEU A 34 -0.377 0.191 -17.385 1.00 1.34 H new ATOM 0 HD23 LEU A 34 0.929 1.151 -16.651 1.00 1.34 H new ATOM 503 N THR A 35 -1.805 1.421 -12.433 1.00 0.46 N ATOM 504 CA THR A 35 -2.984 1.917 -11.729 1.00 0.43 C ATOM 505 C THR A 35 -2.613 2.484 -10.364 1.00 0.43 C ATOM 506 O THR A 35 -1.971 1.816 -9.555 1.00 0.52 O ATOM 507 CB THR A 35 -4.011 0.795 -11.567 1.00 0.49 C ATOM 508 OG1 THR A 35 -3.387 -0.387 -11.101 1.00 0.68 O ATOM 509 CG2 THR A 35 -4.743 0.460 -12.849 1.00 0.72 C ATOM 0 H THR A 35 -1.303 0.679 -11.944 1.00 0.46 H new ATOM 0 HA THR A 35 -3.419 2.720 -12.324 1.00 0.43 H new ATOM 0 HB THR A 35 -4.738 1.168 -10.846 1.00 0.49 H new ATOM 0 HG1 THR A 35 -2.438 -0.211 -10.931 1.00 0.68 H new ATOM 0 HG21 THR A 35 -5.456 -0.343 -12.662 1.00 0.72 H new ATOM 0 HG22 THR A 35 -5.276 1.342 -13.205 1.00 0.72 H new ATOM 0 HG23 THR A 35 -4.026 0.140 -13.605 1.00 0.72 H new ATOM 517 N VAL A 36 -3.023 3.724 -10.115 1.00 0.40 N ATOM 518 CA VAL A 36 -2.741 4.386 -8.847 1.00 0.46 C ATOM 519 C VAL A 36 -3.721 5.529 -8.593 1.00 0.48 C ATOM 520 O VAL A 36 -3.768 6.497 -9.354 1.00 0.56 O ATOM 521 CB VAL A 36 -1.295 4.925 -8.803 1.00 0.58 C ATOM 522 CG1 VAL A 36 -1.024 5.838 -9.990 1.00 1.32 C ATOM 523 CG2 VAL A 36 -1.035 5.654 -7.493 1.00 1.45 C ATOM 0 H VAL A 36 -3.553 4.291 -10.777 1.00 0.40 H new ATOM 0 HA VAL A 36 -2.859 3.638 -8.063 1.00 0.46 H new ATOM 0 HB VAL A 36 -0.612 4.077 -8.864 1.00 0.58 H new ATOM 0 HG11 VAL A 36 0.001 6.207 -9.939 1.00 1.32 H new ATOM 0 HG12 VAL A 36 -1.164 5.281 -10.917 1.00 1.32 H new ATOM 0 HG13 VAL A 36 -1.714 6.681 -9.966 1.00 1.32 H new ATOM 0 HG21 VAL A 36 -0.011 6.026 -7.481 1.00 1.45 H new ATOM 0 HG22 VAL A 36 -1.727 6.491 -7.399 1.00 1.45 H new ATOM 0 HG23 VAL A 36 -1.181 4.967 -6.659 1.00 1.45 H new ATOM 533 N SER A 37 -4.506 5.411 -7.523 1.00 0.45 N ATOM 534 CA SER A 37 -5.484 6.444 -7.183 1.00 0.54 C ATOM 535 C SER A 37 -6.210 6.124 -5.878 1.00 0.57 C ATOM 536 O SER A 37 -5.741 5.321 -5.071 1.00 1.08 O ATOM 537 CB SER A 37 -6.504 6.600 -8.315 1.00 0.65 C ATOM 538 OG SER A 37 -7.190 5.384 -8.555 1.00 1.28 O ATOM 0 H SER A 37 -4.485 4.618 -6.882 1.00 0.45 H new ATOM 0 HA SER A 37 -4.941 7.379 -7.049 1.00 0.54 H new ATOM 0 HB2 SER A 37 -7.220 7.381 -8.058 1.00 0.65 H new ATOM 0 HB3 SER A 37 -5.996 6.920 -9.225 1.00 0.65 H new ATOM 0 HG SER A 37 -8.157 5.539 -8.510 1.00 1.28 H new ATOM 544 N SER A 38 -7.362 6.768 -5.687 1.00 0.59 N ATOM 545 CA SER A 38 -8.182 6.577 -4.493 1.00 0.59 C ATOM 546 C SER A 38 -7.453 7.040 -3.231 1.00 0.52 C ATOM 547 O SER A 38 -7.226 6.254 -2.310 1.00 0.63 O ATOM 548 CB SER A 38 -8.609 5.109 -4.354 1.00 0.78 C ATOM 549 OG SER A 38 -9.414 4.921 -3.203 1.00 1.68 O ATOM 0 H SER A 38 -7.751 7.434 -6.354 1.00 0.59 H new ATOM 0 HA SER A 38 -9.075 7.191 -4.609 1.00 0.59 H new ATOM 0 HB2 SER A 38 -9.161 4.801 -5.242 1.00 0.78 H new ATOM 0 HB3 SER A 38 -7.725 4.474 -4.292 1.00 0.78 H new ATOM 0 HG SER A 38 -8.915 5.197 -2.406 1.00 1.68 H new ATOM 555 N PHE A 39 -7.108 8.327 -3.187 1.00 0.44 N ATOM 556 CA PHE A 39 -6.427 8.894 -2.026 1.00 0.50 C ATOM 557 C PHE A 39 -7.415 9.028 -0.873 1.00 0.57 C ATOM 558 O PHE A 39 -8.176 9.993 -0.796 1.00 0.75 O ATOM 559 CB PHE A 39 -5.819 10.263 -2.356 1.00 0.59 C ATOM 560 CG PHE A 39 -4.771 10.230 -3.439 1.00 0.59 C ATOM 561 CD1 PHE A 39 -5.061 9.726 -4.698 1.00 0.65 C ATOM 562 CD2 PHE A 39 -3.492 10.707 -3.192 1.00 0.83 C ATOM 563 CE1 PHE A 39 -4.097 9.698 -5.688 1.00 0.98 C ATOM 564 CE2 PHE A 39 -2.525 10.681 -4.179 1.00 1.19 C ATOM 565 CZ PHE A 39 -2.828 10.175 -5.428 1.00 1.26 C ATOM 0 H PHE A 39 -7.288 8.993 -3.939 1.00 0.44 H new ATOM 0 HA PHE A 39 -5.616 8.225 -1.739 1.00 0.50 H new ATOM 0 HB2 PHE A 39 -6.618 10.939 -2.660 1.00 0.59 H new ATOM 0 HB3 PHE A 39 -5.377 10.679 -1.451 1.00 0.59 H new ATOM 0 HD1 PHE A 39 -6.052 9.351 -4.907 1.00 0.65 H new ATOM 0 HD2 PHE A 39 -3.249 11.103 -2.217 1.00 0.83 H new ATOM 0 HE1 PHE A 39 -4.336 9.303 -6.664 1.00 0.98 H new ATOM 0 HE2 PHE A 39 -1.533 11.056 -3.974 1.00 1.19 H new ATOM 0 HZ PHE A 39 -2.073 10.153 -6.200 1.00 1.26 H new ATOM 575 N TYR A 40 -7.419 8.037 0.004 1.00 0.65 N ATOM 576 CA TYR A 40 -8.336 8.024 1.134 1.00 0.81 C ATOM 577 C TYR A 40 -7.711 8.619 2.392 1.00 0.71 C ATOM 578 O TYR A 40 -6.512 8.900 2.445 1.00 0.71 O ATOM 579 CB TYR A 40 -8.782 6.589 1.412 1.00 1.01 C ATOM 580 CG TYR A 40 -7.639 5.693 1.825 1.00 1.49 C ATOM 581 CD1 TYR A 40 -7.090 5.789 3.096 1.00 2.39 C ATOM 582 CD2 TYR A 40 -7.102 4.766 0.945 1.00 1.73 C ATOM 583 CE1 TYR A 40 -6.039 4.986 3.479 1.00 3.35 C ATOM 584 CE2 TYR A 40 -6.047 3.960 1.321 1.00 2.61 C ATOM 585 CZ TYR A 40 -5.519 4.076 2.589 1.00 3.41 C ATOM 586 OH TYR A 40 -4.462 3.281 2.967 1.00 4.43 O ATOM 0 H TYR A 40 -6.797 7.230 -0.044 1.00 0.65 H new ATOM 0 HA TYR A 40 -9.193 8.643 0.870 1.00 0.81 H new ATOM 0 HB2 TYR A 40 -9.537 6.593 2.198 1.00 1.01 H new ATOM 0 HB3 TYR A 40 -9.254 6.180 0.519 1.00 1.01 H new ATOM 0 HD1 TYR A 40 -7.494 6.505 3.796 1.00 2.39 H new ATOM 0 HD2 TYR A 40 -7.515 4.673 -0.049 1.00 1.73 H new ATOM 0 HE1 TYR A 40 -5.625 5.071 4.473 1.00 3.35 H new ATOM 0 HE2 TYR A 40 -5.637 3.242 0.626 1.00 2.61 H new ATOM 0 HH TYR A 40 -4.799 2.414 3.277 1.00 4.43 H new ATOM 596 N ARG A 41 -8.554 8.778 3.410 1.00 0.70 N ATOM 597 CA ARG A 41 -8.140 9.306 4.704 1.00 0.67 C ATOM 598 C ARG A 41 -8.320 8.235 5.775 1.00 0.64 C ATOM 599 O ARG A 41 -9.298 7.486 5.746 1.00 0.70 O ATOM 600 CB ARG A 41 -8.967 10.543 5.061 1.00 0.79 C ATOM 601 CG ARG A 41 -8.593 11.166 6.396 1.00 0.95 C ATOM 602 CD ARG A 41 -9.434 12.400 6.687 1.00 1.52 C ATOM 603 NE ARG A 41 -9.082 13.019 7.963 1.00 2.11 N ATOM 604 CZ ARG A 41 -7.897 13.568 8.217 1.00 2.49 C ATOM 605 NH1 ARG A 41 -6.956 13.591 7.283 1.00 2.37 N ATOM 606 NH2 ARG A 41 -7.655 14.101 9.407 1.00 3.51 N ATOM 0 H ARG A 41 -9.545 8.543 3.359 1.00 0.70 H new ATOM 0 HA ARG A 41 -7.089 9.591 4.651 1.00 0.67 H new ATOM 0 HB2 ARG A 41 -8.845 11.289 4.276 1.00 0.79 H new ATOM 0 HB3 ARG A 41 -10.022 10.270 5.081 1.00 0.79 H new ATOM 0 HG2 ARG A 41 -8.730 10.434 7.192 1.00 0.95 H new ATOM 0 HG3 ARG A 41 -7.537 11.436 6.390 1.00 0.95 H new ATOM 0 HD2 ARG A 41 -9.302 13.125 5.884 1.00 1.52 H new ATOM 0 HD3 ARG A 41 -10.489 12.125 6.697 1.00 1.52 H new ATOM 0 HE ARG A 41 -9.785 13.031 8.702 1.00 2.11 H new ATOM 0 HH11 ARG A 41 -7.139 13.187 6.365 1.00 2.37 H new ATOM 0 HH12 ARG A 41 -6.049 14.013 7.483 1.00 2.37 H new ATOM 0 HH21 ARG A 41 -8.377 14.090 10.127 1.00 3.51 H new ATOM 0 HH22 ARG A 41 -6.747 14.522 9.602 1.00 3.51 H new ATOM 620 N THR A 42 -7.381 8.152 6.709 1.00 0.80 N ATOM 621 CA THR A 42 -7.464 7.150 7.766 1.00 0.97 C ATOM 622 C THR A 42 -6.648 7.561 8.990 1.00 1.03 C ATOM 623 O THR A 42 -5.644 8.258 8.867 1.00 1.12 O ATOM 624 CB THR A 42 -6.972 5.802 7.237 1.00 1.17 C ATOM 625 OG1 THR A 42 -7.262 4.760 8.152 1.00 1.44 O ATOM 626 CG2 THR A 42 -5.483 5.768 6.970 1.00 1.32 C ATOM 0 H THR A 42 -6.562 8.758 6.758 1.00 0.80 H new ATOM 0 HA THR A 42 -8.506 7.065 8.073 1.00 0.97 H new ATOM 0 HB THR A 42 -7.501 5.659 6.295 1.00 1.17 H new ATOM 0 HG1 THR A 42 -7.150 3.894 7.708 1.00 1.44 H new ATOM 0 HG21 THR A 42 -5.203 4.783 6.597 1.00 1.32 H new ATOM 0 HG22 THR A 42 -5.229 6.523 6.226 1.00 1.32 H new ATOM 0 HG23 THR A 42 -4.943 5.973 7.894 1.00 1.32 H new ATOM 634 N PRO A 43 -7.067 7.124 10.191 1.00 1.12 N ATOM 635 CA PRO A 43 -6.358 7.441 11.433 1.00 1.31 C ATOM 636 C PRO A 43 -5.104 6.582 11.607 1.00 1.50 C ATOM 637 O PRO A 43 -5.160 5.362 11.461 1.00 1.71 O ATOM 638 CB PRO A 43 -7.391 7.110 12.508 1.00 1.48 C ATOM 639 CG PRO A 43 -8.206 6.012 11.915 1.00 1.38 C ATOM 640 CD PRO A 43 -8.258 6.281 10.434 1.00 1.15 C ATOM 0 HA PRO A 43 -6.005 8.472 11.464 1.00 1.31 H new ATOM 0 HB2 PRO A 43 -6.912 6.793 13.435 1.00 1.48 H new ATOM 0 HB3 PRO A 43 -8.007 7.977 12.747 1.00 1.48 H new ATOM 0 HG2 PRO A 43 -7.757 5.040 12.119 1.00 1.38 H new ATOM 0 HG3 PRO A 43 -9.208 5.996 12.343 1.00 1.38 H new ATOM 0 HD2 PRO A 43 -8.219 5.357 9.857 1.00 1.15 H new ATOM 0 HD3 PRO A 43 -9.177 6.795 10.152 1.00 1.15 H new ATOM 648 N PRO A 44 -3.949 7.205 11.911 1.00 1.55 N ATOM 649 CA PRO A 44 -2.686 6.489 12.092 1.00 1.80 C ATOM 650 C PRO A 44 -2.596 5.807 13.454 1.00 2.15 C ATOM 651 O PRO A 44 -2.379 6.461 14.474 1.00 2.77 O ATOM 652 CB PRO A 44 -1.618 7.592 11.976 1.00 1.80 C ATOM 653 CG PRO A 44 -2.358 8.840 11.611 1.00 1.81 C ATOM 654 CD PRO A 44 -3.764 8.646 12.093 1.00 1.54 C ATOM 0 HA PRO A 44 -2.569 5.689 11.361 1.00 1.80 H new ATOM 0 HB2 PRO A 44 -1.081 7.717 12.916 1.00 1.80 H new ATOM 0 HB3 PRO A 44 -0.877 7.341 11.217 1.00 1.80 H new ATOM 0 HG2 PRO A 44 -1.903 9.713 12.078 1.00 1.81 H new ATOM 0 HG3 PRO A 44 -2.335 9.006 10.534 1.00 1.81 H new ATOM 0 HD2 PRO A 44 -3.884 8.945 13.134 1.00 1.54 H new ATOM 0 HD3 PRO A 44 -4.479 9.227 11.510 1.00 1.54 H new ATOM 662 N LEU A 45 -2.759 4.488 13.459 1.00 2.16 N ATOM 663 CA LEU A 45 -2.692 3.710 14.690 1.00 2.52 C ATOM 664 C LEU A 45 -1.424 2.860 14.727 1.00 2.69 C ATOM 665 O LEU A 45 -1.492 1.630 14.744 1.00 3.09 O ATOM 666 CB LEU A 45 -3.928 2.816 14.831 1.00 2.75 C ATOM 667 CG LEU A 45 -5.204 3.520 15.310 1.00 3.05 C ATOM 668 CD1 LEU A 45 -5.657 4.568 14.308 1.00 3.66 C ATOM 669 CD2 LEU A 45 -6.309 2.503 15.554 1.00 3.32 C ATOM 0 H LEU A 45 -2.939 3.934 12.621 1.00 2.16 H new ATOM 0 HA LEU A 45 -2.666 4.407 15.527 1.00 2.52 H new ATOM 0 HB2 LEU A 45 -4.131 2.352 13.866 1.00 2.75 H new ATOM 0 HB3 LEU A 45 -3.695 2.011 15.528 1.00 2.75 H new ATOM 0 HG LEU A 45 -4.981 4.026 16.249 1.00 3.05 H new ATOM 0 HD11 LEU A 45 -6.563 5.052 14.672 1.00 3.66 H new ATOM 0 HD12 LEU A 45 -4.873 5.314 14.182 1.00 3.66 H new ATOM 0 HD13 LEU A 45 -5.861 4.091 13.349 1.00 3.66 H new ATOM 0 HD21 LEU A 45 -7.208 3.017 15.893 1.00 3.32 H new ATOM 0 HD22 LEU A 45 -6.524 1.970 14.628 1.00 3.32 H new ATOM 0 HD23 LEU A 45 -5.988 1.793 16.316 1.00 3.32 H new ATOM 681 N GLY A 46 -0.270 3.521 14.739 1.00 2.52 N ATOM 682 CA GLY A 46 0.990 2.803 14.774 1.00 2.73 C ATOM 683 C GLY A 46 2.186 3.731 14.717 1.00 2.68 C ATOM 684 O GLY A 46 2.764 4.061 15.754 1.00 2.81 O ATOM 0 H GLY A 46 -0.186 4.537 14.725 1.00 2.52 H new ATOM 0 HA2 GLY A 46 1.040 2.206 15.685 1.00 2.73 H new ATOM 0 HA3 GLY A 46 1.032 2.108 13.935 1.00 2.73 H new ATOM 688 N PRO A 47 2.585 4.177 13.512 1.00 2.59 N ATOM 689 CA PRO A 47 3.727 5.081 13.348 1.00 2.65 C ATOM 690 C PRO A 47 3.598 6.326 14.216 1.00 2.60 C ATOM 691 O PRO A 47 4.563 6.760 14.845 1.00 2.86 O ATOM 692 CB PRO A 47 3.676 5.456 11.864 1.00 2.59 C ATOM 693 CG PRO A 47 2.958 4.325 11.213 1.00 2.63 C ATOM 694 CD PRO A 47 1.956 3.839 12.221 1.00 2.54 C ATOM 0 HA PRO A 47 4.665 4.615 13.648 1.00 2.65 H new ATOM 0 HB2 PRO A 47 3.151 6.399 11.712 1.00 2.59 H new ATOM 0 HB3 PRO A 47 4.678 5.579 11.452 1.00 2.59 H new ATOM 0 HG2 PRO A 47 2.464 4.651 10.297 1.00 2.63 H new ATOM 0 HG3 PRO A 47 3.651 3.530 10.936 1.00 2.63 H new ATOM 0 HD2 PRO A 47 0.992 4.333 12.101 1.00 2.54 H new ATOM 0 HD3 PRO A 47 1.778 2.768 12.128 1.00 2.54 H new ATOM 702 N GLN A 48 2.398 6.899 14.245 1.00 2.39 N ATOM 703 CA GLN A 48 2.138 8.091 15.031 1.00 2.50 C ATOM 704 C GLN A 48 0.777 8.014 15.723 1.00 2.40 C ATOM 705 O GLN A 48 0.491 7.050 16.431 1.00 2.57 O ATOM 706 CB GLN A 48 2.227 9.313 14.142 1.00 2.56 C ATOM 707 CG GLN A 48 1.401 9.204 12.885 1.00 2.73 C ATOM 708 CD GLN A 48 1.430 10.486 12.110 1.00 2.73 C ATOM 709 OE1 GLN A 48 0.376 11.261 12.250 1.00 3.26 O flip ATOM 710 NE2 GLN A 48 2.407 10.798 11.431 1.00 2.45 N flip ATOM 0 H GLN A 48 1.590 6.551 13.729 1.00 2.39 H new ATOM 0 HA GLN A 48 2.893 8.166 15.814 1.00 2.50 H new ATOM 0 HB2 GLN A 48 1.902 10.187 14.706 1.00 2.56 H new ATOM 0 HB3 GLN A 48 3.269 9.479 13.869 1.00 2.56 H new ATOM 0 HG2 GLN A 48 1.781 8.392 12.265 1.00 2.73 H new ATOM 0 HG3 GLN A 48 0.372 8.954 13.143 1.00 2.73 H new ATOM 0 HE21 GLN A 48 3.200 10.161 11.355 1.00 2.45 H new ATOM 0 HE22 GLN A 48 2.425 11.694 10.944 1.00 2.45 H new ATOM 719 N ASP A 49 -0.058 9.034 15.519 1.00 2.45 N ATOM 720 CA ASP A 49 -1.381 9.077 16.126 1.00 2.47 C ATOM 721 C ASP A 49 -2.143 10.299 15.627 1.00 2.38 C ATOM 722 O ASP A 49 -3.362 10.385 15.772 1.00 2.57 O ATOM 723 CB ASP A 49 -1.265 9.120 17.654 1.00 2.79 C ATOM 724 CG ASP A 49 -2.603 8.951 18.352 1.00 2.83 C ATOM 725 OD1 ASP A 49 -3.611 8.719 17.651 1.00 3.28 O ATOM 726 OD2 ASP A 49 -2.647 9.061 19.596 1.00 3.02 O ATOM 0 H ASP A 49 0.163 9.841 14.936 1.00 2.45 H new ATOM 0 HA ASP A 49 -1.926 8.177 15.842 1.00 2.47 H new ATOM 0 HB2 ASP A 49 -0.586 8.334 17.984 1.00 2.79 H new ATOM 0 HB3 ASP A 49 -0.822 10.070 17.953 1.00 2.79 H new ATOM 731 N GLN A 50 -1.411 11.243 15.036 1.00 2.26 N ATOM 732 CA GLN A 50 -2.015 12.463 14.513 1.00 2.39 C ATOM 733 C GLN A 50 -2.942 12.126 13.348 1.00 2.01 C ATOM 734 O GLN A 50 -2.478 11.736 12.276 1.00 2.19 O ATOM 735 CB GLN A 50 -0.931 13.440 14.053 1.00 3.08 C ATOM 736 CG GLN A 50 0.328 13.399 14.908 1.00 3.45 C ATOM 