USER MOD reduce.3.24.130724 H: found=0, std=0, add=386, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 389 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 126 GLN : amide:sc= 0 K(o=1.2,f=0.4) USER MOD Set 1.2: A 128 LYS NZ :NH3+ 176:sc= 1.24 (180deg=1.2) USER MOD Set 2.1: A 110 THR OG1 : rot -110:sc= 0.587 USER MOD Set 2.2: A 112 GLN : amide:sc= 0.62 X(o=1.2,f=1.1) USER MOD Set 3.1: A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= 0.416 K(o=0.42,f=-0.1) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0.00211 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ 162:sc= 1.3 (180deg=1.18) USER MOD Single : A 121 LYS NZ :NH3+ 167:sc= 2.49 (180deg=2.34) USER MOD Single : A 123 MET CE :methyl 178:sc= 0 (180deg=-0.00675) USER MOD Single : A 129 GLN : amide:sc= -0.251 X(o=-0.25,f=-0.54) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 91 9.397 -14.792 -8.482 1.00 1.00 N ATOM 2 CA ALA A 91 9.718 -13.881 -7.348 1.00 1.00 C ATOM 3 C ALA A 91 8.556 -12.917 -7.042 1.00 1.00 C ATOM 4 O ALA A 91 7.738 -12.633 -7.918 1.00 1.00 O ATOM 5 CB ALA A 91 11.029 -13.104 -7.603 1.00 1.00 C ATOM 0 HA ALA A 91 9.865 -14.507 -6.468 1.00 1.00 H new ATOM 0 HB1 ALA A 91 11.234 -12.449 -6.757 1.00 1.00 H new ATOM 0 HB2 ALA A 91 11.852 -13.809 -7.724 1.00 1.00 H new ATOM 0 HB3 ALA A 91 10.927 -12.506 -8.509 1.00 1.00 H new ATOM 13 N ALA A 92 8.478 -12.411 -5.801 1.00 1.00 N ATOM 14 CA ALA A 92 7.358 -11.591 -5.300 1.00 1.00 C ATOM 15 C ALA A 92 7.797 -10.378 -4.439 1.00 1.00 C ATOM 16 O ALA A 92 6.988 -9.819 -3.692 1.00 1.00 O ATOM 17 CB ALA A 92 6.405 -12.535 -4.547 1.00 1.00 C ATOM 0 H ALA A 92 9.205 -12.562 -5.102 1.00 1.00 H new ATOM 0 HA ALA A 92 6.851 -11.127 -6.146 1.00 1.00 H new ATOM 0 HB1 ALA A 92 5.560 -11.966 -4.159 1.00 1.00 H new ATOM 0 HB2 ALA A 92 6.042 -13.305 -5.228 1.00 1.00 H new ATOM 0 HB3 ALA A 92 6.937 -13.004 -3.719 1.00 1.00 H new ATOM 23 N ARG A 93 9.075 -9.969 -4.523 1.00 1.00 N ATOM 24 CA ARG A 93 9.681 -8.884 -3.721 1.00 1.00 C ATOM 25 C ARG A 93 10.702 -8.071 -4.550 1.00 1.00 C ATOM 26 O ARG A 93 11.900 -8.370 -4.506 1.00 1.00 O ATOM 27 CB ARG A 93 10.272 -9.492 -2.430 1.00 1.00 C ATOM 28 CG ARG A 93 10.663 -8.423 -1.399 1.00 1.00 C ATOM 29 CD ARG A 93 11.156 -9.078 -0.102 1.00 1.00 C ATOM 30 NE ARG A 93 11.470 -8.067 0.928 1.00 1.00 N ATOM 31 CZ ARG A 93 11.839 -8.300 2.176 1.00 1.00 C ATOM 32 NH1 ARG A 93 11.987 -9.510 2.641 1.00 1.00 N ATOM 33 NH2 ARG A 93 12.069 -7.312 2.995 1.00 1.00 N ATOM 0 H ARG A 93 9.738 -10.396 -5.170 1.00 1.00 H new ATOM 0 HA ARG A 93 8.919 -8.161 -3.429 1.00 1.00 H new ATOM 0 HB2 ARG A 93 9.544 -10.171 -1.986 1.00 1.00 H new ATOM 0 HB3 ARG A 93 11.150 -10.087 -2.682 1.00 1.00 H new ATOM 0 HG2 ARG A 93 11.444 -7.783 -1.809 1.00 1.00 H new ATOM 0 HG3 ARG A 93 9.806 -7.784 -1.187 1.00 1.00 H new ATOM 0 HD2 ARG A 93 10.394 -9.759 0.276 1.00 1.00 H new ATOM 0 HD3 ARG A 93 12.043 -9.676 -0.309 1.00 1.00 H new ATOM 0 HE ARG A 93 11.394 -7.089 0.648 1.00 1.00 H new ATOM 0 HH11 ARG A 93 11.817 -10.313 2.036 1.00 1.00 H new ATOM 0 HH12 ARG A 93 12.273 -9.653 3.610 1.00 1.00 H new ATOM 0 HH21 ARG A 93 11.965 -6.349 2.675 1.00 1.00 H new ATOM 0 HH22 ARG A 93 12.353 -7.502 3.956 1.00 1.00 H new ATOM 47 N PRO A 94 10.236 -7.101 -5.366 1.00 1.00 N ATOM 48 CA PRO A 94 11.089 -6.221 -6.177 1.00 1.00 C ATOM 49 C PRO A 94 12.193 -5.477 -5.400 1.00 1.00 C ATOM 50 O PRO A 94 12.105 -5.279 -4.187 1.00 1.00 O ATOM 51 CB PRO A 94 10.134 -5.221 -6.838 1.00 1.00 C ATOM 52 CG PRO A 94 8.805 -5.968 -6.893 1.00 1.00 C ATOM 53 CD PRO A 94 8.832 -6.788 -5.606 1.00 1.00 C ATOM 0 HA PRO A 94 11.644 -6.832 -6.889 1.00 1.00 H new ATOM 0 HB2 PRO A 94 10.053 -4.302 -6.257 1.00 1.00 H new ATOM 0 HB3 PRO A 94 10.476 -4.940 -7.834 1.00 1.00 H new ATOM 0 HG2 PRO A 94 7.956 -5.284 -6.921 1.00 1.00 H new ATOM 0 HG3 PRO A 94 8.732 -6.602 -7.777 1.00 1.00 H new ATOM 0 HD2 PRO A 94 8.409 -6.225 -4.774 1.00 1.00 H new ATOM 0 HD3 PRO A 94 8.240 -7.698 -5.709 1.00 1.00 H new ATOM 61 N ALA A 95 13.209 -5.003 -6.133 1.00 1.00 N ATOM 62 CA ALA A 95 14.336 -4.208 -5.629 1.00 1.00 C ATOM 63 C ALA A 95 14.858 -3.223 -6.702 1.00 1.00 C ATOM 64 O ALA A 95 14.427 -3.276 -7.856 1.00 1.00 O ATOM 65 CB ALA A 95 15.437 -5.182 -5.182 1.00 1.00 C ATOM 0 H ALA A 95 13.270 -5.171 -7.137 1.00 1.00 H new ATOM 0 HA ALA A 95 14.012 -3.599 -4.785 1.00 1.00 H new ATOM 0 HB1 ALA A 95 16.289 -4.618 -4.802 1.00 1.00 H new ATOM 0 HB2 ALA A 95 15.051 -5.831 -4.396 1.00 1.00 H new ATOM 0 HB3 ALA A 95 15.753 -5.789 -6.031 1.00 1.00 H new ATOM 71 N LYS A 96 15.809 -2.344 -6.339 1.00 1.00 N ATOM 72 CA LYS A 96 16.445 -1.382 -7.263 1.00 1.00 C ATOM 73 C LYS A 96 17.973 -1.302 -7.156 1.00 1.00 C ATOM 74 O LYS A 96 18.620 -0.897 -8.118 1.00 1.00 O ATOM 75 CB LYS A 96 15.784 0.003 -7.102 1.00 1.00 C ATOM 76 CG LYS A 96 15.907 0.884 -8.361 1.00 1.00 C ATOM 77 CD LYS A 96 15.671 2.381 -8.095 1.00 1.00 C ATOM 78 CE LYS A 96 14.326 2.683 -7.408 1.00 1.00 C ATOM 79 NZ LYS A 96 14.172 4.137 -7.106 1.00 1.00 N ATOM 0 H LYS A 96 16.163 -2.279 -5.385 1.00 1.00 H new ATOM 0 HA LYS A 96 16.272 -1.759 -8.271 1.00 1.00 H new ATOM 0 HB2 LYS A 96 14.729 -0.131 -6.861 1.00 1.00 H new ATOM 0 HB3 LYS A 96 16.240 0.520 -6.258 1.00 1.00 H new ATOM 0 HG2 LYS A 96 16.901 0.753 -8.790 1.00 1.00 H new ATOM 0 HG3 LYS A 96 15.190 0.539 -9.106 1.00 1.00 H new ATOM 0 HD2 LYS A 96 16.481 2.762 -7.473 1.00 1.00 H new ATOM 0 HD3 LYS A 96 15.715 2.920 -9.041 1.00 1.00 H new ATOM 0 HE2 LYS A 96 13.508 2.357 -8.051 1.00 1.00 H new ATOM 0 HE3 