USER MOD reduce.3.24.130724 H: found=0, std=0, add=1153, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1153 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 72 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 102 TYR OH : rot -157:sc= 0.381 USER MOD Set 2.1: A 62 GLN : amide:sc= 0.823 K(o=1.9,f=-7.9!) USER MOD Set 2.2: A 65 LYS NZ :NH3+ -109:sc= 1.11 (180deg=0) USER MOD Set 3.1: A 33 ASN : amide:sc= -0.25 K(o=-0.48,f=-1.7) USER MOD Set 3.2: A 59 ASN : amide:sc= -0.232 K(o=-0.48,f=-1.7!) USER MOD Set 4.1: A 9 THR OG1 : rot 99:sc= 0.456 USER MOD Set 4.2: A 83 GLN : amide:sc= -1.03 K(o=-0.58,f=0.81) USER MOD Single : A 1 MET CE :methyl -177:sc= -0.0447 (180deg=-0.0588) USER MOD Single : A 1 MET N :NH3+ 141:sc= 0.0311 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ -134:sc= 1.13 (180deg=0.167) USER MOD Single : A 8 ASN : amide:sc= -0.492 X(o=-0.49,f=0) USER MOD Single : A 10 ASN : amide:sc= 0.145 X(o=0.14,f=0) USER MOD Single : A 11 ASN : amide:sc= 0.453 K(o=0.45,f=-5.2!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0.108 (180deg=0.108) USER MOD Single : A 17 LYS NZ :NH3+ -173:sc= 1.05 (180deg=1.01) USER MOD Single : A 19 LYS NZ :NH3+ 162:sc= 0.101 (180deg=0.0392) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 ASN : amide:sc= -0.5 X(o=-0.5,f=-0.57) USER MOD Single : A 25 GLN : amide:sc=-0.00547 X(o=-0.0055,f=-0.35) USER MOD Single : A 27 TYR OH : rot 30:sc= -1.46 USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ -104:sc= 0.559 (180deg=-0.141) USER MOD Single : A 42 MET CE :methyl -176:sc= -1.13 (180deg=-1.17) USER MOD Single : A 43 LYS NZ :NH3+ -109:sc= 0.991 (180deg=-0.441) USER MOD Single : A 44 LYS NZ :NH3+ -122:sc= 0.735 (180deg=-0.188) USER MOD Single : A 49 LYS NZ :NH3+ -174:sc= 0.867 (180deg=0.841) USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 61:sc= -0.0641 USER MOD Single : A 61 LYS NZ :NH3+ -109:sc= 0.173 (180deg=-3.99!) USER MOD Single : A 67 MET CE :methyl -173:sc= 0 (180deg=-0.112) USER MOD Single : A 73 LYS NZ :NH3+ -125:sc= -0.0796 (180deg=-0.121) USER MOD Single : A 76 TYR OH : rot -127:sc= 0.648 USER MOD Single : A 77 LYS NZ :NH3+ -170:sc= 0.48 (180deg=0.105) USER MOD Single : A 85 GLN : amide:sc= -1.25 X(o=-1.3,f=-1.4) USER MOD Single : A 88 ASN : amide:sc= -0.0101 K(o=-0.01,f=-1.6!) USER MOD Single : A 94 LYS NZ :NH3+ 137:sc= -0.109 (180deg=-1.64!) USER MOD Single : A 96 LYS NZ :NH3+ 143:sc= -0.404 (180deg=-2.13!) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= -0.466 X(o=-0.47,f=-0.38) USER MOD Single : A 106 LYS NZ :NH3+ 150:sc= 0.552 (180deg=0.0102) USER MOD Single : A 108 THR OG1 : rot -78:sc= 0.21 USER MOD Single : A 115 LYS NZ :NH3+ 149:sc= -0.418 (180deg=-1.64!) USER MOD Single : A 121 MET CE :methyl -106:sc= -0.0188 (180deg=-0.936) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 LYS NZ :NH3+ -176:sc= 0.28 (180deg=0.242) USER MOD Single : A 126 SER OG : rot 53:sc= 0.753 USER MOD Single : A 129 HIS : no HD1:sc= 0.472 K(o=0.47,f=-1.6!) USER MOD Single : A 130 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 131 HIS : no HE2:sc= 0.259 K(o=0.26,f=-1.5) USER MOD Single : A 132 HIS : no HD1:sc= -0.0497 X(o=-0.05,f=0) USER MOD Single : A 133 HIS : no HD1:sc=-0.00624 X(o=-0.0062,f=-0.013) USER MOD Single : A 134 HIS : no HE2:sc= 0.00507 K(o=0.0051,f=-0.58) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -16.221 8.129 4.697 1.00 15.42 N ATOM 2 CA MET A 1 -14.740 8.122 4.634 1.00 34.12 C ATOM 3 C MET A 1 -14.225 6.723 4.238 1.00 20.11 C ATOM 4 O MET A 1 -14.819 5.701 4.617 1.00 33.24 O ATOM 5 CB MET A 1 -14.147 8.594 5.992 1.00 3.15 C ATOM 6 CG MET A 1 -12.617 8.707 6.025 1.00 73.51 C ATOM 7 SD MET A 1 -11.980 9.739 4.692 1.00 43.02 S ATOM 8 CE MET A 1 -10.221 9.659 5.006 1.00 43.24 C ATOM 0 H1 MET A 1 -16.531 8.707 5.504 1.00 15.42 H new ATOM 0 H2 MET A 1 -16.604 8.529 3.817 1.00 15.42 H new ATOM 0 H3 MET A 1 -16.568 7.156 4.815 1.00 15.42 H new ATOM 0 HA MET A 1 -14.409 8.820 3.865 1.00 34.12 H new ATOM 0 HB2 MET A 1 -14.574 9.566 6.240 1.00 3.15 H new ATOM 0 HB3 MET A 1 -14.462 7.899 6.771 1.00 3.15 H new ATOM 0 HG2 MET A 1 -12.306 9.122 6.984 1.00 73.51 H new ATOM 0 HG3 MET A 1 -12.179 7.711 5.952 1.00 73.51 H new ATOM 0 HE1 MET A 1 -9.695 10.294 4.293 1.00 43.24 H new ATOM 0 HE2 MET A 1 -10.016 10.004 6.019 1.00 43.24 H new ATOM 0 HE3 MET A 1 -9.878 8.630 4.897 1.00 43.24 H new ATOM 20 N LYS A 2 -13.130 6.695 3.452 1.00 32.14 N ATOM 21 CA LYS A 2 -12.484 5.459 2.990 1.00 24.24 C ATOM 22 C LYS A 2 -10.962 5.653 3.035 1.00 15.15 C ATOM 23 O LYS A 2 -10.456 6.719 2.680 1.00 30.15 O ATOM 24 CB LYS A 2 -12.967 5.101 1.560 1.00 42.14 C ATOM 25 CG LYS A 2 -12.339 3.816 0.960 1.00 53.13 C ATOM 26 CD LYS A 2 -12.854 3.502 -0.465 1.00 31.41 C ATOM 27 CE LYS A 2 -14.384 3.323 -0.517 1.00 21.52 C ATOM 28 NZ LYS A 2 -14.876 2.284 0.441 1.00 71.45 N ATOM 0 H LYS A 2 -12.668 7.541 3.119 1.00 32.14 H new ATOM 0 HA LYS A 2 -12.755 4.628 3.642 1.00 24.24 H new ATOM 0 HB2 LYS A 2 -14.051 4.984 1.577 1.00 42.14 H new ATOM 0 HB3 LYS A 2 -12.747 5.938 0.898 1.00 42.14 H new ATOM 0 HG2 LYS A 2 -11.255 3.926 0.933 1.00 53.13 H new ATOM 0 HG3 LYS A 2 -12.557 2.972 1.614 1.00 53.13 H new ATOM 0 HD2 LYS A 2 -12.563 4.309 -1.138 1.00 31.41 H new ATOM 0 HD3 LYS A 2 -12.373 2.594 -0.829 1.00 31.41 H new ATOM 0 HE2 LYS A 2 -14.865 4.275 -0.293 1.00 21.52 H new ATOM 0 HE3 LYS A 2 -14.679 3.047 -1.529 1.00 21.52 H new ATOM 0 HZ1 LYS A 2 -15.554 1.661 -0.041 1.00 71.45 H new ATOM 0 HZ2 LYS A 2 -14.072 1.721 0.785 1.00 71.45 H new ATOM 0 HZ3 LYS A 2 -15.344 2.748 1.246 1.00 71.45 H new ATOM 42 N GLU A 3 -10.250 4.631 3.525 1.00 41.12 N ATOM 43 CA GLU A 3 -8.788 4.666 3.702 1.00 24.30 C ATOM 44 C GLU A 3 -8.134 3.720 2.677 1.00 20.13 C ATOM 45 O GLU A 3 -8.706 2.681 2.311 1.00 22.35 O ATOM 46 CB GLU A 3 -8.375 4.289 5.175 1.00 63.05 C ATOM 47 CG GLU A 3 -9.520 4.243 6.219 1.00 14.22 C ATOM 48 CD GLU A 3 -10.277 5.564 6.448 1.00 74.52 C ATOM 49 OE1 GLU A 3 -9.635 6.601 6.681 1.00 30.33 O ATOM 50 OE2 GLU A 3 -11.528 5.556 6.413 1.00 1.21 O ATOM 0 H GLU A 3 -10.673 3.749 3.813 1.00 41.12 H new ATOM 0 HA GLU A 3 -8.434 5.682 3.529 1.00 24.30 H new ATOM 0 HB2 GLU A 3 -7.891 3.313 5.155 1.00 63.05 H new ATOM 0 HB3 GLU A 3 -7.630 5.008 5.516 1.00 63.05 H new ATOM 0 HG2 GLU A 3 -10.238 3.485 5.908 1.00 14.22 H new ATOM 0 HG3 GLU A 3 -9.104 3.916 7.172 1.00 14.22 H new ATOM 57 N LEU A 4 -6.952 4.115 2.195 1.00 42.32 N ATOM 58 CA LEU A 4 -6.165 3.371 1.194 1.00 10.23 C ATOM 59 C LEU A 4 -4.742 3.157 1.731 1.00 31.43 C ATOM 60 O LEU A 4 -3.998 4.123 1.929 1.00 72.14 O ATOM 61 CB LEU A 4 -6.116 4.125 -0.176 1.00 75.53 C ATOM 62 CG LEU A 4 -7.336 3.943 -1.149 1.00 2.10 C ATOM 63 CD1 LEU A 4 -7.558 2.461 -1.496 1.00 42.00 C ATOM 64 CD2 LEU A 4 -8.631 4.607 -0.628 1.00 74.21 C ATOM 0 H LEU A 4 -6.501 4.980 2.494 1.00 42.32 H new ATOM 0 HA LEU A 4 -6.647 2.409 1.021 1.00 10.23 H new ATOM 0 HB2 LEU A 4 -6.006 5.190 0.030 1.00 75.53 H new ATOM 0 HB3 LEU A 4 -5.216 3.808 -0.702 1.00 75.53 H new ATOM 0 HG LEU A 4 -7.077 4.469 -2.068 1.00 2.10 H new ATOM 0 HD11 LEU A 4 -8.409 2.369 -2.171 1.00 42.00 H new ATOM 0 HD12 LEU A 4 -6.666 2.063 -1.980 1.00 42.00 H new ATOM 0 HD13 LEU A 4 -7.756 1.899 -0.583 1.00 42.00 H new ATOM 0 HD21 LEU A 4 -9.436 4.446 -1.345 1.00 74.21 H new ATOM 0 HD22 LEU A 4 -8.905 4.167 0.331 1.00 74.21 H new ATOM 0 HD23 LEU A 4 -8.466 5.677 -0.502 1.00 74.21 H new ATOM 76 N ILE A 5 -4.380 1.888 1.965 1.00 24.31 N ATOM 77 CA ILE A 5 -3.023 1.499 2.385 1.00 53.12 C ATOM 78 C ILE A 5 -2.334 0.742 1.231 1.00 50.23 C ATOM 79 O ILE A 5 -2.856 -0.252 0.723 1.00 24.43 O ATOM 80 CB ILE A 5 -3.039 0.649 3.716 1.00 53.42 C ATOM 81 CG1 ILE A 5 -1.595 0.177 4.106 1.00 41.34 C ATOM 82 CG2 ILE A 5 -4.029 -0.531 3.628 1.00 21.40 C ATOM 83 CD1 ILE A 5 -1.491 -0.663 5.376 1.00 73.11 C ATOM 0 H ILE A 5 -5.020 1.100 1.869 1.00 24.31 H new ATOM 0 HA ILE A 5 -2.452 2.400 2.609 1.00 53.12 H new ATOM 0 HB ILE A 5 -3.394 1.298 4.517 1.00 53.42 H new ATOM 0 HG12 ILE A 5 -1.185 -0.400 3.277 1.00 41.34 H new ATOM 0 HG13 ILE A 5 -0.964 1.058 4.223 1.00 41.34 H new ATOM 0 HG21 ILE A 5 -4.011 -1.092 4.563 1.00 21.40 H new ATOM 0 HG22 ILE A 5 -5.035 -0.150 3.453 1.00 21.40 H new ATOM 0 HG23 ILE A 5 -3.741 -1.187 2.806 1.00 21.40 H new ATOM 0 HD11 ILE A 5 -0.449 -0.933 5.549 1.00 73.11 H new ATOM 0 HD12 ILE A 5 -1.862 -0.088 6.224 1.00 73.11 H new ATOM 0 HD13 ILE A 5 -2.087 -1.569 5.263 1.00 73.11 H new ATOM 95 N LEU A 6 -1.172 1.255 0.811 1.00 54.41 N ATOM 96 CA LEU A 6 -0.382 0.705 -0.293 1.00 73.21 C ATOM 97 C LEU A 6 0.807 -0.067 0.298 1.00 51.44 C ATOM 98 O LEU A 6 1.603 0.504 1.043 1.00 75.53 O ATOM 99 CB LEU A 6 0.127 1.844 -1.230 1.00 21.42 C ATOM 100 CG LEU A 6 -0.949 2.661 -2.042 1.00 43.43 C ATOM 101 CD1 LEU A 6 -1.812 3.586 -1.146 1.00 74.01 C ATOM 102 CD2 LEU A 6 -0.271 3.465 -3.173 1.00 0.51 C ATOM 0 H LEU A 6 -0.748 2.079 1.237 1.00 54.41 H new ATOM 0 HA LEU A 6 -1.004 0.037 -0.889 1.00 73.21 H new ATOM 0 HB2 LEU A 6 0.695 2.549 -0.623 1.00 21.42 H new ATOM 0 HB3 LEU A 6 0.823 1.405 -1.944 1.00 21.42 H new ATOM 0 HG LEU A 6 -1.634 1.935 -2.480 1.00 43.43 H new ATOM 0 HD11 LEU A 6 -2.533 4.121 -1.764 1.00 74.01 H new ATOM 0 HD12 LEU A 6 -2.342 2.985 -0.407 1.00 74.01 H new ATOM 0 HD13 LEU A 6 -1.168 4.303 -0.637 1.00 74.01 H new ATOM 0 HD21 LEU A 6 -1.026 4.024 -3.725 1.00 0.51 H new ATOM 0 HD22 LEU A 6 0.452 4.158 -2.743 1.00 0.51 H new ATOM 0 HD23 LEU A 6 0.241 2.781 -3.850 1.00 0.51 H new ATOM 114 N ILE A 7 0.884 -1.367 -0.007 1.00 51.34 N ATOM 115 CA ILE A 7 1.995 -2.239 0.398 1.00 60.23 C ATOM 116 C ILE A 7 2.940 -2.407 -0.803 1.00 41.23 C ATOM 117 O ILE A 7 2.483 -2.611 -1.931 1.00 62.14 O ATOM 118 CB ILE A 7 1.490 -3.660 0.914 1.00 0.22 C ATOM 119 CG1 ILE A 7 0.790 -3.570 2.323 1.00 35.44 C ATOM 120 CG2 ILE A 7 2.643 -4.699 0.965 1.00 0.35 C ATOM 121 CD1 ILE A 7 -0.531 -2.829 2.351 1.00 54.23 C ATOM 0 H ILE A 7 0.168 -1.850 -0.549 1.00 51.34 H new ATOM 0 HA ILE A 7 2.518 -1.774 1.234 1.00 60.23 H new ATOM 0 HB ILE A 7 0.750 -3.996 0.188 1.00 0.22 H new ATOM 0 HG12 ILE A 7 0.626 -4.582 2.693 1.00 35.44 H new ATOM 0 HG13 ILE A 7 1.474 -3.083 3.018 1.00 35.44 H new ATOM 0 HG21 ILE A 7 2.257 -5.654 1.322 1.00 0.35 H new ATOM 0 HG22 ILE A 7 3.062 -4.827 -0.033 1.00 0.35 H new ATOM 0 HG23 ILE A 7 3.421 -4.346 1.642 1.00 0.35 H new ATOM 0 HD11 ILE A 7 -0.925 -2.827 3.367 1.00 54.23 H new ATOM 0 HD12 ILE A 7 -0.379 -1.802 2.018 1.00 54.23 H new ATOM 0 HD13 ILE A 7 -1.240 -3.324 1.688 1.00 54.23 H new ATOM 133 N ASN A 8 4.250 -2.293 -0.551 1.00 40.13 N ATOM 134 CA ASN A 8 5.298 -2.566 -1.541 1.00 35.13 C ATOM 135 C ASN A 8 6.114 -3.754 -1.046 1.00 71.13 C ATOM 136 O ASN A 8 6.792 -3.642 -0.027 1.00 51.31 O ATOM 137 CB ASN A 8 6.218 -1.332 -1.721 1.00 42.34 C ATOM 138 CG ASN A 8 7.263 -1.468 -2.843 1.00 74.33 C ATOM 139 OD1 ASN A 8 8.386 -0.977 -2.722 1.00 21.22 O ATOM 140 ND2 ASN A 8 6.888 -2.080 -3.963 1.00 71.12 N ATOM 0 H ASN A 8 4.616 -2.005 0.357 1.00 40.13 H new ATOM 0 HA ASN A 8 4.844 -2.788 -2.507 1.00 35.13 H new ATOM 0 HB2 ASN A 8 5.597 -0.460 -1.925 1.00 42.34 H new ATOM 0 HB3 ASN A 8 6.736 -1.142 -0.781 1.00 42.34 H new ATOM 0 HD21 ASN A 8 7.536 -2.151 -4.747 1.00 71.12 H new ATOM 0 HD22 ASN A 8 5.952 -2.478 -4.038 1.00 71.12 H new ATOM 147 N THR A 9 5.968 -4.905 -1.705 1.00 31.32 N ATOM 148 CA THR A 9 6.812 -6.076 -1.453 1.00 31.53 C ATOM 149 C THR A 9 7.001 -6.874 -2.752 1.00 1.54 C ATOM 150 O THR A 9 6.054 -7.041 -3.534 1.00 54.23 O ATOM 151 CB THR A 9 6.242 -6.981 -0.298 1.00 24.14 C ATOM 152 OG1 THR A 9 7.063 -8.147 -0.127 1.00 62.11 O ATOM 153 CG2 THR A 9 4.781 -7.407 -0.523 1.00 5.42 C ATOM 0 H THR A 9 5.263 -5.052 -2.427 1.00 31.32 H new ATOM 0 HA THR A 9 7.786 -5.723 -1.114 1.00 31.53 H new ATOM 0 HB THR A 9 6.261 -6.371 0.605 1.00 24.14 H new ATOM 0 HG1 THR A 9 7.680 -8.006 0.622 1.00 62.11 H new ATOM 0 HG21 THR A 9 4.451 -8.028 0.309 1.00 5.42 H new ATOM 0 HG22 THR A 9 4.149 -6.521 -0.587 1.00 5.42 H new ATOM 0 HG23 THR A 9 4.706 -7.974 -1.451 1.00 5.42 H new ATOM 161 N ASN A 10 8.243 -7.322 -2.987 1.00 44.04 N ATOM 162 CA ASN A 10 8.581 -8.234 -4.102 1.00 45.42 C ATOM 163 C ASN A 10 8.516 -9.704 -3.648 1.00 31.05 C ATOM 164 O ASN A 10 8.631 -10.615 -4.475 1.00 41.44 O ATOM 165 CB ASN A 10 9.992 -7.906 -4.664 1.00 54.04 C ATOM 166 CG ASN A 10 10.036 -6.582 -5.434 1.00 55.25 C ATOM 167 OD1 ASN A 10 9.788 -6.551 -6.640 1.00 55.34 O ATOM 168 ND2 ASN A 10 10.358 -5.489 -4.752 1.00 24.55 N ATOM 0 H ASN A 10 9.045 -7.065 -2.412 1.00 44.04 H new ATOM 0 HA ASN A 10 7.846 -8.087 -4.894 1.00 45.42 H new ATOM 0 HB2 ASN A 10 10.705 -7.865 -3.840 1.00 54.04 H new ATOM 0 HB3 ASN A 10 10.312 -8.714 -5.322 1.00 54.04 H new ATOM 0 HD21 ASN A 10 10.406 -4.587 -5.227 1.00 24.55 H new ATOM 0 HD22 ASN A 10 10.557 -5.551 -3.754 1.00 24.55 H new ATOM 175 N ASN A 11 8.327 -9.919 -2.334 1.00 31.24 N ATOM 176 CA ASN A 11 8.268 -11.260 -1.742 1.00 21.41 C ATOM 177 C ASN A 11 6.862 -11.855 -1.970 1.00 33.11 C ATOM 178 O ASN A 11 5.921 -11.520 -1.243 1.00 21.22 O ATOM 179 CB ASN A 11 8.626 -11.200 -0.226 1.00 11.21 C ATOM 180 CG ASN A 11 8.801 -12.592 0.399 1.00 44.34 C ATOM 181 OD1 ASN A 11 7.859 -13.199 0.893 1.00 22.35 O ATOM 182 ND2 ASN A 11 10.007 -13.113 0.356 1.00 4.14 N ATOM 0 H ASN A 11 8.211 -9.166 -1.656 1.00 31.24 H new ATOM 0 HA ASN A 11 9.000 -11.908 -2.223 1.00 21.41 H new ATOM 0 HB2 ASN A 11 9.546 -10.630 -0.097 1.00 11.21 H new ATOM 0 HB3 ASN A 11 7.841 -10.663 0.307 1.00 11.21 H new ATOM 0 HD21 ASN A 11 10.175 -14.043 0.739 1.00 4.14 H new ATOM 0 HD22 ASN A 11 10.775 -12.587 -0.061 1.00 4.14 H new ATOM 189 N ASP A 12 6.749 -12.687 -3.033 1.00 42.33 N ATOM 190 CA ASP A 12 5.514 -13.415 -3.436 1.00 13.15 C ATOM 191 C ASP A 12 4.786 -14.066 -2.247 1.00 63.04 C ATOM 192 O ASP A 12 3.552 -13.950 -2.107 1.00 41.24 O ATOM 193 CB ASP A 12 5.875 -14.509 -4.495 1.00 33.01 C ATOM 194 CG ASP A 12 4.811 -15.624 -4.644 1.00 12.13 C ATOM 195 OD1 ASP A 12 3.731 -15.362 -5.221 1.00 13.44 O ATOM 196 OD2 ASP A 12 5.033 -16.752 -4.134 1.00 14.23 O ATOM 0 H ASP A 12 7.535 -12.878 -3.654 1.00 42.33 H new ATOM 0 HA ASP A 12 4.832 -12.679 -3.862 1.00 13.15 H new ATOM 0 HB2 ASP A 12 6.019 -14.028 -5.463 1.00 33.01 H new ATOM 0 HB3 ASP A 12 6.826 -14.965 -4.220 1.00 33.01 H new ATOM 201 N GLU A 13 5.566 -14.782 -1.430 1.00 51.04 N ATOM 202 CA GLU A 13 5.040 -15.549 -0.308 1.00 44.13 C ATOM 203 C GLU A 13 4.423 -14.619 0.757 1.00 21.14 C ATOM 204 O GLU A 13 3.384 -14.954 1.339 1.00 4.21 O ATOM 205 CB GLU A 13 6.142 -16.457 0.284 1.00 75.41 C ATOM 206 CG GLU A 13 6.638 -17.555 -0.690 1.00 22.35 C ATOM 207 CD GLU A 13 7.719 -18.459 -0.075 1.00 13.33 C ATOM 208 OE1 GLU A 13 7.367 -19.427 0.642 1.00 30.55 O ATOM 209 OE2 GLU A 13 8.922 -18.203 -0.290 1.00 23.02 O ATOM 0 H GLU A 13 6.579 -14.843 -1.532 1.00 51.04 H new ATOM 0 HA GLU A 13 4.238 -16.193 -0.669 1.00 44.13 H new ATOM 0 HB2 GLU A 13 6.989 -15.838 0.581 1.00 75.41 H new ATOM 0 HB3 GLU A 13 5.762 -16.932 1.188 1.00 75.41 H new ATOM 0 HG2 GLU A 13 5.792 -18.168 -0.999 1.00 22.35 H new ATOM 0 HG3 GLU A 13 7.035 -17.083 -1.589 1.00 22.35 H new ATOM 216 N LEU A 14 5.033 -13.429 0.961 1.00 73.32 N ATOM 217 CA LEU A 14 4.505 -12.422 1.896 1.00 14.44 C ATOM 218 C LEU A 14 3.184 -11.847 1.370 1.00 13.42 C ATOM 219 O LEU A 14 2.255 -11.677 2.145 1.00 32.44 O ATOM 220 CB LEU A 14 5.507 -11.263 2.162 1.00 21.44 C ATOM 221 CG LEU A 14 4.941 -10.073 3.018 1.00 71.24 C ATOM 222 CD1 LEU A 14 4.458 -10.525 4.419 1.00 15.43 C ATOM 223 CD2 LEU A 14 5.940 -8.915 3.117 1.00 72.23 C ATOM 0 H LEU A 14 5.892 -13.147 0.488 1.00 73.32 H new ATOM 0 HA LEU A 14 4.339 -12.934 2.844 1.00 14.44 H new ATOM 0 HB2 LEU A 14 6.382 -11.670 2.668 1.00 21.44 H new ATOM 0 HB3 LEU A 14 5.847 -10.871 1.204 1.00 21.44 H new ATOM 0 HG LEU A 14 4.063 -9.705 2.486 1.00 71.24 H new ATOM 0 HD11 LEU A 14 4.077 -9.664 4.968 1.00 15.43 H new ATOM 0 HD12 LEU A 14 3.665 -11.265 4.309 1.00 15.43 H new ATOM 0 HD13 LEU A 14 5.291 -10.965 4.967 1.00 15.43 H new ATOM 0 HD21 LEU A 14 5.509 -8.113 3.717 1.00 72.23 H new ATOM 0 HD22 LEU A 14 6.859 -9.266 3.587 1.00 72.23 H new ATOM 0 HD23 LEU A 14 6.163 -8.541 2.118 1.00 72.23 H new ATOM 235 N ILE A 15 3.120 -11.566 0.045 1.00 3.33 N ATOM 236 CA ILE A 15 1.924 -10.983 -0.608 1.00 30.32 C ATOM 237 C ILE A 15 0.657 -11.803 -0.257 1.00 51.03 C ATOM 238 O ILE A 15 -0.366 -11.235 0.140 1.00 41.52 O ATOM 239 CB ILE A 15 2.102 -10.893 -2.176 1.00 43.04 C ATOM 240 CG1 ILE A 15 3.342 -10.011 -2.535 1.00 64.55 C ATOM 241 CG2 ILE A 15 0.821 -10.354 -2.866 1.00 62.55 C ATOM 242 CD1 ILE A 15 3.674 -9.912 -4.015 1.00 5.21 C ATOM 0 H ILE A 15 3.893 -11.737 -0.598 1.00 3.33 H new ATOM 0 HA ILE A 15 1.805 -9.969 -0.227 1.00 30.32 H new ATOM 0 HB ILE A 15 2.273 -11.902 -2.551 1.00 43.04 H new ATOM 0 HG12 ILE A 15 3.172 -9.005 -2.151 1.00 64.55 H new ATOM 0 HG13 ILE A 15 4.212 -10.409 -2.012 1.00 64.55 H new ATOM 0 HG21 ILE A 15 0.981 -10.306 -3.943 1.00 62.55 H new ATOM 0 HG22 ILE A 15 -0.015 -11.020 -2.652 1.00 62.55 H new ATOM 0 HG23 ILE A 15 0.596 -9.357 -2.488 1.00 62.55 H new ATOM 0 HD11 ILE A 15 4.550 -9.277 -4.150 1.00 5.21 H new ATOM 0 HD12 ILE A 15 3.883 -10.907 -4.408 1.00 5.21 H new ATOM 0 HD13 ILE A 15 2.828 -9.481 -4.550 1.00 5.21 H new ATOM 254 N LYS A 16 0.786 -13.144 -0.342 1.00 44.33 N ATOM 255 CA LYS A 16 -0.294 -14.091 0.014 1.00 73.22 C ATOM 256 C LYS A 16 -0.594 -14.087 1.533 1.00 71.31 C ATOM 257 O LYS A 16 -1.763 -14.177 1.926 1.00 43.43 O ATOM 258 CB LYS A 16 0.044 -15.527 -0.480 1.00 41.24 C ATOM 259 CG LYS A 16 -0.070 -15.712 -2.016 1.00 41.15 C ATOM 260 CD LYS A 16 0.032 -17.197 -2.461 1.00 61.32 C ATOM 261 CE LYS A 16 1.453 -17.772 -2.341 1.00 24.21 C ATOM 262 NZ LYS A 16 2.373 -17.179 -3.341 1.00 22.41 N ATOM 0 H LYS A 16 1.641 -13.601 -0.659 1.00 44.33 H new ATOM 0 HA LYS A 16 -1.198 -13.754 -0.494 1.00 73.22 H new ATOM 0 HB2 LYS A 16 1.058 -15.777 -0.169 1.00 41.24 H new ATOM 0 HB3 LYS A 16 -0.624 -16.235 0.011 1.00 41.24 H new ATOM 0 HG2 LYS A 16 -1.021 -15.302 -2.356 1.00 41.15 H new ATOM 0 HG3 LYS A 16 0.717 -15.138 -2.504 1.00 41.15 H new ATOM 0 HD2 LYS A 16 -0.648 -17.798 -1.857 1.00 61.32 H new ATOM 0 HD3 LYS A 16 -0.301 -17.283 -3.495 1.00 61.32 H new ATOM 0 HE2 LYS A 16 1.837 -17.585 -1.338 1.00 24.21 H new ATOM 0 HE3 LYS A 16 1.420 -18.853 -2.474 1.00 24.21 H new ATOM 0 HZ1 LYS A 16 3.321 -17.592 -3.228 1.00 22.41 H new ATOM 0 HZ2 LYS A 16 2.020 -17.379 -4.299 1.00 22.41 H new ATOM 0 HZ3 LYS A 16 2.424 -16.150 -3.198 1.00 22.41 H new ATOM 276 N LYS A 17 0.458 -13.969 2.374 1.00 64.53 N ATOM 277 CA LYS A 17 0.308 -13.902 3.855 1.00 43.41 C ATOM 278 C LYS A 17 -0.478 -12.641 4.273 1.00 5.24 C ATOM 279 O LYS A 17 -1.309 -12.686 5.204 1.00 45.03 O ATOM 280 CB LYS A 17 1.692 -13.924 4.560 1.00 71.04 C ATOM 281 CG LYS A 17 2.466 -15.256 4.419 1.00 22.10 C ATOM 282 CD LYS A 17 3.838 -15.228 5.141 1.00 61.33 C ATOM 283 CE LYS A 17 3.698 -15.006 6.656 1.00 22.25 C ATOM 284 NZ LYS A 17 5.011 -14.954 7.347 1.00 74.44 N ATOM 0 H LYS A 17 1.426 -13.918 2.056 1.00 64.53 H new ATOM 0 HA LYS A 17 -0.253 -14.783 4.168 1.00 43.41 H new ATOM 0 HB2 LYS A 17 2.304 -13.119 4.154 1.00 71.04 H new ATOM 0 HB3 LYS A 17 1.549 -13.713 5.620 1.00 71.04 H new ATOM 0 HG2 LYS A 17 1.862 -16.067 4.825 1.00 22.10 H new ATOM 0 HG3 LYS A 17 2.620 -15.472 3.362 1.00 22.10 H new ATOM 0 HD2 LYS A 17 4.360 -16.168 4.961 1.00 61.33 H new ATOM 0 HD3 LYS A 17 4.453 -14.435 4.716 1.00 61.33 H new ATOM 0 HE2 LYS A 17 3.160 -14.075 6.835 1.00 22.25 H new ATOM 0 HE3 LYS A 17 3.098 -15.809 7.084 1.00 22.25 H new ATOM 0 HZ1 LYS A 17 4.861 -14.922 8.376 1.00 74.44 H new ATOM 0 HZ2 LYS A 17 5.565 -15.800 7.104 1.00 74.44 H new ATOM 0 HZ3 LYS A 17 5.528 -14.103 7.046 1.00 74.44 H new ATOM 298 N ILE A 18 -0.212 -11.529 3.553 1.00 33.45 N ATOM 299 CA ILE A 18 -0.895 -10.251 3.761 1.00 34.15 C ATOM 300 C ILE A 18 -2.378 -10.435 3.431 1.00 52.24 C ATOM 301 O ILE A 18 -3.219 -10.130 4.264 1.00 15.13 O ATOM 302 CB ILE A 18 -0.272 -9.093 2.884 1.00 25.54 C ATOM 303 CG1 ILE A 18 1.232 -8.894 3.237 1.00 43.30 C ATOM 304 CG2 ILE A 18 -1.051 -7.762 3.056 1.00 70.22 C ATOM 305 CD1 ILE A 18 1.971 -7.936 2.332 1.00 30.41 C ATOM 0 H ILE A 18 0.487 -11.502 2.810 1.00 33.45 H new ATOM 0 HA ILE A 18 -0.771 -9.954 4.802 1.00 34.15 H new ATOM 0 HB ILE A 18 -0.353 -9.389 1.838 1.00 25.54 H new ATOM 0 HG12 ILE A 18 1.306 -8.534 4.263 1.00 43.30 H new ATOM 0 HG13 ILE A 18 1.731 -9.863 3.203 1.00 43.30 H new ATOM 0 HG21 ILE A 18 -0.593 -6.990 2.438 1.00 70.22 H new ATOM 0 HG22 ILE A 18 -2.087 -7.905 2.750 1.00 70.22 H new ATOM 0 HG23 ILE A 18 -1.021 -7.455 4.101 1.00 70.22 H new ATOM 0 HD11 ILE A 18 3.010 -7.860 2.653 1.00 30.41 H new ATOM 0 HD12 ILE A 18 1.934 -8.303 1.306 1.00 30.41 H new ATOM 0 HD13 ILE A 18 1.503 -6.953 2.383 1.00 30.41 H new ATOM 317 N LYS A 19 -2.665 -11.030 2.240 1.00 72.51 N ATOM 318 CA LYS A 19 -4.048 -11.278 1.768 1.00 32.43 C ATOM 319 C LYS A 19 -4.870 -12.033 2.820 1.00 2.41 C ATOM 320 O LYS A 19 -6.012 -11.671 3.075 1.00 52.02 O ATOM 321 CB LYS A 19 -4.069 -12.073 0.436 1.00 51.51 C ATOM 322 CG LYS A 19 -3.381 -11.360 -0.732 1.00 45.43 C ATOM 323 CD LYS A 19 -3.515 -12.137 -2.056 1.00 23.44 C ATOM 324 CE LYS A 19 -2.781 -11.444 -3.205 1.00 32.20 C ATOM 325 NZ LYS A 19 -3.031 -12.096 -4.515 1.00 61.15 N ATOM 0 H LYS A 19 -1.947 -11.347 1.588 1.00 72.51 H new ATOM 0 HA LYS A 19 -4.496 -10.299 1.598 1.00 32.43 H new ATOM 0 HB2 LYS A 19 -3.586 -13.037 0.594 1.00 51.51 H new ATOM 0 HB3 LYS A 19 -5.105 -12.276 0.164 1.00 51.51 H new ATOM 0 HG2 LYS A 19 -3.812 -10.366 -0.852 1.00 45.43 H new ATOM 0 HG3 LYS A 19 -2.325 -11.223 -0.499 1.00 45.43 H new ATOM 0 HD2 LYS A 19 -3.118 -13.144 -1.927 1.00 23.44 H new ATOM 0 HD3 LYS A 19 -4.570 -12.241 -2.310 1.00 23.44 H new ATOM 0 HE2 LYS A 19 -3.095 -10.401 -3.256 1.00 32.20 H new ATOM 0 HE3 LYS A 19 -1.710 -11.445 -3.001 1.00 32.20 H new ATOM 0 HZ1 LYS A 19 -2.779 -11.441 -5.282 1.00 61.15 H new ATOM 0 HZ2 LYS A 19 -2.452 -12.957 -4.591 1.00 61.15 H new ATOM 0 HZ3 LYS A 19 -4.037 -12.348 -4.591 1.00 61.15 H new ATOM 339 N LYS A 20 -4.244 -13.055 3.448 1.00 35.21 N ATOM 340 CA LYS A 20 -4.863 -13.830 4.542 1.00 14.52 C ATOM 341 C LYS A 20 -5.266 -12.901 5.696 1.00 62.35 C ATOM 342 O LYS A 20 -6.424 -12.922 6.126 1.00 4.45 O ATOM 343 CB LYS A 20 -3.894 -14.930 5.060 1.00 2.51 C ATOM 344 CG LYS A 20 -3.539 -16.022 4.031 1.00 32.31 C ATOM 345 CD LYS A 20 -4.754 -16.854 3.560 1.00 61.33 C ATOM 346 CE LYS A 20 -5.431 -17.627 4.703 1.00 44.12 C ATOM 347 NZ LYS A 20 -6.584 -18.425 4.215 1.00 11.15 N ATOM 0 H LYS A 20 -3.301 -13.362 3.210 1.00 35.21 H new ATOM 0 HA LYS A 20 -5.757 -14.314 4.148 1.00 14.52 H new ATOM 0 HB2 LYS A 20 -2.972 -14.453 5.394 1.00 2.51 H new ATOM 0 HB3 LYS A 20 -4.341 -15.406 5.933 1.00 2.51 H new ATOM 0 HG2 LYS A 20 -3.073 -15.554 3.164 1.00 32.31 H new ATOM 0 HG3 LYS A 20 -2.799 -16.692 4.467 1.00 32.31 H new ATOM 0 HD2 LYS A 20 -5.483 -16.191 3.095 1.00 61.33 H new ATOM 0 HD3 LYS A 20 -4.430 -17.559 2.794 1.00 61.33 H new ATOM 0 HE2 LYS A 20 -4.705 -18.288 5.176 1.00 44.12 H new ATOM 0 HE3 LYS A 20 -5.770 -16.926 5.466 1.00 44.12 H new ATOM 0 HZ1 LYS A 20 -7.017 -18.933 5.012 1.00 11.15 H new ATOM 0 HZ2 LYS A 20 -7.288 -17.791 3.786 1.00 11.15 H new ATOM 0 HZ3 LYS A 20 -6.256 -19.110 3.505 1.00 11.15 H new ATOM 361 N GLU A 21 -4.305 -12.063 6.150 1.00 42.21 N ATOM 362 CA GLU A 21 -4.532 -11.074 7.230 1.00 25.14 C ATOM 363 C GLU A 21 -5.685 -10.115 6.892 1.00 73.41 C ATOM 364 O GLU A 21 -6.546 -9.863 7.725 1.00 71.11 O ATOM 365 CB GLU A 21 -3.236 -10.265 7.522 1.00 60.13 C ATOM 366 CG GLU A 21 -2.054 -11.109 8.027 1.00 11.42 C ATOM 367 CD GLU A 21 -2.376 -11.872 9.327 1.00 33.22 C ATOM 368 OE1 GLU A 21 -2.391 -11.241 10.406 1.00 55.24 O ATOM 369 OE2 GLU A 21 -2.624 -13.104 9.277 1.00 74.11 O ATOM 0 H GLU A 21 -3.355 -12.053 5.780 1.00 42.21 H new ATOM 0 HA GLU A 21 -4.810 -11.633 8.123 1.00 25.14 H new ATOM 0 HB2 GLU A 21 -2.933 -9.748 6.611 1.00 60.13 H new ATOM 0 HB3 GLU A 21 -3.461 -9.499 8.264 1.00 60.13 H new ATOM 0 HG2 GLU A 21 -1.767 -11.822 7.254 1.00 11.42 H new ATOM 0 HG3 GLU A 21 -1.196 -10.459 8.196 1.00 11.42 H new ATOM 376 N VAL A 22 -5.703 -9.642 5.644 1.00 24.51 N ATOM 377 CA VAL A 22 -6.668 -8.639 5.156 1.00 13.43 C ATOM 378 C VAL A 22 -8.088 -9.246 5.070 1.00 32.01 C ATOM 379 O VAL A 22 -9.083 -8.560 5.327 1.00 54.44 O ATOM 380 CB VAL A 22 -6.186 -8.094 3.760 1.00 24.21 C ATOM 381 CG1 VAL A 22 -7.122 -7.023 3.177 1.00 72.00 C ATOM 382 CG2 VAL A 22 -4.753 -7.544 3.861 1.00 64.13 C ATOM 0 H VAL A 22 -5.041 -9.945 4.930 1.00 24.51 H new ATOM 0 HA VAL A 22 -6.717 -7.806 5.857 1.00 13.43 H new ATOM 0 HB VAL A 22 -6.206 -8.941 3.074 1.00 24.21 H new ATOM 0 HG11 VAL A 22 -6.736 -6.687 2.215 1.00 72.00 H new ATOM 0 HG12 VAL A 22 -8.118 -7.445 3.041 1.00 72.00 H new ATOM 0 HG13 VAL A 22 -7.177 -6.176 3.861 1.00 72.00 H new ATOM 0 HG21 VAL A 22 -4.437 -7.172 2.887 1.00 64.13 H new ATOM 0 HG22 VAL A 22 -4.726 -6.731 4.586 1.00 64.13 H new ATOM 0 HG23 VAL A 22 -4.080 -8.339 4.182 1.00 64.13 H new ATOM 392 N GLU A 23 -8.156 -10.552 4.747 1.00 24.21 N ATOM 393 CA GLU A 23 -9.417 -11.318 4.740 1.00 12.51 C ATOM 394 C GLU A 23 -9.900 -11.596 6.179 1.00 74.11 C ATOM 395 O GLU A 23 -11.108 -11.675 6.425 1.00 32.14 O ATOM 396 CB GLU A 23 -9.253 -12.641 3.934 1.00 65.14 C ATOM 397 CG GLU A 23 -8.954 -12.452 2.424 1.00 1.41 C ATOM 398 CD GLU A 23 -10.014 -11.625 1.669 1.00 25.54 C ATOM 399 OE1 GLU A 23 -11.004 -12.211 1.172 1.00 11.34 O ATOM 400 OE2 GLU A 23 -9.867 -10.386 1.564 1.00 2.35 O ATOM 0 H GLU A 23 -7.340 -11.105 4.484 1.00 24.21 H new ATOM 0 HA GLU A 23 -10.180 -10.717 4.245 1.00 12.51 H new ATOM 0 HB2 GLU A 23 -8.446 -13.223 4.379 1.00 65.14 H new ATOM 0 HB3 GLU A 23 -10.165 -13.229 4.038 1.00 65.14 H new ATOM 0 HG2 GLU A 23 -7.985 -11.966 2.315 1.00 1.41 H new ATOM 0 HG3 GLU A 23 -8.873 -13.433 1.955 1.00 1.41 H new ATOM 407 N ASN A 24 -8.943 -11.715 7.127 1.00 42.43 N ATOM 408 CA ASN A 24 -9.244 -11.910 8.569 1.00 74.14 C ATOM 409 C ASN A 24 -9.867 -10.637 9.157 1.00 64.43 C ATOM 410 O ASN A 24 -10.737 -10.705 10.027 1.00 53.52 O ATOM 411 CB ASN A 24 -7.960 -12.282 9.378 1.00 0.22 C ATOM 412 CG ASN A 24 -7.314 -13.593 8.925 1.00 13.54 C ATOM 413 OD1 ASN A 24 -7.991 -14.500 8.445 1.00 51.13 O ATOM 414 ND2 ASN A 24 -5.995 -13.700 9.055 1.00 5.24 N ATOM 0 H ASN A 24 -7.945 -11.679 6.919 1.00 42.43 H new ATOM 0 HA ASN A 24 -9.951 -12.736 8.648 1.00 74.14 H new ATOM 0 HB2 ASN A 24 -7.233 -11.475 9.282 1.00 0.22 H new ATOM 0 HB3 ASN A 24 -8.215 -12.358 10.435 1.00 0.22 H new ATOM 0 HD21 ASN A 24 -5.520 -14.551 8.753 1.00 5.24 H new ATOM 0 HD22 ASN A 24 -5.458 -12.931 9.457 1.00 5.24 H new ATOM 421 N GLN A 25 -9.402 -9.475 8.663 1.00 60.00 N ATOM 422 CA GLN A 25 -9.859 -8.155 9.138 1.00 10.33 C ATOM 423 C GLN A 25 -11.133 -7.716 8.399 1.00 32.22 C ATOM 424 O GLN A 25 -11.930 -6.938 8.931 1.00 53.14 O ATOM 425 CB GLN A 25 -8.732 -7.100 8.961 1.00 23.22 C ATOM 426 CG GLN A 25 -7.361 -7.510 9.562 1.00 52.42 C ATOM 427 CD GLN A 25 -7.399 -7.943 11.032 1.00 54.12 C ATOM 428 OE1 GLN A 25 -8.236 -7.491 11.807 1.00 15.04 O ATOM 429 NE2 GLN A 25 -6.463 -8.791 11.431 1.00 0.12 N ATOM 0 H GLN A 25 -8.700 -9.424 7.925 1.00 60.00 H new ATOM 0 HA GLN A 25 -10.097 -8.236 10.199 1.00 10.33 H new ATOM 0 HB2 GLN A 25 -8.602 -6.901 7.897 1.00 23.22 H new ATOM 0 HB3 GLN A 25 -9.051 -6.166 9.423 1.00 23.22 H new ATOM 0 HG2 GLN A 25 -6.952 -8.328 8.969 1.00 52.42 H new ATOM 0 HG3 GLN A 25 -6.673 -6.670 9.464 1.00 52.42 H new ATOM 0 HE21 GLN A 25 -5.781 -9.149 10.763 1.00 0.12 H new ATOM 0 HE22 GLN A 25 -6.424 -9.086 12.407 1.00 0.12 H new ATOM 438 N GLY A 26 -11.300 -8.226 7.166 1.00 52.45 N ATOM 439 CA GLY A 26 -12.476 -7.945 6.344 1.00 51.44 C ATOM 440 C GLY A 26 -12.254 -6.844 5.314 1.00 62.42 C ATOM 441 O GLY A 26 -13.208 -6.422 4.658 1.00 65.35 O ATOM 0 H GLY A 26 -10.622 -8.842 6.718 1.00 52.45 H new ATOM 0 HA2 GLY A 26 -12.775 -8.858 5.829 1.00 51.44 H new ATOM 0 HA3 GLY A 26 -13.303 -7.661 6.994 1.00 51.44 H new ATOM 445 N TYR A 27 -10.991 -6.392 5.150 1.00 4.42 N ATOM 446 CA TYR A 27 -10.627 -5.357 4.155 1.00 42.42 C ATOM 447 C TYR A 27 -10.581 -5.965 2.741 1.00 43.45 C ATOM 448 O TYR A 27 -10.504 -7.190 2.578 1.00 23.24 O ATOM 449 CB TYR A 27 -9.278 -4.665 4.514 1.00 62.43 C ATOM 450 CG TYR A 27 -9.297 -3.725 5.733 1.00 53.51 C ATOM 451 CD1 TYR A 27 -10.071 -4.002 6.866 1.00 4.35 C ATOM 452 CD2 TYR A 27 -8.523 -2.557 5.752 1.00 11.12 C ATOM 453 CE1 TYR A 27 -10.073 -3.159 7.956 1.00 13.52 C ATOM 454 CE2 TYR A 27 -8.524 -1.714 6.848 1.00 13.23 C ATOM 455 CZ TYR A 27 -9.301 -2.023 7.945 1.00 51.22 C ATOM 456 OH TYR A 27 -9.308 -1.186 9.041 1.00 44.51 O ATOM 0 H TYR A 27 -10.200 -6.731 5.698 1.00 4.42 H new ATOM 0 HA TYR A 27 -11.398 -4.587 4.174 1.00 42.42 H new ATOM 0 HB2 TYR A 27 -8.532 -5.440 4.691 1.00 62.43 H new ATOM 0 HB3 TYR A 27 -8.945 -4.094 3.647 1.00 62.43 H new ATOM 0 HD1 TYR A 27 -10.679 -4.894 6.886 1.00 4.35 H new ATOM 0 HD2 TYR A 27 -7.914 -2.311 4.895 1.00 11.12 H new ATOM 0 HE1 TYR A 27 -10.681 -3.391 8.818 1.00 13.52 H new ATOM 0 HE2 TYR A 27 -7.920 -0.819 6.845 1.00 13.23 H new ATOM 0 HH TYR A 27 -9.478 -1.710 9.852 1.00 44.51 H new ATOM 466 N GLN A 28 -10.626 -5.094 1.725 1.00 52.30 N ATOM 467 CA GLN A 28 -10.729 -5.507 0.316 1.00 43.43 C ATOM 468 C GLN A 28 -9.321 -5.581 -0.317 1.00 61.42 C ATOM 469 O GLN A 28 -8.670 -4.543 -0.469 1.00 23.22 O ATOM 470 CB GLN A 28 -11.604 -4.479 -0.459 1.00 52.33 C ATOM 471 CG GLN A 28 -12.929 -4.067 0.223 1.00 63.50 C ATOM 472 CD GLN A 28 -13.938 -5.207 0.394 1.00 72.34 C ATOM 473 OE1 GLN A 28 -14.748 -5.470 -0.494 1.00 61.01 O ATOM 474 NE2 GLN A 28 -13.922 -5.863 1.546 1.00 22.40 N ATOM 0 H GLN A 28 -10.592 -4.083 1.855 1.00 52.30 H new ATOM 0 HA GLN A 28 -11.191 -6.493 0.261 1.00 43.43 H new ATOM 0 HB2 GLN A 28 -11.010 -3.580 -0.628 1.00 52.33 H new ATOM 0 HB3 GLN A 28 -11.837 -4.896 -1.439 1.00 52.33 H new ATOM 0 HG2 GLN A 28 -12.703 -3.649 1.204 1.00 63.50 H new ATOM 0 HG3 GLN A 28 -13.393 -3.273 -0.363 1.00 63.50 H new ATOM 0 HE21 GLN A 28 -13.237 -5.620 2.262 1.00 22.40 H new ATOM 0 HE22 GLN A 28 -14.595 -6.611 1.717 1.00 22.40 H new ATOM 483 N VAL A 29 -8.855 -6.795 -0.674 1.00 41.44 N ATOM 484 CA VAL A 29 -7.551 -6.988 -1.362 1.00 70.43 C ATOM 485 C VAL A 29 -7.700 -6.678 -2.863 1.00 23.05 C ATOM 486 O VAL A 29 -8.569 -7.258 -3.521 1.00 5.21 O ATOM 487 CB VAL A 29 -6.991 -8.464 -1.233 1.00 21.20 C ATOM 488 CG1 VAL A 29 -5.565 -8.577 -1.841 1.00 3.40 C ATOM 489 CG2 VAL A 29 -7.013 -8.952 0.228 1.00 20.32 C ATOM 0 H VAL A 29 -9.361 -7.663 -0.499 1.00 41.44 H new ATOM 0 HA VAL A 29 -6.850 -6.309 -0.876 1.00 70.43 H new ATOM 0 HB VAL A 29 -7.652 -9.116 -1.805 1.00 21.20 H new ATOM 0 HG11 VAL A 29 -5.206 -9.601 -1.738 1.00 3.40 H new ATOM 0 HG12 VAL A 29 -5.597 -8.308 -2.897 1.00 3.40 H new ATOM 0 HG13 VAL A 29 -4.891 -7.901 -1.315 1.00 3.40 H new ATOM 0 HG21 VAL A 29 -6.622 -9.968 0.278 1.00 20.32 H new ATOM 0 HG22 VAL A 29 -6.396 -8.295 0.840 1.00 20.32 H new ATOM 0 HG23 VAL A 29 -8.037 -8.939 0.601 1.00 20.32 H new ATOM 499 N ARG A 30 -6.880 -5.754 -3.391 1.00 34.35 N ATOM 500 CA ARG A 30 -6.725 -5.542 -4.847 1.00 24.40 C ATOM 501 C ARG A 30 -5.224 -5.494 -5.179 1.00 52.13 C ATOM 502 O ARG A 30 -4.465 -4.758 -4.533 1.00 1.40 O ATOM 503 CB ARG A 30 -7.431 -4.241 -5.349 1.00 65.33 C ATOM 504 CG ARG A 30 -8.991 -4.271 -5.365 1.00 40.22 C ATOM 505 CD ARG A 30 -9.645 -3.916 -4.018 1.00 61.44 C ATOM 506 NE ARG A 30 -11.114 -3.769 -4.108 1.00 14.42 N ATOM 507 CZ ARG A 30 -11.769 -2.782 -4.762 1.00 13.23 C ATOM 508 NH1 ARG A 30 -11.120 -1.818 -5.412 1.00 75.20 N ATOM 509 NH2 ARG A 30 -13.089 -2.764 -4.733 1.00 61.33 N ATOM 0 H ARG A 30 -6.304 -5.131 -2.824 1.00 34.35 H new ATOM 0 HA ARG A 30 -7.208 -6.372 -5.362 1.00 24.40 H new ATOM 0 HB2 ARG A 30 -7.110 -3.411 -4.719 1.00 65.33 H new ATOM 0 HB3 ARG A 30 -7.081 -4.028 -6.359 1.00 65.33 H new ATOM 0 HG2 ARG A 30 -9.348 -3.575 -6.124 1.00 40.22 H new ATOM 0 HG3 ARG A 30 -9.321 -5.266 -5.665 1.00 40.22 H new ATOM 0 HD2 ARG A 30 -9.407 -4.691 -3.290 1.00 61.44 H new ATOM 0 HD3 ARG A 30 -9.215 -2.986 -3.646 1.00 61.44 H new ATOM 0 HE ARG A 30 -11.682 -4.472 -3.636 1.00 14.42 H new ATOM 0 HH11 ARG A 30 -10.100 -1.810 -5.426 1.00 75.20 H new ATOM 0 HH12 ARG A 30 -11.643 -1.088 -5.896 1.00 75.20 H new ATOM 0 HH21 ARG A 30 -13.598 -3.486 -4.223 1.00 61.33 H new ATOM 0 HH22 ARG A 30 -13.600 -2.028 -5.220 1.00 61.33 H new ATOM 523 N ASP A 31 -4.810 -6.302 -6.168 1.00 53.04 N ATOM 524 CA ASP A 31 -3.419 -6.372 -6.654 1.00 73.14 C ATOM 525 C ASP A 31 -3.232 -5.415 -7.838 1.00 1.00 C ATOM 526 O ASP A 31 -4.088 -5.344 -8.732 1.00 42.05 O ATOM 527 CB ASP A 31 -3.070 -7.823 -7.106 1.00 13.33 C ATOM 528 CG ASP A 31 -3.081 -8.848 -5.960 1.00 12.13 C ATOM 529 OD1 ASP A 31 -4.179 -9.165 -5.443 1.00 65.11 O ATOM 530 OD2 ASP A 31 -2.003 -9.379 -5.599 1.00 41.53 O ATOM 0 H ASP A 31 -5.440 -6.935 -6.661 1.00 53.04 H new ATOM 0 HA ASP A 31 -2.755 -6.084 -5.839 1.00 73.14 H new ATOM 0 HB2 ASP A 31 -3.782 -8.137 -7.869 1.00 13.33 H new ATOM 0 HB3 ASP A 31 -2.084 -7.822 -7.571 1.00 13.33 H new ATOM 535 N VAL A 32 -2.119 -4.675 -7.828 1.00 23.21 N ATOM 536 CA VAL A 32 -1.684 -3.833 -8.949 1.00 51.22 C ATOM 537 C VAL A 32 -0.234 -4.220 -9.292 1.00 24.45 C ATOM 538 O VAL A 32 0.656 -4.103 -8.455 1.00 14.41 O ATOM 539 CB VAL A 32 -1.774 -2.291 -8.604 1.00 32.24 C ATOM 540 CG1 VAL A 32 -1.205 -1.434 -9.759 1.00 61.45 C ATOM 541 CG2 VAL A 32 -3.230 -1.869 -8.267 1.00 34.24 C ATOM 0 H VAL A 32 -1.485 -4.643 -7.030 1.00 23.21 H new ATOM 0 HA VAL A 32 -2.344 -4.000 -9.800 1.00 51.22 H new ATOM 0 HB VAL A 32 -1.166 -2.115 -7.717 1.00 32.24 H new ATOM 0 HG11 VAL A 32 -1.278 -0.378 -9.499 1.00 61.45 H new ATOM 0 HG12 VAL A 32 -0.160 -1.696 -9.925 1.00 61.45 H new ATOM 0 HG13 VAL A 32 -1.776 -1.624 -10.668 1.00 61.45 H new ATOM 0 HG21 VAL A 32 -3.256 -0.804 -8.035 1.00 34.24 H new ATOM 0 HG22 VAL A 32 -3.874 -2.070 -9.123 1.00 34.24 H new ATOM 0 HG23 VAL A 32 -3.583 -2.437 -7.406 1.00 34.24 H new ATOM 551 N ASN A 33 -0.017 -4.688 -10.528 1.00 3.23 N ATOM 552 CA ASN A 33 1.315 -5.104 -11.038 1.00 1.43 C ATOM 553 C ASN A 33 1.512 -4.540 -12.461 1.00 0.11 C ATOM 554 O ASN A 33 2.418 -4.952 -13.192 1.00 25.42 O ATOM 555 CB ASN A 33 1.431 -6.666 -11.036 1.00 5.03 C ATOM 556 CG ASN A 33 1.248 -7.304 -9.649 1.00 40.03 C ATOM 557 OD1 ASN A 33 2.211 -7.525 -8.919 1.00 1.43 O ATOM 558 ND2 ASN A 33 0.004 -7.600 -9.274 1.00 60.11 N ATOM 0 H ASN A 33 -0.763 -4.793 -11.216 1.00 3.23 H new ATOM 0 HA ASN A 33 2.096 -4.708 -10.389 1.00 1.43 H new ATOM 0 HB2 ASN A 33 0.684 -7.077 -11.715 1.00 5.03 H new ATOM 0 HB3 ASN A 33 2.408 -6.948 -11.429 1.00 5.03 H new ATOM 0 HD21 ASN A 33 -0.167 -8.021 -8.361 1.00 60.11 H new ATOM 0 HD22 ASN A 33 -0.777 -7.406 -9.900 1.00 60.11 H new ATOM 565 N ASP A 34 0.667 -3.560 -12.823 1.00 74.42 N ATOM 566 CA ASP A 34 0.596 -2.985 -14.175 1.00 40.00 C ATOM 567 C ASP A 34 0.094 -1.533 -14.072 1.00 35.43 C ATOM 568 O ASP A 34 -0.741 -1.220 -13.208 1.00 32.42 O ATOM 569 CB ASP A 34 -0.340 -3.855 -15.064 1.00 43.32 C ATOM 570 CG ASP A 34 -0.511 -3.333 -16.502 1.00 12.42 C ATOM 571 OD1 ASP A 34 0.325 -3.658 -17.370 1.00 31.54 O ATOM 572 OD2 ASP A 34 -1.476 -2.596 -16.764 1.00 20.13 O ATOM 0 H ASP A 34 0.003 -3.139 -12.173 1.00 74.42 H new ATOM 0 HA ASP A 34 1.582 -2.977 -14.640 1.00 40.00 H new ATOM 0 HB2 ASP A 34 0.055 -4.870 -15.103 1.00 43.32 H new ATOM 0 HB3 ASP A 34 -1.321 -3.912 -14.592 1.00 43.32 H new ATOM 577 N SER A 35 0.597 -0.661 -14.970 1.00 5.31 N ATOM 578 CA SER A 35 0.360 0.795 -14.923 1.00 51.44 C ATOM 579 C SER A 35 -1.088 1.172 -15.309 1.00 14.22 C ATOM 580 O SER A 35 -1.600 2.207 -14.869 1.00 52.25 O ATOM 581 CB SER A 35 1.388 1.512 -15.830 1.00 61.20 C ATOM 582 OG SER A 35 1.323 1.035 -17.156 1.00 31.04 O ATOM 0 H SER A 35 1.183 -0.950 -15.753 1.00 5.31 H new ATOM 0 HA SER A 35 0.493 1.126 -13.893 1.00 51.44 H new ATOM 0 HB2 SER A 35 1.200 2.586 -15.818 1.00 61.20 H new ATOM 0 HB3 SER A 35 2.393 1.360 -15.435 1.00 61.20 H new ATOM 0 HG SER A 35 1.982 1.507 -17.706 1.00 31.04 H new ATOM 588 N ASP A 36 -1.738 0.323 -16.113 1.00 42.05 N ATOM 589 CA ASP A 36 -3.124 0.550 -16.565 1.00 63.43 C ATOM 590 C ASP A 36 -4.124 0.068 -15.497 1.00 73.52 C ATOM 591 O ASP A 36 -5.209 0.638 -15.351 1.00 44.23 O ATOM 592 CB ASP A 36 -3.374 -0.155 -17.920 1.00 24.15 C ATOM 593 CG ASP A 36 -4.756 0.157 -18.509 1.00 44.22 C ATOM 594 OD1 ASP A 36 -4.945 1.287 -19.015 1.00 20.14 O ATOM 595 OD2 ASP A 36 -5.663 -0.699 -18.448 1.00 10.14 O ATOM 0 H ASP A 36 -1.324 -0.538 -16.470 1.00 42.05 H new ATOM 0 HA ASP A 36 -3.273 1.620 -16.709 1.00 63.43 H new ATOM 0 HB2 ASP A 36 -2.605 0.150 -18.630 1.00 24.15 H new ATOM 0 HB3 ASP A 36 -3.276 -1.232 -17.787 1.00 24.15 H new ATOM 600 N GLU A 37 -3.738 -0.974 -14.738 1.00 50.55 N ATOM 601 CA GLU A 37 -4.594 -1.538 -13.675 1.00 43.12 C ATOM 602 C GLU A 37 -4.876 -0.529 -12.546 1.00 21.42 C ATOM 603 O GLU A 37 -5.998 -0.475 -12.042 1.00 20.11 O ATOM 604 CB GLU A 37 -3.991 -2.847 -13.099 1.00 1.23 C ATOM 605 CG GLU A 37 -3.941 -4.010 -14.108 1.00 54.14 C ATOM 606 CD GLU A 37 -5.304 -4.307 -14.766 1.00 64.41 C ATOM 607 OE1 GLU A 37 -6.199 -4.858 -14.093 1.00 31.40 O ATOM 608 OE2 GLU A 37 -5.494 -3.990 -15.960 1.00 23.21 O ATOM 0 H GLU A 37 -2.838 -1.444 -14.840 1.00 50.55 H new ATOM 0 HA GLU A 37 -5.550 -1.774 -14.143 1.00 43.12 H new ATOM 0 HB2 GLU A 37 -2.981 -2.644 -12.744 1.00 1.23 H new ATOM 0 HB3 GLU A 37 -4.578 -3.155 -12.233 1.00 1.23 H new ATOM 0 HG2 GLU A 37 -3.214 -3.776 -14.885 1.00 54.14 H new ATOM 0 HG3 GLU A 37 -3.588 -4.907 -13.600 1.00 54.14 H new ATOM 615 N LEU A 38 -3.865 0.284 -12.178 1.00 55.43 N ATOM 616 CA LEU A 38 -3.985 1.228 -11.046 1.00 74.14 C ATOM 617 C LEU A 38 -5.024 2.331 -11.329 1.00 75.25 C ATOM 618 O LEU A 38 -5.803 2.684 -10.447 1.00 3.04 O ATOM 619 CB LEU A 38 -2.591 1.815 -10.669 1.00 25.45 C ATOM 620 CG LEU A 38 -1.897 2.833 -11.660 1.00 53.15 C ATOM 621 CD1 LEU A 38 -2.261 4.305 -11.351 1.00 34.42 C ATOM 622 CD2 LEU A 38 -0.367 2.663 -11.669 1.00 3.40 C ATOM 0 H LEU A 38 -2.959 0.307 -12.646 1.00 55.43 H new ATOM 0 HA LEU A 38 -4.353 0.674 -10.182 1.00 74.14 H new ATOM 0 HB2 LEU A 38 -2.693 2.312 -9.704 1.00 25.45 H new ATOM 0 HB3 LEU A 38 -1.908 0.977 -10.526 1.00 25.45 H new ATOM 0 HG LEU A 38 -2.283 2.595 -12.651 1.00 53.15 H new ATOM 0 HD11 LEU A 38 -1.758 4.961 -12.061 1.00 34.42 H new ATOM 0 HD12 LEU A 38 -3.340 4.438 -11.435 1.00 34.42 H new ATOM 0 HD13 LEU A 38 -1.943 4.554 -10.339 1.00 34.42 H new ATOM 0 HD21 LEU A 38 0.075 3.380 -12.362 1.00 3.40 H new ATOM 0 HD22 LEU A 38 0.024 2.838 -10.667 1.00 3.40 H new ATOM 0 HD23 LEU A 38 -0.115 1.651 -11.985 1.00 3.40 H new ATOM 634 N LYS A 39 -5.054 2.836 -12.583 1.00 43.12 N ATOM 635 CA LYS A 39 -5.943 3.962 -12.976 1.00 34.34 C ATOM 636 C LYS A 39 -7.402 3.481 -13.120 1.00 72.22 C ATOM 637 O LYS A 39 -8.343 4.276 -12.993 1.00 44.34 O ATOM 638 CB LYS A 39 -5.425 4.642 -14.273 1.00 55.24 C ATOM 639 CG LYS A 39 -5.474 3.758 -15.542 1.00 43.34 C ATOM 640 CD LYS A 39 -4.751 4.378 -16.765 1.00 23.24 C ATOM 641 CE LYS A 39 -3.248 4.573 -16.516 1.00 50.24 C ATOM 642 NZ LYS A 39 -2.535 5.120 -17.697 1.00 52.14 N ATOM 0 H LYS A 39 -4.473 2.483 -13.344 1.00 43.12 H new ATOM 0 HA LYS A 39 -5.926 4.713 -12.186 1.00 34.34 H new ATOM 0 HB2 LYS A 39 -6.013 5.542 -14.453 1.00 55.24 H new ATOM 0 HB3 LYS A 39 -4.396 4.961 -14.111 1.00 55.24 H new ATOM 0 HG2 LYS A 39 -5.024 2.791 -15.317 1.00 43.34 H new ATOM 0 HG3 LYS A 39 -6.516 3.572 -15.804 1.00 43.34 H new ATOM 0 HD2 LYS A 39 -4.893 3.734 -17.633 1.00 23.24 H new ATOM 0 HD3 LYS A 39 -5.205 5.340 -17.004 1.00 23.24 H new ATOM 0 HE2 LYS A 39 -3.109 5.246 -15.670 1.00 50.24 H new ATOM 0 HE3 LYS A 39 -2.803 3.617 -16.240 1.00 50.24 H new ATOM 0 HZ1 LYS A 39 -1.526 5.231 -17.472 1.00 52.14 H new ATOM 0 HZ2 LYS A 39 -2.641 4.467 -18.500 1.00 52.14 H new ATOM 0 HZ3 LYS A 39 -2.938 6.046 -17.948 1.00 52.14 H new ATOM 656 N LYS A 40 -7.564 2.168 -13.384 1.00 63.23 N ATOM 657 CA LYS A 40 -8.866 1.483 -13.322 1.00 42.43 C ATOM 658 C LYS A 40 -9.351 1.486 -11.862 1.00 73.44 C ATOM 659 O LYS A 40 -10.442 1.982 -11.567 1.00 34.32 O ATOM 660 CB LYS A 40 -8.734 0.026 -13.861 1.00 55.14 C ATOM 661 CG LYS A 40 -8.398 -0.070 -15.372 1.00 72.21 C ATOM 662 CD LYS A 40 -7.944 -1.488 -15.812 1.00 63.42 C ATOM 663 CE LYS A 40 -8.998 -2.581 -15.570 1.00 3.52 C ATOM 664 NZ LYS A 40 -8.496 -3.923 -15.979 1.00 73.22 N ATOM 0 H LYS A 40 -6.793 1.554 -13.646 1.00 63.23 H new ATOM 0 HA LYS A 40 -9.593 2.003 -13.946 1.00 42.43 H new ATOM 0 HB2 LYS A 40 -7.958 -0.489 -13.295 1.00 55.14 H new ATOM 0 HB3 LYS A 40 -9.668 -0.503 -13.675 1.00 55.14 H new ATOM 0 HG2 LYS A 40 -9.275 0.219 -15.951 1.00 72.21 H new ATOM 0 HG3 LYS A 40 -7.610 0.646 -15.608 1.00 72.21 H new ATOM 0 HD2 LYS A 40 -7.694 -1.466 -16.873 1.00 63.42 H new ATOM 0 HD3 LYS A 40 -7.032 -1.750 -15.275 1.00 63.42 H new ATOM 0 HE2 LYS A 40 -9.269 -2.599 -14.514 1.00 3.52 H new ATOM 0 HE3 LYS A 40 -9.904 -2.344 -16.128 1.00 3.52 H new ATOM 0 HZ1 LYS A 40 -8.929 -4.195 -16.884 1.00 73.22 H new ATOM 0 HZ2 LYS A 40 -7.462 -3.889 -16.086 1.00 73.22 H new ATOM 0 HZ3 LYS A 40 -8.746 -4.623 -15.252 1.00 73.22 H new ATOM 678 N GLU A 41 -8.472 1.002 -10.953 1.00 2.05 N ATOM 679 CA GLU A 41 -8.783 0.860 -9.522 1.00 35.31 C ATOM 680 C GLU A 41 -9.189 2.192 -8.885 1.00 72.24 C ATOM 681 O GLU A 41 -10.184 2.239 -8.170 1.00 55.51 O ATOM 682 CB GLU A 41 -7.592 0.220 -8.748 1.00 21.33 C ATOM 683 CG GLU A 41 -7.265 -1.220 -9.186 1.00 31.42 C ATOM 684 CD GLU A 41 -8.505 -2.136 -9.204 1.00 22.54 C ATOM 685 OE1 GLU A 41 -9.014 -2.474 -8.118 1.00 74.12 O ATOM 686 OE2 GLU A 41 -8.991 -2.502 -10.304 1.00 60.33 O ATOM 0 H GLU A 41 -7.529 0.701 -11.197 1.00 2.05 H new ATOM 0 HA GLU A 41 -9.640 0.190 -9.450 1.00 35.31 H new ATOM 0 HB2 GLU A 41 -6.707 0.841 -8.885 1.00 21.33 H new ATOM 0 HB3 GLU A 41 -7.821 0.222 -7.682 1.00 21.33 H new ATOM 0 HG2 GLU A 41 -6.820 -1.200 -10.181 1.00 31.42 H new ATOM 0 HG3 GLU A 41 -6.519 -1.640 -8.511 1.00 31.42 H new ATOM 693 N MET A 42 -8.448 3.276 -9.203 1.00 32.21 N ATOM 694 CA MET A 42 -8.704 4.629 -8.639 1.00 63.11 C ATOM 695 C MET A 42 -10.161 5.088 -8.883 1.00 50.30 C ATOM 696 O MET A 42 -10.769 5.747 -8.025 1.00 5.43 O ATOM 697 CB MET A 42 -7.727 5.678 -9.231 1.00 51.23 C ATOM 698 CG MET A 42 -6.229 5.462 -8.946 1.00 53.24 C ATOM 699 SD MET A 42 -5.776 5.493 -7.188 1.00 73.45 S ATOM 700 CE MET A 42 -5.870 3.761 -6.714 1.00 2.34 C ATOM 0 H MET A 42 -7.661 3.244 -9.852 1.00 32.21 H new ATOM 0 HA MET A 42 -8.540 4.554 -7.564 1.00 63.11 H new ATOM 0 HB2 MET A 42 -7.868 5.704 -10.312 1.00 51.23 H new ATOM 0 HB3 MET A 42 -8.009 6.659 -8.849 1.00 51.23 H new ATOM 0 HG2 MET A 42 -5.928 4.503 -9.367 1.00 53.24 H new ATOM 0 HG3 MET A 42 -5.660 6.232 -9.467 1.00 53.24 H new ATOM 0 HE1 MET A 42 -5.683 3.666 -5.644 1.00 2.34 H new ATOM 0 HE2 MET A 42 -6.862 3.374 -6.945 1.00 2.34 H new ATOM 0 HE3 MET A 42 -5.121 3.192 -7.265 1.00 2.34 H new ATOM 710 N LYS A 43 -10.709 4.702 -10.051 1.00 15.22 N ATOM 711 CA LYS A 43 -12.085 5.044 -10.450 1.00 15.34 C ATOM 712 C LYS A 43 -13.089 4.178 -9.687 1.00 11.33 C ATOM 713 O LYS A 43 -14.081 4.697 -9.198 1.00 45.24 O ATOM 714 CB LYS A 43 -12.260 4.890 -11.980 1.00 64.02 C ATOM 715 CG LYS A 43 -11.350 5.837 -12.790 1.00 73.41 C ATOM 716 CD LYS A 43 -11.503 5.667 -14.316 1.00 4.54 C ATOM 717 CE LYS A 43 -10.555 6.585 -15.100 1.00 3.23 C ATOM 718 NZ LYS A 43 -9.133 6.313 -14.768 1.00 30.10 N ATOM 0 H LYS A 43 -10.209 4.144 -10.744 1.00 15.22 H new ATOM 0 HA LYS A 43 -12.276 6.087 -10.196 1.00 15.34 H new ATOM 0 HB2 LYS A 43 -12.046 3.859 -12.263 1.00 64.02 H new ATOM 0 HB3 LYS A 43 -13.300 5.083 -12.242 1.00 64.02 H new ATOM 0 HG2 LYS A 43 -11.578 6.868 -12.521 1.00 73.41 H new ATOM 0 HG3 LYS A 43 -10.311 5.658 -12.513 1.00 73.41 H new ATOM 0 HD2 LYS A 43 -11.307 4.629 -14.586 1.00 4.54 H new ATOM 0 HD3 LYS A 43 -12.533 5.881 -14.602 1.00 4.54 H new ATOM 0 HE2 LYS A 43 -10.713 6.445 -16.169 1.00 3.23 H new ATOM 0 HE3 LYS A 43 -10.789 7.626 -14.877 1.00 3.23 H new ATOM 0 HZ1 LYS A 43 -8.750 7.103 -14.210 1.00 30.10 H new ATOM 0 HZ2 LYS A 43 -9.068 5.435 -14.215 1.00 30.10 H new ATOM 0 HZ3 LYS A 43 -8.585 6.211 -15.646 1.00 30.10 H new ATOM 732 N LYS A 44 -12.785 2.866 -9.547 1.00 43.44 N ATOM 733 CA LYS A 44 -13.646 1.904 -8.810 1.00 23.15 C ATOM 734 C LYS A 44 -13.852 2.374 -7.350 1.00 24.12 C ATOM 735 O LYS A 44 -14.964 2.297 -6.810 1.00 73.43 O ATOM 736 CB LYS A 44 -13.044 0.451 -8.852 1.00 21.20 C ATOM 737 CG LYS A 44 -13.490 -0.472 -10.038 1.00 64.10 C ATOM 738 CD LYS A 44 -12.827 -0.182 -11.420 1.00 33.31 C ATOM 739 CE LYS A 44 -13.395 1.043 -12.168 1.00 11.24 C ATOM 740 NZ LYS A 44 -14.851 0.939 -12.420 1.00 10.44 N ATOM 0 H LYS A 44 -11.942 2.444 -9.938 1.00 43.44 H new ATOM 0 HA LYS A 44 -14.617 1.872 -9.303 1.00 23.15 H new ATOM 0 HB2 LYS A 44 -11.958 0.535 -8.879 1.00 21.20 H new ATOM 0 HB3 LYS A 44 -13.302 -0.049 -7.918 1.00 21.20 H new ATOM 0 HG2 LYS A 44 -13.278 -1.506 -9.766 1.00 64.10 H new ATOM 0 HG3 LYS A 44 -14.571 -0.387 -10.151 1.00 64.10 H new ATOM 0 HD2 LYS A 44 -11.758 -0.034 -11.270 1.00 33.31 H new ATOM 0 HD3 LYS A 44 -12.941 -1.062 -12.053 1.00 33.31 H new ATOM 0 HE2 LYS A 44 -13.195 1.943 -11.586 1.00 11.24 H new ATOM 0 HE3 LYS A 44 -12.874 1.156 -13.119 1.00 11.24 H new ATOM 0 HZ1 LYS A 44 -15.032 1.004 -13.442 1.00 10.44 H new ATOM 0 HZ2 LYS A 44 -15.201 0.027 -12.064 1.00 10.44 H new ATOM 0 HZ3 LYS A 44 -15.344 1.713 -11.931 1.00 10.44 H new ATOM 754 N LEU A 45 -12.755 2.874 -6.750 1.00 73.20 N ATOM 755 CA LEU A 45 -12.727 3.401 -5.369 1.00 50.20 C ATOM 756 C LEU A 45 -13.598 4.663 -5.241 1.00 55.40 C ATOM 757 O LEU A 45 -14.299 4.845 -4.243 1.00 62.31 O ATOM 758 CB LEU A 45 -11.257 3.713 -4.963 1.00 51.02 C ATOM 759 CG LEU A 45 -10.257 2.525 -5.108 1.00 11.23 C ATOM 760 CD1 LEU A 45 -8.813 2.958 -4.804 1.00 32.31 C ATOM 761 CD2 LEU A 45 -10.683 1.314 -4.262 1.00 22.23 C ATOM 0 H LEU A 45 -11.849 2.925 -7.216 1.00 73.20 H new ATOM 0 HA LEU A 45 -13.136 2.646 -4.698 1.00 50.20 H new ATOM 0 HB2 LEU A 45 -10.899 4.544 -5.571 1.00 51.02 H new ATOM 0 HB3 LEU A 45 -11.248 4.049 -3.926 1.00 51.02 H new ATOM 0 HG LEU A 45 -10.283 2.208 -6.151 1.00 11.23 H new ATOM 0 HD11 LEU A 45 -8.146 2.103 -4.916 1.00 32.31 H new ATOM 0 HD12 LEU A 45 -8.515 3.744 -5.498 1.00 32.31 H new ATOM 0 HD13 LEU A 45 -8.753 3.334 -3.783 1.00 32.31 H new ATOM 0 HD21 LEU A 45 -9.961 0.508 -4.391 1.00 22.23 H new ATOM 0 HD22 LEU A 45 -10.724 1.601 -3.211 1.00 22.23 H new ATOM 0 HD23 LEU A 45 -11.667 0.974 -4.584 1.00 22.23 H new ATOM 773 N ALA A 46 -13.532 5.520 -6.272 1.00 23.53 N ATOM 774 CA ALA A 46 -14.271 6.793 -6.320 1.00 14.10 C ATOM 775 C ALA A 46 -15.781 6.555 -6.520 1.00 73.45 C ATOM 776 O ALA A 46 -16.615 7.224 -5.898 1.00 54.12 O ATOM 777 CB ALA A 46 -13.706 7.688 -7.440 1.00 40.10 C ATOM 0 H ALA A 46 -12.962 5.349 -7.100 1.00 23.53 H new ATOM 0 HA ALA A 46 -14.142 7.301 -5.364 1.00 14.10 H new ATOM 0 HB1 ALA A 46 -14.258 8.627 -7.469 1.00 40.10 H new ATOM 0 HB2 ALA A 46 -12.653 7.892 -7.246 1.00 40.10 H new ATOM 0 HB3 ALA A 46 -13.807 7.179 -8.398 1.00 40.10 H new ATOM 783 N GLU A 47 -16.111 5.576 -7.380 1.00 44.04 N ATOM 784 CA GLU A 47 -17.503 5.255 -7.759 1.00 11.22 C ATOM 785 C GLU A 47 -18.249 4.556 -6.611 1.00 15.23 C ATOM 786 O GLU A 47 -19.446 4.779 -6.415 1.00 1.55 O ATOM 787 CB GLU A 47 -17.514 4.377 -9.042 1.00 11.22 C ATOM 788 CG GLU A 47 -16.976 5.095 -10.305 1.00 73.42 C ATOM 789 CD GLU A 47 -16.845 4.167 -11.526 1.00 64.55 C ATOM 790 OE1 GLU A 47 -15.780 3.538 -11.700 1.00 24.23 O ATOM 791 OE2 GLU A 47 -17.813 4.051 -12.310 1.00 73.41 O ATOM 0 H GLU A 47 -15.419 4.981 -7.835 1.00 44.04 H new ATOM 0 HA GLU A 47 -18.026 6.189 -7.966 1.00 11.22 H new ATOM 0 HB2 GLU A 47 -16.916 3.483 -8.863 1.00 11.22 H new ATOM 0 HB3 GLU A 47 -18.534 4.045 -9.233 1.00 11.22 H new ATOM 0 HG2 GLU A 47 -17.641 5.921 -10.555 1.00 73.42 H new ATOM 0 HG3 GLU A 47 -16.001 5.528 -10.080 1.00 73.42 H new ATOM 798 N GLU A 48 -17.534 3.719 -5.855 1.00 73.04 N ATOM 799 CA GLU A 48 -18.102 2.967 -4.724 1.00 3.21 C ATOM 800 C GLU A 48 -17.636 3.594 -3.393 1.00 44.50 C ATOM 801 O GLU A 48 -16.454 3.521 -3.054 1.00 20.31 O ATOM 802 CB GLU A 48 -17.673 1.480 -4.834 1.00 43.41 C ATOM 803 CG GLU A 48 -18.104 0.770 -6.130 1.00 34.02 C ATOM 804 CD GLU A 48 -19.634 0.667 -6.294 1.00 52.53 C ATOM 805 OE1 GLU A 48 -20.250 -0.221 -5.667 1.00 43.12 O ATOM 806 OE2 GLU A 48 -20.231 1.476 -7.039 1.00 51.30 O ATOM 0 H GLU A 48 -16.541 3.541 -6.007 1.00 73.04 H new ATOM 0 HA GLU A 48 -19.191 3.014 -4.750 1.00 3.21 H new ATOM 0 HB2 GLU A 48 -16.588 1.424 -4.751 1.00 43.41 H new ATOM 0 HB3 GLU A 48 -18.086 0.935 -3.985 1.00 43.41 H new ATOM 0 HG2 GLU A 48 -17.690 1.306 -6.984 1.00 34.02 H new ATOM 0 HG3 GLU A 48 -17.676 -0.232 -6.145 1.00 34.02 H new ATOM 813 N LYS A 49 -18.579 4.210 -2.642 1.00 51.12 N ATOM 814 CA LYS A 49 -18.266 4.976 -1.414 1.00 52.40 C ATOM 815 C LYS A 49 -18.483 4.099 -0.171 1.00 63.52 C ATOM 816 O LYS A 49 -17.522 3.720 0.518 1.00 22.05 O ATOM 817 CB LYS A 49 -19.164 6.258 -1.279 1.00 14.13 C ATOM 818 CG LYS A 49 -19.123 7.265 -2.457 1.00 21.21 C ATOM 