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 110 THR OG1 : rot 162:sc= 0.224 USER MOD Set 1.2: A 112 GLN : amide:sc= 0.208 K(o=0.43,f=-4.5!) USER MOD Single : A 96 LYS NZ :NH3+ 176:sc= 2.05 (180deg=2.03) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 90:sc= 0.624 USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=-0.041) 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 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0.00887 USER MOD Single : A 120 LYS NZ :NH3+ -169:sc= 1.26 (180deg=1.11) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 126 GLN : amide:sc=-0.00377 X(o=-0.0038,f=-0.23) USER MOD Single : A 128 LYS NZ :NH3+ 173:sc= 1.2 (180deg=1.12) USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 LYS NZ :NH3+ -144:sc= 0.0898 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 91 18.824 -13.072 -14.739 1.00 1.00 N ATOM 2 CA ALA A 91 17.389 -12.776 -14.472 1.00 1.00 C ATOM 3 C ALA A 91 17.218 -11.624 -13.464 1.00 1.00 C ATOM 4 O ALA A 91 18.103 -11.374 -12.641 1.00 1.00 O ATOM 5 CB ALA A 91 16.637 -14.038 -14.004 1.00 1.00 C ATOM 0 HA ALA A 91 16.948 -12.450 -15.414 1.00 1.00 H new ATOM 0 HB1 ALA A 91 15.592 -13.791 -13.817 1.00 1.00 H new ATOM 0 HB2 ALA A 91 16.696 -14.804 -14.777 1.00 1.00 H new ATOM 0 HB3 ALA A 91 17.091 -14.413 -13.087 1.00 1.00 H new ATOM 13 N ALA A 92 16.083 -10.912 -13.523 1.00 1.00 N ATOM 14 CA ALA A 92 15.722 -9.840 -12.582 1.00 1.00 C ATOM 15 C ALA A 92 15.474 -10.345 -11.137 1.00 1.00 C ATOM 16 O ALA A 92 15.288 -11.545 -10.901 1.00 1.00 O ATOM 17 CB ALA A 92 14.482 -9.121 -13.139 1.00 1.00 C ATOM 0 H ALA A 92 15.375 -11.068 -14.241 1.00 1.00 H new ATOM 0 HA ALA A 92 16.565 -9.154 -12.500 1.00 1.00 H new ATOM 0 HB1 ALA A 92 14.191 -8.319 -12.460 1.00 1.00 H new ATOM 0 HB2 ALA A 92 14.714 -8.702 -14.118 1.00 1.00 H new ATOM 0 HB3 ALA A 92 13.661 -9.832 -13.234 1.00 1.00 H new ATOM 23 N ARG A 93 15.434 -9.411 -10.173 1.00 1.00 N ATOM 24 CA ARG A 93 15.195 -9.669 -8.734 1.00 1.00 C ATOM 25 C ARG A 93 14.379 -8.541 -8.072 1.00 1.00 C ATOM 26 O ARG A 93 14.368 -7.430 -8.603 1.00 1.00 O ATOM 27 CB ARG A 93 16.549 -9.959 -8.040 1.00 1.00 C ATOM 28 CG ARG A 93 17.658 -8.904 -8.222 1.00 1.00 C ATOM 29 CD ARG A 93 18.946 -9.394 -7.541 1.00 1.00 C ATOM 30 NE ARG A 93 20.097 -8.503 -7.815 1.00 1.00 N ATOM 31 CZ ARG A 93 21.326 -8.863 -8.162 1.00 1.00 C ATOM 32 NH1 ARG A 93 21.674 -10.100 -8.363 1.00 1.00 N ATOM 33 NH2 ARG A 93 22.266 -7.981 -8.301 1.00 1.00 N ATOM 0 H ARG A 93 15.571 -8.421 -10.375 1.00 1.00 H new ATOM 0 HA ARG A 93 14.571 -10.555 -8.618 1.00 1.00 H new ATOM 0 HB2 ARG A 93 16.366 -10.080 -6.972 1.00 1.00 H new ATOM 0 HB3 ARG A 93 16.923 -10.914 -8.409 1.00 1.00 H new ATOM 0 HG2 ARG A 93 17.838 -8.729 -9.283 1.00 1.00 H new ATOM 0 HG3 ARG A 93 17.345 -7.953 -7.791 1.00 1.00 H new ATOM 0 HD2 ARG A 93 18.785 -9.456 -6.465 1.00 1.00 H new ATOM 0 HD3 ARG A 93 19.178 -10.401 -7.887 1.00 1.00 H new ATOM 0 HE ARG A 93 19.926 -7.501 -7.727 1.00 1.00 H new ATOM 0 HH11 ARG A 93 20.988 -10.847 -8.255 1.00 1.00 H new ATOM 0 HH12 ARG A 93 22.633 -10.323 -8.629 1.00 1.00 H new ATOM 0 HH21 ARG A 93 22.066 -6.993 -8.143 1.00 1.00 H new ATOM 0 HH22 ARG A 93 23.206 -8.275 -8.568 1.00 1.00 H new ATOM 47 N PRO A 94 13.677 -8.785 -6.945 1.00 1.00 N ATOM 48 CA PRO A 94 12.756 -7.828 -6.309 1.00 1.00 C ATOM 49 C PRO A 94 13.474 -6.736 -5.478 1.00 1.00 C ATOM 50 O PRO A 94 13.234 -6.574 -4.279 1.00 1.00 O ATOM 51 CB PRO A 94 11.794 -8.704 -5.491 1.00 1.00 C ATOM 52 CG PRO A 94 12.685 -9.860 -5.049 1.00 1.00 C ATOM 53 CD PRO A 94 13.561 -10.083 -6.280 1.00 1.00 C ATOM 0 HA PRO A 94 12.219 -7.232 -7.047 1.00 1.00 H new ATOM 0 HB2 PRO A 94 11.380 -8.164 -4.640 1.00 1.00 H new ATOM 0 HB3 PRO A 94 10.951 -9.049 -6.091 1.00 1.00 H new ATOM 0 HG2 PRO A 94 13.276 -9.605 -4.170 1.00 1.00 H new ATOM 0 HG3 PRO A 94 12.105 -10.747 -4.796 1.00 1.00 H new ATOM 0 HD2 PRO A 94 14.542 -10.462 -5.995 1.00 1.00 H new ATOM 0 HD3 PRO A 94 13.115 -10.822 -6.946 1.00 1.00 H new ATOM 61 N ALA A 95 14.386 -5.988 -6.110 1.00 1.00 N ATOM 62 CA ALA A 95 15.192 -4.934 -5.479 1.00 1.00 C ATOM 63 C ALA A 95 15.491 -3.766 -6.441 1.00 1.00 C ATOM 64 O ALA A 95 15.285 -3.871 -7.650 1.00 1.00 O ATOM 65 CB ALA A 95 16.484 -5.588 -4.967 1.00 1.00 C ATOM 0 H ALA A 95 14.590 -6.102 -7.103 1.00 1.00 H new ATOM 0 HA ALA A 95 14.634 -4.492 -4.654 1.00 1.00 H new ATOM 0 HB1 ALA A 95 17.110 -4.833 -4.491 1.00 1.00 H new ATOM 0 HB2 ALA A 95 16.237 -6.364 -4.243 1.00 1.00 H new ATOM 0 HB3 ALA A 95 17.024 -6.031 -5.804 1.00 1.00 H new ATOM 71 N LYS A 96 16.017 -2.662 -5.894 1.00 1.00 N ATOM 72 CA LYS A 96 16.307 -1.394 -6.594 1.00 1.00 C ATOM 73 C LYS A 96 17.807 -1.069 -6.637 1.00 1.00 C ATOM 74 O LYS A 96 18.283 -0.481 -7.608 1.00 1.00 O ATOM 75 CB LYS A 96 15.478 -0.299 -5.899 1.00 1.00 C ATOM 76 CG LYS A 96 15.381 1.019 -6.685 1.00 1.00 C ATOM 77 CD LYS A 96 14.553 2.074 -5.921 1.00 1.00 C ATOM 78 CE LYS A 96 13.060 1.714 -5.818 1.00 1.00 C ATOM 79 NZ LYS A 96 12.398 2.419 -4.687 1.00 1.00 N ATOM 0 H LYS A 96 16.265 -2.622 -4.905 1.00 1.00 H new ATOM 0 HA LYS A 96 16.024 -1.470 -7.644 1.00 1.00 H new ATOM 0 HB2 LYS A 96 14.471 -0.678 -5.724 1.00 1.00 H new ATOM 0 HB3 LYS A 96 15.916 -0.094 -4.922 1.00 1.00 H new ATOM 0 HG2 LYS A 96 16.382 1.407 -6.872 1.00 1.00 H new ATOM 0 HG3 LYS A 96 14.925 0.831 -7.657 1.00 1.00 H new ATOM 0 HD2 LYS A 96 14.962 2.191 -4.917 1.00 1.00 H new ATOM 0 HD3 LYS A 96 14.654 3.038 -6.420 1.00 1.00 H new ATOM 0 HE2 LYS A 96 12.559 1.972 -6.751 1.00 