LYS A 96 14.253 2.110 -6.484 1.00 1.00 H new ATOM 0 HZ1 LYS A 96 13.255 4.300 -6.644 1.00 1.00 H new ATOM 0 HZ2 LYS A 96 14.938 4.443 -6.473 1.00 1.00 H new ATOM 0 HZ3 LYS A 96 14.216 4.682 -7.991 1.00 1.00 H new ATOM 93 N TYR A 97 18.558 -1.748 -6.048 1.00 1.00 N ATOM 94 CA TYR A 97 20.000 -1.663 -5.775 1.00 1.00 C ATOM 95 C TYR A 97 20.545 -3.023 -5.313 1.00 1.00 C ATOM 96 O TYR A 97 19.774 -3.894 -4.911 1.00 1.00 O ATOM 97 CB TYR A 97 20.263 -0.585 -4.706 1.00 1.00 C ATOM 98 CG TYR A 97 19.481 0.710 -4.851 1.00 1.00 C ATOM 99 CD1 TYR A 97 20.000 1.779 -5.606 1.00 1.00 C ATOM 100 CD2 TYR A 97 18.230 0.849 -4.217 1.00 1.00 C ATOM 101 CE1 TYR A 97 19.245 2.958 -5.771 1.00 1.00 C ATOM 102 CE2 TYR A 97 17.483 2.034 -4.366 1.00 1.00 C ATOM 103 CZ TYR A 97 17.988 3.092 -5.144 1.00 1.00 C ATOM 104 OH TYR A 97 17.252 4.232 -5.292 1.00 1.00 O ATOM 0 H TYR A 97 18.034 -2.191 -5.293 1.00 1.00 H new ATOM 0 HA TYR A 97 20.517 -1.386 -6.694 1.00 1.00 H new ATOM 0 HB2 TYR A 97 20.041 -1.011 -3.728 1.00 1.00 H new ATOM 0 HB3 TYR A 97 21.326 -0.346 -4.715 1.00 1.00 H new ATOM 0 HD1 TYR A 97 20.977 1.696 -6.059 1.00 1.00 H new ATOM 0 HD2 TYR A 97 17.842 0.042 -3.613 1.00 1.00 H new ATOM 0 HE1 TYR A 97 19.630 3.762 -6.380 1.00 1.00 H new ATOM 0 HE2 TYR A 97 16.522 2.130 -3.883 1.00 1.00 H new ATOM 0 HH TYR A 97 16.414 4.148 -4.791 1.00 1.00 H new ATOM 114 N SER A 98 21.864 -3.213 -5.319 1.00 1.00 N ATOM 115 CA SER A 98 22.539 -4.378 -4.723 1.00 1.00 C ATOM 116 C SER A 98 23.978 -4.076 -4.300 1.00 1.00 C ATOM 117 O SER A 98 24.567 -3.093 -4.751 1.00 1.00 O ATOM 118 CB SER A 98 22.525 -5.566 -5.698 1.00 1.00 C ATOM 119 OG SER A 98 23.316 -5.314 -6.851 1.00 1.00 O ATOM 0 H SER A 98 22.512 -2.551 -5.746 1.00 1.00 H new ATOM 0 HA SER A 98 21.980 -4.633 -3.822 1.00 1.00 H new ATOM 0 HB2 SER A 98 22.896 -6.457 -5.191 1.00 1.00 H new ATOM 0 HB3 SER A 98 21.499 -5.776 -6.000 1.00 1.00 H new ATOM 0 HG SER A 98 23.284 -6.092 -7.446 1.00 1.00 H new ATOM 125 N TYR A 99 24.558 -4.919 -3.435 1.00 1.00 N ATOM 126 CA TYR A 99 25.973 -4.837 -3.055 1.00 1.00 C ATOM 127 C TYR A 99 26.633 -6.211 -2.836 1.00 1.00 C ATOM 128 O TYR A 99 25.976 -7.261 -2.849 1.00 1.00 O ATOM 129 CB TYR A 99 26.150 -3.873 -1.869 1.00 1.00 C ATOM 130 CG TYR A 99 25.608 -4.335 -0.534 1.00 1.00 C ATOM 131 CD1 TYR A 99 24.246 -4.153 -0.230 1.00 1.00 C ATOM 132 CD2 TYR A 99 26.477 -4.879 0.430 1.00 1.00 C ATOM 133 CE1 TYR A 99 23.763 -4.465 1.056 1.00 1.00 C ATOM 134 CE2 TYR A 99 26.000 -5.187 1.716 1.00 1.00 C ATOM 135 CZ TYR A 99 24.646 -4.963 2.042 1.00 1.00 C ATOM 136 OH TYR A 99 24.217 -5.222 3.309 1.00 1.00 O ATOM 0 H TYR A 99 24.056 -5.680 -2.978 1.00 1.00 H new ATOM 0 HA TYR A 99 26.518 -4.420 -3.902 1.00 1.00 H new ATOM 0 HB2 TYR A 99 27.214 -3.668 -1.752 1.00 1.00 H new ATOM 0 HB3 TYR A 99 25.670 -2.928 -2.123 1.00 1.00 H new ATOM 0 HD1 TYR A 99 23.571 -3.774 -0.983 1.00 1.00 H new ATOM 0 HD2 TYR A 99 27.512 -5.060 0.181 1.00 1.00 H new ATOM 0 HE1 TYR A 99 22.718 -4.324 1.289 1.00 1.00 H new ATOM 0 HE2 TYR A 99 26.672 -5.596 2.456 1.00 1.00 H new ATOM 0 HH TYR A 99 24.965 -5.559 3.845 1.00 1.00 H new ATOM 146 N VAL A 100 27.955 -6.178 -2.628 1.00 1.00 N ATOM 147 CA VAL A 100 28.894 -7.319 -2.618 1.00 1.00 C ATOM 148 C VAL A 100 29.575 -7.541 -1.255 1.00 1.00 C ATOM 149 O VAL A 100 29.675 -6.621 -0.443 1.00 1.00 O ATOM 150 CB VAL A 100 29.930 -7.063 -3.744 1.00 1.00 C ATOM 151 CG1 VAL A 100 31.031 -6.073 -3.354 1.00 1.00 C ATOM 152 CG2 VAL A 100 30.577 -8.337 -4.276 1.00 1.00 C ATOM 0 H VAL A 100 28.435 -5.296 -2.450 1.00 1.00 H new ATOM 0 HA VAL A 100 28.342 -8.242 -2.796 1.00 1.00 H new ATOM 0 HB VAL A 100 29.332 -6.618 -4.539 1.00 1.00 H new ATOM 0 HG11 VAL A 100 31.718 -5.944 -4.191 1.00 1.00 H new ATOM 0 HG12 VAL A 100 30.583 -5.112 -3.101 1.00 1.00 H new ATOM 0 HG13 VAL A 100 31.577 -6.457 -2.492 1.00 1.00 H new ATOM 0 HG21 VAL A 100 31.290 -8.083 -5.060 1.00 1.00 H new ATOM 0 HG22 VAL A 100 31.096 -8.847 -3.465 1.00 1.00 H new ATOM 0 HG23 VAL A 100 29.808 -8.993 -4.684 1.00 1.00 H new ATOM 162 N ASP A 101 30.065 -8.760 -1.020 1.00 1.00 N ATOM 163 CA ASP A 101 30.927 -9.157 0.105 1.00 1.00 C ATOM 164 C ASP A 101 31.882 -10.308 -0.321 1.00 1.00 C ATOM 165 O ASP A 101 32.054 -10.570 -1.513 1.00 1.00 O ATOM 166 CB ASP A 101 30.044 -9.516 1.314 1.00 1.00 C ATOM 167 CG ASP A 101 30.812 -9.424 2.644 1.00 1.00 C ATOM 168 OD1 ASP A 101 30.926 -8.308 3.204 1.00 1.00 O ATOM 169 OD2 ASP A 101 31.322 -10.464 3.123 1.00 1.00 O ATOM 0 H ASP A 101 29.862 -9.543 -1.642 1.00 1.00 H new ATOM 0 HA ASP A 101 31.569 -8.328 0.403 1.00 1.00 H new ATOM 0 HB2 ASP A 101 29.185 -8.846 1.346 1.00 1.00 H new ATOM 0 HB3 ASP A 101 29.655 -10.527 1.190 1.00 1.00 H new ATOM 174 N GLU A 102 32.540 -10.996 0.617 1.00 1.00 N ATOM 175 CA GLU A 102 33.550 -12.037 0.365 1.00 1.00 C ATOM 176 C GLU A 102 33.045 -13.200 -0.515 1.00 1.00 C ATOM 177 O GLU A 102 33.784 -13.727 -1.351 1.00 1.00 O ATOM 178 CB GLU A 102 34.003 -12.562 1.738 1.00 1.00 C ATOM 179 CG GLU A 102 35.231 -13.475 1.712 1.00 1.00 C ATOM 180 CD GLU A 102 36.515 -12.718 1.319 1.00 1.00 C ATOM 181 OE1 GLU A 102 37.146 -12.085 2.202 1.00 1.00 O ATOM 182 OE2 GLU A 102 36.917 -12.758 0.131 1.00 1.00 O ATOM 0 H GLU A 102 32.380 -10.840 1.612 1.00 1.00 H new ATOM 0 HA GLU A 102 34.371 -11.594 -0.199 1.00 1.00 H new ATOM 0 HB2 GLU A 102 34.217 -11.710 2.383 1.00 1.00 H new ATOM 0 HB3 GLU A 102 33.175 -13.106 2.193 1.00 1.00 H new ATOM 0 HG2 GLU A 102 35.365 -13.928 2.694 1.00 1.00 H new ATOM 0 HG3 GLU A 102 