USER MOD reduce.3.24.130724 H: found=0, std=0, add=1034, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1037 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 36 ASN : amide:sc= 1.07 K(o=2.3,f=-3.2) USER MOD Set 1.2: A 39 SER OG : rot -170:sc= 1.2 USER MOD Single : A 2 LYS NZ :NH3+ 146:sc= 1.27 (180deg=1.09) USER MOD Single : A 4 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 6 GLN : amide:sc= 0 K(o=0,f=-0.91) USER MOD Single : A 7 SER OG : rot 180:sc= 0.00343 USER MOD Single : A 18 LYS NZ :NH3+ -148:sc= 1.18 (180deg=0.983) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= -0.495 X(o=-0.49,f=-0.044) USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.014 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 42 SER OG : rot 74:sc= 1.06 USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=-0.074) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ -160:sc= 0.0748 (180deg=-0.763) USER MOD Single : A 59 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00113) USER MOD Single : A 61 GLN : amide:sc= 0.71 K(o=0.71,f=-2.2!) USER MOD Single : A 65 GLN : amide:sc= -3.93 K(o=-3.9,f=-1.8!) USER MOD Single : A 69 THR OG1 : rot 161:sc= -1.18 USER MOD Single : A 73 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 75 HIS : no HD1:sc= -1.01 K(o=-1,f=0) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0.00482 USER MOD Single : A 84 SER OG : rot 180:sc= -2.37! USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc= -4.98! C(o=-5!,f=-9.9!) USER MOD Single : A 99 LYS NZ :NH3+ -163:sc= 1.16 (180deg=0.855) USER MOD Single : A 102 SER OG : rot -18:sc= 0.383 USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 TYR OH : rot 180:sc= -0.174 USER MOD Single : A 114 ASN : amide:sc= -2.94 K(o=-2.9,f=-0.044) USER MOD Single : A 116 THR OG1 : rot 180:sc= -0.338 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0.285 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 2 -17.515 -26.659 2.361 1.00 0.00 N ATOM 2 CA LYS A 2 -16.264 -25.982 2.770 1.00 0.00 C ATOM 3 C LYS A 2 -15.126 -26.988 2.925 1.00 0.00 C ATOM 4 O LYS A 2 -14.560 -27.136 4.008 1.00 0.00 O ATOM 5 CB LYS A 2 -16.465 -25.211 4.077 1.00 0.00 C ATOM 6 CG LYS A 2 -17.376 -23.999 3.943 1.00 0.00 C ATOM 7 CD LYS A 2 -17.477 -23.230 5.252 1.00 0.00 C ATOM 8 CE LYS A 2 -16.131 -22.680 5.699 1.00 0.00 C ATOM 9 NZ LYS A 2 -15.579 -21.695 4.731 1.00 0.00 N1+ ATOM 0 HA LYS A 2 -15.997 -25.274 1.985 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -16.881 -25.886 4.825 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -15.494 -24.884 4.448 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -16.995 -23.341 3.162 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -18.370 -24.322 3.632 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -18.183 -22.408 5.135 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -17.876 -23.885 6.027 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -16.239 -22.207 6.675 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -15.426 -23.502 5.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -15.051 -20.961 5.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -14.941 -22.180 4.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -16.358 -21.254 4.202 1.00 0.00 H new ATOM 25 N VAL A 3 -14.794 -27.682 1.844 1.00 0.00 N ATOM 26 CA VAL A 3 -13.682 -28.623 1.862 1.00 0.00 C ATOM 27 C VAL A 3 -12.410 -27.897 1.459 1.00 0.00 C ATOM 28 O VAL A 3 -11.454 -27.807 2.230 1.00 0.00 O ATOM 29 CB VAL A 3 -13.925 -29.814 0.913 1.00 0.00 C ATOM 30 CG1 VAL A 3 -12.762 -30.794 0.973 1.00 0.00 C ATOM 31 CG2 VAL A 3 -15.231 -30.511 1.262 1.00 0.00 C ATOM 0 H VAL A 3 -15.276 -27.612 0.948 1.00 0.00 H new ATOM 0 HA VAL A 3 -13.588 -29.021 2.872 1.00 0.00 H new ATOM 0 HB VAL A 3 -13.998 -29.434 -0.106 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -12.953 -31.627 0.296 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -11.844 -30.288 0.675 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -12.655 -31.170 1.990 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -15.389 -31.349 0.583 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -15.185 -30.878 2.287 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -16.057 -29.806 1.166 1.00 0.00 H new ATOM 41 N GLN A 4 -12.420 -27.351 0.253 1.00 0.00 N ATOM 42 CA GLN A 4 -11.345 -26.488 -0.206 1.00 0.00 C ATOM 43 C GLN A 4 -11.786 -25.044 -0.051 1.00 0.00 C ATOM 44 O GLN A 4 -10.973 -24.122 -0.053 1.00 0.00 O ATOM 45 CB GLN A 4 -10.983 -26.774 -1.661 1.00 0.00 C ATOM 46 CG GLN A 4 -10.495 -28.188 -1.901 1.00 0.00 C ATOM 47 CD GLN A 4 -10.027 -28.394 -3.325 1.00 0.00 C ATOM 48 OE1 GLN A 4 -10.514 -27.743 -4.252 1.00 0.00 O ATOM 49 NE2 GLN A 4 -9.085 -29.302 -3.513 1.00 0.00 N ATOM 0 H GLN A 4 -13.166 -27.492 -0.428 1.00 0.00 H new ATOM 0 HA GLN A 4 -10.455 -26.679 0.394 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -11.857 -26.590 -2.286 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -10.210 -26.074 -1.978 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -9.677 -28.410 -1.215 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -11.298 -28.891 -1.678 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -8.709 -29.819 -2.718 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -8.734 -29.486 -4.453 1.00 0.00 H new ATOM 58 N GLU A 5 -13.096 -24.871 0.094 1.00 0.00 N ATOM 59 CA GLU A 5 -13.697 -23.570 0.352 1.00 0.00 C ATOM 60 C GLU A 5 -13.498 -23.199 1.820 1.00 0.00 C ATOM 61 O GLU A 5 -14.442 -22.840 2.528 1.00 0.00 O ATOM 62 CB GLU A 5 -15.197 -23.585 0.021 1.00 0.00 C ATOM 63 CG GLU A 5 -15.584 -24.502 -1.134 1.00 0.00 C ATOM 64 CD GLU A 5 -15.789 -25.935 -0.686 1.00 0.00 C ATOM 65 OE1 GLU A 5 -16.884 -26.250 -0.179 1.00 0.00 O ATOM 66 OE2 GLU A 5 -14.843 -26.738 -0.793 1.00 0.00 O1- ATOM 0 H GLU A 5 -13.772 -25.633 0.035 1.00 0.00 H new ATOM 0 HA GLU A 5 -13.212 -22.830 -0.285 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -15.749 -23.890 0.910 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -15.513 -22.569 -0.217 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -16.500 -24.134 -1.596 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -14.806 -24.470 -1.897 1.00 0.00 H new ATOM 73 N GLN A 6 -12.260 -23.319 2.262 1.00 0.00 N ATOM 74 CA GLN A 6 -11.879 -23.083 3.639 1.00 0.00 C ATOM 75 C GLN A 6 -10.360 -23.034 3.705 1.00 0.00 C ATOM 76 O GLN A 6 -9.700 -24.048 3.944 1.00 0.00 O ATOM 77 CB GLN A 6 -12.431 -24.191 4.543 1.00 0.00 C ATOM 78 CG GLN A 6 -12.109 -24.003 6.016 1.00 0.00 C ATOM 79 CD GLN A 6 -12.725 -25.081 6.888 1.00 0.00 C ATOM 80 OE1 GLN A 6 -13.851 -24.939 7.365 1.00 0.00 O ATOM 81 NE2 GLN A 6 -12.000 -26.171 7.087 1.00 0.00 N ATOM 0 H GLN A 6 -11.479 -23.588 1.663 1.00 0.00 H new ATOM 0 HA GLN A 6 -12.294 -22.139 3.991 1.00 0.00 H new ATOM 0 HB2 GLN A 6 -13.513 -24.240 4.421 1.00 0.00 H new ATOM 0 HB3 GLN A 6 -12.029 -25.149 4.213 1.00 0.00 H new ATOM 0 HG2 GLN A 6 -11.027 -24.005 6.151 1.00 0.00 H new ATOM 0 HG3 GLN A 6 -12.469 -23.027 6.342 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -11.071 -26.248 6.673 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -12.371 -26.934 7.654 1.00 0.00 H new ATOM 90 N SER A 7 -9.822 -21.854 3.438 1.00 0.00 N ATOM 91 CA SER A 7 -8.381 -21.656 3.334 1.00 0.00 C ATOM 92 C SER A 7 -7.670 -22.006 4.638 1.00 0.00 C ATOM 93 O SER A 7 -7.977 -21.447 5.694 1.00 0.00 O ATOM 94 CB SER A 7 -8.097 -20.201 2.957 1.00 0.00 C ATOM 95 OG SER A 7 -8.922 -19.784 1.876 1.00 0.00 O ATOM 0 H SER A 7 -10.369 -21.007 3.287 1.00 0.00 H new ATOM 0 HA SER A 7 -7.998 -22.323 2.561 1.00 0.00 H new ATOM 0 HB2 SER A 7 -8.269 -19.558 3.820 1.00 0.00 H new ATOM 0 HB3 SER A 7 -7.048 -20.091 2.682 1.00 0.00 H new ATOM 0 HG SER A 7 -8.723 -18.850 1.654 1.00 0.00 H new ATOM 101 N VAL A 8 -6.734 -22.939 4.560 1.00 0.00 N ATOM 102 CA VAL A 8 -5.927 -23.313 5.714 1.00 0.00 C ATOM 103 C VAL A 8 -4.562 -22.639 5.635 1.00 0.00 C ATOM 104 O VAL A 8 -4.248 -21.968 4.648 1.00 0.00 O ATOM 105 CB VAL A 8 -5.739 -24.844 5.825 1.00 0.00 C ATOM 106 CG1 VAL A 8 -7.084 -25.544 5.954 1.00 0.00 C ATOM 107 CG2 VAL A 8 -4.957 -25.392 4.639 1.00 0.00 C ATOM 0 H VAL A 8 -6.513 -23.453 3.707 1.00 0.00 H new ATOM 0 HA VAL A 8 -6.460 -22.978 6.603 1.00 0.00 H new ATOM 0 HB VAL A 8 -5.160 -25.044 6.727 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -6.928 -26.620 6.031 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -7.596 -25.187 6.848 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -7.693 -25.327 5.076 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -4.842 -26.471 4.746 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -5.495 -25.175 3.716 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -3.973 -24.924 4.604 1.00 0.00 H new ATOM 117 N GLY A 9 -3.759 -22.810 6.672 1.00 0.00 N ATOM 118 CA GLY A 9 -2.450 -22.193 6.699 1.00 0.00 C ATOM 119 C GLY A 9 -1.330 -23.205 6.599 1.00 0.00 C ATOM 120 O GLY A 9 -0.733 -23.578 7.611 1.00 0.00 O ATOM 0 H GLY A 9 -3.990 -23.365 7.496 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -2.369 -21.484 5.875 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -2.339 -21.623 7.622 1.00 0.00 H new ATOM 124 N ALA A 10 -1.052 -23.661 5.386 1.00 0.00 N ATOM 125 CA ALA A 10 0.039 -24.593 5.149 1.00 0.00 C ATOM 126 C ALA A 10 1.045 -23.994 4.167 1.00 0.00 C ATOM 127 O ALA A 10 0.952 -24.212 2.958 1.00 0.00 O ATOM 128 CB ALA A 10 -0.505 -25.916 4.629 1.00 0.00 C ATOM 0 H ALA A 10 -1.570 -23.399 4.548 1.00 0.00 H new ATOM 0 HA ALA A 10 0.554 -24.781 6.091 1.00 0.00 H new ATOM 0 HB1 ALA A 10 0.321 -26.606 4.455 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -1.186 -26.344 5.365 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -1.040 -25.747 3.694 1.00 0.00 H new ATOM 134 N PRO A 11 2.004 -23.208 4.677 1.00 0.00 N ATOM 135 CA PRO A 11 3.026 -22.563 3.861 1.00 0.00 C ATOM 136 C PRO A 11 4.209 -23.487 3.579 1.00 0.00 C ATOM 137 O PRO A 11 4.588 -24.296 4.427 1.00 0.00 O ATOM 138 CB PRO A 11 3.479 -21.373 4.728 1.00 0.00 C ATOM 139 CG PRO A 11 2.718 -21.473 6.017 1.00 0.00 C ATOM 140 CD PRO A 11 2.176 -22.870 6.089 1.00 0.00 C ATOM 0 HA PRO A 11 2.642 -22.276 2.882 1.00 0.00 H new ATOM 0 HB2 PRO A 11 4.553 -21.410 4.908 1.00 0.00 H new ATOM 0 HB3 PRO A 11 3.272 -20.427 4.227 1.00 0.00 H new ATOM 0 HG2 PRO A 11 3.368 -21.265 6.867 1.00 0.00 H new ATOM 0 HG3 PRO A 11 1.910 -20.742 6.047 1.00 0.00 H new ATOM 0 HD2 PRO A 11 2.866 -23.549 6.589 1.00 0.00 H new ATOM 0 HD3 PRO A 11 1.234 -22.914 6.636 1.00 0.00 H new ATOM 148 N PRO A 12 4.797 -23.388 2.376 1.00 0.00 N ATOM 149 CA PRO A 12 5.984 -24.164 2.004 1.00 0.00 C ATOM 150 C PRO A 12 7.194 -23.780 2.853 1.00 0.00 C ATOM 151 O PRO A 12 7.675 -22.645 2.788 1.00 0.00 O ATOM 152 CB PRO A 12 6.218 -23.797 0.532 1.00 0.00 C ATOM 153 CG PRO A 12 4.934 -23.192 0.073 1.00 0.00 C ATOM 154 CD PRO A 12 4.346 -22.523 1.279 1.00 0.00 C ATOM 0 HA PRO A 12 5.842 -25.233 2.161 1.00 0.00 H new ATOM 0 HB2 PRO A 12 7.044 -23.094 0.428 1.00 0.00 H new ATOM 0 HB3 PRO A 12 6.472 -24.677 -0.058 1.00 0.00 H new ATOM 0 HG2 PRO A 12 5.104 -22.474 -0.729 1.00 0.00 H new ATOM 0 HG3 PRO A 12 4.260 -23.954 -0.319 1.00 0.00 H new ATOM 0 HD2 PRO A 12 4.708 -21.501 1.393 1.00 0.00 H new ATOM 0 HD3 PRO A 12 3.259 -22.471 1.224 1.00 0.00 H new ATOM 162 N PRO A 13 7.697 -24.722 3.661 1.00 0.00 N ATOM 163 CA PRO A 13 8.806 -24.468 4.587 1.00 0.00 C ATOM 164 C PRO A 13 10.143 -24.262 3.873 1.00 0.00 C ATOM 165 O PRO A 13 10.904 -25.208 3.661 1.00 0.00 O ATOM 166 CB PRO A 13 8.842 -25.729 5.452 1.00 0.00 C ATOM 167 CG PRO A 13 8.252 -26.796 4.593 1.00 0.00 C ATOM 168 CD PRO A 13 7.223 -26.118 3.733 1.00 0.00 C ATOM 0 HA PRO A 13 8.655 -23.549 5.154 1.00 0.00 H new ATOM 0 HB2 PRO A 13 9.861 -25.977 5.747 1.00 0.00 H new ATOM 0 HB3 PRO A 13 8.268 -25.596 6.369 1.00 0.00 H new ATOM 0 HG2 PRO A 13 9.018 -27.272 3.981 1.00 0.00 H new ATOM 0 HG3 PRO A 13 7.798 -27.579 5.201 1.00 0.00 H new ATOM 0 HD2 PRO A 13 7.164 -26.573 2.744 1.00 0.00 H new ATOM 0 HD3 PRO A 13 6.228 -26.181 4.173 1.00 0.00 H new ATOM 176 N GLY A 14 10.410 -23.022 3.486 1.00 0.00 N ATOM 177 CA GLY A 14 11.687 -22.683 2.893 1.00 0.00 C ATOM 178 C GLY A 14 11.791 -23.097 1.435 1.00 0.00 C ATOM 179 O GLY A 14 12.687 -23.860 1.059 1.00 0.00 O ATOM 0 H GLY A 14 9.760 -22.241 3.573 1.00 0.00 H new ATOM 0 HA2 GLY A 14 11.844 -21.607 2.972 1.00 0.00 H new ATOM 0 HA3 GLY A 14 12.484 -23.164 3.460 1.00 0.00 H new ATOM 183 N ARG A 15 10.879 -22.603 0.610 1.00 0.00 N ATOM 184 CA ARG A 15 10.923 -22.882 -0.819 1.00 0.00 C ATOM 185 C ARG A 15 11.647 -21.759 -1.545 1.00 0.00 C ATOM 186 O ARG A 15 11.049 -20.729 -1.863 1.00 0.00 O ATOM 187 CB ARG A 15 9.513 -23.044 -1.390 1.00 0.00 C ATOM 188 CG ARG A 15 9.496 -23.515 -2.838 1.00 0.00 C ATOM 189 CD ARG A 15 10.153 -24.879 -2.984 1.00 0.00 C ATOM 190 NE ARG A 15 9.461 -25.897 -2.194 1.00 0.00 N ATOM 191 CZ ARG A 15 10.069 -26.748 -1.369 1.00 0.00 C ATOM 192 NH1 ARG A 15 11.392 -26.708 -1.216 1.00 0.00 N1+ ATOM 193 NH2 ARG A 15 9.349 -27.629 -0.685 1.00 0.00 N ATOM 0 H ARG A 15 10.103 -22.010 0.903 1.00 0.00 H new ATOM 0 HA ARG A 15 11.463 -23.817 -0.967 1.00 0.00 H new ATOM 0 HB2 ARG A 15 8.961 -23.757 -0.778 1.00 0.00 H new ATOM 0 HB3 ARG A 15 8.989 -22.091 -1.320 1.00 0.00 H new ATOM 0 HG2 ARG A 15 8.467 -23.565 -3.194 1.00 0.00 H new ATOM 0 HG3 ARG A 15 10.016 -22.790 -3.464 1.00 0.00 H new ATOM 0 HD2 ARG A 15 10.155 -25.172 -4.034 1.00 0.00 H new ATOM 0 HD3 ARG A 15 11.194 -24.818 -2.668 1.00 0.00 H new ATOM 0 HE ARG A 15 8.447 -25.959 -2.280 1.00 0.00 H new ATOM 0 HH11 ARG A 15 11.945 -26.023 -1.732 1.00 0.00 H new ATOM 0 HH12 ARG A 15 11.852 -27.362 -0.583 1.00 0.00 H new ATOM 0 HH21 ARG A 15 8.335 -27.652 -0.792 1.00 0.00 H new ATOM 0 HH22 ARG A 15 9.810 -28.283 -0.052 1.00 0.00 H new ATOM 207 N ALA A 16 12.934 -21.954 -1.788 1.00 0.00 N ATOM 208 CA ALA A 16 13.740 -20.964 -2.484 