819 CD LYS A 49 -19.921 6.797 -3.698 1.00 64.51 C ATOM 820 CE LYS A 49 -19.911 7.827 -4.833 1.00 22.44 C ATOM 821 NZ LYS A 49 -20.698 7.362 -6.003 1.00 25.23 N ATOM 0 H LYS A 49 -19.573 4.190 -2.869 1.00 51.12 H new ATOM 0 HA LYS A 49 -17.223 5.283 -1.488 1.00 52.40 H new ATOM 0 HB2 LYS A 49 -20.197 5.937 -1.142 1.00 14.13 H new ATOM 0 HB3 LYS A 49 -18.871 6.785 -0.371 1.00 14.13 H new ATOM 0 HG2 LYS A 49 -19.520 8.223 -2.120 1.00 21.21 H new ATOM 0 HG3 LYS A 49 -18.085 7.433 -2.745 1.00 21.21 H new ATOM 0 HD2 LYS A 49 -19.502 5.859 -4.061 1.00 64.51 H new ATOM 0 HD3 LYS A 49 -20.952 6.594 -3.406 1.00 64.51 H new ATOM 0 HE2 LYS A 49 -20.319 8.771 -4.472 1.00 22.44 H new ATOM 0 HE3 LYS A 49 -18.883 8.021 -5.140 1.00 22.44 H new ATOM 0 HZ1 LYS A 49 -20.586 8.036 -6.787 1.00 25.23 H new ATOM 0 HZ2 LYS A 49 -20.358 6.425 -6.300 1.00 25.23 H new ATOM 0 HZ3 LYS A 49 -21.703 7.299 -5.742 1.00 25.23 H new ATOM 835 N ASN A 50 -19.766 3.747 0.068 1.00 35.03 N ATOM 836 CA ASN A 50 -20.208 3.075 1.298 1.00 64.31 C ATOM 837 C ASN A 50 -19.950 1.560 1.218 1.00 64.20 C ATOM 838 O ASN A 50 -20.811 0.780 0.802 1.00 40.02 O ATOM 839 CB ASN A 50 -21.705 3.382 1.602 1.00 45.42 C ATOM 840 CG ASN A 50 -22.193 2.775 2.931 1.00 65.34 C ATOM 841 OD1 ASN A 50 -21.421 2.609 3.880 1.00 50.00 O ATOM 842 ND2 ASN A 50 -23.474 2.449 3.011 1.00 60.32 N ATOM 0 H ASN A 50 -20.522 3.924 -0.593 1.00 35.03 H new ATOM 0 HA ASN A 50 -19.620 3.469 2.127 1.00 64.31 H new ATOM 0 HB2 ASN A 50 -21.849 4.462 1.629 1.00 45.42 H new ATOM 0 HB3 ASN A 50 -22.320 2.999 0.788 1.00 45.42 H new ATOM 0 HD21 ASN A 50 -23.846 2.050 3.873 1.00 60.32 H new ATOM 0 HD22 ASN A 50 -24.089 2.597 2.211 1.00 60.32 H new ATOM 849 N PHE A 51 -18.713 1.199 1.541 1.00 45.14 N ATOM 850 CA PHE A 51 -18.282 -0.174 1.819 1.00 54.12 C ATOM 851 C PHE A 51 -16.883 -0.103 2.453 1.00 72.02 C ATOM 852 O PHE A 51 -16.338 1.000 2.652 1.00 53.35 O ATOM 853 CB PHE A 51 -18.325 -1.101 0.549 1.00 4.32 C ATOM 854 CG PHE A 51 -17.208 -0.921 -0.478 1.00 53.11 C ATOM 855 CD1 PHE A 51 -17.009 0.297 -1.116 1.00 42.33 C ATOM 856 CD2 PHE A 51 -16.375 -1.993 -0.826 1.00 60.13 C ATOM 857 CE1 PHE A 51 -16.016 0.440 -2.058 1.00 75.33 C ATOM 858 CE2 PHE A 51 -15.383 -1.841 -1.769 1.00 24.02 C ATOM 859 CZ PHE A 51 -15.206 -0.622 -2.385 1.00 65.03 C ATOM 0 H PHE A 51 -17.953 1.875 1.620 1.00 45.14 H new ATOM 0 HA PHE A 51 -18.981 -0.641 2.513 1.00 54.12 H new ATOM 0 HB2 PHE A 51 -18.312 -2.138 0.885 1.00 4.32 H new ATOM 0 HB3 PHE A 51 -19.278 -0.941 0.045 1.00 4.32 H new ATOM 0 HD1 PHE A 51 -17.639 1.139 -0.871 1.00 42.33 H new ATOM 0 HD2 PHE A 51 -16.513 -2.952 -0.348 1.00 60.13 H new ATOM 0 HE1 PHE A 51 -15.872 1.394 -2.544 1.00 75.33 H new ATOM 0 HE2 PHE A 51 -14.746 -2.675 -2.025 1.00 24.02 H new ATOM 0 HZ PHE A 51 -14.430 -0.500 -3.126 1.00 65.03 H new ATOM 869 N GLU A 52 -16.311 -1.271 2.750 1.00 23.21 N ATOM 870 CA GLU A 52 -15.025 -1.414 3.446 1.00 75.12 C ATOM 871 C GLU A 52 -13.877 -0.635 2.754 1.00 33.55 C ATOM 872 O GLU A 52 -13.916 -0.402 1.539 1.00 63.11 O ATOM 873 CB GLU A 52 -14.679 -2.922 3.535 1.00 64.53 C ATOM 874 CG GLU A 52 -13.460 -3.254 4.405 1.00 24.05 C ATOM 875 CD GLU A 52 -13.645 -2.892 5.883 1.00 43.40 C ATOM 876 OE1 GLU A 52 -14.271 -3.677 6.626 1.00 40.35 O ATOM 877 OE2 GLU A 52 -13.194 -1.814 6.305 1.00 14.23 O ATOM 0 H GLU A 52 -16.736 -2.166 2.509 1.00 23.21 H new ATOM 0 HA GLU A 52 -15.127 -0.983 4.442 1.00 75.12 H new ATOM 0 HB2 GLU A 52 -15.544 -3.456 3.928 1.00 64.53 H new ATOM 0 HB3 GLU A 52 -14.502 -3.299 2.528 1.00 64.53 H new ATOM 0 HG2 GLU A 52 -13.246 -4.320 4.324 1.00 24.05 H new ATOM 0 HG3 GLU A 52 -12.591 -2.724 4.016 1.00 24.05 H new ATOM 884 N LYS A 53 -12.885 -0.209 3.561 1.00 4.10 N ATOM 885 CA LYS A 53 -11.661 0.444 3.064 1.00 22.41 C ATOM 886 C LYS A 53 -10.711 -0.593 2.432 1.00 30.24 C ATOM 887 O LYS A 53 -10.657 -1.754 2.856 1.00 43.42 O ATOM 888 CB LYS A 53 -10.953 1.274 4.182 1.00 4.11 C ATOM 889 CG LYS A 53 -10.832 0.605 5.586 1.00 32.24 C ATOM 890 CD LYS A 53 -11.736 1.269 6.660 1.00 44.52 C ATOM 891 CE LYS A 53 -11.620 0.595 8.028 1.00 42.13 C ATOM 892 NZ LYS A 53 -12.494 1.216 9.053 1.00 24.32 N ATOM 0 H LYS A 53 -12.911 -0.309 4.576 1.00 4.10 H new ATOM 0 HA LYS A 53 -11.950 1.151 2.286 1.00 22.41 H new ATOM 0 HB2 LYS A 53 -9.949 1.522 3.837 1.00 4.11 H new ATOM 0 HB3 LYS A 53 -11.491 2.214 4.299 1.00 4.11 H new ATOM 0 HG2 LYS A 53 -11.093 -0.450 5.502 1.00 32.24 H new ATOM 0 HG3 LYS A 53 -9.794 0.651 5.915 1.00 32.24 H new ATOM 0 HD2 LYS A 53 -11.468 2.321 6.754 1.00 44.52 H new ATOM 0 HD3 LYS A 53 -12.774 1.233 6.328 1.00 44.52 H new ATOM 0 HE2 LYS A 53 -11.876 -0.460 7.931 1.00 42.13 H new ATOM 0 HE3 LYS A 53 -10.584 0.642 8.364 1.00 42.13 H new ATOM 0 HZ1 LYS A 53 -12.374 0.719 9.959 1.00 24.32 H new ATOM 0 HZ2 LYS A 53 -12.235 2.216 9.170 1.00 24.32 H new ATOM 0 HZ3 LYS A 53 -13.487 1.148 8.750 1.00 24.32 H new ATOM 906 N ILE A 54 -9.970 -0.147 1.399 1.00 42.21 N ATOM 907 CA ILE A 54 -9.236 -1.037 0.474 1.00 42.02 C ATOM 908 C ILE A 54 -7.731 -1.062 0.811 1.00 40.21 C ATOM 909 O ILE A 54 -7.141 -0.053 1.223 1.00 50.42 O ATOM 910 CB ILE A 54 -9.466 -0.610 -1.047 1.00 40.11 C ATOM 911 CG1 ILE A 54 -10.904 -0.973 -1.560 1.00 55.02 C ATOM 912 CG2 ILE A 54 -8.402 -1.199 -2.010 1.00 20.01 C ATOM 913 CD1 ILE A 54 -12.038 -0.203 -0.931 1.00 52.24 C ATOM 0 H ILE A 54 -9.862 0.844 1.181 1.00 42.21 H new ATOM 0 HA ILE A 54 -9.632 -2.044 0.602 1.00 42.02 H new ATOM 0 HB ILE A 54 -9.359 0.475 -1.053 1.00 40.11 H new ATOM 0 HG12 ILE A 54 -10.936 -0.814 -2.638 1.00 55.02 H new ATOM 0 HG13 ILE A 54 -11.073 -2.036 -1.389 1.00 55.02 H new ATOM 0 HG21 ILE A 54 -8.613 -0.873 -3.028 1.00 20.01 H new ATOM 0 HG22 ILE A 54 -7.412 -0.851 -1.715 1.00 20.01 H new ATOM 0 HG23 ILE A 54 -8.433 -2.288 -1.964 1.00 20.01 H new ATOM 0 HD11 ILE A 54 -12.984 -0.534 -1.359 1.00 52.24 H new ATOM 0 HD12 ILE A 54 -12.045 -0.379 0.145 1.00 52.24 H new ATOM 0 HD13 ILE A 54 -11.906 0.862 -1.123 1.00 52.24 H new ATOM 925 N LEU A 55 -7.138 -2.248 0.631 1.00 12.50 N ATOM 926 CA LEU A 55 -5.709 -2.490 0.755 1.00 13.33 C ATOM 927 C LEU A 55 -5.165 -2.863 -0.640 1.00 42.33 C ATOM 928 O LEU A 55 -5.596 -3.863 -1.234 1.00 52.52 O ATOM 929 CB LEU A 55 -5.480 -3.604 1.815 1.00 34.24 C ATOM 930 CG LEU A 55 -3.979 -3.952 2.158 1.00 44.05 C ATOM 931 CD1 LEU A 55 -3.765 -4.153 3.680 1.00 65.20 C ATOM 932 CD2 LEU A 55 -3.473 -5.179 1.362 1.00 60.43 C ATOM 0 H LEU A 55 -7.663 -3.088 0.387 1.00 12.50 H new ATOM 0 HA LEU A 55 -5.171 -1.606 1.098 1.00 13.33 H new ATOM 0 HB2 LEU A 55 -5.980 -3.306 2.736 1.00 34.24 H new ATOM 0 HB3 LEU A 55 -5.970 -4.513 1.466 1.00 34.24 H new ATOM 0 HG LEU A 55 -3.384 -3.092 1.851 1.00 44.05 H new ATOM 0 HD11 LEU A 55 -2.719 -4.391 3.872 1.00 65.20 H new ATOM 0 HD12 LEU A 55 -4.032 -3.238 4.209 1.00 65.20 H new ATOM 0 HD13 LEU A 55 -4.393 -4.972 4.031 1.00 65.20 H new ATOM 0 HD21 LEU A 55 -2.436 -5.383 1.629 1.00 60.43 H new ATOM 0 HD22 LEU A 55 -4.087 -6.047 1.602 1.00 60.43 H new ATOM 0 HD23 LEU A 55 -3.539 -4.972 0.294 1.00 60.43 H new ATOM 944 N ILE A 56 -4.269 -2.015 -1.171 1.00 41.44 N ATOM 945 CA ILE A 56 -3.611 -2.213 -2.477 1.00 32.45 C ATOM 946 C ILE A 56 -2.224 -2.824 -2.228 1.00 24.20 C ATOM 947 O ILE A 56 -1.487 -2.323 -1.383 1.00 15.24 O ATOM 948 CB ILE A 56 -3.447 -0.833 -3.250 1.00 14.52 C ATOM 949 CG1 ILE A 56 -4.836 -0.168 -3.558 1.00 45.21 C ATOM 950 CG2 ILE A 56 -2.608 -0.984 -4.554 1.00 44.05 C ATOM 951 CD1 ILE A 56 -5.696 -0.900 -4.588 1.00 24.35 C ATOM 0 H ILE A 56 -3.976 -1.159 -0.700 1.00 41.44 H new ATOM 0 HA ILE A 56 -4.224 -2.874 -3.090 1.00 32.45 H new ATOM 0 HB ILE A 56 -2.898 -0.171 -2.581 1.00 14.52 H new ATOM 0 HG12 ILE A 56 -5.398 -0.092 -2.627 1.00 45.21 H new ATOM 0 HG13 ILE A 56 -4.663 0.849 -3.910 1.00 45.21 H new ATOM 0 HG21 ILE A 56 -2.524 -0.015 -5.047 1.00 44.05 H new ATOM 0 HG22 ILE A 56 -1.613 -1.353 -4.306 1.00 44.05 H new ATOM 0 HG23 ILE A 56 -3.100 -1.690 -5.223 1.00 44.05 H new ATOM 0 HD11 ILE A 56 -6.633 -0.361 -4.729 1.00 24.35 H new ATOM 0 HD12 ILE A 56 -5.161 -0.953 -5.536 1.00 24.35 H new ATOM 0 HD13 ILE A 56 -5.908 -1.909 -4.234 1.00 24.35 H new ATOM 963 N ILE A 57 -1.890 -3.920 -2.929 1.00 61.02 N ATOM 964 CA ILE A 57 -0.516 -4.478 -2.940 1.00 21.02 C ATOM 965 C ILE A 57 0.105 -4.228 -4.329 1.00 22.31 C ATOM 966 O ILE A 57 -0.586 -4.338 -5.346 1.00 63.42 O ATOM 967 CB ILE A 57 -0.486 -6.026 -2.606 1.00 1.33 C ATOM 968 CG1 ILE A 57 -1.184 -6.311 -1.236 1.00 24.11 C ATOM 969 CG2 ILE A 57 0.974 -6.576 -2.606 1.00 33.32 C ATOM 970 CD1 ILE A 57 -1.239 -7.778 -0.825 1.00 1.22 C ATOM 0 H ILE A 57 -2.553 -4.444 -3.500 1.00 61.02 H new ATOM 0 HA ILE A 57 0.060 -3.977 -2.162 1.00 21.02 H new ATOM 0 HB ILE A 57 -1.039 -6.546 -3.388 1.00 1.33 H new ATOM 0 HG12 ILE A 57 -0.663 -5.752 -0.458 1.00 24.11 H new ATOM 0 HG13 ILE A 57 -2.202 -5.924 -1.278 1.00 24.11 H new ATOM 0 HG21 ILE A 57 0.962 -7.641 -2.374 1.00 33.32 H new ATOM 0 HG22 ILE A 57 1.420 -6.424 -3.589 1.00 33.32 H new ATOM 0 HG23 ILE A 57 1.562 -6.048 -1.855 1.00 33.32 H new ATOM 0 HD11 ILE A 57 -1.742 -7.867 0.138 1.00 1.22 H new ATOM 0 HD12 ILE A 57 -1.789 -8.346 -1.576 1.00 1.22 H new ATOM 0 HD13 ILE A 57 -0.226 -8.171 -0.743 1.00 1.22 H new ATOM 982 N SER A 58 1.393 -3.855 -4.351 1.00 72.11 N ATOM 983 CA SER A 58 2.177 -3.690 -5.579 1.00 42.21 C ATOM 984 C SER A 58 3.654 -4.013 -5.297 1.00 41.31 C ATOM 985 O SER A 58 4.088 -4.060 -4.138 1.00 13.11 O ATOM 986 CB SER A 58 2.015 -2.255 -6.144 1.00 20.23 C ATOM 987 OG SER A 58 2.687 -2.097 -7.387 1.00 60.42 O ATOM 0 H SER A 58 1.925 -3.657 -3.503 1.00 72.11 H new ATOM 0 HA SER A 58 1.807 -4.384 -6.334 1.00 42.21 H new ATOM 0 HB2 SER A 58 0.956 -2.033 -6.273 1.00 20.23 H new ATOM 0 HB3 SER A 58 2.407 -1.535 -5.425 1.00 20.23 H new ATOM 0 HG SER A 58 2.313 -2.722 -8.043 1.00 60.42 H new ATOM 993 N ASN A 59 4.410 -4.235 -6.374 1.00 32.42 N ATOM 994 CA ASN A 59 5.846 -4.581 -6.324 1.00 22.34 C ATOM 995 C ASN A 59 6.701 -3.450 -6.931 1.00 12.54 C ATOM 996 O ASN A 59 7.920 -3.413 -6.732 1.00 33.24 O ATOM 997 CB ASN A 59 6.079 -5.931 -7.065 1.00 44.34 C ATOM 998 CG ASN A 59 5.476 -5.991 -8.486 1.00 32.13 C ATOM 999 OD1 ASN A 59 5.409 -4.997 -9.213 1.00 2.23 O ATOM 1000 ND2 ASN A 59 5.003 -7.159 -8.877 1.00 73.15 N ATOM 0 H ASN A 59 4.043 -4.180 -7.324 1.00 32.42 H new ATOM 0 HA ASN A 59 6.154 -4.697 -5.285 1.00 22.34 H new ATOM 0 HB2 ASN A 59 7.151 -6.115 -7.130 1.00 44.34 H new ATOM 0 HB3 ASN A 59 5.653 -6.737 -6.468 1.00 44.34 H new ATOM 0 HD21 ASN A 59 4.572 -7.253 -9.797 1.00 73.15 H new ATOM 0 HD22 ASN A 59 5.069 -7.968 -8.260 1.00 73.15 H new ATOM 1007 N ASP A 60 6.039 -2.518 -7.644 1.00 34.43 N ATOM 1008 CA ASP A 60 6.699 -1.456 -8.424 1.00 54.32 C ATOM 1009 C ASP A 60 6.392 -0.077 -7.804 1.00 2.40 C ATOM 1010 O ASP A 60 5.231 0.244 -7.518 1.00 45.31 O ATOM 1011 CB ASP A 60 6.220 -1.527 -9.898 1.00 14.30 C ATOM 1012 CG ASP A 60 6.905 -0.497 -10.818 1.00 71.33 C ATOM 1013 OD1 ASP A 60 8.002 -0.780 -11.344 1.00 42.14 O ATOM 1014 OD2 ASP A 60 6.357 0.607 -11.008 1.00 10.45 O ATOM 0 H ASP A 60 5.021 -2.482 -7.694 1.00 34.43 H new ATOM 0 HA ASP A 60 7.779 -1.600 -8.403 1.00 54.32 H new ATOM 0 HB2 ASP A 60 6.407 -2.529 -10.285 1.00 14.30 H new ATOM 0 HB3 ASP A 60 5.142 -1.370 -9.929 1.00 14.30 H new ATOM 1019 N LYS A 61 7.451 0.735 -7.640 1.00 50.42 N ATOM 1020 CA LYS A 61 7.400 2.045 -6.961 1.00 21.32 C ATOM 1021 C LYS A 61 6.742 3.128 -7.826 1.00 13.51 C ATOM 1022 O LYS A 61 6.102 4.033 -7.290 1.00 45.01 O ATOM 1023 CB LYS A 61 8.826 2.500 -6.601 1.00 11.21 C ATOM 1024 CG LYS A 61 9.604 1.528 -5.698 1.00 61.11 C ATOM 1025 CD LYS A 61 11.062 1.987 -5.523 1.00 43.44 C ATOM 1026 CE LYS A 61 11.910 1.004 -4.721 1.00 62.02 C ATOM 1027 NZ LYS A 61 13.331 1.423 -4.710 1.00 3.34 N ATOM 0 H LYS A 61 8.383 0.497 -7.981 1.00 50.42 H new ATOM 0 HA LYS A 61 6.795 1.915 -6.063 1.00 21.32 H new ATOM 0 HB2 LYS A 61 9.389 2.647 -7.523 1.00 11.21 H new ATOM 0 HB3 LYS A 61 8.769 3.469 -6.104 1.00 11.21 H new ATOM 0 HG2 LYS A 61 9.120 1.464 -4.724 1.00 61.11 H new ATOM 0 HG3 LYS A 61 9.583 0.528 -6.131 1.00 61.11 H new ATOM 0 HD2 LYS A 61 11.512 2.128 -6.506 1.00 43.44 H new ATOM 0 HD3 LYS A 61 11.074 2.957 -5.025 1.00 43.44 H new ATOM 0 HE2 LYS A 61 11.536 0.944 -3.699 1.00 62.02 H new ATOM 0 HE3 LYS A 61 11.824 0.006 -5.152 1.00 62.02 H new ATOM 0 HZ1 LYS A 61 13.890 0.771 -5.297 1.00 3.34 H new ATOM 0 HZ2 LYS A 61 13.411 2.388 -5.090 1.00 3.34 H new ATOM 0 HZ3 LYS A 61 13.691 1.405 -3.734 1.00 3.34 H new ATOM 1041 N GLN A 62 6.934 3.034 -9.161 1.00 74.55 N ATOM 1042 CA GLN A 62 6.426 4.042 -10.119 1.00 10.11 C ATOM 1043 C GLN A 62 4.887 4.055 -10.100 1.00 60.14 C ATOM 1044 O GLN A 62 4.269 5.118 -10.251 1.00 73.41 O ATOM 1045 CB GLN A 62 6.946 3.765 -11.562 1.00 72.25 C ATOM 1046 CG GLN A 62 8.477 3.562 -11.697 1.00 65.04 C ATOM 1047 CD GLN A 62 9.347 4.810 -11.430 1.00 63.03 C ATOM 1048 OE1 GLN A 62 9.011 5.690 -10.638 1.00 33.41 O ATOM 1049 NE2 GLN A 62 10.495 4.882 -12.081 1.00 12.03 N ATOM 0 H GLN A 62 7.440 2.266 -9.601 1.00 74.55 H new ATOM 0 HA GLN A 62 6.798 5.020 -9.813 1.00 10.11 H new ATOM 0 HB2 GLN A 62 6.445 2.876 -11.945 1.00 72.25 H new ATOM 0 HB3 GLN A 62 6.651 4.597 -12.201 1.00 72.25 H new ATOM 0 HG2 GLN A 62 8.782 2.775 -11.007 1.00 65.04 H new ATOM 0 HG3 GLN A 62 8.689 3.203 -12.704 1.00 65.04 H new ATOM 0 HE21 GLN A 62 10.758 4.144 -12.734 1.00 12.03 H new ATOM 0 HE22 GLN A 62 11.118 5.676 -11.930 1.00 12.03 H new ATOM 1058 N LEU A 63 4.297 2.855 -9.877 1.00 34.42 N ATOM 1059 CA LEU A 63 2.840 2.672 -9.754 1.00 41.00 C ATOM 1060 C LEU A 63 2.338 3.387 -8.489 1.00 31.32 C ATOM 1061 O LEU A 63 1.482 4.279 -8.556 1.00 0.22 O ATOM 1062 CB LEU A 63 2.464 1.153 -9.689 1.00 11.41 C ATOM 1063 CG LEU A 63 3.016 0.239 -10.829 1.00 1.15 C ATOM 1064 CD1 LEU A 63 2.442 -1.194 -10.735 1.00 23.41 C ATOM 1065 CD2 LEU A 63 2.791 0.849 -12.224 1.00 42.04 C ATOM 0 H LEU A 63 4.825 1.988 -9.778 1.00 34.42 H new ATOM 0 HA LEU A 63 2.364 3.102 -10.635 1.00 41.00 H new ATOM 0 HB2 LEU A 63 2.816 0.757 -8.736 1.00 11.41 H new ATOM 0 HB3 LEU A 63 1.377 1.072 -9.686 1.00 11.41 H new ATOM 0 HG LEU A 63 4.094 0.171 -10.686 1.00 1.15 H new ATOM 0 HD11 LEU A 63 2.848 -1.802 -11.544 1.00 23.41 H new ATOM 0 HD12 LEU A 63 2.717 -1.634 -9.777 1.00 23.41 H new ATOM 0 HD13 LEU A 63 1.356 -1.157 -10.818 1.00 23.41 H new ATOM 0 HD21 LEU A 63 3.191 0.178 -12.984 1.00 42.04 H new ATOM 0 HD22 LEU A 63 1.723 0.991 -12.391 1.00 42.04 H new ATOM 0 HD23 LEU A 63 3.299 1.811 -12.286 1.00 42.04 H new ATOM 1077 N LEU A 64 2.941 2.996 -7.344 1.00 34.21 N ATOM 1078 CA LEU A 64 2.597 3.505 -6.000 1.00 23.12 C ATOM 1079 C LEU A 64 2.652 5.031 -5.948 1.00 44.33 C ATOM 1080 O LEU A 64 1.745 5.664 -5.425 1.00 73.41 O ATOM 1081 CB LEU A 64 3.576 2.928 -4.952 1.00 63.20 C ATOM 1082 CG LEU A 64 3.585 1.381 -4.818 1.00 41.24 C ATOM 1083 CD1 LEU A 64 4.750 0.924 -3.937 1.00 3.15 C ATOM 1084 CD2 LEU A 64 2.235 0.854 -4.281 1.00 52.24 C ATOM 0 H LEU A 64 3.693 2.307 -7.329 1.00 34.21 H new ATOM 0 HA LEU A 64 1.578 3.188 -5.777 1.00 23.12 H new ATOM 0 HB2 LEU A 64 4.584 3.258 -5.203 1.00 63.20 H new ATOM 0 HB3 LEU A 64 3.333 3.357 -3.980 1.00 63.20 H new ATOM 0 HG LEU A 64 3.725 0.957 -5.812 1.00 41.24 H new ATOM 0 HD11 LEU A 64 4.740 -0.163 -3.855 1.00 3.15 H new ATOM 0 HD12 LEU A 64 5.691 1.245 -4.383 1.00 3.15 H new ATOM 0 HD13 LEU A 64 4.650 1.364 -2.945 1.00 3.15 H new ATOM 0 HD21 LEU A 64 2.275 -0.232 -4.199 1.00 52.24 H new ATOM 0 HD22 LEU A 64 2.041 1.285 -3.299 1.00 52.24 H new ATOM 0 HD23 LEU A 64 1.436 1.137 -4.966 1.00 52.24 H new ATOM 1096 N LYS A 65 3.722 5.580 -6.545 1.00 63.02 N ATOM 1097 CA LYS A 65 4.030 7.019 -6.529 1.00 20.52 C ATOM 1098 C LYS A 65 2.919 7.826 -7.240 1.00 52.10 C ATOM 1099 O LYS A 65 2.589 8.944 -6.812 1.00 42.43 O ATOM 1100 CB LYS A 65 5.423 7.239 -7.176 1.00 14.33 C ATOM 1101 CG LYS A 65 5.977 8.679 -7.104 1.00 12.33 C ATOM 1102 CD LYS A 65 7.421 8.786 -7.666 1.00 10.32 C ATOM 1103 CE LYS A 65 7.545 8.294 -9.125 1.00 74.14 C ATOM 1104 NZ LYS A 65 8.958 8.308 -9.595 1.00 60.24 N ATOM 0 H LYS A 65 4.408 5.028 -7.060 1.00 63.02 H new ATOM 0 HA LYS A 65 4.065 7.382 -5.502 1.00 20.52 H new ATOM 0 HB2 LYS A 65 6.136 6.571 -6.694 1.00 14.33 H new ATOM 0 HB3 LYS A 65 5.367 6.943 -8.224 1.00 14.33 H new ATOM 0 HG2 LYS A 65 5.322 9.346 -7.664 1.00 12.33 H new ATOM 0 HG3 LYS A 65 5.967 9.018 -6.068 1.00 12.33 H new ATOM 0 