35.061 -14.288 1.007 1.00 1.00 H new ATOM 189 N ASN A 103 31.774 -13.591 -0.354 1.00 1.00 N ATOM 190 CA ASN A 103 31.123 -14.657 -1.119 1.00 1.00 C ATOM 191 C ASN A 103 30.852 -14.307 -2.603 1.00 1.00 C ATOM 192 O ASN A 103 30.538 -15.197 -3.397 1.00 1.00 O ATOM 193 CB ASN A 103 29.791 -15.004 -0.420 1.00 1.00 C ATOM 194 CG ASN A 103 28.726 -13.936 -0.653 1.00 1.00 C ATOM 195 OD1 ASN A 103 28.689 -12.913 0.013 1.00 1.00 O ATOM 196 ND2 ASN A 103 27.866 -14.123 -1.631 1.00 1.00 N ATOM 0 H ASN A 103 31.154 -13.161 0.332 1.00 1.00 H new ATOM 0 HA ASN A 103 31.811 -15.502 -1.138 1.00 1.00 H new ATOM 0 HB2 ASN A 103 29.428 -15.964 -0.788 1.00 1.00 H new ATOM 0 HB3 ASN A 103 29.962 -15.117 0.650 1.00 1.00 H new ATOM 0 HD21 ASN A 103 27.164 -13.412 -1.836 1.00 1.00 H new ATOM 0 HD22 ASN A 103 27.901 -14.979 -2.184 1.00 1.00 H new ATOM 203 N GLY A 104 30.906 -13.019 -2.953 1.00 1.00 N ATOM 204 CA GLY A 104 30.459 -12.458 -4.229 1.00 1.00 C ATOM 205 C GLY A 104 29.335 -11.453 -3.959 1.00 1.00 C ATOM 206 O GLY A 104 29.291 -10.838 -2.892 1.00 1.00 O ATOM 0 H GLY A 104 31.280 -12.307 -2.325 1.00 1.00 H new ATOM 0 HA2 GLY A 104 31.289 -11.968 -4.738 1.00 1.00 H new ATOM 0 HA3 GLY A 104 30.106 -13.252 -4.887 1.00 1.00 H new ATOM 210 N GLU A 105 28.408 -11.257 -4.904 1.00 1.00 N ATOM 211 CA GLU A 105 27.183 -10.479 -4.637 1.00 1.00 C ATOM 212 C GLU A 105 26.488 -10.970 -3.350 1.00 1.00 C ATOM 213 O GLU A 105 26.278 -12.175 -3.172 1.00 1.00 O ATOM 214 CB GLU A 105 26.246 -10.464 -5.857 1.00 1.00 C ATOM 215 CG GLU A 105 25.729 -11.837 -6.314 1.00 1.00 C ATOM 216 CD GLU A 105 24.907 -11.705 -7.612 1.00 1.00 C ATOM 217 OE1 GLU A 105 23.682 -11.443 -7.537 1.00 1.00 O ATOM 218 OE2 GLU A 105 25.478 -11.873 -8.717 1.00 1.00 O ATOM 0 H GLU A 105 28.477 -11.621 -5.854 1.00 1.00 H new ATOM 0 HA GLU A 105 27.468 -9.441 -4.463 1.00 1.00 H new ATOM 0 HB2 GLU A 105 25.389 -9.831 -5.627 1.00 1.00 H new ATOM 0 HB3 GLU A 105 26.771 -9.998 -6.690 1.00 1.00 H new ATOM 0 HG2 GLU A 105 26.569 -12.512 -6.477 1.00 1.00 H new ATOM 0 HG3 GLU A 105 25.113 -12.278 -5.531 1.00 1.00 H new ATOM 225 N THR A 106 26.189 -10.054 -2.418 1.00 1.00 N ATOM 226 CA THR A 106 25.730 -10.419 -1.073 1.00 1.00 C ATOM 227 C THR A 106 24.227 -10.217 -0.884 1.00 1.00 C ATOM 228 O THR A 106 23.564 -11.148 -0.419 1.00 1.00 O ATOM 229 CB THR A 106 26.577 -9.804 0.051 1.00 1.00 C ATOM 230 OG1 THR A 106 26.301 -10.496 1.255 1.00 1.00 O ATOM 231 CG2 THR A 106 26.367 -8.319 0.339 1.00 1.00 C ATOM 0 H THR A 106 26.258 -9.048 -2.574 1.00 1.00 H new ATOM 0 HA THR A 106 25.894 -11.493 -0.989 1.00 1.00 H new ATOM 0 HB THR A 106 27.603 -9.901 -0.305 1.00 1.00 H new ATOM 0 HG1 THR A 106 26.837 -10.115 1.982 1.00 1.00 H new ATOM 0 HG21 THR A 106 27.023 -8.010 1.152 1.00 1.00 H new ATOM 0 HG22 THR A 106 26.598 -7.739 -0.554 1.00 1.00 H new ATOM 0 HG23 THR A 106 25.329 -8.147 0.625 1.00 1.00 H new ATOM 239 N LYS A 107 23.657 -9.077 -1.327 1.00 1.00 N ATOM 240 CA LYS A 107 22.185 -8.875 -1.338 1.00 1.00 C ATOM 241 C LYS A 107 21.705 -7.707 -2.210 1.00 1.00 C ATOM 242 O LYS A 107 22.500 -6.883 -2.661 1.00 1.00 O ATOM 243 CB LYS A 107 21.627 -8.742 0.101 1.00 1.00 C ATOM 244 CG LYS A 107 22.014 -7.445 0.831 1.00 1.00 C ATOM 245 CD LYS A 107 21.440 -7.392 2.256 1.00 1.00 C ATOM 246 CE LYS A 107 19.904 -7.320 2.281 1.00 1.00 C ATOM 247 NZ LYS A 107 19.377 -7.228 3.674 1.00 1.00 N ATOM 0 H LYS A 107 24.188 -8.282 -1.682 1.00 1.00 H new ATOM 0 HA LYS A 107 21.783 -9.775 -1.804 1.00 1.00 H new ATOM 0 HB2 LYS A 107 20.540 -8.808 0.060 1.00 1.00 H new ATOM 0 HB3 LYS A 107 21.976 -9.590 0.690 1.00 1.00 H new ATOM 0 HG2 LYS A 107 23.100 -7.364 0.875 1.00 1.00 H new ATOM 0 HG3 LYS A 107 21.653 -6.588 0.263 1.00 1.00 H new ATOM 0 HD2 LYS A 107 21.766 -8.274 2.807 1.00 1.00 H new ATOM 0 HD3 LYS A 107 21.848 -6.524 2.774 1.00 1.00 H new ATOM 0 HE2 LYS A 107 19.571 -6.454 1.708 1.00 1.00 H new ATOM 0 HE3 LYS A 107 19.491 -8.203 1.793 1.00 1.00 H new ATOM 0 HZ1 LYS A 107 18.338 -7.181 3.650 1.00 1.00 H new ATOM 0 HZ2 LYS A 107 19.673 -8.066 4.213 1.00 1.00 H new ATOM 0 HZ3 LYS A 107 19.751 -6.372 4.131 1.00 1.00 H new ATOM 261 N THR A 108 20.384 -7.613 -2.377 1.00 1.00 N ATOM 262 CA THR A 108 19.651 -6.499 -3.013 1.00 1.00 C ATOM 263 C THR A 108 19.033 -5.551 -1.969 1.00 1.00 C ATOM 264 O THR A 108 18.948 -5.882 -0.782 1.00 1.00 O ATOM 265 CB THR A 108 18.532 -7.042 -3.926 1.00 1.00 C ATOM 266 OG1 THR A 108 17.715 -7.948 -3.209 1.00 1.00 O ATOM 267 CG2 THR A 108 19.085 -7.777 -5.150 1.00 1.00 C ATOM 0 H THR A 108 19.756 -8.350 -2.057 1.00 1.00 H new ATOM 0 HA THR A 108 20.373 -5.937 -3.605 1.00 1.00 H new ATOM 0 HB THR A 108 17.959 -6.178 -4.262 1.00 1.00 H new ATOM 0 HG1 THR A 108 17.007 -8.286 -3.797 1.00 1.00 H new ATOM 0 HG21 THR A 108 18.258 -8.140 -5.761 1.00 1.00 H new ATOM 0 HG22 THR A 108 19.698 -7.094 -5.738 1.00 1.00 H new ATOM 0 HG23 THR A 108 19.693 -8.621 -4.824 1.00 1.00 H new ATOM 275 N TRP A 109 18.603 -4.360 -2.406 1.00 1.00 N ATOM 276 CA TRP A 109 17.982 -3.321 -1.569 1.00 1.00 C ATOM 277 C TRP A 109 16.951 -2.493 -2.362 1.00 1.00 C ATOM 278 O TRP A 109 16.992 -2.431 -3.592 1.00 1.00 O ATOM 279 CB TRP A 109 19.100 -2.448 -0.964 1.00 1.00 C ATOM 280 CG TRP A 109 18.677 -1.325 -0.060 1.00 1.00 C ATOM 281 CD1 TRP A 109 17.885 -1.456 1.031 1.00 1.00 C ATOM 282 CD2 TRP A 109 19.046 0.092 -0.113 1.00 1.00 C ATOM 283 NE1 TRP A 109 17.696 -0.219 1.617 1.00 1.00 N ATOM 284 CE2 TRP A 109 18.420 0.762 0.982 1.00 1.00 C ATOM 285 CE3 TRP A 109 19.862 0.881 -0.952 1.00 