1.00 0.00 C ATOM 209 C ALA A 16 14.996 -21.591 -3.068 1.00 0.00 C ATOM 210 O ALA A 16 15.439 -22.656 -2.627 1.00 0.00 O ATOM 211 CB ALA A 16 14.119 -19.830 -1.543 1.00 0.00 C ATOM 0 H ALA A 16 13.444 -22.793 -1.512 1.00 0.00 H new ATOM 0 HA ALA A 16 13.142 -20.564 -3.303 1.00 0.00 H new ATOM 0 HB1 ALA A 16 14.722 -19.098 -2.080 1.00 0.00 H new ATOM 0 HB2 ALA A 16 13.215 -19.351 -1.168 1.00 0.00 H new ATOM 0 HB3 ALA A 16 14.692 -20.228 -0.706 1.00 0.00 H new ATOM 217 N ASP A 17 15.545 -20.929 -4.073 1.00 0.00 N ATOM 218 CA ASP A 17 16.812 -21.325 -4.674 1.00 0.00 C ATOM 219 C ASP A 17 17.471 -20.105 -5.283 1.00 0.00 C ATOM 220 O ASP A 17 18.587 -19.732 -4.923 1.00 0.00 O ATOM 221 CB ASP A 17 16.604 -22.385 -5.755 1.00 0.00 C ATOM 222 CG ASP A 17 17.914 -22.908 -6.303 1.00 0.00 C ATOM 223 OD1 ASP A 17 18.503 -23.820 -5.678 1.00 0.00 O ATOM 224 OD2 ASP A 17 18.362 -22.416 -7.358 1.00 0.00 O1- ATOM 0 H ASP A 17 15.126 -20.101 -4.497 1.00 0.00 H new ATOM 0 HA ASP A 17 17.447 -21.752 -3.898 1.00 0.00 H new ATOM 0 HB2 ASP A 17 16.028 -23.214 -5.343 1.00 0.00 H new ATOM 0 HB3 ASP A 17 16.015 -21.961 -6.569 1.00 0.00 H new ATOM 229 N LYS A 18 16.761 -19.490 -6.213 1.00 0.00 N ATOM 230 CA LYS A 18 17.175 -18.233 -6.808 1.00 0.00 C ATOM 231 C LYS A 18 16.221 -17.145 -6.335 1.00 0.00 C ATOM 232 O LYS A 18 15.079 -17.059 -6.787 1.00 0.00 O ATOM 233 CB LYS A 18 17.146 -18.342 -8.334 1.00 0.00 C ATOM 234 CG LYS A 18 17.965 -19.500 -8.903 1.00 0.00 C ATOM 235 CD LYS A 18 19.454 -19.182 -8.986 1.00 0.00 C ATOM 236 CE LYS A 18 20.173 -19.339 -7.654 1.00 0.00 C ATOM 237 NZ LYS A 18 20.399 -20.771 -7.316 1.00 0.00 N1+ ATOM 0 H LYS A 18 15.879 -19.850 -6.577 1.00 0.00 H new ATOM 0 HA LYS A 18 18.193 -17.989 -6.505 1.00 0.00 H new ATOM 0 HB2 LYS A 18 16.111 -18.452 -8.658 1.00 0.00 H new ATOM 0 HB3 LYS A 18 17.516 -17.409 -8.759 1.00 0.00 H new ATOM 0 HG2 LYS A 18 17.820 -20.383 -8.280 1.00 0.00 H new ATOM 0 HG3 LYS A 18 17.594 -19.748 -9.898 1.00 0.00 H new ATOM 0 HD2 LYS A 18 19.919 -19.837 -9.723 1.00 0.00 H new ATOM 0 HD3 LYS A 18 19.582 -18.160 -9.343 1.00 0.00 H new ATOM 0 HE2 LYS A 18 21.130 -18.819 -7.694 1.00 0.00 H new ATOM 0 HE3 LYS A 18 19.586 -18.867 -6.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 20.366 -20.893 -6.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 19.658 -21.353 -7.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 21.330 -21.069 -7.671 1.00 0.00 H new ATOM 251 N THR A 19 16.690 -16.333 -5.401 1.00 0.00 N ATOM 252 CA THR A 19 15.852 -15.333 -4.764 1.00 0.00 C ATOM 253 C THR A 19 15.415 -14.250 -5.747 1.00 0.00 C ATOM 254 O THR A 19 14.238 -14.148 -6.082 1.00 0.00 O ATOM 255 CB THR A 19 16.583 -14.687 -3.575 1.00 0.00 C ATOM 256 OG1 THR A 19 17.174 -15.710 -2.760 1.00 0.00 O ATOM 257 CG2 THR A 19 15.626 -13.857 -2.733 1.00 0.00 C ATOM 0 H THR A 19 17.653 -16.349 -5.066 1.00 0.00 H new ATOM 0 HA THR A 19 14.960 -15.846 -4.404 1.00 0.00 H new ATOM 0 HB THR A 19 17.359 -14.029 -3.965 1.00 0.00 H new ATOM 0 HG1 THR A 19 17.641 -15.297 -2.004 1.00 0.00 H new ATOM 0 HG21 THR A 19 16.168 -13.411 -1.899 1.00 0.00 H new ATOM 0 HG22 THR A 19 15.192 -13.068 -3.347 1.00 0.00 H new ATOM 0 HG23 THR A 19 14.831 -14.496 -2.349 1.00 0.00 H new ATOM 265 N ALA A 20 16.363 -13.464 -6.226 1.00 0.00 N ATOM 266 CA ALA A 20 16.048 -12.336 -7.087 1.00 0.00 C ATOM 267 C ALA A 20 16.343 -12.651 -8.549 1.00 0.00 C ATOM 268 O ALA A 20 17.147 -11.977 -9.189 1.00 0.00 O ATOM 269 CB ALA A 20 16.818 -11.103 -6.639 1.00 0.00 C ATOM 0 H ALA A 20 17.357 -13.585 -6.034 1.00 0.00 H new ATOM 0 HA ALA A 20 14.980 -12.135 -7.003 1.00 0.00 H new ATOM 0 HB1 ALA A 20 16.574 -10.265 -7.291 1.00 0.00 H new ATOM 0 HB2 ALA A 20 16.545 -10.856 -5.613 1.00 0.00 H new ATOM 0 HB3 ALA A 20 17.888 -11.304 -6.691 1.00 0.00 H new ATOM 275 N ALA A 21 15.697 -13.685 -9.068 1.00 0.00 N ATOM 276 CA ALA A 21 15.821 -14.021 -10.481 1.00 0.00 C ATOM 277 C ALA A 21 14.456 -14.398 -11.074 1.00 0.00 C ATOM 278 O ALA A 21 13.964 -13.698 -11.954 1.00 0.00 O ATOM 279 CB ALA A 21 16.867 -15.111 -10.706 1.00 0.00 C ATOM 0 H ALA A 21 15.085 -14.304 -8.536 1.00 0.00 H new ATOM 0 HA ALA A 21 16.173 -13.136 -11.011 1.00 0.00 H new ATOM 0 HB1 ALA A 21 16.934 -15.337 -11.770 1.00 0.00 H new ATOM 0 HB2 ALA A 21 17.836 -14.765 -10.347 1.00 0.00 H new ATOM 0 HB3 ALA A 21 16.579 -16.010 -10.161 1.00 0.00 H new ATOM 285 N PRO A 22 13.806 -15.497 -10.609 1.00 0.00 N ATOM 286 CA PRO A 22 12.467 -15.863 -11.067 1.00 0.00 C ATOM 287 C PRO A 22 11.380 -15.162 -10.254 1.00 0.00 C ATOM 288 O PRO A 22 10.277 -14.917 -10.746 1.00 0.00 O ATOM 289 CB PRO A 22 12.407 -17.387 -10.840 1.00 0.00 C ATOM 290 CG PRO A 22 13.694 -17.763 -10.169 1.00 0.00 C ATOM 291 CD PRO A 22 14.300 -16.488 -9.651 1.00 0.00 C ATOM 0 HA PRO A 22 12.294 -15.572 -12.103 1.00 0.00 H new ATOM 0 HB2 PRO A 22 11.552 -17.654 -10.219 1.00 0.00 H new ATOM 0 HB3 PRO A 22 12.292 -17.917 -11.786 1.00 0.00 H new ATOM 0 HG2 PRO A 22 13.515 -18.465 -9.355 1.00 0.00 H new ATOM 0 HG3 PRO A 22 14.367 -18.254 -10.871 1.00 0.00 H new ATOM 0 HD2 PRO A 22 13.976 -16.267 -8.634 1.00 0.00 H new ATOM 0 HD3 PRO A 22 15.389 -16.532 -9.636 1.00 0.00 H new ATOM 299 N GLN A 23 11.703 -14.849 -9.004 1.00 0.00 N ATOM 300 CA GLN A 23 10.773 -14.177 -8.111 1.00 0.00 C ATOM 301 C GLN A 23 10.808 -12.668 -8.342 1.00 0.00 C ATOM 302 O GLN A 23 10.840 -12.217 -9.486 1.00 0.00 O ATOM 303 CB GLN A 23 11.117 -14.496 -6.656 1.00 0.00 C ATOM 304 CG GLN A 23 10.973 -15.965 -6.295 1.00 0.00 C ATOM 305 CD GLN A 23 11.291 -16.232 -4.837 1.00 0.00 C ATOM 306 OE1 GLN A 23 10.411 -16.181 -3.980 1.00 0.00 O ATOM 307 NE2 GLN A 23 12.551 -16.516 -4.545 1.00 0.00 N ATOM 0 H GLN A 23 12.611 -15.053 -8.586 1.00 0.00 H new ATOM 0 HA GLN A 23 9.766 -14.537 -8.322 1.00 0.00 H new ATOM 0 HB2 GLN A 23 12.142 -14.183 -6.459 1.00 0.00 H new ATOM 0 HB3 GLN A 23 10.472 -13.907 -6.003 1.00 0.00 H new ATOM 0 HG2 GLN A 23 9.955 -16.291 -6.508 1.00 0.00 H new ATOM 0 HG3 GLN A 23 11.637 -16.558 -6.924 1.00 0.00 H new ATOM 0 HE21 GLN A 23 13.251 -16.548 -5.286 1.00 0.00 H new ATOM 0 HE22 GLN A 23 12.821 -16.702 -3.579 1.00 0.00 H new ATOM 316 N THR A 24 10.765 -11.899 -7.252 1.00 0.00 N ATOM 317 CA THR A 24 10.799 -10.436 -7.312 1.00 0.00 C ATOM 318 C THR A 24 9.457 -9.871 -7.795 1.00 0.00 C ATOM 319 O THR A 24 9.038 -8.788 -7.376 1.00 0.00 O ATOM 320 CB THR A 24 11.947 -9.930 -8.221 1.00 0.00 C ATOM 321 OG1 THR A 24 13.178 -10.577 -7.860 1.00 0.00 O ATOM 322 CG2 THR A 24 12.120 -8.422 -8.101 1.00 0.00 C ATOM 0 H THR A 24 10.706 -12.272 -6.304 1.00 0.00 H new ATOM 0 HA THR A 24 10.984 -10.078 -6.299 1.00 0.00 H new ATOM 0 HB THR A 24 11.689 -10.170 -9.252 1.00 0.00 H new ATOM 0 HG1 THR A 24 13.899 -10.254 -8.439 1.00 0.00 H new ATOM 0 HG21 THR A 24 12.933 -8.096 -8.750 1.00 0.00 H new ATOM 0 HG22 THR A 24 11.197 -7.925 -8.398 1.00 0.00 H new ATOM 0 HG23 THR A 24 12.355 -8.164 -7.068 1.00 0.00 H new ATOM 330 N ARG A 25 8.780 -10.626 -8.656 1.00 0.00 N ATOM 331 CA ARG A 25 7.470 -10.250 -9.183 1.00 0.00 C ATOM 332 C ARG A 25 6.462 -10.019 -8.053 1.00 0.00 C ATOM 333 O ARG A 25 5.579 -9.171 -8.164 1.00 0.00 O ATOM 334 CB ARG A 25 6.967 -11.338 -10.139 1.00 0.00 C ATOM 335 CG ARG A 25 6.741 -12.690 -9.477 1.00 0.00 C ATOM 336 CD ARG A 25 6.532 -13.790 -10.504 1.00 0.00 C ATOM 337 NE ARG A 25 6.067 -15.032 -9.884 1.00 0.00 N ATOM 338 CZ ARG A 25 6.715 -16.198 -9.951 1.00 0.00 C ATOM 339 NH1 ARG A 25 7.899 -16.274 -10.544 1.00 0.00 N1+ ATOM 340 NH2 ARG A 25 6.192 -17.287 -9.400 1.00 0.00 N ATOM 0 H ARG A 25 9.125 -11.519 -9.009 1.00 0.00 H new ATOM 0 HA ARG A 25 7.573 -9.312 -9.729 1.00 0.00 H new ATOM 0 HB2 ARG A 25 6.032 -11.006 -10.591 1.00 0.00 H new ATOM 0 HB3 ARG A 25 7.688 -11.457 -10.948 1.00 0.00 H new ATOM 0 HG2 ARG A 25 7.598 -12.936 -8.850 1.00 0.00 H new ATOM 0 HG3 ARG A 25 5.872 -12.634 -8.822 1.00 0.00 H new ATOM 0 HD2 ARG A 25 5.805 -13.460 -11.247 1.00 0.00 H new ATOM 0 HD3 ARG A 25 7.467 -13.976 -11.033 1.00 0.00 H new ATOM 0 HE ARG A 25 5.189 -15.005 -9.366 1.00 0.00 H new ATOM 0 HH11 ARG A 25 8.320 -15.439 -10.952 1.00 0.00 H new ATOM 0 HH12 ARG A 25 8.389 -17.167 -10.592 1.00 0.00 H new ATOM 0 HH21 ARG A 25 5.292 -17.235 -8.923 1.00 0.00 H new ATOM 0 HH22 ARG A 25 6.690 -18.175 -9.454 1.00 0.00 H new ATOM 354 N LEU A 26 6.602 -10.773 -6.968 1.00 0.00 N ATOM 355 CA LEU A 26 5.748 -10.595 -5.799 1.00 0.00 C ATOM 356 C LEU A 26 6.586 -10.191 -4.593 1.00 0.00 C ATOM 357 O LEU A 26 6.213 -10.437 -3.446 1.00 0.00 O ATOM 358 CB LEU A 26 4.971 -11.878 -5.485 1.00 0.00 C ATOM 359 CG LEU A 26 3.957 -12.312 -6.547 1.00 0.00 C ATOM 360 CD1 LEU A 26 3.253 -13.587 -6.115 1.00 0.00 C ATOM 361 CD2 LEU A 26 2.941 -11.208 -6.802 1.00 0.00 C ATOM 0 H LEU A 26 7.298 -11.513 -6.874 1.00 0.00 H new ATOM 0 HA LEU A 26 5.032 -9.804 -6.021 1.00 0.00 H new ATOM 0 HB2 LEU A 26 5.686 -12.688 -5.338 1.00 0.00 H new ATOM 0 HB3 LEU A 26 4.445 -11.741 -4.540 1.00 0.00 H new ATOM 0 HG LEU A 26 4.494 -12.506 -7.475 1.00 0.00 H new ATOM 0 HD11 LEU A 26 2.535 -13.883 -6.880 1.00 0.00 H new ATOM 0 HD12 LEU A 26 3.988 -14.381 -5.980 1.00 0.00 H new ATOM 0 HD13 LEU A 26 2.730 -13.413 -5.175 1.00 0.00 H new ATOM 0 HD21 LEU A 26 2.229 -11.536 -7.560 1.00 0.00 H new ATOM 0 HD22 LEU A 26 2.409 -10.983 -5.878 1.00 0.00 H new ATOM 0 HD23 LEU A 26 3.456 -10.313 -7.151 1.00 0.00 H new ATOM 373 N THR A 27 7.722 -9.571 -4.861 1.00 0.00 N ATOM 374 CA THR A 27 8.623 -9.148 -3.813 1.00 0.00 C ATOM 375 C THR A 27 8.994 -7.674 -3.995 1.00 0.00 C ATOM 376 O THR A 27 10.063 -7.354 -4.513 1.00 0.00 O ATOM 377 CB THR A 27 9.898 -10.015 -3.821 1.00 0.00 C ATOM 378 OG1 THR A 27 9.548 -11.409 -3.841 1.00 0.00 O ATOM 379 CG2 THR A 27 10.755 -9.720 -2.604 1.00 0.00 C ATOM 0 H THR A 27 8.041 -9.350 -5.804 1.00 0.00 H new ATOM 0 HA THR A 27 8.119 -9.270 -2.854 1.00 0.00 H new ATOM 0 HB THR A 27 10.469 -9.774 -4.717 1.00 0.00 H new ATOM 0 HG1 THR A 27 10.364 -11.951 -3.848 1.00 0.00 H new ATOM 0 HG21 THR A 27 11.649 -10.342 -2.629 1.00 0.00 H new ATOM 0 HG22 THR A 27 11.044 -8.669 -2.609 1.00 0.00 H new ATOM 0 HG23 THR A 27 10.188 -9.936 -1.699 1.00 0.00 H new ATOM 387 N PRO A 28 8.093 -6.760 -3.597 1.00 0.00 N ATOM 388 CA PRO A 28 8.321 -5.320 -3.709 1.00 0.00 C ATOM 389 C PRO A 28 9.277 -4.815 -2.635 1.00 0.00 C ATOM 390 O PRO A 28 8.886 -4.617 -1.479 1.00 0.00 O ATOM 391 CB PRO A 28 6.922 -4.704 -3.521 1.00 0.00 C ATOM 392 CG PRO A 28 5.971 -5.857 -3.435 1.00 0.00 C ATOM 393 CD PRO A 28 6.783 -7.044 -3.006 1.00 0.00 C ATOM 0 HA PRO A 28 8.781 -5.053 -4.660 1.00 0.00 H new ATOM 0 HB2 PRO A 28 6.882 -4.097 -2.617 1.00 0.00 H new ATOM 0 HB3 PRO A 28 6.668 -4.050 -4.356 1.00 0.00 H new ATOM 0 HG2 PRO A 28 5.175 -5.652 -2.719 1.00 0.00 H new ATOM 0 HG3 PRO A 28 5.494 -6.040 -4.398 1.00 0.00 H new ATOM 0 HD2 PRO A 28 6.837 -7.128 -1.921 1.00 0.00 H new ATOM 0 HD3 PRO A 28 6.364 -7.979 -3.378 1.00 0.00 H new ATOM 401 N TYR A 29 10.530 -4.617 -3.013 1.00 0.00 N ATOM 402 CA TYR A 29 11.540 -4.148 -2.078 1.00 0.00 C ATOM 403 C TYR A 29 11.421 -2.638 -1.878 1.00 0.00 C ATOM 404 O TYR A 29 12.107 -1.853 -2.533 1.00 0.00 O ATOM 405 CB TYR A 29 12.941 -4.525 -2.578 1.00 0.00 C ATOM 406 CG TYR A 29 14.060 -4.098 -1.653 1.00 0.00 C ATOM 407 CD1 TYR A 29 14.074 -4.486 -0.319 1.00 0.00 C ATOM 408 CD2 TYR A 29 15.102 -3.306 -2.117 1.00 0.00 C ATOM 409 CE1 TYR A 29 15.097 -4.095 0.526 1.00 0.00 C ATOM 410 CE2 TYR A 29 16.125 -2.914 -1.279 1.00 0.00 C ATOM 411 CZ TYR A 29 16.119 -3.310 0.039 1.00 0.00 C ATOM 412 OH TYR A 29 17.143 -2.917 0.872 1.00 0.00 O ATOM 0 H TYR A 29 10.872 -4.774 -3.961 1.00 0.00 H new ATOM 0 HA TYR A 29 11.378 -4.631 -1.114 1.00 0.00 H new ATOM 0 HB2 TYR A 29 12.988 -5.605 -2.714 1.00 0.00 H new ATOM 0 HB3 TYR A 29 13.100 -4.073 -3.557 1.00 0.00 H new ATOM 0 HD1 TYR A 29 13.274 -5.102 0.064 1.00 0.00 H new ATOM 0 HD2 TYR A 29 15.112 -2.992 -3.150 1.00 0.00 H new ATOM 0 HE1 TYR A 29 15.095 -4.403 1.561 1.00 0.00 H new ATOM 0 HE2 TYR A 29 16.928 -2.298 -1.656 1.00 0.00 H new ATOM 0 HH TYR A 29 17.781 -2.369 0.370 1.00 0.00 H new ATOM 422 N ALA A 30 10.520 -2.244 -0.988 1.00 0.00 N ATOM 423 CA ALA A 30 10.323 -0.837 -0.670 1.00 0.00 C ATOM 424 C ALA A 30 10.156 -0.635 0.831 1.00 0.00 C ATOM 425 O ALA A 30 10.639 0.351 1.385 1.00 0.00 O ATOM 426 CB ALA A 30 9.118 -0.286 -1.420 1.00 0.00 C ATOM 0 H ALA A 30 9.913 -2.881 -0.473 1.00 0.00 H new ATOM 0 HA ALA A 30 11.211 -0.290 -0.988 1.00 0.00 H new ATOM 0 HB1 ALA A 30 8.985 0.767 -1.171 1.00 0.00 H new ATOM 0 HB2 ALA A 30 9.280 -0.387 -2.493 1.00 0.00 H new ATOM 0 HB3 ALA A 30 8.226 -0.842 -1.133 1.00 0.00 H new ATOM 432 N GLN A 31 9.475 -1.589 1.472 1.00 0.00 N ATOM 433 CA GLN A 31 9.240 -1.571 2.918 1.00 0.00 C ATOM 434 C GLN A 31 8.450 -0.327 3.333 1.00 0.00 C ATOM 435 O GLN A 31 7.219 -0.354 3.315 1.00 0.00 O ATOM 436 CB GLN A 31 10.568 -1.662 3.686 1.00 0.00 C ATOM 437 CG GLN A 31 10.405 -1.764 5.197 1.00 0.00 C ATOM 438 CD GLN A 31 11.735 -1.823 5.922 1.00 0.00 C ATOM 439 OE1 GLN A 31 12.724 -2.339 5.402 1.00 0.00 O ATOM 440 NE2 GLN A 31 11.769 -1.291 7.132 1.00 0.00 N ATOM 0 H GLN A 31 9.070 -2.398 1.001 1.00 0.00 H new ATOM 0 HA GLN A 31 8.640 -2.445 3.173 1.00 0.00 H new ATOM 0 HB2 GLN A 31 11.122 -2.531 3.331 1.00 0.00 H new ATOM 0 HB3 GLN A 31 11.171 -0.784 3.454 1.00 0.00 H new ATOM 0 HG2 GLN A 31 9.837 -0.906 5.557 1.00 0.00 H new ATOM 0 HG3 GLN A 31 9.824 -2.655 5.437 1.00 0.00 H new ATOM 0 HE21 GLN A 31 10.928 -0.872 7.529 1.00 0.00 H new ATOM 0 HE22 GLN A 31 12.636 -1.299 7.669 1.00 0.00 H new ATOM 449 N ALA A 32 9.154 0.745 3.709 1.00 0.00 N ATOM 450 CA ALA A 32 8.533 2.018 4.092 1.00 0.00 C ATOM 451 C ALA A 32 7.590 1.882 5.295 1.00 0.00 C ATOM 452 O ALA A 32 6.821 2.799 5.595 1.00 0.00 O ATOM 453 CB ALA A 32 7.798 2.627 2.905 1.00 0.00 C ATOM 0 H ALA A 32 10.173 0.755 3.757 1.00 0.00 H new ATOM 0 HA ALA A 32 9.339 2.684 4.399 1.00 0.00 H new ATOM 0 HB1 ALA A 32 7.342 