1.00 H new ATOM 0 HE3 LYS A 96 12.954 0.637 -5.687 1.00 1.00 H new ATOM 0 HZ1 LYS A 96 11.381 2.204 -4.692 1.00 1.00 H new ATOM 0 HZ2 LYS A 96 12.815 2.102 -3.789 1.00 1.00 H new ATOM 0 HZ3 LYS A 96 12.535 3.445 -4.789 1.00 1.00 H new ATOM 93 N TYR A 97 18.556 -1.572 -5.654 1.00 1.00 N ATOM 94 CA TYR A 97 20.015 -1.508 -5.563 1.00 1.00 C ATOM 95 C TYR A 97 20.572 -2.849 -5.056 1.00 1.00 C ATOM 96 O TYR A 97 19.869 -3.596 -4.373 1.00 1.00 O ATOM 97 CB TYR A 97 20.431 -0.371 -4.606 1.00 1.00 C ATOM 98 CG TYR A 97 19.670 0.930 -4.784 1.00 1.00 C ATOM 99 CD1 TYR A 97 20.090 1.862 -5.746 1.00 1.00 C ATOM 100 CD2 TYR A 97 18.532 1.197 -3.997 1.00 1.00 C ATOM 101 CE1 TYR A 97 19.351 3.037 -5.962 1.00 1.00 C ATOM 102 CE2 TYR A 97 17.811 2.392 -4.182 1.00 1.00 C ATOM 103 CZ TYR A 97 18.211 3.314 -5.177 1.00 1.00 C ATOM 104 OH TYR A 97 17.529 4.480 -5.361 1.00 1.00 O ATOM 0 H TYR A 97 18.140 -2.059 -4.860 1.00 1.00 H new ATOM 0 HA TYR A 97 20.423 -1.308 -6.554 1.00 1.00 H new ATOM 0 HB2 TYR A 97 20.299 -0.714 -3.580 1.00 1.00 H new ATOM 0 HB3 TYR A 97 21.494 -0.174 -4.742 1.00 1.00 H new ATOM 0 HD1 TYR A 97 20.984 1.675 -6.322 1.00 1.00 H new ATOM 0 HD2 TYR A 97 18.213 0.484 -3.251 1.00 1.00 H new ATOM 0 HE1 TYR A 97 19.656 3.731 -6.731 1.00 1.00 H new ATOM 0 HE2 TYR A 97 16.952 2.605 -3.563 1.00 1.00 H new ATOM 0 HH TYR A 97 16.770 4.516 -4.743 1.00 1.00 H new ATOM 114 N SER A 98 21.832 -3.159 -5.350 1.00 1.00 N ATOM 115 CA SER A 98 22.511 -4.368 -4.848 1.00 1.00 C ATOM 116 C SER A 98 24.035 -4.217 -4.812 1.00 1.00 C ATOM 117 O SER A 98 24.600 -3.446 -5.584 1.00 1.00 O ATOM 118 CB SER A 98 22.107 -5.581 -5.697 1.00 1.00 C ATOM 119 OG SER A 98 22.346 -5.391 -7.084 1.00 1.00 O ATOM 0 H SER A 98 22.422 -2.579 -5.947 1.00 1.00 H new ATOM 0 HA SER A 98 22.190 -4.520 -3.817 1.00 1.00 H new ATOM 0 HB2 SER A 98 22.659 -6.457 -5.355 1.00 1.00 H new ATOM 0 HB3 SER A 98 21.049 -5.790 -5.541 1.00 1.00 H new ATOM 0 HG SER A 98 23.250 -5.697 -7.305 1.00 1.00 H new ATOM 125 N TYR A 99 24.705 -4.970 -3.932 1.00 1.00 N ATOM 126 CA TYR A 99 26.159 -4.903 -3.736 1.00 1.00 C ATOM 127 C TYR A 99 26.826 -6.275 -3.534 1.00 1.00 C ATOM 128 O TYR A 99 26.171 -7.310 -3.379 1.00 1.00 O ATOM 129 CB TYR A 99 26.489 -3.899 -2.619 1.00 1.00 C ATOM 130 CG TYR A 99 25.986 -4.235 -1.227 1.00 1.00 C ATOM 131 CD1 TYR A 99 24.698 -3.829 -0.829 1.00 1.00 C ATOM 132 CD2 TYR A 99 26.836 -4.871 -0.302 1.00 1.00 C ATOM 133 CE1 TYR A 99 24.288 -3.985 0.509 1.00 1.00 C ATOM 134 CE2 TYR A 99 26.422 -5.047 1.034 1.00 1.00 C ATOM 135 CZ TYR A 99 25.161 -4.565 1.451 1.00 1.00 C ATOM 136 OH TYR A 99 24.781 -4.653 2.755 1.00 1.00 O ATOM 0 H TYR A 99 24.247 -5.652 -3.328 1.00 1.00 H new ATOM 0 HA TYR A 99 26.598 -4.538 -4.665 1.00 1.00 H new ATOM 0 HB2 TYR A 99 27.572 -3.788 -2.571 1.00 1.00 H new ATOM 0 HB3 TYR A 99 26.081 -2.929 -2.903 1.00 1.00 H new ATOM 0 HD1 TYR A 99 24.022 -3.397 -1.552 1.00 1.00 H new ATOM 0 HD2 TYR A 99 27.807 -5.225 -0.617 1.00 1.00 H new ATOM 0 HE1 TYR A 99 23.304 -3.660 0.813 1.00 1.00 H new ATOM 0 HE2 TYR A 99 27.068 -5.550 1.738 1.00 1.00 H new ATOM 0 HH TYR A 99 25.494 -5.079 3.276 1.00 1.00 H new ATOM 146 N VAL A 100 28.162 -6.264 -3.527 1.00 1.00 N ATOM 147 CA VAL A 100 29.046 -7.442 -3.584 1.00 1.00 C ATOM 148 C VAL A 100 29.986 -7.558 -2.373 1.00 1.00 C ATOM 149 O VAL A 100 30.251 -6.575 -1.679 1.00 1.00 O ATOM 150 CB VAL A 100 29.824 -7.362 -4.922 1.00 1.00 C ATOM 151 CG1 VAL A 100 31.010 -6.392 -4.890 1.00 1.00 C ATOM 152 CG2 VAL A 100 30.311 -8.716 -5.429 1.00 1.00 C ATOM 0 H VAL A 100 28.687 -5.391 -3.479 1.00 1.00 H new ATOM 0 HA VAL A 100 28.445 -8.350 -3.541 1.00 1.00 H new ATOM 0 HB VAL A 100 29.079 -6.976 -5.618 1.00 1.00 H new ATOM 0 HG11 VAL A 100 31.505 -6.390 -5.861 1.00 1.00 H new ATOM 0 HG12 VAL A 100 30.653 -5.388 -4.663 1.00 1.00 H new ATOM 0 HG13 VAL A 100 31.717 -6.707 -4.123 1.00 1.00 H new ATOM 0 HG21 VAL A 100 30.847 -8.581 -6.369 1.00 1.00 H new ATOM 0 HG22 VAL A 100 30.978 -9.162 -4.692 1.00 1.00 H new ATOM 0 HG23 VAL A 100 29.456 -9.373 -5.589 1.00 1.00 H new ATOM 162 N ASP A 101 30.512 -8.763 -2.145 1.00 1.00 N ATOM 163 CA ASP A 101 31.587 -9.069 -1.188 1.00 1.00 C ATOM 164 C ASP A 101 32.496 -10.185 -1.761 1.00 1.00 C ATOM 165 O ASP A 101 32.332 -10.600 -2.910 1.00 1.00 O ATOM 166 CB ASP A 101 30.975 -9.431 0.177 1.00 1.00 C ATOM 167 CG ASP A 101 31.982 -9.246 1.327 1.00 1.00 C ATOM 168 OD1 ASP A 101 32.110 -8.110 1.846 1.00 1.00 O ATOM 169 OD2 ASP A 101 32.658 -10.233 1.698 1.00 1.00 O ATOM 0 H ASP A 101 30.188 -9.592 -2.643 1.00 1.00 H new ATOM 0 HA ASP A 101 32.220 -8.195 -1.032 1.00 1.00 H new ATOM 0 HB2 ASP A 101 30.099 -8.808 0.358 1.00 1.00 H new ATOM 0 HB3 ASP A 101 30.632 -10.466 0.158 1.00 1.00 H new ATOM 174 N GLU A 102 33.477 -10.679 -1.000 1.00 1.00 N ATOM 175 CA GLU A 102 34.513 -11.608 -1.493 1.00 1.00 C ATOM 176 C GLU A 102 33.964 -12.943 -2.047 1.00 1.00 C ATOM 177 O GLU A 102 34.585 -13.547 -2.927 1.00 1.00 O ATOM 178 CB GLU A 102 35.540 -11.889 -0.384 1.00 1.00 C ATOM 179 CG GLU A 102 36.328 -10.637 0.024 1.00 1.00 C ATOM 180 CD GLU A 102 37.433 -10.992 1.036 1.00 1.00 C ATOM 181 OE1 GLU A 102 38.566 -11.336 0.610 1.00 1.00 O ATOM 182 OE2 GLU A 102 37.188 -10.930 2.268 1.00 1.00 O ATOM 0 H GLU A 102 33.580 -10.446 -0.012 1.00 1.00 H new ATOM 0 HA GLU A 102 34.984 -11.103 -2.337 1.00 1.00 H new ATOM 0 HB2 GLU A 102 35.025 -12.290 0.489 1.00 1.00 H new ATOM 0 HB3 GLU A 102 36.235 -12.656 -0.724 1.00 1.00 H new ATOM 0 HG2 GLU A 102 36.772 -10.177 -0.859 