737 CD GLN A 50 0.034 13.504 16.392 1.00 3.73 C ATOM 738 OE1 GLN A 50 -0.482 14.517 16.865 1.00 4.34 O ATOM 739 NE2 GLN A 50 0.356 12.447 17.130 1.00 3.74 N ATOM 0 H GLN A 50 -0.401 11.184 14.909 1.00 2.26 H new ATOM 0 HA GLN A 50 -2.595 12.934 15.307 1.00 2.39 H new ATOM 0 HB2 GLN A 50 -0.666 13.216 13.020 1.00 3.08 H new ATOM 0 HB3 GLN A 50 -1.336 14.452 14.066 1.00 3.08 H new ATOM 0 HG2 GLN A 50 0.864 12.470 14.713 1.00 3.45 H new ATOM 0 HG3 GLN A 50 0.988 14.215 14.614 1.00 3.45 H new ATOM 0 HE21 GLN A 50 0.782 11.630 16.692 1.00 3.74 H new ATOM 0 HE22 GLN A 50 0.177 12.453 18.134 1.00 3.74 H new ATOM 748 N PRO A 51 -4.266 12.258 13.541 1.00 1.98 N ATOM 749 CA PRO A 51 -5.246 11.945 12.496 1.00 2.00 C ATOM 750 C PRO A 51 -4.992 12.714 11.203 1.00 1.82 C ATOM 751 O PRO A 51 -5.453 13.844 11.043 1.00 2.47 O ATOM 752 CB PRO A 51 -6.582 12.368 13.116 1.00 2.71 C ATOM 753 CG PRO A 51 -6.351 12.321 14.586 1.00 2.89 C ATOM 754 CD PRO A 51 -4.914 12.705 14.789 1.00 2.51 C ATOM 0 HA PRO A 51 -5.207 10.894 12.211 1.00 2.00 H new ATOM 0 HB2 PRO A 51 -6.869 13.369 12.792 1.00 2.71 H new ATOM 0 HB3 PRO A 51 -7.386 11.694 12.820 1.00 2.71 H new ATOM 0 HG2 PRO A 51 -7.017 13.008 15.108 1.00 2.89 H new ATOM 0 HG3 PRO A 51 -6.549 11.324 14.981 1.00 2.89 H new ATOM 0 HD2 PRO A 51 -4.801 13.779 14.939 1.00 2.51 H new ATOM 0 HD3 PRO A 51 -4.486 12.215 15.663 1.00 2.51 H new ATOM 762 N ASP A 52 -4.261 12.085 10.284 1.00 1.32 N ATOM 763 CA ASP A 52 -3.943 12.698 8.997 1.00 1.52 C ATOM 764 C ASP A 52 -3.097 11.750 8.146 1.00 1.28 C ATOM 765 O ASP A 52 -2.089 12.151 7.566 1.00 2.07 O ATOM 766 CB ASP A 52 -3.197 14.022 9.205 1.00 2.12 C ATOM 767 CG ASP A 52 -3.013 14.801 7.916 1.00 2.77 C ATOM 768 OD1 ASP A 52 -3.497 14.337 6.863 1.00 3.33 O ATOM 769 OD2 ASP A 52 -2.388 15.883 7.961 1.00 3.26 O ATOM 0 H ASP A 52 -3.877 11.148 10.408 1.00 1.32 H new ATOM 0 HA ASP A 52 -4.878 12.899 8.473 1.00 1.52 H new ATOM 0 HB2 ASP A 52 -3.746 14.635 9.920 1.00 2.12 H new ATOM 0 HB3 ASP A 52 -2.220 13.819 9.644 1.00 2.12 H new ATOM 774 N TYR A 53 -3.517 10.487 8.076 1.00 0.84 N ATOM 775 CA TYR A 53 -2.797 9.486 7.299 1.00 1.19 C ATOM 776 C TYR A 53 -3.377 9.410 5.890 1.00 0.96 C ATOM 777 O TYR A 53 -4.460 8.861 5.682 1.00 1.43 O ATOM 778 CB TYR A 53 -2.878 8.124 8.003 1.00 2.08 C ATOM 779 CG TYR A 53 -1.889 7.086 7.509 1.00 3.12 C ATOM 780 CD1 TYR A 53 -0.682 7.473 6.940 1.00 3.74 C ATOM 781 CD2 TYR A 53 -2.165 5.728 7.589 1.00 3.88 C ATOM 782 CE1 TYR A 53 0.221 6.538 6.472 1.00 4.86 C ATOM 783 CE2 TYR A 53 -1.268 4.787 7.121 1.00 5.03 C ATOM 784 CZ TYR A 53 -0.069 5.170 6.636 1.00 5.45 C ATOM 785 OH TYR A 53 0.818 4.262 6.098 1.00 6.66 O ATOM 0 H TYR A 53 -4.350 10.136 8.548 1.00 0.84 H new ATOM 0 HA TYR A 53 -1.747 9.769 7.222 1.00 1.19 H new ATOM 0 HB2 TYR A 53 -2.720 8.274 9.071 1.00 2.08 H new ATOM 0 HB3 TYR A 53 -3.887 7.729 7.882 1.00 2.08 H new ATOM 0 HD1 TYR A 53 -0.445 8.524 6.862 1.00 3.74 H new ATOM 0 HD2 TYR A 53 -3.098 5.401 8.025 1.00 3.88 H new ATOM 0 HE1 TYR A 53 1.134 6.851 5.988 1.00 4.86 H new ATOM 0 HE2 TYR A 53 -1.528 3.739 7.144 1.00 5.03 H new ATOM 0 HH TYR A 53 0.505 3.351 6.280 1.00 6.66 H new ATOM 795 N LEU A 54 -2.654 9.977 4.926 1.00 0.84 N ATOM 796 CA LEU A 54 -3.100 9.989 3.535 1.00 0.76 C ATOM 797 C LEU A 54 -2.435 8.861 2.768 1.00 0.76 C ATOM 798 O LEU A 54 -1.210 8.745 2.771 1.00 0.98 O ATOM 799 CB LEU A 54 -2.770 11.345 2.892 1.00 0.97 C ATOM 800 CG LEU A 54 -3.263 11.562 1.452 1.00 1.15 C ATOM 801 CD1 LEU A 54 -2.441 10.753 0.459 1.00 1.60 C ATOM 802 CD2 LEU A 54 -4.738 11.210 1.328 1.00 1.60 C ATOM 0 H LEU A 54 -1.756 10.434 5.083 1.00 0.84 H new ATOM 0 HA LEU A 54 -4.180 9.841 3.503 1.00 0.76 H new ATOM 0 HB2 LEU A 54 -3.192 12.131 3.519 1.00 0.97 H new ATOM 0 HB3 LEU A 54 -1.688 11.474 2.905 1.00 0.97 H new ATOM 0 HG LEU A 54 -3.136 12.618 1.215 1.00 1.15 H new ATOM 0 HD11 LEU A 54 -2.814 10.928 -0.550 1.00 1.60 H new ATOM 0 HD12 LEU A 54 -1.396 11.058 0.518 1.00 1.60 H new ATOM 0 HD13 LEU A 54 -2.523 9.693 0.697 1.00 1.60 H new ATOM 0 HD21 LEU A 54 -5.065 11.371 0.301 1.00 1.60 H new ATOM 0 HD22 LEU A 54 -4.886 10.164 1.596 1.00 1.60 H new ATOM 0 HD23 LEU A 54 -5.321 11.842 1.998 1.00 1.60 H new ATOM 814 N ASN A 55 -3.238 8.029 2.110 1.00 0.60 N ATOM 815 CA ASN A 55 -2.678 6.915 1.354 1.00 0.66 C ATOM 816 C ASN A 55 -3.458 6.666 0.071 1.00 0.50 C ATOM 817 O ASN A 55 -4.543 7.213 -0.132 1.00 0.56 O ATOM 818 CB ASN A 55 -2.671 5.642 2.203 1.00 0.87 C ATOM 819 CG ASN A 55 -2.306 5.897 3.651 1.00 1.51 C ATOM 820 OD1 ASN A 55 -1.280 6.502 3.950 1.00 2.21 O ATOM 821 ND2 ASN A 55 -3.141 5.418 4.563 1.00 2.21 N ATOM 0 H ASN A 55 -4.255 8.102 2.084 1.00 0.60 H new ATOM 0 HA ASN A 55 -1.654 7.181 1.090 1.00 0.66 H new ATOM 0 HB2 ASN A 55 -3.656 5.177 2.159 1.00 0.87 H new ATOM 0 HB3 ASN A 55 -1.964 4.931 1.776 1.00 0.87 H new ATOM 0 HD21 ASN A 55 -2.941 5.547 5.555 1.00 2.21 H new ATOM 0 HD22 ASN A 55 -3.983 4.921 4.273 1.00 2.21 H new ATOM 828 N ALA A 56 -2.892 5.826 -0.790 1.00 0.50 N ATOM 829 CA ALA A 56 -3.518 5.482 -2.058 1.00 0.45 C ATOM 830 C ALA A 56 -3.201 4.040 -2.439 1.00 0.45 C ATOM 831 O ALA A 56 -2.499 3.335 -1.712 1.00 0.61 O ATOM 832 CB ALA A 56 -3.058 6.436 -3.151 1.00 0.58 C ATOM 0 H ALA A 56 -1.994 5.369 -0.629 1.00 0.50 H new ATOM 0 HA ALA A 56 -4.598 5.577 -1.947 1.00 0.45 H new ATOM 0 HB1 ALA A 56 -3.534 6.166 -4.094 1.00 0.58 H new ATOM 0 HB2 ALA A 56 -3.334 7.456 -2.884 1.00 0.58 H new ATOM 0 HB3 ALA A 56 -1.975 6.370 -3.260 1.00 0.58 H new ATOM 838 N ALA A 57 -3.716 3.606 -3.581 1.00 0.43 N ATOM 839 CA ALA A 57 -3.481 2.247 -4.053 1.00 0.47 C ATOM 840 C ALA A 57 -2.549 2.247 -5.256 1.00 0.40 C ATOM 841 O ALA A 57 -2.641 3.119 -6.121 1.00 0.44 O ATOM 842 CB ALA A 57 -4.798 1.570 -4.399 1.00 0.59 C ATOM 0 H ALA A 57 -4.298 4.173 -4.197 1.00 0.43 H new ATOM 0 HA ALA A 57 -3.002 1.685 -3.251 1.00 0.47 H new ATOM 0 HB1 ALA A 57 -4.605 0.556 -4.750 1.00 0.59 H new ATOM 0 HB2 ALA A 57 -5.432 1.533 -3.513 1.00 0.59 H new ATOM 0 HB3 ALA A 57 -5.303 2.135 -5.183 1.00 0.59 H new ATOM 848 N VAL A 58 -1.652 1.265 -5.304 1.00 0.39 N ATOM 849 CA VAL A 58 -0.702 1.145 -6.391 1.00 0.39 C ATOM 850 C VAL A 58 -0.620 -0.296 -6.870 1.00 0.40 C ATOM 851 O VAL A 58 -0.122 -1.177 -6.168 1.00 0.60 O ATOM 852 CB VAL A 58 0.694 1.638 -5.968 1.00 0.49 C ATOM 853 CG1 VAL A 58 0.696 3.150 -5.806 1.00 1.11 C ATOM 854 CG2 VAL A 58 1.136 0.967 -4.676 1.00 1.22 C ATOM 0 H VAL A 58 -1.569 0.538 -4.593 1.00 0.39 H new ATOM 0 HA VAL A 58 -1.053 1.773 -7.210 1.00 0.39 H new ATOM 0 HB VAL A 58 1.402 1.370 -6.752 1.00 0.49 H new ATOM 0 HG11 VAL A 58 1.690 3.483 -5.507 1.00 1.11 H new ATOM 0 HG12 VAL A 58 0.427 3.618 -6.753 1.00 1.11 H new ATOM 0 HG13 VAL A 58 -0.027 3.435 -5.042 1.00 1.11 H new ATOM 0 HG21 VAL A 58 2.125 1.331 -4.397 1.00 1.22 H new ATOM 0 HG22 VAL A 58 0.426 1.201 -3.883 1.00 1.22 H new ATOM 0 HG23 VAL A 58 1.174 -0.113 -4.821 1.00 1.22 H new ATOM 864 N ALA A 59 -1.113 -0.526 -8.073 1.00 0.34 N ATOM 865 CA ALA A 59 -1.108 -1.849 -8.667 1.00 0.36 C ATOM 866 C ALA A 59 -0.370 -1.808 -9.986 1.00 0.37 C ATOM 867 O ALA A 59 -0.941 -1.487 -11.029 1.00 0.43 O ATOM 868 CB ALA A 59 -2.529 -2.356 -8.860 1.00 0.44 C ATOM 0 H ALA A 59 -1.526 0.196 -8.663 1.00 0.34 H new ATOM 0 HA ALA A 59 -0.596 -2.539 -7.996 1.00 0.36 H new ATOM 0 HB1 ALA A 59 -2.503 -3.350 -9.307 1.00 0.44 H new ATOM 0 HB2 ALA A 59 -3.032 -2.405 -7.894 1.00 0.44 H new ATOM 0 HB3 ALA A 59 -3.072 -1.677 -9.517 1.00 0.44 H new ATOM 874 N LEU A 60 0.912 -2.117 -9.927 1.00 0.37 N ATOM 875 CA LEU A 60 1.750 -2.099 -11.117 1.00 0.45 C ATOM 876 C LEU A 60 2.271 -3.491 -11.435 1.00 0.39 C ATOM 877 O LEU A 60 2.262 -4.375 -10.580 1.00 0.38 O ATOM 878 CB LEU A 60 2.924 -1.139 -10.936 1.00 0.56 C ATOM 879 CG LEU A 60 4.124 -1.714 -10.194 1.00 0.48 C ATOM 880 CD1 LEU A 60 5.269 -0.714 -10.176 1.00 0.44 C ATOM 881 CD2 LEU A 60 3.737 -2.113 -8.781 1.00 0.98 C ATOM 0 H LEU A 60 1.397 -2.383 -9.070 1.00 0.37 H new ATOM 0 HA LEU A 60 1.136 -1.756 -11.950 1.00 0.45 H new ATOM 0 HB2 LEU A 60 3.252 -0.803 -11.919 1.00 0.56 H new ATOM 0 HB3 LEU A 60 2.573 -0.258 -10.399 1.00 0.56 H new ATOM 0 HG LEU A 60 4.459 -2.608 -10.721 1.00 0.48 H new ATOM 0 HD11 LEU A 60 6.117 -1.142 -9.642 1.00 0.44 H new ATOM 0 HD12 LEU A 60 5.564 -0.481 -11.199 1.00 0.44 H new ATOM 0 HD13 LEU A 60 4.947 0.199 -9.674 1.00 0.44 H new ATOM 0 HD21 LEU A 60 4.607 -2.521 -8.267 1.00 0.98 H new ATOM 0 HD22 LEU A 60 3.375 -1.238 -8.242 1.00 0.98 H new ATOM 0 HD23 LEU A 60 2.951 -2.867 -8.818 1.00 0.98 H new ATOM 893 N GLU A 61 2.724 -3.680 -12.668 1.00 0.39 N ATOM 894 CA GLU A 61 3.246 -4.971 -13.095 1.00 0.38 C ATOM 895 C GLU A 61 4.714 -5.123 -12.727 1.00 0.36 C ATOM 896 O GLU A 61 5.594 -4.619 -13.427 1.00 0.38 O ATOM 897 CB GLU A 61 3.074 -5.144 -14.601 1.00 0.44 C ATOM 898 CG GLU A 61 1.641 -4.983 -15.062 1.00 1.08 C ATOM 899 CD GLU A 61 1.446 -5.353 -16.519 1.00 1.06 C ATOM 900 OE1 GLU A 61 2.440 -5.742 -17.170 1.00 1.24 O ATOM 901 OE2 GLU A 61 0.302 -5.255 -17.012 1.00 1.39 O ATOM 0 H GLU A 61 2.740 -2.958 -13.388 1.00 0.39 H new ATOM 0 HA GLU A 61 2.679 -5.744 -12.576 1.00 0.38 H new ATOM 0 HB2 GLU A 61 3.699 -4.415 -15.117 1.00 0.44 H new ATOM 0 HB3 GLU A 61 3.432 -6.132 -14.890 1.00 0.44 H new ATOM 0 HG2 GLU A 61 0.994 -5.605 -14.444 1.00 1.08 H new ATOM 0 HG3 GLU A 61 1.329 -3.950 -14.910 1.00 1.08 H new ATOM 908 N THR A 62 4.976 -5.826 -11.631 1.00 0.39 N ATOM 909 CA THR A 62 6.327 -6.056 -11.186 1.00 0.43 C ATOM 910 C THR A 62 6.842 -7.375 -11.733 1.00 0.39 C ATOM 911 O THR A 62 6.118 -8.122 -12.389 1.00 0.43 O ATOM 912 CB THR A 62 6.387 -6.071 -9.658 1.00 0.54 C ATOM 913 OG1 THR A 62 5.636 -7.151 -9.138 1.00 1.47 O ATOM 914 CG2 THR A 62 5.865 -4.801 -9.022 1.00 1.02 C ATOM 0 H THR A 62 4.260 -6.245 -11.038 1.00 0.39 H new ATOM 0 HA THR A 62 6.956 -5.247 -11.557 1.00 0.43 H new ATOM 0 HB THR A 62 7.445 -6.170 -9.414 1.00 0.54 H new ATOM 0 HG1 THR A 62 5.688 -7.145 -8.159 1.00 1.47 H new ATOM 0 HG21 THR A 62 5.937 -4.881 -7.937 1.00 1.02 H new ATOM 0 HG22 THR A 62 6.458 -3.953 -9.364 1.00 1.02 H new ATOM 0 HG23 THR A 62 4.823 -4.653 -9.306 1.00 1.02 H new ATOM 922 N SER A 63 8.092 -7.653 -11.436 1.00 0.40 N ATOM 923 CA SER A 63 8.739 -8.886 -11.859 1.00 0.44 C ATOM 924 C SER A 63 9.583 -9.389 -10.709 1.00 0.44 C ATOM 925 O SER A 63 9.985 -10.553 -10.652 1.00 0.64 O ATOM 926 CB SER A 63 9.599 -8.646 -13.097 1.00 0.56 C ATOM 927 OG SER A 63 8.803 -8.260 -14.204 1.00 1.23 O ATOM 0 H SER A 63 8.694 -7.033 -10.894 1.00 0.40 H new ATOM 0 HA SER A 63 7.989 -9.631 -12.125 1.00 0.44 H new ATOM 0 HB2 SER A 63 10.336 -7.871 -12.887 1.00 0.56 H new ATOM 0 HB3 SER A 63 10.152 -9.553 -13.341 1.00 0.56 H new ATOM 0 HG SER A 63 9.377 -8.111 -14.984 1.00 1.23 H new ATOM 933 N LEU A 64 9.814 -8.475 -9.782 1.00 0.39 N ATOM 934 CA LEU A 64 10.570 -8.732 -8.585 1.00 0.38 C ATOM 935 C LEU A 64 9.614 -8.871 -7.412 1.00 0.35 C ATOM 936 O LEU A 64 9.095 -7.873 -6.910 1.00 0.39 O ATOM 937 CB LEU A 64 11.528 -7.572 -8.343 1.00 0.42 C ATOM 938 CG LEU A 64 10.922 -6.185 -8.574 1.00 0.50 C ATOM 939 CD1 LEU A 64 11.505 -5.188 -7.588 1.00 0.78 C ATOM 940 CD2 LEU A 64 11.181 -5.727 -10.002 1.00 0.84 C ATOM 0 H LEU A 64 9.471 -7.517 -9.849 1.00 0.39 H new ATOM 0 HA LEU A 64 11.141 -9.654 -8.692 1.00 0.38 H new ATOM 0 HB2 LEU A 64 11.894 -7.628 -7.318 1.00 0.42 H new ATOM 0 HB3 LEU A 64 12.392 -7.690 -8.996 1.00 0.42 H new ATOM 0 HG LEU A 64 9.845 -6.244 -8.417 1.00 0.50 H new ATOM 0 HD11 LEU A 64 11.067 -4.205 -7.762 1.00 0.78 H new ATOM 0 HD12 LEU A 64 11.282 -5.510 -6.571 1.00 0.78 H new ATOM 0 HD13 LEU A 64 12.585 -5.132 -7.723 1.00 0.78 H new ATOM 0 HD21 LEU A 64 10.745 -4.739 -10.152 1.00 0.84 H new ATOM 0 HD22 LEU A 64 12.255 -5.680 -10.180 1.00 0.84 H new ATOM 0 HD23 LEU A 64 10.729 -6.433 -10.698 1.00 0.84 H new ATOM 952 N ALA A 65 9.365 -10.111 -6.997 1.00 0.38 N ATOM 953 CA ALA A 65 8.452 -10.383 -5.891 1.00 0.42 C ATOM 954 C ALA A 65 8.554 -9.307 -4.816 1.00 0.39 C ATOM 955 O ALA A 65 9.643 -8.807 -4.542 1.00 0.38 O ATOM 956 CB ALA A 65 8.742 -11.754 -5.296 1.00 0.52 C ATOM 0 H ALA A 65 9.784 -10.944 -7.411 1.00 0.38 H new ATOM 0 HA ALA A 65 7.434 -10.373 -6.281 1.00 0.42 H new ATOM 0 HB1 ALA A 65 8.055 -11.946 -4.472 1.00 0.52 H new ATOM 0 HB2 ALA A 65 8.612 -12.518 -6.062 1.00 0.52 H new ATOM 0 HB3 ALA A 65 9.767 -11.781 -4.927 1.00 0.52 H new ATOM 962 N PRO A 66 7.411 -8.925 -4.208 1.00 0.44 N ATOM 963 CA PRO A 66 7.345 -7.901 -3.166 1.00 0.47 C ATOM 964 C PRO A 66 8.575 -7.842 -2.275 1.00 0.45 C ATOM 965 O PRO A 66 8.890 -6.801 -1.724 1.00 0.49 O ATOM 966 CB PRO A 66 6.131 -8.348 -2.373 1.00 0.55 C ATOM 967 CG PRO A 66 5.202 -8.851 -3.418 1.00 0.57 C ATOM 968 CD PRO A 66 6.067 -9.455 -4.502 1.00 0.50 C ATOM 0 HA PRO A 66 7.288 -6.895 -3.583 1.00 0.47 H new ATOM 0 HB2 PRO A 66 6.386 -9.126 -1.654 1.00 0.55 H new ATOM 0 HB3 PRO A 66 5.693 -7.524 -1.810 1.00 0.55 H new ATOM 0 HG2 PRO A 66 4.520 -9.595 -3.006 1.00 0.57 H new ATOM 0 HG3 PRO A 66 4.589 -8.042 -3.815 1.00 0.57 H new ATOM 0 HD2 PRO A 66 6.049 -10.544 -4.469 1.00 0.50 H new ATOM 0 HD3 PRO A 66 5.728 -9.161 -5.496 1.00 0.50 H new ATOM 976 N GLU A 67 9.280 -8.951 -2.144 1.00 0.45 N ATOM 977 CA GLU A 67 10.483 -8.980 -1.332 1.00 0.49 C ATOM 978 C GLU A 67 11.463 -7.931 -1.854 1.00 0.44 C ATOM 979 O GLU A 67 11.922 -7.064 -1.112 1.00 0.47 O ATOM 980 CB GLU A 67 11.100 -10.375 -1.378 1.00 0.52 C ATOM 981 CG GLU A 67 10.116 -11.470 -0.998 1.00 0.71 C ATOM 982 CD GLU A 67 10.703 -12.861 -1.138 1.00 0.77 C ATOM 983 OE1 GLU A 67 11.714 -13.150 -0.464 1.00 1.06 O ATOM 984 OE2 GLU A 67 10.150 -13.663 -1.920 1.00 1.20 O ATOM 0 H GLU A 67 9.042 -9.839 -2.587 1.00 0.45 H new ATOM 0 HA GLU A 67 10.241 -8.749 -0.295 1.00 0.49 H new ATOM 0 HB2 GLU A 67 11.479 -10.566 -2.382 1.00 0.52 H new ATOM 0 HB3 GLU A 67 11.955 -10.411 -0.703 1.00 0.52 H new ATOM 0 HG2 GLU A 67 9.791 -11.319 0.032 1.00 0.71 H new ATOM 0 HG3 GLU A 67 9.229 -11.390 -1.627 1.00 0.71 H new ATOM 991 N GLU A 68 11.746 -8.006 -3.153 1.00 0.40 N ATOM 992 CA GLU A 68 12.640 -7.062 -3.813 1.00 0.39 C ATOM 993 C GLU A 68 11.970 -5.698 -3.934 1.00 0.35 C ATOM 994 O GLU A 68 12.520 -4.680 -3.513 1.00 0.40 O ATOM 995 CB GLU A 68 13.006 -7.579 -5.207 1.00 0.41 C ATOM 996 CG GLU A 68 13.639 -8.960 -5.196 1.00 0.97 C ATOM 997 CD GLU A 68 14.913 -9.015 -4.378 1.00 1.52 C ATOM 998 OE1 GLU A 68 15.870 -8.286 -4.718 1.00 1.90 O ATOM 999 OE2 GLU A 68 14.957 -9.790 -3.399 1.00 2.06 O ATOM 0 H GLU A 68 11.363 -8.720 -3.773 1.00 0.40 H new ATOM 0 HA GLU A 68 13.546 -6.961 -3.215 1.00 0.39 H new ATOM 0 HB2 GLU A 68 12.107 -7.605 -5.823 1.00 0.41 H new ATOM 0 HB3 GLU A 68 13.694 -6.877 -5.677 1.00 0.41 H new ATOM 0 HG2 GLU A 68 12.924 -9.679 -4.796 1.00 0.97 H new ATOM 0 HG3 GLU A 68 13.857 -9.263 -6.220 1.00 0.97 H new ATOM 1006 N LEU A 69 10.768 -5.701 -4.505 1.00 0.32 N ATOM 1007 CA LEU A 69 9.984 -4.484 -4.686 1.00 0.33 C ATOM 1008 C LEU A 69 9.924 -3.677 -3.392 1.00 0.34 C ATOM 1009 O LEU A 69 10.276 -2.497 -3.367 1.00 0.44 O ATOM 1010 CB LEU A 69 8.576 -4.861 -5.160 1.00 0.38 C ATOM 1011 CG LEU A 69 7.436 -3.981 -4.636 1.00 0.44 C ATOM 1012 CD1 LEU A 69 7.395 -2.657 -5.382 1.00 0.66 C ATOM 1013 CD2 LEU A 69 6.102 -4.710 -4.738 1.00 0.67 C ATOM 0 H LEU A 69 10.312 -6.544 -4.854 1.00 0.32 H new ATOM 0 HA LEU A 69 10.462 -3.857 -5.439 1.00 0.33 H new ATOM 0 HB2 LEU A 69 8.560 -4.832 -6.249 1.00 0.38 H new ATOM 0 HB3 LEU A 69 8.378 -5.892 -4.866 1.00 0.38 H new ATOM 0 HG LEU A 69 7.622 -3.768 -3.583 1.00 0.44 H new ATOM 0 HD11 LEU A 69 6.579 -2.047 -4.995 1.00 0.66 H new ATOM 0 HD12 LEU A 69 8.339 -2.131 -5.242 1.00 0.66 H new ATOM 0 HD13 LEU A 69 7.237 -2.843 -6.444 1.00 0.66 H new ATOM 0 HD21 LEU A 69 5.306 -4.067 -4.361 1.00 0.67 H new ATOM 0 HD22 LEU A 69 5.903 -4.960 -5.780 1.00 0.67 H new ATOM 0 HD23 LEU A 69 6.141 -5.625 -4.146 1.00 0.67 H new ATOM 1025 N LEU A 70 9.479 -4.327 -2.322 1.00 0.39 N ATOM 1026 CA LEU A 70 9.372 -3.695 -1.013 1.00 0.47 C ATOM 1027 C LEU A 70 10.658 -2.958 -0.669 1.00 0.44 C ATOM 1028 O LEU A 70 10.626 -1.833 -0.174 1.00 0.47 O ATOM 1029 CB LEU A 70 9.097 -4.755 0.053 1.00 0.62 C ATOM 1030 CG LEU A 70 8.738 -4.223 1.439 1.00 0.99 C ATOM 1031 CD1 LEU A 70 7.272 -3.840 1.489 1.00 1.48 C ATOM 1032 CD2 LEU A 70 9.049 -5.259 2.501 1.00 1.65 C ATOM 0 H LEU A 70 9.183 -5.303 -2.338 1.00 0.39 H new ATOM 0 HA LEU A 70 8.550 -2.980 -1.041 1.00 0.47 H new ATOM 0 HB2 LEU A 70 8.282 -5.390 -0.294 1.00 0.62 H new ATOM 0 HB3 LEU A 70 9.979 -5.389 0.145 1.00 0.62 H new ATOM 0 HG LEU A 70 9.338 -3.335 1.637 1.00 0.99 H new ATOM 0 HD11 LEU A 70 7.028 -3.462 2.482 1.00 1.48 H new ATOM 0 HD12 LEU A 70 7.073 -3.066 0.747 1.00 1.48 H new ATOM 0 HD13 LEU A 70 6.660 -4.716 1.274 1.00 1.48 H new ATOM 0 HD21 LEU A 70 8.787 -4.864 3.483 1.00 1.65 H new ATOM 0 HD22 LEU A 70 8.471 -6.163 2.308 1.00 1.65 H new ATOM 0 HD23 LEU A 70 10.113 -5.496 2.477 1.00 1.65 H new ATOM 1044 N ASN A 71 11.790 -3.607 -0.930 1.00 0.46 N ATOM 1045 CA ASN A 71 13.095 -3.016 -0.638 1.00 0.50 C ATOM 1046 C ASN A 71 13.282 -1.660 -1.321 1.00 0.41 C ATOM 1047 O ASN A 71 13.794 -0.728 -0.705 1.00 0.44 O ATOM 1048 CB ASN A 71 14.222 -3.967 -1.047 1.00 0.59 C ATOM 1049 CG ASN A 71 14.411 -5.100 -0.055 1.00 0.79 C ATOM 1050 OD1 ASN A 71 14.263 -6.333 -0.524 1.00 1.59 O flip ATOM 1051 ND2 ASN A 71 14.691 -4.867 1.121 1.00 0.72 N flip ATOM 0 H ASN A 71 11.831 -4.539 -1.342 1.00 0.46 H new ATOM 0 HA ASN A 71 13.135 -2.852 0.439 1.00 0.50 H new ATOM 0 HB2 ASN A 71 14.005 -4.382 -2.031 1.00 0.59 H new ATOM 0 HB3 ASN A 71 15.153 -3.406 -1.136 1.00 0.59 H new ATOM 0 HD21 ASN A 71 14.795 -3.904 1.439 1.00 0.72 H new ATOM 0 HD22 ASN A 71 14.819 -5.637 1.777 1.00 0.72 H new ATOM 1058 N HIS A 72 12.887 -1.551 -2.590 1.00 0.37 N ATOM 1059 CA HIS A 72 13.040 -0.303 -3.329 1.00 0.35 C ATOM 1060 C HIS A 72 12.048 0.756 -2.863 1.00 0.32 C ATOM 1061 O HIS A 72 12.410 1.917 -2.683 1.00 0.35 O ATOM 1062 CB HIS A 72 12.884 -0.559 -4.828 1.00 0.39 C ATOM 1063 CG HIS A 72 13.979 -1.408 -5.396 1.00 0.57 C ATOM 1064 ND1 HIS A 72 15.273 -0.957 -5.558 1.00 1.07 N ATOM 1065 CD2 HIS A 72 13.974 -2.691 -5.825 1.00 0.61 C ATOM 1066 CE1 HIS A 72 16.014 -1.926 -6.065 1.00 1.40 C ATOM 1067 NE2 HIS A 72 15.250 -2.989 -6.235 1.00 1.11 N ATOM 0 H HIS A 72 12.461 -2.309 -3.123 1.00 0.37 H new ATOM 0 HA HIS A 72 14.041 0.080 -3.133 1.00 0.35 H new ATOM 0 HB2 HIS A 72 11.925 -1.044 -5.010 1.00 0.39 H new ATOM 0 HB3 HIS A 72 12.863 0.396 -5.353 1.00 0.39 H new ATOM 0 HD2 HIS A 72 13.124 -3.357 -5.842 1.00 0.61 H new ATOM 0 HE1 HIS A 72 17.066 -1.860 -6.300 1.00 1.40 H new ATOM 0 HE2 HIS A 72 15.558 -3.886 -6.610 1.00 1.11 H new ATOM 1076 N THR A 73 10.797 0.358 -2.661 1.00 0.34 N ATOM 1077 CA THR A 73 9.781 1.295 -2.200 1.00 0.38 C ATOM 1078 C THR A 73 10.186 1.886 -0.852 1.00 0.36 C ATOM 1079 O THR A 73 10.145 3.102 -0.649 1.00 0.36 O ATOM 1080 CB THR A 73 8.429 0.594 -2.088 1.00 0.47 C ATOM 1081 OG1 THR A 73 8.536 -0.562 -1.278 1.00 0.77 O ATOM 1082 CG2 THR A 73 7.862 0.171 -3.425 1.00 0.61 C ATOM 0 H THR A 73 10.465 -0.595 -2.807 1.00 0.34 H new ATOM 0 HA THR A 73 9.694 2.105 -2.925 1.00 0.38 H new ATOM 0 HB THR A 73 7.755 1.327 -1.645 1.00 0.47 H new ATOM 0 HG1 THR A 73 9.477 -0.827 -1.209 1.00 0.77 H new ATOM 0 HG21 THR A 73 6.901 -0.321 -3.274 1.00 0.61 H new ATOM 0 HG22 THR A 73 7.725 1.049 -4.056 1.00 0.61 H new ATOM 0 HG23 THR A 73 8.551 -0.521 -3.910 1.00 0.61 H new ATOM 1090 N GLN A 74 10.600 1.010 0.058 1.00 0.39 N ATOM 1091 CA GLN A 74 11.038 1.418 1.378 1.00 0.42 C ATOM 1092 C GLN A 74 12.409 2.065 1.282 1.00 0.41 C ATOM 1093 O GLN A 74 12.804 2.837 2.149 1.00 0.50 O ATOM 1094 CB GLN A 74 11.099 0.214 2.320 1.00 0.49 C ATOM 1095 CG GLN A 74 12.265 -0.724 2.045 1.00 1.45 C ATOM 1096 CD GLN A 74 12.303 -1.901 2.998 1.00 1.87 C ATOM 1097 OE1 GLN A 74 11.359 -2.688 3.069 1.00 2.25 O ATOM 1098 NE2 GLN A 74 13.400 -2.029 3.737 1.00 2.54 N ATOM 0 H GLN A 74 10.639 0.003 -0.102 1.00 0.39 H new ATOM 0 HA GLN A 74 10.322 2.136 1.778 1.00 0.42 H new ATOM 0 HB2 GLN A 74 11.167 0.572 3.347 1.00 0.49 H new ATOM 0 HB3 GLN A 74 10.168 -0.346 2.239 1.00 0.49 H new ATOM 0 HG2 GLN A 74 12.197 -1.092 1.021 1.00 1.45 H new ATOM 0 HG3 GLN A 74 13.200 -0.168 2.122 1.00 1.45 H new ATOM 0 HE21 GLN A 74 14.158 -1.353 3.645 1.00 2.54 H new ATOM 0 HE22 GLN A 74 13.484 -2.803 4.396 1.00 2.54 H new ATOM 1107 N ARG A 75 13.122 1.748 0.210 1.00 0.37 N ATOM 1108 CA ARG A 75 14.447 2.306 -0.017 1.00 0.41 C ATOM 1109 C ARG A 75 14.355 3.818 -0.018 1.00 0.39 C ATOM 1110 O ARG A 75 15.222 4.519 0.509 1.00 0.43 O ATOM 1111 CB ARG A 75 15.003 1.811 -1.355 1.00 0.48 C ATOM 1112 CG ARG A 75 16.441 2.215 -1.624 1.00 0.89 C ATOM 1113 CD ARG A 75 16.899 1.729 -2.991 1.00 0.88 C ATOM 1114 NE ARG A 75 16.176 2.391 -4.073 1.00 1.59 N ATOM 1115 CZ ARG A 75 16.394 2.152 -5.363 1.00 2.26 C ATOM 1116 NH1 ARG A 75 17.315 1.273 -5.733 1.00 2.72 N ATOM 1117 NH2 ARG A 75 15.690 2.794 -6.284 1.00 3.06 N ATOM 0 H ARG A 75 12.804 1.107 -0.517 1.00 0.37 H new ATOM 0 HA ARG A 75 15.120 1.984 0.778 1.00 0.41 H new ATOM 0 HB2 ARG A 75 14.932 0.724 -1.384 1.00 0.48 H new ATOM 0 HB3 ARG A 75 14.374 2.193 -2.159 1.00 0.48 H new ATOM 0 HG2 ARG A 75 16.534 3.300 -1.570 1.00 0.89 H new ATOM 0 HG3 ARG A 75 17.089 1.801 -0.851 1.00 0.89 H new ATOM 0 HD2 ARG A 75 17.968 1.913 -3.103 1.00 0.88 H new ATOM 0 HD3 ARG A 75 16.752 0.651 -3.062 1.00 0.88 H new ATOM 0 HE ARG A 75 15.462 3.076 -3.825 1.00 1.59 H new ATOM 0 HH11 ARG A 75 17.859 0.777 -5.027 1.00 2.72 H new ATOM 0 HH12 ARG A 75 17.479 1.093 -6.723 1.00 2.72 H new ATOM 0 HH21 ARG A 75 14.981 3.471 -6.004 1.00 3.06 H new ATOM 0 HH22 ARG A 75 15.857 2.611 -7.273 1.00 3.06 H new ATOM 1131 N ILE A 76 13.278 4.312 -0.613 1.00 0.38 N ATOM 1132 CA ILE A 76 13.042 5.736 -0.696 1.00 0.41 C ATOM 1133 C ILE A 76 12.580 6.292 0.643 1.00 0.42 C ATOM 1134 O ILE A 76 13.277 7.100 1.248 1.00 0.44 O ATOM 1135 CB ILE A 76 11.992 6.065 -1.770 1.00 0.45 C ATOM 1136 CG1 ILE A 76 12.198 5.177 -3.004 1.00 0.55 C ATOM 1137 CG2 ILE A 76 12.071 7.536 -2.148 1.00 0.50 C ATOM 1138 CD1 ILE A 76 13.550 5.354 -3.667 1.00 0.83 C ATOM 0 H ILE A 76 12.554 3.739 -1.046 1.00 0.38 H new ATOM 0 HA ILE A 76 13.988 6.202 -0.971 1.00 0.41 H new ATOM 0 HB ILE A 76 11.000 5.866 -1.365 1.00 0.45 H new ATOM 0 HG12 ILE A 76 12.081 4.133 -2.713 1.00 0.55 H new ATOM 0 HG13 ILE A 76 11.416 5.395 -3.731 1.00 0.55 H new ATOM 0 HG21 ILE A 76 11.323 7.757 -2.909 1.00 0.50 H new ATOM 0 HG22 ILE A 76 11.883 8.149 -1.266 1.00 0.50 H new ATOM 0 HG23 ILE A 76 13.064 7.758 -2.540 1.00 0.50 H new ATOM 0 HD11 ILE A 76 13.621 4.693 -4.531 1.00 0.83 H new ATOM 0 HD12 ILE A 76 13.664 6.389 -3.991 1.00 0.83 H new ATOM 0 HD13 ILE A 76 14.339 5.107 -2.956 1.00 0.83 H new ATOM 1150 N GLU A 77 11.407 5.862 1.110 1.00 0.44 N ATOM 1151 CA GLU A 77 10.884 6.348 2.385 1.00 0.47 C ATOM 1152 C GLU A 77 11.892 6.185 3.516 1.00 0.48 C ATOM 1153 O GLU A 77 11.795 6.863 4.537 1.00 0.54 O ATOM 1154 CB GLU A 77 9.545 5.696 2.748 1.00 0.50 C ATOM 1155 CG GLU A 77 9.437 4.201 2.484 1.00 0.66 C ATOM 1156 CD GLU A 77 9.958 3.360 3.635 1.00 0.97 C ATOM 1157 OE1 GLU A 77 11.150 3.504 3.980 1.00 1.32 O ATOM 1158 OE2 GLU A 77 9.180 2.561 4.193 1.00 1.43 O ATOM 0 H GLU A 77 10.809 5.188 0.632 1.00 0.44 H new ATOM 0 HA GLU A 77 10.704 7.415 2.254 1.00 0.47 H new ATOM 0 HB2 GLU A 77 9.353 5.873 3.806 1.00 0.50 H new ATOM 0 HB3 GLU A 77 8.755 6.201 2.192 1.00 0.50 H new ATOM 0 HG2 GLU A 77 8.394 3.945 2.296 1.00 0.66 H new ATOM 0 HG3 GLU A 77 9.994 3.955 1.580 1.00 0.66 H new ATOM 1165 N LEU A 78 12.866 5.303 3.330 1.00 0.45 N ATOM 1166 CA LEU A 78 13.891 5.088 4.344 1.00 0.49 C ATOM 1167 C LEU A 78 14.860 6.263 4.363 1.00 0.49 C ATOM 1168 O LEU A 78 15.270 6.727 5.428 1.00 0.59 O ATOM 1169 CB LEU A 78 14.656 3.789 4.079 1.00 0.53 C ATOM 1170 CG LEU A 78 15.725 3.441 5.116 1.00 0.88 C ATOM 1171 CD1 LEU A 78 15.091 3.182 6.474 1.00 1.66 C ATOM 1172 CD2 LEU A 78 16.530 2.232 4.663 1.00 1.52 C ATOM 0 H LEU A 78 12.968 4.729 2.493 1.00 0.45 H new ATOM 0 HA LEU A 78 13.401 5.008 5.314 1.00 0.49 H new ATOM 0 HB2 LEU A 78 13.940 2.968 4.029 1.00 0.53 H new ATOM 0 HB3 LEU A 78 15.131 3.859 3.100 1.00 0.53 H new ATOM 0 HG LEU A 78 16.401 4.291 5.211 1.00 0.88 H new ATOM 0 HD11 LEU A 78 15.868 2.936 7.197 1.00 1.66 H new ATOM 0 HD12 LEU A 78 14.558 4.074 6.803 1.00 1.66 H new ATOM 0 HD13 LEU A 78 14.391 2.350 6.396 1.00 1.66 H new ATOM 0 HD21 LEU A 78 17.286 1.997 5.412 1.00 1.52 H new ATOM 0 HD22 LEU A 78 15.865 1.378 4.539 1.00 1.52 H new ATOM 0 HD23 LEU A 78 17.016 2.454 3.713 1.00 1.52 H new ATOM 1184 N GLN A 79 15.232 6.734 3.173 1.00 0.47 N ATOM 1185 CA GLN A 79 16.162 7.851 3.052 1.00 0.52 C ATOM 1186 C GLN A 79 15.547 9.021 2.281 1.00 0.53 C ATOM 1187 O GLN A 79 16.262 9.795 1.643 1.00 0.72 O ATOM 1188 CB GLN A 79 17.440 7.384 2.351 1.00 0.63 C ATOM 1189 CG GLN A 79 17.195 6.795 0.971 1.00 1.12 C ATOM 1190 CD GLN A 79 18.467 6.297 0.315 1.00 1.67 C ATOM 1191 OE1 GLN A 79 19.408 7.060 0.098 1.00 2.24 O ATOM 1192 NE2 GLN A 79 18.499 5.009 -0.008 1.00 2.32 N ATOM 0 H GLN A 79 14.904 6.359 2.283 1.00 0.47 H new ATOM 0 HA GLN A 79 16.396 8.201 4.057 1.00 0.52 H new ATOM 0 HB2 GLN A 79 18.124 8.228 2.261 1.00 0.63 H new ATOM 0 HB3 GLN A 79 17.934 6.638 2.973 1.00 0.63 H new ATOM 0 HG2 GLN A 79 16.486 5.971 1.052 1.00 1.12 H new ATOM 0 HG3 GLN A 79 16.734 7.550 0.334 1.00 1.12 H new ATOM 0 HE21 GLN A 79 17.695 4.413 0.191 1.00 2.32 H new ATOM 0 HE22 GLN A 79 19.327 4.616 -0.455 1.00 2.32 H new ATOM 1201 N GLN A 80 14.222 9.150 2.340 1.00 0.61 N ATOM 1202 CA GLN A 80 13.533 10.234 1.644 1.00 0.72 C ATOM 1203 C GLN A 80 12.654 11.037 2.599 1.00 0.88 C ATOM 1204 O GLN A 80 12.646 12.267 2.561 1.00 1.15 O ATOM 1205 CB GLN A 80 12.680 