1.00 C ATOM 286 CZ2 TRP A 109 18.590 2.132 1.233 1.00 1.00 C ATOM 287 CZ3 TRP A 109 20.039 2.260 -0.710 1.00 1.00 C ATOM 288 CH2 TRP A 109 19.407 2.886 0.377 1.00 1.00 C ATOM 0 H TRP A 109 18.680 -4.082 -3.385 1.00 1.00 H new ATOM 0 HA TRP A 109 17.421 -3.787 -0.759 1.00 1.00 H new ATOM 0 HB2 TRP A 109 19.772 -3.099 -0.404 1.00 1.00 H new ATOM 0 HB3 TRP A 109 19.678 -2.023 -1.784 1.00 1.00 H new ATOM 0 HD1 TRP A 109 17.466 -2.385 1.388 1.00 1.00 H new ATOM 0 HE1 TRP A 109 17.093 -0.054 2.423 1.00 1.00 H new ATOM 0 HE3 TRP A 109 20.359 0.422 -1.793 1.00 1.00 H new ATOM 0 HZ2 TRP A 109 18.099 2.600 2.073 1.00 1.00 H new ATOM 0 HZ3 TRP A 109 20.668 2.841 -1.368 1.00 1.00 H new ATOM 0 HH2 TRP A 109 19.549 3.942 0.553 1.00 1.00 H new ATOM 299 N THR A 110 16.021 -1.848 -1.651 1.00 1.00 N ATOM 300 CA THR A 110 14.844 -1.149 -2.218 1.00 1.00 C ATOM 301 C THR A 110 14.920 0.380 -2.142 1.00 1.00 C ATOM 302 O THR A 110 14.123 1.064 -2.785 1.00 1.00 O ATOM 303 CB THR A 110 13.565 -1.580 -1.488 1.00 1.00 C ATOM 304 OG1 THR A 110 13.666 -1.249 -0.117 1.00 1.00 O ATOM 305 CG2 THR A 110 13.279 -3.074 -1.576 1.00 1.00 C ATOM 0 H THR A 110 16.060 -1.791 -0.633 1.00 1.00 H new ATOM 0 HA THR A 110 14.832 -1.433 -3.270 1.00 1.00 H new ATOM 0 HB THR A 110 12.751 -1.051 -1.983 1.00 1.00 H new ATOM 0 HG1 THR A 110 13.754 -2.069 0.412 1.00 1.00 H new ATOM 0 HG21 THR A 110 12.360 -3.301 -1.036 1.00 1.00 H new ATOM 0 HG22 THR A 110 13.167 -3.362 -2.621 1.00 1.00 H new ATOM 0 HG23 THR A 110 14.106 -3.629 -1.133 1.00 1.00 H new ATOM 313 N GLY A 111 15.851 0.924 -1.346 1.00 1.00 N ATOM 314 CA GLY A 111 15.927 2.351 -1.007 1.00 1.00 C ATOM 315 C GLY A 111 15.279 2.702 0.343 1.00 1.00 C ATOM 316 O GLY A 111 15.425 3.831 0.815 1.00 1.00 O ATOM 0 H GLY A 111 16.589 0.371 -0.910 1.00 1.00 H new ATOM 0 HA2 GLY A 111 16.973 2.655 -0.988 1.00 1.00 H new ATOM 0 HA3 GLY A 111 15.442 2.928 -1.794 1.00 1.00 H new ATOM 320 N GLN A 112 14.551 1.761 0.966 1.00 1.00 N ATOM 321 CA GLN A 112 13.915 1.948 2.280 1.00 1.00 C ATOM 322 C GLN A 112 14.939 1.858 3.431 1.00 1.00 C ATOM 323 O GLN A 112 15.850 1.026 3.403 1.00 1.00 O ATOM 324 CB GLN A 112 12.818 0.885 2.467 1.00 1.00 C ATOM 325 CG GLN A 112 11.668 1.045 1.458 1.00 1.00 C ATOM 326 CD GLN A 112 10.648 -0.083 1.584 1.00 1.00 C ATOM 327 OE1 GLN A 112 9.593 0.051 2.191 1.00 1.00 O ATOM 328 NE2 GLN A 112 10.928 -1.239 1.019 1.00 1.00 N ATOM 0 H GLN A 112 14.386 0.837 0.566 1.00 1.00 H new ATOM 0 HA GLN A 112 13.479 2.946 2.309 1.00 1.00 H new ATOM 0 HB2 GLN A 112 13.256 -0.108 2.360 1.00 1.00 H new ATOM 0 HB3 GLN A 112 12.421 0.951 3.480 1.00 1.00 H new ATOM 0 HG2 GLN A 112 11.173 2.003 1.618 1.00 1.00 H new ATOM 0 HG3 GLN A 112 12.071 1.060 0.445 1.00 1.00 H new ATOM 0 HE21 GLN A 112 11.804 -1.360 0.511 1.00 1.00 H new ATOM 0 HE22 GLN A 112 10.268 -2.014 1.089 1.00 1.00 H new ATOM 337 N GLY A 113 14.759 2.679 4.470 1.00 1.00 N ATOM 338 CA GLY A 113 15.693 2.778 5.602 1.00 1.00 C ATOM 339 C GLY A 113 17.010 3.496 5.263 1.00 1.00 C ATOM 340 O GLY A 113 17.152 4.114 4.201 1.00 1.00 O ATOM 0 H GLY A 113 13.954 3.300 4.552 1.00 1.00 H new ATOM 0 HA2 GLY A 113 15.203 3.306 6.420 1.00 1.00 H new ATOM 0 HA3 GLY A 113 15.920 1.774 5.962 1.00 1.00 H new ATOM 344 N ARG A 114 17.981 3.444 6.186 1.00 1.00 N ATOM 345 CA ARG A 114 19.337 3.997 5.987 1.00 1.00 C ATOM 346 C ARG A 114 20.123 3.201 4.931 1.00 1.00 C ATOM 347 O ARG A 114 19.917 1.996 4.773 1.00 1.00 O ATOM 348 CB ARG A 114 20.113 4.014 7.321 1.00 1.00 C ATOM 349 CG ARG A 114 19.425 4.776 8.474 1.00 1.00 C ATOM 350 CD ARG A 114 19.012 6.218 8.148 1.00 1.00 C ATOM 351 NE ARG A 114 20.171 7.073 7.812 1.00 1.00 N ATOM 352 CZ ARG A 114 20.128 8.303 7.325 1.00 1.00 C ATOM 353 NH1 ARG A 114 19.003 8.907 7.066 1.00 1.00 N ATOM 354 NH2 ARG A 114 21.228 8.956 7.084 1.00 1.00 N ATOM 0 H ARG A 114 17.850 3.014 7.102 1.00 1.00 H new ATOM 0 HA ARG A 114 19.225 5.019 5.624 1.00 1.00 H new ATOM 0 HB2 ARG A 114 20.282 2.985 7.637 1.00 1.00 H new ATOM 0 HB3 ARG A 114 21.093 4.459 7.147 1.00 1.00 H new ATOM 0 HG2 ARG A 114 18.538 4.220 8.777 1.00 1.00 H new ATOM 0 HG3 ARG A 114 20.099 4.793 9.331 1.00 1.00 H new ATOM 0 HD2 ARG A 114 18.313 6.213 7.312 1.00 1.00 H new ATOM 0 HD3 ARG A 114 18.485 6.644 9.002 1.00 1.00 H new ATOM 0 HE ARG A 114 21.096 6.675 7.972 1.00 1.00 H new ATOM 0 HH11 ARG A 114 18.117 8.431 7.238 1.00 1.00 H new ATOM 0 HH12 ARG A 114 19.008 9.856 6.691 1.00 1.00 H new ATOM 0 HH21 ARG A 114 22.131 8.520 7.270 1.00 1.00 H new ATOM 0 HH22 ARG A 114 21.187 9.904 6.709 1.00 1.00 H new ATOM 368 N THR A 115 21.054 3.867 4.244 1.00 1.00 N ATOM 369 CA THR A 115 21.929 3.272 3.212 1.00 1.00 C ATOM 370 C THR A 115 22.724 2.070 3.755 1.00 1.00 C ATOM 371 O THR A 115 23.330 2.203 4.826 1.00 1.00 O ATOM 372 CB THR A 115 22.911 4.328 2.676 1.00 1.00 C ATOM 373 OG1 THR A 115 22.186 5.465 2.249 1.00 1.00 O ATOM 374 CG2 THR A 115 23.722 3.830 1.480 1.00 1.00 C ATOM 0 H THR A 115 21.231 4.861 4.388 1.00 1.00 H new ATOM 0 HA THR A 115 21.284 2.919 2.407 1.00 1.00 H new ATOM 0 HB THR A 115 23.598 4.559 3.491 1.00 1.00 H new ATOM 0 HG1 THR A 115 22.808 6.141 1.908 1.00 1.00 H new ATOM 0 HG21 THR A 115 24.397 4.617 1.145 1.00 1.00 H new ATOM 0 HG22 THR A 115 24.302 2.955 1.773 1.00 1.00 H new ATOM 0 HG23 THR A 115 23.046 3.562 0.668 1.00 1.00 H new ATOM 382 N PRO A 116 22.767 0.914 3.052 1.00 1.00 N ATOM 383 CA PRO A 116 23.560 -0.255 3.449 1.00 1.00 C ATOM 384 C PRO A 116 25.034 0.054 3.731 1.00 1.00 C ATOM 385 O PRO A 116 25.652 0.865 3.039 1.00 