1.00 1.00 H new ATOM 0 HG3 GLU A 102 35.651 -9.902 0.460 1.00 1.00 H new ATOM 189 N ASN A 103 32.798 -13.393 -1.566 1.00 1.00 N ATOM 190 CA ASN A 103 32.132 -14.619 -2.014 1.00 1.00 C ATOM 191 C ASN A 103 31.301 -14.459 -3.313 1.00 1.00 C ATOM 192 O ASN A 103 30.925 -15.469 -3.917 1.00 1.00 O ATOM 193 CB ASN A 103 31.250 -15.152 -0.866 1.00 1.00 C ATOM 194 CG ASN A 103 32.050 -15.589 0.352 1.00 1.00 C ATOM 195 OD1 ASN A 103 33.046 -16.296 0.259 1.00 1.00 O ATOM 196 ND2 ASN A 103 31.642 -15.197 1.538 1.00 1.00 N ATOM 0 H ASN A 103 32.281 -12.902 -0.837 1.00 1.00 H new ATOM 0 HA ASN A 103 32.916 -15.332 -2.268 1.00 1.00 H new ATOM 0 HB2 ASN A 103 30.544 -14.377 -0.569 1.00 1.00 H new ATOM 0 HB3 ASN A 103 30.663 -15.996 -1.229 1.00 1.00 H new ATOM 0 HD21 ASN A 103 32.154 -15.482 2.373 1.00 1.00 H new ATOM 0 HD22 ASN A 103 30.814 -14.608 1.623 1.00 1.00 H new ATOM 203 N GLY A 104 30.993 -13.226 -3.738 1.00 1.00 N ATOM 204 CA GLY A 104 30.083 -12.918 -4.853 1.00 1.00 C ATOM 205 C GLY A 104 29.103 -11.787 -4.522 1.00 1.00 C ATOM 206 O GLY A 104 29.278 -11.071 -3.532 1.00 1.00 O ATOM 0 H GLY A 104 31.381 -12.389 -3.303 1.00 1.00 H new ATOM 0 HA2 GLY A 104 30.669 -12.640 -5.729 1.00 1.00 H new ATOM 0 HA3 GLY A 104 29.521 -13.814 -5.116 1.00 1.00 H new ATOM 210 N GLU A 105 28.062 -11.602 -5.343 1.00 1.00 N ATOM 211 CA GLU A 105 26.949 -10.696 -5.014 1.00 1.00 C ATOM 212 C GLU A 105 26.384 -11.062 -3.633 1.00 1.00 C ATOM 213 O GLU A 105 25.996 -12.212 -3.409 1.00 1.00 O ATOM 214 CB GLU A 105 25.840 -10.721 -6.072 1.00 1.00 C ATOM 215 CG GLU A 105 26.312 -10.220 -7.443 1.00 1.00 C ATOM 216 CD GLU A 105 25.107 -9.931 -8.357 1.00 1.00 C ATOM 217 OE1 GLU A 105 24.331 -10.858 -8.685 1.00 1.00 O ATOM 218 OE2 GLU A 105 24.882 -8.755 -8.724 1.00 1.00 O ATOM 0 H GLU A 105 27.965 -12.069 -6.245 1.00 1.00 H new ATOM 0 HA GLU A 105 27.341 -9.679 -4.997 1.00 1.00 H new ATOM 0 HB2 GLU A 105 25.464 -11.739 -6.173 1.00 1.00 H new ATOM 0 HB3 GLU A 105 25.007 -10.105 -5.733 1.00 1.00 H new ATOM 0 HG2 GLU A 105 26.908 -9.316 -7.321 1.00 1.00 H new ATOM 0 HG3 GLU A 105 26.957 -10.966 -7.907 1.00 1.00 H new ATOM 225 N THR A 106 26.347 -10.092 -2.710 1.00 1.00 N ATOM 226 CA THR A 106 26.063 -10.367 -1.299 1.00 1.00 C ATOM 227 C THR A 106 24.650 -9.983 -0.856 1.00 1.00 C ATOM 228 O THR A 106 23.961 -10.820 -0.265 1.00 1.00 O ATOM 229 CB THR A 106 27.160 -9.804 -0.374 1.00 1.00 C ATOM 230 OG1 THR A 106 27.044 -10.411 0.896 1.00 1.00 O ATOM 231 CG2 THR A 106 27.146 -8.288 -0.158 1.00 1.00 C ATOM 0 H THR A 106 26.511 -9.107 -2.918 1.00 1.00 H new ATOM 0 HA THR A 106 26.088 -11.452 -1.200 1.00 1.00 H new ATOM 0 HB THR A 106 28.095 -10.031 -0.886 1.00 1.00 H new ATOM 0 HG1 THR A 106 27.739 -10.060 1.491 1.00 1.00 H new ATOM 0 HG21 THR A 106 27.961 -8.008 0.509 1.00 1.00 H new ATOM 0 HG22 THR A 106 27.271 -7.783 -1.116 1.00 1.00 H new ATOM 0 HG23 THR A 106 26.196 -7.993 0.287 1.00 1.00 H new ATOM 239 N LYS A 107 24.183 -8.761 -1.171 1.00 1.00 N ATOM 240 CA LYS A 107 22.930 -8.203 -0.615 1.00 1.00 C ATOM 241 C LYS A 107 22.238 -7.213 -1.556 1.00 1.00 C ATOM 242 O LYS A 107 22.813 -6.731 -2.534 1.00 1.00 O ATOM 243 CB LYS A 107 23.205 -7.545 0.762 1.00 1.00 C ATOM 244 CG LYS A 107 23.410 -8.572 1.889 1.00 1.00 C ATOM 245 CD LYS A 107 23.486 -7.911 3.272 1.00 1.00 C ATOM 246 CE LYS A 107 23.598 -8.995 4.355 1.00 1.00 C ATOM 247 NZ LYS A 107 23.661 -8.408 5.723 1.00 1.00 N ATOM 0 H LYS A 107 24.660 -8.131 -1.816 1.00 1.00 H new ATOM 0 HA LYS A 107 22.241 -9.039 -0.492 1.00 1.00 H new ATOM 0 HB2 LYS A 107 24.091 -6.915 0.687 1.00 1.00 H new ATOM 0 HB3 LYS A 107 22.371 -6.893 1.020 1.00 1.00 H new ATOM 0 HG2 LYS A 107 22.590 -9.290 1.877 1.00 1.00 H new ATOM 0 HG3 LYS A 107 24.327 -9.132 1.705 1.00 1.00 H new ATOM 0 HD2 LYS A 107 24.346 -7.244 3.321 1.00 1.00 H new ATOM 0 HD3 LYS A 107 22.599 -7.301 3.444 1.00 1.00 H new ATOM 0 HE2 LYS A 107 22.742 -9.666 4.287 1.00 1.00 H new ATOM 0 HE3 LYS A 107 24.489 -9.596 4.176 1.00 1.00 H new ATOM 0 HZ1 LYS A 107 23.736 -9.171 6.425 1.00 1.00 H new ATOM 0 HZ2 LYS A 107 24.492 -7.787 5.796 1.00 1.00 H new ATOM 0 HZ3 LYS A 107 22.799 -7.855 5.904 1.00 1.00 H new ATOM 261 N THR A 108 20.986 -6.900 -1.225 1.00 1.00 N ATOM 262 CA THR A 108 20.032 -6.098 -2.010 1.00 1.00 C ATOM 263 C THR A 108 19.340 -5.039 -1.138 1.00 1.00 C ATOM 264 O THR A 108 19.286 -5.161 0.089 1.00 1.00 O ATOM 265 CB THR A 108 18.958 -7.011 -2.632 1.00 1.00 C ATOM 266 OG1 THR A 108 18.327 -7.787 -1.633 1.00 1.00 O ATOM 267 CG2 THR A 108 19.529 -7.980 -3.670 1.00 1.00 C ATOM 0 H THR A 108 20.579 -7.218 -0.345 1.00 1.00 H new ATOM 0 HA THR A 108 20.595 -5.593 -2.795 1.00 1.00 H new ATOM 0 HB THR A 108 18.250 -6.342 -3.122 1.00 1.00 H new ATOM 0 HG1 THR A 108 17.647 -8.360 -2.045 1.00 1.00 H new ATOM 0 HG21 THR A 108 18.726 -8.597 -4.073 1.00 1.00 H new ATOM 0 HG22 THR A 108 19.993 -7.415 -4.478 1.00 1.00 H new ATOM 0 HG23 THR A 108 20.276 -8.619 -3.199 1.00 1.00 H new ATOM 275 N TRP A 109 18.803 -3.988 -1.772 1.00 1.00 N ATOM 276 CA TRP A 109 18.117 -2.874 -1.097 1.00 1.00 C ATOM 277 C TRP A 109 17.048 -2.231 -1.993 1.00 1.00 C ATOM 278 O TRP A 109 17.092 -2.338 -3.220 1.00 1.00 O ATOM 279 CB TRP A 109 19.179 -1.851 -0.649 1.00 1.00 C ATOM 280 CG TRP A 109 18.708 -0.672 0.152 1.00 1.00 C ATOM 281 CD1 TRP A 109 17.869 -0.728 1.213 1.00 1.00 C ATOM 282 CD2 TRP A 109 19.097 0.736 0.033 1.00 1.00 C ATOM 283 NE1 TRP A 109 17.673 0.540 1.718 1.00 1.00 N ATOM 284 CE2 TRP A 109 18.429 1.476 1.054 1.00 1.00 C ATOM 285 CE3 TRP A 