USER MOD reduce.3.24.130724 H: found=0, std=0, add=782, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 785 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 120 HIS : no HE2:sc= -0.314 K(o=0.37,f=-0.21) USER MOD Set 1.2: A 124 SER OG : rot 85:sc= 0.68 USER MOD Set 2.1: A 117 LYS NZ :NH3+ -152:sc= 0.0784 (180deg=0) USER MOD Set 2.2: A 118 THR OG1 : rot 93:sc= 1.22 USER MOD Set 3.1: A 58 HIS : no HD1:sc= -0.171 K(o=-0.17,f=-0.74) USER MOD Set 3.2: A 79 MET CE :methyl -167:sc= 0 (180deg=-0.265) USER MOD Single : A 30 MET CE :methyl 172:sc= -0.116 (180deg=-0.292) USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= -0.435 X(o=-0.43,f=-0.58) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 167:sc= 0.752 (180deg=0.654) USER MOD Single : A 59 SER OG : rot 100:sc= 0.355 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 THR OG1 : rot 85:sc= 0.416 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 LYS NZ :NH3+ -161:sc= 0.671 (180deg=0.294) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 SER OG : rot 78:sc= 0.9 USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 97:sc= 0.786 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 MET CE :methyl -160:sc= 0 (180deg=-0.0627) USER MOD Single : A 132 SER OG : rot -64:sc= 1.25 USER MOD Single : A 134 TYR OH : rot 180:sc= -0.205 USER MOD Single : A 135 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 THR OG1 : rot 71:sc= 1.18 USER MOD Single : A 138 GLN : amide:sc= 0.0414 X(o=0.041,f=0) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 141 TYR OH : rot 15:sc= -0.313 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 27 -10.639 28.107 6.155 1.00 0.00 N ATOM 2 CA ASP A 27 -11.526 27.468 7.158 1.00 0.00 C ATOM 3 C ASP A 27 -12.245 26.201 6.583 1.00 0.00 C ATOM 4 O ASP A 27 -12.125 25.153 7.227 1.00 0.00 O ATOM 5 CB ASP A 27 -12.463 28.559 7.751 1.00 0.00 C ATOM 6 CG ASP A 27 -13.198 28.138 9.025 1.00 0.00 C ATOM 7 OD1 ASP A 27 -12.368 28.130 10.115 1.00 0.00 O ATOM 8 OD2 ASP A 27 -14.392 27.843 9.053 1.00 0.00 O ATOM 0 HA ASP A 27 -10.945 27.063 7.987 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -11.873 29.450 7.964 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -13.199 28.837 6.997 1.00 0.00 H new ATOM 15 N ARG A 28 -12.963 26.280 5.430 1.00 0.00 N ATOM 16 CA ARG A 28 -13.728 25.131 4.834 1.00 0.00 C ATOM 17 C ARG A 28 -12.882 23.961 4.245 1.00 0.00 C ATOM 18 O ARG A 28 -13.341 22.817 4.338 1.00 0.00 O ATOM 19 CB ARG A 28 -14.755 25.648 3.780 1.00 0.00 C ATOM 20 CG ARG A 28 -16.017 26.360 4.345 1.00 0.00 C ATOM 21 CD ARG A 28 -16.931 26.944 3.267 1.00 0.00 C ATOM 22 NE ARG A 28 -18.115 27.594 3.885 1.00 0.00 N ATOM 23 CZ ARG A 28 -18.884 28.570 3.339 1.00 0.00 C ATOM 24 NH1 ARG A 28 -18.711 29.129 2.133 1.00 0.00 N ATOM 25 NH2 ARG A 28 -19.896 29.011 4.064 1.00 0.00 N ATOM 0 H ARG A 28 -13.033 27.138 4.882 1.00 0.00 H new ATOM 0 HA ARG A 28 -14.238 24.683 5.687 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -14.242 26.339 3.112 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -15.081 24.802 3.175 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -16.586 25.649 4.944 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -15.702 27.161 5.014 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -16.380 27.671 2.670 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -17.255 26.154 2.589 1.00 0.00 H new ATOM 0 HE ARG A 28 -18.378 27.273 4.817 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -17.943 28.824 1.535 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -19.347 29.859 1.813 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -20.070 28.619 4.989 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -20.504 29.744 3.699 1.00 0.00 H new ATOM 39 N PHE A 29 -11.689 24.238 3.686 1.00 0.00 N ATOM 40 CA PHE A 29 -10.679 23.217 3.279 1.00 0.00 C ATOM 41 C PHE A 29 -10.087 22.335 4.424 1.00 0.00 C ATOM 42 O PHE A 29 -10.046 21.113 4.234 1.00 0.00 O ATOM 43 CB PHE A 29 -9.581 23.912 2.430 1.00 0.00 C ATOM 44 CG PHE A 29 -8.802 25.079 3.092 1.00 0.00 C ATOM 45 CD1 PHE A 29 -9.297 26.378 3.017 1.00 0.00 C ATOM 46 CD2 PHE A 29 -7.661 24.832 3.839 1.00 0.00 C ATOM 47 CE1 PHE A 29 -8.610 27.417 3.612 1.00 0.00 C ATOM 48 CE2 PHE A 29 -6.975 25.877 4.426 1.00 0.00 C ATOM 49 CZ PHE A 29 -7.444 27.169 4.306 1.00 0.00 C ATOM 0 H PHE A 29 -11.385 25.193 3.497 1.00 0.00 H new ATOM 0 HA PHE A 29 -11.213 22.478 2.681 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -8.859 23.154 2.126 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -10.047 24.291 1.520 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -10.220 26.573 2.492 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -7.307 23.819 3.962 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -8.986 28.426 3.534 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -6.069 25.682 4.981 1.00 0.00 H new ATOM 0 HZ PHE A 29 -6.898 27.986 4.755 1.00 0.00 H new ATOM 59 N MET A 30 -9.708 22.912 5.596 1.00 0.00 N ATOM 60 CA MET A 30 -9.344 22.141 6.828 1.00 0.00 C ATOM 61 C MET A 30 -10.544 21.370 7.466 1.00 0.00 C ATOM 62 O MET A 30 -10.319 20.229 7.878 1.00 0.00 O ATOM 63 CB MET A 30 -8.649 23.067 7.862 1.00 0.00 C ATOM 64 CG MET A 30 -7.272 23.637 7.466 1.00 0.00 C ATOM 65 SD MET A 30 -6.012 22.342 7.449 1.00 0.00 S ATOM 66 CE MET A 30 -5.400 22.352 9.143 1.00 0.00 C ATOM 0 H MET A 30 -9.645 23.923 5.719 1.00 0.00 H new ATOM 0 HA MET A 30 -8.641 21.370 6.513 1.00 0.00 H new ATOM 0 HB2 MET A 30 -9.316 23.903 8.072 1.00 0.00 H new ATOM 0 HB3 MET A 30 -8.532 22.511 8.792 1.00 0.00 H new ATOM 0 HG2 MET A 30 -7.336 24.099 6.481 1.00 0.00 H new ATOM 0 HG3 MET A 30 -6.984 24.420 8.167 1.00 0.00 H new ATOM 0 HE1 MET A 30 -4.727 21.508 9.292 1.00 0.00 H new ATOM 0 HE2 MET A 30 -4.863 23.282 9.330 1.00 0.00 H new ATOM 0 HE3 MET A 30 -6.240 22.272 9.834 1.00 0.00 H new ATOM 76 N ASP A 31 -11.787 21.936 7.481 1.00 0.00 N ATOM 77 CA ASP A 31 -13.046 21.200 7.853 1.00 0.00 C ATOM 78 C ASP A 31 -13.308 19.893 7.017 1.00 0.00 C ATOM 79 O ASP A 31 -13.685 18.890 7.635 1.00 0.00 O ATOM 80 CB ASP A 31 -14.271 22.154 7.813 1.00 0.00 C ATOM 81 CG ASP A 31 -14.328 23.195 8.938 1.00 0.00 C ATOM 82 OD1 ASP A 31 -14.331 22.900 10.132 1.00 0.00 O ATOM 83 OD2 ASP A 31 -14.373 24.476 8.453 1.00 0.00 O ATOM 0 H ASP A 31 -11.950 22.913 7.237 1.00 0.00 H new ATOM 0 HA ASP A 31 -12.895 20.853 8.875 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -14.273 22.677 6.856 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -15.180 21.553 7.850 1.00 0.00 H new ATOM 88 N GLU A 32 -13.055 19.891 5.675 1.00 0.00 N ATOM 89 CA GLU A 32 -13.035 18.646 4.836 1.00 0.00 C ATOM 90 C GLU A 32 -11.851 17.673 5.196 1.00 0.00 C ATOM 91 O GLU A 32 -12.091 16.462 5.209 1.00 0.00 O ATOM 92 CB GLU A 32 -13.036 18.975 3.307 1.00 0.00 C ATOM 93 CG GLU A 32 -14.330 19.535 2.665 1.00 0.00 C ATOM 94 CD GLU A 32 -15.431 18.499 2.430 1.00 0.00 C ATOM 95 OE1 GLU A 32 -15.266 17.838 1.242 1.00 0.00 O ATOM 96 OE2 GLU A 32 -16.349 18.295 3.222 1.00 0.00 O ATOM 0 H GLU A 32 -12.861 20.741 5.146 1.00 0.00 H new ATOM 0 HA GLU A 32 -13.959 18.119 5.074 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -12.238 19.695 3.124 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -12.771 18.063 2.773 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -14.724 20.324 3.305 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -14.075 19.996 1.711 1.00 0.00 H new ATOM 103 N PHE A 33 -10.636 18.190 5.533 1.00 0.00 N ATOM 104 CA PHE A 33 -9.507 17.395 6.105 1.00 0.00 C ATOM 105 C PHE A 33 -9.791 16.714 7.494 1.00 0.00 C ATOM 106 O PHE A 33 -9.377 15.559 7.631 1.00 0.00 O ATOM 107 CB PHE A 33 -8.241 18.300 6.119 1.00 0.00 C ATOM 108 CG PHE A 33 -6.900 17.572 6.372 1.00 0.00 C ATOM 109 CD1 PHE A 33 -6.179 17.015 5.322 1.00 0.00 C ATOM 110 CD2 PHE A 33 -6.406 17.449 7.667 1.00 0.00 C ATOM 111 CE1 PHE A 33 -4.992 16.354 5.564 1.00 0.00 C ATOM 112 CE2 PHE A 33 -5.214 16.792 7.900 1.00 0.00 C ATOM 113 CZ PHE A 33 -4.506 16.245 6.850 1.00 0.00 C ATOM 0 H PHE A 33 -10.409 19.177 5.415 1.00 0.00 H new ATOM 0 HA PHE A 33 -9.352 16.531 5.458 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -8.177 18.819 5.163 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -8.370 19.062 6.887 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -6.550 17.100 4.311 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -6.958 17.870 8.495 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -4.441 15.920 4.743 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -4.835 16.706 8.908 1.00 0.00 H new ATOM 0 HZ PHE A 33 -3.573 15.733 7.035 1.00 0.00 H new ATOM 123 N PHE A 34 -10.471 17.374 8.470 1.00 0.00 N ATOM 124 CA PHE A 34 -10.924 16.743 9.739 1.00 0.00 C ATOM 125 C PHE A 34 -12.054 15.670 9.607 1.00 0.00 C ATOM 126 O PHE A 34 -12.012 14.717 10.393 1.00 0.00 O ATOM 127 CB PHE A 34 -11.313 17.864 10.746 1.00 0.00 C ATOM 128 CG PHE A 34 -10.146 18.627 11.428 1.00 0.00 C ATOM 129 CD1 PHE A 34 -9.424 18.051 12.472 1.00 0.00 C ATOM 130 CD2 PHE A 34 -9.827 19.921 11.033 1.00 0.00 C ATOM 131 CE1 PHE A 34 -8.389 18.740 13.073 1.00 0.00 C ATOM 132 CE2 PHE A 34 -8.792 20.605 11.640 1.00 0.00 C ATOM 133 CZ PHE A 34 -8.069 20.014 12.654 1.00 0.00 C ATOM 0 H PHE A 34 -10.721 18.360 8.398 1.00 0.00 H new ATOM 0 HA PHE A 34 -10.078 16.163 10.107 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -11.934 18.591 10.222 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -11.931 17.420 11.527 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -9.676 17.058 12.814 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -10.393 20.395 10.245 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -7.829 18.280 13.873 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -8.548 21.607 11.319 1.00 0.00 H new ATOM 0 HZ PHE A 34 -7.254 20.548 13.119 1.00 0.00 H new ATOM 143 N GLU A 35 -13.015 15.793 8.657 1.00 0.00 N ATOM 144 CA GLU A 35 -14.087 14.827 8.404 1.00 0.00 C ATOM 145 C GLU A 35 -13.634 13.492 7.712 1.00 0.00 C ATOM 146 O GLU A 35 -14.070 12.430 8.168 1.00 0.00 O ATOM 147 CB GLU A 35 -15.144 15.754 7.704 1.00 0.00 C ATOM 148 CG GLU A 35 -15.350 15.812 6.176 1.00 0.00 C ATOM 149 CD GLU A 35 -16.028 14.570 5.606 1.00 0.00 C ATOM 150 OE1 GLU A 35 -17.225 14.325 5.748 1.00 0.00 O ATOM 151 OE2 GLU A 35 -15.146 13.772 4.926 1.00 0.00 O ATOM 0 H GLU A 35 -13.057 16.598 8.031 1.00 0.00 H new ATOM 0 HA GLU A 35 -14.513 14.337 9.279 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -16.111 15.495 8.134 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -14.917 16.772 8.021 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -15.950 16.688 5.931 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -14.382 15.943 5.692 1.00 0.00 H new ATOM 158 N GLN A 36 -12.787 13.568 6.652 1.00 0.00 N ATOM 159 CA GLN A 36 -12.220 12.366 5.949 1.00 0.00 C ATOM 160 C GLN A 36 -11.208 11.479 6.756 1.00 0.00 C ATOM 161 O GLN A 36 -11.297 10.251 6.638 1.00 0.00 O ATOM 162 CB GLN A 36 -11.649 12.786 4.555 1.00 0.00 C ATOM 163 CG GLN A 36 -10.379 13.679 4.421 1.00 0.00 C ATOM 164 CD GLN A 36 -9.893 13.969 2.988 1.00 0.00 C ATOM 165 OE1 GLN A 36 -10.457 13.568 1.967 1.00 0.00 O ATOM 166 NE2 GLN A 36 -8.797 14.702 2.897 1.00 0.00 N ATOM 0 H GLN A 36 -12.474 14.454 6.256 1.00 0.00 H new ATOM 0 HA GLN A 36 -13.068 11.692 5.828 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -11.446 11.866 4.008 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -12.452 13.300 4.027 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -10.577 14.631 4.914 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -9.566 13.201 4.967 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -8.333 15.032 3.743 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -8.416 14.937 1.981 1.00 0.00 H new ATOM 175 N VAL A 37 -10.289 12.071 