1.00 O ATOM 386 CB PRO A 116 23.409 -1.259 2.302 1.00 1.00 C ATOM 387 CG PRO A 116 22.043 -0.920 1.713 1.00 1.00 C ATOM 388 CD PRO A 116 21.965 0.595 1.879 1.00 1.00 C ATOM 0 HA PRO A 116 23.193 -0.645 4.398 1.00 1.00 H new ATOM 0 HB2 PRO A 116 24.203 -1.148 1.564 1.00 1.00 H new ATOM 0 HB3 PRO A 116 23.448 -2.288 2.661 1.00 1.00 H new ATOM 0 HG2 PRO A 116 21.970 -1.216 0.666 1.00 1.00 H new ATOM 0 HG3 PRO A 116 21.237 -1.426 2.244 1.00 1.00 H new ATOM 0 HD2 PRO A 116 22.348 1.104 0.995 1.00 1.00 H new ATOM 0 HD3 PRO A 116 20.933 0.920 2.012 1.00 1.00 H new ATOM 396 N ALA A 117 25.622 -0.632 4.717 1.00 1.00 N ATOM 397 CA ALA A 117 26.952 -0.319 5.255 1.00 1.00 C ATOM 398 C ALA A 117 28.069 -0.290 4.195 1.00 1.00 C ATOM 399 O ALA A 117 28.853 0.654 4.167 1.00 1.00 O ATOM 400 CB ALA A 117 27.261 -1.319 6.378 1.00 1.00 C ATOM 0 H ALA A 117 25.182 -1.432 5.171 1.00 1.00 H new ATOM 0 HA ALA A 117 26.927 0.699 5.644 1.00 1.00 H new ATOM 0 HB1 ALA A 117 28.246 -1.106 6.794 1.00 1.00 H new ATOM 0 HB2 ALA A 117 26.509 -1.230 7.162 1.00 1.00 H new ATOM 0 HB3 ALA A 117 27.248 -2.332 5.977 1.00 1.00 H new ATOM 406 N VAL A 118 28.119 -1.267 3.279 1.00 1.00 N ATOM 407 CA VAL A 118 29.143 -1.315 2.217 1.00 1.00 C ATOM 408 C VAL A 118 28.970 -0.175 1.208 1.00 1.00 C ATOM 409 O VAL A 118 29.949 0.465 0.828 1.00 1.00 O ATOM 410 CB VAL A 118 29.144 -2.682 1.496 1.00 1.00 C ATOM 411 CG1 VAL A 118 30.213 -2.774 0.399 1.00 1.00 C ATOM 412 CG2 VAL A 118 29.401 -3.827 2.483 1.00 1.00 C ATOM 0 H VAL A 118 27.457 -2.043 3.250 1.00 1.00 H new ATOM 0 HA VAL A 118 30.110 -1.186 2.703 1.00 1.00 H new ATOM 0 HB VAL A 118 28.156 -2.771 1.044 1.00 1.00 H new ATOM 0 HG11 VAL A 118 30.167 -3.756 -0.073 1.00 1.00 H new ATOM 0 HG12 VAL A 118 30.033 -2.003 -0.350 1.00 1.00 H new ATOM 0 HG13 VAL A 118 31.200 -2.629 0.839 1.00 1.00 H new ATOM 0 HG21 VAL A 118 29.396 -4.777 1.948 1.00 1.00 H new ATOM 0 HG22 VAL A 118 30.370 -3.685 2.961 1.00 1.00 H new ATOM 0 HG23 VAL A 118 28.619 -3.835 3.243 1.00 1.00 H new ATOM 422 N ILE A 119 27.725 0.143 0.833 1.00 1.00 N ATOM 423 CA ILE A 119 27.409 1.278 -0.058 1.00 1.00 C ATOM 424 C ILE A 119 27.838 2.600 0.599 1.00 1.00 C ATOM 425 O ILE A 119 28.527 3.408 -0.018 1.00 1.00 O ATOM 426 CB ILE A 119 25.909 1.265 -0.450 1.00 1.00 C ATOM 427 CG1 ILE A 119 25.565 -0.040 -1.210 1.00 1.00 C ATOM 428 CG2 ILE A 119 25.560 2.504 -1.289 1.00 1.00 C ATOM 429 CD1 ILE A 119 24.114 -0.150 -1.703 1.00 1.00 C ATOM 0 H ILE A 119 26.903 -0.378 1.137 1.00 1.00 H new ATOM 0 HA ILE A 119 27.974 1.179 -0.985 1.00 1.00 H new ATOM 0 HB ILE A 119 25.308 1.297 0.459 1.00 1.00 H new ATOM 0 HG12 ILE A 119 26.231 -0.127 -2.069 1.00 1.00 H new ATOM 0 HG13 ILE A 119 25.775 -0.887 -0.557 1.00 1.00 H new ATOM 0 HG21 ILE A 119 24.503 2.478 -1.555 1.00 1.00 H new ATOM 0 HG22 ILE A 119 25.766 3.405 -0.711 1.00 1.00 H new ATOM 0 HG23 ILE A 119 26.163 2.510 -2.197 1.00 1.00 H new ATOM 0 HD11 ILE A 119 23.977 -1.099 -2.222 1.00 1.00 H new ATOM 0 HD12 ILE A 119 23.436 -0.101 -0.851 1.00 1.00 H new ATOM 0 HD13 ILE A 119 23.899 0.671 -2.386 1.00 1.00 H new ATOM 441 N LYS A 120 27.518 2.781 1.887 1.00 1.00 N ATOM 442 CA LYS A 120 27.971 3.919 2.708 1.00 1.00 C ATOM 443 C LYS A 120 29.503 4.010 2.759 1.00 1.00 C ATOM 444 O LYS A 120 30.058 5.085 2.547 1.00 1.00 O ATOM 445 CB LYS A 120 27.310 3.790 4.097 1.00 1.00 C ATOM 446 CG LYS A 120 27.799 4.752 5.190 1.00 1.00 C ATOM 447 CD LYS A 120 27.687 6.241 4.819 1.00 1.00 C ATOM 448 CE LYS A 120 27.670 7.183 6.038 1.00 1.00 C ATOM 449 NZ LYS A 120 28.858 7.024 6.925 1.00 1.00 N ATOM 0 H LYS A 120 26.925 2.129 2.401 1.00 1.00 H new ATOM 0 HA LYS A 120 27.660 4.863 2.262 1.00 1.00 H new ATOM 0 HB2 LYS A 120 26.236 3.931 3.976 1.00 1.00 H new ATOM 0 HB3 LYS A 120 27.460 2.770 4.451 1.00 1.00 H new ATOM 0 HG2 LYS A 120 27.225 4.572 6.099 1.00 1.00 H new ATOM 0 HG3 LYS A 120 28.840 4.524 5.419 1.00 1.00 H new ATOM 0 HD2 LYS A 120 28.524 6.510 4.175 1.00 1.00 H new ATOM 0 HD3 LYS A 120 26.777 6.395 4.239 1.00 1.00 H new ATOM 0 HE2 LYS A 120 27.621 8.215 5.690 1.00 1.00 H new ATOM 0 HE3 LYS A 120 26.766 6.999 6.618 1.00 1.00 H new ATOM 0 HZ1 LYS A 120 28.950 7.861 7.535 1.00 1.00 H new ATOM 0 HZ2 LYS A 120 28.739 6.176 7.516 1.00 1.00 H new ATOM 0 HZ3 LYS A 120 29.714 6.923 6.344 1.00 1.00 H new ATOM 463 N LYS A 121 30.198 2.883 2.959 1.00 1.00 N ATOM 464 CA LYS A 121 31.671 2.824 2.961 1.00 1.00 C ATOM 465 C LYS A 121 32.270 3.244 1.618 1.00 1.00 C ATOM 466 O LYS A 121 33.218 4.022 1.585 1.00 1.00 O ATOM 467 CB LYS A 121 32.172 1.430 3.400 1.00 1.00 C ATOM 468 CG LYS A 121 33.215 1.524 4.525 1.00 1.00 C ATOM 469 CD LYS A 121 32.581 1.915 5.877 1.00 1.00 C ATOM 470 CE LYS A 121 33.612 2.047 7.007 1.00 1.00 C ATOM 471 NZ LYS A 121 34.490 3.233 6.840 1.00 1.00 N ATOM 0 H LYS A 121 29.755 1.980 3.125 1.00 1.00 H new ATOM 0 HA LYS A 121 32.021 3.549 3.696 1.00 1.00 H new ATOM 0 HB2 LYS A 121 31.327 0.830 3.738 1.00 1.00 H new ATOM 0 HB3 LYS A 121 32.607 0.914 2.544 1.00 1.00 H new ATOM 0 HG2 LYS A 121 33.723 0.565 4.628 1.00 1.00 H new ATOM 0 HG3 LYS A 121 33.973 2.259 4.255 1.00 1.00 H new ATOM 0 HD2 LYS A 121 32.051 2.861 5.764 1.00 1.00 H new ATOM 0 HD3 LYS A 121 31.840 1.166 6.155 1.00 1.00 H new ATOM 0 HE2 LYS A 121 33.092 2.115 7.963 1.00 1.00 H new ATOM 0 HE3 LYS A 121 34.226 1.147 7.042 1.00 1.00 H new ATOM 0 HZ1 LYS A 121 35.013 3.405 7.722 1.00 1.00 H new ATOM 0 HZ2 LYS A 121 35.163 3.060 6.067 1.00 1.00 H new ATOM 0 HZ3 LYS A 121 33.909 4.066 6.614 1.00 1.00 H new ATOM 485 N