9.692 0.492 1.00 0.74 C ATOM 1206 CG GLN A 80 12.042 10.780 -0.355 1.00 1.27 C ATOM 1207 CD GLN A 80 13.068 11.658 -1.048 1.00 1.51 C ATOM 1208 OE1 GLN A 80 13.880 11.178 -1.837 1.00 2.00 O ATOM 1209 NE2 GLN A 80 13.032 12.952 -0.755 1.00 2.07 N ATOM 0 H GLN A 80 13.609 8.522 2.859 1.00 0.61 H new ATOM 0 HA GLN A 80 14.299 10.894 1.238 1.00 0.72 H new ATOM 0 HB2 GLN A 80 13.302 9.064 -0.146 1.00 0.74 H new ATOM 0 HB3 GLN A 80 11.896 9.054 0.900 1.00 0.74 H new ATOM 0 HG2 GLN A 80 11.397 10.321 -1.104 1.00 1.27 H new ATOM 0 HG3 GLN A 80 11.406 11.400 0.276 1.00 1.27 H new ATOM 0 HE21 GLN A 80 12.340 13.306 -0.094 1.00 2.07 H new ATOM 0 HE22 GLN A 80 13.696 13.592 -1.191 1.00 2.07 H new ATOM 1218 N GLY A 81 11.902 10.333 3.444 1.00 0.99 N ATOM 1219 CA GLY A 81 11.017 11.001 4.382 1.00 1.25 C ATOM 1220 C GLY A 81 11.742 11.895 5.372 1.00 1.79 C ATOM 1221 O GLY A 81 11.100 12.619 6.133 1.00 2.18 O ATOM 0 H GLY A 81 11.891 9.314 3.495 1.00 0.99 H new ATOM 0 HA2 GLY A 81 10.296 11.600 3.825 1.00 1.25 H new ATOM 0 HA3 GLY A 81 10.450 10.250 4.932 1.00 1.25 H new ATOM 1429 N THR A 93 7.159 9.081 7.569 1.00 1.14 N ATOM 1430 CA THR A 93 7.158 7.628 7.425 1.00 1.33 C ATOM 1431 C THR A 93 6.302 7.216 6.232 1.00 1.11 C ATOM 1432 O THR A 93 5.433 7.964 5.784 1.00 1.61 O ATOM 1433 CB THR A 93 6.624 6.948 8.700 1.00 1.94 C ATOM 1434 OG1 THR A 93 7.530 7.094 9.780 1.00 2.57 O ATOM 1435 CG2 THR A 93 6.359 5.465 8.540 1.00 2.58 C ATOM 0 HA THR A 93 8.187 7.307 7.262 1.00 1.33 H new ATOM 0 HB THR A 93 5.679 7.454 8.899 1.00 1.94 H new ATOM 0 HG1 THR A 93 7.164 6.654 10.576 1.00 2.57 H new ATOM 0 HG21 THR A 93 5.985 5.059 9.480 1.00 2.58 H new ATOM 0 HG22 THR A 93 5.616 5.310 7.757 1.00 2.58 H new ATOM 0 HG23 THR A 93 7.284 4.957 8.268 1.00 2.58 H new ATOM 1443 N LEU A 94 6.556 6.018 5.731 1.00 0.80 N ATOM 1444 CA LEU A 94 5.826 5.473 4.597 1.00 0.54 C ATOM 1445 C LEU A 94 5.763 3.957 4.751 1.00 0.52 C ATOM 1446 O LEU A 94 6.672 3.354 5.321 1.00 0.65 O ATOM 1447 CB LEU A 94 6.537 5.883 3.305 1.00 0.48 C ATOM 1448 CG LEU A 94 5.763 5.730 1.992 1.00 0.52 C ATOM 1449 CD1 LEU A 94 6.545 6.378 0.859 1.00 1.39 C ATOM 1450 CD2 LEU A 94 5.499 4.266 1.671 1.00 1.37 C ATOM 0 H LEU A 94 7.275 5.395 6.099 1.00 0.80 H new ATOM 0 HA LEU A 94 4.808 5.860 4.557 1.00 0.54 H new ATOM 0 HB2 LEU A 94 6.833 6.928 3.401 1.00 0.48 H new ATOM 0 HB3 LEU A 94 7.453 5.298 3.225 1.00 0.48 H new ATOM 0 HG LEU A 94 4.799 6.227 2.104 1.00 0.52 H new ATOM 0 HD11 LEU A 94 5.992 6.268 -0.074 1.00 1.39 H new ATOM 0 HD12 LEU A 94 6.687 7.437 1.074 1.00 1.39 H new ATOM 0 HD13 LEU A 94 7.517 5.894 0.764 1.00 1.39 H new ATOM 0 HD21 LEU A 94 4.948 4.193 0.733 1.00 1.37 H new ATOM 0 HD22 LEU A 94 6.448 3.737 1.577 1.00 1.37 H new ATOM 0 HD23 LEU A 94 4.912 3.818 2.473 1.00 1.37 H new ATOM 1462 N ASP A 95 4.692 3.340 4.271 1.00 0.49 N ATOM 1463 CA ASP A 95 4.546 1.899 4.397 1.00 0.56 C ATOM 1464 C ASP A 95 3.709 1.332 3.264 1.00 0.48 C ATOM 1465 O ASP A 95 2.545 1.695 3.089 1.00 0.65 O ATOM 1466 CB ASP A 95 3.905 1.551 5.744 1.00 0.87 C ATOM 1467 CG ASP A 95 3.807 0.053 5.977 1.00 1.51 C ATOM 1468 OD1 ASP A 95 4.274 -0.712 5.108 1.00 1.92 O ATOM 1469 OD2 ASP A 95 3.260 -0.354 7.024 1.00 2.19 O ATOM 0 H ASP A 95 3.921 3.809 3.796 1.00 0.49 H new ATOM 0 HA ASP A 95 5.539 1.453 4.344 1.00 0.56 H new ATOM 0 HB2 ASP A 95 4.488 2.002 6.547 1.00 0.87 H new ATOM 0 HB3 ASP A 95 2.907 1.988 5.791 1.00 0.87 H new ATOM 1474 N LEU A 96 4.317 0.441 2.496 1.00 0.48 N ATOM 1475 CA LEU A 96 3.634 -0.184 1.374 1.00 0.63 C ATOM 1476 C LEU A 96 3.819 -1.701 1.397 1.00 0.60 C ATOM 1477 O LEU A 96 4.902 -2.198 1.695 1.00 0.76 O ATOM 1478 CB LEU A 96 4.128 0.416 0.049 1.00 0.97 C ATOM 1479 CG LEU A 96 5.578 0.109 -0.361 1.00 0.98 C ATOM 1480 CD1 LEU A 96 6.538 0.221 0.816 1.00 1.91 C ATOM 1481 CD2 LEU A 96 5.675 -1.261 -1.017 1.00 2.04 C ATOM 0 H LEU A 96 5.281 0.135 2.629 1.00 0.48 H new ATOM 0 HA LEU A 96 2.567 0.018 1.463 1.00 0.63 H new ATOM 0 HB2 LEU A 96 3.470 0.067 -0.747 1.00 0.97 H new ATOM 0 HB3 LEU A 96 4.014 1.499 0.104 1.00 0.97 H new ATOM 0 HG LEU A 96 5.877 0.861 -1.091 1.00 0.98 H new ATOM 0 HD11 LEU A 96 7.551 -0.004 0.482 1.00 1.91 H new ATOM 0 HD12 LEU A 96 6.505 1.234 1.218 1.00 1.91 H new ATOM 0 HD13 LEU A 96 6.246 -0.487 1.592 1.00 1.91 H new ATOM 0 HD21 LEU A 96 6.710 -1.457 -1.299 1.00 2.04 H new ATOM 0 HD22 LEU A 96 5.339 -2.025 -0.316 1.00 2.04 H new ATOM 0 HD23 LEU A 96 5.046 -1.284 -1.907 1.00 2.04 H new ATOM 1493 N ASP A 97 2.747 -2.431 1.094 1.00 0.55 N ATOM 1494 CA ASP A 97 2.783 -3.891 1.086 1.00 0.62 C ATOM 1495 C ASP A 97 1.836 -4.446 0.028 1.00 0.56 C ATOM 1496 O ASP A 97 0.765 -3.888 -0.213 1.00 0.70 O ATOM 1497 CB ASP A 97 2.410 -4.433 2.470 1.00 0.79 C ATOM 1498 CG ASP A 97 2.482 -5.948 2.549 1.00 1.45 C ATOM 1499 OD1 ASP A 97 1.711 -6.615 1.828 1.00 2.17 O ATOM 1500 OD2 ASP A 97 3.307 -6.465 3.329 1.00 1.98 O ATOM 0 H ASP A 97 1.840 -2.033 0.850 1.00 0.55 H new ATOM 0 HA ASP A 97 3.796 -4.212 0.842 1.00 0.62 H new ATOM 0 HB2 ASP A 97 3.079 -4.003 3.216 1.00 0.79 H new ATOM 0 HB3 ASP A 97 1.400 -4.108 2.722 1.00 0.79 H new ATOM 1505 N ILE A 98 2.241 -5.541 -0.608 1.00 0.69 N ATOM 1506 CA ILE A 98 1.432 -6.160 -1.647 1.00 0.63 C ATOM 1507 C ILE A 98 0.451 -7.183 -1.084 1.00 0.67 C ATOM 1508 O ILE A 98 0.822 -8.067 -0.310 1.00 0.93 O ATOM 1509 CB ILE A 98 2.319 -6.832 -2.719 1.00 0.74 C ATOM 1510 CG1 ILE A 98 2.444 -5.929 -3.942 1.00 1.91 C ATOM 1511 CG2 ILE A 98 1.785 -8.204 -3.116 1.00 1.40 C ATOM 1512 CD1 ILE A 98 3.351 -6.483 -5.014 1.00 2.73 C ATOM 0 H ILE A 98 3.124 -6.016 -0.421 1.00 0.69 H new ATOM 0 HA ILE A 98 0.857 -5.356 -2.107 1.00 0.63 H new ATOM 0 HB ILE A 98 3.308 -6.981 -2.286 1.00 0.74 H new ATOM 0 HG12 ILE A 98 1.453 -5.766 -4.365 1.00 1.91 H new ATOM 0 HG13 ILE A 98 2.820 -4.956 -3.627 1.00 1.91 H new ATOM 0 HG21 ILE A 98 2.436 -8.643 -3.872 1.00 1.40 H new ATOM 0 HG22 ILE A 98 1.758 -8.851 -2.240 1.00 1.40 H new ATOM 0 HG23 ILE A 98 0.779 -8.099 -3.521 1.00 1.40 H new ATOM 0 HD11 ILE A 98 3.391 -5.787 -5.852 1.00 2.73 H new ATOM 0 HD12 ILE A 98 4.353 -6.620 -4.608 1.00 2.73 H new ATOM 0 HD13 ILE A 98 2.965 -7.443 -5.357 1.00 2.73 H new ATOM 1524 N MET A 99 -0.801 -7.061 -1.506 1.00 0.53 N ATOM 1525 CA MET A 99 -1.847 -7.979 -1.084 1.00 0.63 C ATOM 1526 C MET A 99 -2.158 -8.982 -2.194 1.00 0.63 C ATOM 1527 O MET A 99 -2.838 -9.973 -1.964 1.00 0.87 O ATOM 1528 CB MET A 99 -3.115 -7.228 -0.670 1.00 0.70 C ATOM 1529 CG MET A 99 -3.480 -6.070 -1.583 1.00 0.93 C ATOM 1530 SD MET A 99 -2.397 -4.646 -1.363 1.00 1.77 S ATOM 1531 CE MET A 99 -2.564 -4.372 0.399 1.00 2.48 C ATOM 0 H MET A 99 -1.116 -6.330 -2.144 1.00 0.53 H new ATOM 0 HA MET A 99 -1.482 -8.523 -0.213 1.00 0.63 H new ATOM 0 HB2 MET A 99 -3.948 -7.931 -0.643 1.00 0.70 H new ATOM 0 HB3 MET A 99 -2.985 -6.849 0.344 1.00 0.70 H new ATOM 0 HG2 MET A 99 -3.432 -6.401 -2.620 1.00 0.93 H new ATOM 0 HG3 MET A 99 -4.510 -5.771 -1.391 1.00 0.93 H new ATOM 0 HE1 MET A 99 -2.978 -3.379 0.575 1.00 2.48 H new ATOM 0 HE2 MET A 99 -3.230 -5.124 0.823 1.00 2.48 H new ATOM 0 HE3 MET A 99 -1.585 -4.446 0.873 1.00 2.48 H new ATOM 1541 N LEU A 100 -1.639 -8.724 -3.396 1.00 0.51 N ATOM 1542 CA LEU A 100 -1.838 -9.620 -4.542 1.00 0.55 C ATOM 1543 C LEU A 100 -0.590 -9.649 -5.421 1.00 0.54 C ATOM 1544 O LEU A 100 0.107 -8.644 -5.544 1.00 0.76 O ATOM 1545 CB LEU A 100 -3.041 -9.194 -5.397 1.00 0.75 C ATOM 1546 CG LEU A 100 -4.426 -9.533 -4.840 1.00 1.12 C ATOM 1547 CD1 LEU A 100 -4.842 -8.545 -3.763 1.00 1.87 C ATOM 1548 CD2 LEU A 100 -5.450 -9.556 -5.965 1.00 1.69 C ATOM 0 H LEU A 100 -1.076 -7.900 -3.604 1.00 0.51 H new ATOM 0 HA LEU A 100 -2.032 -10.614 -4.139 1.00 0.55 H new ATOM 0 HB2 LEU A 100 -2.988 -8.116 -5.548 1.00 0.75 H new ATOM 0 HB3 LEU A 100 -2.944 -9.659 -6.378 1.00 0.75 H new ATOM 0 HG LEU A 100 -4.377 -10.522 -4.384 1.00 1.12 H new ATOM 0 HD11 LEU A 100 -5.830 -8.812 -3.387 1.00 1.87 H new ATOM 0 HD12 LEU A 100 -4.122 -8.574 -2.945 1.00 1.87 H new ATOM 0 HD13 LEU A 100 -4.873 -7.540 -4.184 1.00 1.87 H new ATOM 0 HD21 LEU A 100 -6.432 -9.798 -5.558 1.00 1.69 H new ATOM 0 HD22 LEU A 100 -5.487 -8.577 -6.444 1.00 1.69 H new ATOM 0 HD23 LEU A 100 -5.166 -10.309 -6.700 1.00 1.69 H new ATOM 1560 N PHE A 101 -0.313 -10.795 -6.046 1.00 0.46 N ATOM 1561 CA PHE A 101 0.852 -10.910 -6.920 1.00 0.46 C ATOM 1562 C PHE A 101 0.495 -11.651 -8.207 1.00 0.51 C ATOM 1563 O PHE A 101 0.950 -12.763 -8.449 1.00 0.58 O ATOM 1564 CB PHE A 101 1.993 -11.630 -6.195 1.00 0.45 C ATOM 1565 CG PHE A 101 3.275 -11.681 -6.980 1.00 0.51 C ATOM 1566 CD1 PHE A 101 3.828 -10.522 -7.498 1.00 0.56 C ATOM 1567 CD2 PHE A 101 3.926 -12.887 -7.199 1.00 0.58 C ATOM 1568 CE1 PHE A 101 5.006 -10.563 -8.219 1.00 0.65 C ATOM 1569 CE2 PHE A 101 5.104 -12.933 -7.920 1.00 0.68 C ATOM 1570 CZ PHE A 101 5.644 -11.783 -8.431 1.00 0.71 C ATOM 0 H PHE A 101 -0.872 -11.645 -5.964 1.00 0.46 H new ATOM 0 HA PHE A 101 1.180 -9.904 -7.183 1.00 0.46 H new ATOM 0 HB2 PHE A 101 2.180 -11.130 -5.245 1.00 0.45 H new ATOM 0 HB3 PHE A 101 1.679 -12.648 -5.964 1.00 0.45 H new ATOM 0 HD1 PHE A 101 3.333 -9.576 -7.337 1.00 0.56 H new ATOM 0 HD2 PHE A 101 3.507 -13.800 -6.801 1.00 0.58 H new ATOM 0 HE1 PHE A 101 5.430 -9.653 -8.617 1.00 0.65 H new ATOM 0 HE2 PHE A 101 5.600 -13.879 -8.081 1.00 0.68 H new ATOM 0 HZ PHE A 101 6.563 -11.822 -8.997 1.00 0.71 H new ATOM 1580 N GLY A 102 -0.319 -11.007 -9.028 1.00 0.54 N ATOM 1581 CA GLY A 102 -0.746 -11.583 -10.290 1.00 0.65 C ATOM 1582 C GLY A 102 -1.781 -12.667 -10.097 1.00 0.67 C ATOM 1583 O GLY A 102 -1.777 -13.671 -10.811 1.00 0.99 O ATOM 0 H GLY A 102 -0.699 -10.079 -8.840 1.00 0.54 H new ATOM 0 HA2 GLY A 102 -1.157 -10.799 -10.926 1.00 0.65 H new ATOM 0 HA3 GLY A 102 0.118 -11.996 -10.811 1.00 0.65 H new ATOM 1587 N ASN A 103 -2.656 -12.477 -9.109 1.00 0.58 N ATOM 1588 CA ASN A 103 -3.684 -13.461 -8.800 1.00 0.64 C ATOM 1589 C ASN A 103 -3.033 -14.818 -8.603 1.00 0.71 C ATOM 1590 O ASN A 103 -3.659 -15.867 -8.748 1.00 1.08 O ATOM 1591 CB ASN A 103 -4.739 -13.517 -9.905 1.00 0.78 C ATOM 1592 CG ASN A 103 -5.601 -12.274 -9.929 1.00 1.18 C ATOM 1593 OD1 ASN A 103 -6.884 -12.442 -9.629 1.00 2.12 O flip ATOM 1594 ND2 ASN A 103 -5.122 -11.173 -10.202 1.00 1.38 N flip ATOM 0 H ASN A 103 -2.670 -11.650 -8.512 1.00 0.58 H new ATOM 0 HA ASN A 103 -4.192 -13.170 -7.881 1.00 0.64 H new ATOM 0 HB2 ASN A 103 -4.247 -13.636 -10.870 1.00 0.78 H new ATOM 0 HB3 ASN A 103 -5.371 -14.393 -9.759 1.00 0.78 H new ATOM 0 HD21 ASN A 103 -4.131 -11.090 -10.427 1.00 1.38 H new ATOM 0 HD22 ASN A 103 -5.717 -10.344 -10.203 1.00 1.38 H new ATOM 1601 N GLU A 104 -1.751 -14.759 -8.274 1.00 0.53 N ATOM 1602 CA GLU A 104 -0.939 -15.931 -8.046 1.00 0.61 C ATOM 1603 C GLU A 104 -1.042 -16.380 -6.598 1.00 0.64 C ATOM 1604 O GLU A 104 -0.846 -15.587 -5.685 1.00 0.84 O ATOM 1605 CB GLU A 104 0.507 -15.583 -8.393 1.00 0.70 C ATOM 1606 CG GLU A 104 0.887 -15.887 -9.831 1.00 1.16 C ATOM 1607 CD GLU A 104 0.935 -17.374 -10.131 1.00 1.28 C ATOM 1608 OE1 GLU A 104 0.690 -18.173 -9.203 1.00 1.87 O ATOM 1609 OE2 GLU A 104 1.215 -17.740 -11.293 1.00 1.79 O ATOM 0 H GLU A 104 -1.245 -13.881 -8.158 1.00 0.53 H new ATOM 0 HA GLU A 104 -1.288 -16.752 -8.672 1.00 0.61 H new ATOM 0 HB2 GLU A 104 0.671 -14.523 -8.201 1.00 0.70 H new ATOM 0 HB3 GLU A 104 1.172 -16.134 -7.728 1.00 0.70 H new ATOM 0 HG2 GLU A 104 0.170 -15.410 -10.499 1.00 1.16 H new ATOM 0 HG3 GLU A 104 1.861 -15.448 -10.044 1.00 1.16 H new ATOM 1616 N VAL A 105 -1.334 -17.653 -6.385 1.00 0.62 N ATOM 1617 CA VAL A 105 -1.440 -18.169 -5.029 1.00 0.66 C ATOM 1618 C VAL A 105 -0.048 -18.358 -4.464 1.00 0.70 C ATOM 1619 O VAL A 105 0.545 -19.433 -4.564 1.00 0.83 O ATOM 1620 CB VAL A 105 -2.210 -19.503 -4.972 1.00 0.75 C ATOM 1621 CG1 VAL A 105 -2.328 -19.993 -3.535 1.00 1.18 C ATOM 1622 CG2 VAL A 105 -3.585 -19.353 -5.605 1.00 0.95 C ATOM 0 H VAL A 105 -1.500 -18.339 -7.121 1.00 0.62 H new ATOM 0 HA VAL A 105 -2.000 -17.446 -4.436 1.00 0.66 H new ATOM 0 HB VAL A 105 -1.652 -20.247 -5.540 1.00 0.75 H new ATOM 0 HG11 VAL A 105 -2.875 -20.936 -3.516 1.00 1.18 H new ATOM 0 HG12 VAL A 105 -1.332 -20.143 -3.119 1.00 1.18 H new ATOM 0 HG13 VAL A 105 -2.862 -19.252 -2.941 1.00 1.18 H new ATOM 0 HG21 VAL A 105 -4.114 -20.305 -5.556 1.00 0.95 H new ATOM 0 HG22 VAL A 105 -4.153 -18.594 -5.067 1.00 0.95 H new ATOM 0 HG23 VAL A 105 -3.475 -19.053 -6.647 1.00 0.95 H new ATOM 1632 N ILE A 106 0.483 -17.283 -3.911 1.00 0.65 N ATOM 1633 CA ILE A 106 1.824 -17.285 -3.369 1.00 0.72 C ATOM 1634 C ILE A 106 1.851 -16.666 -1.977 1.00 0.77 C ATOM 1635 O ILE A 106 1.685 -15.457 -1.813 1.00 0.84 O ATOM 1636 CB ILE A 106 2.751 -16.532 -4.338 1.00 0.81 C ATOM 1637 CG1 ILE A 106 4.184 -16.473 -3.830 1.00 0.76 C ATOM 1638 CG2 ILE A 106 2.224 -15.128 -4.600 1.00 1.33 C ATOM 1639 CD1 ILE A 106 5.104 -15.808 -4.825 1.00 0.76 C ATOM 0 H ILE A 106 -0.002 -16.390 -3.826 1.00 0.65 H new ATOM 0 HA ILE A 106 2.175 -18.312 -3.265 1.00 0.72 H new ATOM 0 HB ILE A 106 2.759 -17.090 -5.275 1.00 0.81 H new ATOM 0 HG12 ILE A 106 4.213 -15.927 -2.887 1.00 0.76 H new ATOM 0 HG13 ILE A 106 4.539 -17.483 -3.625 1.00 0.76 H new ATOM 0 HG21 ILE A 106 2.893 -14.611 -5.288 1.00 1.33 H new ATOM 0 HG22 ILE A 106 1.228 -15.189 -5.039 1.00 1.33 H new ATOM 0 HG23 ILE A 106 2.173 -14.577 -3.661 1.00 1.33 H new ATOM 0 HD11 ILE A 106 6.118 -15.786 -4.425 1.00 0.76 H new ATOM 0 HD12 ILE A 106 5.095 -16.369 -5.760 1.00 0.76 H new ATOM 0 HD13 ILE A 106 4.764 -14.789 -5.010 1.00 0.76 H new ATOM 1651 N ASN A 107 2.029 -17.517 -0.973 1.00 0.80 N ATOM 1652 CA ASN A 107 2.041 -17.063 0.410 1.00 0.91 C ATOM 1653 C ASN A 107 3.369 -17.361 1.098 1.00 0.92 C ATOM 1654 O ASN A 107 3.910 -18.461 0.984 1.00 1.03 O ATOM 1655 CB ASN A 107 0.906 -17.734 1.177 1.00 1.00 C ATOM 1656 CG ASN A 107 -0.367 -17.814 0.358 1.00 1.11 C ATOM 1657 OD1 ASN A 107 -1.329 -16.967 0.683 1.00 1.79 O flip ATOM 1658 ND2 ASN A 107 -0.470 -18.611 -0.575 1.00 1.12 N flip ATOM 0 H ASN A 107 2.166 -18.521 -1.091 1.00 0.80 H new ATOM 0 HA ASN A 107 1.906 -15.981 0.406 1.00 0.91 H new ATOM 0 HB2 ASN A 107 1.211 -18.738 1.470 1.00 1.00 H new ATOM 0 HB3 ASN A 107 0.712 -17.179 2.095 1.00 1.00 H new ATOM 0 HD21 ASN A 107 0.298 -19.247 -0.790 1.00 1.12 H new ATOM 0 HD22 ASN A 107 -1.324 -18.636 -1.133 1.00 1.12 H new ATOM 1665 N THR A 108 3.873 -16.371 1.830 1.00 0.92 N ATOM 1666 CA THR A 108 5.125 -16.506 2.567 1.00 1.01 C ATOM 1667 C THR A 108 5.094 -15.629 3.817 1.00 1.15 C ATOM 1668 O THR A 108 4.922 -16.129 4.930 1.00 1.79 O ATOM 1669 CB THR A 108 6.320 -16.129 1.686 1.00 1.00 C ATOM 1670 OG1 THR A 108 6.171 -14.823 1.165 1.00 1.66 O ATOM 1671 CG2 THR A 108 6.530 -17.069 0.519 1.00 1.26 C ATOM 0 H THR A 108 3.428 -15.458 1.928 1.00 0.92 H new ATOM 0 HA THR A 108 5.237 -17.548 2.866 1.00 1.01 H new ATOM 0 HB THR A 108 7.188 -16.194 2.342 1.00 1.00 H new ATOM 0 HG1 THR A 108 7.046 -14.480 0.886 1.00 1.66 H new ATOM 0 HG21 THR A 108 7.393 -16.742 -0.061 1.00 1.26 H new ATOM 0 HG22 THR A 108 6.705 -18.078 0.892 1.00 1.26 H new ATOM 0 HG23 THR A 108 5.644 -17.065 -0.115 1.00 1.26 H new ATOM 1679 N GLU A 109 5.245 -14.317 3.623 1.00 0.95 N ATOM 1680 CA GLU A 109 5.222 -13.361 4.729 1.00 1.05 C ATOM 1681 C GLU A 109 5.461 -11.942 4.231 1.00 1.06 C ATOM 1682 O GLU A 109 4.993 -10.978 4.836 1.00 1.32 O ATOM 1683 CB GLU A 109 6.272 -13.723 5.785 1.00 1.20 C ATOM 1684 CG GLU A 109 7.698 -13.682 5.262 1.00 1.46 C ATOM 1685 CD GLU A 109 8.720 -14.032 6.326 1.00 2.13 C ATOM 1686 OE1 GLU A 109 8.773 -13.325 7.354 1.00 2.57 O ATOM 1687 OE2 GLU A 109 9.467 -15.015 6.132 1.00 2.74 O ATOM 0 H GLU A 109 5.385 -13.893 2.706 1.00 0.95 H new ATOM 0 HA GLU A 109 4.233 -13.409 5.184 1.00 1.05 H new ATOM 0 HB2 GLU A 109 6.182 -13.035 6.626 1.00 1.20 H new ATOM 0 HB3 GLU A 109 6.062 -14.722 6.167 1.00 1.20 H new ATOM 0 HG2 GLU A 109 7.795 -14.377 4.428 1.00 1.46 H new ATOM 0 HG3 GLU A 109 7.910 -12.686 4.874 1.00 1.46 H new ATOM 1694 N ARG A 110 6.181 -11.818 3.120 1.00 0.93 N ATOM 1695 CA ARG A 110 6.464 -10.507 2.548 1.00 0.97 C ATOM 1696 C ARG A 110 5.447 -10.199 1.467 1.00 0.79 C ATOM 1697 O ARG A 110 5.407 -9.092 0.930 1.00 0.87 O ATOM 1698 CB ARG A 110 7.881 -10.448 1.967 1.00 1.17 C ATOM 1699 CG ARG A 110 8.444 -9.040 1.881 1.00 1.05 C ATOM 1700 CD ARG A 110 8.703 -8.470 3.266 1.00 1.57 C ATOM 1701 NE ARG A 110 9.664 -9.272 4.019 1.00 2.14 N ATOM 1702 CZ ARG A 110 10.936 -9.434 3.661 1.00 2.68 C ATOM 1703 NH1 ARG A 110 11.408 -8.835 2.577 1.00 2.96 N ATOM 1704 NH2 ARG A 110 11.739 -10.193 4.395 1.00 3.52 N ATOM 0 H ARG A 110 6.576 -12.603 2.602 1.00 0.93 H new ATOM 0 HA ARG A 110 6.397 -9.762 3.341 1.00 0.97 H new ATOM 0 HB2 ARG A 110 8.543 -11.058 2.582 1.00 1.17 H new ATOM 0 HB3 ARG A 110 7.875 -10.890 0.970 1.00 1.17 H new ATOM 0 HG2 ARG A 110 9.372 -9.050 1.309 1.00 1.05 H new ATOM 0 HG3 ARG A 110 7.746 -8.398 1.344 1.00 1.05 H new ATOM 0 HD2 ARG A 110 9.076 -7.450 3.174 1.00 1.57 H new ATOM 0 HD3 ARG A 110 7.764 -8.418 3.817 1.00 1.57 H new ATOM 0 HE ARG A 110 9.342 -9.735 4.869 1.00 2.14 H new ATOM 0 HH11 ARG A 110 10.796 -8.246 2.012 1.00 2.96 H new ATOM 0 HH12 ARG A 110 12.383 -8.963 2.308 1.00 2.96 H new ATOM 0 HH21 ARG A 110 11.382 -10.652 5.233 1.00 3.52 H new ATOM 0 HH22 ARG A 110 12.714 -10.318 4.121 1.00 3.52 H new ATOM 1718 N LEU A 111 4.621 -11.190 1.160 1.00 0.72 N ATOM 1719 CA LEU A 111 3.595 -11.029 0.151 1.00 0.75 C ATOM 1720 C LEU A 111 2.541 -12.124 0.253 1.00 0.66 C ATOM 1721 O LEU A 111 2.830 -13.312 0.098 1.00 0.70 O ATOM 1722 CB LEU A 111 4.209 -11.025 -1.248 1.00 0.95 C ATOM 1723 CG LEU A 111 4.625 -12.393 -1.799 1.00 0.69 C ATOM 1724 CD1 LEU A 111 4.967 -12.293 -3.275 1.00 0.95 C ATOM 1725 CD2 LEU A 111 5.806 -12.946 -1.020 1.00 1.36 C ATOM 0 H LEU A 111 4.645 -12.111 1.597 1.00 0.72 H new ATOM 0 HA LEU A 111 3.109 -10.069 0.327 1.00 0.75 H new ATOM 0 HB2 LEU A 111 3.492 -10.580 -1.937 1.00 0.95 H new ATOM 0 HB3 LEU A 111 5.085 -10.377 -1.237 1.00 0.95 H new ATOM 0 HG LEU A 111 3.784 -13.077 -1.684 1.00 0.69 H new ATOM 0 HD11 LEU A 111 5.260 -13.274 -3.648 1.00 0.95 H new ATOM 0 HD12 LEU A 111 4.096 -11.940 -3.827 1.00 0.95 H new ATOM 0 HD13 LEU A 111 5.791 -11.592 -3.411 1.00 0.95 H new ATOM 0 HD21 LEU A 111 6.087 -13.918 -1.426 1.00 1.36 H new ATOM 0 HD22 LEU A 111 6.650 -12.261 -1.103 1.00 1.36 H new ATOM 0 HD23 LEU A 111 5.530 -13.057 0.029 1.00 1.36 H new ATOM 1737 N THR A 112 1.314 -11.708 0.508 1.00 0.71 N ATOM 1738 CA THR A 112 0.202 -12.633 0.616 1.00 0.67 C ATOM 1739 C THR A 112 -0.894 -12.240 -0.372 1.00 0.66 C ATOM 1740 O THR A 112 -1.631 -11.282 -0.144 1.00 0.82 O ATOM 1741 CB THR A 112 -0.325 -12.641 2.054 1.00 0.74 C ATOM 1742 OG1 THR A 112 -1.444 -13.501 2.173 1.00 0.75 O ATOM 1743 CG2 THR A 112 -0.731 -11.272 2.557 1.00 0.83 C ATOM 0 H THR A 112 1.062 -10.729 0.645 1.00 0.71 H new ATOM 0 HA THR A 112 0.536 -13.641 0.370 1.00 0.67 H new ATOM 0 HB THR A 112 0.507 -12.993 2.663 1.00 0.74 H new ATOM 0 HG1 THR A 112 -1.667 -13.619 3.120 1.00 0.75 H new ATOM 0 HG21 THR A 112 -1.094 -11.354 3.581 1.00 0.83 H new ATOM 0 HG22 THR A 112 0.130 -10.604 2.529 1.00 0.83 H new ATOM 0 HG23 THR A 112 -1.522 -10.871 1.923 1.00 0.83 H new ATOM 1751 N VAL A 113 -0.994 -12.977 -1.478 1.00 0.60 N ATOM 1752 CA VAL A 113 -1.999 -12.687 -2.491 1.00 0.61 C ATOM 1753 C VAL A 113 -3.390 -12.918 -1.908 1.00 0.64 C ATOM 1754 O VAL A 113 -4.155 -11.969 -1.758 1.00 0.80 O ATOM 1755 CB VAL A 113 -1.766 -13.514 -3.768 1.00 0.64 C ATOM 1756 CG1 VAL A 113 -2.873 -13.277 -4.782 1.00 1.27 C ATOM 1757 CG2 VAL A 113 -0.411 -13.170 -4.354 1.00 1.38 C ATOM 0 H VAL A 113 -0.394 -13.774 -1.691 1.00 0.60 H new ATOM 0 HA VAL A 113 -1.916 -11.640 -2.783 1.00 0.61 H new ATOM 0 HB VAL A 113 -1.782 -14.573 -3.510 1.00 0.64 H new ATOM 0 HG11 VAL A 113 -2.683 -13.874 -5.674 1.00 1.27 H new ATOM 0 HG12 VAL A 113 -3.831 -13.566 -4.349 1.00 1.27 H new ATOM 0 HG13 VAL A 113 -2.900 -12.221 -5.051 1.00 1.27 H new ATOM 0 HG21 VAL A 113 -0.246 -13.756 -5.258 1.00 1.38 H new ATOM 0 HG22 VAL A 113 -0.379 -12.108 -4.599 1.00 1.38 H new ATOM 0 HG23 VAL A 113 0.368 -13.398 -3.627 1.00 1.38 H new ATOM 1767 N PRO A 114 -3.735 -14.165 -1.510 1.00 0.61 N ATOM 1768 CA PRO A 114 -5.028 -14.443 -0.880 1.00 0.70 C ATOM 1769 C PRO A 114 -5.229 -13.512 0.308 1.00 0.76 C ATOM 1770 O PRO A 114 -6.336 -13.336 0.815 1.00 0.88 O ATOM 1771 CB PRO A 114 -4.888 -15.889 -0.413 1.00 0.68 C ATOM 1772 CG PRO A 114 -3.868 -16.478 -1.314 1.00 0.83 C ATOM 1773 CD PRO A 114 -2.898 -15.373 -1.594 1.00 0.63 C ATOM 0 HA PRO A 114 -5.880 -14.295 -1.544 1.00 0.70 H new ATOM 0 HB2 PRO A 114 -4.573 -15.940 0.629 1.00 0.68 H new ATOM 0 HB3 PRO A 114 -5.836 -16.422 -0.486 1.00 0.68 H new ATOM 0 HG2 PRO A 114 -3.371 -17.327 -0.843 1.00 0.83 H new ATOM 0 HG3 PRO A 114 -4.322 -16.845 -2.235 1.00 0.83 H new ATOM 0 HD2 PRO A 114 -2.088 -15.354 -0.865 1.00 0.63 H new ATOM 0 HD3 PRO A 114 -2.440 -15.478 -2.577 1.00 0.63 H new ATOM 1781 N HIS A 115 -4.109 -12.916 0.707 1.00 0.82 N ATOM 1782 CA HIS A 115 -4.018 -11.964 1.803 1.00 0.95 C ATOM 1783 C HIS A 115 -4.921 -12.287 2.986 1.00 0.86 C ATOM 1784 O HIS A 115 -6.131 -12.059 2.955 1.00 0.88 O ATOM 1785 CB HIS A 115 -4.289 -10.537 1.300 1.00 1.14 C ATOM 1786 CG HIS A 115 -5.670 -10.294 0.765 1.00 2.17 C ATOM 1787 ND1 HIS A 115 -6.192 -10.954 -0.326 1.00 3.14 N ATOM 1788 CD2 HIS A 115 -6.631 -9.429 1.170 1.00 2.95 C ATOM 1789 CE1 HIS A 115 -7.410 -10.508 -0.569 1.00 4.09 C ATOM 1790 NE2 HIS A 115 -7.701 -9.582 0.325 1.00 3.97 N ATOM 0 H HIS A 115 -3.210 -13.091 0.258 1.00 0.82 H new ATOM 0 HA HIS A 115 -2.997 -12.040 2.176 1.00 0.95 H new ATOM 0 HB2 HIS A 115 -4.107 -9.841 2.119 1.00 1.14 H new ATOM 0 HB3 HIS A 115 -3.568 -10.303 0.517 1.00 1.14 H new ATOM 0 HD1 HIS A 115 -5.711 -11.676 -0.863 1.00 3.14 H new ATOM 0 HD2 HIS A 115 -6.567 -8.746 2.004 1.00 2.95 H new ATOM 0 HE1 HIS A 115 -8.059 -10.844 -1.365 1.00 4.09 H new ATOM 1799 N TYR A 116 -4.297 -12.754 4.062 1.00 1.04 N ATOM 1800 CA TYR A 116 -5.015 -13.033 5.291 1.00 1.14 C ATOM 1801 C TYR A 116 -4.552 -12.047 6.352 1.00 1.04 C ATOM 1802 O TYR A 116 -3.518 -12.258 6.985 1.00 1.47 O ATOM 1803 CB TYR A 116 -4.772 -14.471 5.763 1.00 1.62 C ATOM 1804 CG TYR A 116 -5.456 -15.524 4.919 1.00 2.18 C ATOM 1805 CD1 TYR A 116 -5.308 -15.548 3.538 1.00 3.06 C ATOM 1806 CD2 TYR A 116 -6.253 -16.496 5.509 1.00 2.56 C ATOM 1807 CE1 TYR A 116 -5.936 -16.511 2.770 1.00 4.05 C ATOM 1808 CE2 TYR A 116 -6.883 -17.463 4.749 1.00 3.50 C ATOM 1809 CZ TYR A 116 -6.720 -17.465 3.380 1.00 4.18 C ATOM 1810 OH TYR A 116 -7.347 -18.425 2.618 1.00 5.29 O ATOM 0 H TYR A 116 -3.296 -12.946 4.104 1.00 1.04 H new ATOM 0 HA TYR A 116 -6.085 -12.924 5.114 1.00 1.14 H new ATOM 0 HB2 TYR A 116 -3.699 -14.664 5.766 1.00 1.62 H new ATOM 0 HB3 TYR A 116 -5.116 -14.567 6.793 1.00 1.62 H new ATOM 0 HD1 TYR A 116 -4.693 -14.802 3.057 1.00 3.06 H new ATOM 0 HD2 TYR A 116 -6.383 -16.496 6.581 1.00 2.56 H new ATOM 0 HE1 TYR A 116 -5.812 -16.515 1.697 1.00 4.05 H new ATOM 0 HE2 TYR A 116 -7.499 -18.212 5.224 1.00 3.50 H new ATOM 0 HH TYR A 116 -7.860 -19.022 3.202 1.00 5.29 H new ATOM 1820 N ASP A 117 -5.333 -10.978 6.516 1.00 0.77 N ATOM 1821 CA ASP A 117 -5.055 -9.902 7.475 1.00 0.80 C ATOM 1822 C ASP A 117 -5.570 -8.583 6.911 1.00 0.72 C ATOM 1823 O ASP A 117 -6.306 -7.856 7.573 1.00 0.82 O ATOM 1824 CB ASP A 117 -3.554 -9.767 7.768 1.00 1.03 C ATOM 1825 CG ASP A 117 -3.258 -8.777 8.879 1.00 1.77 C ATOM 1826 OD1 ASP A 117 -4.215 -8.289 9.512 1.00 2.46 O ATOM 1827 OD2 ASP A 117 -2.065 -8.502 9.124 1.00 2.22 O ATOM 0 H ASP A 117 -6.188 -10.831 5.980 1.00 0.77 H new ATOM 0 HA ASP A 117 -5.560 -10.149 8.409 1.00 0.80 H new ATOM 0 HB2 ASP A 117 -3.153 -10.743 8.041 1.00 1.03 H new ATOM 0 HB3 ASP A 117 -3.038 -9.453 6.861 1.00 1.03 H new ATOM 1832 N MET A 118 -5.181 -8.294 5.667 1.00 0.69 N ATOM 1833 CA MET A 118 -5.600 -7.068 4.981 1.00 0.72 C ATOM 1834 C MET A 118 -7.108 -6.955 5.005 1.00 0.71 C ATOM 1835 O MET A 118 -7.673 -5.870 4.874 1.00 0.73 O ATOM 1836 CB MET A 118 -5.113 -7.083 3.538 1.00 0.83 C ATOM 1837 CG MET A 118 -3.784 -7.775 3.383 1.00 1.15 C ATOM 1838 SD MET A 118 -2.424 -6.861 4.136 1.00 2.40 S ATOM 1839 CE MET A 118 -1.050 -7.959 3.803 1.00 3.10 C ATOM 0 H MET A 118 -4.573 -8.896 5.111 1.00 0.69 H new ATOM 0 HA MET A 118 -5.165 -6.211 5.496 1.00 0.72 H new ATOM 0 HB2 MET A 118 -5.854 -7.582 2.914 1.00 0.83 H new ATOM 0 HB3 MET A 118 -5.030 -6.058 3.176 1.00 0.83 H new ATOM 0 HG2 MET A 118 -3.842 -8.766 3.833 1.00 1.15 H new ATOM 0 HG3 MET A 118 -3.576 -7.918 2.323 1.00 1.15 H new ATOM 0 HE1 MET A 118 -0.134 -7.530 4.209 1.00 3.10 H new ATOM 0 HE2 MET A 118 -1.236 -8.926 4.270 1.00 3.10 H new ATOM 0 HE3 MET A 118 -0.942 -8.091 2.726 1.00 3.10 H new ATOM 1849 N LYS A 119 -7.746 -8.094 5.200 1.00 0.80 N ATOM 1850 CA LYS A 119 -9.188 -8.166 5.283 1.00 0.95 C ATOM 1851 C LYS A 119 -9.671 -7.488 6.553 1.00 0.99 C ATOM 1852 O LYS A 119 -10.836 -7.607 6.930 1.00 1.24 O ATOM 1853 CB LYS A 119 -9.630 -9.627 5.266 1.00 1.15 C ATOM 1854 CG LYS A 119 -8.772 -10.531 6.137 1.00 1.30 C ATOM 1855 CD LYS A 119 -9.309 -11.954 6.171 1.00 1.70 C ATOM 1856 CE LYS A 119 -10.695 -12.019 6.790 1.00 2.06 C ATOM 1857 NZ LYS A 119 -11.224 -13.410 6.823 1.00 2.67 N ATOM 0 H LYS A 119 -7.277 -8.994 5.305 1.00 0.80 H new ATOM 0 HA LYS A 119 -9.623 -7.652 4.426 1.00 0.95 H new ATOM 0 HB2 LYS A 119 -10.665 -9.689 5.601 1.00 1.15 H new ATOM 0 HB3 LYS A 119 -9.605 -9.994 4.240 1.00 1.15 H new ATOM 0 HG2 LYS A 119 -7.750 -10.537 5.759 1.00 1.30 H new ATOM 0 HG3 LYS A 119 -8.735 -10.132 7.151 1.00 1.30 H new ATOM 0 HD2 LYS A 119 -9.344 -12.354 5.157 1.00 1.70 H new ATOM 0 HD3 LYS A 119 -8.627 -12.586 6.739 1.00 1.70 H new ATOM 0 HE2 LYS A 119 -10.659 -11.620 7.804 1.00 2.06 H new ATOM 0 