7.562 1.00 0.00 N ATOM 176 CA VAL A 37 -9.330 11.328 8.473 1.00 0.00 C ATOM 177 C VAL A 37 -9.957 10.152 9.321 1.00 0.00 C ATOM 178 O VAL A 37 -9.353 9.077 9.330 1.00 0.00 O ATOM 179 CB VAL A 37 -8.500 12.306 9.428 1.00 0.00 C ATOM 180 CG1 VAL A 37 -7.348 13.068 8.716 1.00 0.00 C ATOM 181 CG2 VAL A 37 -9.283 13.285 10.351 1.00 0.00 C ATOM 0 H VAL A 37 -10.178 13.084 7.611 1.00 0.00 H new ATOM 0 HA VAL A 37 -8.652 10.854 7.764 1.00 0.00 H new ATOM 0 HB VAL A 37 -8.088 11.560 10.107 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -6.837 13.709 9.435 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -6.640 12.351 8.301 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -7.758 13.680 7.913 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -8.578 13.878 10.934 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -9.897 13.948 9.741 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -9.923 12.716 11.025 1.00 0.00 H new ATOM 191 N GLU A 38 -11.136 10.351 9.959 1.00 0.00 N ATOM 192 CA GLU A 38 -11.882 9.295 10.717 1.00 0.00 C ATOM 193 C GLU A 38 -12.341 8.070 9.852 1.00 0.00 C ATOM 194 O GLU A 38 -12.198 6.953 10.361 1.00 0.00 O ATOM 195 CB GLU A 38 -13.047 9.986 11.495 1.00 0.00 C ATOM 196 CG GLU A 38 -13.626 9.220 12.705 1.00 0.00 C ATOM 197 CD GLU A 38 -14.794 9.958 13.344 1.00 0.00 C ATOM 198 OE1 GLU A 38 -15.937 9.942 12.890 1.00 0.00 O ATOM 199 OE2 GLU A 38 -14.415 10.634 14.474 1.00 0.00 O ATOM 0 H GLU A 38 -11.608 11.255 9.967 1.00 0.00 H new ATOM 0 HA GLU A 38 -11.196 8.831 11.426 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -12.694 10.956 11.844 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -13.859 10.176 10.793 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -13.954 8.231 12.384 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -12.842 9.070 13.448 1.00 0.00 H new ATOM 206 N GLU A 39 -12.849 8.261 8.603 1.00 0.00 N ATOM 207 CA GLU A 39 -13.076 7.121 7.643 1.00 0.00 C ATOM 208 C GLU A 39 -11.764 6.446 7.091 1.00 0.00 C ATOM 209 O GLU A 39 -11.813 5.249 6.792 1.00 0.00 O ATOM 210 CB GLU A 39 -14.044 7.519 6.489 1.00 0.00 C ATOM 211 CG GLU A 39 -13.695 8.621 5.457 1.00 0.00 C ATOM 212 CD GLU A 39 -14.791 8.800 4.415 1.00 0.00 C ATOM 213 OE1 GLU A 39 -14.874 8.120 3.394 1.00 0.00 O ATOM 214 OE2 GLU A 39 -15.662 9.801 4.756 1.00 0.00 O ATOM 0 H GLU A 39 -13.109 9.175 8.233 1.00 0.00 H new ATOM 0 HA GLU A 39 -13.555 6.349 8.245 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -14.243 6.610 5.921 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -14.983 7.815 6.957 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -13.532 9.565 5.977 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -12.760 8.367 4.958 1.00 0.00 H new ATOM 221 N ILE A 40 -10.622 7.182 7.025 1.00 0.00 N ATOM 222 CA ILE A 40 -9.240 6.631 6.734 1.00 0.00 C ATOM 223 C ILE A 40 -8.782 5.701 7.927 1.00 0.00 C ATOM 224 O ILE A 40 -8.471 4.534 7.674 1.00 0.00 O ATOM 225 CB ILE A 40 -8.299 7.873 6.319 1.00 0.00 C ATOM 226 CG1 ILE A 40 -8.607 8.376 4.846 1.00 0.00 C ATOM 227 CG2 ILE A 40 -6.757 7.603 6.475 1.00 0.00 C ATOM 228 CD1 ILE A 40 -8.308 9.843 4.454 1.00 0.00 C ATOM 0 H ILE A 40 -10.619 8.191 7.172 1.00 0.00 H new ATOM 0 HA ILE A 40 -9.193 5.955 5.880 1.00 0.00 H new ATOM 0 HB ILE A 40 -8.552 8.655 7.035 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -8.050 7.737 4.161 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -9.666 8.199 4.657 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -6.200 8.490 6.174 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -6.532 7.369 7.516 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -6.469 6.762 5.844 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -8.582 10.004 3.411 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -8.886 10.514 5.089 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -7.245 10.045 4.585 1.00 0.00 H new ATOM 240 N ARG A 41 -8.794 6.218 9.174 1.00 0.00 N ATOM 241 CA ARG A 41 -8.614 5.424 10.447 1.00 0.00 C ATOM 242 C ARG A 41 -9.521 4.147 10.585 1.00 0.00 C ATOM 243 O ARG A 41 -9.060 3.148 11.145 1.00 0.00 O ATOM 244 CB ARG A 41 -8.806 6.295 11.719 1.00 0.00 C ATOM 245 CG ARG A 41 -7.875 7.515 11.892 1.00 0.00 C ATOM 246 CD ARG A 41 -8.187 8.477 13.048 1.00 0.00 C ATOM 247 NE ARG A 41 -7.697 7.993 14.369 1.00 0.00 N ATOM 248 CZ ARG A 41 -8.081 8.442 15.591 1.00 0.00 C ATOM 249 NH1 ARG A 41 -8.977 9.411 15.831 1.00 0.00 N ATOM 250 NH2 ARG A 41 -7.519 7.873 16.642 1.00 0.00 N ATOM 0 H ARG A 41 -8.930 7.214 9.347 1.00 0.00 H new ATOM 0 HA ARG A 41 -7.583 5.079 10.366 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -9.836 6.653 11.730 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -8.683 5.651 12.590 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -6.857 7.147 12.024 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -7.890 8.086 10.964 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -7.737 9.447 12.835 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -9.265 8.630 13.103 1.00 0.00 H new ATOM 0 HE ARG A 41 -7.001 7.247 14.354 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -9.438 9.883 15.053 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -9.197 9.676 16.791 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -6.830 7.132 16.513 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -7.774 8.175 17.582 1.00 0.00 H new ATOM 264 N GLY A 42 -10.768 4.212 10.052 1.00 0.00 N ATOM 265 CA GLY A 42 -11.682 3.047 9.873 1.00 0.00 C ATOM 266 C GLY A 42 -11.143 1.923 8.950 1.00 0.00 C ATOM 267 O GLY A 42 -11.111 0.769 9.388 1.00 0.00 O ATOM 0 H GLY A 42 -11.176 5.089 9.728 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -11.897 2.620 10.852 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -12.628 3.406 9.468 1.00 0.00 H new ATOM 271 N PHE A 43 -10.690 2.286 7.723 1.00 0.00 N ATOM 272 CA PHE A 43 -9.925 1.377 6.817 1.00 0.00 C ATOM 273 C PHE A 43 -8.535 0.907 7.376 1.00 0.00 C ATOM 274 O PHE A 43 -8.207 -0.252 7.122 1.00 0.00 O ATOM 275 CB PHE A 43 -9.723 1.994 5.398 1.00 0.00 C ATOM 276 CG PHE A 43 -10.963 2.416 4.561 1.00 0.00 C ATOM 277 CD1 PHE A 43 -11.803 1.461 3.996 1.00 0.00 C ATOM 278 CD2 PHE A 43 -11.224 3.760 4.312 1.00 0.00 C ATOM 279 CE1 PHE A 43 -12.887 1.842 3.230 1.00 0.00 C ATOM 280 CE2 PHE A 43 -12.309 4.135 3.544 1.00 0.00 C ATOM 281 CZ PHE A 43 -13.142 3.178 3.006 1.00 0.00 C ATOM 0 H PHE A 43 -10.842 3.215 7.330 1.00 0.00 H new ATOM 0 HA PHE A 43 -10.557 0.491 6.750 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -9.091 2.875 5.512 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -9.160 1.273 4.806 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -11.605 0.412 4.158 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -10.572 4.517 4.723 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -13.537 1.091 2.805 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -12.505 5.182 3.364 1.00 0.00 H new ATOM 0 HZ PHE A 43 -13.993 3.474 2.410 1.00 0.00 H new ATOM 291 N ILE A 44 -7.787 1.744 8.158 1.00 0.00 N ATOM 292 CA ILE A 44 -6.518 1.361 8.890 1.00 0.00 C ATOM 293 C ILE A 44 -6.851 0.277 9.998 1.00 0.00 C ATOM 294 O ILE A 44 -6.223 -0.785 9.942 1.00 0.00 O ATOM 295 CB ILE A 44 -5.729 2.664 9.409 1.00 0.00 C ATOM 296 CG1 ILE A 44 -5.266 3.661 8.256 1.00 0.00 C ATOM 297 CG2 ILE A 44 -4.479 2.303 10.300 1.00 0.00 C ATOM 298 CD1 ILE A 44 -5.030 5.155 8.591 1.00 0.00 C ATOM 0 H ILE A 44 -8.045 2.720 8.305 1.00 0.00 H new ATOM 0 HA ILE A 44 -5.813 0.882 8.210 1.00 0.00 H new ATOM 0 HB ILE A 44 -6.474 3.182 10.013 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -4.339 3.269 7.838 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -6.015 3.618 7.466 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -3.985 3.220 10.622 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -4.806 1.740 11.174 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -3.781 1.699 9.720 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -4.720 5.685 7.691 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -5.953 5.593 8.970 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -4.250 5.239 9.348 1.00 0.00 H new ATOM 310 N ASP A 45 -7.808 0.518 10.936 1.00 0.00 N ATOM 311 CA ASP A 45 -8.346 -0.519 11.884 1.00 0.00 C ATOM 312 C ASP A 45 -8.779 -1.877 11.232 1.00 0.00 C ATOM 313 O ASP A 45 -8.368 -2.930 11.732 1.00 0.00 O ATOM 314 CB ASP A 45 -9.498 0.106 12.727 1.00 0.00 C ATOM 315 CG ASP A 45 -9.657 -0.500 14.120 1.00 0.00 C ATOM 316 OD1 ASP A 45 -8.646 -0.118 14.962 1.00 0.00 O ATOM 317 OD2 ASP A 45 -10.587 -1.242 14.435 1.00 0.00 O ATOM 0 H ASP A 45 -8.234 1.436 11.063 1.00 0.00 H new ATOM 0 HA ASP A 45 -7.511 -0.803 12.525 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -9.320 1.177 12.827 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -10.435 -0.011 12.183 1.00 0.00 H new ATOM 322 N LYS A 46 -9.517 -1.808 10.093 1.00 0.00 N ATOM 323 CA LYS A 46 -9.821 -2.975 9.218 1.00 0.00 C ATOM 324 C LYS A 46 -8.599 -3.735 8.597 1.00 0.00 C ATOM 325 O LYS A 46 -8.798 -4.887 8.199 1.00 0.00 O ATOM 326 CB LYS A 46 -10.852 -2.487 8.150 1.00 0.00 C ATOM 327 CG LYS A 46 -11.698 -3.528 7.372 1.00 0.00 C ATOM 328 CD LYS A 46 -12.910 -4.140 8.115 1.00 0.00 C ATOM 329 CE LYS A 46 -13.709 -5.143 7.273 1.00 0.00 C ATOM 330 NZ LYS A 46 -14.838 -5.674 8.054 1.00 0.00 N ATOM 0 H LYS A 46 -9.921 -0.936 9.753 1.00 0.00 H new ATOM 0 HA LYS A 46 -10.237 -3.759 9.850 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -11.546 -1.811 8.651 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -10.306 -1.896 7.415 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -12.062 -3.056 6.460 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -11.040 -4.342 7.069 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -12.557 -4.638 9.018 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -13.574 -3.336 8.432 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -14.078 -4.658 6.369 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -13.061 -5.960 6.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -15.372 -6.352 7.474 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -14.477 -6.153 8.