109 19.974 1.461 -0.803 1.00 1.00 C ATOM 286 CZ2 TRP A 109 18.604 2.853 1.233 1.00 1.00 C ATOM 287 CZ3 TRP A 109 20.165 2.848 -0.631 1.00 1.00 C ATOM 288 CH2 TRP A 109 19.480 3.545 0.381 1.00 1.00 C ATOM 0 H TRP A 109 18.833 -3.885 -2.786 1.00 1.00 H new ATOM 0 HA TRP A 109 17.584 -3.252 -0.225 1.00 1.00 H new ATOM 0 HB2 TRP A 109 19.929 -2.380 -0.061 1.00 1.00 H new ATOM 0 HB3 TRP A 109 19.681 -1.474 -1.540 1.00 1.00 H new ATOM 0 HD1 TRP A 109 17.421 -1.629 1.605 1.00 1.00 H new ATOM 0 HE1 TRP A 109 17.043 0.757 2.491 1.00 1.00 H new ATOM 0 HE3 TRP A 109 20.508 0.945 -1.587 1.00 1.00 H new ATOM 0 HZ2 TRP A 109 18.073 3.376 2.015 1.00 1.00 H new ATOM 0 HZ3 TRP A 109 20.843 3.380 -1.282 1.00 1.00 H new ATOM 0 HH2 TRP A 109 19.627 4.608 0.502 1.00 1.00 H new ATOM 299 N THR A 110 16.082 -1.546 -1.382 1.00 1.00 N ATOM 300 CA THR A 110 14.880 -0.973 -2.033 1.00 1.00 C ATOM 301 C THR A 110 14.798 0.558 -1.937 1.00 1.00 C ATOM 302 O THR A 110 13.966 1.170 -2.606 1.00 1.00 O ATOM 303 CB THR A 110 13.620 -1.551 -1.367 1.00 1.00 C ATOM 304 OG1 THR A 110 13.678 -1.259 0.013 1.00 1.00 O ATOM 305 CG2 THR A 110 13.514 -3.066 -1.520 1.00 1.00 C ATOM 0 H THR A 110 16.106 -1.362 -0.379 1.00 1.00 H new ATOM 0 HA THR A 110 14.950 -1.237 -3.088 1.00 1.00 H new ATOM 0 HB THR A 110 12.754 -1.102 -1.853 1.00 1.00 H new ATOM 0 HG1 THR A 110 12.785 -1.354 0.405 1.00 1.00 H new ATOM 0 HG21 THR A 110 12.606 -3.418 -1.031 1.00 1.00 H new ATOM 0 HG22 THR A 110 13.479 -3.323 -2.579 1.00 1.00 H new ATOM 0 HG23 THR A 110 14.381 -3.540 -1.060 1.00 1.00 H new ATOM 313 N GLY A 111 15.637 1.181 -1.100 1.00 1.00 N ATOM 314 CA GLY A 111 15.565 2.604 -0.734 1.00 1.00 C ATOM 315 C GLY A 111 14.900 2.858 0.633 1.00 1.00 C ATOM 316 O GLY A 111 14.983 3.971 1.156 1.00 1.00 O ATOM 0 H GLY A 111 16.409 0.695 -0.644 1.00 1.00 H new ATOM 0 HA2 GLY A 111 16.573 3.018 -0.721 1.00 1.00 H new ATOM 0 HA3 GLY A 111 15.010 3.141 -1.504 1.00 1.00 H new ATOM 320 N GLN A 112 14.238 1.848 1.220 1.00 1.00 N ATOM 321 CA GLN A 112 13.587 1.930 2.538 1.00 1.00 C ATOM 322 C GLN A 112 14.605 1.950 3.697 1.00 1.00 C ATOM 323 O GLN A 112 15.739 1.485 3.559 1.00 1.00 O ATOM 324 CB GLN A 112 12.624 0.739 2.706 1.00 1.00 C ATOM 325 CG GLN A 112 11.449 0.782 1.712 1.00 1.00 C ATOM 326 CD GLN A 112 10.557 -0.451 1.840 1.00 1.00 C ATOM 327 OE1 GLN A 112 10.879 -1.537 1.369 1.00 1.00 O ATOM 328 NE2 GLN A 112 9.408 -0.343 2.478 1.00 1.00 N ATOM 0 H GLN A 112 14.138 0.932 0.782 1.00 1.00 H new ATOM 0 HA GLN A 112 13.037 2.870 2.578 1.00 1.00 H new ATOM 0 HB2 GLN A 112 13.176 -0.191 2.570 1.00 1.00 H new ATOM 0 HB3 GLN A 112 12.234 0.733 3.724 1.00 1.00 H new ATOM 0 HG2 GLN A 112 10.856 1.680 1.887 1.00 1.00 H new ATOM 0 HG3 GLN A 112 11.835 0.848 0.695 1.00 1.00 H new ATOM 0 HE21 GLN A 112 9.127 0.554 2.875 1.00 1.00 H new ATOM 0 HE22 GLN A 112 8.800 -1.156 2.575 1.00 1.00 H new ATOM 337 N GLY A 113 14.189 2.435 4.872 1.00 1.00 N ATOM 338 CA GLY A 113 15.038 2.506 6.070 1.00 1.00 C ATOM 339 C GLY A 113 16.183 3.518 5.924 1.00 1.00 C ATOM 340 O GLY A 113 15.935 4.720 5.790 1.00 1.00 O ATOM 0 H GLY A 113 13.246 2.793 5.021 1.00 1.00 H new ATOM 0 HA2 GLY A 113 14.425 2.778 6.929 1.00 1.00 H new ATOM 0 HA3 GLY A 113 15.454 1.520 6.275 1.00 1.00 H new ATOM 344 N ARG A 114 17.434 3.039 5.973 1.00 1.00 N ATOM 345 CA ARG A 114 18.672 3.828 5.793 1.00 1.00 C ATOM 346 C ARG A 114 19.695 3.080 4.924 1.00 1.00 C ATOM 347 O ARG A 114 19.644 1.855 4.799 1.00 1.00 O ATOM 348 CB ARG A 114 19.283 4.175 7.171 1.00 1.00 C ATOM 349 CG ARG A 114 18.428 5.096 8.062 1.00 1.00 C ATOM 350 CD ARG A 114 18.239 6.498 7.467 1.00 1.00 C ATOM 351 NE ARG A 114 17.436 7.359 8.359 1.00 1.00 N ATOM 352 CZ ARG A 114 16.126 7.536 8.348 1.00 1.00 C ATOM 353 NH1 ARG A 114 15.334 6.900 7.529 1.00 1.00 N ATOM 354 NH2 ARG A 114 15.570 8.366 9.186 1.00 1.00 N ATOM 0 H ARG A 114 17.624 2.052 6.146 1.00 1.00 H new ATOM 0 HA ARG A 114 18.413 4.751 5.275 1.00 1.00 H new ATOM 0 HB2 ARG A 114 19.469 3.246 7.711 1.00 1.00 H new ATOM 0 HB3 ARG A 114 20.251 4.650 7.011 1.00 1.00 H new ATOM 0 HG2 ARG A 114 17.451 4.638 8.217 1.00 1.00 H new ATOM 0 HG3 ARG A 114 18.898 5.183 9.042 1.00 1.00 H new ATOM 0 HD2 ARG A 114 19.213 6.957 7.296 1.00 1.00 H new ATOM 0 HD3 ARG A 114 17.749 6.420 6.496 1.00 1.00 H new ATOM 0 HE ARG A 114 17.954 7.879 9.068 1.00 1.00 H new ATOM 0 HH11 ARG A 114 15.720 6.233 6.861 1.00 1.00 H new ATOM 0 HH12 ARG A 114 14.329 7.069 7.557 1.00 1.00 H new ATOM 0 HH21 ARG A 114 16.146 8.881 9.852 1.00 1.00 H new ATOM 0 HH22 ARG A 114 14.559 8.501 9.175 1.00 1.00 H new ATOM 368 N THR A 115 20.637 3.826 4.343 1.00 1.00 N ATOM 369 CA THR A 115 21.687 3.338 3.427 1.00 1.00 C ATOM 370 C THR A 115 22.507 2.173 4.020 1.00 1.00 C ATOM 371 O THR A 115 23.079 2.345 5.103 1.00 1.00 O ATOM 372 CB THR A 115 22.632 4.492 3.062 1.00 1.00 C ATOM 373 OG1 THR A 115 21.871 5.608 2.637 1.00 1.00 O ATOM 374 CG2 THR A 115 23.586 4.134 1.923 1.00 1.00 C ATOM 0 H THR A 115 20.697 4.832 4.501 1.00 1.00 H new ATOM 0 HA THR A 115 21.182 2.959 2.538 1.00 1.00 H new ATOM 0 HB THR A 115 23.217 4.711 3.956 1.00 1.00 H new ATOM 0 HG1 THR A 115 22.473 6.346 2.405 1.00 1.00 H new ATOM 0 HG21 THR A 115 24.231 4.986 1.707 1.00 1.00 H new ATOM 0 HG22 THR A 115 24.198 3.281 2.216 1.00 1.00 H new ATOM 0 HG23 THR A 115 23.011 3.879 1.033 1.00 1.00 H new ATOM 382 N PRO A 116 22.592 0.998 3.353 1.00 1.00 N ATOM 383 CA PRO A 116 23.383 -0.149 3.814 1.00 1.00 C ATOM 384 C PRO A 116 24.874 0.159 4.041 1.00 1.00 C ATOM 385 O PRO A 