3.571 3.204 1.00 0.00 H new ATOM 0 HB2 ALA A 32 8.503 2.806 2.093 1.00 0.00 H new ATOM 0 HB3 ALA A 32 7.022 1.941 2.567 1.00 0.00 H new ATOM 459 N GLY A 33 7.661 0.752 5.988 1.00 0.00 N ATOM 460 CA GLY A 33 6.831 0.544 7.160 1.00 0.00 C ATOM 461 C GLY A 33 5.485 -0.069 6.820 1.00 0.00 C ATOM 462 O GLY A 33 4.628 0.584 6.230 1.00 0.00 O ATOM 0 H GLY A 33 8.280 -0.026 5.759 1.00 0.00 H new ATOM 0 HA2 GLY A 33 7.355 -0.105 7.861 1.00 0.00 H new ATOM 0 HA3 GLY A 33 6.675 1.498 7.664 1.00 0.00 H new ATOM 466 N GLU A 34 5.300 -1.322 7.205 1.00 0.00 N ATOM 467 CA GLU A 34 4.057 -2.045 6.943 1.00 0.00 C ATOM 468 C GLU A 34 3.012 -1.731 8.018 1.00 0.00 C ATOM 469 O GLU A 34 1.847 -2.123 7.916 1.00 0.00 O ATOM 470 CB GLU A 34 4.348 -3.552 6.928 1.00 0.00 C ATOM 471 CG GLU A 34 3.162 -4.420 6.540 1.00 0.00 C ATOM 472 CD GLU A 34 3.395 -5.885 6.841 1.00 0.00 C ATOM 473 OE1 GLU A 34 4.208 -6.522 6.140 1.00 0.00 O1- ATOM 474 OE2 GLU A 34 2.773 -6.410 7.790 1.00 0.00 O ATOM 0 H GLU A 34 6.001 -1.868 7.706 1.00 0.00 H new ATOM 0 HA GLU A 34 3.660 -1.732 5.977 1.00 0.00 H new ATOM 0 HB2 GLU A 34 5.165 -3.744 6.233 1.00 0.00 H new ATOM 0 HB3 GLU A 34 4.693 -3.852 7.917 1.00 0.00 H new ATOM 0 HG2 GLU A 34 2.275 -4.079 7.075 1.00 0.00 H new ATOM 0 HG3 GLU A 34 2.959 -4.298 5.476 1.00 0.00 H new ATOM 481 N ASP A 35 3.443 -1.004 9.033 1.00 0.00 N ATOM 482 CA ASP A 35 2.651 -0.810 10.242 1.00 0.00 C ATOM 483 C ASP A 35 1.657 0.356 10.146 1.00 0.00 C ATOM 484 O ASP A 35 0.618 0.252 9.491 1.00 0.00 O ATOM 485 CB ASP A 35 3.581 -0.627 11.450 1.00 0.00 C ATOM 486 CG ASP A 35 4.733 0.321 11.166 1.00 0.00 C ATOM 487 OD1 ASP A 35 4.562 1.545 11.346 1.00 0.00 O1- ATOM 488 OD2 ASP A 35 5.810 -0.154 10.755 1.00 0.00 O ATOM 0 H ASP A 35 4.347 -0.532 9.046 1.00 0.00 H new ATOM 0 HA ASP A 35 2.047 -1.708 10.368 1.00 0.00 H new ATOM 0 HB2 ASP A 35 3.004 -0.248 12.293 1.00 0.00 H new ATOM 0 HB3 ASP A 35 3.979 -1.597 11.747 1.00 0.00 H new ATOM 493 N ASN A 36 1.990 1.474 10.782 1.00 0.00 N ATOM 494 CA ASN A 36 1.040 2.554 11.010 1.00 0.00 C ATOM 495 C ASN A 36 1.018 3.542 9.848 1.00 0.00 C ATOM 496 O ASN A 36 1.516 4.662 9.956 1.00 0.00 O ATOM 497 CB ASN A 36 1.390 3.277 12.314 1.00 0.00 C ATOM 498 CG ASN A 36 0.308 4.236 12.778 1.00 0.00 C ATOM 499 OD1 ASN A 36 -0.880 4.010 12.557 1.00 0.00 O ATOM 500 ND2 ASN A 36 0.715 5.312 13.433 1.00 0.00 N ATOM 0 H ASN A 36 2.923 1.656 11.152 1.00 0.00 H new ATOM 0 HA ASN A 36 0.044 2.119 11.087 1.00 0.00 H new ATOM 0 HB2 ASN A 36 1.569 2.538 13.094 1.00 0.00 H new ATOM 0 HB3 ASN A 36 2.320 3.828 12.177 1.00 0.00 H new ATOM 0 HD21 ASN A 36 0.033 5.989 13.774 1.00 0.00 H new ATOM 0 HD22 ASN A 36 1.710 5.464 13.596 1.00 0.00 H new ATOM 507 N TRP A 37 0.455 3.119 8.729 1.00 0.00 N ATOM 508 CA TRP A 37 0.265 4.015 7.594 1.00 0.00 C ATOM 509 C TRP A 37 -1.137 3.879 7.007 1.00 0.00 C ATOM 510 O TRP A 37 -1.661 4.819 6.411 1.00 0.00 O ATOM 511 CB TRP A 37 1.336 3.794 6.509 1.00 0.00 C ATOM 512 CG TRP A 37 1.427 2.396 5.952 1.00 0.00 C ATOM 513 CD1 TRP A 37 1.011 1.230 6.534 1.00 0.00 C ATOM 514 CD2 TRP A 37 2.009 2.028 4.699 1.00 0.00 C ATOM 515 NE1 TRP A 37 1.287 0.166 5.713 1.00 0.00 N ATOM 516 CE2 TRP A 37 1.903 0.630 4.580 1.00 0.00 C ATOM 517 CE3 TRP A 37 2.606 2.748 3.659 1.00 0.00 C ATOM 518 CZ2 TRP A 37 2.375 -0.060 3.467 1.00 0.00 C ATOM 519 CZ3 TRP A 37 3.077 2.062 2.557 1.00 0.00 C ATOM 520 CH2 TRP A 37 2.955 0.672 2.467 1.00 0.00 C ATOM 0 H TRP A 37 0.122 2.167 8.579 1.00 0.00 H new ATOM 0 HA TRP A 37 0.377 5.033 7.968 1.00 0.00 H new ATOM 0 HB2 TRP A 37 1.139 4.481 5.686 1.00 0.00 H new ATOM 0 HB3 TRP A 37 2.307 4.064 6.924 1.00 0.00 H new ATOM 0 HD1 TRP A 37 0.534 1.157 7.500 1.00 0.00 H new ATOM 0 HE1 TRP A 37 1.069 -0.810 5.913 1.00 0.00 H new ATOM 0 HE3 TRP A 37 2.697 3.823 3.717 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 2.287 -1.134 3.395 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 3.547 2.608 1.752 1.00 0.00 H new ATOM 0 HH2 TRP A 37 3.327 0.165 1.589 1.00 0.00 H new ATOM 531 N ARG A 38 -1.759 2.719 7.208 1.00 0.00 N ATOM 532 CA ARG A 38 -3.096 2.468 6.674 1.00 0.00 C ATOM 533 C ARG A 38 -4.117 3.331 7.395 1.00 0.00 C ATOM 534 O ARG A 38 -5.131 3.726 6.821 1.00 0.00 O ATOM 535 CB ARG A 38 -3.485 0.990 6.797 1.00 0.00 C ATOM 536 CG ARG A 38 -3.520 0.472 8.228 1.00 0.00 C ATOM 537 CD ARG A 38 -4.248 -0.861 8.326 1.00 0.00 C ATOM 538 NE ARG A 38 -3.552 -1.938 7.621 1.00 0.00 N ATOM 539 CZ ARG A 38 -4.164 -2.997 7.083 1.00 0.00 C ATOM 540 NH1 ARG A 38 -5.493 -3.071 7.078 1.00 0.00 N1+ ATOM 541 NH2 ARG A 38 -3.443 -3.964 6.526 1.00 0.00 N ATOM 0 H ARG A 38 -1.361 1.941 7.734 1.00 0.00 H new ATOM 0 HA ARG A 38 -3.083 2.726 5.615 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -4.467 0.845 6.346 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -2.779 0.391 6.223 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -2.501 0.359 8.599 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -4.013 1.204 8.868 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -4.360 -1.133 9.376 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -5.252 -0.753 7.916 1.00 0.00 H new ATOM 0 HE ARG A 38 -2.537 -1.877 7.535 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -6.047 -2.318 7.486 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -5.957 -3.881 6.667 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -2.425 -3.897 6.510 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -3.907 -4.774 6.114 1.00 0.00 H new ATOM 555 N SER A 39 -3.831 3.615 8.655 1.00 0.00 N ATOM 556 CA SER A 39 -4.664 4.483 9.466 1.00 0.00 C ATOM 557 C SER A 39 -4.700 5.881 8.867 1.00 0.00 C ATOM 558 O SER A 39 -5.746 6.533 8.823 1.00 0.00 O ATOM 559 CB SER A 39 -4.093 4.531 10.880 1.00 0.00 C ATOM 560 OG SER A 39 -2.696 4.776 10.833 1.00 0.00 O ATOM 0 H SER A 39 -3.014 3.249 9.143 1.00 0.00 H new ATOM 0 HA SER A 39 -5.682 4.095 9.495 1.00 0.00 H new ATOM 0 HB2 SER A 39 -4.588 5.314 11.454 1.00 0.00 H new ATOM 0 HB3 SER A 39 -4.288 3.588 11.392 1.00 0.00 H new ATOM 0 HG SER A 39 -2.312 4.650 11.726 1.00 0.00 H new ATOM 566 N ARG A 40 -3.545 6.325 8.385 1.00 0.00 N ATOM 567 CA ARG A 40 -3.407 7.641 7.823 1.00 0.00 C ATOM 568 C ARG A 40 -4.075 7.688 6.456 1.00 0.00 C ATOM 569 O ARG A 40 -4.721 8.670 6.099 1.00 0.00 O ATOM 570 CB ARG A 40 -1.926 7.986 7.707 1.00 0.00 C ATOM 571 CG ARG A 40 -1.080 7.513 8.883 1.00 0.00 C ATOM 572 CD ARG A 40 -1.627 8.008 10.215 1.00 0.00 C ATOM 573 NE ARG A 40 -1.618 9.464 10.325 1.00 0.00 N ATOM 574 CZ ARG A 40 -1.908 10.120 11.447 1.00 0.00 C ATOM 575 NH1 ARG A 40 -2.313 9.450 12.520 1.00 0.00 N1+ ATOM 576 NH2 ARG A 40 -1.814 11.442 11.491 1.00 0.00 N ATOM 0 H ARG A 40 -2.686 5.775 8.378 1.00 0.00 H new ATOM 0 HA ARG A 40 -3.891 8.372 8.470 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -1.533 7.546 6.791 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -1.823 9.067 7.611 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -1.044 