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -15.463 -4.892 8.336 1.00 0.00 H new ATOM 344 N ILE A 47 -7.377 -3.139 8.560 1.00 0.00 N ATOM 345 CA ILE A 47 -6.105 -3.833 8.221 1.00 0.00 C ATOM 346 C ILE A 47 -5.670 -4.587 9.542 1.00 0.00 C ATOM 347 O ILE A 47 -5.725 -5.817 9.490 1.00 0.00 O ATOM 348 CB ILE A 47 -5.022 -2.820 7.600 1.00 0.00 C ATOM 349 CG1 ILE A 47 -5.402 -1.863 6.387 1.00 0.00 C ATOM 350 CG2 ILE A 47 -3.707 -3.574 7.239 1.00 0.00 C ATOM 351 CD1 ILE A 47 -6.091 -2.349 5.085 1.00 0.00 C ATOM 0 H ILE A 47 -7.246 -2.149 8.768 1.00 0.00 H new ATOM 0 HA ILE A 47 -6.216 -4.566 7.421 1.00 0.00 H new ATOM 0 HB ILE A 47 -4.928 -2.120 8.430 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -6.045 -1.087 6.801 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -4.475 -1.378 6.079 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -2.987 -2.870 6.820 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -3.290 -4.028 8.138 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -3.923 -4.351 6.506 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -6.242 -1.502 4.415 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -5.461 -3.091 4.595 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -7.055 -2.795 5.328 1.00 0.00 H new ATOM 363 N ALA A 48 -5.301 -3.928 10.680 1.00 0.00 N ATOM 364 CA ALA A 48 -4.879 -4.633 11.928 1.00 0.00 C ATOM 365 C ALA A 48 -5.763 -5.792 12.475 1.00 0.00 C ATOM 366 O ALA A 48 -5.178 -6.713 13.058 1.00 0.00 O ATOM 367 CB ALA A 48 -4.631 -3.586 13.017 1.00 0.00 C ATOM 0 H ALA A 48 -5.288 -2.911 10.758 1.00 0.00 H new ATOM 0 HA ALA A 48 -3.979 -5.171 11.631 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -4.322 -4.083 13.936 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -3.846 -2.902 12.693 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -5.548 -3.026 13.199 1.00 0.00 H new ATOM 373 N GLU A 49 -7.106 -5.777 12.254 1.00 0.00 N ATOM 374 CA GLU A 49 -7.982 -6.964 12.542 1.00 0.00 C ATOM 375 C GLU A 49 -7.878 -8.084 11.458 1.00 0.00 C ATOM 376 O GLU A 49 -7.765 -9.251 11.857 1.00 0.00 O ATOM 377 CB GLU A 49 -9.460 -6.564 12.824 1.00 0.00 C ATOM 378 CG GLU A 49 -10.332 -5.813 11.794 1.00 0.00 C ATOM 379 CD GLU A 49 -11.756 -5.599 12.288 1.00 0.00 C ATOM 380 OE1 GLU A 49 -12.087 -4.667 13.019 1.00 0.00 O ATOM 381 OE2 GLU A 49 -12.609 -6.564 11.822 1.00 0.00 O ATOM 0 H GLU A 49 -7.608 -4.970 11.882 1.00 0.00 H new ATOM 0 HA GLU A 49 -7.590 -7.395 13.463 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -9.990 -7.485 13.068 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -9.450 -5.953 13.727 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -9.878 -4.847 11.572 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -10.354 -6.376 10.861 1.00 0.00 H new ATOM 388 N ASN A 50 -7.869 -7.740 10.140 1.00 0.00 N ATOM 389 CA ASN A 50 -7.601 -8.726 9.047 1.00 0.00 C ATOM 390 C ASN A 50 -6.167 -9.358 9.067 1.00 0.00 C ATOM 391 O ASN A 50 -6.105 -10.573 8.883 1.00 0.00 O ATOM 392 CB ASN A 50 -7.950 -8.097 7.668 1.00 0.00 C ATOM 393 CG ASN A 50 -8.194 -9.094 6.504 1.00 0.00 C ATOM 394 OD1 ASN A 50 -7.706 -10.226 6.476 1.00 0.00 O ATOM 395 ND2 ASN A 50 -8.937 -8.678 5.490 1.00 0.00 N ATOM 0 H ASN A 50 -8.043 -6.792 9.807 1.00 0.00 H new ATOM 0 HA ASN A 50 -8.259 -9.575 9.231 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -8.843 -7.484 7.787 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -7.139 -7.427 7.382 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -9.102 -9.293 4.693 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -9.344 -7.743 5.506 1.00 0.00 H new ATOM 402 N VAL A 51 -5.085 -8.585 9.365 1.00 0.00 N ATOM 403 CA VAL A 51 -3.668 -9.077 9.545 1.00 0.00 C ATOM 404 C VAL A 51 -3.566 -9.991 10.828 1.00 0.00 C ATOM 405 O VAL A 51 -3.022 -11.090 10.676 1.00 0.00 O ATOM 406 CB VAL A 51 -2.608 -7.888 9.527 1.00 0.00 C ATOM 407 CG1 VAL A 51 -1.118 -8.351 9.580 1.00 0.00 C ATOM 408 CG2 VAL A 51 -2.725 -6.886 8.337 1.00 0.00 C ATOM 0 H VAL A 51 -5.165 -7.576 9.492 1.00 0.00 H new ATOM 0 HA VAL A 51 -3.407 -9.697 8.687 1.00 0.00 H new ATOM 0 HB VAL A 51 -2.883 -7.374 10.448 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -0.465 -7.478 9.564 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -0.945 -8.917 10.496 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -0.902 -8.982 8.718 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -1.954 -6.121 8.429 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -2.595 -7.421 7.396 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -3.708 -6.415 8.353 1.00 0.00 H new ATOM 418 N GLU A 52 -4.093 -9.588 12.020 1.00 0.00 N ATOM 419 CA GLU A 52 -4.233 -10.492 13.217 1.00 0.00 C ATOM 420 C GLU A 52 -4.955 -11.853 12.946 1.00 0.00 C ATOM 421 O GLU A 52 -4.553 -12.839 13.573 1.00 0.00 O ATOM 422 CB GLU A 52 -4.909 -9.753 14.417 1.00 0.00 C ATOM 423 CG GLU A 52 -4.094 -8.674 15.175 1.00 0.00 C ATOM 424 CD GLU A 52 -3.031 -9.221 16.129 1.00 0.00 C ATOM 425 OE1 GLU A 52 -3.267 -9.548 17.291 1.00 0.00 O ATOM 426 OE2 GLU A 52 -1.800 -9.299 15.533 1.00 0.00 O ATOM 0 H GLU A 52 -4.431 -8.640 12.185 1.00 0.00 H new ATOM 0 HA GLU A 52 -3.206 -10.752 13.473 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -5.819 -9.281 14.046 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -5.214 -10.508 15.142 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -3.608 -8.027 14.445 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -4.784 -8.050 15.743 1.00 0.00 H new ATOM 433 N GLU A 53 -5.948 -11.907 12.016 1.00 0.00 N ATOM 434 CA GLU A 53 -6.526 -13.194 11.514 1.00 0.00 C ATOM 435 C GLU A 53 -5.542 -14.006 10.580 1.00 0.00 C ATOM 436 O GLU A 53 -5.504 -15.233 10.728 1.00 0.00 O ATOM 437 CB GLU A 53 -7.915 -12.933 10.857 1.00 0.00 C ATOM 438 CG GLU A 53 -8.813 -14.183 10.646 1.00 0.00 C ATOM 439 CD GLU A 53 -10.253 -13.843 10.280 1.00 0.00 C ATOM 440 OE1 GLU A 53 -10.379 -13.513 8.956 1.00 0.00 O ATOM 441 OE2 GLU A 53 -11.181 -13.865 11.086 1.00 0.00 O ATOM 0 H GLU A 53 -6.367 -11.077 11.597 1.00 0.00 H new ATOM 0 HA GLU A 53 -6.675 -13.846 12.374 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -8.459 -12.219 11.476 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -7.754 -12.458 9.889 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -8.382 -14.801 9.858 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -8.810 -14.781 11.557 1.00 0.00 H new ATOM 448 N VAL A 54 -4.747 -13.356 9.685 1.00 0.00 N ATOM 449 CA VAL A 54 -3.628 -13.999 8.881 1.00 0.00 C ATOM 450 C VAL A 54 -2.608 -14.776 9.787 1.00 0.00 C ATOM 451 O VAL A 54 -2.213 -15.862 9.360 1.00 0.00 O ATOM 452 CB VAL A 54 -2.840 -12.990 7.926 1.00 0.00 C ATOM 453 CG1 VAL A 54 -1.822 -13.640 6.926 1.00 0.00 C ATOM 454 CG2 VAL A 54 -3.728 -12.055 7.083 1.00 0.00 C ATOM 0 H VAL A 54 -4.853 -12.361 9.488 1.00 0.00 H new ATOM 0 HA VAL A 54 -4.145 -14.710 8.236 1.00 0.00 H new ATOM 0 HB VAL A 54 -2.298 -12.423 8.683 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.348 -12.860 6.331 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -1.060 -14.184 7.485 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -2.349 -14.329 6.267 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -3.098 -11.410 6.470 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -4.374 -12.651 6.438 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.340 -11.441 7.744 1.00 0.00 H new ATOM 464 N LYS A 55 -2.204 -14.238 10.961 1.00 0.00 N ATOM 465 CA LYS A 55 -1.324 -14.979 11.927 1.00 0.00 C ATOM 466 C LYS A 55 -1.971 -16.221 12.614 1.00 0.00 C ATOM 467 O LYS A 55 -1.197 -17.154 12.858 1.00 0.00 O ATOM 468 CB LYS A 55 -0.717 -14.050 13.023 1.00 0.00 C ATOM 469 CG LYS A 55 0.432 -13.075 12.615 1.00 0.00 C ATOM 470 CD LYS A 55 0.037 -11.681 12.051 1.00 0.00 C ATOM 471 CE LYS A 55 -0.327 -10.565 13.066 1.00 0.00 C ATOM 472 NZ LYS A 55 0.850 -9.942 13.705 1.00 0.00 N ATOM 0 H LYS A 55 -2.465 -13.302 11.271 1.00 0.00 H new ATOM 0 HA LYS A 55 -0.533 -15.358 11.280 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -1.528 -13.452 13.438 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -0.345 -14.684 13.827 1.00 0.00 H new ATOM 0 HG2 LYS A 55 1.062 -12.915 13.490 1.00 0.00 H new ATOM 0 HG3 LYS A 55 1.046 -13.576 11.867 1.00 0.00 H new ATOM 0 HD2 LYS A 55 0.864 -11.321 11.440 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -0.815 -11.819 11.385 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -0.903 -9.794 12.555 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -0.971 -10.984 13.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 0.536 -9.207 14.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 1.390 -10.667 14.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 1.455 -9.513 12.976 1.00 0.00 H new ATOM 486 N ARG A 56 -3.297 -16.272 12.918 1.00 0.00 N ATOM 487 CA ARG A 56 -3.963 -17.562 13.355 1.00 0.00 C ATOM 488 C ARG A 56 -4.097 -18.630 12.204 1.00 0.00 C ATOM 489 O ARG A 56 -4.077 -19.826 12.511 1.00 0.00 O ATOM 490 CB ARG A 56 -5.335 -17.365 14.064 1.00 0.00 C ATOM 491 CG ARG A 56 -6.460 -16.575 13.365 1.00 0.00 C ATOM 492 CD ARG A 56 -7.749 -16.307 14.166 1.00 0.00 C ATOM 493 NE ARG A 56 -7.616 -15.211 15.168 1.00 0.00 N ATOM 494 CZ ARG A 56 -8.626 -14.556 15.795 1.00 0.00 C ATOM 495 NH1 ARG A 56 -9.937 -14.780 15.625 1.00 0.00 N ATOM 496 NH2 ARG A 56 -8.286 -13.612 16.652 1.00 0.00 N ATOM 0 H ARG A 56 -3.923 -15.468 12.875 1.00 0.00 H new ATOM 0 HA ARG A 56 -3.269 -17.957 14.097 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -5.728 -18.356 14.290 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -5.139 -16.875 15.018 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -6.052 -15.613 13.054 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -6.734 -17.113 12.458 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -8.552 -16.057 13.472 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -8.044 -17.222 14.679 1.00 0.00 H new ATOM 0 HE ARG A 56 -6.667 -14.923 15.407 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -10.251 -15.500 14.974 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -10.620 -14.231 16.147 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -7.301 -13.404 16.817 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -9.008 -13.090 17.149 1.00 0.00 H new ATOM 510 N LYS A 57 -4.194 -18.183 10.927 1.00 0.00 N ATOM 511 CA LYS A 57 -4.137 -19.041 9.708 1.00 0.00 C ATOM 512 C LYS A 57 -2.679 -19.534 9.417 1.00 0.00 C ATOM 513 O LYS A 57 -2.400 -20.709 9.664 1.00 0.00 O ATOM 514 CB LYS A 57 -4.809 -18.270 8.514 1.00 0.00 C ATOM 515 CG LYS A 57 -6.348 -18.179 8.437 1.00 0.00 C ATOM 516 CD LYS A 57 -7.083 -19.400 7.830 1.00 0.00 C ATOM 517 CE LYS A 57 -8.616 -19.277 7.718 1.00 0.00 C ATOM 518 NZ LYS A 57 -9.064 -18.470 6.564 1.00 0.00 N ATOM 0 H LYS A 57 -4.317 -17.195 10.707 1.00 0.00 H new ATOM 0 HA LYS A 57 -4.705 -19.958 9.864 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -4.422 -17.251 8.524 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -4.463 -18.733 7.590 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -6.731 -18.016 9.444 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -6.609 -17.298 7.851 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -6.679 -19.584 6.835 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -6.852 -20.276 8.435 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -9.047 -20.275 7.641 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -9.004 -18.832 8.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -10.085 -18.608 6.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -8.873 -17.464 6.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -8.550 -18.769 5.711 1.00 0.00 H new ATOM 532 N HIS A 58 -1.751 -18.645 8.987 1.00 0.00 N ATOM 533 CA HIS A 58 -0.310 -18.949 8.732 1.00 0.00 C ATOM 534 C HIS A 58 0.517 -19.709 9.824 1.00 0.00 C ATOM 535 O HIS A 58 1.556 -20.272 9.478 1.00 0.00 O ATOM 536 CB HIS A 58 0.373 -17.574 8.410 1.00 0.00 C ATOM 537 CG HIS A 58 0.258 -16.980 6.998 1.00 0.00 C ATOM 538 ND1 HIS A 58 1.286 -16.249 6.403 1.00 0.00 N ATOM 539 CD2 HIS A 58 -0.890 -16.946 6.190 1.00 0.00 C ATOM 540 CE1 HIS A 58 0.645 -15.853 5.255 1.00 0.00 C ATOM 541 NE2 HIS A 58 -0.656 -16.226 5.033 1.00 0.00 N ATOM 0 H HIS A 58 -1.984 -17.669 8.801 1.00 0.00 H new ATOM 0 HA HIS A 58 -0.309 -19.677 7.921 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -0.030 -16.839 9.106 1.00 0.00 H new ATOM 0 HB3 HIS A 58 1.435 -17.677 8.635 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -1.829 -17.418 6.439 1.00 0.00 H new ATOM 0 HE1 HIS A 58 1.165 -15.248 4.527 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -1.272 -16.029 4.244 1.00 0.00 H new ATOM 549 N SER A 59 0.074 -19.637 11.089 1.00 0.00 N ATOM 550 CA SER A 59 0.619 -20.422 12.232 1.00 0.00 C ATOM 551 C SER A 59 -0.068 -21.793 12.498 1.00 0.00 C ATOM 552 O SER A 59 0.677 -22.705 12.875 1.00 0.00 O ATOM 553 CB SER A 59 0.615 -19.551 13.501 1.00 0.00 C ATOM 554 OG SER A 59 1.397 -18.378 13.313 1.00 0.00 O ATOM 0 H SER A 59 -0.691 -19.020 11.363 1.00 0.00 H new ATOM 0 HA SER A 59 1.636 -20.688 11.945 1.00 0.00 H new ATOM 0 HB2 SER A 59 -0.408 -19.274 13.754 1.00 0.00 H new ATOM 0 HB3 SER A 59 1.007 -20.124 14.341 1.00 0.00 H new ATOM 0 HG SER A 59 0.808 -17.622 13.107 1.00 0.00 H new ATOM 560 N ALA A 60 -1.418 -21.948 12.359 1.00 0.00 N ATOM 561 CA ALA A 60 -2.098 -23.261 12.523 1.00 0.00 C ATOM 562 C ALA A 60 -1.989 -24.211 11.302 1.00 0.00 C ATOM 563 O ALA A 60 -2.060 -25.423 11.515 1.00 0.00 O ATOM 564 CB ALA A 60 -3.568 -22.997 12.864 1.00 0.00 C ATOM 0 H ALA A 60 -2.051 -21.180 12.135 1.00 0.00 H new ATOM 0 HA ALA A 60 -1.583 -23.788 13.327 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -4.089 -23.946 12.989 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -3.630 -22.424 13.789 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -4.033 -22.432 12.056 1.00 0.00 H new ATOM 570 N ILE A 61 -1.815 -23.670 10.074 1.00 0.00 N ATOM 571 CA ILE A 61 -1.655 -24.423 8.801 1.00 0.00 C ATOM 572 C ILE A 61 -0.138 -24.760 8.600 1.00 0.00 C ATOM 573 O ILE A 61 0.111 -25.904 8.210 1.00 0.00 O ATOM 574 CB ILE A 61 -2.319 -23.647 7.573 1.00 0.00 C ATOM 575 CG1 ILE A 61 -3.699 -22.888 7.793 1.00 0.00 C ATOM 576 CG2 ILE A 61 -2.457 -24.653 6.378 1.00 0.00 C ATOM 577 CD1 ILE A 61 -4.131 -21.779 6.796 1.00 0.00 C ATOM 0 H ILE A 61 -1.780 -22.660 9.934 1.00 0.00 H new ATOM 0 HA ILE A 61 -2.196 -25.368 8.851 1.00 0.00 H new ATOM 0 HB ILE A 61 -1.633 -22.821 7.389 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -4.487 -23.641 7.805 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -3.670 -22.440 8.786 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -2.909 -24.146 5.526 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.471 -25.024 6.099 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -3.087 -25.490 6.678 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.095 -21.372 7.100 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.386 -20.983 6.792 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.215 -22.202 5.795 1.00 0.00 H new ATOM 734 N LYS A 72 -6.045 -23.283 2.554 1.00 0.00 N ATOM 735 CA LYS A 72 -5.215 -22.378 1.692 1.00 0.00 C ATOM 736 C LYS A 72 -5.986 -21.697 0.523 1.00 0.00 C ATOM 737 O LYS A 72 -5.656 -20.538 0.260 1.00 0.00 O ATOM 738 CB LYS A 72 -3.952 -23.090 1.120 1.00 0.00 C ATOM 739 CG LYS A 72 -2.847 -23.538 2.121 1.00 0.00 C ATOM 740 CD LYS A 72 -1.676 -24.378 1.550 1.00 0.00 C ATOM 741 CE LYS A 72 -0.512 -23.598 0.906 1.00 0.00 C ATOM 742 NZ LYS A 72 0.529 -24.519 0.420 1.00 0.00 N ATOM 0 HA LYS A 72 -4.913 -21.589 2.381 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -4.285 -23.973 0.574 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -3.492 -22.420 0.393 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -2.428 -22.645 2.585 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -3.323 -24.115 2.914 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -1.271 -24.989 2.357 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -2.080 -25.062 0.804 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -0.886 -22.995 0.078 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -0.083 -22.909 1.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 1.303 -23.973 -0.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 0.899 -25.076 1.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 0.121 -25.160 -0.291 1.00 0.00 H new ATOM 756 N GLU A 73 -6.986 -22.324 -0.158 1.00 0.00 N ATOM 757 CA GLU A 73 -7.898 -21.619 -1.135 1.00 0.00 C ATOM 758 C GLU A 73 -8.593 -20.318 -0.587 1.00 0.00 C ATOM 759 O GLU A 73 -8.773 -19.388 -1.380 1.00 0.00 O ATOM 760 CB GLU A 73 -8.945 -22.593 -1.724 1.00 0.00 C ATOM 761 CG GLU A 73 -8.463 -23.741 -2.651 1.00 0.00 C ATOM 762 CD GLU A 73 -8.262 -23.325 -4.105 1.00 0.00 C ATOM 763 OE1 GLU A 73 -9.429 -23.384 -4.820 1.00 0.00 O ATOM 764 OE2 GLU A 73 -7.175 -22.980 -4.567 1.00 0.00 O ATOM 0 H GLU A 73 -7.190 -23.318 -0.055 1.00 0.00 H new ATOM 0 HA GLU A 73 -7.234 -21.272 -1.926 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -9.480 -23.046 -0.889 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -9.669 -22.000 -2.283 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -7.524 -24.136 -2.264 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -9.189 -24.553 -2.614 1.00 0.00 H new ATOM 771 N GLU A 74 -8.930 -20.258 0.729 1.00 0.00 N ATOM 772 CA GLU A 74 -9.372 -19.012 1.426 1.00 0.00 C ATOM 773 C GLU A 74 -8.214 -17.979 1.700 1.00 0.00 C ATOM 774 O GLU A 74 -8.560 -16.795 1.821 1.00 0.00 O ATOM 775 CB GLU A 74 -10.151 -19.405 2.719 1.00 0.00 C ATOM 776 CG GLU A 74 -11.154 -18.361 3.269 1.00 0.00 C ATOM 777 CD GLU A 74 -11.944 -18.854 4.477 1.00 0.00 C ATOM 778 OE1 GLU A 74 -12.821 -19.855 4.147 1.00 0.00 O ATOM 779 OE2 GLU A 74 -11.814 -18.388 5.608 1.00 0.00 O ATOM 0 H GLU A 74 -8.904 -21.073 1.341 1.00 0.00 H new ATOM 0 HA GLU A 74 -10.038 -18.472 0.753 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -10.695 -20.329 2.521 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -9.424 -19.624 3.501 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -10.611 -17.457 3.544 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -11.851 -18.086 2.477 1.00 0.00 H new ATOM 786 N LEU A 75 -6.898 -18.360 1.768 1.00 0.00 N ATOM 787 CA LEU A 75 -5.753 -17.398 1.800 1.00 0.00 C ATOM 788 C LEU A 75 -5.682 -16.388 0.599 1.00 0.00 C ATOM 789 O LEU A 75 -5.263 -15.249 0.823 1.00 0.00 O ATOM 790 CB LEU A 75 -4.395 -18.154 1.957 1.00 0.00 C ATOM 791 CG LEU A 75 -4.035 -18.979 3.250 1.00 0.00 C ATOM 792 CD1 LEU A 75 -2.768 -19.849 3.030 1.00 0.00 C ATOM 793 CD2 LEU A 75 -3.861 -18.149 4.548 1.00 0.00 C ATOM 0 H LEU A 75 -6.607 -19.337 1.802 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.944 -16.779 2.677 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.322 -18.843 1.116 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.607 -17.411 1.830 1.00 0.00 H new ATOM 0 HG LEU A 75 -4.913 -19.605 3.407 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -2.546 -20.406 3.941 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.944 -20.547 2.212 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -1.923 -19.206 2.783 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -3.615 -18.815 5.375 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -3.057 -17.426 4.413 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -4.789 -17.622 4.770 1.00 0.00 H new ATOM 805 N GLU A 76 -6.109 -16.795 -0.621 1.00 0.00 N ATOM 806 CA GLU A 76 -6.318 -15.866 -1.784 1.00 0.00 C ATOM 807 C GLU A 76 -7.456 -14.799 -1.588 1.00 0.00 C ATOM 808 O GLU A 76 -7.328 -13.721 -2.177 1.00 0.00 O ATOM 809 CB GLU A 76 -6.565 -16.651 -3.111 1.00 0.00 C ATOM 810 CG GLU A 76 -5.382 -17.417 -3.758 1.00 0.00 C ATOM 811 CD GLU A 76 -4.362 -16.535 -4.480 1.00 0.00 C ATOM 812 OE1 GLU A 76 -4.766 -16.223 -5.752 1.00 0.00 O ATOM 813 OE2 GLU A 76 -3.309 -16.158 -3.969 1.00 0.00 O ATOM 0 H GLU A 76 -6.320 -17.769 -0.837 1.00 0.00 H new ATOM 0 HA GLU A 76 -5.383 -15.309 -1.845 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -7.362 -17.371 -2.925 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -6.942 -15.942 -3.848 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -4.867 -17.983 -2.982 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -5.782 -18.141 -4.468 1.00 0.00 H new ATOM 820 N GLU A 77 -8.514 -15.085 -0.781 1.00 0.00 N ATOM 821 CA GLU A 77 -9.575 -14.107 -0.392 1.00 0.00 C ATOM 822 C GLU A 77 -9.073 -13.066 0.677 1.00 0.00 C ATOM 823 O GLU A 77 -9.217 -11.875 0.381 1.00 0.00 O ATOM 824 CB GLU A 77 -10.849 -14.922 0.010 1.00 0.00 C ATOM 825 CG GLU A 77 -12.179 -14.141 0.084 1.00 0.00 C ATOM 826 CD GLU A 77 -13.335 -15.025 0.534 1.00 0.00 C ATOM 827 OE1 GLU A 77 -13.442 -15.069 1.900 1.00 0.00 O ATOM 828 OE2 GLU A 77 -14.076 -15.622 -0.245 1.00 0.00 O ATOM 0 H GLU A 77 -8.658 -16.010 -0.377 1.00 0.00 H new ATOM 0 HA GLU A 77 -9.842 -13.467 -1.233 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -10.972 -15.735 -0.705 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -10.668 -15.378 0.983 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -12.071 -13.305 0.776 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -12.406 -13.718 -0.894 1.00 0.00 H new ATOM 835 N LEU A 78 -8.492 -13.464 1.846 1.00 0.00 N ATOM 836 CA LEU A 78 -7.847 -12.527 2.813 1.00 0.00 C ATOM 837 C LEU A 78 -6.568 -11.768 2.338 1.00 0.00 C ATOM 838 O LEU A 78 -6.382 -10.640 2.811 1.00 0.00 O ATOM 839 CB LEU A 78 -7.613 -13.272 4.165 1.00 0.00 C ATOM 840 CG LEU A 78 -6.737 -14.565 4.385 1.00 0.00 C ATOM 841 CD1 LEU A 78 -5.222 -14.425 4.075 1.00 0.00 C ATOM 842 CD2 LEU A 78 -6.915 -15.126 5.822 1.00 0.00 C ATOM 0 H LEU A 78 -8.458 -14.439 2.143 1.00 0.00 H new ATOM 0 HA LEU A 78 -8.558 -11.708 2.927 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -7.204 -12.523 4.843 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -8.607 -13.527 4.533 1.00 0.00 H new ATOM 0 HG LEU A 78 -7.125 -15.261 3.641 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -4.723 -15.376 4.263 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -5.089 -14.145 3.030 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -4.789 -13.656 4.715 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -6.299 -16.017 5.944 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -6.610 -14.372 6.547 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -7.962 -15.383 5.985 1.00 0.00 H new ATOM 854 N MET A 79 -5.751 -12.321 1.407 1.00 0.00 N ATOM 855 CA MET A 79 -4.629 -11.582 0.730 1.00 0.00 C ATOM 856 C MET A 79 -5.145 -10.519 -0.302 1.00 0.00 C ATOM 857 O MET A 79 -4.634 -9.395 -0.251 1.00 0.00 O ATOM 858 CB MET A 79 -3.596 -12.572 0.097 1.00 0.00 C ATOM 859 CG MET A 79 -2.633 -13.281 1.073 1.00 0.00 C ATOM 860 SD MET A 79 -1.530 -14.389 0.180 1.00 0.00 S ATOM 861 CE MET A 79 -0.698 -15.149 1.588 1.00 0.00 C ATOM 0 H MET A 79 -5.842 -13.289 1.097 1.00 0.00 H new ATOM 0 HA MET A 79 -4.106 -11.019 1.503 1.00 0.00 H new ATOM 0 HB2 MET A 79 -4.147 -13.335 -0.452 1.00 0.00 H new ATOM 0 HB3 MET A 79 -3.000 -12.023 -0.632 1.00 0.00 H new ATOM 0 HG2 MET A 79 -2.049 -12.540 1.619 1.00 0.00 H new ATOM 0 HG3 MET A 79 -3.204 -13.844 1.811 1.00 0.00 H new ATOM 0 HE1 MET A 79 0.180 -15.694 1.241 1.00 0.00 H new ATOM 0 HE2 MET A 79 -0.390 -14.374 2.290 1.00 0.00 H new ATOM 0 HE3 MET A 79 -1.380 -15.838 2.085 1.00 0.00 H new ATOM 871 N SER A 80 -6.136 -10.842 -1.176 1.00 0.00 N ATOM 872 CA SER A 80 -6.852 -9.836 -2.016 1.00 0.00 C ATOM 873 C SER A 80 -7.735 -8.799 -1.238 1.00 0.00 C ATOM 874 O SER A 80 -7.907 -7.693 -1.759 1.00 0.00 O ATOM 875 CB SER A 80 -7.702 -10.585 -3.054 1.00 0.00 C ATOM 876 OG SER A 80 -8.276 -9.673 -3.982 1.00 0.00 O ATOM 0 H SER A 80 -6.461 -11.798 -1.319 1.00 0.00 H new ATOM 0 HA SER A 80 -6.077 -9.227 -2.482 1.00 0.00 H new ATOM 0 HB2 SER A 80 -7.084 -11.310 -3.583 1.00 0.00 H new ATOM 0 HB3 SER A 80 -8.490 -11.145 -2.551 1.00 0.00 H new ATOM 0 HG SER A 80 -8.813 -10.167 -4.637 1.00 0.00 H new ATOM 882 N ASP A 81 -8.246 -9.142 -0.025 1.00 0.00 N ATOM 883 CA ASP A 81 -8.931 -8.197 0.907 1.00 0.00 C ATOM 884 C ASP A 81 -7.999 -7.126 1.571 1.00 0.00 C ATOM 885 O ASP A 81 -8.425 -5.967 1.598 1.00 0.00 O ATOM 886 CB ASP A 81 -9.732 -9.020 1.959 1.00 0.00 C ATOM 887 CG ASP A 81 -10.876 -8.258 2.634 1.00 0.00 C ATOM 888 OD1 ASP A 81 -10.418 -7.233 3.420 1.00 0.00 O ATOM 889 OD2 ASP A 81 -12.062 -8.544 2.481 1.00 0.00 O ATOM 0 H ASP A 81 -8.195 -10.093 0.340 1.00 0.00 H new ATOM 0 HA ASP A 81 -9.612 -7.593 0.307 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -10.141 -9.905 1.472 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -9.043 -9.369 2.728 1.00 0.00 H new ATOM 894 N ILE A 82 -6.773 -7.470 2.064 1.00 0.00 N ATOM 895 CA ILE A 82 -5.754 -6.476 2.561 1.00 0.00 C ATOM 896 C ILE A 82 -5.114 -5.693 1.345 1.00 0.00 C ATOM 897 O ILE A 82 -4.919 -4.490 1.523 1.00 0.00 O ATOM 898 CB ILE A 82 -4.732 -7.200 3.556 1.00 0.00 C ATOM 899 CG1 ILE A 82 -5.406 -7.731 4.899 1.00 0.00 C ATOM 900 CG2 ILE A 82 -3.495 -6.309 3.926 1.00 0.00 C ATOM 901 CD1 ILE A 82 -4.777 -8.956 5.613 1.00 0.00 C ATOM 0 H ILE A 82 -6.458 -8.438 2.131 1.00 0.00 H new ATOM 0 HA ILE A 82 -6.219 -5.696 3.164 1.00 0.00 H new ATOM 0 HB