HD2 LYS A 65 7.749 9.824 -7.610 1.00 10.32 H new ATOM 0 HD3 LYS A 65 8.093 8.205 -7.035 1.00 10.32 H new ATOM 0 HE2 LYS A 65 7.146 7.283 -9.203 1.00 74.14 H new ATOM 0 HE3 LYS A 65 6.940 8.926 -9.775 1.00 74.14 H new ATOM 0 HZ1 LYS A 65 9.085 9.070 -10.291 1.00 60.24 H new ATOM 0 HZ2 LYS A 65 9.591 8.469 -8.786 1.00 60.24 H new ATOM 0 HZ3 LYS A 65 9.186 7.394 -10.036 1.00 60.24 H new ATOM 1118 N GLU A 66 2.338 7.233 -8.314 1.00 35.51 N ATOM 1119 CA GLU A 66 1.120 7.763 -8.964 1.00 25.42 C ATOM 1120 C GLU A 66 -0.055 7.766 -7.974 1.00 34.04 C ATOM 1121 O GLU A 66 -0.653 8.818 -7.730 1.00 32.34 O ATOM 1122 CB GLU A 66 0.736 6.941 -10.229 1.00 54.43 C ATOM 1123 CG GLU A 66 1.776 6.974 -11.355 1.00 2.11 C ATOM 1124 CD GLU A 66 1.343 6.167 -12.590 1.00 24.25 C ATOM 1125 OE1 GLU A 66 0.443 6.637 -13.320 1.00 74.31 O ATOM 1126 OE2 GLU A 66 1.884 5.060 -12.827 1.00 22.33 O ATOM 0 H GLU A 66 2.699 6.383 -8.747 1.00 35.51 H new ATOM 0 HA GLU A 66 1.337 8.784 -9.277 1.00 25.42 H new ATOM 0 HB2 GLU A 66 0.571 5.904 -9.936 1.00 54.43 H new ATOM 0 HB3 GLU A 66 -0.211 7.317 -10.616 1.00 54.43 H new ATOM 0 HG2 GLU A 66 1.955 8.009 -11.647 1.00 2.11 H new ATOM 0 HG3 GLU A 66 2.721 6.580 -10.982 1.00 2.11 H new ATOM 1133 N MET A 67 -0.352 6.583 -7.378 1.00 50.30 N ATOM 1134 CA MET A 67 -1.544 6.397 -6.519 1.00 33.41 C ATOM 1135 C MET A 67 -1.513 7.277 -5.244 1.00 10.41 C ATOM 1136 O MET A 67 -2.564 7.715 -4.795 1.00 13.23 O ATOM 1137 CB MET A 67 -1.776 4.898 -6.147 1.00 11.02 C ATOM 1138 CG MET A 67 -2.279 3.995 -7.301 1.00 32.51 C ATOM 1139 SD MET A 67 -0.974 3.050 -8.116 1.00 31.44 S ATOM 1140 CE MET A 67 -0.677 1.702 -6.966 1.00 3.31 C ATOM 0 H MET A 67 0.220 5.744 -7.478 1.00 50.30 H new ATOM 0 HA MET A 67 -2.390 6.730 -7.121 1.00 33.41 H new ATOM 0 HB2 MET A 67 -0.840 4.487 -5.768 1.00 11.02 H new ATOM 0 HB3 MET A 67 -2.498 4.852 -5.331 1.00 11.02 H new ATOM 0 HG2 MET A 67 -3.024 3.303 -6.909 1.00 32.51 H new ATOM 0 HG3 MET A 67 -2.781 4.616 -8.043 1.00 32.51 H new ATOM 0 HE1 MET A 67 0.187 1.126 -7.296 1.00 3.31 H new ATOM 0 HE2 MET A 67 -0.485 2.107 -5.972 1.00 3.31 H new ATOM 0 HE3 MET A 67 -1.553 1.054 -6.931 1.00 3.31 H new ATOM 1150 N LEU A 68 -0.314 7.541 -4.678 1.00 42.10 N ATOM 1151 CA LEU A 68 -0.151 8.454 -3.508 1.00 23.43 C ATOM 1152 C LEU A 68 -0.745 9.850 -3.810 1.00 64.12 C ATOM 1153 O LEU A 68 -1.373 10.469 -2.948 1.00 35.12 O ATOM 1154 CB LEU A 68 1.351 8.579 -3.115 1.00 12.31 C ATOM 1155 CG LEU A 68 2.070 7.248 -2.716 1.00 22.30 C ATOM 1156 CD1 LEU A 68 3.569 7.480 -2.469 1.00 23.12 C ATOM 1157 CD2 LEU A 68 1.401 6.561 -1.503 1.00 0.33 C ATOM 0 H LEU A 68 0.562 7.136 -5.009 1.00 42.10 H new ATOM 0 HA LEU A 68 -0.696 8.025 -2.667 1.00 23.43 H new ATOM 0 HB2 LEU A 68 1.889 9.022 -3.953 1.00 12.31 H new ATOM 0 HB3 LEU A 68 1.431 9.276 -2.281 1.00 12.31 H new ATOM 0 HG LEU A 68 1.968 6.566 -3.560 1.00 22.30 H new ATOM 0 HD11 LEU A 68 4.042 6.538 -2.193 1.00 23.12 H new ATOM 0 HD12 LEU A 68 4.032 7.867 -3.377 1.00 23.12 H new ATOM 0 HD13 LEU A 68 3.697 8.200 -1.661 1.00 23.12 H new ATOM 0 HD21 LEU A 68 1.936 5.642 -1.265 1.00 0.33 H new ATOM 0 HD22 LEU A 68 1.430 7.231 -0.644 1.00 0.33 H new ATOM 0 HD23 LEU A 68 0.365 6.325 -1.744 1.00 0.33 H new ATOM 1169 N GLU A 69 -0.554 10.293 -5.064 1.00 11.25 N ATOM 1170 CA GLU A 69 -1.054 11.585 -5.568 1.00 2.41 C ATOM 1171 C GLU A 69 -2.531 11.495 -6.009 1.00 23.35 C ATOM 1172 O GLU A 69 -3.301 12.428 -5.776 1.00 4.40 O ATOM 1173 CB GLU A 69 -0.176 12.047 -6.755 1.00 74.42 C ATOM 1174 CG GLU A 69 1.305 12.272 -6.412 1.00 73.33 C ATOM 1175 CD GLU A 69 1.518 13.405 -5.395 1.00 74.25 C ATOM 1176 OE1 GLU A 69 1.350 14.587 -5.770 1.00 60.34 O ATOM 1177 OE2 GLU A 69 1.828 13.127 -4.222 1.00 74.31 O ATOM 0 H GLU A 69 -0.042 9.758 -5.765 1.00 11.25 H new ATOM 0 HA GLU A 69 -0.997 12.311 -4.757 1.00 2.41 H new ATOM 0 HB2 GLU A 69 -0.242 11.303 -7.548 1.00 74.42 H new ATOM 0 HB3 GLU A 69 -0.587 12.975 -7.153 1.00 74.42 H new ATOM 0 HG2 GLU A 69 1.725 11.349 -6.013 1.00 73.33 H new ATOM 0 HG3 GLU A 69 1.853 12.503 -7.325 1.00 73.33 H new ATOM 1184 N LEU A 70 -2.902 10.367 -6.653 1.00 4.41 N ATOM 1185 CA LEU A 70 -4.252 10.156 -7.228 1.00 12.42 C ATOM 1186 C LEU A 70 -5.316 10.064 -6.118 1.00 71.03 C ATOM 1187 O LEU A 70 -6.328 10.761 -6.161 1.00 34.40 O ATOM 1188 CB LEU A 70 -4.269 8.878 -8.118 1.00 64.13 C ATOM 1189 CG LEU A 70 -3.392 8.941 -9.411 1.00 75.21 C ATOM 1190 CD1 LEU A 70 -3.355 7.576 -10.137 1.00 21.43 C ATOM 1191 CD2 LEU A 70 -3.875 10.065 -10.353 1.00 63.01 C ATOM 0 H LEU A 70 -2.274 9.575 -6.790 1.00 4.41 H new ATOM 0 HA LEU A 70 -4.495 11.015 -7.853 1.00 12.42 H new ATOM 0 HB2 LEU A 70 -3.935 8.033 -7.515 1.00 64.13 H new ATOM 0 HB3 LEU A 70 -5.299 8.674 -8.409 1.00 64.13 H new ATOM 0 HG LEU A 70 -2.372 9.175 -9.108 1.00 75.21 H new ATOM 0 HD11 LEU A 70 -2.737 7.656 -11.031 1.00 21.43 H new ATOM 0 HD12 LEU A 70 -2.935 6.821 -9.472 1.00 21.43 H new ATOM 0 HD13 LEU A 70 -4.367 7.287 -10.420 1.00 21.43 H new ATOM 0 HD21 LEU A 70 -3.248 10.087 -11.244 1.00 63.01 H new ATOM 0 HD22 LEU A 70 -4.909 9.879 -10.641 1.00 63.01 H new ATOM 0 HD23 LEU A 70 -3.809 11.024 -9.839 1.00 63.01 H new ATOM 1203 N ILE A 71 -5.048 9.196 -5.131 1.00 64.34 N ATOM 1204 CA ILE A 71 -5.895 8.995 -3.927 1.00 32.34 C ATOM 1205 C ILE A 71 -5.982 10.297 -3.087 1.00 51.05 C ATOM 1206 O ILE A 71 -7.018 10.589 -2.460 1.00 54.04 O ATOM 1207 CB ILE A 71 -5.320 7.791 -3.076 1.00 33.35 C ATOM 1208 CG1 ILE A 71 -5.324 6.469 -3.926 1.00 34.12 C ATOM 1209 CG2 ILE A 71 -6.086 7.597 -1.746 1.00 20.03 C ATOM 1210 CD1 ILE A 71 -4.517 5.326 -3.331 1.00 21.40 C ATOM 0 H ILE A 71 -4.222 8.598 -5.140 1.00 64.34 H new ATOM 0 HA ILE A 71 -6.910 8.748 -4.238 1.00 32.34 H new ATOM 0 HB ILE A 71 -4.291 8.037 -2.814 1.00 33.35 H new ATOM 0 HG12 ILE A 71 -6.355 6.139 -4.054 1.00 34.12 H new ATOM 0 HG13 ILE A 71 -4.935 6.691 -4.920 1.00 34.12 H new ATOM 0 HG21 ILE A 71 -5.655 6.760 -1.197 1.00 20.03 H new ATOM 0 HG22 ILE A 71 -6.008 8.503 -1.146 1.00 20.03 H new ATOM 0 HG23 ILE A 71 -7.135 7.391 -1.957 1.00 20.03 H new ATOM 0 HD11 ILE A 71 -4.579 4.457 -3.986 1.00 21.40 H new ATOM 0 HD12 ILE A 71 -3.475 5.630 -3.229 1.00 21.40 H new ATOM 0 HD13 ILE A 71 -4.918 5.070 -2.350 1.00 21.40 H new ATOM 1222 N SER A 72 -4.896 11.092 -3.125 1.00 0.34 N ATOM 1223 CA SER A 72 -4.827 12.409 -2.462 1.00 43.14 C ATOM 1224 C SER A 72 -5.771 13.432 -3.150 1.00 1.03 C ATOM 1225 O SER A 72 -6.265 14.356 -2.501 1.00 51.54 O ATOM 1226 CB SER A 72 -3.364 12.909 -2.463 1.00 13.04 C ATOM 1227 OG SER A 72 -3.194 14.083 -1.685 1.00 52.11 O ATOM 0 H SER A 72 -4.039 10.839 -3.617 1.00 0.34 H new ATOM 0 HA SER A 72 -5.164 12.305 -1.431 1.00 43.14 H new ATOM 0 HB2 SER A 72 -2.714 12.123 -2.078 1.00 13.04 H new ATOM 0 HB3 SER A 72 -3.051 13.107 -3.488 1.00 13.04 H new ATOM 0 HG SER A 72 -2.255 14.361 -1.714 1.00 52.11 H new ATOM 1233 N LYS A 73 -6.003 13.252 -4.470 1.00 4.14 N ATOM 1234 CA LYS A 73 -6.994 14.037 -5.251 1.00 2.02 C ATOM 1235 C LYS A 73 -8.419 13.528 -4.985 1.00 13.31 C ATOM 1236 O LYS A 73 -9.362 14.315 -4.880 1.00 74.20 O ATOM 1237 CB LYS A 73 -6.714 13.902 -6.763 1.00 62.21 C ATOM 1238 CG LYS A 73 -5.344 14.426 -7.225 1.00 33.24 C ATOM 1239 CD LYS A 73 -5.035 13.981 -8.670 1.00 73.00 C ATOM 1240 CE LYS A 73 -3.728 14.580 -9.210 1.00 63.52 C ATOM 1241 NZ LYS A 73 -2.545 14.126 -8.434 1.00 14.13 N ATOM 0 H LYS A 73 -5.508 12.556 -5.028 1.00 4.14 H new ATOM 0 HA LYS A 73 -6.907 15.079 -4.942 1.00 2.02 H new ATOM 0 HB2 LYS A 73 -6.795 12.851 -7.039 1.00 62.21 H new ATOM 0 HB3 LYS A 73 -7.492 14.435 -7.309 1.00 62.21 H new ATOM 0 HG2 LYS A 73 -5.329 15.514 -7.166 1.00 33.24 H new ATOM 0 HG3 LYS A 73 -4.567 14.060 -6.555 1.00 33.24 H new ATOM 0 HD2 LYS A 73 -4.973 12.893 -8.705 1.00 73.00 H new ATOM 0 HD3 LYS A 73 -5.860 14.274 -9.320 1.00 73.00 H new ATOM 0 HE2 LYS A 73 -3.605 14.299 -10.256 1.00 63.52 H new ATOM 0 HE3 LYS A 73 -3.787 15.668 -9.177 1.00 63.52 H new ATOM 0 HZ1 LYS A 73 -2.017 14.953 -8.090 1.00 14.13 H new ATOM 0 HZ2 LYS A 73 -2.860 13.555 -7.624 1.00 14.13 H new ATOM 0 HZ3 LYS A 73 -1.929 13.551 -9.044 1.00 14.13 H new ATOM 1255 N LEU A 74 -8.541 12.185 -4.905 1.00 0.24 N ATOM 1256 CA LEU A 74 -9.833 11.486 -4.673 1.00 62.31 C ATOM 1257 C LEU A 74 -10.417 11.850 -3.290 1.00 63.01 C ATOM 1258 O LEU A 74 -11.633 11.780 -3.088 1.00 61.54 O ATOM 1259 CB LEU A 74 -9.656 9.940 -4.789 1.00 63.24 C ATOM 1260 CG LEU A 74 -9.221 9.385 -6.185 1.00 74.01 C ATOM 1261 CD1 LEU A 74 -8.974 7.859 -6.130 1.00 35.24 C ATOM 1262 CD2 LEU A 74 -10.243 9.751 -7.286 1.00 1.44 C ATOM 0 H LEU A 74 -7.748 11.550 -4.999 1.00 0.24 H new ATOM 0 HA LEU A 74 -10.532 11.816 -5.442 1.00 62.31 H new ATOM 0 HB2 LEU A 74 -8.916 9.626 -4.053 1.00 63.24 H new ATOM 0 HB3 LEU A 74 -10.599 9.468 -4.514 1.00 63.24 H new ATOM 0 HG LEU A 74 -8.277 9.863 -6.447 1.00 74.01 H new ATOM 0 HD11 LEU A 74 -8.673 7.503 -7.115 1.00 35.24 H new ATOM 0 HD12 LEU A 74 -8.184 7.644 -5.410 1.00 35.24 H new ATOM 0 HD13 LEU A 74 -9.890 7.353 -5.826 1.00 35.24 H new ATOM 0 HD21 LEU A 74 -9.908 9.349 -8.242 1.00 1.44 H new ATOM 0 HD22 LEU A 74 -11.215 9.327 -7.035 1.00 1.44 H new ATOM 0 HD23 LEU A 74 -10.327 10.835 -7.358 1.00 1.44 H new ATOM 1274 N GLY A 75 -9.525 12.221 -2.351 1.00 61.20 N ATOM 1275 CA GLY A 75 -9.923 12.699 -1.031 1.00 24.21 C ATOM 1276 C GLY A 75 -10.105 11.575 -0.031 1.00 0.41 C ATOM 1277 O GLY A 75 -11.155 11.461 0.614 1.00 72.24 O ATOM 0 H GLY A 75 -8.515 12.195 -2.494 1.00 61.20 H new ATOM 0 HA2 GLY A 75 -9.169 13.393 -0.658 1.00 24.21 H new ATOM 0 HA3 GLY A 75 -10.855 13.257 -1.117 1.00 24.21 H new ATOM 1281 N TYR A 76 -9.067 10.739 0.089 1.00 32.22 N ATOM 1282 CA TYR A 76 -9.042 9.596 1.022 1.00 61.22 C ATOM 1283 C TYR A 76 -7.785 9.662 1.889 1.00 21.12 C ATOM 1284 O TYR A 76 -6.870 10.457 1.616 1.00 24.13 O ATOM 1285 CB TYR A 76 -9.077 8.251 0.248 1.00 50.55 C ATOM 1286 CG TYR A 76 -10.336 8.009 -0.598 1.00 70.51 C ATOM 1287 CD1 TYR A 76 -11.610 8.235 -0.071 1.00 21.24 C ATOM 1288 CD2 TYR A 76 -10.253 7.533 -1.914 1.00 50.43 C ATOM 1289 CE1 TYR A 76 -12.745 8.007 -0.818 1.00 52.13 C ATOM 1290 CE2 TYR A 76 -11.392 7.304 -2.662 1.00 20.41 C ATOM 1291 CZ TYR A 76 -12.631 7.544 -2.109 1.00 63.35 C ATOM 1292 OH TYR A 76 -13.761 7.321 -2.852 1.00 40.14 O ATOM 0 H TYR A 76 -8.213 10.833 -0.460 1.00 32.22 H new ATOM 0 HA TYR A 76 -9.925 9.651 1.658 1.00 61.22 H new ATOM 0 HB2 TYR A 76 -8.206 8.205 -0.406 1.00 50.55 H new ATOM 0 HB3 TYR A 76 -8.980 7.436 0.965 1.00 50.55 H new ATOM 0 HD1 TYR A 76 -11.707 8.596 0.942 1.00 21.24 H new ATOM 0 HD2 TYR A 76 -9.284 7.342 -2.350 1.00 50.43 H new ATOM 0 HE1 TYR A 76 -13.720 8.191 -0.392 1.00 52.13 H new ATOM 0 HE2 TYR A 76 -11.311 6.939 -3.675 1.00 20.41 H new ATOM 0 HH TYR A 76 -13.738 6.412 -3.218 1.00 40.14 H new ATOM 1302 N LYS A 77 -7.757 8.821 2.937 1.00 24.41 N ATOM 1303 CA LYS A 77 -6.572 8.637 3.779 1.00 52.43 C ATOM 1304 C LYS A 77 -5.542 7.832 2.995 1.00 53.43 C ATOM 1305 O LYS A 77 -5.792 6.685 2.634 1.00 4.32 O ATOM 1306 CB LYS A 77 -6.918 7.912 5.110 1.00 72.14 C ATOM 1307 CG LYS A 77 -5.685 7.568 5.997 1.00 73.11 C ATOM 1308 CD LYS A 77 -6.050 6.850 7.321 1.00 53.04 C ATOM 1309 CE LYS A 77 -6.950 7.697 8.238 1.00 44.43 C ATOM 1310 NZ LYS A 77 -6.396 9.052 8.464 1.00 55.45 N ATOM 0 H LYS A 77 -8.555 8.253 3.220 1.00 24.41 H new ATOM 0 HA LYS A 77 -6.171 9.616 4.041 1.00 52.43 H new ATOM 0 HB2 LYS A 77 -7.599 8.540 5.685 1.00 72.14 H new ATOM 0 HB3 LYS A 77 -7.452 6.990 4.879 1.00 72.14 H new ATOM 0 HG2 LYS A 77 -5.004 6.936 5.427 1.00 73.11 H new ATOM 0 HG3 LYS A 77 -5.148 8.488 6.229 1.00 73.11 H new ATOM 0 HD2 LYS A 77 -6.555 5.912 7.091 1.00 53.04 H new ATOM 0 HD3 LYS A 77 -5.134 6.596 7.854 1.00 53.04 H new ATOM 0 HE2 LYS A 77 -7.942 7.781 7.795 1.00 44.43 H new ATOM 0 HE3 LYS A 77 -7.070 7.190 9.196 1.00 44.43 H new ATOM 0 HZ1 LYS A 77 -6.937 9.528 9.214 1.00 55.45 H new ATOM 0 HZ2 LYS A 77 -5.399 8.976 8.751 1.00 55.45 H new ATOM 0 HZ3 LYS A 77 -6.462 9.605 7.586 1.00 55.45 H new ATOM 1324 N VAL A 78 -4.404 8.451 2.710 1.00 71.24 N ATOM 1325 CA VAL A 78 -3.278 7.772 2.072 1.00 31.02 C ATOM 1326 C VAL A 78 -2.385 7.184 3.176 1.00 23.51 C ATOM 1327 O VAL A 78 -2.166 7.827 4.213 1.00 45.23 O ATOM 1328 CB VAL A 78 -2.453 8.757 1.155 1.00 15.04 C ATOM 1329 CG1 VAL A 78 -1.321 8.015 0.406 1.00 52.12 C ATOM 1330 CG2 VAL A 78 -3.379 9.508 0.162 1.00 70.25 C ATOM 0 H VAL A 78 -4.233 9.436 2.913 1.00 71.24 H new ATOM 0 HA VAL A 78 -3.653 6.978 1.426 1.00 31.02 H new ATOM 0 HB VAL A 78 -1.989 9.499 1.805 1.00 15.04 H new ATOM 0 HG11 VAL A 78 -0.772 8.722 -0.216 1.00 52.12 H new ATOM 0 HG12 VAL A 78 -0.641 7.564 1.129 1.00 52.12 H new ATOM 0 HG13 VAL A 78 -1.751 7.235 -0.223 1.00 52.12 H new ATOM 0 HG21 VAL A 78 -2.782 10.179 -0.456 1.00 70.25 H new ATOM 0 HG22 VAL A 78 -3.890 8.787 -0.475 1.00 70.25 H new ATOM 0 HG23 VAL A 78 -4.116 10.087 0.719 1.00 70.25 H new ATOM 1340 N PHE A 79 -1.917 5.956 2.965 1.00 33.42 N ATOM 1341 CA PHE A 79 -0.938 5.299 3.838 1.00 43.24 C ATOM 1342 C PHE A 79 -0.014 4.470 2.939 1.00 22.43 C ATOM 1343 O PHE A 79 -0.478 3.877 1.964 1.00 41.42 O ATOM 1344 CB PHE A 79 -1.663 4.410 4.892 1.00 20.11 C ATOM 1345 CG PHE A 79 -0.779 3.906 6.050 1.00 33.12 C ATOM 1346 CD1 PHE A 79 0.085 2.819 5.885 1.00 14.10 C ATOM 1347 CD2 PHE A 79 -0.828 4.512 7.308 1.00 34.11 C ATOM 1348 CE1 PHE A 79 0.865 2.360 6.929 1.00 21.14 C ATOM 1349 CE2 PHE A 79 -0.045 4.051 8.352 1.00 4.35 C ATOM 1350 CZ PHE A 79 0.800 2.976 8.160 1.00 74.34 C ATOM 0 H PHE A 79 -2.208 5.380 2.175 1.00 33.42 H new ATOM 0 HA PHE A 79 -0.353 6.031 4.395 1.00 43.24 H new ATOM 0 HB2 PHE A 79 -2.494 4.977 5.312 1.00 20.11 H new ATOM 0 HB3 PHE A 79 -2.092 3.547 4.382 1.00 20.11 H new ATOM 0 HD1 PHE A 79 0.144 2.329 4.924 1.00 14.10 H new ATOM 0 HD2 PHE A 79 -1.487 5.353 7.468 1.00 34.11 H new ATOM 0 HE1 PHE A 79 1.526 1.519 6.780 1.00 21.14 H new ATOM 0 HE2 PHE A 79 -0.095 4.532 9.317 1.00 4.35 H new ATOM 0 HZ PHE A 79 1.411 2.618 8.975 1.00 74.34 H new ATOM 1360 N LEU A 80 1.283 4.441 3.257 1.00 14.05 N ATOM 1361 CA LEU A 80 2.273 3.653 2.511 1.00 30.12 C ATOM 1362 C LEU A 80 3.082 2.810 3.511 1.00 34.33 C ATOM 1363 O LEU A 80 3.410 3.268 4.609 1.00 63.31 O ATOM 1364 CB LEU A 80 3.194 4.582 1.653 1.00 5.11 C ATOM 1365 CG LEU A 80 4.238 3.871 0.710 1.00 53.31 C ATOM 1366 CD1 LEU A 80 3.560 2.907 -0.291 1.00 62.43 C ATOM 1367 CD2 LEU A 80 5.113 4.907 -0.036 1.00 12.23 C ATOM 0 H LEU A 80 1.678 4.963 4.039 1.00 14.05 H new ATOM 0 HA LEU A 80 1.768 2.986 1.812 1.00 30.12 H new ATOM 0 HB2 LEU A 80 2.557 5.217 1.037 1.00 5.11 H new ATOM 0 HB3 LEU A 80 3.740 5.239 2.330 1.00 5.11 H new ATOM 0 HG LEU A 80 4.884 3.271 1.351 1.00 53.31 H new ATOM 0 HD11 LEU A 80 4.320 2.441 -0.919 1.00 62.43 H new ATOM 0 HD12 LEU A 80 3.019 2.135 0.257 1.00 62.43 H new ATOM 0 HD13 LEU A 80 2.863 3.464 -0.917 1.00 62.43 H new ATOM 0 HD21 LEU A 80 5.824 4.387 -0.679 1.00 12.23 H new ATOM 0 HD22 LEU A 80 4.477 5.550 -0.644 1.00 12.23 H new ATOM 0 HD23 LEU A 80 5.656 5.514 0.689 1.00 12.23 H new ATOM 1379 N LEU A 81 3.351 1.570 3.116 1.00 21.20 N ATOM 1380 CA LEU A 81 4.117 0.581 3.880 1.00 25.53 C ATOM 1381 C LEU A 81 4.952 -0.188 2.861 1.00 11.55 C ATOM 1382 O LEU A 81 4.406 -0.680 1.874 1.00 15.12 O ATOM 1383 CB LEU A 81 3.156 -0.371 4.667 1.00 30.31 C ATOM 1384 CG LEU A 81 3.780 -1.685 5.264 1.00 3.10 C ATOM 1385 CD1 LEU A 81 4.949 -1.395 6.238 1.00 23.05 C ATOM 1386 CD2 LEU A 81 2.691 -2.558 5.933 1.00 61.15 C ATOM 0 H LEU A 81 3.030 1.208 2.218 1.00 21.20 H new ATOM 0 HA LEU A 81 4.756 1.056 4.624 1.00 25.53 H new ATOM 0 HB2 LEU A 81 2.714 0.196 5.486 1.00 30.31 H new ATOM 0 HB3 LEU A 81 2.342 -0.656 4.001 1.00 30.31 H new ATOM 0 HG LEU A 81 4.203 -2.246 4.431 1.00 3.10 H new ATOM 0 HD11 LEU A 81 5.344 -2.335 6.622 1.00 23.05 H new ATOM 0 HD12 LEU A 81 5.737 -0.858 5.710 1.00 23.05 H new ATOM 0 HD13 LEU A 81 4.589 -0.787 7.068 1.00 23.05 H new ATOM 0 HD21 LEU A 81 3.147 -3.461 6.338 1.00 61.15 H new ATOM 0 HD22 LEU A 81 2.219 -1.996 6.739 1.00 61.15 H new ATOM 0 HD23 LEU A 81 1.939 -2.832 5.193 1.00 61.15 H new ATOM 1398 N LEU A 82 6.270 -0.265 3.074 1.00 50.53 N ATOM 1399 CA LEU A 82 7.183 -0.907 2.119 1.00 20.03 C ATOM 1400 C LEU A 82 8.219 -1.782 2.843 1.00 1.11 C ATOM 1401 O LEU A 82 8.651 -1.473 3.965 1.00 1.21 O ATOM 1402 CB LEU A 82 7.815 0.175 1.177 1.00 3.14 C ATOM 1403 CG LEU A 82 8.398 1.486 1.833 1.00 41.35 C ATOM 1404 