116 25.448 1.030 3.386 1.00 1.00 O ATOM 386 CB PRO A 116 23.207 -1.236 2.745 1.00 1.00 C ATOM 387 CG PRO A 116 21.890 -0.882 2.064 1.00 1.00 C ATOM 388 CD PRO A 116 21.830 0.638 2.167 1.00 1.00 C ATOM 0 HA PRO A 116 23.025 -0.460 4.795 1.00 1.00 H new ATOM 0 HB2 PRO A 116 24.035 -1.235 2.036 1.00 1.00 H new ATOM 0 HB3 PRO A 116 23.170 -2.230 3.190 1.00 1.00 H new ATOM 0 HG2 PRO A 116 21.873 -1.214 1.026 1.00 1.00 H new ATOM 0 HG3 PRO A 116 21.042 -1.351 2.563 1.00 1.00 H new ATOM 0 HD2 PRO A 116 22.252 1.105 1.277 1.00 1.00 H new ATOM 0 HD3 PRO A 116 20.799 0.982 2.248 1.00 1.00 H new ATOM 396 N ALA A 117 25.519 -0.612 4.923 1.00 1.00 N ATOM 397 CA ALA A 117 26.900 -0.381 5.379 1.00 1.00 C ATOM 398 C ALA A 117 27.935 -0.294 4.242 1.00 1.00 C ATOM 399 O ALA A 117 28.724 0.647 4.194 1.00 1.00 O ATOM 400 CB ALA A 117 27.255 -1.476 6.394 1.00 1.00 C ATOM 0 H ALA A 117 25.089 -1.432 5.351 1.00 1.00 H new ATOM 0 HA ALA A 117 26.942 0.603 5.846 1.00 1.00 H new ATOM 0 HB1 ALA A 117 28.275 -1.327 6.748 1.00 1.00 H new ATOM 0 HB2 ALA A 117 26.567 -1.426 7.238 1.00 1.00 H new ATOM 0 HB3 ALA A 117 27.175 -2.453 5.918 1.00 1.00 H new ATOM 406 N VAL A 118 27.927 -1.230 3.286 1.00 1.00 N ATOM 407 CA VAL A 118 28.890 -1.201 2.168 1.00 1.00 C ATOM 408 C VAL A 118 28.571 -0.081 1.177 1.00 1.00 C ATOM 409 O VAL A 118 29.491 0.569 0.689 1.00 1.00 O ATOM 410 CB VAL A 118 28.982 -2.571 1.458 1.00 1.00 C ATOM 411 CG1 VAL A 118 29.975 -2.579 0.286 1.00 1.00 C ATOM 412 CG2 VAL A 118 29.430 -3.665 2.440 1.00 1.00 C ATOM 0 H VAL A 118 27.273 -2.012 3.259 1.00 1.00 H new ATOM 0 HA VAL A 118 29.870 -0.989 2.596 1.00 1.00 H new ATOM 0 HB VAL A 118 27.980 -2.764 1.075 1.00 1.00 H new ATOM 0 HG11 VAL A 118 29.992 -3.569 -0.169 1.00 1.00 H new ATOM 0 HG12 VAL A 118 29.667 -1.843 -0.457 1.00 1.00 H new ATOM 0 HG13 VAL A 118 30.971 -2.330 0.652 1.00 1.00 H new ATOM 0 HG21 VAL A 118 29.488 -4.620 1.919 1.00 1.00 H new ATOM 0 HG22 VAL A 118 30.410 -3.412 2.844 1.00 1.00 H new ATOM 0 HG23 VAL A 118 28.710 -3.739 3.255 1.00 1.00 H new ATOM 422 N ILE A 119 27.286 0.216 0.943 1.00 1.00 N ATOM 423 CA ILE A 119 26.862 1.336 0.086 1.00 1.00 C ATOM 424 C ILE A 119 27.418 2.660 0.640 1.00 1.00 C ATOM 425 O ILE A 119 28.083 3.398 -0.088 1.00 1.00 O ATOM 426 CB ILE A 119 25.319 1.370 -0.060 1.00 1.00 C ATOM 427 CG1 ILE A 119 24.706 0.060 -0.614 1.00 1.00 C ATOM 428 CG2 ILE A 119 24.873 2.560 -0.926 1.00 1.00 C ATOM 429 CD1 ILE A 119 25.063 -0.272 -2.065 1.00 1.00 C ATOM 0 H ILE A 119 26.510 -0.312 1.341 1.00 1.00 H new ATOM 0 HA ILE A 119 27.270 1.193 -0.914 1.00 1.00 H new ATOM 0 HB ILE A 119 24.939 1.485 0.955 1.00 1.00 H new ATOM 0 HG12 ILE A 119 25.027 -0.767 0.019 1.00 1.00 H new ATOM 0 HG13 ILE A 119 23.621 0.123 -0.530 1.00 1.00 H new ATOM 0 HG21 ILE A 119 23.786 2.560 -1.012 1.00 1.00 H new ATOM 0 HG22 ILE A 119 25.200 3.490 -0.462 1.00 1.00 H new ATOM 0 HG23 ILE A 119 25.316 2.474 -1.918 1.00 1.00 H new ATOM 0 HD11 ILE A 119 24.583 -1.207 -2.353 1.00 1.00 H new ATOM 0 HD12 ILE A 119 24.716 0.529 -2.717 1.00 1.00 H new ATOM 0 HD13 ILE A 119 26.144 -0.375 -2.159 1.00 1.00 H new ATOM 441 N LYS A 120 27.223 2.936 1.941 1.00 1.00 N ATOM 442 CA LYS A 120 27.743 4.163 2.569 1.00 1.00 C ATOM 443 C LYS A 120 29.274 4.199 2.620 1.00 1.00 C ATOM 444 O LYS A 120 29.870 5.204 2.244 1.00 1.00 O ATOM 445 CB LYS A 120 27.088 4.426 3.936 1.00 1.00 C ATOM 446 CG LYS A 120 27.468 3.472 5.083 1.00 1.00 C ATOM 447 CD LYS A 120 26.696 3.746 6.387 1.00 1.00 C ATOM 448 CE LYS A 120 26.880 5.150 6.998 1.00 1.00 C ATOM 449 NZ LYS A 120 28.280 5.417 7.435 1.00 1.00 N ATOM 0 H LYS A 120 26.710 2.327 2.578 1.00 1.00 H new ATOM 0 HA LYS A 120 27.456 4.994 1.924 1.00 1.00 H new ATOM 0 HB2 LYS A 120 27.337 5.442 4.242 1.00 1.00 H new ATOM 0 HB3 LYS A 120 26.006 4.388 3.807 1.00 1.00 H new ATOM 0 HG2 LYS A 120 27.282 2.445 4.768 1.00 1.00 H new ATOM 0 HG3 LYS A 120 28.537 3.557 5.278 1.00 1.00 H new ATOM 0 HD2 LYS A 120 25.634 3.590 6.197 1.00 1.00 H new ATOM 0 HD3 LYS A 120 26.999 3.006 7.128 1.00 1.00 H new ATOM 0 HE2 LYS A 120 26.585 5.901 6.265 1.00 1.00 H new ATOM 0 HE3 LYS A 120 26.212 5.259 7.852 1.00 1.00 H new ATOM 0 HZ1 LYS A 120 28.307 6.289 8.001 1.00 1.00 H new ATOM 0 HZ2 LYS A 120 28.622 4.621 8.010 1.00 1.00 H new ATOM 0 HZ3 LYS A 120 28.889 5.527 6.600 1.00 1.00 H new ATOM 463 N LYS A 121 29.926 3.086 2.975 1.00 1.00 N ATOM 464 CA LYS A 121 31.396 3.008 3.055 1.00 1.00 C ATOM 465 C LYS A 121 32.066 3.185 1.690 1.00 1.00 C ATOM 466 O LYS A 121 33.103 3.834 1.608 1.00 1.00 O ATOM 467 CB LYS A 121 31.822 1.714 3.771 1.00 1.00 C ATOM 468 CG LYS A 121 31.499 1.816 5.277 1.00 1.00 C ATOM 469 CD LYS A 121 31.580 0.478 6.021 1.00 1.00 C ATOM 470 CE LYS A 121 33.008 -0.092 6.052 1.00 1.00 C ATOM 471 NZ LYS A 121 33.085 -1.346 6.856 1.00 1.00 N ATOM 0 H LYS A 121 29.454 2.214 3.215 1.00 1.00 H new ATOM 0 HA LYS A 121 31.749 3.847 3.655 1.00 1.00 H new ATOM 0 HB2 LYS A 121 31.303 0.860 3.336 1.00 1.00 H new ATOM 0 HB3 LYS A 121 32.889 1.544 3.630 1.00 1.00 H new ATOM 0 HG2 LYS A 121 32.190 2.521 5.740 1.00 1.00 H new ATOM 0 HG3 LYS A 121 30.497 2.227 5.397 1.00 1.00 H new ATOM 0 HD2 LYS A 121 31.223 0.611 7.042 1.00 1.00 H new ATOM 0 HD3 LYS A 121 30.915 -0.241 5.542 1.00 1.00 H new ATOM 0 HE2 LYS A 121 33.342 -0.292 5.034 1.00 1.00 H new ATOM 0 HE3 LYS A 121 33.687 0.651 6.471 1.00 1.00 H new ATOM 0 HZ1 LYS A 121 34.063 -1.700 6.854 1.00 1.00 H new ATOM 0 HZ2 LYS A 121 32.790 -1.150 7.834 1.00 1.00 H new ATOM 0 HZ3 LYS A 121 32.456 -2.063 6.442 