ILE A 82 -4.389 -8.062 2.984 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.421 -6.905 5.610 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -6.444 -7.976 4.674 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -2.841 -6.858 4.603 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -2.947 -6.053 3.019 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -3.837 -5.396 4.413 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -5.352 -9.190 6.509 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -4.787 -9.814 4.941 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -3.749 -8.726 5.892 1.00 0.00 H new ATOM 913 N LYS A 83 -4.803 -6.316 0.183 1.00 0.00 N ATOM 914 CA LYS A 83 -4.404 -5.608 -1.070 1.00 0.00 C ATOM 915 C LYS A 83 -5.486 -4.600 -1.626 1.00 0.00 C ATOM 916 O LYS A 83 -5.084 -3.487 -1.982 1.00 0.00 O ATOM 917 CB LYS A 83 -3.935 -6.747 -2.041 1.00 0.00 C ATOM 918 CG LYS A 83 -3.421 -6.410 -3.469 1.00 0.00 C ATOM 919 CD LYS A 83 -4.543 -6.264 -4.523 1.00 0.00 C ATOM 920 CE LYS A 83 -4.031 -5.941 -5.933 1.00 0.00 C ATOM 921 NZ LYS A 83 -5.162 -5.828 -6.867 1.00 0.00 N ATOM 0 H LYS A 83 -4.820 -7.331 0.082 1.00 0.00 H new ATOM 0 HA LYS A 83 -3.587 -4.905 -0.905 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -3.139 -7.293 -1.534 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -4.772 -7.436 -2.155 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -2.851 -5.482 -3.429 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -2.734 -7.193 -3.791 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -5.118 -7.189 -4.559 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -5.226 -5.476 -4.206 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -3.466 -5.009 -5.919 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -3.349 -6.722 -6.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -4.805 -5.609 -7.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -5.684 -6.727 -6.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -5.798 -5.067 -6.552 1.00 0.00 H new ATOM 935 N LYS A 84 -6.797 -4.960 -1.663 1.00 0.00 N ATOM 936 CA LYS A 84 -7.915 -4.043 -2.044 1.00 0.00 C ATOM 937 C LYS A 84 -8.191 -2.890 -1.012 1.00 0.00 C ATOM 938 O LYS A 84 -8.280 -1.744 -1.468 1.00 0.00 O ATOM 939 CB LYS A 84 -9.193 -4.896 -2.360 1.00 0.00 C ATOM 940 CG LYS A 84 -9.288 -5.538 -3.753 1.00 0.00 C ATOM 941 CD LYS A 84 -10.515 -6.442 -3.992 1.00 0.00 C ATOM 942 CE LYS A 84 -10.576 -7.022 -5.413 1.00 0.00 C ATOM 943 NZ LYS A 84 -11.766 -7.875 -5.563 1.00 0.00 N ATOM 0 H LYS A 84 -7.114 -5.901 -1.428 1.00 0.00 H new ATOM 0 HA LYS A 84 -7.608 -3.507 -2.942 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -9.259 -5.691 -1.617 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -10.066 -4.258 -2.223 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -9.295 -4.743 -4.499 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -8.387 -6.127 -3.923 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -10.499 -7.261 -3.273 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -11.422 -5.869 -3.802 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -10.605 -6.213 -6.143 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -9.676 -7.602 -5.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -11.797 -8.262 -6.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -11.722 -8.656 -4.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -12.622 -7.310 -5.389 1.00 0.00 H new ATOM 957 N THR A 85 -8.284 -3.157 0.324 1.00 0.00 N ATOM 958 CA THR A 85 -8.439 -2.109 1.381 1.00 0.00 C ATOM 959 C THR A 85 -7.149 -1.227 1.558 1.00 0.00 C ATOM 960 O THR A 85 -7.325 -0.005 1.509 1.00 0.00 O ATOM 961 CB THR A 85 -8.951 -2.794 2.694 1.00 0.00 C ATOM 962 OG1 THR A 85 -10.074 -3.627 2.420 1.00 0.00 O ATOM 963 CG2 THR A 85 -9.406 -1.844 3.819 1.00 0.00 C ATOM 0 H THR A 85 -8.254 -4.105 0.699 1.00 0.00 H new ATOM 0 HA THR A 85 -9.191 -1.383 1.073 1.00 0.00 H new ATOM 0 HB THR A 85 -8.073 -3.338 3.042 1.00 0.00 H new ATOM 0 HG1 THR A 85 -9.763 -4.510 2.129 1.00 0.00 H new ATOM 0 HG21 THR A 85 -9.739 -2.429 4.677 1.00 0.00 H new ATOM 0 HG22 THR A 85 -8.573 -1.206 4.116 1.00 0.00 H new ATOM 0 HG23 THR A 85 -10.228 -1.224 3.461 1.00 0.00 H new ATOM 971 N ALA A 86 -5.916 -1.796 1.713 1.00 0.00 N ATOM 972 CA ALA A 86 -4.640 -1.014 1.712 1.00 0.00 C ATOM 973 C ALA A 86 -4.422 -0.104 0.473 1.00 0.00 C ATOM 974 O ALA A 86 -4.024 1.027 0.718 1.00 0.00 O ATOM 975 CB ALA A 86 -3.382 -1.881 1.892 1.00 0.00 C ATOM 0 H ALA A 86 -5.779 -2.799 1.841 1.00 0.00 H new ATOM 0 HA ALA A 86 -4.775 -0.373 2.584 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -2.497 -1.245 1.881 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -3.437 -2.409 2.844 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -3.319 -2.604 1.079 1.00 0.00 H new ATOM 981 N ASN A 87 -4.726 -0.536 -0.779 1.00 0.00 N ATOM 982 CA ASN A 87 -4.669 0.339 -1.990 1.00 0.00 C ATOM 983 C ASN A 87 -5.750 1.464 -2.066 1.00 0.00 C ATOM 984 O ASN A 87 -5.384 2.549 -2.532 1.00 0.00 O ATOM 985 CB ASN A 87 -4.659 -0.556 -3.259 1.00 0.00 C ATOM 986 CG ASN A 87 -4.120 0.121 -4.532 1.00 0.00 C ATOM 987 OD1 ASN A 87 -2.918 0.117 -4.789 1.00 0.00 O ATOM 988 ND2 ASN A 87 -4.987 0.708 -5.345 1.00 0.00 N ATOM 0 H ASN A 87 -5.016 -1.493 -0.981 1.00 0.00 H new ATOM 0 HA ASN A 87 -3.740 0.905 -1.918 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -4.058 -1.442 -3.055 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -5.676 -0.898 -3.451 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -4.659 1.164 -6.197 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -5.982 0.704 -5.119 1.00 0.00 H new ATOM 995 N LYS A 88 -7.009 1.244 -1.608 1.00 0.00 N ATOM 996 CA LYS A 88 -8.025 2.336 -1.434 1.00 0.00 C ATOM 997 C LYS A 88 -7.617 3.478 -0.419 1.00 0.00 C ATOM 998 O LYS A 88 -7.981 4.630 -0.656 1.00 0.00 O ATOM 999 CB LYS A 88 -9.387 1.662 -1.079 1.00 0.00 C ATOM 1000 CG LYS A 88 -10.660 2.485 -1.327 1.00 0.00 C ATOM 1001 CD LYS A 88 -12.005 1.863 -0.999 1.00 0.00 C ATOM 1002 CE LYS A 88 -13.277 2.696 -1.268 1.00 0.00 C ATOM 1003 NZ LYS A 88 -13.543 3.731 -0.248 1.00 0.00 N ATOM 0 H LYS A 88 -7.354 0.320 -1.349 1.00 0.00 H new ATOM 0 HA LYS A 88 -8.102 2.881 -2.375 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -9.466 0.737 -1.650 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -9.363 1.385 -0.025 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -10.574 3.408 -0.754 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -10.673 2.764 -2.381 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -12.089 0.934 -1.563 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -11.999 1.595 0.057 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -13.186 3.176 -2.243 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -14.134 2.025 -1.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -14.540 4.023 -0.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -13.346 3.345 0.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -12.931 4.554 -0.421 1.00 0.00 H new ATOM 1017 N VAL A 89 -6.898 3.132 0.669 1.00 0.00 N ATOM 1018 CA VAL A 89 -6.375 4.076 1.717 1.00 0.00 C ATOM 1019 C VAL A 89 -4.933 4.639 1.414 1.00 0.00 C ATOM 1020 O VAL A 89 -4.773 5.863 1.469 1.00 0.00 O ATOM 1021 CB VAL A 89 -6.586 3.389 3.141 1.00 0.00 C ATOM 1022 CG1 VAL A 89 -5.746 2.122 3.452 1.00 0.00 C ATOM 1023 CG2 VAL A 89 -6.483 4.352 4.346 1.00 0.00 C ATOM 0 H VAL A 89 -6.650 2.162 0.862 1.00 0.00 H new ATOM 0 HA VAL A 89 -6.949 5.003 1.712 1.00 0.00 H new ATOM 0 HB VAL A 89 -7.618 3.059 3.020 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -5.989 1.760 4.451 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -5.972 1.347 2.720 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -4.685 2.368 3.404 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -6.640 3.796 5.270 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -5.494 4.811 4.362 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -7.242 5.129 4.257 1.00 0.00 H new ATOM 1033 N ARG A 90 -3.921 3.781 1.146 1.00 0.00 N ATOM 1034 CA ARG A 90 -2.477 4.174 0.982 1.00 0.00 C ATOM 1035 C ARG A 90 -2.220 5.213 -0.179 1.00 0.00 C ATOM 1036 O ARG A 90 -1.473 6.174 0.034 1.00 0.00 O ATOM 1037 CB ARG A 90 -1.611 2.867 0.961 1.00 0.00 C ATOM 1038 CG ARG A 90 -1.413 2.111 -0.348 1.00 0.00 C ATOM 1039 CD ARG A 90 -0.758 0.716 -0.335 1.00 0.00 C ATOM 1040 NE ARG A 90 0.722 0.767 -0.176 1.00 0.00 N ATOM 1041 CZ ARG A 90 1.601 -0.236 -0.431 1.00 0.00 C ATOM 1042 NH1 ARG A 90 1.291 -1.463 -0.875 1.00 0.00 N ATOM 1043 NH2 ARG A 90 2.879 0.020 -0.222 1.00 0.00 N ATOM 0 H ARG A 90 -4.073 2.779 1.034 1.00 0.00 H new ATOM 0 HA ARG A 90 -2.149 4.760 1.841 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -0.622 3.126 1.340 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -2.054 2.172 1.674 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -2.393 2.006 -0.814 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -0.815 2.745 -1.002 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -1.185 0.128 0.478 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -1.000 0.199 -1.263 1.00 0.00 H new ATOM 0 HE ARG A 90 1.116 1.646 0.159 1.00 0.00 H new ATOM 0 HH11 ARG A 90 0.317 -1.711 -1.051 1.00 0.00 H new ATOM 0 HH12 ARG A 90 2.029 -2.149 -1.036 1.00 0.00 H new ATOM 0 HH21 ARG A 90 3.167 0.938 0.116 1.00 0.00 H new ATOM 0 HH22 ARG A 90 3.579 -0.701 -0.399 1.00 0.00 H new ATOM 1057 N SER A 91 -2.876 4.994 -1.338 1.00 0.00 N ATOM 1058 CA SER A 91 -2.947 5.972 -2.455 1.00 0.00 C ATOM 1059 C SER A 91 -3.736 7.295 -2.189 1.00 0.00 C ATOM 1060 O SER A 91 -3.458 8.257 -2.913 1.00 0.00 O ATOM 1061 CB SER A 91 -3.551 5.270 -3.680 1.00 0.00 C ATOM 1062 OG SER A 91 -2.745 4.168 -4.081 1.00 0.00 O ATOM 0 H SER A 91 -3.377 4.127 -1.531 1.00 0.00 H new ATOM 0 HA SER A 91 -1.918 6.297 -2.605 1.00 0.00 H new ATOM 0 HB2 SER A 91 -4.558 4.924 -3.446 1.00 0.00 H new ATOM 0 HB3 SER A 91 -3.641 5.979 -4.503 1.00 0.00 H new ATOM 0 HG SER A 91 -3.149 3.734 -4.862 1.00 0.00 H new ATOM 1068 N LYS A 92 -4.686 7.348 -1.217 1.00 0.00 N ATOM 1069 CA LYS A 92 -5.384 8.611 -0.814 1.00 0.00 C ATOM 1070 C LYS A 92 -4.629 9.397 0.293 1.00 0.00 C ATOM 1071 O LYS A 92 -4.695 10.629 0.279 1.00 0.00 O ATOM 1072 CB LYS A 92 -6.868 8.350 -0.388 1.00 0.00 C ATOM 1073 CG LYS A 92 -7.897 7.710 -1.369 1.00 0.00 C ATOM 1074 CD LYS A 92 -8.218 8.492 -2.664 1.00 0.00 C ATOM 1075 CE LYS A 92 -9.322 7.919 -3.573 1.00 0.00 C ATOM 1076 NZ LYS A 92 -10.687 8.238 -3.106 1.00 0.00 N ATOM 0 H LYS A 92 -4.991 6.528 -0.692 1.00 0.00 H new ATOM 0 HA LYS A 92 -5.389 9.238 -1.705 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -6.836 7.714 0.497 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -7.282 9.309 -0.077 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -7.526 6.725 -1.652 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -8.830 7.556 -0.827 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -8.502 9.507 -2.385 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -7.302 8.567 -3.250 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -9.190 8.309 -4.582 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -9.209 6.836 -3.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -11.383 7.825 -3.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -10.829 7.844 -2.