HE3 LYS A 119 -11.376 -11.385 6.222 1.00 2.06 H new ATOM 0 HZ1 LYS A 119 -12.171 -13.411 7.252 1.00 2.67 H new ATOM 0 HZ2 LYS A 119 -11.283 -13.782 5.854 1.00 2.67 H new ATOM 0 HZ3 LYS A 119 -10.588 -14.010 7.386 1.00 2.67 H new ATOM 1871 N ASN A 120 -8.761 -6.779 7.218 1.00 0.90 N ATOM 1872 CA ASN A 120 -9.109 -6.090 8.456 1.00 1.04 C ATOM 1873 C ASN A 120 -9.195 -4.582 8.248 1.00 1.08 C ATOM 1874 O ASN A 120 -9.419 -3.836 9.203 1.00 1.35 O ATOM 1875 CB ASN A 120 -8.096 -6.409 9.566 1.00 1.08 C ATOM 1876 CG ASN A 120 -6.860 -5.522 9.535 1.00 1.41 C ATOM 1877 OD1 ASN A 120 -6.947 -4.304 9.699 1.00 1.77 O ATOM 1878 ND2 ASN A 120 -5.698 -6.129 9.348 1.00 1.84 N ATOM 0 H ASN A 120 -7.790 -6.668 6.925 1.00 0.90 H new ATOM 0 HA ASN A 120 -10.091 -6.451 8.762 1.00 1.04 H new ATOM 0 HB2 ASN A 120 -8.585 -6.303 10.534 1.00 1.08 H new ATOM 0 HB3 ASN A 120 -7.788 -7.451 9.477 1.00 1.08 H new ATOM 0 HD21 ASN A 120 -4.835 -5.586 9.336 1.00 1.84 H new ATOM 0 HD22 ASN A 120 -5.666 -7.140 9.216 1.00 1.84 H new ATOM 1885 N ARG A 121 -9.011 -4.123 7.011 1.00 0.93 N ATOM 1886 CA ARG A 121 -9.066 -2.691 6.743 1.00 1.06 C ATOM 1887 C ARG A 121 -9.454 -2.354 5.305 1.00 0.84 C ATOM 1888 O ARG A 121 -8.873 -2.861 4.337 1.00 0.87 O ATOM 1889 CB ARG A 121 -7.728 -2.035 7.084 1.00 1.31 C ATOM 1890 CG ARG A 121 -6.532 -2.578 6.312 1.00 1.14 C ATOM 1891 CD ARG A 121 -6.142 -3.973 6.771 1.00 1.39 C ATOM 1892 NE ARG A 121 -4.777 -4.320 6.379 1.00 1.56 N ATOM 1893 CZ ARG A 121 -3.695 -3.722 6.868 1.00 1.73 C ATOM 1894 NH1 ARG A 121 -3.814 -2.755 7.768 1.00 2.29 N ATOM 1895 NH2 ARG A 121 -2.489 -4.096 6.461 1.00 2.04 N ATOM 0 H ARG A 121 -8.827 -4.708 6.196 1.00 0.93 H new ATOM 0 HA ARG A 121 -9.854 -2.293 7.383 1.00 1.06 H new ATOM 0 HB2 ARG A 121 -7.807 -0.964 6.897 1.00 1.31 H new ATOM 0 HB3 ARG A 121 -7.540 -2.159 8.151 1.00 1.31 H new ATOM 0 HG2 ARG A 121 -6.767 -2.599 5.248 1.00 1.14 H new ATOM 0 HG3 ARG A 121 -5.684 -1.905 6.438 1.00 1.14 H new ATOM 0 HD2 ARG A 121 -6.234 -4.036 7.855 1.00 1.39 H new ATOM 0 HD3 ARG A 121 -6.836 -4.700 6.349 1.00 1.39 H new ATOM 0 HE ARG A 121 -4.648 -5.063 5.692 1.00 1.56 H new ATOM 0 HH11 ARG A 121 -4.739 -2.467 8.088 1.00 2.29 H new ATOM 0 HH12 ARG A 121 -2.981 -2.299 8.140 1.00 2.29 H new ATOM 0 HH21 ARG A 121 -2.392 -4.842 5.773 1.00 2.04 H new ATOM 0 HH22 ARG A 121 -1.659 -3.637 6.836 1.00 2.04 H new ATOM 1909 N GLY A 122 -10.428 -1.457 5.186 1.00 0.73 N ATOM 1910 CA GLY A 122 -10.887 -1.000 3.892 1.00 0.60 C ATOM 1911 C GLY A 122 -9.955 0.043 3.320 1.00 0.57 C ATOM 1912 O GLY A 122 -10.165 0.520 2.211 1.00 0.59 O ATOM 0 H GLY A 122 -10.912 -1.034 5.978 1.00 0.73 H new ATOM 0 HA2 GLY A 122 -10.955 -1.846 3.208 1.00 0.60 H new ATOM 0 HA3 GLY A 122 -11.890 -0.584 3.985 1.00 0.60 H new ATOM 1916 N PHE A 123 -8.913 0.394 4.075 1.00 0.65 N ATOM 1917 CA PHE A 123 -7.954 1.383 3.605 1.00 0.72 C ATOM 1918 C PHE A 123 -6.860 0.709 2.789 1.00 0.80 C ATOM 1919 O PHE A 123 -5.758 1.226 2.637 1.00 1.14 O ATOM 1920 CB PHE A 123 -7.378 2.219 4.765 1.00 0.84 C ATOM 1921 CG PHE A 123 -6.607 1.470 5.821 1.00 0.95 C ATOM 1922 CD1 PHE A 123 -5.428 0.818 5.493 1.00 1.47 C ATOM 1923 CD2 PHE A 123 -7.079 1.373 7.121 1.00 1.10 C ATOM 1924 CE1 PHE A 123 -4.733 0.091 6.439 1.00 2.04 C ATOM 1925 CE2 PHE A 123 -6.385 0.652 8.073 1.00 1.49 C ATOM 1926 CZ PHE A 123 -5.160 0.165 7.807 1.00 1.98 C ATOM 0 H PHE A 123 -8.717 0.012 5.000 1.00 0.65 H new ATOM 0 HA PHE A 123 -8.477 2.083 2.954 1.00 0.72 H new ATOM 0 HB2 PHE A 123 -6.724 2.982 4.343 1.00 0.84 H new ATOM 0 HB3 PHE A 123 -8.203 2.740 5.251 1.00 0.84 H new ATOM 0 HD1 PHE A 123 -5.048 0.880 4.484 1.00 1.47 H new ATOM 0 HD2 PHE A 123 -8.000 1.867 7.392 1.00 1.10 H new ATOM 0 HE1 PHE A 123 -3.888 -0.519 6.156 1.00 2.04 H new ATOM 0 HE2 PHE A 123 -6.831 0.478 9.041 1.00 1.49 H new ATOM 0 HZ PHE A 123 -4.512 -0.163 8.606 1.00 1.98 H new ATOM 1936 N MET A 124 -7.197 -0.450 2.244 1.00 0.62 N ATOM 1937 CA MET A 124 -6.282 -1.216 1.411 1.00 0.68 C ATOM 1938 C MET A 124 -7.073 -2.056 0.421 1.00 0.64 C ATOM 1939 O MET A 124 -6.683 -2.207 -0.741 1.00 0.68 O ATOM 1940 CB MET A 124 -5.383 -2.121 2.258 1.00 0.80 C ATOM 1941 CG MET A 124 -4.335 -1.370 3.061 1.00 1.00 C ATOM 1942 SD MET A 124 -3.202 -2.474 3.924 1.00 1.91 S ATOM 1943 CE MET A 124 -2.087 -1.294 4.683 1.00 2.23 C ATOM 0 H MET A 124 -8.111 -0.886 2.366 1.00 0.62 H new ATOM 0 HA MET A 124 -5.644 -0.515 0.872 1.00 0.68 H new ATOM 0 HB2 MET A 124 -6.006 -2.698 2.942 1.00 0.80 H new ATOM 0 HB3 MET A 124 -4.883 -2.835 1.603 1.00 0.80 H new ATOM 0 HG2 MET A 124 -3.767 -0.721 2.394 1.00 1.00 H new ATOM 0 HG3 MET A 124 -4.831 -0.725 3.786 1.00 1.00 H new ATOM 0 HE1 MET A 124 -1.094 -1.399 4.246 1.00 2.23 H new ATOM 0 HE2 MET A 124 -2.455 -0.283 4.510 1.00 2.23 H new ATOM 0 HE3 MET A 124 -2.033 -1.482 5.755 1.00 2.23 H new ATOM 1953 N LEU A 125 -8.197 -2.595 0.889 1.00 0.61 N ATOM 1954 CA LEU A 125 -9.045 -3.416 0.062 1.00 0.62 C ATOM 1955 C LEU A 125 -9.960 -2.557 -0.801 1.00 0.56 C ATOM 1956 O LEU A 125 -10.313 -2.940 -1.914 1.00 0.63 O ATOM 1957 CB LEU A 125 -9.842 -4.374 0.944 1.00 0.67 C ATOM 1958 CG LEU A 125 -8.994 -5.306 1.813 1.00 0.77 C ATOM 1959 CD1 LEU A 125 -9.883 -6.251 2.602 1.00 1.24 C ATOM 1960 CD2 LEU A 125 -8.006 -6.091 0.963 1.00 1.16 C ATOM 0 H LEU A 125 -8.533 -2.470 1.844 1.00 0.61 H new ATOM 0 HA LEU A 125 -8.425 -4.003 -0.616 1.00 0.62 H new ATOM 0 HB2 LEU A 125 -10.495 -3.790 1.593 1.00 0.67 H new ATOM 0 HB3 LEU A 125 -10.486 -4.981 0.307 1.00 0.67 H new ATOM 0 HG LEU A 125 -8.427 -4.694 2.515 1.00 0.77 H new ATOM 0 HD11 LEU A 125 -9.264 -6.907 3.214 1.00 1.24 H new ATOM 0 HD12 LEU A 125 -10.547 -5.674 3.245 1.00 1.24 H new ATOM 0 HD13 LEU A 125 -10.477 -6.852 1.913 1.00 1.24 H new ATOM 0 HD21 LEU A 125 -7.415 -6.746 1.603 1.00 1.16 H new ATOM 0 HD22 LEU A 125 -8.550 -6.691 0.234 1.00 1.16 H new ATOM 0 HD23 LEU A 125 -7.344 -5.399 0.442 1.00 1.16 H new ATOM 1972 N TRP A 126 -10.327 -1.386 -0.294 1.00 0.48 N ATOM 1973 CA TRP A 126 -11.186 -0.474 -1.039 1.00 0.48 C ATOM 1974 C TRP A 126 -10.373 0.341 -2.048 1.00 0.47 C ATOM 1975 O TRP A 126 -10.691 0.345 -3.235 1.00 0.48 O ATOM 1976 CB TRP A 126 -11.950 0.447 -0.089 1.00 0.52 C ATOM 1977 CG TRP A 126 -12.683 1.541 -0.789 1.00 0.80 C ATOM 1978 CD1 TRP A 126 -12.498 2.875 -0.607 1.00 1.33 C ATOM 1979 CD2 TRP A 126 -13.714 1.406 -1.774 1.00 1.45 C ATOM 1980 NE1 TRP A 126 -13.347 3.587 -1.420 1.00 1.82 N ATOM 1981 CE2 TRP A 126 -14.104 2.706 -2.148 1.00 1.88 C ATOM 1982 CE3 TRP A 126 -14.342 0.314 -2.378 1.00 2.11 C ATOM 1983 CZ2 TRP A 126 -15.096 2.942 -3.096 1.00 2.60 C ATOM 1984 CZ3 TRP A 126 -15.326 0.549 -3.320 1.00 2.88 C ATOM 1985 CH2 TRP A 126 -15.693 1.854 -3.672 1.00 3.03 C ATOM 0 H TRP A 126 -10.045 -1.047 0.626 1.00 0.48 H new ATOM 0 HA TRP A 126 -11.911 -1.070 -1.593 1.00 0.48 H new ATOM 0 HB2 TRP A 126 -12.660 -0.146 0.487 1.00 0.52 H new ATOM 0 HB3 TRP A 126 -11.250 0.885 0.622 1.00 0.52 H new ATOM 0 HD1 TRP A 126 -11.787 3.312 0.078 1.00 1.33 H new ATOM 0 HE1 TRP A 126 -13.404 4.604 -1.473 1.00 1.82 H new ATOM 0 HE3 TRP A 126 -14.064 -0.696 -2.114 1.00 2.11 H new ATOM 0 HZ2 TRP A 126 -15.384 3.947 -3.367 1.00 2.60 H new ATOM 0 HZ3 TRP A 126 -15.820 -0.287 -3.792 1.00 2.88 H new ATOM 0 HH2 TRP A 126 -16.463 2.005 -4.414 1.00 3.03 H new ATOM 1996 N PRO A 127 -9.303 1.043 -1.606 1.00 0.50 N ATOM 1997 CA PRO A 127 -8.462 1.834 -2.508 1.00 0.54 C ATOM 1998 C PRO A 127 -8.024 1.018 -3.718 1.00 0.53 C ATOM 1999 O PRO A 127 -8.092 1.489 -4.853 1.00 0.56 O ATOM 2000 CB PRO A 127 -7.245 2.212 -1.647 1.00 0.61 C ATOM 2001 CG PRO A 127 -7.348 1.360 -0.425 1.00 0.61 C ATOM 2002 CD PRO A 127 -8.813 1.125 -0.223 1.00 0.55 C ATOM 0 HA PRO A 127 -8.989 2.701 -2.906 1.00 0.54 H new ATOM 0 HB2 PRO A 127 -6.313 2.025 -2.180 1.00 0.61 H new ATOM 0 HB3 PRO A 127 -7.258 3.271 -1.390 1.00 0.61 H new ATOM 0 HG2 PRO A 127 -6.814 0.419 -0.557 1.00 0.61 H new ATOM 0 HG3 PRO A 127 -6.908 1.858 0.439 1.00 0.61 H new ATOM 0 HD2 PRO A 127 -9.006 0.208 0.333 1.00 0.55 H new ATOM 0 HD3 PRO A 127 -9.284 1.938 0.329 1.00 0.55 H new ATOM 2010 N LEU A 128 -7.590 -0.216 -3.466 1.00 0.53 N ATOM 2011 CA LEU A 128 -7.160 -1.102 -4.538 1.00 0.56 C ATOM 2012 C LEU A 128 -8.369 -1.655 -5.273 1.00 0.54 C ATOM 2013 O LEU A 128 -8.271 -2.066 -6.428 1.00 0.61 O ATOM 2014 CB LEU A 128 -6.321 -2.249 -3.976 1.00 0.63 C ATOM 2015 CG LEU A 128 -5.680 -3.163 -5.024 1.00 0.79 C ATOM 2016 CD1 LEU A 128 -4.860 -2.353 -6.020 1.00 1.42 C ATOM 2017 CD2 LEU A 128 -4.805 -4.197 -4.337 1.00 1.55 C ATOM 0 H LEU A 128 -7.528 -0.621 -2.532 1.00 0.53 H new ATOM 0 HA LEU A 128 -6.549 -0.532 -5.237 1.00 0.56 H new ATOM 0 HB2 LEU A 128 -5.532 -1.829 -3.352 1.00 0.63 H new ATOM 0 HB3 LEU A 128 -6.952 -2.855 -3.326 1.00 0.63 H new ATOM 0 HG LEU A 128 -6.472 -3.673 -5.573 1.00 0.79 H new ATOM 0 HD11 LEU A 128 -4.414 -3.023 -6.755 1.00 1.42 H new ATOM 0 HD12 LEU A 128 -5.507 -1.637 -6.527 1.00 1.42 H new ATOM 0 HD13 LEU A 128 -4.071 -1.818 -5.492 1.00 1.42 H new ATOM 0 HD21 LEU A 128 -4.351 -4.845 -5.087 1.00 1.55 H new ATOM 0 HD22 LEU A 128 -4.022 -3.693 -3.771 1.00 1.55 H new ATOM 0 HD23 LEU A 128 -5.413 -4.796 -3.660 1.00 1.55 H new ATOM 2029 N PHE A 129 -9.515 -1.647 -4.598 1.00 0.50 N ATOM 2030 CA PHE A 129 -10.748 -2.132 -5.199 1.00 0.51 C ATOM 2031 C PHE A 129 -11.095 -1.262 -6.396 1.00 0.53 C ATOM 2032 O PHE A 129 -11.377 -1.765 -7.480 1.00 0.70 O ATOM 2033 CB PHE A 129 -11.891 -2.111 -4.180 1.00 0.49 C ATOM 2034 CG PHE A 129 -13.182 -2.673 -4.699 1.00 0.54 C ATOM 2035 CD1 PHE A 129 -14.065 -1.876 -5.411 1.00 0.62 C ATOM 2036 CD2 PHE A 129 -13.516 -4.000 -4.470 1.00 0.60 C ATOM 2037 CE1 PHE A 129 -15.251 -2.394 -5.887 1.00 0.73 C ATOM 2038 CE2 PHE A 129 -14.702 -4.521 -4.944 1.00 0.71 C ATOM 2039 CZ PHE A 129 -15.570 -3.711 -5.664 1.00 0.75 C ATOM 0 H PHE A 129 -9.613 -1.311 -3.640 1.00 0.50 H new ATOM 0 HA PHE A 129 -10.605 -3.162 -5.525 1.00 0.51 H new ATOM 0 HB2 PHE A 129 -11.589 -2.677 -3.299 1.00 0.49 H new ATOM 0 HB3 PHE A 129 -12.058 -1.083 -3.857 1.00 0.49 H new ATOM 0 HD1 PHE A 129 -13.822 -0.840 -5.595 1.00 0.62 H new ATOM 0 HD2 PHE A 129 -12.840 -4.632 -3.914 1.00 0.60 H new ATOM 0 HE1 PHE A 129 -15.932 -1.761 -6.437 1.00 0.73 H new ATOM 0 HE2 PHE A 129 -14.954 -5.554 -4.756 1.00 0.71 H new ATOM 0 HZ PHE A 129 -16.495 -4.116 -6.048 1.00 0.75 H new ATOM 2049 N GLU A 130 -11.043 0.052 -6.195 1.00 0.43 N ATOM 2050 CA GLU A 130 -11.321 0.997 -7.268 1.00 0.49 C ATOM 2051 C GLU A 130 -10.318 0.767 -8.389 1.00 0.53 C ATOM 2052 O GLU A 130 -10.670 0.757 -9.569 1.00 0.68 O ATOM 2053 CB GLU A 130 -11.231 2.437 -6.747 1.00 0.54 C ATOM 2054 CG GLU A 130 -11.733 3.489 -7.727 1.00 0.99 C ATOM 2055 CD GLU A 130 -10.887 3.588 -8.981 1.00 1.63 C ATOM 2056 OE1 GLU A 130 -9.676 3.864 -8.861 1.00 2.40 O ATOM 2057 OE2 GLU A 130 -11.438 3.387 -10.085 1.00 2.04 O ATOM 0 H GLU A 130 -10.811 0.484 -5.301 1.00 0.43 H new ATOM 0 HA GLU A 130 -12.332 0.843 -7.646 1.00 0.49 H new ATOM 0 HB2 GLU A 130 -11.805 2.514 -5.824 1.00 0.54 H new ATOM 0 HB3 GLU A 130 -10.193 2.656 -6.496 1.00 0.54 H new ATOM 0 HG2 GLU A 130 -12.760 3.255 -8.007 1.00 0.99 H new ATOM 0 HG3 GLU A 130 -11.751 4.459 -7.231 1.00 0.99 H new ATOM 2064 N ILE A 131 -9.066 0.551 -7.995 1.00 0.48 N ATOM 2065 CA ILE A 131 -7.992 0.281 -8.938 1.00 0.56 C ATOM 2066 C ILE A 131 -8.370 -0.874 -9.854 1.00 0.52 C ATOM 2067 O ILE A 131 -8.320 -0.758 -11.079 1.00 0.64 O ATOM 2068 CB ILE A 131 -6.688 -0.069 -8.193 1.00 0.77 C ATOM 2069 CG1 ILE A 131 -6.144 1.156 -7.454 1.00 0.77 C ATOM 2070 CG2 ILE A 131 -5.648 -0.631 -9.149 1.00 1.55 C ATOM 2071 CD1 ILE A 131 -5.801 2.318 -8.365 1.00 1.41 C ATOM 0 H ILE A 131 -8.771 0.559 -7.018 1.00 0.48 H new ATOM 0 HA ILE A 131 -7.833 1.180 -9.533 1.00 0.56 H new ATOM 0 HB ILE A 131 -6.915 -0.839 -7.456 1.00 0.77 H new ATOM 0 HG12 ILE A 131 -6.883 1.485 -6.723 1.00 0.77 H new ATOM 0 HG13 ILE A 131 -5.252 0.867 -6.898 1.00 0.77 H new ATOM 0 HG21 ILE A 131 -4.738 -0.869 -8.598 1.00 1.55 H new ATOM 0 HG22 ILE A 131 -6.036 -1.535 -9.618 1.00 1.55 H new ATOM 0 HG23 ILE A 131 -5.423 0.108 -9.918 1.00 1.55 H new ATOM 0 HD11 ILE A 131 -5.422 3.148 -7.769 1.00 1.41 H new ATOM 0 HD12 ILE A 131 -5.039 2.007 -9.080 1.00 1.41 H new ATOM 0 HD13 ILE A 131 -6.695 2.635 -8.902 1.00 1.41 H new ATOM 2083 N ALA A 132 -8.754 -1.987 -9.242 1.00 0.53 N ATOM 2084 CA ALA A 132 -9.153 -3.174 -9.982 1.00 0.58 C ATOM 2085 C ALA A 132 -10.278 -3.908 -9.261 1.00 0.56 C ATOM 2086 O ALA A 132 -10.029 -4.834 -8.487 1.00 0.63 O ATOM 2087 CB ALA A 132 -7.959 -4.096 -10.187 1.00 0.73 C ATOM 0 H ALA A 132 -8.797 -2.091 -8.228 1.00 0.53 H new ATOM 0 HA ALA A 132 -9.523 -2.862 -10.959 1.00 0.58 H new ATOM 0 HB1 ALA A 132 -8.273 -4.980 -10.742 1.00 0.73 H new ATOM 0 HB2 ALA A 132 -7.186 -3.571 -10.748 1.00 0.73 H new ATOM 0 HB3 ALA A 132 -7.562 -4.398 -9.218 1.00 0.73 H new ATOM 2093 N PRO A 133 -11.541 -3.503 -9.502 1.00 0.63 N ATOM 2094 CA PRO A 133 -12.708 -4.124 -8.880 1.00 0.66 C ATOM 2095 C PRO A 133 -13.061 -5.443 -9.559 1.00 0.88 C ATOM 2096 O PRO A 133 -14.202 -5.657 -9.973 1.00 1.24 O ATOM 2097 CB PRO A 133 -13.836 -3.099 -9.094 1.00 0.79 C ATOM 2098 CG PRO A 133 -13.216 -1.929 -9.795 1.00 0.82 C ATOM 2099 CD PRO A 133 -11.933 -2.416 -10.405 1.00 0.81 C ATOM 0 HA PRO A 133 -12.536 -4.359 -7.830 1.00 0.66 H new ATOM 0 HB2 PRO A 133 -14.642 -3.527 -9.691 1.00 0.79 H new ATOM 0 HB3 PRO A 133 -14.271 -2.795 -8.142 1.00 0.79 H new ATOM 0 HG2 PRO A 133 -13.885 -1.540 -10.562 1.00 0.82 H new ATOM 0 HG3 PRO A 133 -13.026 -1.115 -9.095 1.00 0.82 H new ATOM 0 HD2 PRO A 133 -12.078 -2.770 -11.426 1.00 0.81 H new ATOM 0 HD3 PRO A 133 -11.179 -1.630 -10.444 1.00 0.81 H new ATOM 2107 N GLU A 134 -12.070 -6.321 -9.685 1.00 0.90 N ATOM 2108 CA GLU A 134 -12.271 -7.614 -10.325 1.00 1.12 C ATOM 2109 C GLU A 134 -11.127 -8.571 -10.003 1.00 1.08 C ATOM 2110 O GLU A 134 -11.123 -9.714 -10.461 1.00 1.25 O ATOM 2111 CB GLU A 134 -12.390 -7.441 -11.841 1.00 1.34 C ATOM 2112 CG GLU A 134 -11.176 -6.783 -12.476 1.00 1.87 C ATOM 2113 CD GLU A 134 -11.321 -6.612 -13.976 1.00 2.20 C ATOM 2114 OE1 GLU A 134 -12.374 -7.010 -14.517 1.00 2.61 O ATOM 2115 OE2 GLU A 134 -10.385 -6.080 -14.608 1.00 2.50 O ATOM 0 H GLU A 134 -11.120 -6.159 -9.352 1.00 0.90 H new ATOM 0 HA GLU A 134 -13.196 -8.040 -9.937 1.00 1.12 H new ATOM 0 HB2 GLU A 134 -12.544 -8.418 -12.299 1.00 1.34 H new ATOM 0 HB3 GLU A 134 -13.274 -6.843 -12.062 1.00 1.34 H new ATOM 0 HG2 GLU A 134 -11.015 -5.808 -12.017 1.00 1.87 H new ATOM 0 HG3 GLU A 134 -10.291 -7.384 -12.267 1.00 1.87 H new ATOM 2122 N LEU A 135 -10.158 -8.103 -9.220 1.00 0.99 N ATOM 2123 CA LEU A 135 -9.017 -8.933 -8.851 1.00 1.03 C ATOM 2124 C LEU A 135 -9.466 -10.156 -8.056 1.00 1.50 C ATOM 2125 O LEU A 135 -8.703 -11.109 -7.893 1.00 2.32 O ATOM 2126 CB LEU A 135 -8.001 -8.108 -8.056 1.00 1.00 C ATOM 2127 CG LEU A 135 -8.544 -7.423 -6.799 1.00 1.43 C ATOM 2128 CD1 LEU A 135 -8.659 -8.411 -5.647 1.00 2.07 C ATOM 2129 CD2 LEU A 135 -7.658 -6.249 -6.413 1.00 2.26 C ATOM 0 H LEU A 135 -10.141 -7.160 -8.832 1.00 0.99 H new ATOM 0 HA LEU A 135 -8.538 -9.288 -9.763 1.00 1.03 H new ATOM 0 HB2 LEU A 135 -7.178 -8.761 -7.766 1.00 1.00 H new ATOM 0 HB3 LEU A 135 -7.586 -7.344 -8.714 1.00 1.00 H new ATOM 0 HG LEU A 135 -9.543 -7.047 -7.019 1.00 1.43 H new ATOM 0 HD11 LEU A 135 -9.047 -7.899 -4.766 1.00 2.07 H new ATOM 0 HD12 LEU A 135 -9.337 -9.218 -5.926 1.00 2.07 H new ATOM 0 HD13 LEU A 135 -7.676 -8.824 -5.423 1.00 2.07 H new ATOM 0 HD21 LEU A 135 -8.056 -5.772 -5.518 1.00 2.26 H new ATOM 0 HD22 LEU A 135 -6.647 -6.606 -6.215 1.00 2.26 H new ATOM 0 HD23 LEU A 135 -7.635 -5.527 -7.229 1.00 2.26 H new ATOM 2141 N VAL A 136 -10.709 -10.115 -7.568 1.00 1.65 N ATOM 2142 CA VAL A 136 -11.286 -11.212 -6.787 1.00 2.11 C ATOM 2143 C VAL A 136 -10.789 -12.568 -7.269 1.00 1.98 C ATOM 2144 O VAL A 136 -11.073 -12.979 -8.394 1.00 2.82 O ATOM 2145 CB VAL A 136 -12.828 -11.194 -6.849 1.00 2.85 C ATOM 2146 CG1 VAL A 136 -13.314 -11.159 -8.291 1.00 3.55 C ATOM 2147 CG2 VAL A 136 -13.410 -12.390 -6.112 1.00 3.66 C ATOM 0 H VAL A 136 -11.340 -9.325 -7.702 1.00 1.65 H new ATOM 0 HA VAL A 136 -10.963 -11.061 -5.757 1.00 2.11 H new ATOM 0 HB VAL A 136 -13.176 -10.287 -6.355 1.00 2.85 H new ATOM 0 HG11 VAL A 136 -14.404 -11.147 -8.307 1.00 3.55 H new ATOM 0 HG12 VAL A 136 -12.934 -10.263 -8.781 1.00 3.55 H new ATOM 0 HG13 VAL A 136 -12.953 -12.042 -8.818 1.00 3.55 H new ATOM 0 HG21 VAL A 136 -14.498 -12.358 -6.168 1.00 3.66 H new ATOM 0 HG22 VAL A 136 -13.050 -13.311 -6.571 1.00 3.66 H new ATOM 0 HG23 VAL A 136 -13.100 -12.360 -5.068 1.00 3.66 H new ATOM 2157 N PHE A 137 -10.042 -13.251 -6.401 1.00 1.34 N ATOM 2158 CA PHE A 137 -9.483 -14.568 -6.722 1.00 1.66 C ATOM 2159 C PHE A 137 -8.410 -15.011 -5.723 1.00 1.18 C ATOM 2160 O PHE A 137 -8.356 -16.190 -5.370 1.00 1.57 O ATOM 2161 CB PHE A 137 -8.871 -14.565 -8.121 1.00 2.23 C ATOM 2162 CG PHE A 137 -8.341 -15.904 -8.553 1.00 3.15 C ATOM 2163 CD1 PHE A 137 -9.150 -17.031 -8.517 1.00 3.49 C ATOM 2164 CD2 PHE A 137 -7.036 -16.036 -8.997 1.00 3.88 C ATOM 2165 CE1 PHE A 137 -8.665 -18.261 -8.917 1.00 4.44 C ATOM 2166 CE2 PHE A 137 -6.546 -17.265 -9.397 1.00 4.85 C ATOM 2167 CZ PHE A 137 -7.361 -18.379 -9.355 1.00 5.09 C ATOM 0 H PHE A 137 -9.809 -12.914 -5.467 1.00 1.34 H new ATOM 0 HA PHE A 137 -10.313 -15.272 -6.670 1.00 1.66 H new ATOM 0 HB2 PHE A 137 -9.624 -14.234 -8.836 1.00 2.23 H new ATOM 0 HB3 PHE A 137 -8.061 -13.837 -8.152 1.00 2.23 H new ATOM 0 HD1 PHE A 137 -10.170 -16.945 -8.172 1.00 3.49 H new ATOM 0 HD2 PHE A 137 -6.394 -15.169 -9.031 1.00 3.88 H new ATOM 0 HE1 PHE A 137 -9.306 -19.130 -8.887 1.00 4.44 H new ATOM 0 HE2 PHE A 137 -5.527 -17.354 -9.742 1.00 4.85 H new ATOM 0 HZ PHE A 137 -6.979 -19.341 -9.664 1.00 5.09 H new ATOM 2177 N PRO A 138 -7.529 -14.092 -5.256 1.00 0.88 N ATOM 2178 CA PRO A 138 -6.466 -14.425 -4.310 1.00 0.92 C ATOM 2179 C PRO A 138 -6.946 -15.414 -3.259 1.00 1.20 C ATOM 2180 O PRO A 138 -6.332 -16.456 -3.033 1.00 1.94 O ATOM 2181 CB PRO A 138 -6.110 -13.067 -3.670 1.00 1.24 C ATOM 2182 CG PRO A 138 -7.023 -12.063 -4.301 1.00 1.68 C ATOM 2183 CD PRO A 138 -7.481 -12.669 -5.594 1.00 1.44 C ATOM 0 HA PRO A 138 -5.614 -14.905 -4.791 1.00 0.92 H new ATOM 0 HB2 PRO A 138 -6.249 -13.096 -2.589 1.00 1.24 H new ATOM 0 HB3 PRO A 138 -5.066 -12.812 -3.850 1.00 1.24 H new ATOM 0 HG2 PRO A 138 -7.871 -11.845 -3.651 1.00 1.68 H new ATOM 0 HG3 PRO A 138 -6.504 -11.120 -4.475 1.00 1.68 H new ATOM 0 HD2 PRO A 138 -8.455 -12.289 -5.902 1.00 1.44 H new ATOM 0 HD3 PRO A 138 -6.787 -12.465 -6.410 1.00 1.44 H new ATOM 2191 N ASP A 139 -8.067 -15.078 -2.648 1.00 1.07 N ATOM 2192 CA ASP A 139 -8.686 -15.919 -1.634 1.00 1.62 C ATOM 2193 C ASP A 139 -10.103 -16.286 -2.060 1.00 1.65 C ATOM 2194 O ASP A 139 -10.745 -17.148 -1.460 1.00 2.28 O ATOM 2195 CB ASP A 139 -8.713 -15.200 -0.285 1.00 2.26 C ATOM 2196 CG ASP A 139 -9.528 -13.923 -0.325 1.00 2.93 C ATOM 2197 OD1 ASP A 139 -9.183 -13.022 -1.119 1.00 3.67 O ATOM 2198 OD2 ASP A 139 -10.514 -13.823 0.436 1.00 3.20 O ATOM 0 H ASP A 139 -8.576 -14.215 -2.839 1.00 1.07 H new ATOM 0 HA ASP A 139 -8.097 -16.830 -1.528 1.00 1.62 H new ATOM 0 HB2 ASP A 139 -9.126 -15.868 0.471 1.00 2.26 H new ATOM 0 HB3 ASP A 139 -7.693 -14.967 0.019 1.00 2.26 H new ATOM 2203 N GLY A 140 -10.578 -15.617 -3.110 1.00 1.25 N ATOM 2204 CA GLY A 140 -11.913 -15.872 -3.621 1.00 1.72 C ATOM 2205 C GLY A 140 -12.896 -14.786 -3.246 1.00 1.31 C ATOM 2206 O GLY A 140 -14.100 -15.032 -3.167 1.00 1.85 O ATOM 0 H GLY A 140 -10.058 -14.900 -3.617 1.00 1.25 H new ATOM 0 HA2 GLY A 140 -11.872 -15.961 -4.707 1.00 1.72 H new ATOM 0 HA3 GLY A 140 -12.269 -16.828 -3.236 1.00 1.72 H new ATOM 2210 N GLU A 141 -12.387 -13.576 -3.029 1.00 0.75 N ATOM 2211 CA GLU A 141 -13.233 -12.440 -2.672 1.00 0.94 C ATOM 2212 C GLU A 141 -12.564 -11.120 -3.014 1.00 0.82 C ATOM 2213 O GLU A 141 -11.389 -10.915 -2.707 1.00 1.19 O ATOM 2214 CB GLU A 141 -13.563 -12.426 -1.171 1.00 1.56 C ATOM 2215 CG GLU A 141 -14.415 -13.588 -0.697 1.00 1.38 C ATOM 2216 CD GLU A 141 -14.925 -13.396 0.717 1.00 2.16 C ATOM 2217 OE1 GLU A 141 -14.090 -13.253 1.635 1.00 2.97 O ATOM 2218 OE2 GLU A 141 -16.161 -13.387 0.907 1.00 2.47 O ATOM 0 H GLU A 141 -11.393 -13.357 -3.094 1.00 0.75 H new ATOM 0 HA GLU A 141 -14.150 -12.554 -3.250 1.00 0.94 H new ATOM 0 HB2 GLU A 141 -12.630 -12.424 -0.608 1.00 1.56 H new ATOM 0 HB3 GLU A 141 -14.079 -11.495 -0.935 1.00 1.56 H new ATOM 0 HG2 GLU A 141 -15.262 -13.712 -1.372 1.00 1.38 H new ATOM 0 HG3 GLU A 141 -13.831 -14.507 -0.747 1.00 1.38 H new ATOM 2225 N MET A 142 -13.328 -10.209 -3.610 1.00 0.57 N ATOM 2226 CA MET A 142 -12.800 -8.893 -3.933 1.00 0.54 C ATOM 2227 C MET A 142 -12.318 -8.263 -2.647 1.00 0.58 C ATOM 2228 O MET A 142 -12.940 -8.443 -1.602 1.00 0.92 O ATOM 2229 CB MET A 142 -13.867 -8.009 -4.577 1.00 0.57 C ATOM 2230 CG MET A 142 -14.621 -8.718 -5.675 1.00 0.67 C ATOM 2231 SD MET A 142 -16.025 -7.784 -6.311 1.00 1.32 S ATOM 2232 CE MET A 142 -15.193 -6.615 -7.377 1.00 1.58 C ATOM 0 H MET A 142 -14.302 -10.357 -3.875 1.00 0.57 H new ATOM 0 HA MET A 142 -11.984 -8.993 -4.649 1.00 0.54 H new ATOM 0 HB2 MET A 142 -14.570 -7.679 -3.812 1.00 0.57 H new ATOM 0 HB3 MET A 142 -13.396 -7.114 -4.984 1.00 0.57 H new ATOM 0 HG2 MET A 142 -13.936 -8.930 -6.496 1.00 0.67 H new ATOM 0 HG3 MET A 142 -14.975 -9.678 -5.299 1.00 0.67 H new ATOM 0 HE1 MET A 142 -15.833 -5.747 -7.534 1.00 1.58 H new ATOM 0 HE2 MET A 142 -14.259 -6.299 -6.912 1.00 1.58 H new ATOM 0 HE3 MET A 142 -14.979 -7.086 -8.336 1.00 1.58 H new ATOM 2242 N LEU A 143 -11.215 -7.545 -2.716 1.00 0.55 N ATOM 2243 CA LEU A 143 -10.653 -6.909 -1.538 1.00 0.62 C ATOM 2244 C LEU A 143 -11.754 -6.330 -0.663 1.00 0.56 C ATOM 2245 O LEU A 143 -11.939 -6.732 0.484 1.00 0.60 O ATOM 2246 CB LEU A 143 -9.707 -5.804 -1.966 1.00 0.76 C ATOM 2247 CG LEU A 143 -8.684 -6.208 -3.012 1.00 0.81 C ATOM 2248 CD1 LEU A 143 -7.743 -5.059 -3.282 1.00 1.54 C ATOM 2249 CD2 LEU A 143 -7.911 -7.439 -2.564 1.00 1.70 C ATOM 0 H LEU A 143 -10.689 -7.386 -3.575 1.00 0.55 H new ATOM 0 HA LEU A 143 -10.110 -7.657 -0.960 1.00 0.62 H new ATOM 0 HB2 LEU A 143 -10.295 -4.973 -2.356 1.00 0.76 H new ATOM 0 HB3 LEU A 143 -9.179 -5.436 -1.086 1.00 0.76 H new ATOM 0 HG LEU A 143 -9.208 -6.458 -3.934 1.00 0.81 H new ATOM 0 HD11 LEU A 143 -7.012 -5.356 -4.034 1.00 1.54 H new ATOM 0 HD12 LEU A 143 -8.310 -4.202 -3.646 1.00 1.54 H new ATOM 0 HD13 LEU A 143 -7.227 -4.787 -2.361 1.00 1.54 H new ATOM 0 HD21 LEU A 143 -7.184 -7.710 -3.329 1.00 1.70 H new ATOM 0 HD22 LEU A 143 -7.392 -7.223 -1.630 1.00 1.70 H new ATOM 0 HD23 LEU A 143 -8.603 -8.267 -2.411 1.00 1.70 H new ATOM 2261 N ARG A 144 -12.463 -5.370 -1.223 1.00 0.53 N ATOM 2262 CA ARG A 144 -13.538 -4.685 -0.538 1.00 0.52 C ATOM 2263 C ARG A 144 -14.573 -5.624 0.063 1.00 0.61 C ATOM 2264 O ARG A 144 -15.016 -5.389 1.175 1.00 0.69 O ATOM 2265 CB ARG A 144 -14.192 -3.688 -1.487 1.00 0.53 C ATOM 2266 CG ARG A 144 -15.289 -2.840 -0.853 1.00 0.58 C ATOM 2267 CD ARG A 144 -16.619 -3.578 -0.759 1.00 0.85 C ATOM 2268 NE ARG A 144 -17.254 -3.745 -2.065 1.00 1.18 N ATOM 2269 CZ ARG A 144 -17.690 -2.731 -2.809 1.00 1.39 C ATOM 2270 NH1 ARG A 144 -17.565 -1.482 -2.379 1.00 1.59 N ATOM 2271 NH2 ARG A 144 -18.260 -2.967 -3.983 1.00 2.16 N ATOM 0 H ARG A 144 -12.306 -5.041 -2.176 1.00 0.53 H new ATOM 0 HA ARG A 144 -13.096 -4.159 0.308 1.00 0.52 H new ATOM 0 HB2 ARG A 144 -13.423 -3.026 -1.885 1.00 0.53 H new ATOM 0 HB3 ARG A 144 -14.613 -4.232 -2.332 1.00 0.53 H new ATOM 0 HG2 ARG A 144 -14.976 -2.534 0.145 1.00 0.58 H new ATOM 0 HG3 ARG A 144 -15.423 -1.930 -1.437 1.00 0.58 H new ATOM 0 HD2 ARG A 144 -16.458 -4.557 -0.308 1.00 0.85 H new ATOM 0 HD3 ARG A 144 -17.290 -3.030 -0.098 1.00 0.85 H new ATOM 0 HE ARG A 144 -17.369 -4.692 -2.427 1.00 1.18 H new ATOM 0 HH11 ARG A 144 -17.133 -1.295 -1.474 1.00 1.59 H new ATOM 0 HH12 ARG A 144 -17.901 -0.709 -2.953 1.00 1.59 H new ATOM 0 HH21 ARG A 144 -18.364 -3.926 -4.316 1.00 2.16 H new ATOM 0 HH22 ARG A 144 -18.594 -2.190 -4.553 1.00 2.16 H new ATOM 2285 N GLN A 145 -14.984 -6.671 -0.644 1.00 0.76 N ATOM 2286 CA GLN A 145 -15.988 -7.572 -0.076 1.00 0.92 C ATOM 2287 C GLN A 145 -15.510 -8.067 1.267 1.00 0.89 C ATOM 2288 O GLN A 145 -16.282 -8.215 2.209 1.00 0.97 O ATOM 2289 CB GLN A 145 -16.254 -8.780 -0.966 1.00 1.21 C ATOM 2290 CG GLN A 145 -16.033 -8.493 -2.417 1.00 0.96 C ATOM 2291 CD GLN A 145 -16.921 -7.389 -2.921 1.00 1.54 C ATOM 2292 OE1 GLN A 145 -16.330 -6.222 -3.102 1.00 2.27 O flip ATOM 2293 NE2 GLN A 145 -18.123 -7.571 -3.115 1.00 1.87 N flip ATOM 0 H GLN A 145 -14.654 -6.914 -1.578 1.00 0.76 H new ATOM 0 HA GLN A 145 -16.915 -7.006 0.016 1.00 0.92 H new ATOM 0 HB2 GLN A 145 -15.605 -9.600 -0.660 1.00 1.21 H new ATOM 0 HB3 GLN A 145 -17.281 -9.114 -0.819 1.00 1.21 H new ATOM 0 HG2 GLN A 145 -14.990 -8.219 -2.576 1.00 0.96 H new ATOM 0 HG3 GLN A 145 -16.217 -9.398 -2.996 1.00 0.96 H new ATOM 0 HE21 GLN A 145 -18.531 -8.493 -2.960 1.00 1.87 H new ATOM 0 HE22 GLN A 145 -18.711 -6.800 -3.431 1.00 1.87 H new ATOM 2302 N ILE A 146 -14.218 -8.326 1.334 1.00 0.85 N ATOM 2303 CA ILE A 146 -13.600 -8.816 2.542 1.00 0.90 C ATOM 2304 C ILE A 146 -13.473 -7.705 3.580 1.00 0.85 C ATOM 2305 O ILE A 146 -13.439 -7.974 4.776 1.00 1.01 O ATOM 2306 CB ILE A 146 -12.202 -9.376 2.248 1.00 0.95 C ATOM 2307 CG1 ILE A 146 -12.129 -9.901 0.817 1.00 1.06 C ATOM 2308 CG2 ILE A 146 -11.874 -10.486 3.230 1.00 1.24 C ATOM 2309 CD1 ILE A 146 -10.716 -10.079 0.319 1.00 1.06 C ATOM 0 H ILE A 146 -13.573 -8.202 0.554 1.00 0.85 H new ATOM 0 HA ILE A 146 -14.238 -9.608 2.935 1.00 0.90 H new ATOM 0 HB ILE A 146 -11.472 -8.575 2.360 1.00 0.95 H new ATOM 0 HG12 ILE A 146 -12.650 -10.857 0.761 1.00 1.06 H new ATOM 