1.00 1.00 H new ATOM 485 N ALA A 122 31.449 2.709 0.607 1.00 1.00 N ATOM 486 CA ALA A 122 31.907 2.976 -0.757 1.00 1.00 C ATOM 487 C ALA A 122 31.801 4.464 -1.148 1.00 1.00 C ATOM 488 O ALA A 122 32.707 4.995 -1.791 1.00 1.00 O ATOM 489 CB ALA A 122 31.118 2.079 -1.717 1.00 1.00 C ATOM 0 H ALA A 122 30.614 2.125 0.652 1.00 1.00 H new ATOM 0 HA ALA A 122 32.970 2.742 -0.819 1.00 1.00 H new ATOM 0 HB1 ALA A 122 31.446 2.264 -2.740 1.00 1.00 H new ATOM 0 HB2 ALA A 122 31.292 1.033 -1.464 1.00 1.00 H new ATOM 0 HB3 ALA A 122 30.054 2.301 -1.631 1.00 1.00 H new ATOM 495 N MET A 123 30.739 5.165 -0.736 1.00 1.00 N ATOM 496 CA MET A 123 30.619 6.618 -0.913 1.00 1.00 C ATOM 497 C MET A 123 31.680 7.383 -0.102 1.00 1.00 C ATOM 498 O MET A 123 32.332 8.290 -0.621 1.00 1.00 O ATOM 499 CB MET A 123 29.213 7.096 -0.513 1.00 1.00 C ATOM 500 CG MET A 123 28.102 6.536 -1.407 1.00 1.00 C ATOM 501 SD MET A 123 26.442 6.735 -0.700 1.00 1.00 S ATOM 502 CE MET A 123 25.459 6.037 -2.054 1.00 1.00 C ATOM 0 H MET A 123 29.937 4.741 -0.270 1.00 1.00 H new ATOM 0 HA MET A 123 30.786 6.829 -1.969 1.00 1.00 H new ATOM 0 HB2 MET A 123 29.019 6.806 0.520 1.00 1.00 H new ATOM 0 HB3 MET A 123 29.184 8.185 -0.549 1.00 1.00 H new ATOM 0 HG2 MET A 123 28.139 7.034 -2.376 1.00 1.00 H new ATOM 0 HG3 MET A 123 28.288 5.477 -1.586 1.00 1.00 H new ATOM 0 HE1 MET A 123 24.401 6.076 -1.794 1.00 1.00 H new ATOM 0 HE2 MET A 123 25.631 6.614 -2.963 1.00 1.00 H new ATOM 0 HE3 MET A 123 25.753 5.001 -2.221 1.00 1.00 H new ATOM 512 N GLU A 124 31.872 7.013 1.167 1.00 1.00 N ATOM 513 CA GLU A 124 32.759 7.699 2.116 1.00 1.00 C ATOM 514 C GLU A 124 34.260 7.454 1.866 1.00 1.00 C ATOM 515 O GLU A 124 35.062 8.384 1.982 1.00 1.00 O ATOM 516 CB GLU A 124 32.405 7.250 3.545 1.00 1.00 C ATOM 517 CG GLU A 124 31.055 7.805 4.019 1.00 1.00 C ATOM 518 CD GLU A 124 30.673 7.240 5.399 1.00 1.00 C ATOM 519 OE1 GLU A 124 30.089 6.133 5.478 1.00 1.00 O ATOM 520 OE2 GLU A 124 30.925 7.915 6.428 1.00 1.00 O ATOM 0 H GLU A 124 31.402 6.205 1.576 1.00 1.00 H new ATOM 0 HA GLU A 124 32.596 8.768 1.976 1.00 1.00 H new ATOM 0 HB2 GLU A 124 32.380 6.161 3.584 1.00 1.00 H new ATOM 0 HB3 GLU A 124 33.188 7.576 4.229 1.00 1.00 H new ATOM 0 HG2 GLU A 124 31.104 8.893 4.070 1.00 1.00 H new ATOM 0 HG3 GLU A 124 30.281 7.554 3.294 1.00 1.00 H new ATOM 527 N GLU A 125 34.650 6.224 1.508 1.00 1.00 N ATOM 528 CA GLU A 125 36.059 5.787 1.442 1.00 1.00 C ATOM 529 C GLU A 125 36.575 5.501 0.019 1.00 1.00 C ATOM 530 O GLU A 125 37.789 5.455 -0.187 1.00 1.00 O ATOM 531 CB GLU A 125 36.268 4.542 2.326 1.00 1.00 C ATOM 532 CG GLU A 125 35.892 4.727 3.805 1.00 1.00 C ATOM 533 CD GLU A 125 36.692 5.848 4.497 1.00 1.00 C ATOM 534 OE1 GLU A 125 37.943 5.872 4.391 1.00 1.00 O ATOM 535 OE2 GLU A 125 36.084 6.699 5.191 1.00 1.00 O ATOM 0 H GLU A 125 33.989 5.490 1.251 1.00 1.00 H new ATOM 0 HA GLU A 125 36.643 6.630 1.811 1.00 1.00 H new ATOM 0 HB2 GLU A 125 35.679 3.721 1.917 1.00 1.00 H new ATOM 0 HB3 GLU A 125 37.315 4.244 2.267 1.00 1.00 H new ATOM 0 HG2 GLU A 125 34.828 4.950 3.878 1.00 1.00 H new ATOM 0 HG3 GLU A 125 36.058 3.790 4.336 1.00 1.00 H new ATOM 542 N GLN A 126 35.679 5.338 -0.969 1.00 1.00 N ATOM 543 CA GLN A 126 36.030 5.040 -2.373 1.00 1.00 C ATOM 544 C GLN A 126 35.424 6.044 -3.381 1.00 1.00 C ATOM 545 O GLN A 126 35.624 5.912 -4.591 1.00 1.00 O ATOM 546 CB GLN A 126 35.639 3.587 -2.724 1.00 1.00 C ATOM 547 CG GLN A 126 36.273 2.510 -1.822 1.00 1.00 C ATOM 548 CD GLN A 126 37.803 2.456 -1.884 1.00 1.00 C ATOM 549 OE1 GLN A 126 38.440 2.807 -2.870 1.00 1.00 O ATOM 550 NE2 GLN A 126 38.457 1.991 -0.839 1.00 1.00 N ATOM 0 H GLN A 126 34.673 5.410 -0.815 1.00 1.00 H new ATOM 0 HA GLN A 126 37.111 5.150 -2.460 1.00 1.00 H new ATOM 0 HB2 GLN A 126 34.554 3.494 -2.669 1.00 1.00 H new ATOM 0 HB3 GLN A 126 35.924 3.389 -3.757 1.00 1.00 H new ATOM 0 HG2 GLN A 126 35.969 2.691 -0.791 1.00 1.00 H new ATOM 0 HG3 GLN A 126 35.875 1.536 -2.105 1.00 1.00 H new ATOM 0 HE21 GLN A 126 37.945 1.694 -0.008 1.00 1.00 H new ATOM 0 HE22 GLN A 126 39.475 1.929 -0.861 1.00 1.00 H new ATOM 559 N GLY A 127 34.700 7.068 -2.904 1.00 1.00 N ATOM 560 CA GLY A 127 34.137 8.154 -3.720 1.00 1.00 C ATOM 561 C GLY A 127 33.005 7.739 -4.675 1.00 1.00 C ATOM 562 O GLY A 127 32.719 8.468 -5.629 1.00 1.00 O ATOM 0 H GLY A 127 34.484 7.166 -1.912 1.00 1.00 H new ATOM 0 HA2 GLY A 127 33.761 8.930 -3.053 1.00 1.00 H new ATOM 0 HA3 GLY A 127 34.940 8.599 -4.307 1.00 1.00 H new ATOM 566 N LYS A 128 32.376 6.574 -4.455 1.00 1.00 N ATOM 567 CA LYS A 128 31.250 6.075 -5.271 1.00 1.00 C ATOM 568 C LYS A 128 29.982 6.936 -5.132 1.00 1.00 C ATOM 569 O LYS A 128 29.845 7.744 -4.214 1.00 1.00 O ATOM 570 CB LYS A 128 30.940 4.605 -4.903 1.00 1.00 C ATOM 571 CG LYS A 128 31.994 3.588 -5.375 1.00 1.00 C ATOM 572 CD LYS A 128 32.162 3.572 -6.903 1.00 1.00 C ATOM 573 CE LYS A 128 32.822 2.264 -7.347 1.00 1.00 C ATOM 574 NZ LYS A 128 32.960 2.185 -8.829 1.00 1.00 N ATOM 0 H LYS A 128 32.635 5.942 -3.697 1.00 1.00 H new ATOM 0 HA LYS A 128 31.561 6.138 -6.314 1.00 1.00 H new ATOM 0 HB2 LYS A 128 30.841 4.529 -3.820 1.00 1.00 H new ATOM 0 HB3 LYS A 128 29.975 4.333 -5.331 1.00 1.00 H new ATOM 0 HG2 LYS A 128 32.952 3.822 -4.911 1.00 1.00 H new ATOM 0 HG3 LYS A 128 31.710 2.592 -5.035 1.00 1.00 H new ATOM 0 HD2 LYS A 128 31.190 3.679 -7.384 1.00 1.00 H new ATOM 0 HD3 LYS A 128 32.770 4.420 -7.219 1.00 1.00 H new ATOM 0 HE2 LYS A 128 33.806 2.179 -6.886 1.00 1.00 H new ATOM 0 HE3 LYS A 128 32.230 1.420 -6.992 