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -10.811 9.270 -3.075 1.00 0.00 H new ATOM 1090 N LEU A 93 -3.925 8.699 1.212 1.00 0.00 N ATOM 1091 CA LEU A 93 -2.979 9.282 2.200 1.00 0.00 C ATOM 1092 C LEU A 93 -1.669 9.860 1.531 1.00 0.00 C ATOM 1093 O LEU A 93 -1.304 11.000 1.865 1.00 0.00 O ATOM 1094 CB LEU A 93 -2.888 8.131 3.275 1.00 0.00 C ATOM 1095 CG LEU A 93 -1.727 8.014 4.323 1.00 0.00 C ATOM 1096 CD1 LEU A 93 -2.134 7.113 5.519 1.00 0.00 C ATOM 1097 CD2 LEU A 93 -0.431 7.455 3.680 1.00 0.00 C ATOM 0 H LEU A 93 -3.999 7.685 1.292 1.00 0.00 H new ATOM 0 HA LEU A 93 -3.284 10.204 2.695 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -3.815 8.172 3.847 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -2.897 7.192 2.721 1.00 0.00 H new ATOM 0 HG LEU A 93 -1.533 9.023 4.686 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -1.307 7.053 6.227 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -3.006 7.539 6.015 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -2.375 6.114 5.156 1.00 0.00 H new ATOM 0 HD21 LEU A 93 0.351 7.388 4.436 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -0.626 6.464 3.271 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -0.106 8.120 2.880 1.00 0.00 H new ATOM 1109 N LYS A 94 -1.014 9.158 0.557 1.00 0.00 N ATOM 1110 CA LYS A 94 0.093 9.764 -0.266 1.00 0.00 C ATOM 1111 C LYS A 94 -0.288 11.099 -0.993 1.00 0.00 C ATOM 1112 O LYS A 94 0.602 11.934 -1.105 1.00 0.00 O ATOM 1113 CB LYS A 94 0.726 8.722 -1.238 1.00 0.00 C ATOM 1114 CG LYS A 94 0.022 8.308 -2.558 1.00 0.00 C ATOM 1115 CD LYS A 94 0.328 9.188 -3.794 1.00 0.00 C ATOM 1116 CE LYS A 94 -0.369 8.778 -5.109 1.00 0.00 C ATOM 1117 NZ LYS A 94 0.276 7.641 -5.800 1.00 0.00 N ATOM 0 H LYS A 94 -1.225 8.188 0.321 1.00 0.00 H new ATOM 0 HA LYS A 94 0.856 10.056 0.456 1.00 0.00 H new ATOM 0 HB2 LYS A 94 1.711 9.101 -1.510 1.00 0.00 H new ATOM 0 HB3 LYS A 94 0.884 7.809 -0.664 1.00 0.00 H new ATOM 0 HG2 LYS A 94 0.303 7.281 -2.790 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -1.055 8.314 -2.390 1.00 0.00 H new ATOM 0 HD2 LYS A 94 0.046 10.215 -3.562 1.00 0.00 H new ATOM 0 HD3 LYS A 94 1.405 9.183 -3.961 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -1.406 8.519 -4.894 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -0.388 9.636 -5.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -0.246 7.424 -6.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 1.257 7.890 -6.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 0.271 6.808 -5.177 1.00 0.00 H new ATOM 1131 N SER A 95 -1.560 11.277 -1.449 1.00 0.00 N ATOM 1132 CA SER A 95 -2.096 12.593 -1.931 1.00 0.00 C ATOM 1133 C SER A 95 -2.000 13.784 -0.912 1.00 0.00 C ATOM 1134 O SER A 95 -1.902 14.933 -1.355 1.00 0.00 O ATOM 1135 CB SER A 95 -3.546 12.406 -2.400 1.00 0.00 C ATOM 1136 OG SER A 95 -4.015 13.585 -3.042 1.00 0.00 O ATOM 0 H SER A 95 -2.242 10.520 -1.495 1.00 0.00 H new ATOM 0 HA SER A 95 -1.445 12.890 -2.753 1.00 0.00 H new ATOM 0 HB2 SER A 95 -3.607 11.562 -3.087 1.00 0.00 H new ATOM 0 HB3 SER A 95 -4.183 12.170 -1.548 1.00 0.00 H new ATOM 0 HG SER A 95 -4.940 13.451 -3.337 1.00 0.00 H new ATOM 1142 N ILE A 96 -1.983 13.483 0.415 1.00 0.00 N ATOM 1143 CA ILE A 96 -1.649 14.448 1.516 1.00 0.00 C ATOM 1144 C ILE A 96 -0.086 14.699 1.470 1.00 0.00 C ATOM 1145 O ILE A 96 0.278 15.877 1.430 1.00 0.00 O ATOM 1146 CB ILE A 96 -2.222 13.984 2.926 1.00 0.00 C ATOM 1147 CG1 ILE A 96 -3.767 13.662 3.035 1.00 0.00 C ATOM 1148 CG2 ILE A 96 -1.844 14.977 4.087 1.00 0.00 C ATOM 1149 CD1 ILE A 96 -4.860 14.455 2.294 1.00 0.00 C ATOM 0 H ILE A 96 -2.204 12.550 0.762 1.00 0.00 H new ATOM 0 HA ILE A 96 -2.148 15.405 1.363 1.00 0.00 H new ATOM 0 HB ILE A 96 -1.719 13.023 3.032 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.885 12.622 2.731 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -4.016 13.715 4.095 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -2.260 14.613 5.027 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -0.759 15.042 4.171 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -2.251 15.964 3.868 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.838 14.038 2.534 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -4.825 15.499 2.604 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -4.691 14.390 1.219 1.00 0.00 H new ATOM 1161 N GLU A 97 0.787 13.649 1.426 1.00 0.00 N ATOM 1162 CA GLU A 97 2.262 13.813 1.162 1.00 0.00 C ATOM 1163 C GLU A 97 2.646 14.601 -0.144 1.00 0.00 C ATOM 1164 O GLU A 97 3.530 15.461 -0.080 1.00 0.00 O ATOM 1165 CB GLU A 97 2.948 12.403 1.204 1.00 0.00 C ATOM 1166 CG GLU A 97 4.390 12.365 1.748 1.00 0.00 C ATOM 1167 CD GLU A 97 4.972 10.958 1.726 1.00 0.00 C ATOM 1168 OE1 GLU A 97 5.431 10.614 0.482 1.00 0.00 O ATOM 1169 OE2 GLU A 97 5.019 10.228 2.715 1.00 0.00 O ATOM 0 H GLU A 97 0.502 12.680 1.569 1.00 0.00 H new ATOM 0 HA GLU A 97 2.638 14.455 1.958 1.00 0.00 H new ATOM 0 HB2 GLU A 97 2.334 11.741 1.814 1.00 0.00 H new ATOM 0 HB3 GLU A 97 2.952 11.993 0.194 1.00 0.00 H new ATOM 0 HG2 GLU A 97 5.019 13.027 1.153 1.00 0.00 H new ATOM 0 HG3 GLU A 97 4.402 12.746 2.769 1.00 0.00 H new ATOM 1176 N GLN A 98 1.937 14.327 -1.264 1.00 0.00 N ATOM 1177 CA GLN A 98 1.997 15.113 -2.535 1.00 0.00 C ATOM 1178 C GLN A 98 1.626 16.635 -2.418 1.00 0.00 C ATOM 1179 O GLN A 98 2.299 17.451 -3.057 1.00 0.00 O ATOM 1180 CB GLN A 98 1.121 14.432 -3.639 1.00 0.00 C ATOM 1181 CG GLN A 98 1.426 13.008 -4.200 1.00 0.00 C ATOM 1182 CD GLN A 98 2.874 12.658 -4.595 1.00 0.00 C ATOM 1183 OE1 GLN A 98 3.264 12.756 -5.758 1.00 0.00 O ATOM 1184 NE2 GLN A 98 3.681 12.243 -3.626 1.00 0.00 N ATOM 0 H GLN A 98 1.292 13.539 -1.318 1.00 0.00 H new ATOM 0 HA GLN A 98 3.051 15.103 -2.811 1.00 0.00 H new ATOM 0 HB2 GLN A 98 0.102 14.402 -3.252 1.00 0.00 H new ATOM 0 HB3 GLN A 98 1.118 15.108 -4.494 1.00 0.00 H new ATOM 0 HG2 GLN A 98 1.104 12.283 -3.452 1.00 0.00 H new ATOM 0 HG3 GLN A 98 0.799 12.859 -5.079 1.00 0.00 H new ATOM 0 HE21 GLN A 98 3.334 12.170 -2.670 1.00 0.00 H new ATOM 0 HE22 GLN A 98 4.648 11.997 -3.838 1.00 0.00 H new ATOM 1193 N SER A 99 0.590 16.971 -1.615 1.00 0.00 N ATOM 1194 CA SER A 99 0.204 18.373 -1.284 1.00 0.00 C ATOM 1195 C SER A 99 1.194 19.222 -0.453 1.00 0.00 C ATOM 1196 O SER A 99 1.177 20.444 -0.631 1.00 0.00 O ATOM 1197 CB SER A 99 -1.151 18.352 -0.545 1.00 0.00 C ATOM 1198 OG SER A 99 -2.167 17.779 -1.358 1.00 0.00 O ATOM 0 H SER A 99 -0.010 16.275 -1.172 1.00 0.00 H new ATOM 0 HA SER A 99 0.178 18.868 -2.255 1.00 0.00 H new ATOM 0 HB2 SER A 99 -1.056 17.783 0.380 1.00 0.00 H new ATOM 0 HB3 SER A 99 -1.433 19.367 -0.266 1.00 0.00 H new ATOM 0 HG SER A 99 -2.075 16.803 -1.358 1.00 0.00 H new ATOM 1371 N ALA A 111 0.559 27.983 9.447 1.00 0.00 N ATOM 1372 CA ALA A 111 0.499 26.932 10.509 1.00 0.00 C ATOM 1373 C ALA A 111 -0.535 25.798 10.255 1.00 0.00 C ATOM 1374 O ALA A 111 -0.246 24.673 10.676 1.00 0.00 O ATOM 1375 CB ALA A 111 0.241 27.618 11.853 1.00 0.00 C ATOM 0 HA ALA A 111 1.461 26.420 10.504 1.00 0.00 H new ATOM 0 HB1 ALA A 111 0.194 26.867 12.642 1.00 0.00 H new ATOM 0 HB2 ALA A 111 1.050 28.317 12.066 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -0.704 28.159 11.810 1.00 0.00 H new ATOM 1381 N ASP A 112 -1.694 26.048 9.585 1.00 0.00 N ATOM 1382 CA ASP A 112 -2.643 24.999 9.085 1.00 0.00 C ATOM 1383 C ASP A 112 -2.006 23.882 8.181 1.00 0.00 C ATOM 1384 O ASP A 112 -2.375 22.721 8.356 1.00 0.00 O ATOM 1385 CB ASP A 112 -3.810 25.733 8.363 1.00 0.00 C ATOM 1386 CG ASP A 112 -4.899 26.288 9.284 1.00 0.00 C ATOM 1387 OD1 ASP A 112 -5.720 25.581 9.866 1.00 0.00 O ATOM 1388 OD2 ASP A 112 -4.844 27.653 9.378 1.00 0.00 O ATOM 0 H ASP A 112 -2.005 26.996 9.371 1.00 0.00 H new ATOM 0 HA ASP A 112 -2.995 24.436 9.949 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -3.395 26.555 7.780 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -4.271 25.042 7.657 1.00 0.00 H new ATOM 1393 N LEU A 113 -1.043 24.245 7.296 1.00 0.00 N ATOM 1394 CA LEU A 113 -0.157 23.306 6.518 1.00 0.00 C ATOM 1395 C LEU A 113 0.675 22.310 7.392 1.00 0.00 C ATOM 1396 O LEU A 113 1.005 21.213 6.929 1.00 0.00 O ATOM 1397 CB LEU A 113 0.727 24.223 5.586 1.00 0.00 C ATOM 1398 CG LEU A 113 1.712 23.645 4.496 1.00 0.00 C ATOM 1399 CD1 LEU A 113 2.075 24.731 3.449 1.00 0.00 C ATOM 1400 CD2 LEU A 113 3.040 23.051 5.055 1.00 0.00 C ATOM 0 H LEU A 113 -0.846 25.224 7.089 1.00 0.00 H new ATOM 0 HA LEU A 113 -0.767 22.619 5.932 1.00 0.00 H new ATOM 0 HB2 LEU A 113 0.039 24.885 5.061 1.00 0.00 H new ATOM 0 HB3 LEU A 113 1.329 24.847 6.247 1.00 0.00 H new ATOM 0 HG LEU A 113 1.157 22.822 4.046 1.00 0.00 H new ATOM 0 HD11 LEU A 113 2.755 24.310 2.708 1.00 0.00 H new ATOM 0 HD12 LEU A 113 1.168 25.077 2.954 1.00 0.00 H new ATOM 0 HD13 LEU A 113 2.558 25.571 3.948 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.648 22.680 4.230 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.588 23.826 5.590 1.00 0.00 H new ATOM 0 HD23 LEU A 113 2.813 22.231 5.736 1.00 0.00 H new ATOM 1412 N ARG A 114 1.027 22.764 8.598 1.00 0.00 N ATOM 1413 CA ARG A 114 1.983 22.118 9.530 1.00 0.00 C ATOM 1414 C ARG A 114 1.221 21.139 10.468 1.00 0.00 C ATOM 1415 O ARG A 114 1.708 20.046 10.763 1.00 0.00 O ATOM 1416 CB ARG A 114 2.789 23.274 10.195 1.00 0.00 C ATOM 1417 CG ARG A 114 3.688 24.159 9.252 1.00 0.00 C ATOM 1418 CD ARG A 114 5.133 24.384 9.708 1.00 0.00 C ATOM 1419 NE ARG A 114 5.872 25.208 8.716 1.00 0.00 N ATOM 1420 CZ ARG A 114 7.114 25.736 8.863 1.00 0.00 C ATOM 1421 NH1 ARG A 114 7.905 25.608 9.939 1.00 0.00 N ATOM 1422 NH2 ARG A 114 7.588 26.441 7.853 1.00 0.00 N ATOM 0 H ARG A 114 0.642 23.629 8.977 1.00 0.00 H new ATOM 0 HA ARG A 114 2.716 21.467 9.053 1.00 0.00 H new ATOM 0 HB2 ARG A 114 2.082 23.931 10.702 1.00 0.00 H new ATOM 0 HB3 ARG A 114 3.429 22.841 10.964 1.00 0.00 H new ATOM 0 HG2 ARG A 114 3.709 23.696 8.265 1.00 0.00 H new ATOM 0 HG3 ARG A 114 3.210 25.132 9.138 1.00 0.00 H new ATOM 0 HD2 ARG A 114 5.141 24.880 10.679 1.00 0.00 H new ATOM 0 HD3 ARG A 114 5.633 23.424 9.836 1.00 0.00 H new ATOM 0 HE ARG A 114 5.397 25.396 7.833 1.00 0.00 H new ATOM 0 HH11 ARG A 114 7.585 25.073 10.746 1.00 0.00 H new ATOM 0 HH12 ARG A 114 8.826 26.046 9.950 1.00 0.00 H new ATOM 0 HH21 ARG A 114 7.026 26.568 7.011 1.00 0.00 H new ATOM 0 HH22 ARG A 114 8.516 26.859 7.914 1.00 0.00 H new ATOM 1436 N ILE A 115 -0.014 21.520 10.856 1.00 0.00 N ATOM 1437 CA ILE A 115 -1.047 20.687 11.535 1.00 0.00 C ATOM 1438 C ILE A 115 -1.442 19.441 10.629 1.00 0.00 C ATOM 1439 O ILE A 115 -1.571 18.341 11.175 1.00 0.00 O ATOM 1440 CB ILE A 115 -2.227 21.695 11.937 1.00 0.00 C ATOM 1441 CG1 ILE A 115 -1.822 22.788 13.018 1.00 0.00 C ATOM 1442 CG2 ILE A 115 -3.508 20.947 12.403 1.00 0.00 C ATOM 1443 CD1 ILE A 115 -2.608 24.123 13.084 1.00 0.00 C ATOM 0 H ILE A 115 -0.343 22.472 10.698 1.00 0.00 H new ATOM 0 HA ILE A 115 -0.702 20.209 12.452 1.00 0.00 H new ATOM 0 HB ILE A 115 -2.439 22.231 11.012 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -1.892 22.319 13.999 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -0.773 23.034 12.856 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -4.278 21.673 12.664 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -3.870 20.308 11.597 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -3.275 20.335 13.275 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -2.198 24.748 13.877 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -2.521 24.644 12.130 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -3.658 23.917 13.291 1.00 0.00 H new ATOM 1455 N ARG A 116 -1.642 19.646 9.301 1.00 0.00 N ATOM 1456 CA ARG A 116 -1.977 18.567 8.307 1.00 0.00 C ATOM 1457 C ARG A 116 -0.914 17.411 8.232 1.00 0.00 C ATOM 1458 O ARG A 116 -1.325 16.248 8.179 1.00 0.00 O ATOM 1459 CB ARG A 116 -2.251 19.093 6.847 1.00 0.00 C ATOM 1460 CG ARG A 116 -3.081 20.393 6.576 1.00 0.00 C ATOM 1461 CD ARG A 116 -4.111 20.484 5.439 1.00 0.00 C ATOM 1462 NE ARG A 116 -3.618 20.175 4.064 1.00 0.00 N ATOM 1463 CZ ARG A 116 -4.266 20.418 2.896 1.00 0.00 C ATOM 1464 NH1 ARG A 116 -5.475 20.983 2.767 1.00 0.00 N ATOM 1465 NH2 ARG A 116 -3.649 20.064 1.785 1.00 0.00 N ATOM 0 H ARG A 116 -1.577 20.571 8.876 1.00 0.00 H new ATOM 0 HA ARG A 116 -2.906 18.163 8.709 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -1.278 