6.424 8.888 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -0.056 7.866 8.758 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -2.647 7.645 10.341 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -1.035 7.583 11.026 1.00 0.00 H new ATOM 0 HE ARG A 40 -1.376 10.008 9.497 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -2.401 8.434 12.484 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -2.535 9.951 13.380 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -1.519 11.960 10.663 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -2.037 11.941 12.352 1.00 0.00 H new ATOM 590 N ILE A 41 -3.908 6.610 5.699 1.00 0.00 N ATOM 591 CA ILE A 41 -4.548 6.469 4.398 1.00 0.00 C ATOM 592 C ILE A 41 -6.069 6.521 4.550 1.00 0.00 C ATOM 593 O ILE A 41 -6.744 7.282 3.862 1.00 0.00 O ATOM 594 CB ILE A 41 -4.147 5.130 3.735 1.00 0.00 C ATOM 595 CG1 ILE A 41 -2.654 5.130 3.412 1.00 0.00 C ATOM 596 CG2 ILE A 41 -4.972 4.869 2.483 1.00 0.00 C ATOM 597 CD1 ILE A 41 -2.147 3.825 2.840 1.00 0.00 C ATOM 0 H ILE A 41 -3.329 5.814 5.968 1.00 0.00 H new ATOM 0 HA ILE A 41 -4.216 7.293 3.766 1.00 0.00 H new ATOM 0 HB ILE A 41 -4.352 4.323 4.439 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -2.447 5.931 2.702 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -2.096 5.357 4.321 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -4.668 3.921 2.038 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -6.029 4.824 2.746 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -4.810 5.674 1.766 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -1.079 3.907 2.638 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -2.320 3.022 3.556 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -2.676 3.604 1.913 1.00 0.00 H new ATOM 609 N SER A 42 -6.593 5.713 5.469 1.00 0.00 N ATOM 610 CA SER A 42 -8.030 5.671 5.726 1.00 0.00 C ATOM 611 C SER A 42 -8.550 7.050 6.137 1.00 0.00 C ATOM 612 O SER A 42 -9.599 7.500 5.659 1.00 0.00 O ATOM 613 CB SER A 42 -8.339 4.640 6.814 1.00 0.00 C ATOM 614 OG SER A 42 -7.871 3.352 6.438 1.00 0.00 O ATOM 0 H SER A 42 -6.043 5.078 6.048 1.00 0.00 H new ATOM 0 HA SER A 42 -8.536 5.378 4.806 1.00 0.00 H new ATOM 0 HB2 SER A 42 -7.871 4.942 7.751 1.00 0.00 H new ATOM 0 HB3 SER A 42 -9.414 4.604 6.992 1.00 0.00 H new ATOM 0 HG SER A 42 -6.895 3.322 6.519 1.00 0.00 H new ATOM 620 N GLY A 43 -7.799 7.723 7.005 1.00 0.00 N ATOM 621 CA GLY A 43 -8.160 9.066 7.415 1.00 0.00 C ATOM 622 C GLY A 43 -8.115 10.041 6.256 1.00 0.00 C ATOM 623 O GLY A 43 -8.948 10.940 6.156 1.00 0.00 O ATOM 0 H GLY A 43 -6.946 7.360 7.431 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -9.162 9.058 7.844 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -7.481 9.402 8.198 1.00 0.00 H new ATOM 627 N ARG A 44 -7.150 9.846 5.362 1.00 0.00 N ATOM 628 CA ARG A 44 -7.006 10.682 4.196 1.00 0.00 C ATOM 629 C ARG A 44 -8.156 10.443 3.229 1.00 0.00 C ATOM 630 O ARG A 44 -8.563 11.340 2.505 1.00 0.00 O ATOM 631 CB ARG A 44 -5.694 10.387 3.503 1.00 0.00 C ATOM 632 CG ARG A 44 -5.013 11.621 2.954 1.00 0.00 C ATOM 633 CD ARG A 44 -3.720 11.256 2.260 1.00 0.00 C ATOM 634 NE ARG A 44 -2.798 12.393 2.202 1.00 0.00 N ATOM 635 CZ ARG A 44 -2.680 13.230 1.168 1.00 0.00 C ATOM 636 NH1 ARG A 44 -3.447 13.096 0.092 1.00 0.00 N1+ ATOM 637 NH2 ARG A 44 -1.794 14.215 1.223 1.00 0.00 N ATOM 0 H ARG A 44 -6.453 9.105 5.434 1.00 0.00 H new ATOM 0 HA ARG A 44 -7.019 11.724 4.515 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -5.023 9.894 4.206 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -5.872 9.686 2.687 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -5.677 12.127 2.253 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -4.811 12.322 3.764 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -3.245 10.428 2.787 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -3.935 10.909 1.249 1.00 0.00 H new ATOM 0 HE ARG A 44 -2.201 12.558 3.013 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -4.137 12.346 0.048 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -3.346 13.743 -0.690 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -1.209 14.329 2.051 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -1.698 14.859 0.438 1.00 0.00 H new ATOM 651 N LEU A 45 -8.656 9.215 3.204 1.00 0.00 N ATOM 652 CA LEU A 45 -9.770 8.859 2.355 1.00 0.00 C ATOM 653 C LEU A 45 -11.006 9.652 2.759 1.00 0.00 C ATOM 654 O LEU A 45 -11.852 9.972 1.934 1.00 0.00 O ATOM 655 CB LEU A 45 -10.030 7.360 2.468 1.00 0.00 C ATOM 656 CG LEU A 45 -10.050 6.607 1.150 1.00 0.00 C ATOM 657 CD1 LEU A 45 -9.706 5.143 1.370 1.00 0.00 C ATOM 658 CD2 LEU A 45 -11.404 6.738 0.490 1.00 0.00 C ATOM 0 H LEU A 45 -8.299 8.446 3.771 1.00 0.00 H new ATOM 0 HA LEU A 45 -9.534 9.100 1.319 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -9.264 6.922 3.107 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -10.987 7.210 2.969 1.00 0.00 H new ATOM 0 HG LEU A 45 -9.299 7.042 0.490 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -9.725 4.617 0.415 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -8.711 5.065 1.808 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -10.435 4.695 2.045 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -11.403 6.193 -0.454 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -12.170 6.325 1.146 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -11.616 7.790 0.301 1.00 0.00 H new ATOM 670 N ASN A 46 -11.096 9.959 4.046 1.00 0.00 N ATOM 671 CA ASN A 46 -12.157 10.825 4.564 1.00 0.00 C ATOM 672 C ASN A 46 -11.905 12.258 4.126 1.00 0.00 C ATOM 673 O ASN A 46 -12.833 13.012 3.842 1.00 0.00 O ATOM 674 CB ASN A 46 -12.239 10.746 6.094 1.00 0.00 C ATOM 675 CG ASN A 46 -13.310 11.661 6.670 1.00 0.00 C ATOM 676 OD1 ASN A 46 -13.052 12.825 6.970 1.00 0.00 O ATOM 677 ND2 ASN A 46 -14.518 11.140 6.837 1.00 0.00 N ATOM 0 H ASN A 46 -10.446 9.622 4.756 1.00 0.00 H new ATOM 0 HA ASN A 46 -13.110 10.483 4.160 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -12.447 9.718 6.391 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -11.272 11.012 6.520 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -15.270 11.709 7.226 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -14.695 10.170 6.577 1.00 0.00 H new ATOM 684 N ARG A 47 -10.629 12.611 4.069 1.00 0.00 N ATOM 685 CA ARG A 47 -10.186 13.908 3.573 1.00 0.00 C ATOM 686 C ARG A 47 -10.481 14.013 2.073 1.00 0.00 C ATOM 687 O ARG A 47 -10.677 15.104 1.537 1.00 0.00 O ATOM 688 CB ARG A 47 -8.689 14.052 3.865 1.00 0.00 C ATOM 689 CG ARG A 47 -8.063 15.383 3.483 1.00 0.00 C ATOM 690 CD ARG A 47 -6.600 15.401 3.900 1.00 0.00 C ATOM 691 NE ARG A 47 -5.899 16.621 3.508 1.00 0.00 N ATOM 692 CZ ARG A 47 -4.741 17.004 4.048 1.00 0.00 C ATOM 693 NH1 ARG A 47 -4.196 16.279 5.022 1.00 0.00 N1+ ATOM 694 NH2 ARG A 47 -4.131 18.106 3.627 1.00 0.00 N ATOM 0 H ARG A 47 -9.867 12.003 4.367 1.00 0.00 H new ATOM 0 HA ARG A 47 -10.721 14.717 4.071 