1.00 1.00 H new ATOM 0 HZ1 LYS A 128 33.516 1.343 -9.082 1.00 1.00 H new ATOM 0 HZ2 LYS A 128 32.017 2.120 -9.263 1.00 1.00 H new ATOM 0 HZ3 LYS A 128 33.444 3.037 -9.178 1.00 1.00 H new ATOM 588 N GLN A 129 29.022 6.683 -6.024 1.00 1.00 N ATOM 589 CA GLN A 129 27.646 7.205 -5.988 1.00 1.00 C ATOM 590 C GLN A 129 26.660 6.034 -6.141 1.00 1.00 C ATOM 591 O GLN A 129 27.040 4.955 -6.592 1.00 1.00 O ATOM 592 CB GLN A 129 27.456 8.271 -7.088 1.00 1.00 C ATOM 593 CG GLN A 129 28.345 9.507 -6.881 1.00 1.00 C ATOM 594 CD GLN A 129 28.066 10.590 -7.921 1.00 1.00 C ATOM 595 OE1 GLN A 129 27.078 11.312 -7.860 1.00 1.00 O ATOM 596 NE2 GLN A 129 28.916 10.757 -8.915 1.00 1.00 N ATOM 0 H GLN A 129 29.186 6.081 -6.831 1.00 1.00 H new ATOM 0 HA GLN A 129 27.451 7.691 -5.032 1.00 1.00 H new ATOM 0 HB2 GLN A 129 27.678 7.828 -8.059 1.00 1.00 H new ATOM 0 HB3 GLN A 129 26.411 8.581 -7.111 1.00 1.00 H new ATOM 0 HG2 GLN A 129 28.178 9.911 -5.882 1.00 1.00 H new ATOM 0 HG3 GLN A 129 29.393 9.213 -6.935 1.00 1.00 H new ATOM 0 HE21 GLN A 129 29.744 10.166 -8.983 1.00 1.00 H new ATOM 0 HE22 GLN A 129 28.745 11.478 -9.616 1.00 1.00 H new ATOM 605 N LEU A 130 25.391 6.222 -5.767 1.00 1.00 N ATOM 606 CA LEU A 130 24.402 5.137 -5.659 1.00 1.00 C ATOM 607 C LEU A 130 24.108 4.438 -6.998 1.00 1.00 C ATOM 608 O LEU A 130 23.776 3.255 -7.033 1.00 1.00 O ATOM 609 CB LEU A 130 23.133 5.735 -5.021 1.00 1.00 C ATOM 610 CG LEU A 130 22.039 4.719 -4.650 1.00 1.00 C ATOM 611 CD1 LEU A 130 22.534 3.603 -3.729 1.00 1.00 C ATOM 612 CD2 LEU A 130 20.895 5.441 -3.938 1.00 1.00 C ATOM 0 H LEU A 130 25.014 7.139 -5.528 1.00 1.00 H new ATOM 0 HA LEU A 130 24.808 4.343 -5.032 1.00 1.00 H new ATOM 0 HB2 LEU A 130 23.421 6.278 -4.121 1.00 1.00 H new ATOM 0 HB3 LEU A 130 22.709 6.464 -5.711 1.00 1.00 H new ATOM 0 HG LEU A 130 21.715 4.263 -5.586 1.00 1.00 H new ATOM 0 HD11 LEU A 130 21.712 2.922 -3.508 1.00 1.00 H new ATOM 0 HD12 LEU A 130 23.337 3.054 -4.221 1.00 1.00 H new ATOM 0 HD13 LEU A 130 22.907 4.036 -2.801 1.00 1.00 H new ATOM 0 HD21 LEU A 130 20.119 4.722 -3.675 1.00 1.00 H new ATOM 0 HD22 LEU A 130 21.272 5.916 -3.032 1.00 1.00 H new ATOM 0 HD23 LEU A 130 20.477 6.200 -4.599 1.00 1.00 H new ATOM 624 N GLU A 131 24.298 5.141 -8.113 1.00 1.00 N ATOM 625 CA GLU A 131 24.186 4.582 -9.466 1.00 1.00 C ATOM 626 C GLU A 131 25.181 3.437 -9.748 1.00 1.00 C ATOM 627 O GLU A 131 24.909 2.603 -10.613 1.00 1.00 O ATOM 628 CB GLU A 131 24.365 5.688 -10.517 1.00 1.00 C ATOM 629 CG GLU A 131 23.228 6.714 -10.483 1.00 1.00 C ATOM 630 CD GLU A 131 23.383 7.740 -11.625 1.00 1.00 C ATOM 631 OE1 GLU A 131 22.928 7.465 -12.763 1.00 1.00 O ATOM 632 OE2 GLU A 131 23.967 8.828 -11.397 1.00 1.00 O ATOM 0 H GLU A 131 24.538 6.132 -8.105 1.00 1.00 H new ATOM 0 HA GLU A 131 23.186 4.154 -9.531 1.00 1.00 H new ATOM 0 HB2 GLU A 131 25.315 6.196 -10.348 1.00 1.00 H new ATOM 0 HB3 GLU A 131 24.416 5.239 -11.509 1.00 1.00 H new ATOM 0 HG2 GLU A 131 22.269 6.204 -10.574 1.00 1.00 H new ATOM 0 HG3 GLU A 131 23.226 7.229 -9.523 1.00 1.00 H new ATOM 639 N ASP A 132 26.295 3.343 -9.008 1.00 1.00 N ATOM 640 CA ASP A 132 27.211 2.192 -9.076 1.00 1.00 C ATOM 641 C ASP A 132 26.551 0.873 -8.609 1.00 1.00 C ATOM 642 O ASP A 132 26.979 -0.217 -9.003 1.00 1.00 O ATOM 643 CB ASP A 132 28.485 2.475 -8.260 1.00 1.00 C ATOM 644 CG ASP A 132 29.634 1.549 -8.680 1.00 1.00 C ATOM 645 OD1 ASP A 132 30.312 1.868 -9.686 1.00 1.00 O ATOM 646 OD2 ASP A 132 29.926 0.551 -7.983 1.00 1.00 O ATOM 0 H ASP A 132 26.588 4.061 -8.346 1.00 1.00 H new ATOM 0 HA ASP A 132 27.475 2.057 -10.125 1.00 1.00 H new ATOM 0 HB2 ASP A 132 28.784 3.514 -8.397 1.00 1.00 H new ATOM 0 HB3 ASP A 132 28.277 2.341 -7.199 1.00 1.00 H new ATOM 651 N PHE A 133 25.469 0.978 -7.826 1.00 1.00 N ATOM 652 CA PHE A 133 24.743 -0.132 -7.197 1.00 1.00 C ATOM 653 C PHE A 133 23.276 -0.246 -7.657 1.00 1.00 C ATOM 654 O PHE A 133 22.637 -1.272 -7.429 1.00 1.00 O ATOM 655 CB PHE A 133 24.807 0.055 -5.674 1.00 1.00 C ATOM 656 CG PHE A 133 26.214 0.208 -5.124 1.00 1.00 C ATOM 657 CD1 PHE A 133 27.033 -0.924 -4.959 1.00 1.00 C ATOM 658 CD2 PHE A 133 26.704 1.481 -4.772 1.00 1.00 C ATOM 659 CE1 PHE A 133 28.332 -0.786 -4.437 1.00 1.00 C ATOM 660 CE2 PHE A 133 28.000 1.620 -4.243 1.00 1.00 C ATOM 661 CZ PHE A 133 28.814 0.485 -4.080 1.00 1.00 C ATOM 0 H PHE A 133 25.057 1.884 -7.604 1.00 1.00 H new ATOM 0 HA PHE A 133 25.223 -1.061 -7.503 1.00 1.00 H new ATOM 0 HB2 PHE A 133 24.225 0.936 -5.403 1.00 1.00 H new ATOM 0 HB3 PHE A 133 24.332 -0.801 -5.194 1.00 1.00 H new ATOM 0 HD1 PHE A 133 26.664 -1.901 -5.234 1.00 1.00 H new ATOM 0 HD2 PHE A 133 26.082 2.353 -4.909 1.00 1.00 H new ATOM 0 HE1 PHE A 133 28.959 -1.656 -4.311 1.00 1.00 H new ATOM 0 HE2 PHE A 133 28.369 2.596 -3.963 1.00 1.00 H new ATOM 0 HZ PHE A 133 29.812 0.590 -3.680 1.00 1.00 H new ATOM 671 N LEU A 134 22.739 0.792 -8.305 1.00 1.00 N ATOM 672 CA LEU A 134 21.430 0.843 -8.965 1.00 1.00 C ATOM 673 C LEU A 134 21.251 -0.275 -10.008 1.00 1.00 C ATOM 674 O LEU A 134 22.113 -0.488 -10.864 1.00 1.00 O ATOM 675 CB LEU A 134 21.325 2.252 -9.584 1.00 1.00 C ATOM 676 CG LEU A 134 20.087 2.657 -10.404 1.00 1.00 C ATOM 677 CD1 LEU A 134 20.030 2.070 -11.817 1.00 1.00 C ATOM 678 CD2 LEU A 134 18.779 2.351 -9.690 1.00 1.00 C ATOM 0 H LEU A 134 23.239 1.677 -8.388 1.00 1.00 H new ATOM 0 HA LEU A 134 20.625 0.670 -8.250 1.00 1.00 H new ATOM 0 HB2 LEU A 134 21.419 2.969 -8.768 1.00 1.00 H new ATOM 0 HB3 LEU A 134 22.194 2.386 -10.228 1.00 1.00 H new ATOM 0 HG LEU A 134 