19.237 6.377 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -2.748 18.285 6.310 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -3.612 20.624 7.499 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -2.362 21.196 6.413 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -4.932 19.804 5.668 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -4.525 21.492 5.434 1.00 0.00 H new ATOM 0 HE ARG A 116 -2.700 19.736 3.995 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -5.993 21.273 3.596 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -5.876 21.122 1.840 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -2.727 19.629 1.830 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -4.094 20.225 0.881 1.00 0.00 H new ATOM 1479 N LYS A 117 0.402 17.743 8.272 1.00 0.00 N ATOM 1480 CA LYS A 117 1.524 16.771 8.383 1.00 0.00 C ATOM 1481 C LYS A 117 1.740 16.123 9.766 1.00 0.00 C ATOM 1482 O LYS A 117 2.145 14.959 9.814 1.00 0.00 O ATOM 1483 CB LYS A 117 2.782 17.474 7.821 1.00 0.00 C ATOM 1484 CG LYS A 117 3.655 18.520 8.540 1.00 0.00 C ATOM 1485 CD LYS A 117 4.677 17.949 9.550 1.00 0.00 C ATOM 1486 CE LYS A 117 5.577 18.986 10.254 1.00 0.00 C ATOM 1487 NZ LYS A 117 4.919 19.691 11.374 1.00 0.00 N ATOM 0 H LYS A 117 0.720 18.711 8.227 1.00 0.00 H new ATOM 0 HA LYS A 117 1.268 15.890 7.795 1.00 0.00 H new ATOM 0 HB2 LYS A 117 3.463 16.670 7.542 1.00 0.00 H new ATOM 0 HB3 LYS A 117 2.458 17.952 6.897 1.00 0.00 H new ATOM 0 HG2 LYS A 117 4.195 19.096 7.789 1.00 0.00 H new ATOM 0 HG3 LYS A 117 3.000 19.216 9.065 1.00 0.00 H new ATOM 0 HD2 LYS A 117 4.133 17.391 10.312 1.00 0.00 H new ATOM 0 HD3 LYS A 117 5.316 17.236 9.028 1.00 0.00 H new ATOM 0 HE2 LYS A 117 6.469 18.483 10.628 1.00 0.00 H new ATOM 0 HE3 LYS A 117 5.909 19.721 9.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 5.342 20.635 11.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 3.903 19.788 11.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 5.049 19.147 12.251 1.00 0.00 H new ATOM 1501 N THR A 118 1.461 16.874 10.853 1.00 0.00 N ATOM 1502 CA THR A 118 1.406 16.328 12.253 1.00 0.00 C ATOM 1503 C THR A 118 0.522 15.021 12.409 1.00 0.00 C ATOM 1504 O THR A 118 0.962 14.094 13.096 1.00 0.00 O ATOM 1505 CB THR A 118 1.013 17.514 13.196 1.00 0.00 C ATOM 1506 OG1 THR A 118 1.839 18.648 12.952 1.00 0.00 O ATOM 1507 CG2 THR A 118 1.154 17.270 14.703 1.00 0.00 C ATOM 0 H THR A 118 1.266 17.874 10.800 1.00 0.00 H new ATOM 0 HA THR A 118 2.386 15.952 12.545 1.00 0.00 H new ATOM 0 HB THR A 118 -0.042 17.652 12.957 1.00 0.00 H new ATOM 0 HG1 THR A 118 1.404 19.236 12.300 1.00 0.00 H new ATOM 0 HG21 THR A 118 0.851 18.165 15.246 1.00 0.00 H new ATOM 0 HG22 THR A 118 0.519 16.435 14.997 1.00 0.00 H new ATOM 0 HG23 THR A 118 2.192 17.036 14.938 1.00 0.00 H new ATOM 1515 N GLN A 119 -0.647 14.974 11.737 1.00 0.00 N ATOM 1516 CA GLN A 119 -1.501 13.748 11.602 1.00 0.00 C ATOM 1517 C GLN A 119 -1.002 12.740 10.512 1.00 0.00 C ATOM 1518 O GLN A 119 -1.038 11.544 10.819 1.00 0.00 O ATOM 1519 CB GLN A 119 -3.007 14.084 11.352 1.00 0.00 C ATOM 1520 CG GLN A 119 -3.752 14.947 12.402 1.00 0.00 C ATOM 1521 CD GLN A 119 -5.271 14.982 12.203 1.00 0.00 C ATOM 1522 OE1 GLN A 119 -5.786 15.759 11.400 1.00 0.00 O ATOM 1523 NE2 GLN A 119 -6.015 14.152 12.918 1.00 0.00 N ATOM 0 H GLN A 119 -1.039 15.788 11.264 1.00 0.00 H new ATOM 0 HA GLN A 119 -1.405 13.257 12.570 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -3.079 14.594 10.391 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -3.546 13.142 11.254 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -3.533 14.561 13.398 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -3.366 15.965 12.363 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -5.574 13.513 13.580 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -7.029 14.151 12.807 1.00 0.00 H new ATOM 1532 N HIS A 120 -0.539 13.163 9.297 1.00 0.00 N ATOM 1533 CA HIS A 120 0.092 12.266 8.268 1.00 0.00 C ATOM 1534 C HIS A 120 1.334 11.451 8.754 1.00 0.00 C ATOM 1535 O HIS A 120 1.381 10.259 8.463 1.00 0.00 O ATOM 1536 CB HIS A 120 0.428 13.086 6.988 1.00 0.00 C ATOM 1537 CG HIS A 120 0.762 12.263 5.732 1.00 0.00 C ATOM 1538 ND1 HIS A 120 2.083 11.974 5.403 1.00 0.00 N ATOM 1539 CD2 HIS A 120 -0.126 11.531 4.911 1.00 0.00 C ATOM 1540 CE1 HIS A 120 1.863 11.074 4.395 1.00 0.00 C ATOM 1541 NE2 HIS A 120 0.590 10.748 4.029 1.00 0.00 N ATOM 0 H HIS A 120 -0.591 14.137 9.000 1.00 0.00 H new ATOM 0 HA HIS A 120 -0.656 11.504 8.049 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -0.420 13.732 6.761 1.00 0.00 H new ATOM 0 HB3 HIS A 120 1.274 13.737 7.208 1.00 0.00 H new ATOM 0 HD1 HIS A 120 2.955 12.327 5.796 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -1.204 11.578 4.966 1.00 0.00 H new ATOM 0 HE1 HIS A 120 2.701 10.620 3.887 1.00 0.00 H new ATOM 1549 N SER A 121 2.291 12.104 9.437 1.00 0.00 N ATOM 1550 CA SER A 121 3.483 11.443 10.046 1.00 0.00 C ATOM 1551 C SER A 121 3.229 10.510 11.264 1.00 0.00 C ATOM 1552 O SER A 121 3.988 9.546 11.400 1.00 0.00 O ATOM 1553 CB SER A 121 4.536 12.507 10.390 1.00 0.00 C ATOM 1554 OG SER A 121 4.940 13.211 9.222 1.00 0.00 O ATOM 0 H SER A 121 2.269 13.112 9.589 1.00 0.00 H new ATOM 0 HA SER A 121 3.837 10.756 9.277 1.00 0.00 H new ATOM 0 HB2 SER A 121 4.128 13.207 11.120 1.00 0.00 H new ATOM 0 HB3 SER A 121 5.402 12.033 10.852 1.00 0.00 H new ATOM 0 HG SER A 121 5.609 13.885 9.462 1.00 0.00 H new ATOM 1560 N THR A 122 2.189 10.761 12.098 1.00 0.00 N ATOM 1561 CA THR A 122 1.718 9.816 13.157 1.00 0.00 C ATOM 1562 C THR A 122 0.944 8.585 12.531 1.00 0.00 C ATOM 1563 O THR A 122 1.315 7.449 12.854 1.00 0.00 O ATOM 1564 CB THR A 122 0.945 10.681 14.210 1.00 0.00 C ATOM 1565 OG1 THR A 122 1.745 11.780 14.641 1.00 0.00 O ATOM 1566 CG2 THR A 122 0.527 9.965 15.502 1.00 0.00 C ATOM 0 H THR A 122 1.648 11.625 12.060 1.00 0.00 H new ATOM 0 HA THR A 122 2.533 9.320 13.684 1.00 0.00 H new ATOM 0 HB THR A 122 0.044 10.966 13.667 1.00 0.00 H new ATOM 0 HG1 THR A 122 1.502 12.581 14.132 1.00 0.00 H new ATOM 0 HG21 THR A 122 0.001 10.664 16.152 1.00 0.00 H new ATOM 0 HG22 THR A 122 -0.131 9.130 15.259 1.00 0.00 H new ATOM 0 HG23 THR A 122 1.414 9.591 16.014 1.00 0.00 H new ATOM 1574 N LEU A 123 -0.055 8.812 11.636 1.00 0.00 N ATOM 1575 CA LEU A 123 -0.774 7.738 10.881 1.00 0.00 C ATOM 1576 C LEU A 123 0.106 6.923 9.876 1.00 0.00 C ATOM 1577 O LEU A 123 -0.076 5.702 9.865 1.00 0.00 O ATOM 1578 CB LEU A 123 -2.050 8.305 10.161 1.00 0.00 C ATOM 1579 CG LEU A 123 -3.274 8.827 11.006 1.00 0.00 C ATOM 1580 CD1 LEU A 123 -4.221 9.708 10.155 1.00 0.00 C ATOM 1581 CD2 LEU A 123 -4.097 7.718 11.718 1.00 0.00 C ATOM 0 H LEU A 123 -0.389 9.750 11.414 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.070 7.021 11.647 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -1.723 9.127 9.525 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -2.424 7.521 9.502 1.00 0.00 H new ATOM 0 HG LEU A 123 -2.816 9.425 11.794 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -5.053 10.049 10.772 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -3.673 10.570 9.776 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -4.605 9.126 9.318 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -4.917 8.173 12.274 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -4.500 7.030 10.975 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -3.452 7.171 12.406 1.00 0.00 H new ATOM 1593 N SER A 124 1.042 7.544 9.103 1.00 0.00 N ATOM 1594 CA SER A 124 2.044 6.821 8.267 1.00 0.00 C ATOM 1595 C SER A 124 3.105 6.003 9.065 1.00 0.00 C ATOM 1596 O SER A 124 3.306 4.849 8.683 1.00 0.00 O ATOM 1597 CB SER A 124 2.712 7.792 7.276 1.00 0.00 C ATOM 1598 OG SER A 124 1.740 8.378 6.421 1.00 0.00 O ATOM 0 H SER A 124 1.123 8.559 9.042 1.00 0.00 H new ATOM 0 HA SER A 124 1.479 6.067 7.720 1.00 0.00 H new ATOM 0 HB2 SER A 124 3.241 8.572 7.823 1.00 0.00 H new ATOM 0 HB3 SER A 124 3.455 7.260 6.681 1.00 0.00 H new ATOM 0 HG SER A 124 1.349 9.163 6.859 1.00 0.00 H new ATOM 1604 N ARG A 125 3.698 6.525 10.180 1.00 0.00 N ATOM 1605 CA ARG A 125 4.556 5.740 11.132 1.00 0.00 C ATOM 1606 C ARG A 125 3.878 4.433 11.679 1.00 0.00 C ATOM 1607 O ARG A 125 4.559 3.403 11.686 1.00 0.00 O ATOM 1608 CB ARG A 125 5.060 6.754 12.220 1.00 0.00 C ATOM 1609 CG ARG A 125 6.073 6.331 13.319 1.00 0.00 C ATOM 1610 CD ARG A 125 7.539 6.127 12.889 1.00 0.00 C ATOM 1611 NE ARG A 125 8.371 5.726 14.055 1.00 0.00 N ATOM 1612 CZ ARG A 125 8.799 4.474 14.366 1.00 0.00 C ATOM 1613 NH1 ARG A 125 8.544 3.358 13.668 1.00 0.00 N ATOM 1614 NH2 ARG A 125 9.532 4.345 15.456 1.00 0.00 N ATOM 0 H ARG A 125 3.596 7.504 10.448 1.00 0.00 H new ATOM 0 HA ARG A 125 5.418 5.315 10.617 1.00 0.00 H new ATOM 0 HB2 ARG A 125 5.504 7.595 11.687 1.00 0.00 H new ATOM 0 HB3 ARG A 125 4.176 7.133 12.733 1.00 0.00 H new ATOM 0 HG2 ARG A 125 6.054 7.087 14.104 1.00 0.00 H new ATOM 0 HG3 ARG A 125 5.719 5.401 13.764 1.00 0.00 H new ATOM 0 HD2 ARG A 125 7.594 5.362 12.115 1.00 0.00 H new ATOM 0 HD3 ARG A 125 7.929 7.048 12.456 1.00 0.00 H new ATOM 0 HE ARG A 125 8.651 6.473 14.691 1.00 0.00 H new ATOM 0 HH11 ARG A 125 7.981 3.405 12.819 1.00 0.00 H new ATOM 0 HH12 ARG A 125 8.913 2.462 13.986 1.00 0.00 H new ATOM 0 HH21 ARG A 125 9.753 5.164 16.022 1.00 0.00 H new ATOM 0 HH22 ARG A 125 9.877 3.426 15.732 1.00 0.00 H new ATOM 1628 N LYS A 126 2.580 4.480 12.076 1.00 0.00 N ATOM 1629 CA LYS A 126 1.771 3.251 12.367 1.00 0.00 C ATOM 1630 C LYS A 126 1.411 2.404 11.086 1.00 0.00 C ATOM 1631 O LYS A 126 1.286 1.184 11.223 1.00 0.00 O ATOM 1632 CB LYS A 126 0.506 3.654 13.193 1.00 0.00 C ATOM 1633 CG LYS A 126 -0.256 2.558 13.996 1.00 0.00 C ATOM 1634 CD LYS A 126 0.350 2.155 15.363 1.00 0.00 C ATOM 1635 CE LYS A 126 -0.452 1.075 16.103 1.00 0.00 C ATOM 1636 NZ LYS A 126 0.191 0.752 17.386 1.00 0.00 N ATOM 0 H LYS A 126 2.065 5.351 12.204 1.00 0.00 H new ATOM 0 HA LYS A 126 2.390 2.579 12.961 1.00 0.00 H new ATOM 0 HB2 LYS A 126 0.807 4.428 13.899 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -0.205 4.110 12.504 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -1.275 2.905 14.164 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -0.322 1.664 13.375 1.00 0.00 H new ATOM 0 HD2 LYS A 126 1.367 1.796 15.207 1.00 0.00 H new ATOM 0 HD3 LYS A 126 0.418 3.041 15.995 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -1.470 1.423 16.276 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -0.522 0.178 15.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -0.361 0.020 17.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 1.154 0.401 17.