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -8.529 13.890 4.931 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -8.158 13.259 3.339 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -8.146 15.540 2.408 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -8.599 16.200 3.966 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -6.537 15.287 4.982 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -6.094 14.542 3.459 1.00 0.00 H new ATOM 0 HE ARG A 47 -6.315 17.209 2.786 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -4.664 15.435 5.352 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -3.311 16.568 5.438 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -4.548 18.668 2.885 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -3.246 18.391 4.046 1.00 0.00 H new ATOM 708 N PHE A 48 -10.528 12.859 1.408 1.00 0.00 N ATOM 709 CA PHE A 48 -10.957 12.781 0.014 1.00 0.00 C ATOM 710 C PHE A 48 -12.456 12.512 -0.071 1.00 0.00 C ATOM 711 O PHE A 48 -13.002 12.281 -1.154 1.00 0.00 O ATOM 712 CB PHE A 48 -10.196 11.686 -0.744 1.00 0.00 C ATOM 713 CG PHE A 48 -8.810 12.075 -1.172 1.00 0.00 C ATOM 714 CD1 PHE A 48 -8.620 12.950 -2.230 1.00 0.00 C ATOM 715 CD2 PHE A 48 -7.700 11.553 -0.533 1.00 0.00 C ATOM 716 CE1 PHE A 48 -7.349 13.299 -2.640 1.00 0.00 C ATOM 717 CE2 PHE A 48 -6.426 11.899 -0.936 1.00 0.00 C ATOM 718 CZ PHE A 48 -6.251 12.772 -1.991 1.00 0.00 C ATOM 0 H PHE A 48 -10.272 11.960 1.817 1.00 0.00 H new ATOM 0 HA PHE A 48 -10.736 13.742 -0.450 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -10.132 10.801 -0.111 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -10.771 11.406 -1.627 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -9.477 13.364 -2.740 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -7.832 10.867 0.291 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -7.214 13.982 -3.466 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -5.567 11.487 -0.427 1.00 0.00 H new ATOM 0 HZ PHE A 48 -5.255 13.043 -2.308 1.00 0.00 H new ATOM 728 N LYS A 49 -13.100 12.559 1.091 1.00 0.00 N ATOM 729 CA LYS A 49 -14.517 12.248 1.246 1.00 0.00 C ATOM 730 C LYS A 49 -14.789 10.764 1.000 1.00 0.00 C ATOM 731 O LYS A 49 -14.836 10.299 -0.140 1.00 0.00 O ATOM 732 CB LYS A 49 -15.388 13.108 0.324 1.00 0.00 C ATOM 733 CG LYS A 49 -16.877 12.874 0.507 1.00 0.00 C ATOM 734 CD LYS A 49 -17.340 13.296 1.893 1.00 0.00 C ATOM 735 CE LYS A 49 -17.272 14.806 2.063 1.00 0.00 C ATOM 736 NZ LYS A 49 -17.476 15.220 3.476 1.00 0.00 N1+ ATOM 0 H LYS A 49 -12.644 12.819 1.966 1.00 0.00 H new ATOM 0 HA LYS A 49 -14.784 12.481 2.277 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -15.168 14.160 0.507 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -15.120 12.902 -0.712 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -17.430 13.432 -0.248 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -17.103 11.819 0.352 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -18.362 12.955 2.057 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -16.719 12.815 2.648 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -16.303 15.166 1.717 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -18.029 15.275 1.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -17.422 16.256 3.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -18.411 14.900 3.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -16.738 14.794 4.073 1.00 0.00 H new ATOM 750 N ARG A 50 -14.972 10.027 2.086 1.00 0.00 N ATOM 751 CA ARG A 50 -15.369 8.631 2.006 1.00 0.00 C ATOM 752 C ARG A 50 -16.716 8.463 2.684 1.00 0.00 C ATOM 753 O ARG A 50 -16.917 8.936 3.806 1.00 0.00 O ATOM 754 CB ARG A 50 -14.318 7.705 2.648 1.00 0.00 C ATOM 755 CG ARG A 50 -14.016 8.011 4.108 1.00 0.00 C ATOM 756 CD ARG A 50 -12.812 7.224 4.613 1.00 0.00 C ATOM 757 NE ARG A 50 -13.181 5.991 5.316 1.00 0.00 N ATOM 758 CZ ARG A 50 -12.435 4.882 5.309 1.00 0.00 C ATOM 759 NH1 ARG A 50 -11.358 4.812 4.538 1.00 0.00 N1+ ATOM 760 NH2 ARG A 50 -12.763 3.843 6.072 1.00 0.00 N ATOM 0 H ARG A 50 -14.851 10.376 3.037 1.00 0.00 H new ATOM 0 HA ARG A 50 -15.446 8.347 0.957 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -14.664 6.674 2.570 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -13.393 7.775 2.076 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -13.828 9.078 4.224 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -14.888 7.773 4.717 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -12.169 6.975 3.769 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -12.228 7.856 5.283 1.00 0.00 H new ATOM 0 HE ARG A 50 -14.056 5.979 5.840 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -11.099 5.605 3.950 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -10.789 3.966 4.533 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -13.589 3.889 6.668 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -12.188 3.000 6.061 1.00 0.00 H new ATOM 774 N TYR A 51 -17.635 7.811 1.992 1.00 0.00 N ATOM 775 CA TYR A 51 -18.972 7.594 2.514 1.00 0.00 C ATOM 776 C TYR A 51 -18.888 6.779 3.797 1.00 0.00 C ATOM 777 O TYR A 51 -18.177 5.774 3.840 1.00 0.00 O ATOM 778 CB TYR A 51 -19.812 6.845 1.481 1.00 0.00 C ATOM 779 CG TYR A 51 -21.303 6.996 1.690 1.00 0.00 C ATOM 780 CD1 TYR A 51 -22.005 6.145 2.533 1.00 0.00 C ATOM 781 CD2 TYR A 51 -22.008 8.005 1.047 1.00 0.00 C ATOM 782 CE1 TYR A 51 -23.364 6.296 2.729 1.00 0.00 C ATOM 783 CE2 TYR A 51 -23.367 8.163 1.237 1.00 0.00 C ATOM 784 CZ TYR A 51 -24.040 7.307 2.080 1.00 0.00 C ATOM 785 OH TYR A 51 -25.394 7.458 2.278 1.00 0.00 O ATOM 0 H TYR A 51 -17.478 7.421 1.063 1.00 0.00 H new ATOM 0 HA TYR A 51 -19.440 8.555 2.726 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -19.555 7.205 0.485 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -19.554 5.786 1.513 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -21.480 5.352 3.044 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -21.484 8.679 0.386 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -23.895 5.625 3.388 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -23.899 8.953 0.727 1.00 0.00 H new ATOM 0 HH TYR A 51 -25.719 8.217 1.750 1.00 0.00 H new ATOM 795 N PRO A 52 -19.592 7.214 4.862 1.00 0.00 N ATOM 796 CA PRO A 52 -19.579 6.549 6.168 1.00 0.00 C ATOM 797 C PRO A 52 -19.750 5.040 6.050 1.00 0.00 C ATOM 798 O PRO A 52 -20.691 4.560 5.419 1.00 0.00 O ATOM 799 CB PRO A 52 -20.779 7.163 6.906 1.00 0.00 C ATOM 800 CG PRO A 52 -21.479 8.032 5.911 1.00 0.00 C ATOM 801 CD PRO A 52 -20.454 8.398 4.881 1.00 0.00 C ATOM 0 HA PRO A 52 -18.629 6.694 6.682 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -21.445 6.386 7.281 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -20.451 7.744 7.768 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -22.317 7.505 5.456 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -21.885 8.923 6.390 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -20.906 8.587 3.907 