CD1 LEU A 82 9.809 1.288 2.413 1.00 35.20 C ATOM 1405 CD2 LEU A 82 8.384 2.668 0.843 1.00 44.11 C ATOM 0 H LEU A 82 6.731 0.111 3.903 1.00 50.53 H new ATOM 0 HA LEU A 82 6.624 -1.592 1.481 1.00 20.03 H new ATOM 0 HB2 LEU A 82 8.618 -0.301 0.615 1.00 3.14 H new ATOM 0 HB3 LEU A 82 7.054 0.474 0.456 1.00 3.14 H new ATOM 0 HG LEU A 82 7.738 1.723 2.667 1.00 41.35 H new ATOM 0 HD11 LEU A 82 10.157 2.224 2.850 1.00 35.20 H new ATOM 0 HD12 LEU A 82 9.781 0.516 3.182 1.00 35.20 H new ATOM 0 HD13 LEU A 82 10.490 0.984 1.618 1.00 35.20 H new ATOM 0 HD21 LEU A 82 8.792 3.554 1.329 1.00 44.11 H new ATOM 0 HD22 LEU A 82 8.990 2.420 -0.028 1.00 44.11 H new ATOM 0 HD23 LEU A 82 7.360 2.867 0.528 1.00 44.11 H new ATOM 1417 N GLN A 83 8.567 -2.895 2.178 1.00 11.35 N ATOM 1418 CA GLN A 83 9.547 -3.880 2.647 1.00 13.31 C ATOM 1419 C GLN A 83 10.084 -4.616 1.413 1.00 14.24 C ATOM 1420 O GLN A 83 9.331 -4.884 0.466 1.00 25.22 O ATOM 1421 CB GLN A 83 8.918 -4.862 3.697 1.00 54.21 C ATOM 1422 CG GLN A 83 8.265 -6.175 3.177 1.00 71.21 C ATOM 1423 CD GLN A 83 9.240 -7.361 3.000 1.00 40.43 C ATOM 1424 OE1 GLN A 83 9.081 -8.179 2.103 1.00 73.22 O ATOM 1425 NE2 GLN A 83 10.251 -7.464 3.857 1.00 5.41 N ATOM 0 H GLN A 83 8.162 -3.139 1.274 1.00 11.35 H new ATOM 0 HA GLN A 83 10.367 -3.385 3.166 1.00 13.31 H new ATOM 0 HB2 GLN A 83 9.699 -5.137 4.406 1.00 54.21 H new ATOM 0 HB3 GLN A 83 8.160 -4.312 4.255 1.00 54.21 H new ATOM 0 HG2 GLN A 83 7.478 -6.471 3.870 1.00 71.21 H new ATOM 0 HG3 GLN A 83 7.786 -5.971 2.219 1.00 71.21 H new ATOM 0 HE21 GLN A 83 10.365 -6.771 4.597 1.00 5.41 H new ATOM 0 HE22 GLN A 83 10.913 -8.236 3.775 1.00 5.41 H new ATOM 1434 N ASP A 84 11.379 -4.920 1.428 1.00 4.45 N ATOM 1435 CA ASP A 84 12.050 -5.611 0.324 1.00 15.53 C ATOM 1436 C ASP A 84 13.414 -6.134 0.801 1.00 31.11 C ATOM 1437 O ASP A 84 13.888 -5.783 1.885 1.00 70.22 O ATOM 1438 CB ASP A 84 12.199 -4.672 -0.918 1.00 3.52 C ATOM 1439 CG ASP A 84 12.743 -5.370 -2.174 1.00 3.41 C ATOM 1440 OD1 ASP A 84 12.186 -6.419 -2.567 1.00 60.01 O ATOM 1441 OD2 ASP A 84 13.731 -4.883 -2.766 1.00 61.24 O ATOM 0 H ASP A 84 11.997 -4.694 2.207 1.00 4.45 H new ATOM 0 HA ASP A 84 11.441 -6.459 0.011 1.00 15.53 H new ATOM 0 HB2 ASP A 84 11.226 -4.238 -1.150 1.00 3.52 H new ATOM 0 HB3 ASP A 84 12.863 -3.847 -0.658 1.00 3.52 H new ATOM 1446 N GLN A 85 14.007 -7.004 -0.020 1.00 2.52 N ATOM 1447 CA GLN A 85 15.336 -7.597 0.196 1.00 23.20 C ATOM 1448 C GLN A 85 16.436 -6.514 0.117 1.00 33.34 C ATOM 1449 O GLN A 85 17.486 -6.637 0.751 1.00 71.20 O ATOM 1450 CB GLN A 85 15.581 -8.708 -0.867 1.00 3.43 C ATOM 1451 CG GLN A 85 14.629 -9.945 -0.816 1.00 2.31 C ATOM 1452 CD GLN A 85 13.149 -9.658 -1.136 1.00 54.10 C ATOM 1453 OE1 GLN A 85 12.337 -9.407 -0.245 1.00 4.35 O ATOM 1454 NE2 GLN A 85 12.800 -9.636 -2.407 1.00 74.10 N ATOM 0 H GLN A 85 13.565 -7.327 -0.881 1.00 2.52 H new ATOM 0 HA GLN A 85 15.375 -8.038 1.192 1.00 23.20 H new ATOM 0 HB2 GLN A 85 15.501 -8.257 -1.856 1.00 3.43 H new ATOM 0 HB3 GLN A 85 16.606 -9.062 -0.760 1.00 3.43 H new ATOM 0 HG2 GLN A 85 14.996 -10.693 -1.519 1.00 2.31 H new ATOM 0 HG3 GLN A 85 14.688 -10.386 0.179 1.00 2.31 H new ATOM 0 HE21 GLN A 85 13.489 -9.847 -3.129 1.00 74.10 H new ATOM 0 HE22 GLN A 85 11.841 -9.408 -2.669 1.00 74.10 H new ATOM 1463 N ASP A 86 16.171 -5.467 -0.684 1.00 35.13 N ATOM 1464 CA ASP A 86 17.066 -4.314 -0.857 1.00 1.41 C ATOM 1465 C ASP A 86 16.651 -3.171 0.083 1.00 70.55 C ATOM 1466 O ASP A 86 15.708 -2.430 -0.220 1.00 22.25 O ATOM 1467 CB ASP A 86 17.045 -3.838 -2.332 1.00 41.32 C ATOM 1468 CG ASP A 86 17.598 -4.891 -3.302 1.00 53.03 C ATOM 1469 OD1 ASP A 86 16.847 -5.813 -3.686 1.00 21.54 O ATOM 1470 OD2 ASP A 86 18.802 -4.825 -3.650 1.00 22.42 O ATOM 0 H ASP A 86 15.316 -5.399 -1.236 1.00 35.13 H new ATOM 0 HA ASP A 86 18.082 -4.617 -0.604 1.00 1.41 H new ATOM 0 HB2 ASP A 86 16.022 -3.591 -2.615 1.00 41.32 H new ATOM 0 HB3 ASP A 86 17.631 -2.923 -2.423 1.00 41.32 H new ATOM 1475 N GLU A 87 17.355 -3.049 1.236 1.00 55.42 N ATOM 1476 CA GLU A 87 17.121 -1.968 2.229 1.00 40.03 C ATOM 1477 C GLU A 87 17.434 -0.578 1.625 1.00 22.42 C ATOM 1478 O GLU A 87 16.741 0.407 1.910 1.00 73.23 O ATOM 1479 CB GLU A 87 17.979 -2.193 3.510 1.00 70.21 C ATOM 1480 CG GLU A 87 17.815 -1.117 4.621 1.00 34.51 C ATOM 1481 CD GLU A 87 16.444 -1.153 5.322 1.00 32.35 C ATOM 1482 OE1 GLU A 87 15.483 -0.539 4.819 1.00 73.14 O ATOM 1483 OE2 GLU A 87 16.331 -1.782 6.396 1.00 71.21 O ATOM 0 H GLU A 87 18.098 -3.694 1.504 1.00 55.42 H new ATOM 0 HA GLU A 87 16.066 -1.999 2.503 1.00 40.03 H new ATOM 0 HB2 GLU A 87 17.725 -3.166 3.930 1.00 70.21 H new ATOM 0 HB3 GLU A 87 19.029 -2.235 3.221 1.00 70.21 H new ATOM 0 HG2 GLU A 87 18.598 -1.256 5.367 1.00 34.51 H new ATOM 0 HG3 GLU A 87 17.963 -0.130 4.183 1.00 34.51 H new ATOM 1490 N ASN A 88 18.484 -0.538 0.776 1.00 62.34 N ATOM 1491 CA ASN A 88 18.939 0.687 0.078 1.00 33.41 C ATOM 1492 C ASN A 88 17.819 1.251 -0.807 1.00 21.43 C ATOM 1493 O ASN A 88 17.633 2.467 -0.883 1.00 23.23 O ATOM 1494 CB ASN A 88 20.200 0.401 -0.791 1.00 61.25 C ATOM 1495 CG ASN A 88 21.452 0.014 0.005 1.00 22.34 C ATOM 1496 OD1 ASN A 88 21.380 -0.503 1.120 1.00 11.44 O ATOM 1497 ND2 ASN A 88 22.617 0.238 -0.582 1.00 71.02 N ATOM 0 H ASN A 88 19.045 -1.361 0.553 1.00 62.34 H new ATOM 0 HA ASN A 88 19.200 1.424 0.838 1.00 33.41 H new ATOM 0 HB2 ASN A 88 19.968 -0.402 -1.490 1.00 61.25 H new ATOM 0 HB3 ASN A 88 20.423 1.287 -1.386 1.00 61.25 H new ATOM 0 HD21 ASN A 88 23.484 -0.019 -0.110 1.00 71.02 H new ATOM 0 HD22 ASN A 88 22.648 0.668 -1.506 1.00 71.02 H new ATOM 1504 N GLU A 89 17.076 0.341 -1.458 1.00 42.35 N ATOM 1505 CA GLU A 89 15.966 0.698 -2.356 1.00 71.23 C ATOM 1506 C GLU A 89 14.738 1.197 -1.580 1.00 22.44 C ATOM 1507 O GLU A 89 13.973 2.031 -2.083 1.00 71.02 O ATOM 1508 CB GLU A 89 15.605 -0.505 -3.272 1.00 12.13 C ATOM 1509 CG GLU A 89 16.635 -0.771 -4.388 1.00 54.45 C ATOM 1510 CD GLU A 89 16.918 0.481 -5.244 1.00 11.21 C ATOM 1511 OE1 GLU A 89 15.985 0.970 -5.924 1.00 54.42 O ATOM 1512 OE2 GLU A 89 18.059 1.002 -5.215 1.00 13.45 O ATOM 0 H GLU A 89 17.229 -0.664 -1.376 1.00 42.35 H new ATOM 0 HA GLU A 89 16.298 1.524 -2.985 1.00 71.23 H new ATOM 0 HB2 GLU A 89 15.509 -1.401 -2.658 1.00 12.13 H new ATOM 0 HB3 GLU A 89 14.631 -0.324 -3.726 1.00 12.13 H new ATOM 0 HG2 GLU A 89 17.566 -1.120 -3.942 1.00 54.45 H new ATOM 0 HG3 GLU A 89 16.270 -1.572 -5.031 1.00 54.45 H new ATOM 1519 N LEU A 90 14.563 0.687 -0.362 1.00 62.10 N ATOM 1520 CA LEU A 90 13.463 1.083 0.522 1.00 3.32 C ATOM 1521 C LEU A 90 13.633 2.539 1.001 1.00 22.32 C ATOM 1522 O LEU A 90 12.720 3.358 0.863 1.00 31.44 O ATOM 1523 CB LEU A 90 13.397 0.122 1.729 1.00 12.00 C ATOM 1524 CG LEU A 90 13.062 -1.358 1.408 1.00 40.31 C ATOM 1525 CD1 LEU A 90 13.109 -2.228 2.688 1.00 65.23 C ATOM 1526 CD2 LEU A 90 11.700 -1.460 0.684 1.00 14.53 C ATOM 0 H LEU A 90 15.182 -0.016 0.043 1.00 62.10 H new ATOM 0 HA LEU A 90 12.529 1.024 -0.037 1.00 3.32 H new ATOM 0 HB2 LEU A 90 14.357 0.152 2.244 1.00 12.00 H new ATOM 0 HB3 LEU A 90 12.649 0.499 2.427 1.00 12.00 H new ATOM 0 HG LEU A 90 13.822 -1.749 0.731 1.00 40.31 H new ATOM 0 HD11 LEU A 90 12.870 -3.261 2.435 1.00 65.23 H new ATOM 0 HD12 LEU A 90 14.108 -2.182 3.123 1.00 65.23 H new ATOM 0 HD13 LEU A 90 12.382 -1.854 3.409 1.00 65.23 H new ATOM 0 HD21 LEU A 90 11.481 -2.505 0.466 1.00 14.53 H new ATOM 0 HD22 LEU A 90 10.917 -1.050 1.322 1.00 14.53 H new ATOM 0 HD23 LEU A 90 11.740 -0.896 -0.248 1.00 14.53 H new ATOM 1538 N GLU A 91 14.829 2.837 1.546 1.00 14.15 N ATOM 1539 CA GLU A 91 15.145 4.139 2.170 1.00 21.14 C ATOM 1540 C GLU A 91 15.179 5.295 1.145 1.00 34.23 C ATOM 1541 O GLU A 91 14.745 6.407 1.464 1.00 11.42 O ATOM 1542 CB GLU A 91 16.490 4.049 2.950 1.00 13.30 C ATOM 1543 CG GLU A 91 17.702 3.648 2.089 1.00 65.31 C ATOM 1544 CD GLU A 91 19.006 3.442 2.877 1.00 21.23 C ATOM 1545 OE1 GLU A 91 19.022 2.598 3.798 1.00 53.33 O ATOM 1546 OE2 GLU A 91 20.021 4.120 2.579 1.00 11.22 O ATOM 0 H GLU A 91 15.608 2.178 1.566 1.00 14.15 H new ATOM 0 HA GLU A 91 14.341 4.367 2.870 1.00 21.14 H new ATOM 0 HB2 GLU A 91 16.693 5.015 3.412 1.00 13.30 H new ATOM 0 HB3 GLU A 91 16.379 3.326 3.758 1.00 13.30 H new ATOM 0 HG2 GLU A 91 17.465 2.727 1.557 1.00 65.31 H new ATOM 0 HG3 GLU A 91 17.866 4.418 1.335 1.00 65.31 H new ATOM 1553 N GLU A 92 15.682 5.023 -0.087 1.00 35.23 N ATOM 1554 CA GLU A 92 15.814 6.063 -1.137 1.00 11.45 C ATOM 1555 C GLU A 92 14.444 6.477 -1.693 1.00 71.30 C ATOM 1556 O GLU A 92 14.256 7.638 -2.055 1.00 14.44 O ATOM 1557 CB GLU A 92 16.804 5.621 -2.264 1.00 53.34 C ATOM 1558 CG GLU A 92 16.453 4.330 -3.056 1.00 22.11 C ATOM 1559 CD GLU A 92 15.523 4.527 -4.269 1.00 2.11 C ATOM 1560 OE1 GLU A 92 15.955 5.154 -5.257 1.00 63.45 O ATOM 1561 OE2 GLU A 92 14.374 4.040 -4.256 1.00 61.23 O ATOM 0 H GLU A 92 16.001 4.098 -0.375 1.00 35.23 H new ATOM 0 HA GLU A 92 16.246 6.949 -0.672 1.00 11.45 H new ATOM 0 HB2 GLU A 92 16.891 6.441 -2.977 1.00 53.34 H new ATOM 0 HB3 GLU A 92 17.787 5.484 -1.814 1.00 53.34 H new ATOM 0 HG2 GLU A 92 17.380 3.874 -3.402 1.00 22.11 H new ATOM 0 HG3 GLU A 92 15.985 3.622 -2.373 1.00 22.11 H new ATOM 1568 N PHE A 93 13.502 5.519 -1.775 1.00 34.15 N ATOM 1569 CA PHE A 93 12.105 5.801 -2.158 1.00 54.24 C ATOM 1570 C PHE A 93 11.385 6.547 -1.023 1.00 15.54 C ATOM 1571 O PHE A 93 10.764 7.591 -1.262 1.00 63.43 O ATOM 1572 CB PHE A 93 11.364 4.480 -2.518 1.00 23.54 C ATOM 1573 CG PHE A 93 9.921 4.654 -3.037 1.00 24.22 C ATOM 1574 CD1 PHE A 93 9.644 5.467 -4.139 1.00 0.01 C ATOM 1575 CD2 PHE A 93 8.847 4.002 -2.431 1.00 1.14 C ATOM 1576 CE1 PHE A 93 8.349 5.619 -4.612 1.00 52.01 C ATOM 1577 CE2 PHE A 93 7.553 4.151 -2.904 1.00 63.44 C ATOM 1578 CZ PHE A 93 7.305 4.960 -3.994 1.00 3.04 C ATOM 0 H PHE A 93 13.685 4.535 -1.579 1.00 34.15 H new ATOM 0 HA PHE A 93 12.102 6.440 -3.041 1.00 54.24 H new ATOM 0 HB2 PHE A 93 11.944 3.952 -3.275 1.00 23.54 H new ATOM 0 HB3 PHE A 93 11.340 3.843 -1.634 1.00 23.54 H new ATOM 0 HD1 PHE A 93 10.453 5.986 -4.631 1.00 0.01 H new ATOM 0 HD2 PHE A 93 9.028 3.368 -1.576 1.00 1.14 H new ATOM 0 HE1 PHE A 93 8.157 6.254 -5.465 1.00 52.01 H new ATOM 0 HE2 PHE A 93 6.738 3.634 -2.419 1.00 63.44 H new ATOM 0 HZ PHE A 93 6.297 5.077 -4.363 1.00 3.04 H new ATOM 1588 N LYS A 94 11.526 6.019 0.216 1.00 73.13 N ATOM 1589 CA LYS A 94 10.814 6.517 1.409 1.00 43.31 C ATOM 1590 C LYS A 94 11.115 8.000 1.697 1.00 24.22 C ATOM 1591 O LYS A 94 10.186 8.769 1.935 1.00 55.34 O ATOM 1592 CB LYS A 94 11.137 5.641 2.655 1.00 60.53 C ATOM 1593 CG LYS A 94 10.586 6.200 3.978 1.00 63.32 C ATOM 1594 CD LYS A 94 10.713 5.207 5.142 1.00 12.42 C ATOM 1595 CE LYS A 94 10.207 5.786 6.459 1.00 63.43 C ATOM 1596 NZ LYS A 94 11.101 6.853 6.973 1.00 70.21 N ATOM 0 H LYS A 94 12.142 5.230 0.413 1.00 73.13 H new ATOM 0 HA LYS A 94 9.748 6.442 1.194 1.00 43.31 H new ATOM 0 HB2 LYS A 94 10.730 4.642 2.498 1.00 60.53 H new ATOM 0 HB3 LYS A 94 12.218 5.535 2.740 1.00 60.53 H new ATOM 0 HG2 LYS A 94 11.118 7.117 4.229 1.00 63.32 H new ATOM 0 HG3 LYS A 94 9.537 6.466 3.846 1.00 63.32 H new ATOM 0 HD2 LYS A 94 10.152 4.302 4.907 1.00 12.42 H new ATOM 0 HD3 LYS A 94 11.757 4.915 5.254 1.00 12.42 H new ATOM 0 HE2 LYS A 94 9.204 6.189 6.317 1.00 63.43 H new ATOM 0 HE3 LYS A 94 10.128 4.990 7.199 1.00 63.43 H new ATOM 0 HZ1 LYS A 94 10.528 7.647 7.324 1.00 70.21 H new ATOM 0 HZ2 LYS A 94 11.682 6.475 7.749 1.00 70.21 H new ATOM 0 HZ3 LYS A 94 11.721 7.186 6.207 1.00 70.21 H new ATOM 1610 N ARG A 95 12.407 8.391 1.645 1.00 42.13 N ATOM 1611 CA ARG A 95 12.843 9.783 1.949 1.00 21.13 C ATOM 1612 C ARG A 95 12.183 10.818 1.004 1.00 24.35 C ATOM 1613 O ARG A 95 11.926 11.963 1.403 1.00 44.35 O ATOM 1614 CB ARG A 95 14.389 9.908 1.882 1.00 70.44 C ATOM 1615 CG ARG A 95 15.004 9.564 0.501 1.00 3.32 C ATOM 1616 CD ARG A 95 16.511 9.852 0.409 1.00 43.44 C ATOM 1617 NE ARG A 95 16.812 11.294 0.531 1.00 40.11 N ATOM 1618 CZ ARG A 95 17.773 11.954 -0.148 1.00 11.45 C ATOM 1619 NH1 ARG A 95 18.558 11.319 -1.018 1.00 4.32 N ATOM 1620 NH2 ARG A 95 17.937 13.252 0.056 1.00 4.35 N ATOM 0 H ARG A 95 13.172 7.765 1.395 1.00 42.13 H new ATOM 0 HA ARG A 95 12.515 10.003 2.965 1.00 21.13 H new ATOM 0 HB2 ARG A 95 14.670 10.927 2.147 1.00 70.44 H new ATOM 0 HB3 ARG A 95 14.827 9.251 2.634 1.00 70.44 H new ATOM 0 HG2 ARG A 95 14.831 8.509 0.288 1.00 3.32 H new ATOM 0 HG3 ARG A 95 14.486 10.134 -0.270 1.00 3.32 H new ATOM 0 HD2 ARG A 95 17.032 9.306 1.195 1.00 43.44 H new ATOM 0 HD3 ARG A 95 16.893 9.482 -0.543 1.00 43.44 H new ATOM 0 HE ARG A 95 16.245 11.836 1.184 1.00 40.11 H new ATOM 0 HH11 ARG A 95 18.437 10.319 -1.179 1.00 4.32 H new ATOM 0 HH12 ARG A 95 19.280 11.833 -1.523 1.00 4.32 H new ATOM 0 HH21 ARG A 95 17.340 13.743 0.721 1.00 4.35 H new ATOM 0 HH22 ARG A 95 18.661 13.761 -0.452 1.00 4.35 H new ATOM 1634 N LYS A 96 11.903 10.386 -0.244 1.00 42.14 N ATOM 1635 CA LYS A 96 11.229 11.216 -1.260 1.00 54.20 C ATOM 1636 C LYS A 96 9.747 11.385 -0.900 1.00 34.11 C ATOM 1637 O LYS A 96 9.191 12.469 -1.046 1.00 51.42 O ATOM 1638 CB LYS A 96 11.369 10.577 -2.672 1.00 35.42 C ATOM 1639 CG LYS A 96 12.823 10.255 -3.095 1.00 1.34 C ATOM 1640 CD LYS A 96 13.804 11.465 -3.087 1.00 4.31 C ATOM 1641 CE LYS A 96 13.616 12.456 -4.262 1.00 42.22 C ATOM 1642 NZ LYS A 96 12.322 13.191 -4.219 1.00 65.10 N ATOM 0 H LYS A 96 12.139 9.450 -0.574 1.00 42.14 H new ATOM 0 HA LYS A 96 11.705 12.196 -1.278 1.00 54.20 H new ATOM 0 HB2 LYS A 96 10.785 9.657 -2.699 1.00 35.42 H new ATOM 0 HB3 LYS A 96 10.933 11.253 -3.407 1.00 35.42 H new ATOM 0 HG2 LYS A 96 13.215 9.486 -2.429 1.00 1.34 H new ATOM 0 HG3 LYS A 96 12.806 9.829 -4.098 1.00 1.34 H new ATOM 0 HD2 LYS A 96 13.684 12.007 -2.149 1.00 4.31 H new ATOM 0 HD3 LYS A 96 14.826 11.087 -3.108 1.00 4.31 H new ATOM 0 HE2 LYS A 96 14.434 13.176 -4.254 1.00 42.22 H new ATOM 0 HE3 LYS A 96 13.683 11.909 -5.202 1.00 42.22 H new ATOM 0 HZ1 LYS A 96 12.466 14.167 -4.547 1.00 65.10 H new ATOM 0 HZ2 LYS A 96 11.632 12.716 -4.836 1.00 65.10 H new ATOM 0 HZ3 LYS A 96 11.962 13.204 -3.243 1.00 65.10 H new ATOM 1656 N ILE A 97 9.139 10.289 -0.415 1.00 73.32 N ATOM 1657 CA ILE A 97 7.719 10.250 -0.012 1.00 33.02 C ATOM 1658 C ILE A 97 7.490 11.089 1.277 1.00 10.21 C ATOM 1659 O ILE A 97 6.429 11.702 1.451 1.00 3.12 O ATOM 1660 CB ILE A 97 7.227 8.760 0.182 1.00 24.02 C ATOM 1661 CG1 ILE A 97 7.576 7.878 -1.070 1.00 13.34 C ATOM 1662 CG2 ILE A 97 5.715 8.691 0.491 1.00 2.10 C ATOM 1663 CD1 ILE A 97 7.100 8.412 -2.419 1.00 30.10 C ATOM 0 H ILE A 97 9.620 9.398 -0.290 1.00 73.32 H new ATOM 0 HA ILE A 97 7.126 10.694 -0.812 1.00 33.02 H new ATOM 0 HB ILE A 97 7.760 8.358 1.043 1.00 24.02 H new ATOM 0 HG12 ILE A 97 8.658 7.754 -1.112 1.00 13.34 H new ATOM 0 HG13 ILE A 97 7.147 6.887 -0.922 1.00 13.34 H new ATOM 0 HG21 ILE A 97 5.417 7.650 0.617 1.00 2.10 H new ATOM 0 HG22 ILE A 97 5.505 9.242 1.408 1.00 2.10 H new ATOM 0 HG23 ILE A 97 5.155 9.132 -0.334 1.00 2.10 H new ATOM 0 HD11 ILE A 97 7.397 7.722 -3.209 1.00 30.10 H new ATOM 0 HD12 ILE A 97 6.014 8.508 -2.410 1.00 30.10 H new ATOM 0 HD13 ILE A 97 7.549 9.388 -2.603 1.00 30.10 H new ATOM 1675 N GLU A 98 8.498 11.104 2.171 1.00 31.42 N ATOM 1676 CA GLU A 98 8.524 11.987 3.361 1.00 13.11 C ATOM 1677 C GLU A 98 8.673 13.464 2.951 1.00 44.44 C ATOM 1678 O GLU A 98 8.135 14.355 3.619 1.00 53.31 O ATOM 1679 CB GLU A 98 9.676 11.573 4.312 1.00 21.44 C ATOM 1680 CG GLU A 98 9.566 10.134 4.844 1.00 21.42 C ATOM 1681 CD GLU A 98 10.741 9.735 5.741 1.00 61.54 C ATOM 1682 OE1 GLU A 98 11.780 9.275 5.219 1.00 51.12 O ATOM 1683 OE2 GLU A 98 10.631 9.863 6.982 1.00 71.14 O ATOM 0 H GLU A 98 9.320 10.505 2.091 1.00 31.42 H new ATOM 0 HA GLU A 98 7.576 11.876 3.887 1.00 13.11 H new ATOM 0 HB2 GLU A 98 10.624 11.683 3.786 1.00 21.44 H new ATOM 0 HB3 GLU A 98 9.699 12.261 5.157 1.00 21.44 H new ATOM 0 HG2 GLU A 98 8.637 10.030 5.404 1.00 21.42 H new ATOM 0 HG3 GLU A 98 9.509 9.445 4.002 1.00 21.42 H new ATOM 1690 N SER A 99 9.403 13.708 1.841 1.00 34.20 N ATOM 1691 CA SER A 99 9.545 15.053 1.240 1.00 25.53 C ATOM 1692 C SER A 99 8.232 15.485 0.549 1.00 32.50 C ATOM 1693 O SER A 99 7.997 16.678 0.355 1.00 62.42 O ATOM 1694 CB SER A 99 10.717 15.068 0.232 1.00 74.43 C ATOM 1695 OG SER A 99 10.955 16.374 -0.291 1.00 55.15 O ATOM 0 H SER A 99 9.910 12.980 1.337 1.00 34.20 H new ATOM 0 HA SER A 99 9.760 15.765 2.037 1.00 25.53 H new ATOM 0 HB2 SER A 99 11.620 