20.205 3.736 -10.505 1.00 1.00 H new ATOM 0 HD11 LEU A 134 19.123 2.411 -12.316 1.00 1.00 H new ATOM 0 HD12 LEU A 134 20.902 2.399 -12.383 1.00 1.00 H new ATOM 0 HD13 LEU A 134 20.025 0.982 -11.759 1.00 1.00 H new ATOM 0 HD21 LEU A 134 17.942 2.658 -10.317 1.00 1.00 H new ATOM 0 HD22 LEU A 134 18.713 1.281 -9.495 1.00 1.00 H new ATOM 0 HD23 LEU A 134 18.744 2.894 -8.746 1.00 1.00 H new ATOM 690 N ILE A 135 20.090 -0.937 -9.948 1.00 1.00 N ATOM 691 CA ILE A 135 19.670 -1.995 -10.895 1.00 1.00 C ATOM 692 C ILE A 135 18.289 -1.795 -11.558 1.00 1.00 C ATOM 693 O ILE A 135 17.989 -2.528 -12.503 1.00 1.00 O ATOM 694 CB ILE A 135 19.801 -3.406 -10.266 1.00 1.00 C ATOM 695 CG1 ILE A 135 18.742 -3.639 -9.159 1.00 1.00 C ATOM 696 CG2 ILE A 135 21.258 -3.657 -9.830 1.00 1.00 C ATOM 697 CD1 ILE A 135 19.156 -4.544 -7.997 1.00 1.00 C ATOM 0 H ILE A 135 19.394 -0.753 -9.225 1.00 1.00 H new ATOM 0 HA ILE A 135 20.375 -1.906 -11.721 1.00 1.00 H new ATOM 0 HB ILE A 135 19.576 -4.164 -11.017 1.00 1.00 H new ATOM 0 HG12 ILE A 135 18.456 -2.669 -8.751 1.00 1.00 H new ATOM 0 HG13 ILE A 135 17.852 -4.065 -9.623 1.00 1.00 H new ATOM 0 HG21 ILE A 135 21.340 -4.651 -9.389 1.00 1.00 H new ATOM 0 HG22 ILE A 135 21.914 -3.590 -10.698 1.00 1.00 H new ATOM 0 HG23 ILE A 135 21.552 -2.908 -9.094 1.00 1.00 H new ATOM 0 HD11 ILE A 135 18.331 -4.629 -7.290 1.00 1.00 H new ATOM 0 HD12 ILE A 135 19.410 -5.533 -8.379 1.00 1.00 H new ATOM 0 HD13 ILE A 135 20.023 -4.116 -7.494 1.00 1.00 H new ATOM 709 N LYS A 136 17.466 -0.817 -11.126 1.00 1.00 N ATOM 710 CA LYS A 136 16.143 -0.525 -11.740 1.00 1.00 C ATOM 711 C LYS A 136 15.843 0.967 -11.955 1.00 1.00 C ATOM 712 O LYS A 136 15.926 1.442 -13.086 1.00 1.00 O ATOM 713 CB LYS A 136 15.001 -1.202 -10.949 1.00 1.00 C ATOM 714 CG LYS A 136 15.036 -2.734 -11.014 1.00 1.00 C ATOM 715 CD LYS A 136 13.732 -3.325 -10.467 1.00 1.00 C ATOM 716 CE LYS A 136 13.811 -4.859 -10.449 1.00 1.00 C ATOM 717 NZ LYS A 136 12.497 -5.471 -10.099 1.00 1.00 N ATOM 0 H LYS A 136 17.695 -0.205 -10.343 1.00 1.00 H new ATOM 0 HA LYS A 136 16.200 -0.954 -12.740 1.00 1.00 H new ATOM 0 HB2 LYS A 136 15.057 -0.889 -9.906 1.00 1.00 H new ATOM 0 HB3 LYS A 136 14.044 -0.852 -11.336 1.00 1.00 H new ATOM 0 HG2 LYS A 136 15.184 -3.057 -12.045 1.00 1.00 H new ATOM 0 HG3 LYS A 136 15.882 -3.109 -10.438 1.00 1.00 H new ATOM 0 HD2 LYS A 136 13.549 -2.951 -9.460 1.00 1.00 H new ATOM 0 HD3 LYS A 136 12.892 -3.004 -11.083 1.00 1.00 H new ATOM 0 HE2 LYS A 136 14.132 -5.219 -11.426 1.00 1.00 H new ATOM 0 HE3 LYS A 136 14.565 -5.177 -9.729 1.00 1.00 H new ATOM 0 HZ1 LYS A 136 12.653 -6.323 -9.523 1.00 1.00 H new ATOM 0 HZ2 LYS A 136 11.928 -4.787 -9.560 1.00 1.00 H new ATOM 0 HZ3 LYS A 136 11.992 -5.730 -10.970 1.00 1.00 H new ATOM 731 N GLU A 137 15.490 1.705 -10.897 1.00 1.00 N ATOM 732 CA GLU A 137 14.965 3.083 -10.977 1.00 1.00 C ATOM 733 C GLU A 137 15.457 3.973 -9.818 1.00 1.00 C ATOM 734 O GLU A 137 15.930 3.473 -8.798 1.00 1.00 O ATOM 735 CB GLU A 137 13.420 3.045 -10.956 1.00 1.00 C ATOM 736 CG GLU A 137 12.758 2.427 -12.198 1.00 1.00 C ATOM 737 CD GLU A 137 13.022 3.195 -13.514 1.00 1.00 C ATOM 738 OE1 GLU A 137 13.400 4.394 -13.486 1.00 1.00 O ATOM 739 OE2 GLU A 137 12.808 2.609 -14.605 1.00 1.00 O ATOM 0 H GLU A 137 15.561 1.359 -9.940 1.00 1.00 H new ATOM 0 HA GLU A 137 15.334 3.515 -11.907 1.00 1.00 H new ATOM 0 HB2 GLU A 137 13.099 2.485 -10.078 1.00 1.00 H new ATOM 0 HB3 GLU A 137 13.050 4.063 -10.837 1.00 1.00 H new ATOM 0 HG2 GLU A 137 13.114 1.403 -12.312 1.00 1.00 H new ATOM 0 HG3 GLU A 137 11.682 2.374 -12.032 1.00 1.00 H new ATOM 746 N LEU A 138 15.320 5.297 -9.966 1.00 1.00 N ATOM 747 CA LEU A 138 15.812 6.318 -9.026 1.00 1.00 C ATOM 748 C LEU A 138 14.701 7.311 -8.632 1.00 1.00 C ATOM 749 O LEU A 138 13.700 7.463 -9.340 1.00 1.00 O ATOM 750 CB LEU A 138 16.995 7.069 -9.671 1.00 1.00 C ATOM 751 CG LEU A 138 18.256 6.216 -9.907 1.00 1.00 C ATOM 752 CD1 LEU A 138 19.248 6.995 -10.768 1.00 1.00 C ATOM 753 CD2 LEU A 138 18.953 5.843 -8.596 1.00 1.00 C ATOM 0 H LEU A 138 14.846 5.704 -10.773 1.00 1.00 H new ATOM 0 HA LEU A 138 16.140 5.820 -8.114 1.00 1.00 H new ATOM 0 HB2 LEU A 138 16.668 7.479 -10.626 1.00 1.00 H new ATOM 0 HB3 LEU A 138 17.260 7.914 -9.035 1.00 1.00 H new ATOM 0 HG LEU A 138 17.936 5.300 -10.405 1.00 1.00 H new ATOM 0 HD11 LEU A 138 20.139 6.390 -10.934 1.00 1.00 H new ATOM 0 HD12 LEU A 138 18.788 7.234 -11.727 1.00 1.00 H new ATOM 0 HD13 LEU A 138 19.526 7.918 -10.259 1.00 1.00 H new ATOM 0 HD21 LEU A 138 19.836 5.242 -8.812 1.00 1.00 H new ATOM 0 HD22 LEU A 138 19.251 6.751 -8.071 1.00 1.00 H new ATOM 0 HD23 LEU A 138 18.269 5.270 -7.970 1.00 1.00 H new ATOM 765 N GLU A 139 14.894 7.998 -7.500 1.00 1.00 N ATOM 766 CA GLU A 139 13.918 8.895 -6.844 1.00 1.00 C ATOM 767 C GLU A 139 14.576 10.155 -6.247 1.00 1.00 C ATOM 768 O GLU A 139 15.620 10.041 -5.564 1.00 1.00 O ATOM 769 CB GLU A 139 13.156 8.134 -5.739 1.00 1.00 C ATOM 770 CG GLU A 139 12.233 7.019 -6.265 1.00 1.00 C ATOM 771 CD GLU A 139 11.540 6.267 -5.109 1.00 1.00 C ATOM 772 OE1 GLU A 139 10.518 6.760 -4.567 1.00 1.00 O ATOM 773 OE2 GLU A 139 11.998 5.152 -4.746 1.00 1.00 O ATOM 0 H GLU A 139 15.774 7.946 -6.987 1.00 1.00 H new ATOM 0 HA GLU A 139 13.224 9.226 -7.617 1.00 1.00 H new ATOM 0 HB2 GLU A 139 13.878 7.698 -5.049 1.00 1.00 H new ATOM 0 HB3 GLU A 139 12.559 8.845 -5.168 1.00 1.00 H new ATOM 0 HG2 GLU A 139 11.479 7.450 -6.924 1.00 1.00 H new ATOM 0 HG3 GLU A 139 12.814 6.316 -6.862 1.00 1.00 H new TER 780 GLU A 139