0 HG13 ILE A 146 -12.656 -9.212 0.157 1.00 1.06 H new ATOM 0 HG21 ILE A 146 -10.880 -10.879 3.016 1.00 1.24 H new ATOM 0 HG22 ILE A 146 -11.897 -10.092 4.246 1.00 1.24 H new ATOM 0 HG23 ILE A 146 -12.609 -11.285 3.134 1.00 1.24 H new ATOM 0 HD11 ILE A 146 -10.735 -10.455 -0.704 1.00 1.06 H new ATOM 0 HD12 ILE A 146 -10.198 -9.120 0.344 1.00 1.06 H new ATOM 0 HD13 ILE A 146 -10.192 -10.791 0.957 1.00 1.06 H new ATOM 2321 N LEU A 147 -13.380 -6.453 3.121 1.00 0.72 N ATOM 2322 CA LEU A 147 -13.233 -5.324 4.043 1.00 0.75 C ATOM 2323 C LEU A 147 -14.589 -4.792 4.512 1.00 0.71 C ATOM 2324 O LEU A 147 -14.736 -4.354 5.650 1.00 0.81 O ATOM 2325 CB LEU A 147 -12.436 -4.193 3.381 1.00 0.92 C ATOM 2326 CG LEU A 147 -13.254 -3.240 2.504 1.00 0.82 C ATOM 2327 CD1 LEU A 147 -13.970 -2.212 3.354 1.00 1.36 C ATOM 2328 CD2 LEU A 147 -12.375 -2.542 1.497 1.00 1.66 C ATOM 0 H LEU A 147 -13.403 -6.199 2.134 1.00 0.72 H new ATOM 0 HA LEU A 147 -12.692 -5.688 4.917 1.00 0.75 H new ATOM 0 HB2 LEU A 147 -11.946 -3.611 4.162 1.00 0.92 H new ATOM 0 HB3 LEU A 147 -11.648 -4.635 2.771 1.00 0.92 H new ATOM 0 HG LEU A 147 -13.993 -3.836 1.969 1.00 0.82 H new ATOM 0 HD11 LEU A 147 -14.545 -1.545 2.711 1.00 1.36 H new ATOM 0 HD12 LEU A 147 -14.643 -2.718 4.047 1.00 1.36 H new ATOM 0 HD13 LEU A 147 -13.239 -1.632 3.917 1.00 1.36 H new ATOM 0 HD21 LEU A 147 -12.981 -1.872 0.888 1.00 1.66 H new ATOM 0 HD22 LEU A 147 -11.610 -1.966 2.019 1.00 1.66 H new ATOM 0 HD23 LEU A 147 -11.897 -3.283 0.856 1.00 1.66 H new ATOM 2340 N HIS A 148 -15.566 -4.793 3.620 1.00 0.71 N ATOM 2341 CA HIS A 148 -16.889 -4.280 3.940 1.00 0.76 C ATOM 2342 C HIS A 148 -17.631 -5.257 4.832 1.00 0.83 C ATOM 2343 O HIS A 148 -18.581 -4.894 5.525 1.00 0.92 O ATOM 2344 CB HIS A 148 -17.681 -4.029 2.654 1.00 0.79 C ATOM 2345 CG HIS A 148 -18.962 -3.277 2.856 1.00 0.93 C ATOM 2346 ND1 HIS A 148 -19.475 -2.669 3.953 1.00 1.04 N flip ATOM 2347 CD2 HIS A 148 -19.879 -3.069 1.846 1.00 1.02 C flip ATOM 2348 CE1 HIS A 148 -20.674 -2.111 3.590 1.00 1.20 C flip ATOM 2349 NE2 HIS A 148 -20.895 -2.365 2.314 1.00 1.19 N flip ATOM 0 H HIS A 148 -15.468 -5.144 2.667 1.00 0.71 H new ATOM 0 HA HIS A 148 -16.779 -3.336 4.475 1.00 0.76 H new ATOM 0 HB2 HIS A 148 -17.053 -3.474 1.957 1.00 0.79 H new ATOM 0 HB3 HIS A 148 -17.906 -4.988 2.186 1.00 0.79 H new ATOM 0 HD2 HIS A 148 -19.782 -3.426 0.831 1.00 1.02 H new ATOM 0 HE1 HIS A 148 -21.331 -1.554 4.242 1.00 1.20 H new ATOM 0 HE2 HIS A 148 -21.712 -2.068 1.780 1.00 1.19 H new ATOM 2358 N THR A 149 -17.190 -6.504 4.807 1.00 0.86 N ATOM 2359 CA THR A 149 -17.814 -7.536 5.610 1.00 0.97 C ATOM 2360 C THR A 149 -16.952 -7.898 6.819 1.00 1.00 C ATOM 2361 O THR A 149 -17.466 -8.396 7.820 1.00 1.13 O ATOM 2362 CB THR A 149 -18.076 -8.776 4.751 1.00 1.02 C ATOM 2363 OG1 THR A 149 -16.857 -9.407 4.398 1.00 1.35 O ATOM 2364 CG2 THR A 149 -18.823 -8.467 3.463 1.00 1.48 C ATOM 0 H THR A 149 -16.404 -6.823 4.240 1.00 0.86 H new ATOM 0 HA THR A 149 -18.763 -7.151 5.983 1.00 0.97 H new ATOM 0 HB THR A 149 -18.696 -9.428 5.366 1.00 1.02 H new ATOM 0 HG1 THR A 149 -16.406 -8.882 3.704 1.00 1.35 H new ATOM 0 HG21 THR A 149 -18.976 -9.388 2.901 1.00 1.48 H new ATOM 0 HG22 THR A 149 -19.789 -8.022 3.701 1.00 1.48 H new ATOM 0 HG23 THR A 149 -18.240 -7.769 2.863 1.00 1.48 H new ATOM 2372 N ARG A 150 -15.638 -7.661 6.731 1.00 0.91 N ATOM 2373 CA ARG A 150 -14.746 -7.993 7.845 1.00 0.97 C ATOM 2374 C ARG A 150 -14.080 -6.759 8.460 1.00 0.97 C ATOM 2375 O ARG A 150 -13.709 -6.776 9.634 1.00 1.16 O ATOM 2376 CB ARG A 150 -13.670 -8.983 7.395 1.00 1.01 C ATOM 2377 CG ARG A 150 -14.230 -10.240 6.746 1.00 1.12 C ATOM 2378 CD ARG A 150 -15.100 -11.032 7.707 1.00 1.43 C ATOM 2379 NE ARG A 150 -14.346 -11.490 8.871 1.00 1.84 N ATOM 2380 CZ ARG A 150 -14.872 -12.213 9.857 1.00 2.15 C ATOM 2381 NH1 ARG A 150 -16.152 -12.563 9.819 1.00 2.45 N ATOM 2382 NH2 ARG A 150 -14.117 -12.588 10.880 1.00 2.86 N ATOM 0 H ARG A 150 -15.178 -7.250 5.919 1.00 0.91 H new ATOM 0 HA ARG A 150 -15.370 -8.447 8.615 1.00 0.97 H new ATOM 0 HB2 ARG A 150 -13.004 -8.486 6.690 1.00 1.01 H new ATOM 0 HB3 ARG A 150 -13.067 -9.267 8.257 1.00 1.01 H new ATOM 0 HG2 ARG A 150 -14.815 -9.966 5.868 1.00 1.12 H new ATOM 0 HG3 ARG A 150 -13.408 -10.867 6.399 1.00 1.12 H new ATOM 0 HD2 ARG A 150 -15.935 -10.413 8.036 1.00 1.43 H new ATOM 0 HD3 ARG A 150 -15.525 -11.891 7.188 1.00 1.43 H new ATOM 0 HE ARG A 150 -13.359 -11.241 8.932 1.00 1.84 H new ATOM 0 HH11 ARG A 150 -16.736 -12.278 9.033 1.00 2.45 H new ATOM 0 HH12 ARG A 150 -16.552 -13.117 10.576 1.00 2.45 H new ATOM 0 HH21 ARG A 150 -13.133 -12.322 10.912 1.00 2.86 H new ATOM 0 HH22 ARG A 150 -14.520 -13.142 11.635 1.00 2.86 H new ATOM 2396 N ALA A 151 -13.900 -5.705 7.669 1.00 0.88 N ATOM 2397 CA ALA A 151 -13.243 -4.496 8.158 1.00 0.91 C ATOM 2398 C ALA A 151 -14.232 -3.362 8.420 1.00 0.92 C ATOM 2399 O ALA A 151 -14.975 -3.391 9.402 1.00 1.18 O ATOM 2400 CB ALA A 151 -12.172 -4.054 7.172 1.00 0.89 C ATOM 0 H ALA A 151 -14.197 -5.663 6.694 1.00 0.88 H new ATOM 0 HA ALA A 151 -12.779 -4.738 9.114 1.00 0.91 H new ATOM 0 HB1 ALA A 151 -11.686 -3.152 7.543 1.00 0.89 H new ATOM 0 HB2 ALA A 151 -11.431 -4.846 7.061 1.00 0.89 H new ATOM 0 HB3 ALA A 151 -12.631 -3.848 6.205 1.00 0.89 H new ATOM 2406 N PHE A 152 -14.225 -2.354 7.549 1.00 0.79 N ATOM 2407 CA PHE A 152 -15.108 -1.204 7.706 1.00 0.99 C ATOM 2408 C PHE A 152 -16.115 -1.119 6.561 1.00 0.88 C ATOM 2409 O PHE A 152 -17.145 -1.793 6.582 1.00 1.32 O ATOM 2410 CB PHE A 152 -14.273 0.074 7.778 1.00 1.26 C ATOM 2411 CG PHE A 152 -15.081 1.315 8.024 1.00 2.02 C ATOM 2412 CD1 PHE A 152 -15.840 1.452 9.174 1.00 2.81 C ATOM 2413 CD2 PHE A 152 -15.074 2.349 7.101 1.00 2.37 C ATOM 2414 CE1 PHE A 152 -16.580 2.599 9.401 1.00 3.76 C ATOM 2415 CE2 PHE A 152 -15.811 3.498 7.322 1.00 3.27 C ATOM 2416 CZ PHE A 152 -16.565 3.623 8.473 1.00 3.92 C ATOM 0 H PHE A 152 -13.619 -2.312 6.730 1.00 0.79 H new ATOM 0 HA PHE A 152 -15.671 -1.322 8.632 1.00 0.99 H new ATOM 0 HB2 PHE A 152 -13.534 -0.030 8.573 1.00 1.26 H new ATOM 0 HB3 PHE A 152 -13.722 0.190 6.844 1.00 1.26 H new ATOM 0 HD1 PHE A 152 -15.855 0.654 9.902 1.00 2.81 H new ATOM 0 HD2 PHE A 152 -14.487 2.256 6.199 1.00 2.37 H new ATOM 0 HE1 PHE A 152 -17.168 2.694 10.302 1.00 3.76 H new ATOM 0 HE2 PHE A 152 -15.797 4.297 6.595 1.00 3.27 H new ATOM 0 HZ PHE A 152 -17.142 4.519 8.647 1.00 3.92 H new ATOM 2426 N ASP A 153 -15.818 -0.284 5.566 1.00 0.92 N ATOM 2427 CA ASP A 153 -16.711 -0.120 4.426 1.00 1.10 C ATOM 2428 C ASP A 153 -15.959 0.413 3.206 1.00 1.14 C ATOM 2429 O ASP A 153 -15.893 -0.257 2.176 1.00 1.88 O ATOM 2430 CB ASP A 153 -17.863 0.822 4.786 1.00 1.43 C ATOM 2431 CG ASP A 153 -18.912 0.908 3.692 1.00 2.10 C ATOM 2432 OD1 ASP A 153 -18.765 0.206 2.669 1.00 2.58 O ATOM 2433 OD2 ASP A 153 -19.882 1.675 3.861 1.00 2.80 O ATOM 0 H ASP A 153 -14.972 0.284 5.528 1.00 0.92 H new ATOM 0 HA ASP A 153 -17.116 -1.100 4.173 1.00 1.10 H new ATOM 0 HB2 ASP A 153 -18.333 0.479 5.708 1.00 1.43 H new ATOM 0 HB3 ASP A 153 -17.465 1.818 4.982 1.00 1.43 H new ATOM 2438 N LYS A 154 -15.396 1.618 3.324 1.00 0.75 N ATOM 2439 CA LYS A 154 -14.653 2.215 2.212 1.00 0.78 C ATOM 2440 C LYS A 154 -13.997 3.536 2.609 1.00 0.91 C ATOM 2441 O LYS A 154 -13.308 4.157 1.801 1.00 1.80 O ATOM 2442 CB LYS A 154 -15.576 2.445 1.008 1.00 0.89 C ATOM 2443 CG LYS A 154 -16.523 3.631 1.158 1.00 0.86 C ATOM 2444 CD LYS A 154 -17.471 3.457 2.333 1.00 1.03 C ATOM 2445 CE LYS A 154 -18.479 4.595 2.408 1.00 1.54 C ATOM 2446 NZ LYS A 154 -17.813 5.916 2.569 1.00 2.17 N ATOM 0 H LYS A 154 -15.439 2.193 4.166 1.00 0.75 H new ATOM 0 HA LYS A 154 -13.866 1.512 1.940 1.00 0.78 H new ATOM 0 HB2 LYS A 154 -14.963 2.595 0.119 1.00 0.89 H new ATOM 0 HB3 LYS A 154 -16.166 1.544 0.840 1.00 0.89 H new ATOM 0 HG2 LYS A 154 -15.943 4.544 1.292 1.00 0.86 H new ATOM 0 HG3 LYS A 154 -17.100 3.752 0.241 1.00 0.86 H new ATOM 0 HD2 LYS A 154 -17.998 2.508 2.239 1.00 1.03 H new ATOM 0 HD3 LYS A 154 -16.899 3.414 3.260 1.00 1.03 H new ATOM 0 HE2 LYS A 154 -19.086 4.602 1.503 1.00 1.54 H new ATOM 0 HE3 LYS A 154 -19.156 4.425 3.245 1.00 1.54 H new ATOM 0 HZ1 LYS A 154 -18.251 6.431 3.359 1.00 2.17 H new ATOM 0 HZ2 LYS A 154 -16.802 5.773 2.766 1.00 2.17 H new ATOM 0 HZ3 LYS A 154 -17.920 6.468 1.694 1.00 2.17 H new ATOM 2460 N LEU A 155 -14.214 3.975 3.845 1.00 0.61 N ATOM 2461 CA LEU A 155 -13.637 5.234 4.312 1.00 0.61 C ATOM 2462 C LEU A 155 -14.015 6.375 3.370 1.00 0.68 C ATOM 2463 O LEU A 155 -14.934 6.243 2.561 1.00 0.89 O ATOM 2464 CB LEU A 155 -12.110 5.125 4.402 1.00 0.60 C ATOM 2465 CG LEU A 155 -11.571 4.024 5.320 1.00 0.60 C ATOM 2466 CD1 LEU A 155 -10.060 4.122 5.428 1.00 1.18 C ATOM 2467 CD2 LEU A 155 -12.205 4.113 6.701 1.00 1.23 C ATOM 0 H LEU A 155 -14.780 3.484 4.537 1.00 0.61 H new ATOM 0 HA LEU A 155 -14.037 5.444 5.304 1.00 0.61 H new ATOM 0 HB2 LEU A 155 -11.717 4.959 3.399 1.00 0.60 H new ATOM 0 HB3 LEU A 155 -11.716 6.082 4.745 1.00 0.60 H new ATOM 0 HG LEU A 155 -11.831 3.059 4.886 1.00 0.60 H new ATOM 0 HD11 LEU A 155 -9.690 3.334 6.083 1.00 1.18 H new ATOM 0 HD12 LEU A 155 -9.616 4.009 4.439 1.00 1.18 H new ATOM 0 HD13 LEU A 155 -9.787 5.094 5.839 1.00 1.18 H new ATOM 0 HD21 LEU A 155 -11.807 3.321 7.336 1.00 1.23 H new ATOM 0 HD22 LEU A 155 -11.977 5.082 7.144 1.00 1.23 H new ATOM 0 HD23 LEU A 155 -13.285 3.999 6.613 1.00 1.23 H new ATOM 2479 N ASN A 156 -13.296 7.490 3.467 1.00 0.66 N ATOM 2480 CA ASN A 156 -13.556 8.640 2.606 1.00 0.77 C ATOM 2481 C ASN A 156 -12.300 9.041 1.837 1.00 0.65 C ATOM 2482 O ASN A 156 -11.204 9.080 2.393 1.00 0.69 O ATOM 2483 CB ASN A 156 -14.093 9.827 3.420 1.00 1.04 C ATOM 2484 CG ASN A 156 -13.190 10.258 4.568 1.00 1.66 C ATOM 2485 OD1 ASN A 156 -12.065 9.574 4.753 1.00 2.44 O flip ATOM 2486 ND2 ASN A 156 -13.504 11.207 5.287 1.00 2.12 N flip ATOM 0 H ASN A 156 -12.532 7.622 4.130 1.00 0.66 H new ATOM 0 HA ASN A 156 -14.319 8.350 1.884 1.00 0.77 H new ATOM 0 HB2 ASN A 156 -14.240 10.675 2.751 1.00 1.04 H new ATOM 0 HB3 ASN A 156 -15.072 9.564 3.822 1.00 1.04 H new ATOM 0 HD21 ASN A 156 -14.375 11.710 5.116 1.00 2.12 H new ATOM 0 HD22 ASN A 156 -12.893 11.490 6.053 1.00 2.12 H new ATOM 2493 N LYS A 157 -12.463 9.332 0.551 1.00 0.64 N ATOM 2494 CA LYS A 157 -11.332 9.723 -0.281 1.00 0.64 C ATOM 2495 C LYS A 157 -10.757 11.051 0.196 1.00 0.68 C ATOM 2496 O LYS A 157 -11.211 12.120 -0.210 1.00 0.95 O ATOM 2497 CB LYS A 157 -11.734 9.821 -1.756 1.00 0.79 C ATOM 2498 CG LYS A 157 -11.961 8.476 -2.442 1.00 0.96 C ATOM 2499 CD LYS A 157 -13.241 7.792 -1.978 1.00 1.67 C ATOM 2500 CE LYS A 157 -12.989 6.840 -0.818 1.00 1.70 C ATOM 2501 NZ LYS A 157 -14.245 6.199 -0.344 1.00 2.51 N ATOM 0 H LYS A 157 -13.360 9.305 0.066 1.00 0.64 H new ATOM 0 HA LYS A 157 -10.568 8.951 -0.190 1.00 0.64 H new ATOM 0 HB2 LYS A 157 -12.647 10.412 -1.832 1.00 0.79 H new ATOM 0 HB3 LYS A 157 -10.958 10.363 -2.296 1.00 0.79 H new ATOM 0 HG2 LYS A 157 -12.003 8.625 -3.521 1.00 0.96 H new ATOM 0 HG3 LYS A 157 -11.111 7.823 -2.243 1.00 0.96 H new ATOM 0 HD2 LYS A 157 -13.967 8.547 -1.676 1.00 1.67 H new ATOM 0 HD3 LYS A 157 -13.680 7.242 -2.810 1.00 1.67 H new ATOM 0 HE2 LYS A 157 -12.283 6.070 -1.127 1.00 1.70 H new ATOM 0 HE3 LYS A 157 -12.526 7.385 0.005 1.00 1.70 H new ATOM 0 HZ1 LYS A 157 -14.368 6.385 0.672 1.00 2.51 H new ATOM 0 HZ2 LYS A 157 -15.054 6.591 -0.868 1.00 2.51 H new ATOM 0 HZ3 LYS A 157 -14.193 5.173 -0.505 1.00 2.51 H new ATOM 2515 N TRP A 158 -9.755 10.960 1.065 1.00 0.73 N ATOM 2516 CA TRP A 158 -9.095 12.132 1.629 1.00 0.83 C ATOM 2517 C TRP A 158 -10.107 13.197 2.043 1.00 1.08 C ATOM 2518 O TRP A 158 -10.687 13.062 3.141 1.00 1.47 O ATOM 2519 CB TRP A 158 -8.093 12.713 0.624 1.00 0.85 C ATOM 2520 CG TRP A 158 -7.271 13.837 1.181 1.00 1.04 C ATOM 2521 CD1 TRP A 158 -6.726 13.914 2.431 1.00 1.51 C ATOM 2522 CD2 TRP A 158 -6.895 15.041 0.505 1.00 1.55 C ATOM 2523 NE1 TRP A 158 -6.037 15.094 2.574 1.00 1.52 N ATOM 2524 CE2 TRP A 158 -6.125 15.803 1.404 1.00 1.52 C ATOM 2525 CE3 TRP A 158 -7.131 15.551 -0.776 1.00 2.50 C ATOM 2526 CZ2 TRP A 158 -5.593 17.043 1.066 1.00 2.07 C ATOM 2527 CZ3 TRP A 158 -6.603 16.784 -1.111 1.00 3.24 C ATOM 2528 CH2 TRP A 158 -5.840 17.518 -0.194 1.00 2.95 C ATOM 2529 OXT TRP A 158 -10.313 14.156 1.268 1.00 1.75 O ATOM 0 H TRP A 158 -9.378 10.072 1.398 1.00 0.73 H new ATOM 0 HA TRP A 158 -8.559 11.815 2.523 1.00 0.83 H new ATOM 0 HB2 TRP A 158 -7.427 11.919 0.286 1.00 0.85 H new ATOM 0 HB3 TRP A 158 -8.634 13.069 -0.252 1.00 0.85 H new ATOM 0 HD1 TRP A 158 -6.823 13.157 3.196 1.00 1.51 H new ATOM 0 HE1 TRP A 158 -5.541 15.394 3.413 1.00 1.52 H new ATOM 0 HE3 TRP A 158 -7.716 14.991 -1.491 1.00 2.50 H new ATOM 0 HZ2 TRP A 158 -5.006 17.611 1.773 1.00 2.07 H new ATOM 0 HZ3 TRP A 158 -6.782 17.188 -2.096 1.00 3.24 H new ATOM 0 HH2 TRP A 158 -5.439 18.477 -0.487 1.00 2.95 H new