14.703 0.721 1.00 74.43 H new ATOM 0 HB3 SER A 99 10.499 14.383 -0.588 1.00 74.43 H new ATOM 0 HG SER A 99 11.704 16.342 -0.923 1.00 55.15 H new ATOM 1701 N GLN A 100 7.403 14.492 0.160 1.00 1.52 N ATOM 1702 CA GLN A 100 6.030 14.722 -0.336 1.00 21.53 C ATOM 1703 C GLN A 100 5.058 14.941 0.852 1.00 5.33 C ATOM 1704 O GLN A 100 3.976 15.502 0.671 1.00 43.34 O ATOM 1705 CB GLN A 100 5.560 13.525 -1.206 1.00 63.40 C ATOM 1706 CG GLN A 100 6.420 13.243 -2.457 1.00 43.44 C ATOM 1707 CD GLN A 100 5.932 12.052 -3.296 1.00 1.52 C ATOM 1708 OE1 GLN A 100 4.741 11.753 -3.353 1.00 21.42 O ATOM 1709 NE2 GLN A 100 6.854 11.365 -3.957 1.00 32.33 N ATOM 0 H GLN A 100 7.668 13.507 0.181 1.00 1.52 H new ATOM 0 HA GLN A 100 6.031 15.619 -0.955 1.00 21.53 H new ATOM 0 HB2 GLN A 100 5.546 12.629 -0.585 1.00 63.40 H new ATOM 0 HB3 GLN A 100 4.534 13.709 -1.524 1.00 63.40 H new ATOM 0 HG2 GLN A 100 6.434 14.134 -3.084 1.00 43.44 H new ATOM 0 HG3 GLN A 100 7.448 13.057 -2.144 1.00 43.44 H new ATOM 0 HE21 GLN A 100 7.835 11.635 -3.892 1.00 32.33 H new ATOM 0 HE22 GLN A 100 6.582 10.567 -4.530 1.00 32.33 H new ATOM 1718 N GLY A 101 5.471 14.477 2.058 1.00 11.40 N ATOM 1719 CA GLY A 101 4.722 14.680 3.306 1.00 60.03 C ATOM 1720 C GLY A 101 3.665 13.610 3.550 1.00 5.14 C ATOM 1721 O GLY A 101 2.567 13.907 4.039 1.00 64.34 O ATOM 0 H GLY A 101 6.336 13.951 2.184 1.00 11.40 H new ATOM 0 HA2 GLY A 101 5.419 14.691 4.144 1.00 60.03 H new ATOM 0 HA3 GLY A 101 4.241 15.658 3.279 1.00 60.03 H new ATOM 1725 N TYR A 102 3.995 12.352 3.213 1.00 34.24 N ATOM 1726 CA TYR A 102 3.079 11.201 3.385 1.00 71.32 C ATOM 1727 C TYR A 102 3.580 10.264 4.485 1.00 42.41 C ATOM 1728 O TYR A 102 4.794 10.097 4.662 1.00 54.23 O ATOM 1729 CB TYR A 102 2.933 10.414 2.060 1.00 61.42 C ATOM 1730 CG TYR A 102 2.114 11.131 0.988 1.00 42.31 C ATOM 1731 CD1 TYR A 102 0.719 11.163 1.052 1.00 74.23 C ATOM 1732 CD2 TYR A 102 2.726 11.773 -0.084 1.00 64.44 C ATOM 1733 CE1 TYR A 102 -0.026 11.810 0.089 1.00 44.52 C ATOM 1734 CE2 TYR A 102 1.982 12.421 -1.047 1.00 25.34 C ATOM 1735 CZ TYR A 102 0.610 12.436 -0.956 1.00 63.11 C ATOM 1736 OH TYR A 102 -0.129 13.078 -1.918 1.00 3.51 O ATOM 0 H TYR A 102 4.900 12.100 2.815 1.00 34.24 H new ATOM 0 HA TYR A 102 2.105 11.594 3.674 1.00 71.32 H new ATOM 0 HB2 TYR A 102 3.927 10.207 1.663 1.00 61.42 H new ATOM 0 HB3 TYR A 102 2.468 9.451 2.272 1.00 61.42 H new ATOM 0 HD1 TYR A 102 0.215 10.672 1.871 1.00 74.23 H new ATOM 0 HD2 TYR A 102 3.803 11.764 -0.163 1.00 64.44 H new ATOM 0 HE1 TYR A 102 -1.104 11.825 0.156 1.00 44.52 H new ATOM 0 HE2 TYR A 102 2.475 12.916 -1.871 1.00 25.34 H new ATOM 0 HH TYR A 102 0.397 13.148 -2.742 1.00 3.51 H new ATOM 1746 N GLU A 103 2.618 9.661 5.214 1.00 24.05 N ATOM 1747 CA GLU A 103 2.878 8.604 6.194 1.00 5.34 C ATOM 1748 C GLU A 103 3.341 7.326 5.460 1.00 41.44 C ATOM 1749 O GLU A 103 2.535 6.611 4.848 1.00 71.22 O ATOM 1750 CB GLU A 103 1.602 8.331 7.043 1.00 50.23 C ATOM 1751 CG GLU A 103 1.765 7.258 8.146 1.00 3.22 C ATOM 1752 CD GLU A 103 2.831 7.613 9.199 1.00 31.14 C ATOM 1753 OE1 GLU A 103 2.566 8.488 10.051 1.00 41.31 O ATOM 1754 OE2 GLU A 103 3.932 7.024 9.188 1.00 72.44 O ATOM 0 H GLU A 103 1.630 9.902 5.132 1.00 24.05 H new ATOM 0 HA GLU A 103 3.669 8.923 6.873 1.00 5.34 H new ATOM 0 HB2 GLU A 103 1.288 9.265 7.510 1.00 50.23 H new ATOM 0 HB3 GLU A 103 0.798 8.023 6.374 1.00 50.23 H new ATOM 0 HG2 GLU A 103 0.807 7.114 8.645 1.00 3.22 H new ATOM 0 HG3 GLU A 103 2.028 6.308 7.681 1.00 3.22 H new ATOM 1761 N VAL A 104 4.654 7.095 5.492 1.00 11.30 N ATOM 1762 CA VAL A 104 5.312 5.944 4.868 1.00 1.01 C ATOM 1763 C VAL A 104 6.128 5.178 5.922 1.00 2.44 C ATOM 1764 O VAL A 104 6.876 5.775 6.707 1.00 45.21 O ATOM 1765 CB VAL A 104 6.215 6.392 3.655 1.00 53.30 C ATOM 1766 CG1 VAL A 104 7.131 7.584 4.012 1.00 41.32 C ATOM 1767 CG2 VAL A 104 7.034 5.206 3.091 1.00 30.52 C ATOM 0 H VAL A 104 5.307 7.719 5.965 1.00 11.30 H new ATOM 0 HA VAL A 104 4.548 5.277 4.468 1.00 1.01 H new ATOM 0 HB VAL A 104 5.539 6.735 2.872 1.00 53.30 H new ATOM 0 HG11 VAL A 104 7.732 7.854 3.144 1.00 41.32 H new ATOM 0 HG12 VAL A 104 6.520 8.436 4.309 1.00 41.32 H new ATOM 0 HG13 VAL A 104 7.788 7.304 4.835 1.00 41.32 H new ATOM 0 HG21 VAL A 104 7.645 5.550 2.256 1.00 30.52 H new ATOM 0 HG22 VAL A 104 7.680 4.805 3.873 1.00 30.52 H new ATOM 0 HG23 VAL A 104 6.355 4.426 2.746 1.00 30.52 H new ATOM 1777 N ARG A 105 5.945 3.848 5.958 1.00 74.13 N ATOM 1778 CA ARG A 105 6.655 2.956 6.889 1.00 25.11 C ATOM 1779 C ARG A 105 7.668 2.116 6.111 1.00 53.51 C ATOM 1780 O ARG A 105 7.430 1.782 4.949 1.00 71.35 O ATOM 1781 CB ARG A 105 5.663 2.018 7.637 1.00 43.01 C ATOM 1782 CG ARG A 105 4.463 2.711 8.314 1.00 62.40 C ATOM 1783 CD ARG A 105 4.851 3.930 9.168 1.00 35.22 C ATOM 1784 NE ARG A 105 5.859 3.630 10.200 1.00 61.31 N ATOM 1785 CZ ARG A 105 6.444 4.553 10.993 1.00 25.24 C ATOM 1786 NH1 ARG A 105 6.144 5.844 10.876 1.00 64.04 N ATOM 1787 NH2 ARG A 105 7.323 4.167 11.903 1.00 75.14 N ATOM 0 H ARG A 105 5.298 3.359 5.339 1.00 74.13 H new ATOM 0 HA ARG A 105 7.168 3.569 7.631 1.00 25.11 H new ATOM 0 HB2 ARG A 105 5.281 1.284 6.927 1.00 43.01 H new ATOM 0 HB3 ARG A 105 6.217 1.468 8.398 1.00 43.01 H new ATOM 0 HG2 ARG A 105 3.757 3.027 7.546 1.00 62.40 H new ATOM 0 HG3 ARG A 105 3.946 1.988 8.944 1.00 62.40 H new ATOM 0 HD2 ARG A 105 5.234 4.714 8.515 1.00 35.22 H new ATOM 0 HD3 ARG A 105 3.957 4.325 9.650 1.00 35.22 H new ATOM 0 HE ARG A 105 6.134 2.656 10.324 1.00 61.31 H new ATOM 0 HH11 ARG A 105 5.463 6.148 10.180 1.00 64.04 H new ATOM 0 HH12 ARG A 105 6.594 6.529 11.483 1.00 64.04 H new ATOM 0 HH21 ARG A 105 7.554 3.178 12.002 1.00 75.14 H new ATOM 0 HH22 ARG A 105 7.770 4.858 12.506 1.00 75.14 H new ATOM 1801 N LYS A 106 8.779 1.765 6.770 1.00 31.44 N ATOM 1802 CA LYS A 106 9.851 0.951 6.175 1.00 40.53 C ATOM 1803 C LYS A 106 10.255 -0.149 7.143 1.00 44.34 C ATOM 1804 O LYS A 106 10.510 0.129 8.322 1.00 64.40 O ATOM 1805 CB LYS A 106 11.075 1.827 5.838 1.00 13.32 C ATOM 1806 CG LYS A 106 12.241 1.078 5.161 1.00 34.41 C ATOM 1807 CD LYS A 106 13.381 2.023 4.721 1.00 30.35 C ATOM 1808 CE LYS A 106 14.152 2.640 5.890 1.00 20.24 C ATOM 1809 NZ LYS A 106 14.758 1.607 6.764 1.00 44.41 N ATOM 0 H LYS A 106 8.962 2.038 7.736 1.00 31.44 H new ATOM 0 HA LYS A 106 9.480 0.505 5.252 1.00 40.53 H new ATOM 0 HB2 LYS A 106 10.754 2.638 5.184 1.00 13.32 H new ATOM 0 HB3 LYS A 106 11.441 2.284 6.757 1.00 13.32 H new ATOM 0 HG2 LYS A 106 12.638 0.333 5.851 1.00 34.41 H new ATOM 0 HG3 LYS A 106 11.865 0.539 4.291 1.00 34.41 H new ATOM 0 HD2 LYS A 106 14.077 1.470 4.090 1.00 30.35 H new ATOM 0 HD3 LYS A 106 12.963 2.823 4.110 1.00 30.35 H new ATOM 0 HE2 LYS A 106 14.935 3.292 5.504 1.00 20.24 H new ATOM 0 HE3 LYS A 106 13.479 3.264 6.479 1.00 20.24 H new ATOM 0 HZ1 LYS A 106 15.628 1.982 7.193 1.00 44.41 H new ATOM 0 HZ2 LYS A 106 14.086 1.349 7.514 1.00 44.41 H new ATOM 0 HZ3 LYS A 106 14.986 0.764 6.199 1.00 44.41 H new ATOM 1823 N VAL A 107 10.303 -1.398 6.651 1.00 43.45 N ATOM 1824 CA VAL A 107 10.712 -2.564 7.449 1.00 40.51 C ATOM 1825 C VAL A 107 11.568 -3.515 6.591 1.00 12.04 C ATOM 1826 O VAL A 107 11.563 -3.431 5.361 1.00 22.20 O ATOM 1827 CB VAL A 107 9.479 -3.327 8.068 1.00 72.12 C ATOM 1828 CG1 VAL A 107 8.644 -2.417 8.997 1.00 14.34 C ATOM 1829 CG2 VAL A 107 8.586 -3.954 6.991 1.00 72.11 C ATOM 0 H VAL A 107 10.059 -1.627 5.688 1.00 43.45 H new ATOM 0 HA VAL A 107 11.309 -2.199 8.285 1.00 40.51 H new ATOM 0 HB VAL A 107 9.894 -4.136 8.670 1.00 72.12 H new ATOM 0 HG11 VAL A 107 7.805 -2.983 9.402 1.00 14.34 H new ATOM 0 HG12 VAL A 107 9.270 -2.060 9.815 1.00 14.34 H new ATOM 0 HG13 VAL A 107 8.268 -1.565 8.430 1.00 14.34 H new ATOM 0 HG21 VAL A 107 7.750 -4.468 7.465 1.00 72.11 H new ATOM 0 HG22 VAL A 107 8.205 -3.172 6.334 1.00 72.11 H new ATOM 0 HG23 VAL A 107 9.167 -4.668 6.407 1.00 72.11 H new ATOM 1839 N THR A 108 12.299 -4.406 7.266 1.00 11.11 N ATOM 1840 CA THR A 108 13.235 -5.352 6.627 1.00 2.20 C ATOM 1841 C THR A 108 12.593 -6.749 6.589 1.00 2.55 C ATOM 1842 O THR A 108 12.503 -7.381 5.532 1.00 45.33 O ATOM 1843 CB THR A 108 14.587 -5.393 7.419 1.00 13.43 C ATOM 1844 OG1 THR A 108 15.043 -4.050 7.658 1.00 11.11 O ATOM 1845 CG2 THR A 108 15.689 -6.183 6.681 1.00 64.00 C ATOM 0 H THR A 108 12.262 -4.497 8.281 1.00 11.11 H new ATOM 0 HA THR A 108 13.446 -5.025 5.609 1.00 2.20 H new ATOM 0 HB THR A 108 14.393 -5.909 8.359 1.00 13.43 H new ATOM 0 HG1 THR A 108 15.456 -3.695 6.843 1.00 11.11 H new ATOM 0 HG21 THR A 108 16.602 -6.177 7.277 1.00 64.00 H new ATOM 0 HG22 THR A 108 15.361 -7.211 6.530 1.00 64.00 H new ATOM 0 HG23 THR A 108 15.884 -5.719 5.714 1.00 64.00 H new ATOM 1853 N ASP A 109 12.139 -7.199 7.770 1.00 63.13 N ATOM 1854 CA ASP A 109 11.438 -8.476 7.951 1.00 3.22 C ATOM 1855 C ASP A 109 9.983 -8.351 7.493 1.00 43.23 C ATOM 1856 O ASP A 109 9.345 -7.305 7.679 1.00 72.14 O ATOM 1857 CB ASP A 109 11.467 -8.911 9.440 1.00 2.31 C ATOM 1858 CG ASP A 109 12.862 -9.304 9.935 1.00 53.42 C ATOM 1859 OD1 ASP A 109 13.739 -8.420 10.028 1.00 54.32 O ATOM 1860 OD2 ASP A 109 13.096 -10.500 10.246 1.00 61.42 O ATOM 0 H ASP A 109 12.252 -6.676 8.638 1.00 63.13 H new ATOM 0 HA ASP A 109 11.947 -9.228 7.349 1.00 3.22 H new ATOM 0 HB2 ASP A 109 11.088 -8.095 10.056 1.00 2.31 H new ATOM 0 HB3 ASP A 109 10.791 -9.755 9.577 1.00 2.31 H new ATOM 1865 N ASP A 110 9.471 -9.446 6.914 1.00 24.21 N ATOM 1866 CA ASP A 110 8.078 -9.556 6.455 1.00 31.22 C ATOM 1867 C ASP A 110 7.096 -9.499 7.650 1.00 42.45 C ATOM 1868 O ASP A 110 5.960 -9.039 7.502 1.00 12.32 O ATOM 1869 CB ASP A 110 7.883 -10.878 5.643 1.00 22.31 C ATOM 1870 CG ASP A 110 7.659 -12.132 6.517 1.00 10.33 C ATOM 1871 OD1 ASP A 110 8.626 -12.614 7.137 1.00 2.21 O ATOM 1872 OD2 ASP A 110 6.511 -12.620 6.607 1.00 33.44 O ATOM 0 H ASP A 110 10.019 -10.291 6.749 1.00 24.21 H new ATOM 0 HA ASP A 110 7.861 -8.710 5.803 1.00 31.22 H new ATOM 0 HB2 ASP A 110 7.030 -10.758 4.975 1.00 22.31 H new ATOM 0 HB3 ASP A 110 8.760 -11.038 5.016 1.00 22.31 H new ATOM 1877 N GLU A 111 7.561 -9.987 8.829 1.00 73.42 N ATOM 1878 CA GLU A 111 6.755 -10.033 10.071 1.00 61.00 C ATOM 1879 C GLU A 111 6.357 -8.621 10.537 1.00 52.34 C ATOM 1880 O GLU A 111 5.230 -8.411 11.008 1.00 32.10 O ATOM 1881 CB GLU A 111 7.522 -10.784 11.205 1.00 24.23 C ATOM 1882 CG GLU A 111 8.800 -10.072 11.710 1.00 53.21 C ATOM 1883 CD GLU A 111 9.467 -10.747 12.920 1.00 72.25 C ATOM 1884 OE1 GLU A 111 8.809 -10.876 13.971 1.00 63.02 O ATOM 1885 OE2 GLU A 111 10.651 -11.147 12.831 1.00 44.23 O ATOM 0 H GLU A 111 8.504 -10.358 8.942 1.00 73.42 H new ATOM 0 HA GLU A 111 5.841 -10.583 9.847 1.00 61.00 H new ATOM 0 HB2 GLU A 111 6.846 -10.927 12.048 1.00 24.23 H new ATOM 0 HB3 GLU A 111 7.795 -11.776 10.844 1.00 24.23 H new ATOM 0 HG2 GLU A 111 9.521 -10.023 10.894 1.00 53.21 H new ATOM 0 HG3 GLU A 111 8.548 -9.045 11.975 1.00 53.21 H new ATOM 1892 N GLU A 112 7.289 -7.663 10.378 1.00 24.34 N ATOM 1893 CA GLU A 112 7.103 -6.263 10.791 1.00 52.32 C ATOM 1894 C GLU A 112 6.024 -5.593 9.929 1.00 33.32 C ATOM 1895 O GLU A 112 5.220 -4.796 10.430 1.00 44.23 O ATOM 1896 CB GLU A 112 8.424 -5.483 10.647 1.00 5.44 C ATOM 1897 CG GLU A 112 9.645 -6.043 11.393 1.00 1.11 C ATOM 1898 CD GLU A 112 10.914 -5.210 11.116 1.00 74.12 C ATOM 1899 OE1 GLU A 112 11.607 -5.476 10.115 1.00 53.54 O ATOM 1900 OE2 GLU A 112 11.202 -4.254 11.869 1.00 31.11 O ATOM 0 H GLU A 112 8.200 -7.843 9.955 1.00 24.34 H new ATOM 0 HA GLU A 112 6.790 -6.253 11.835 1.00 52.32 H new ATOM 0 HB2 GLU A 112 8.671 -5.426 9.587 1.00 5.44 H new ATOM 0 HB3 GLU A 112 8.255 -4.462 10.990 1.00 5.44 H new ATOM 0 HG2 GLU A 112 9.444 -6.054 12.464 1.00 1.11 H new ATOM 0 HG3 GLU A 112 9.814 -7.076 11.090 1.00 1.11 H new ATOM 1907 N ALA A 113 6.032 -5.938 8.624 1.00 72.42 N ATOM 1908 CA ALA A 113 5.027 -5.470 7.661 1.00 63.34 C ATOM 1909 C ALA A 113 3.629 -5.955 8.068 1.00 5.43 C ATOM 1910 O ALA A 113 2.683 -5.176 8.058 1.00 20.23 O ATOM 1911 CB ALA A 113 5.381 -5.935 6.239 1.00 34.13 C ATOM 0 H ALA A 113 6.738 -6.549 8.214 1.00 72.42 H new ATOM 0 HA ALA A 113 5.023 -4.380 7.666 1.00 63.34 H new ATOM 0 HB1 ALA A 113 4.624 -5.578 5.540 1.00 34.13 H new ATOM 0 HB2 ALA A 113 6.354 -5.533 5.956 1.00 34.13 H new ATOM 0 HB3 ALA A 113 5.416 -7.024 6.211 1.00 34.13 H new ATOM 1917 N LEU A 114 3.539 -7.235 8.494 1.00 65.01 N ATOM 1918 CA LEU A 114 2.273 -7.870 8.925 1.00 30.24 C ATOM 1919 C LEU A 114 1.734 -7.222 10.212 1.00 72.22 C ATOM 1920 O LEU A 114 0.510 -7.128 10.398 1.00 41.14 O ATOM 1921 CB LEU A 114 2.488 -9.389 9.145 1.00 52.44 C ATOM 1922 CG LEU A 114 2.802 -10.224 7.868 1.00 35.20 C ATOM 1923 CD1 LEU A 114 3.160 -11.683 8.231 1.00 34.23 C ATOM 1924 CD2 LEU A 114 1.624 -10.161 6.864 1.00 2.22 C ATOM 0 H LEU A 114 4.344 -7.858 8.549 1.00 65.01 H new ATOM 0 HA LEU A 114 1.535 -7.721 8.137 1.00 30.24 H new ATOM 0 HB2 LEU A 114 3.306 -9.522 9.853 1.00 52.44 H new ATOM 0 HB3 LEU A 114 1.593 -9.799 9.613 1.00 52.44 H new ATOM 0 HG LEU A 114 3.674 -9.785 7.383 1.00 35.20 H new ATOM 0 HD11 LEU A 114 3.374 -12.242 7.320 1.00 34.23 H new ATOM 0 HD12 LEU A 114 4.037 -11.692 8.878 1.00 34.23 H new ATOM 0 HD13 LEU A 114 2.321 -12.145 8.751 1.00 34.23 H new ATOM 0 HD21 LEU A 114 1.867 -10.752 5.981 1.00 2.22 H new ATOM 0 HD22 LEU A 114 0.725 -10.562 7.332 1.00 2.22 H new ATOM 0 HD23 LEU A 114 1.450 -9.125 6.572 1.00 2.22 H new ATOM 1936 N LYS A 115 2.663 -6.784 11.097 1.00 55.42 N ATOM 1937 CA LYS A 115 2.308 -6.045 12.319 1.00 70.40 C ATOM 1938 C LYS A 115 1.618 -4.725 11.944 1.00 15.11 C ATOM 1939 O LYS A 115 0.539 -4.440 12.442 1.00 60.40 O ATOM 1940 CB LYS A 115 3.554 -5.764 13.213 1.00 50.24 C ATOM 1941 CG LYS A 115 3.243 -4.906 14.477 1.00 71.55 C ATOM 1942 CD LYS A 115 4.484 -4.559 15.350 1.00 30.34 C ATOM 1943 CE LYS A 115 4.945 -5.695 16.293 1.00 22.23 C ATOM 1944 NZ LYS A 115 5.422 -6.911 15.575 1.00 14.23 N ATOM 0 H LYS A 115 3.665 -6.934 10.980 1.00 55.42 H new ATOM 0 HA LYS A 115 1.625 -6.666 12.898 1.00 70.40 H new ATOM 0 HB2 LYS A 115 3.985 -6.714 13.528 1.00 50.24 H new ATOM 0 HB3 LYS A 115 4.310 -5.253 12.616 1.00 50.24 H new ATOM 0 HG2 LYS A 115 2.767 -3.978 14.161 1.00 71.55 H new ATOM 0 HG3 LYS A 115 2.520 -5.441 15.093 1.00 71.55 H new ATOM 0 HD2 LYS A 115 5.311 -4.292 14.692 1.00 30.34 H new ATOM 0 HD3 LYS A 115 4.256 -3.677 15.949 1.00 30.34 H new ATOM 0 HE2 LYS A 115 5.746 -5.323 16.932 1.00 22.23 H new ATOM 0 HE3 LYS A 115 4.118 -5.971 16.947 1.00 22.23 H new ATOM 0 HZ1 LYS A 115 6.158 -7.381 16.140 1.00 14.23 H new ATOM 0 HZ2 LYS A 115 4.626 -7.564 15.431 1.00 14.23 H new ATOM 0 HZ3 LYS A 115 5.816 -6.637 14.652 1.00 14.23 H new ATOM 1958 N ILE A 116 2.248 -3.966 11.020 1.00 60.53 N ATOM 1959 CA ILE A 116 1.781 -2.622 10.605 1.00 25.42 C ATOM 1960 C ILE A 116 0.472 -2.707 9.776 1.00 22.34 C ATOM 1961 O ILE A 116 -0.350 -1.784 9.824 1.00 33.44 O ATOM 1962 CB ILE A 116 2.912 -1.850 9.818 1.00 34.24 C ATOM 1963 CG1 ILE A 116 4.194 -1.709 10.710 1.00 12.23 C ATOM 1964 CG2 ILE A 116 2.433 -0.452 9.327 1.00 55.02 C ATOM 1965 CD1 ILE A 116 5.389 -1.083 10.012 1.00 34.44 C ATOM 0 H ILE A 116 3.096 -4.267 10.540 1.00 60.53 H new ATOM 0 HA ILE A 116 1.556 -2.055 11.508 1.00 25.42 H new ATOM 0 HB ILE A 116 3.155 -2.438 8.933 1.00 34.24 H new ATOM 0 HG12 ILE A 116 3.946 -1.108 11.585 1.00 12.23 H new ATOM 0 HG13 ILE A 116 4.479 -2.697 11.072 1.00 12.23 H new ATOM 0 HG21 ILE A 116 3.243 0.043 8.791 1.00 55.02 H new ATOM 0 HG22 ILE A 116 1.579 -0.573 8.661 1.00 55.02 H new ATOM 0 HG23 ILE A 116 2.142 0.155 10.184 1.00 55.02 H new ATOM 0 HD11 ILE A 116 6.227 -1.027 10.706 1.00 34.44 H new ATOM 0 HD12 ILE A 116 5.669 -1.693 9.153 1.00 34.44 H new ATOM 0 HD13 ILE A 116 5.129 -0.080 9.675 1.00 34.44 H new ATOM 1977 N VAL A 117 0.285 -3.823 9.036 1.00 21.00 N ATOM 1978 CA VAL A 117 -0.989 -4.135 8.353 1.00 11.34 C ATOM 1979 C VAL A 117 -2.128 -4.222 9.403 1.00 24.10 C ATOM 1980 O VAL A 117 -3.177 -3.590 9.235 1.00 41.21 O ATOM 1981 CB VAL A 117 -0.886 -5.476 7.502 1.00 13.53 C ATOM 1982 CG1 VAL A 117 -2.265 -5.965 6.994 1.00 74.10 C ATOM 1983 CG2 VAL A 117 0.089 -5.310 6.306 1.00 31.41 C ATOM 0 H VAL A 117 1.009 -4.528 8.896 1.00 21.00 H new ATOM 0 HA VAL A 117 -1.213 -3.333 7.649 1.00 11.34 H new ATOM 0 HB VAL A 117 -0.494 -6.236 8.178 1.00 13.53 H new ATOM 0 HG11 VAL A 117 -2.137 -6.883 6.420 1.00 74.10 H new ATOM 0 HG12 VAL A 117 -2.919 -6.158 7.845 1.00 74.10 H