ALA A 122 31.674 2.809 0.510 1.00 1.00 N ATOM 486 CA ALA A 122 32.065 3.223 -0.838 1.00 1.00 C ATOM 487 C ALA A 122 31.829 4.726 -1.098 1.00 1.00 C ATOM 488 O ALA A 122 32.663 5.375 -1.733 1.00 1.00 O ATOM 489 CB ALA A 122 31.312 2.348 -1.842 1.00 1.00 C ATOM 0 H ALA A 122 30.895 2.150 0.522 1.00 1.00 H new ATOM 0 HA ALA A 122 33.140 3.083 -0.952 1.00 1.00 H new ATOM 0 HB1 ALA A 122 31.587 2.638 -2.856 1.00 1.00 H new ATOM 0 HB2 ALA A 122 31.573 1.302 -1.680 1.00 1.00 H new ATOM 0 HB3 ALA A 122 30.239 2.479 -1.706 1.00 1.00 H new ATOM 495 N MET A 123 30.746 5.306 -0.575 1.00 1.00 N ATOM 496 CA MET A 123 30.489 6.751 -0.650 1.00 1.00 C ATOM 497 C MET A 123 31.570 7.596 0.052 1.00 1.00 C ATOM 498 O MET A 123 31.902 8.677 -0.435 1.00 1.00 O ATOM 499 CB MET A 123 29.100 7.079 -0.080 1.00 1.00 C ATOM 500 CG MET A 123 27.963 6.585 -0.982 1.00 1.00 C ATOM 501 SD MET A 123 26.327 6.654 -0.200 1.00 1.00 S ATOM 502 CE MET A 123 25.296 6.275 -1.645 1.00 1.00 C ATOM 0 H MET A 123 30.018 4.786 -0.085 1.00 1.00 H new ATOM 0 HA MET A 123 30.522 7.018 -1.706 1.00 1.00 H new ATOM 0 HB2 MET A 123 29.000 6.626 0.906 1.00 1.00 H new ATOM 0 HB3 MET A 123 29.011 8.157 0.054 1.00 1.00 H new ATOM 0 HG2 MET A 123 27.946 7.185 -1.892 1.00 1.00 H new ATOM 0 HG3 MET A 123 28.169 5.558 -1.282 1.00 1.00 H new ATOM 0 HE1 MET A 123 24.249 6.239 -1.345 1.00 1.00 H new ATOM 0 HE2 MET A 123 25.430 7.049 -2.401 1.00 1.00 H new ATOM 0 HE3 MET A 123 25.589 5.310 -2.058 1.00 1.00 H new ATOM 512 N GLU A 124 32.157 7.108 1.157 1.00 1.00 N ATOM 513 CA GLU A 124 33.135 7.861 1.966 1.00 1.00 C ATOM 514 C GLU A 124 34.622 7.505 1.722 1.00 1.00 C ATOM 515 O GLU A 124 35.479 8.366 1.920 1.00 1.00 O ATOM 516 CB GLU A 124 32.759 7.796 3.458 1.00 1.00 C ATOM 517 CG GLU A 124 32.903 6.396 4.066 1.00 1.00 C ATOM 518 CD GLU A 124 32.449 6.311 5.534 1.00 1.00 C ATOM 519 OE1 GLU A 124 31.400 6.898 5.893 1.00 1.00 O ATOM 520 OE2 GLU A 124 33.118 5.605 6.328 1.00 1.00 O ATOM 0 H GLU A 124 31.966 6.173 1.518 1.00 1.00 H new ATOM 0 HA GLU A 124 33.064 8.892 1.619 1.00 1.00 H new ATOM 0 HB2 GLU A 124 33.389 8.491 4.014 1.00 1.00 H new ATOM 0 HB3 GLU A 124 31.729 8.132 3.580 1.00 1.00 H new ATOM 0 HG2 GLU A 124 32.321 5.690 3.473 1.00 1.00 H new ATOM 0 HG3 GLU A 124 33.946 6.085 3.999 1.00 1.00 H new ATOM 527 N GLU A 125 34.948 6.293 1.246 1.00 1.00 N ATOM 528 CA GLU A 125 36.335 5.851 0.965 1.00 1.00 C ATOM 529 C GLU A 125 36.658 5.650 -0.528 1.00 1.00 C ATOM 530 O GLU A 125 37.835 5.647 -0.897 1.00 1.00 O ATOM 531 CB GLU A 125 36.661 4.562 1.744 1.00 1.00 C ATOM 532 CG GLU A 125 36.846 4.838 3.238 1.00 1.00 C ATOM 533 CD GLU A 125 37.235 3.567 4.016 1.00 1.00 C ATOM 534 OE1 GLU A 125 38.330 3.003 3.775 1.00 1.00 O ATOM 535 OE2 GLU A 125 36.459 3.143 4.909 1.00 1.00 O ATOM 0 H GLU A 125 34.250 5.578 1.041 1.00 1.00 H new ATOM 0 HA GLU A 125 36.967 6.673 1.302 1.00 1.00 H new ATOM 0 HB2 GLU A 125 35.858 3.839 1.604 1.00 1.00 H new ATOM 0 HB3 GLU A 125 37.569 4.113 1.341 1.00 1.00 H new ATOM 0 HG2 GLU A 125 37.617 5.596 3.374 1.00 1.00 H new ATOM 0 HG3 GLU A 125 35.922 5.246 3.648 1.00 1.00 H new ATOM 542 N GLN A 126 35.646 5.544 -1.400 1.00 1.00 N ATOM 543 CA GLN A 126 35.817 5.498 -2.867 1.00 1.00 C ATOM 544 C GLN A 126 35.185 6.715 -3.582 1.00 1.00 C ATOM 545 O GLN A 126 35.281 6.831 -4.805 1.00 1.00 O ATOM 546 CB GLN A 126 35.278 4.168 -3.434 1.00 1.00 C ATOM 547 CG GLN A 126 35.945 2.926 -2.819 1.00 1.00 C ATOM 548 CD GLN A 126 35.505 1.604 -3.459 1.00 1.00 C ATOM 549 OE1 GLN A 126 34.616 1.526 -4.297 1.00 1.00 O ATOM 550 NE2 GLN A 126 36.121 0.503 -3.083 1.00 1.00 N ATOM 0 H GLN A 126 34.671 5.487 -1.107 1.00 1.00 H new ATOM 0 HA GLN A 126 36.887 5.552 -3.067 1.00 1.00 H new ATOM 0 HB2 GLN A 126 34.203 4.117 -3.261 1.00 1.00 H new ATOM 0 HB3 GLN A 126 35.428 4.155 -4.514 1.00 1.00 H new ATOM 0 HG2 GLN A 126 37.027 3.022 -2.914 1.00 1.00 H new ATOM 0 HG3 GLN A 126 35.720 2.895 -1.753 1.00 1.00 H new ATOM 0 HE21 GLN A 126 36.864 0.547 -2.386 1.00 1.00 H new ATOM 0 HE22 GLN A 126 35.855 -0.394 -3.489 1.00 1.00 H new ATOM 559 N GLY A 127 34.544 7.629 -2.834 1.00 1.00 N ATOM 560 CA GLY A 127 33.873 8.829 -3.355 1.00 1.00 C ATOM 561 C GLY A 127 32.681 8.544 -4.284 1.00 1.00 C ATOM 562 O GLY A 127 32.310 9.412 -5.083 1.00 1.00 O ATOM 0 H GLY A 127 34.477 7.549 -1.819 1.00 1.00 H new ATOM 0 HA2 GLY A 127 33.526 9.429 -2.514 1.00 1.00 H new ATOM 0 HA3 GLY A 127 34.603 9.431 -3.896 1.00 1.00 H new ATOM 566 N LYS A 128 32.114 7.327 -4.224 1.00 1.00 N ATOM 567 CA LYS A 128 31.062 6.841 -5.137 1.00 1.00 C ATOM 568 C LYS A 128 29.678 7.454 -4.880 1.00 1.00 C ATOM 569 O LYS A 128 29.417 8.046 -3.835 1.00 1.00 O ATOM 570 CB LYS A 128 31.002 5.300 -5.080 1.00 1.00 C ATOM 571 CG LYS A 128 32.106 4.686 -5.953 1.00 1.00 C ATOM 572 CD LYS A 128 32.000 3.159 -5.973 1.00 1.00 C ATOM 573 CE LYS A 128 32.906 2.579 -7.066 1.00 1.00 C ATOM 574 NZ LYS A 128 32.767 1.101 -7.144 1.00 1.00 N ATOM 0 H LYS A 128 32.380 6.636 -3.522 1.00 1.00 H new ATOM 0 HA LYS A 128 31.339 7.169 -6.139 1.00 1.00 H new ATOM 0 HB2 LYS A 128 31.116 4.964 -4.049 1.00 1.00 H new ATOM 0 HB3 LYS A 128 30.026 4.955 -5.422 1.00 1.00 H new ATOM 0 HG2 LYS A 128 32.029 5.073 -6.969 1.00 1.00 H new ATOM 0 HG3 LYS A 128 33.083 4.982 -5.572 1.00 1.00 H new ATOM 0 HD2 LYS A 128 32.285 2.755 -5.002 1.00 1.00 H new ATOM 0 HD3 LYS A 128 30.967 2.861 -6.151 1.00 1.00 H new ATOM 0 HE2 LYS A 128 32.651 3.023 -8.028 1.00 1.00 H new ATOM 0 HE3 LYS A 128 33.944 2.840 -6.859 1.00 1.00 H new ATOM 0 HZ1 LYS A 