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 0.235 1.607 17.977 1.00 0.00 H new ATOM 1650 N PHE A 127 1.276 3.039 9.893 1.00 0.00 N ATOM 1651 CA PHE A 127 1.115 2.356 8.574 1.00 0.00 C ATOM 1652 C PHE A 127 2.333 1.510 8.072 1.00 0.00 C ATOM 1653 O PHE A 127 2.089 0.444 7.500 1.00 0.00 O ATOM 1654 CB PHE A 127 0.681 3.411 7.510 1.00 0.00 C ATOM 1655 CG PHE A 127 -0.242 2.876 6.402 1.00 0.00 C ATOM 1656 CD1 PHE A 127 -1.625 2.916 6.569 1.00 0.00 C ATOM 1657 CD2 PHE A 127 0.281 2.391 5.211 1.00 0.00 C ATOM 1658 CE1 PHE A 127 -2.461 2.454 5.578 1.00 0.00 C ATOM 1659 CE2 PHE A 127 -0.564 1.930 4.221 1.00 0.00 C ATOM 1660 CZ PHE A 127 -1.931 1.960 4.408 1.00 0.00 C ATOM 0 H PHE A 127 1.275 4.056 9.815 1.00 0.00 H new ATOM 0 HA PHE A 127 0.343 1.602 8.726 1.00 0.00 H new ATOM 0 HB2 PHE A 127 0.175 4.231 8.019 1.00 0.00 H new ATOM 0 HB3 PHE A 127 1.576 3.827 7.047 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -2.044 3.312 7.482 1.00 0.00 H new ATOM 0 HD2 PHE A 127 1.350 2.374 5.059 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -3.532 2.479 5.718 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -0.154 1.545 3.299 1.00 0.00 H new ATOM 0 HZ PHE A 127 -2.588 1.594 3.633 1.00 0.00 H new ATOM 1670 N VAL A 128 3.603 1.949 8.304 1.00 0.00 N ATOM 1671 CA VAL A 128 4.864 1.177 8.009 1.00 0.00 C ATOM 1672 C VAL A 128 5.025 0.004 9.035 1.00 0.00 C ATOM 1673 O VAL A 128 5.297 -1.107 8.577 1.00 0.00 O ATOM 1674 CB VAL A 128 6.162 2.089 7.954 1.00 0.00 C ATOM 1675 CG1 VAL A 128 7.431 1.362 7.425 1.00 0.00 C ATOM 1676 CG2 VAL A 128 5.998 3.395 7.147 1.00 0.00 C ATOM 0 H VAL A 128 3.791 2.866 8.709 1.00 0.00 H new ATOM 0 HA VAL A 128 4.761 0.762 7.006 1.00 0.00 H new ATOM 0 HB VAL A 128 6.299 2.338 9.006 1.00 0.00 H new ATOM 0 HG11 VAL A 128 8.272 2.055 7.419 1.00 0.00 H new ATOM 0 HG12 VAL A 128 7.662 0.516 8.073 1.00 0.00 H new ATOM 0 HG13 VAL A 128 7.249 1.004 6.412 1.00 0.00 H new ATOM 0 HG21 VAL A 128 6.934 3.953 7.164 1.00 0.00 H new ATOM 0 HG22 VAL A 128 5.737 3.155 6.116 1.00 0.00 H new ATOM 0 HG23 VAL A 128 5.207 4.000 7.590 1.00 0.00 H new ATOM 1686 N GLU A 129 4.812 0.233 10.358 1.00 0.00 N ATOM 1687 CA GLU A 129 4.715 -0.859 11.390 1.00 0.00 C ATOM 1688 C GLU A 129 3.643 -1.987 11.128 1.00 0.00 C ATOM 1689 O GLU A 129 3.706 -3.011 11.819 1.00 0.00 O ATOM 1690 CB GLU A 129 4.502 -0.249 12.816 1.00 0.00 C ATOM 1691 CG GLU A 129 5.678 0.498 13.497 1.00 0.00 C ATOM 1692 CD GLU A 129 6.780 -0.406 14.051 1.00 0.00 C ATOM 1693 OE1 GLU A 129 6.441 -0.941 15.265 1.00 0.00 O ATOM 1694 OE2 GLU A 129 7.841 -0.619 13.465 1.00 0.00 O ATOM 0 H GLU A 129 4.702 1.169 10.747 1.00 0.00 H new ATOM 0 HA GLU A 129 5.675 -1.370 11.314 1.00 0.00 H new ATOM 0 HB2 GLU A 129 3.663 0.444 12.756 1.00 0.00 H new ATOM 0 HB3 GLU A 129 4.199 -1.060 13.479 1.00 0.00 H new ATOM 0 HG2 GLU A 129 6.120 1.185 12.775 1.00 0.00 H new ATOM 0 HG3 GLU A 129 5.281 1.104 14.312 1.00 0.00 H new ATOM 1701 N VAL A 130 2.724 -1.816 10.142 1.00 0.00 N ATOM 1702 CA VAL A 130 1.797 -2.907 9.666 1.00 0.00 C ATOM 1703 C VAL A 130 2.322 -3.364 8.242 1.00 0.00 C ATOM 1704 O VAL A 130 2.672 -4.541 8.148 1.00 0.00 O ATOM 1705 CB VAL A 130 0.255 -2.499 9.719 1.00 0.00 C ATOM 1706 CG1 VAL A 130 -0.704 -3.661 9.317 1.00 0.00 C ATOM 1707 CG2 VAL A 130 -0.291 -1.915 11.062 1.00 0.00 C ATOM 0 H VAL A 130 2.596 -0.931 9.651 1.00 0.00 H new ATOM 0 HA VAL A 130 1.822 -3.760 10.345 1.00 0.00 H new ATOM 0 HB VAL A 130 0.253 -1.691 8.987 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -1.737 -3.317 9.374 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -0.483 -3.979 8.298 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -0.563 -4.501 9.997 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -1.350 -1.683 10.954 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -0.160 -2.648 11.858 1.00 0.00 H new ATOM 0 HG23 VAL A 130 0.256 -1.006 11.313 1.00 0.00 H new ATOM 1717 N MET A 131 2.363 -2.513 7.175 1.00 0.00 N ATOM 1718 CA MET A 131 2.796 -2.880 5.779 1.00 0.00 C ATOM 1719 C MET A 131 4.218 -3.527 5.654 1.00 0.00 C ATOM 1720 O MET A 131 4.344 -4.451 4.842 1.00 0.00 O ATOM 1721 CB MET A 131 2.660 -1.650 4.818 1.00 0.00 C ATOM 1722 CG MET A 131 1.244 -1.258 4.339 1.00 0.00 C ATOM 1723 SD MET A 131 0.628 -2.511 3.186 1.00 0.00 S ATOM 1724 CE MET A 131 -0.582 -3.424 4.166 1.00 0.00 C ATOM 0 H MET A 131 2.092 -1.533 7.256 1.00 0.00 H new ATOM 0 HA MET A 131 2.110 -3.672 5.479 1.00 0.00 H new ATOM 0 HB2 MET A 131 3.095 -0.785 5.319 1.00 0.00 H new ATOM 0 HB3 MET A 131 3.269 -1.847 3.935 1.00 0.00 H new ATOM 0 HG2 MET A 131 0.571 -1.171 5.192 1.00 0.00 H new ATOM 0 HG3 MET A 131 1.270 -0.283 3.853 1.00 0.00 H new ATOM 0 HE1 MET A 131 -0.757 -4.399 3.712 1.00 0.00 H new ATOM 0 HE2 MET A 131 -0.203 -3.558 5.179 1.00 0.00 H new ATOM 0 HE3 MET A 131 -1.518 -2.867 4.200 1.00 0.00 H new ATOM 1734 N SER A 132 5.233 -3.078 6.438 1.00 0.00 N ATOM 1735 CA SER A 132 6.549 -3.789 6.557 1.00 0.00 C ATOM 1736 C SER A 132 6.502 -5.176 7.286 1.00 0.00 C ATOM 1737 O SER A 132 7.279 -6.059 6.908 1.00 0.00 O ATOM 1738 CB SER A 132 7.602 -2.872 7.201 1.00 0.00 C ATOM 1739 OG SER A 132 7.350 -2.690 8.588 1.00 0.00 O ATOM 0 H SER A 132 5.172 -2.229 6.999 1.00 0.00 H new ATOM 0 HA SER A 132 6.832 -4.025 5.531 1.00 0.00 H new ATOM 0 HB2 SER A 132 8.594 -3.301 7.063 1.00 0.00 H new ATOM 0 HB3 SER A 132 7.601 -1.904 6.699 1.00 0.00 H new ATOM 0 HG SER A 132 6.492 -2.231 8.707 1.00 0.00 H new ATOM 1745 N GLU A 133 5.591 -5.353 8.278 1.00 0.00 N ATOM 1746 CA GLU A 133 5.256 -6.662 8.915 1.00 0.00 C ATOM 1747 C GLU A 133 4.481 -7.627 7.940 1.00 0.00 C ATOM 1748 O GLU A 133 4.907 -8.780 7.823 1.00 0.00 O ATOM 1749 CB GLU A 133 4.520 -6.343 10.261 1.00 0.00 C ATOM 1750 CG GLU A 133 4.357 -7.473 11.299 1.00 0.00 C ATOM 1751 CD GLU A 133 5.621 -7.807 12.090 1.00 0.00 C ATOM 1752 OE1 GLU A 133 5.997 -7.167 13.071 1.00 0.00 O ATOM 1753 OE2 GLU A 133 6.275 -8.895 11.574 1.00 0.00 O ATOM 0 H GLU A 133 5.056 -4.577 8.668 1.00 0.00 H new ATOM 0 HA GLU A 133 6.156 -7.233 9.142 1.00 0.00 H new ATOM 0 HB2 GLU A 133 5.053 -5.524 10.744 1.00 0.00 H new ATOM 0 HB3 GLU A 133 3.525 -5.974 10.015 1.00 0.00 H new ATOM 0 HG2 GLU A 133 3.571 -7.192 12.000 1.00 0.00 H new ATOM 0 HG3 GLU A 133 4.019 -8.373 10.785 1.00 0.00 H new ATOM 1760 N TYR A 134 3.420 -7.146 7.236 1.00 0.00 N ATOM 1761 CA TYR A 134 2.729 -7.862 6.123 1.00 0.00 C ATOM 1762 C TYR A 134 3.618 -8.337 4.916 1.00 0.00 C ATOM 1763 O TYR A 134 3.276 -9.351 4.299 1.00 0.00 O ATOM 1764 CB TYR A 134 1.553 -6.955 5.638 1.00 0.00 C ATOM 1765 CG TYR A 134 0.449 -7.696 4.837 1.00 0.00 C ATOM 1766 CD1 TYR A 134 -0.517 -8.470 5.473 1.00 0.00 C ATOM 1767 CD2 TYR A 134 0.461 -7.657 3.447 1.00 0.00 C ATOM 1768 CE1 TYR A 134 -1.409 -9.218 4.735 1.00 0.00 C ATOM 1769 CE2 TYR A 134 -0.457 -8.380 2.716 1.00 0.00 C ATOM 1770 CZ TYR A 134 -1.385 -9.168 3.359 1.00 0.00 C ATOM 1771 OH TYR A 134 -2.269 -9.916 2.630 1.00 0.00 O ATOM 0 H TYR A 134 3.012 -6.231 7.429 1.00 0.00 H new ATOM 0 HA TYR A 134 2.385 -8.809 6.538 1.00 0.00 H new ATOM 0 HB2 TYR A 134 1.096 -6.481 6.507 1.00 0.00 H new ATOM 0 HB3 TYR A 134 1.960 -6.157 5.017 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -0.568 -8.485 6.552 1.00 0.00 H new ATOM 0 HD2 TYR A 134 1.197 -7.054 2.935 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -2.130 -9.846 5.238 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -0.448 -8.328 1.637 1.00 0.00 H new ATOM 0 HH TYR A 134 -2.117 -9.763 1.674 1.00 0.00 H new ATOM 1781 N ASN A 135 4.726 -7.622 4.619 1.00 0.00 N ATOM 1782 CA ASN A 135 5.790 -8.044 3.653 1.00 0.00 C ATOM 1783 C ASN A 135 6.618 -9.278 4.118 1.00 0.00 C ATOM 1784 O ASN A 135 6.761 -10.200 3.309 1.00 0.00 O ATOM 1785 CB ASN A 135 6.659 -6.811 3.325 1.00 0.00 C ATOM 1786 CG ASN A 135 7.405 -6.874 1.982 1.00 0.00 C ATOM 1787 OD1 ASN A 135 8.507 -7.415 1.898 1.00 0.00 O ATOM 1788 ND2 ASN A 135 6.832 -6.332 0.918 1.00 0.00 N ATOM 0 H ASN A 135 4.919 -6.716 5.047 1.00 0.00 H new ATOM 0 HA ASN A 135 5.311 -8.403 2.742 1.00 0.00 H new ATOM 0 HB2 ASN A 135 6.022 -5.927 3.327 1.00 0.00 H new ATOM 0 HB3 ASN A 135 7.390 -6.679 4.123 1.00 0.00 H new ATOM 0 HD21 ASN A 135 7.305 -6.360 0.014 1.00 0.00 H new ATOM 0 HD22 ASN A 135 5.918 -5.887 1.002 1.00 0.00 H new ATOM 1795 N ALA A 136 7.114 -9.298 5.387 1.00 0.00 N ATOM 1796 CA ALA A 136 7.687 -10.520 6.006 1.00 0.00 C ATOM 1797 C ALA A 136 6.652 -11.649 6.311 1.00 0.00 C ATOM 1798 O ALA A 136 7.084 -12.786 6.524 1.00 0.00 O ATOM 1799 CB ALA A 136 8.346 -10.107 7.320 1.00 0.00 C ATOM 0 H ALA A 136 7.127 -8.481 5.997 1.00 0.00 H new ATOM 0 HA ALA A 136 8.386 -10.940 5.282 1.00 0.00 H new ATOM 0 HB1 ALA A 136 8.778 -10.984 7.802 1.00 0.00 H new ATOM 0 HB2 ALA A 136 9.132 -9.379 7.120 1.00 0.00 H new ATOM 0 HB3 ALA A 136 7.599 -9.663 7.978 1.00 0.00 H new ATOM 1805 N THR A 137 5.326 -11.338 6.286 1.00 0.00 N ATOM 1806 CA THR A 137 4.231 -12.347 6.424 1.00 0.00 C ATOM 1807 C THR A 137 4.087 -13.266 5.150 1.00 0.00 C ATOM 1808 O THR A 137 4.039 -14.485 5.343 1.00 0.00 O ATOM 1809 CB THR A 137 2.939 -11.578 6.859 1.00 0.00 C ATOM 1810 OG1 THR A 137 3.197 -10.759 7.996 1.00 0.00 O ATOM 1811 CG2 THR A 137 1.733 -12.437 7.255 1.00 0.00 C ATOM 0 H THR A 137 4.984 -10.384 6.170 1.00 0.00 H new ATOM 0 HA THR A 137 4.461 -13.076 7.201 1.00 0.00 H new ATOM 0 HB THR A 137 2.684 -11.024 5.955 1.00 0.00 H new ATOM 0 HG1 THR A 137 3.756 -9.999 7.731 1.00 0.00 H new ATOM 0 HG21 THR A 137 0.902 -11.790 7.536 1.00 0.00 H new ATOM 0 HG22 THR A 137 1.438 -13.061 6.411 1.00 0.00 H new ATOM 0 HG23 THR A 137 2.000 -13.072 8.100 1.00 0.00 H new ATOM 1819 N GLN A 138 4.020 -12.708 3.913 1.00 0.00 N ATOM 1820 CA GLN A 138 3.955 -13.483 2.642 1.00 0.00 C ATOM 1821 C GLN A 138 5.300 -14.187 2.246 1.00 0.00 C ATOM 1822 O GLN A 138 5.216 -15.353 1.844 1.00 0.00 O ATOM 1823 CB GLN A 138 3.429 -12.542 1.510 1.00 0.00 C ATOM 1824 CG GLN A 138 1.922 -12.287 1.405 1.00 0.00 C ATOM 1825 CD GLN A 138 1.540 -11.336 0.261 1.00 0.00 C ATOM 1826 OE1 GLN A 138 1.409 -11.757 -0.887 1.00 0.00 O ATOM 1827 NE2 GLN A 138 1.354 -10.053 0.535 1.00 0.00 N ATOM 0 H GLN A 138 4.009 -11.699 3.767 1.00 0.00 H new ATOM 0 HA GLN A 138 3.262 -14.310 2.794 1.00 0.00 H new ATOM 0 HB2 GLN A 138 3.920 -11.576 1.629 1.00 0.00 H new ATOM 0 HB3 GLN A 138 3.762 -12.954 0.557 1.00 0.00 H new ATOM 0 HG2 GLN A 138 1.410 -13.238 1.262 1.00 0.00 H new ATOM 0 HG3 GLN A 138 1.565 -11.871 2.347 1.00 0.00 H new ATOM 0 HE21 GLN A 138 1.465 -9.714 1.491 1.00 0.00 H new ATOM 0 HE22 GLN A 138 1.100 -9.404 -0.210 1.00 0.00 H new ATOM 1836 N SER A 139 6.492 -13.533 2.369 1.00 0.00 N ATOM 1837 CA SER A 139 7.822 -14.184 2.169 1.00 0.00 C ATOM 1838 C SER A 139 8.205 -15.298 3.193 1.00 0.00 C ATOM 1839 O SER A 139 8.749 -16.307 2.732 1.00 0.00 O ATOM 1840 CB SER A 139 8.906 -13.096 2.080 1.00 0.00 C ATOM 1841 OG SER A 139 8.657 -12.227 0.982 1.00 0.00 O ATOM 0 H SER A 139 6.558 -12.544 2.609 1.00 0.00 H new ATOM 0 HA SER A 139 7.745 -14.734 1.231 1.00 0.00 H new ATOM 0 HB2 SER A 139 8.929 -12.522 3.006 1.00 0.00 H new ATOM 0 HB3 SER A 139 9.886 -13.560 1.968 1.00 0.00 H new ATOM 0 HG SER A 139 9.356 -11.541 0.943 1.00 0.00 H new ATOM 1847 N ASP A 140 7.909 -15.156 4.517 1.00 0.00 N ATOM 1848 CA ASP A 140 8.029 -16.273 5.508 1.00 0.00 C ATOM 1849 C ASP A 140 7.028 -17.464 5.291 1.00 0.00 C ATOM 1850 O ASP A 140 7.373 -18.574 5.709 1.00 0.00 O ATOM 1851 CB ASP A 140 7.932 -15.700 6.944 1.00 0.00 C ATOM 1852 CG ASP A 140 8.486 -16.601 8.051 1.00 0.00 C ATOM 1853 OD1 ASP A 140 9.830 -16.413 8.240 1.00 0.00 O ATOM 1854 OD2 ASP A 140 7.796 -17.395 8.688 1.00 0.00 O ATOM 0 H ASP A 140 7.585 -14.279 4.925 1.00 0.00 H new ATOM 0 HA ASP A 140 9.009 -16.722 5.348 1.00 0.00 H new ATOM 0 HB2 ASP A 140 8.463 -14.749 6.974 1.00 0.00 H new ATOM 0 HB3 ASP A 140 6.885 -15.488 7.162 1.00 0.00 H new ATOM 1859 N TYR A 141 5.851 -17.244 4.645 1.00 0.00 N ATOM 1860 CA TYR A 141 4.933 -18.330 4.185 1.00 0.00 C ATOM 1861 C TYR A 141 5.479 -19.140 2.965 1.00 0.00 C ATOM 1862 O TYR A 141 5.433 -20.359 3.041 1.00 0.00 O ATOM 1863 CB TYR A 141 3.514 -17.749 3.905 1.00 0.00 C ATOM 1864 CG TYR A 141 2.377 -18.798 3.878 1.00 0.00 C ATOM 1865 CD1 TYR A 141 1.770 -19.230 5.053 1.00 0.00 C ATOM 1866 CD2 TYR A 141 1.998 -19.377 2.672 1.00 0.00 C ATOM 1867 CE1 TYR A 141 0.820 -20.231 5.018 1.00 0.00 C ATOM 1868 CE2 TYR A 141 1.041 -20.369 2.644 1.00 0.00 C ATOM 1869 CZ TYR A 141 0.459 -20.803 3.817 1.00 0.00 C ATOM 1870 OH TYR A 141 -0.476 -21.803 3.791 1.00 0.00 O ATOM 0 H TYR A 141 5.509 -16.308 4.427 1.00 0.00 H new ATOM 0 HA TYR A 141 4.867 -19.054 4.997 1.00 0.00 H new ATOM 0 HB2 TYR A 141 3.285 -17.005 4.668 1.00 0.00 H new ATOM 0 HB3 TYR A 141 3.532 -17.229 2.947 1.00 0.00 H new ATOM 0 HD1 TYR A 141 2.043 -18.780 5.996 1.00 0.00 H new ATOM 0 HD2 TYR A 141 2.456 -19.047 1.751 1.00 0.00 H new ATOM 0 HE1 TYR A 141 0.358 -20.567 5.935 1.00 0.00 H new ATOM 0 HE2 TYR A 141 0.746 -20.807 1.702 1.00 0.00 H new ATOM 0 HH TYR A 141 -0.953 -21.827 4.647 1.00 0.00 H new