new ATOM 0 HG13 VAL A 117 -2.711 -5.199 6.360 1.00 74.10 H new ATOM 0 HG21 VAL A 117 0.138 -6.243 5.744 1.00 31.41 H new ATOM 0 HG22 VAL A 117 -0.267 -4.512 5.654 1.00 31.41 H new ATOM 0 HG23 VAL A 117 1.082 -5.058 6.678 1.00 31.41 H new ATOM 1993 N ARG A 118 -1.872 -4.960 10.511 1.00 44.13 N ATOM 1994 CA ARG A 118 -2.844 -5.115 11.618 1.00 11.03 C ATOM 1995 C ARG A 118 -3.015 -3.791 12.413 1.00 75.33 C ATOM 1996 O ARG A 118 -4.132 -3.459 12.833 1.00 52.21 O ATOM 1997 CB ARG A 118 -2.445 -6.284 12.568 1.00 54.34 C ATOM 1998 CG ARG A 118 -2.497 -7.698 11.925 1.00 74.01 C ATOM 1999 CD ARG A 118 -2.451 -8.837 12.975 1.00 43.53 C ATOM 2000 NE ARG A 118 -3.611 -8.780 13.897 1.00 74.12 N ATOM 2001 CZ ARG A 118 -3.909 -9.678 14.868 1.00 43.24 C ATOM 2002 NH1 ARG A 118 -3.152 -10.752 15.088 1.00 64.52 N ATOM 2003 NH2 ARG A 118 -4.976 -9.471 15.628 1.00 35.43 N ATOM 0 H ARG A 118 -0.995 -5.459 10.661 1.00 44.13 H new ATOM 0 HA ARG A 118 -3.806 -5.363 11.169 1.00 11.03 H new ATOM 0 HB2 ARG A 118 -1.435 -6.105 12.936 1.00 54.34 H new ATOM 0 HB3 ARG A 118 -3.106 -6.270 13.434 1.00 54.34 H new ATOM 0 HG2 ARG A 118 -3.409 -7.791 11.335 1.00 74.01 H new ATOM 0 HG3 ARG A 118 -1.659 -7.810 11.237 1.00 74.01 H new ATOM 0 HD2 ARG A 118 -2.438 -9.801 12.466 1.00 43.53 H new ATOM 0 HD3 ARG A 118 -1.527 -8.766 13.548 1.00 43.53 H new ATOM 0 HE ARG A 118 -4.246 -7.989 13.790 1.00 74.12 H new ATOM 0 HH11 ARG A 118 -2.322 -10.916 14.518 1.00 64.52 H new ATOM 0 HH12 ARG A 118 -3.402 -11.410 15.826 1.00 64.52 H new ATOM 0 HH21 ARG A 118 -5.557 -8.647 15.477 1.00 35.43 H new ATOM 0 HH22 ARG A 118 -5.215 -10.136 16.363 1.00 35.43 H new ATOM 2017 N GLU A 119 -1.902 -3.052 12.617 1.00 3.02 N ATOM 2018 CA GLU A 119 -1.906 -1.731 13.286 1.00 1.52 C ATOM 2019 C GLU A 119 -2.787 -0.723 12.544 1.00 61.23 C ATOM 2020 O GLU A 119 -3.513 0.049 13.177 1.00 74.43 O ATOM 2021 CB GLU A 119 -0.462 -1.163 13.420 1.00 3.11 C ATOM 2022 CG GLU A 119 0.441 -1.922 14.405 1.00 32.31 C ATOM 2023 CD GLU A 119 -0.107 -1.919 15.846 1.00 10.41 C ATOM 2024 OE1 GLU A 119 -0.089 -0.847 16.487 1.00 33.33 O ATOM 2025 OE2 GLU A 119 -0.557 -2.979 16.336 1.00 72.01 O ATOM 0 H GLU A 119 -0.974 -3.355 12.322 1.00 3.02 H new ATOM 0 HA GLU A 119 -2.321 -1.885 14.282 1.00 1.52 H new ATOM 0 HB2 GLU A 119 0.009 -1.171 12.437 1.00 3.11 H new ATOM 0 HB3 GLU A 119 -0.524 -0.121 13.735 1.00 3.11 H new ATOM 0 HG2 GLU A 119 0.554 -2.952 14.067 1.00 32.31 H new ATOM 0 HG3 GLU A 119 1.435 -1.474 14.399 1.00 32.31 H new ATOM 2032 N PHE A 120 -2.715 -0.756 11.199 1.00 5.40 N ATOM 2033 CA PHE A 120 -3.506 0.126 10.326 1.00 53.02 C ATOM 2034 C PHE A 120 -5.005 -0.093 10.552 1.00 51.21 C ATOM 2035 O PHE A 120 -5.769 0.852 10.530 1.00 3.12 O ATOM 2036 CB PHE A 120 -3.151 -0.110 8.831 1.00 43.41 C ATOM 2037 CG PHE A 120 -3.968 0.751 7.851 1.00 3.42 C ATOM 2038 CD1 PHE A 120 -3.654 2.095 7.648 1.00 41.10 C ATOM 2039 CD2 PHE A 120 -5.068 0.223 7.161 1.00 62.13 C ATOM 2040 CE1 PHE A 120 -4.403 2.877 6.786 1.00 11.34 C ATOM 2041 CE2 PHE A 120 -5.817 1.010 6.306 1.00 52.44 C ATOM 2042 CZ PHE A 120 -5.481 2.336 6.118 1.00 1.40 C ATOM 0 H PHE A 120 -2.106 -1.396 10.689 1.00 5.40 H new ATOM 0 HA PHE A 120 -3.261 1.157 10.581 1.00 53.02 H new ATOM 0 HB2 PHE A 120 -2.091 0.096 8.683 1.00 43.41 H new ATOM 0 HB3 PHE A 120 -3.308 -1.162 8.592 1.00 43.41 H new ATOM 0 HD1 PHE A 120 -2.815 2.531 8.170 1.00 41.10 H new ATOM 0 HD2 PHE A 120 -5.334 -0.814 7.299 1.00 62.13 H new ATOM 0 HE1 PHE A 120 -4.142 3.914 6.636 1.00 11.34 H new ATOM 0 HE2 PHE A 120 -6.664 0.588 5.786 1.00 52.44 H new ATOM 0 HZ PHE A 120 -6.063 2.950 5.447 1.00 1.40 H new ATOM 2052 N MET A 121 -5.392 -1.354 10.799 1.00 51.34 N ATOM 2053 CA MET A 121 -6.809 -1.752 10.953 1.00 24.43 C ATOM 2054 C MET A 121 -7.533 -0.968 12.079 1.00 62.22 C ATOM 2055 O MET A 121 -8.746 -0.771 12.002 1.00 1.15 O ATOM 2056 CB MET A 121 -6.917 -3.277 11.201 1.00 52.21 C ATOM 2057 CG MET A 121 -6.199 -4.138 10.156 1.00 64.33 C ATOM 2058 SD MET A 121 -6.833 -3.902 8.485 1.00 52.42 S ATOM 2059 CE MET A 121 -5.721 -4.887 7.479 1.00 55.20 C ATOM 0 H MET A 121 -4.736 -2.129 10.898 1.00 51.34 H new ATOM 0 HA MET A 121 -7.312 -1.501 10.019 1.00 24.43 H new ATOM 0 HB2 MET A 121 -6.507 -3.503 12.185 1.00 52.21 H new ATOM 0 HB3 MET A 121 -7.970 -3.556 11.223 1.00 52.21 H new ATOM 0 HG2 MET A 121 -5.135 -3.903 10.170 1.00 64.33 H new ATOM 0 HG3 MET A 121 -6.298 -5.188 10.430 1.00 64.33 H new ATOM 0 HE1 MET A 121 -5.048 -4.229 6.929 1.00 55.20 H new ATOM 0 HE2 MET A 121 -5.138 -5.547 8.121 1.00 55.20 H new ATOM 0 HE3 MET A 121 -6.300 -5.484 6.775 1.00 55.20 H new ATOM 2069 N GLN A 122 -6.785 -0.538 13.122 1.00 1.41 N ATOM 2070 CA GLN A 122 -7.331 0.317 14.209 1.00 24.11 C ATOM 2071 C GLN A 122 -6.939 1.804 14.006 1.00 43.23 C ATOM 2072 O GLN A 122 -7.734 2.710 14.289 1.00 41.11 O ATOM 2073 CB GLN A 122 -6.891 -0.210 15.609 1.00 3.43 C ATOM 2074 CG GLN A 122 -5.373 -0.212 15.881 1.00 50.03 C ATOM 2075 CD GLN A 122 -5.007 -0.852 17.225 1.00 31.21 C ATOM 2076 OE1 GLN A 122 -4.753 -2.054 17.307 1.00 62.51 O ATOM 2077 NE2 GLN A 122 -5.010 -0.066 18.288 1.00 61.40 N ATOM 0 H GLN A 122 -5.798 -0.769 13.236 1.00 1.41 H new ATOM 0 HA GLN A 122 -8.419 0.262 14.166 1.00 24.11 H new ATOM 0 HB2 GLN A 122 -7.377 0.397 16.373 1.00 3.43 H new ATOM 0 HB3 GLN A 122 -7.263 -1.228 15.726 1.00 3.43 H new ATOM 0 HG2 GLN A 122 -4.866 -0.749 15.079 1.00 50.03 H new ATOM 0 HG3 GLN A 122 -5.004 0.814 15.861 1.00 50.03 H new ATOM 0 HE21 GLN A 122 -5.224 0.926 18.188 1.00 61.40 H new ATOM 0 HE22 GLN A 122 -4.798 -0.452 19.208 1.00 61.40 H new ATOM 2086 N LYS A 123 -5.714 2.038 13.492 1.00 44.34 N ATOM 2087 CA LYS A 123 -5.152 3.400 13.270 1.00 22.40 C ATOM 2088 C LYS A 123 -5.865 4.148 12.133 1.00 75.44 C ATOM 2089 O LYS A 123 -5.790 5.373 12.061 1.00 52.52 O ATOM 2090 CB LYS A 123 -3.626 3.320 12.967 1.00 41.02 C ATOM 2091 CG LYS A 123 -2.732 3.060 14.201 1.00 31.55 C ATOM 2092 CD LYS A 123 -1.227 2.981 13.836 1.00 12.32 C ATOM 2093 CE LYS A 123 -0.316 3.037 15.076 1.00 4.00 C ATOM 2094 NZ LYS A 123 -0.566 1.926 16.033 1.00 64.21 N ATOM 0 H LYS A 123 -5.079 1.289 13.216 1.00 44.34 H new ATOM 0 HA LYS A 123 -5.314 3.961 14.190 1.00 22.40 H new ATOM 0 HB2 LYS A 123 -3.456 2.527 12.239 1.00 41.02 H new ATOM 0 HB3 LYS A 123 -3.313 4.254 12.500 1.00 41.02 H new ATOM 0 HG2 LYS A 123 -2.885 3.855 14.931 1.00 31.55 H new ATOM 0 HG3 LYS A 123 -3.037 2.128 14.677 1.00 31.55 H new ATOM 0 HD2 LYS A 123 -1.037 2.057 13.291 1.00 12.32 H new ATOM 0 HD3 LYS A 123 -0.975 3.804 13.167 1.00 12.32 H new ATOM 0 HE2 LYS A 123 0.726 3.006 14.756 1.00 4.00 H new ATOM 0 HE3 LYS A 123 -0.465 3.989 15.586 1.00 4.00 H new ATOM 0 HZ1 LYS A 123 0.028 2.055 16.877 1.00 64.21 H new ATOM 0 HZ2 LYS A 123 -1.568 1.926 16.311 1.00 64.21 H new ATOM 0 HZ3 LYS A 123 -0.333 1.019 15.581 1.00 64.21 H new ATOM 2108 N ALA A 124 -6.534 3.397 11.250 1.00 54.52 N ATOM 2109 CA ALA A 124 -7.271 3.954 10.112 1.00 61.42 C ATOM 2110 C ALA A 124 -8.555 4.634 10.595 1.00 41.41 C ATOM 2111 O ALA A 124 -9.027 5.587 9.973 1.00 13.42 O ATOM 2112 CB ALA A 124 -7.586 2.849 9.101 1.00 71.33 C ATOM 0 H ALA A 124 -6.579 2.380 11.306 1.00 54.52 H new ATOM 0 HA ALA A 124 -6.653 4.705 9.620 1.00 61.42 H new ATOM 0 HB1 ALA A 124 -8.134 3.272 8.259 1.00 71.33 H new ATOM 0 HB2 ALA A 124 -6.656 2.407 8.744 1.00 71.33 H new ATOM 0 HB3 ALA A 124 -8.193 2.080 9.579 1.00 71.33 H new ATOM 2118 N GLY A 125 -9.103 4.123 11.722 1.00 52.00 N ATOM 2119 CA GLY A 125 -10.262 4.714 12.388 1.00 75.21 C ATOM 2120 C GLY A 125 -9.871 5.895 13.263 1.00 50.44 C ATOM 2121 O GLY A 125 -10.106 5.895 14.476 1.00 65.44 O ATOM 0 H GLY A 125 -8.746 3.288 12.187 1.00 52.00 H new ATOM 0 HA2 GLY A 125 -10.984 5.040 11.639 1.00 75.21 H new ATOM 0 HA3 GLY A 125 -10.755 3.957 12.998 1.00 75.21 H new ATOM 2125 N SER A 126 -9.235 6.896 12.639 1.00 31.32 N ATOM 2126 CA SER A 126 -8.825 8.138 13.293 1.00 70.23 C ATOM 2127 C SER A 126 -9.991 9.134 13.320 1.00 75.04 C ATOM 2128 O SER A 126 -10.924 9.037 12.504 1.00 75.03 O ATOM 2129 CB SER A 126 -7.644 8.757 12.521 1.00 72.40 C ATOM 2130 OG SER A 126 -6.506 7.923 12.529 1.00 72.21 O ATOM 0 H SER A 126 -8.989 6.861 11.650 1.00 31.32 H new ATOM 0 HA SER A 126 -8.524 7.916 14.317 1.00 70.23 H new ATOM 0 HB2 SER A 126 -7.945 8.947 11.491 1.00 72.40 H new ATOM 0 HB3 SER A 126 -7.389 9.721 12.962 1.00 72.40 H new ATOM 0 HG SER A 126 -6.753 7.030 12.211 1.00 72.21 H new ATOM 2136 N LEU A 127 -9.922 10.090 14.257 1.00 3.31 N ATOM 2137 CA LEU A 127 -10.855 11.219 14.323 1.00 33.53 C ATOM 2138 C LEU A 127 -10.503 12.160 13.154 1.00 72.11 C ATOM 2139 O LEU A 127 -9.659 13.058 13.302 1.00 14.32 O ATOM 2140 CB LEU A 127 -10.750 11.929 15.718 1.00 21.12 C ATOM 2141 CG LEU A 127 -11.965 12.819 16.189 1.00 21.11 C ATOM 2142 CD1 LEU A 127 -11.745 13.335 17.627 1.00 62.24 C ATOM 2143 CD2 LEU A 127 -12.272 13.998 15.233 1.00 64.31 C ATOM 0 H LEU A 127 -9.215 10.100 14.992 1.00 3.31 H new ATOM 0 HA LEU A 127 -11.891 10.893 14.228 1.00 33.53 H new ATOM 0 HB2 LEU A 127 -10.587 11.160 16.473 1.00 21.12 H new ATOM 0 HB3 LEU A 127 -9.860 12.558 15.707 1.00 21.12 H new ATOM 0 HG LEU A 127 -12.839 12.168 16.170 1.00 21.11 H new ATOM 0 HD11 LEU A 127 -12.596 13.946 17.929 1.00 62.24 H new ATOM 0 HD12 LEU A 127 -11.647 12.488 18.306 1.00 62.24 H new ATOM 0 HD13 LEU A 127 -10.836 13.936 17.663 1.00 62.24 H new ATOM 0 HD21 LEU A 127 -13.118 14.567 15.618 1.00 64.31 H new ATOM 0 HD22 LEU A 127 -11.399 14.647 15.164 1.00 64.31 H new ATOM 0 HD23 LEU A 127 -12.515 13.610 14.244 1.00 64.31 H new ATOM 2155 N GLU A 128 -11.089 11.880 11.977 1.00 11.03 N ATOM 2156 CA GLU A 128 -10.902 12.685 10.768 1.00 4.22 C ATOM 2157 C GLU A 128 -11.635 14.016 10.923 1.00 20.31 C ATOM 2158 O GLU A 128 -12.842 14.117 10.662 1.00 13.52 O ATOM 2159 CB GLU A 128 -11.380 11.917 9.498 1.00 21.34 C ATOM 2160 CG GLU A 128 -10.601 10.622 9.194 1.00 32.14 C ATOM 2161 CD GLU A 128 -9.090 10.848 8.966 1.00 13.12 C ATOM 2162 OE1 GLU A 128 -8.673 11.115 7.814 1.00 72.01 O ATOM 2163 OE2 GLU A 128 -8.306 10.759 9.937 1.00 24.41 O ATOM 0 H GLU A 128 -11.709 11.082 11.842 1.00 11.03 H new ATOM 0 HA GLU A 128 -9.838 12.884 10.637 1.00 4.22 H new ATOM 0 HB2 GLU A 128 -12.435 11.670 9.615 1.00 21.34 H new ATOM 0 HB3 GLU A 128 -11.302 12.582 8.638 1.00 21.34 H new ATOM 0 HG2 GLU A 128 -10.735 9.925 10.021 1.00 32.14 H new ATOM 0 HG3 GLU A 128 -11.027 10.151 8.308 1.00 32.14 H new ATOM 2170 N HIS A 129 -10.905 15.008 11.441 1.00 71.33 N ATOM 2171 CA HIS A 129 -11.369 16.388 11.522 1.00 14.13 C ATOM 2172 C HIS A 129 -11.431 16.932 10.082 1.00 75.04 C ATOM 2173 O HIS A 129 -10.417 17.350 9.528 1.00 55.04 O ATOM 2174 CB HIS A 129 -10.421 17.208 12.434 1.00 23.15 C ATOM 2175 CG HIS A 129 -10.890 18.601 12.755 1.00 22.23 C ATOM 2176 ND1 HIS A 129 -11.909 18.864 13.645 1.00 73.41 N ATOM 2177 CD2 HIS A 129 -10.480 19.808 12.309 1.00 72.22 C ATOM 2178 CE1 HIS A 129 -12.090 20.161 13.738 1.00 5.24 C ATOM 2179 NE2 HIS A 129 -11.241 20.758 12.936 1.00 42.24 N ATOM 0 H HIS A 129 -9.967 14.870 11.818 1.00 71.33 H new ATOM 0 HA HIS A 129 -12.360 16.460 11.970 1.00 14.13 H new ATOM 0 HB2 HIS A 129 -10.281 16.664 13.368 1.00 23.15 H new ATOM 0 HB3 HIS A 129 -9.445 17.272 11.953 1.00 23.15 H new ATOM 0 HD2 HIS A 129 -9.696 19.990 11.590 1.00 72.22 H new ATOM 0 HE1 HIS A 129 -12.816 20.653 14.369 1.00 5.24 H new ATOM 0 HE2 HIS A 129 -11.161 21.766 12.801 1.00 42.24 H new ATOM 2188 N HIS A 130 -12.642 16.841 9.490 1.00 34.31 N ATOM 2189 CA HIS A 130 -12.898 17.026 8.046 1.00 54.43 C ATOM 2190 C HIS A 130 -12.450 18.419 7.557 1.00 73.33 C ATOM 2191 O HIS A 130 -11.908 18.554 6.457 1.00 21.33 O ATOM 2192 CB HIS A 130 -14.402 16.776 7.744 1.00 65.40 C ATOM 2193 CG HIS A 130 -14.739 16.622 6.280 1.00 43.51 C ATOM 2194 ND1 HIS A 130 -14.775 15.397 5.643 1.00 22.04 N ATOM 2195 CD2 HIS A 130 -15.041 17.539 5.327 1.00 32.05 C ATOM 2196 CE1 HIS A 130 -15.098 15.569 4.378 1.00 35.23 C ATOM 2197 NE2 HIS A 130 -15.259 16.855 4.160 1.00 41.12 N ATOM 0 H HIS A 130 -13.490 16.631 10.017 1.00 34.31 H new ATOM 0 HA HIS A 130 -12.303 16.297 7.496 1.00 54.43 H new ATOM 0 HB2 HIS A 130 -14.719 15.876 8.272 1.00 65.40 H new ATOM 0 HB3 HIS A 130 -14.982 17.605 8.150 1.00 65.40 H new ATOM 0 HD2 HIS A 130 -15.099 18.609 5.463 1.00 32.05 H new ATOM 0 HE1 HIS A 130 -15.211 14.785 3.644 1.00 35.23 H new ATOM 0 HE2 HIS A 130 -15.507 17.277 3.265 1.00 41.12 H new ATOM 2206 N HIS A 131 -12.686 19.444 8.399 1.00 34.24 N ATOM 2207 CA HIS A 131 -12.126 20.803 8.216 1.00 4.22 C ATOM 2208 C HIS A 131 -10.631 20.747 8.609 1.00 5.12 C ATOM 2209 O HIS A 131 -10.213 21.284 9.635 1.00 71.55 O ATOM 2210 CB HIS A 131 -12.929 21.814 9.086 1.00 31.20 C ATOM 2211 CG HIS A 131 -12.580 23.267 8.874 1.00 14.23 C ATOM 2212 ND1 HIS A 131 -11.629 23.926 9.621 1.00 4.41 N ATOM 2213 CD2 HIS A 131 -13.054 24.185 7.993 1.00 43.13 C ATOM 2214 CE1 HIS A 131 -11.550 25.175 9.227 1.00 13.42 C ATOM 2215 NE2 HIS A 131 -12.394 25.359 8.240 1.00 32.52 N ATOM 0 H HIS A 131 -13.272 19.355 9.229 1.00 34.24 H new ATOM 0 HA HIS A 131 -12.206 21.139 7.182 1.00 4.22 H new ATOM 0 HB2 HIS A 131 -13.991 21.679 8.883 1.00 31.20 H new ATOM 0 HB3 HIS A 131 -12.772 21.569 10.136 1.00 31.20 H new ATOM 0 HD1 HIS A 131 -11.072 23.508 10.366 1.00 4.41 H new ATOM 0 HD2 HIS A 131 -13.810 24.020 7.239 1.00 43.13 H new ATOM 0 HE1 HIS A 131 -10.898 25.927 9.646 1.00 13.42 H new ATOM 2224 N HIS A 132 -9.843 20.075 7.753 1.00 74.00 N ATOM 2225 CA HIS A 132 -8.558 19.447 8.130 1.00 54.12 C ATOM 2226 C HIS A 132 -7.427 20.464 8.364 1.00 24.21 C ATOM 2227 O HIS A 132 -6.429 20.143 9.027 1.00 74.22 O ATOM 2228 CB HIS A 132 -8.175 18.383 7.056 1.00 23.34 C ATOM 2229 CG HIS A 132 -7.301 17.256 7.557 1.00 2.13 C ATOM 2230 ND1 HIS A 132 -6.359 16.614 6.778 1.00 14.15 N ATOM 2231 CD2 HIS A 132 -7.294 16.610 8.744 1.00 14.33 C ATOM 2232 CE1 HIS A 132 -5.821 15.630 7.467 1.00 21.45 C ATOM 2233 NE2 HIS A 132 -6.368 15.607 8.659 1.00 61.44 N ATOM 0 H HIS A 132 -10.080 19.949 6.769 1.00 74.00 H new ATOM 0 HA HIS A 132 -8.694 18.956 9.094 1.00 54.12 H new ATOM 0 HB2 HIS A 132 -9.091 17.958 6.645 1.00 23.34 H new ATOM 0 HB3 HIS A 132 -7.661 18.885 6.236 1.00 23.34 H new ATOM 0 HD2 HIS A 132 -7.907 16.843 9.602 1.00 14.33 H new ATOM 0 HE1 HIS A 132 -5.057 14.955 7.111 1.00 21.45 H new ATOM 0 HE2 HIS A 132 -6.140 14.947 9.403 1.00 61.44 H new ATOM 2242 N HIS A 133 -7.589 21.683 7.829 1.00 24.12 N ATOM 2243 CA HIS A 133 -6.664 22.796 8.093 1.00 44.12 C ATOM 2244 C HIS A 133 -7.177 23.600 9.310 1.00 72.22 C ATOM 2245 O HIS A 133 -7.645 24.742 9.177 1.00 14.11 O ATOM 2246 CB HIS A 133 -6.496 23.680 6.823 1.00 73.34 C ATOM 2247 CG HIS A 133 -5.533 24.828 6.998 1.00 1.33 C ATOM 2248 ND1 HIS A 133 -5.879 26.147 6.782 1.00 53.43 N ATOM 2249 CD2 HIS A 133 -4.228 24.842 7.360 1.00 35.41 C ATOM 2250 CE1 HIS A 133 -4.836 26.915 7.027 1.00 32.01 C ATOM 2251 NE2 HIS A 133 -3.825 26.149 7.372 1.00 14.15 N ATOM 0 H HIS A 133 -8.359 21.925 7.205 1.00 24.12 H new ATOM 0 HA HIS A 133 -5.673 22.411 8.335 1.00 44.12 H new ATOM 0 HB2 HIS A 133 -6.153 23.054 6.000 1.00 73.34 H new ATOM 0 HB3 HIS A 133 -7.470 24.077 6.537 1.00 73.34 H new ATOM 0 HD2 HIS A 133 -3.619 23.982 7.595 1.00 35.41 H new ATOM 0 HE1 HIS A 133 -4.816 27.992 6.956 1.00 32.01 H new ATOM 0 HE2 HIS A 133 -2.889 26.477 7.611 1.00 14.15 H new ATOM 2260 N HIS A 134 -7.119 22.934 10.488 1.00 42.33 N ATOM 2261 CA HIS A 134 -7.519 23.480 11.801 1.00 14.13 C ATOM 2262 C HIS A 134 -9.003 23.964 11.792 1.00 20.52 C ATOM 2263 O HIS A 134 -9.266 25.157 11.513 1.00 53.22 O ATOM 2264 CB HIS A 134 -6.545 24.604 12.256 1.00 23.55 C ATOM 2265 CG HIS A 134 -6.825 25.132 13.649 1.00 50.41 C ATOM 2266 ND1 HIS A 134 -7.809 26.064 13.916 1.00 54.12 N ATOM 2267 CD2 HIS A 134 -6.282 24.822 14.851 1.00 21.43 C ATOM 2268 CE1 HIS A 134 -7.858 26.300 15.209 1.00 41.35 C ATOM 2269 NE2 HIS A 134 -6.945 25.562 15.802 1.00 30.54 N ATOM 2270 OXT HIS A 134 -9.905 23.145 12.032 1.00 37.82 O ATOM 0 H HIS A 134 -6.782 21.973 10.549 1.00 42.33 H new ATOM 0 HA HIS A 134 -7.454 22.674 12.532 1.00 14.13 H new ATOM 0 HB2 HIS A 134 -5.524 24.223 12.221 1.00 23.55 H new ATOM 0 HB3 HIS A 134 -6.602 25.430 11.547 1.00 23.55 H new ATOM 0 HD1 HIS A 134 -8.407 26.503 13.216 1.00 54.12 H new ATOM 0 HD2 HIS A 134 -5.478 24.123 15.029 1.00 21.43 H new ATOM 0 HE1 HIS A 134 -8.534 26.984 15.701 1.00 41.35 H new TER 2279 HIS A 134