128 33.338 0.740 -7.935 1.00 1.00 H new ATOM 0 HZ2 LYS A 128 33.097 0.674 -6.255 1.00 1.00 H new ATOM 0 HZ3 LYS A 128 31.768 0.854 -7.297 1.00 1.00 H new ATOM 588 N GLN A 129 28.776 7.237 -5.838 1.00 1.00 N ATOM 589 CA GLN A 129 27.354 7.600 -5.794 1.00 1.00 C ATOM 590 C GLN A 129 26.496 6.328 -5.932 1.00 1.00 C ATOM 591 O GLN A 129 26.963 5.297 -6.420 1.00 1.00 O ATOM 592 CB GLN A 129 27.031 8.618 -6.912 1.00 1.00 C ATOM 593 CG GLN A 129 27.608 10.031 -6.693 1.00 1.00 C ATOM 594 CD GLN A 129 29.134 10.101 -6.776 1.00 1.00 C ATOM 595 OE1 GLN A 129 29.763 9.616 -7.709 1.00 1.00 O ATOM 596 NE2 GLN A 129 29.796 10.674 -5.793 1.00 1.00 N ATOM 0 H GLN A 129 29.029 6.779 -6.714 1.00 1.00 H new ATOM 0 HA GLN A 129 27.124 8.070 -4.838 1.00 1.00 H new ATOM 0 HB2 GLN A 129 27.410 8.229 -7.857 1.00 1.00 H new ATOM 0 HB3 GLN A 129 25.948 8.695 -7.011 1.00 1.00 H new ATOM 0 HG2 GLN A 129 27.183 10.705 -7.437 1.00 1.00 H new ATOM 0 HG3 GLN A 129 27.291 10.394 -5.715 1.00 1.00 H new ATOM 0 HE21 GLN A 129 29.290 11.083 -5.008 1.00 1.00 H new ATOM 0 HE22 GLN A 129 30.815 10.709 -5.817 1.00 1.00 H new ATOM 605 N LEU A 130 25.228 6.395 -5.509 1.00 1.00 N ATOM 606 CA LEU A 130 24.335 5.230 -5.399 1.00 1.00 C ATOM 607 C LEU A 130 24.057 4.531 -6.742 1.00 1.00 C ATOM 608 O LEU A 130 23.802 3.332 -6.780 1.00 1.00 O ATOM 609 CB LEU A 130 23.035 5.709 -4.725 1.00 1.00 C ATOM 610 CG LEU A 130 22.010 4.606 -4.392 1.00 1.00 C ATOM 611 CD1 LEU A 130 22.572 3.505 -3.493 1.00 1.00 C ATOM 612 CD2 LEU A 130 20.805 5.218 -3.678 1.00 1.00 C ATOM 0 H LEU A 130 24.785 7.270 -5.229 1.00 1.00 H new ATOM 0 HA LEU A 130 24.828 4.466 -4.798 1.00 1.00 H new ATOM 0 HB2 LEU A 130 23.295 6.228 -3.803 1.00 1.00 H new ATOM 0 HB3 LEU A 130 22.557 6.439 -5.378 1.00 1.00 H new ATOM 0 HG LEU A 130 21.733 4.157 -5.346 1.00 1.00 H new ATOM 0 HD11 LEU A 130 21.798 2.763 -3.299 1.00 1.00 H new ATOM 0 HD12 LEU A 130 23.417 3.027 -3.988 1.00 1.00 H new ATOM 0 HD13 LEU A 130 22.903 3.939 -2.549 1.00 1.00 H new ATOM 0 HD21 LEU A 130 20.084 4.435 -3.445 1.00 1.00 H new ATOM 0 HD22 LEU A 130 21.133 5.696 -2.755 1.00 1.00 H new ATOM 0 HD23 LEU A 130 20.338 5.961 -4.324 1.00 1.00 H new ATOM 624 N GLU A 131 24.160 5.252 -7.857 1.00 1.00 N ATOM 625 CA GLU A 131 24.016 4.691 -9.211 1.00 1.00 C ATOM 626 C GLU A 131 25.067 3.618 -9.554 1.00 1.00 C ATOM 627 O GLU A 131 24.797 2.773 -10.408 1.00 1.00 O ATOM 628 CB GLU A 131 24.048 5.815 -10.256 1.00 1.00 C ATOM 629 CG GLU A 131 22.824 6.734 -10.163 1.00 1.00 C ATOM 630 CD GLU A 131 22.916 7.878 -11.189 1.00 1.00 C ATOM 631 OE1 GLU A 131 23.484 8.949 -10.858 1.00 1.00 O ATOM 632 OE2 GLU A 131 22.423 7.719 -12.332 1.00 1.00 O ATOM 0 H GLU A 131 24.348 6.255 -7.852 1.00 1.00 H new ATOM 0 HA GLU A 131 23.049 4.188 -9.230 1.00 1.00 H new ATOM 0 HB2 GLU A 131 24.954 6.406 -10.122 1.00 1.00 H new ATOM 0 HB3 GLU A 131 24.097 5.379 -11.254 1.00 1.00 H new ATOM 0 HG2 GLU A 131 21.916 6.156 -10.337 1.00 1.00 H new ATOM 0 HG3 GLU A 131 22.750 7.147 -9.157 1.00 1.00 H new ATOM 639 N ASP A 132 26.224 3.576 -8.877 1.00 1.00 N ATOM 640 CA ASP A 132 27.175 2.456 -9.008 1.00 1.00 C ATOM 641 C ASP A 132 26.609 1.122 -8.462 1.00 1.00 C ATOM 642 O ASP A 132 27.081 0.044 -8.829 1.00 1.00 O ATOM 643 CB ASP A 132 28.515 2.789 -8.330 1.00 1.00 C ATOM 644 CG ASP A 132 29.612 1.800 -8.768 1.00 1.00 C ATOM 645 OD1 ASP A 132 30.028 1.855 -9.953 1.00 1.00 O ATOM 646 OD2 ASP A 132 30.109 1.007 -7.932 1.00 1.00 O ATOM 0 H ASP A 132 26.527 4.305 -8.231 1.00 1.00 H new ATOM 0 HA ASP A 132 27.343 2.318 -10.076 1.00 1.00 H new ATOM 0 HB2 ASP A 132 28.813 3.806 -8.585 1.00 1.00 H new ATOM 0 HB3 ASP A 132 28.398 2.753 -7.247 1.00 1.00 H new ATOM 651 N PHE A 133 25.564 1.201 -7.628 1.00 1.00 N ATOM 652 CA PHE A 133 24.907 0.085 -6.937 1.00 1.00 C ATOM 653 C PHE A 133 23.442 -0.100 -7.374 1.00 1.00 C ATOM 654 O PHE A 133 22.855 -1.155 -7.139 1.00 1.00 O ATOM 655 CB PHE A 133 24.999 0.333 -5.426 1.00 1.00 C ATOM 656 CG PHE A 133 26.420 0.434 -4.905 1.00 1.00 C ATOM 657 CD1 PHE A 133 27.149 -0.737 -4.625 1.00 1.00 C ATOM 658 CD2 PHE A 133 27.028 1.692 -4.720 1.00 1.00 C ATOM 659 CE1 PHE A 133 28.472 -0.654 -4.154 1.00 1.00 C ATOM 660 CE2 PHE A 133 28.350 1.777 -4.249 1.00 1.00 C ATOM 661 CZ PHE A 133 29.073 0.603 -3.973 1.00 1.00 C ATOM 0 H PHE A 133 25.130 2.097 -7.405 1.00 1.00 H new ATOM 0 HA PHE A 133 25.419 -0.840 -7.203 1.00 1.00 H new ATOM 0 HB2 PHE A 133 24.468 1.254 -5.186 1.00 1.00 H new ATOM 0 HB3 PHE A 133 24.487 -0.475 -4.903 1.00 1.00 H new ATOM 0 HD1 PHE A 133 26.691 -1.704 -4.772 1.00 1.00 H new ATOM 0 HD2 PHE A 133 26.476 2.594 -4.941 1.00 1.00 H new ATOM 0 HE1 PHE A 133 29.025 -1.555 -3.932 1.00 1.00 H new ATOM 0 HE2 PHE A 133 28.810 2.743 -4.099 1.00 1.00 H new ATOM 0 HZ PHE A 133 30.092 0.668 -3.621 1.00 1.00 H new ATOM 671 N LEU A 134 22.845 0.903 -8.026 1.00 1.00 N ATOM 672 CA LEU A 134 21.543 0.836 -8.700 1.00 1.00 C ATOM 673 C LEU A 134 21.637 -0.108 -9.916 1.00 1.00 C ATOM 674 O LEU A 134 22.485 0.082 -10.790 1.00 1.00 O ATOM 675 CB LEU A 134 21.142 2.274 -9.084 1.00 1.00 C ATOM 676 CG LEU A 134 19.644 2.525 -9.346 1.00 1.00 C ATOM 677 CD1 LEU A 134 19.423 4.021 -9.580 1.00 1.00 C ATOM 678 CD2 LEU A 134 19.093 1.782 -10.562 1.00 1.00 C ATOM 0 H LEU A 134 23.275 1.825 -8.102 1.00 1.00 H new ATOM 0 HA LEU A 134 20.770 0.424 -8.051 1.00 1.00 H new ATOM 0 HB2 LEU A 134 21.465 2.943 -8.286 1.00 1.00 H new ATOM 0 HB3 LEU A 134 21.696 2.555 -9.979 1.00 1.00 H new ATOM 0 HG LEU A 134 19.117 2.154 -8.467 1.00 1.00 H new ATOM 0 HD11 LEU A 134 18.365 4.208 -9.766 1.00 1.00 H new ATOM 0 HD12 LEU A 134 19.740 4.578 -8.698 1.00 1.00 H new ATOM 0 HD13 LEU A 134 20.006 4.344 -10.442 1.00 1.00 H new ATOM 0 HD21 LEU A 134 18.034 2.011 -10.679 1.00 1.00 H new ATOM 0 HD22 LEU A 134 19.633 2.096 -11.455 1.00 1.00 H new ATOM 0 HD23 LEU A 134 19.219 0.709 -10.420 1.00 1.00 H new ATOM 690 N ILE A 135 20.771 -1.126 -9.960 1.00 1.00 N ATOM 691 CA ILE A 135 20.818 -2.232 -10.945 1.00 1.00 C ATOM 692 C ILE A 135 19.540 -2.471 -11.775 1.00 1.00 C ATOM 693 O ILE A 135 19.610 -3.182 -12.777 1.00 1.00 O ATOM 694 CB ILE A 135 21.340 -3.538 -10.291 1.00 1.00 C ATOM 695 CG1 ILE A 135 20.679 -3.948 -8.955 1.00 1.00 C ATOM 696 CG2 ILE A 135 22.856 -3.420 -10.056 1.00 1.00 C ATOM 697 CD1 ILE A 135 19.181 -4.264 -9.030 1.00 1.00 C ATOM 0 H ILE A 135 19.998 -1.214 -9.301 1.00 1.00 H new ATOM 0 HA ILE A 135 21.533 -1.890 -11.693 1.00 1.00 H new ATOM 0 HB ILE A 135 21.075 -4.320 -11.003 1.00 1.00 H new ATOM 0 HG12 ILE A 135 21.198 -4.824 -8.566 1.00 1.00 H new ATOM 0 HG13 ILE A 135 20.827 -3.144 -8.234 1.00 1.00 H new ATOM 0 HG21 ILE A 135 23.225 -4.337 -9.596 1.00 1.00 H new ATOM 0 HG22 ILE A 135 23.361 -3.263 -11.009 1.00 1.00 H new ATOM 0 HG23 ILE A 135 23.057 -2.576 -9.396 1.00 1.00 H new ATOM 0 HD11 ILE A 135 18.817 -4.540 -8.040 1.00 1.00 H new ATOM 0 HD12 ILE A 135 18.641 -3.385 -9.383 1.00 1.00 H new ATOM 0 HD13 ILE A 135 19.018 -5.092 -9.720 1.00 1.00 H new ATOM 709 N LYS A 136 18.384 -1.879 -11.418 1.00 1.00 N ATOM 710 CA LYS A 136 17.118 -2.089 -12.156 1.00 1.00 C ATOM 711 C LYS A 136 17.135 -1.468 -13.563 1.00 1.00 C ATOM 712 O LYS A 136 16.824 -2.144 -14.542 1.00 1.00 O ATOM 713 CB LYS A 136 15.929 -1.570 -11.323 1.00 1.00 C ATOM 714 CG LYS A 136 14.570 -1.860 -11.985 1.00 1.00 C ATOM 715 CD LYS A 136 13.401 -1.393 -11.107 1.00 1.00 C ATOM 716 CE LYS A 136 12.071 -1.731 -11.797 1.00 1.00 C ATOM 717 NZ LYS A 136 10.896 -1.269 -11.006 1.00 1.00 N ATOM 0 H LYS A 136 18.298 -1.249 -10.620 1.00 1.00 H new ATOM 0 HA LYS A 136 17.002 -3.162 -12.307 1.00 1.00 H new ATOM 0 HB2 LYS A 136 15.953 -2.031 -10.336 1.00 1.00 H new ATOM 0 HB3 LYS A 136 16.035 -0.495 -11.176 1.00 1.00 H new ATOM 0 HG2 LYS A 136 14.522 -1.359 -12.952 1.00 1.00 H new ATOM 0 HG3 LYS A 136 14.478 -2.929 -12.175 1.00 1.00 H new ATOM 0 HD2 LYS A 136 13.450 -1.877 -10.132 1.00 1.00 H new ATOM 0 HD3 LYS A 136 13.470 -0.319 -10.934 1.00 1.00 H new ATOM 0 HE2 LYS A 136 12.047 -1.269 -12.784 1.00 1.00 H new ATOM 0 HE3 LYS A 136 12.005 -2.808 -11.948 1.00 1.00 H new ATOM 0 HZ1 LYS A 136 10.020 -1.518 -11.508 1.00 1.00 H new ATOM 0 HZ2 LYS A 136 10.903 -1.729 -10.073 1.00 1.00 H new ATOM 0 HZ3 LYS A 136 10.944 -0.237 -10.883 1.00 1.00 H new ATOM 731 N GLU A 137 17.495 -0.186 -13.654 1.00 1.00 N ATOM 732 CA GLU A 137 17.472 0.604 -14.895 1.00 1.00 C ATOM 733 C GLU A 137 18.389 1.837 -14.782 1.00 1.00 C ATOM 734 O GLU A 137 18.322 2.571 -13.792 1.00 1.00 O ATOM 735 CB GLU A 137 16.020 1.053 -15.165 1.00 1.00 C ATOM 736 CG GLU A 137 15.838 1.722 -16.535 1.00 1.00 C ATOM 737 CD GLU A 137 14.367 2.134 -16.743 1.00 1.00 C ATOM 738 OE1 GLU A 137 13.525 1.269 -17.089 1.00 1.00 O ATOM 739 OE2 GLU A 137 14.033 3.330 -16.549 1.00 1.00 O ATOM 0 H GLU A 137 17.819 0.349 -12.848 1.00 1.00 H new ATOM 0 HA GLU A 137 17.838 -0.010 -15.718 1.00 1.00 H new ATOM 0 HB2 GLU A 137 15.361 0.187 -15.100 1.00 1.00 H new ATOM 0 HB3 GLU A 137 15.711 1.748 -14.385 1.00 1.00 H new ATOM 0 HG2 GLU A 137 16.481 2.599 -16.606 1.00 1.00 H new ATOM 0 HG3 GLU A 137 16.145 1.036 -17.325 1.00 1.00 H new ATOM 746 N LEU A 138 19.220 2.084 -15.802 1.00 1.00 N ATOM 747 CA LEU A 138 20.126 3.246 -15.905 1.00 1.00 C ATOM 748 C LEU A 138 20.151 3.857 -17.330 1.00 1.00 C ATOM 749 O LEU A 138 21.111 4.526 -17.724 1.00 1.00 O ATOM 750 CB LEU A 138 21.535 2.833 -15.423 1.00 1.00 C ATOM 751 CG LEU A 138 21.693 2.572 -13.911 1.00 1.00 C ATOM 752 CD1 LEU A 138 23.113 2.070 -13.645 1.00 1.00 C ATOM 753 CD2 LEU A 138 21.483 3.839 -13.077 1.00 1.00 C ATOM 0 H LEU A 138 19.286 1.462 -16.608 1.00 1.00 H new ATOM 0 HA LEU A 138 19.748 4.039 -15.259 1.00 1.00 H new ATOM 0 HB2 LEU A 138 21.828 1.930 -15.958 1.00 1.00 H new ATOM 0 HB3 LEU A 138 22.237 3.616 -15.710 1.00 1.00 H new ATOM 0 HG LEU A 138 20.938 1.840 -13.624 1.00 1.00 H new ATOM 0 HD11 LEU A 138 23.238 1.881 -12.579 1.00 1.00 H new ATOM 0 HD12 LEU A 138 23.282 1.147 -14.199 1.00 1.00 H new ATOM 0 HD13 LEU A 138 23.832 2.824 -13.967 1.00 1.00 H new ATOM 0 HD21 LEU A 138 21.605 3.603 -12.020 1.00 1.00 H new ATOM 0 HD22 LEU A 138 22.216 4.592 -13.368 1.00 1.00 H new ATOM 0 HD23 LEU A 138 20.478 4.226 -13.249 1.00 1.00 H new ATOM 765 N GLU A 139 19.100 3.603 -18.122 1.00 1.00 N ATOM 766 CA GLU A 139 18.919 4.128 -19.496 1.00 1.00 C ATOM 767 C GLU A 139 18.800 5.664 -19.566 1.00 1.00 C ATOM 768 O GLU A 139 19.464 6.270 -20.440 1.00 1.00 O ATOM 769 CB GLU A 139 17.706 3.464 -20.173 1.00 1.00 C ATOM 770 CG GLU A 139 17.898 1.958 -20.415 1.00 1.00 C ATOM 771 CD GLU A 139 16.764 1.378 -21.292 1.00 1.00 C ATOM 772 OE1 GLU A 139 15.709 0.965 -20.746 1.00 1.00 O ATOM 773 OE2 GLU A 139 16.913 1.322 -22.539 1.00 1.00 O ATOM 0 H GLU A 139 18.326 3.010 -17.822 1.00 1.00 H new ATOM 0 HA GLU A 139 19.829 3.870 -20.038 1.00 1.00 H new ATOM 0 HB2 GLU A 139 16.823 3.616 -19.552 1.00 1.00 H new ATOM 0 HB3 GLU A 139 17.515 3.957 -21.126 1.00 1.00 H new ATOM 0 HG2 GLU A 139 18.859 1.785 -20.899 1.00 1.00 H new ATOM 0 HG3 GLU A 139 17.924 1.435 -19.459 1.00 1.00 H new TER 780 GLU A 139