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -19.903 9.297 5.157 1.00 0.00 H new ATOM 809 N LYS A 53 -18.861 4.302 6.709 1.00 0.00 N ATOM 810 CA LYS A 53 -18.793 2.850 6.565 1.00 0.00 C ATOM 811 C LYS A 53 -20.050 2.174 7.077 1.00 0.00 C ATOM 812 O LYS A 53 -20.330 1.045 6.709 1.00 0.00 O ATOM 813 CB LYS A 53 -17.566 2.277 7.283 1.00 0.00 C ATOM 814 CG LYS A 53 -16.226 2.651 6.658 1.00 0.00 C ATOM 815 CD LYS A 53 -16.055 2.085 5.251 1.00 0.00 C ATOM 816 CE LYS A 53 -16.701 2.982 4.209 1.00 0.00 C ATOM 817 NZ LYS A 53 -16.048 4.314 4.148 1.00 0.00 N1+ ATOM 0 H LYS A 53 -18.172 4.690 7.353 1.00 0.00 H new ATOM 0 HA LYS A 53 -18.705 2.644 5.498 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -17.576 2.618 8.318 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -17.650 1.190 7.305 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -16.137 3.737 6.622 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -15.419 2.286 7.293 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -14.994 1.973 5.029 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -16.498 1.090 5.201 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -16.643 2.504 3.231 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -17.759 3.106 4.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -16.692 4.996 3.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -15.820 4.634 5.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -15.173 4.246 3.590 1.00 0.00 H new ATOM 831 N ASP A 54 -20.796 2.861 7.929 1.00 0.00 N ATOM 832 CA ASP A 54 -22.024 2.308 8.498 1.00 0.00 C ATOM 833 C ASP A 54 -22.957 1.796 7.400 1.00 0.00 C ATOM 834 O ASP A 54 -23.550 0.726 7.529 1.00 0.00 O ATOM 835 CB ASP A 54 -22.740 3.370 9.338 1.00 0.00 C ATOM 836 CG ASP A 54 -21.923 3.808 10.537 1.00 0.00 C ATOM 837 OD1 ASP A 54 -21.041 4.684 10.374 1.00 0.00 O ATOM 838 OD2 ASP A 54 -22.154 3.282 11.642 1.00 0.00 O1- ATOM 0 H ASP A 54 -20.575 3.805 8.245 1.00 0.00 H new ATOM 0 HA ASP A 54 -21.753 1.467 9.136 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -22.957 4.237 8.714 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -23.697 2.975 9.679 1.00 0.00 H new ATOM 843 N ALA A 55 -23.063 2.549 6.312 1.00 0.00 N ATOM 844 CA ALA A 55 -23.882 2.136 5.179 1.00 0.00 C ATOM 845 C ALA A 55 -23.192 1.043 4.363 1.00 0.00 C ATOM 846 O ALA A 55 -23.842 0.125 3.864 1.00 0.00 O ATOM 847 CB ALA A 55 -24.210 3.332 4.299 1.00 0.00 C ATOM 0 H ALA A 55 -22.594 3.446 6.190 1.00 0.00 H new ATOM 0 HA ALA A 55 -24.812 1.722 5.570 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -24.822 3.008 3.457 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -24.758 4.073 4.881 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -23.286 3.774 3.927 1.00 0.00 H new ATOM 853 N LEU A 56 -21.870 1.135 4.250 1.00 0.00 N ATOM 854 CA LEU A 56 -21.099 0.207 3.421 1.00 0.00 C ATOM 855 C LEU A 56 -20.983 -1.160 4.082 1.00 0.00 C ATOM 856 O LEU A 56 -21.150 -2.180 3.434 1.00 0.00 O ATOM 857 CB LEU A 56 -19.675 0.738 3.160 1.00 0.00 C ATOM 858 CG LEU A 56 -19.538 1.941 2.218 1.00 0.00 C ATOM 859 CD1 LEU A 56 -20.215 1.667 0.896 1.00 0.00 C ATOM 860 CD2 LEU A 56 -20.093 3.200 2.844 1.00 0.00 C ATOM 0 H LEU A 56 -21.308 1.843 4.722 1.00 0.00 H new ATOM 0 HA LEU A 56 -21.636 0.115 2.477 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -19.234 1.008 4.119 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -19.079 -0.079 2.754 1.00 0.00 H new ATOM 0 HG LEU A 56 -18.474 2.097 2.038 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -20.105 2.534 0.244 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -19.755 0.798 0.425 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -21.274 1.471 1.063 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -19.980 4.032 2.149 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -21.150 3.058 3.071 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -19.551 3.419 3.764 1.00 0.00 H new ATOM 872 N ARG A 57 -20.722 -1.166 5.378 1.00 0.00 N ATOM 873 CA ARG A 57 -20.472 -2.400 6.116 1.00 0.00 C ATOM 874 C ARG A 57 -21.765 -3.160 6.380 1.00 0.00 C ATOM 875 O ARG A 57 -21.746 -4.337 6.733 1.00 0.00 O ATOM 876 CB ARG A 57 -19.758 -2.077 7.425 1.00 0.00 C ATOM 877 CG ARG A 57 -18.384 -1.457 7.215 1.00 0.00 C ATOM 878 CD ARG A 57 -17.275 -2.437 7.549 1.00 0.00 C ATOM 879 NE ARG A 57 -17.318 -2.849 8.951 1.00 0.00 N ATOM 880 CZ ARG A 57 -16.512 -3.765 9.480 1.00 0.00 C ATOM 881 NH1 ARG A 57 -15.564 -4.318 8.735 1.00 0.00 N1+ ATOM 882 NH2 ARG A 57 -16.645 -4.116 10.755 1.00 0.00 N ATOM 0 H ARG A 57 -20.677 -0.322 5.949 1.00 0.00 H new ATOM 0 HA ARG A 57 -19.835 -3.044 5.510 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -20.374 -1.393 8.009 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -19.653 -2.991 8.010 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -18.285 -1.133 6.179 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -18.286 -0.568 7.838 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -17.361 -3.315 6.909 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -16.309 -1.980 7.334 1.00 0.00 H new ATOM 0 HE ARG A 57 -18.007 -2.408 9.560 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -15.455 -4.040 7.760 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -14.944 -5.021 9.138 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -17.367 -3.682 11.331 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -16.025 -4.819 11.158 1.00 0.00 H new ATOM 896 N LEU A 58 -22.884 -2.475 6.208 1.00 0.00 N ATOM 897 CA LEU A 58 -24.192 -3.105 6.311 1.00 0.00 C ATOM 898 C LEU A 58 -24.570 -3.705 4.959 1.00 0.00 C ATOM 899 O LEU A 58 -25.535 -4.465 4.834 1.00 0.00 O ATOM 900 CB LEU A 58 -25.234 -2.064 6.739 1.00 0.00 C ATOM 901 CG LEU A 58 -26.648 -2.598 6.981 1.00 0.00 C ATOM 902 CD1 LEU A 58 -26.669 -3.552 8.165 1.00 0.00 C ATOM 903 CD2 LEU A 58 -27.619 -1.446 7.200 1.00 0.00 C ATOM 0 H LEU A 58 -22.913 -1.478 5.995 1.00 0.00 H new ATOM 0 HA LEU A 58 -24.161 -3.898 7.058 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -24.886 -1.584 7.653 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -25.284 -1.291 5.972 1.00 0.00 H new ATOM 0 HG LEU A 58 -26.963 -3.151 6.096 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -27.684 -3.919 8.319 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -26.005 -4.393 7.966 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -26.333 -3.028 9.060 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -28.620 -1.842 7.371 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -27.305 -0.866 8.068 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -27.628 -0.805 6.319 1.00 0.00 H new ATOM 915 N LYS A 59 -23.773 -3.371 3.952 1.00 0.00 N ATOM 916 CA LYS A 59 -24.069 -3.733 2.577 1.00 0.00 C ATOM 917 C LYS A 59 -23.026 -4.702 2.016 1.00 0.00 C ATOM 918 O LYS A 59 -23.361 -5.804 1.578 1.00 0.00 O ATOM 919 CB LYS A 59 -24.107 -2.461 1.729 1.00 0.00 C ATOM 920 CG LYS A 59 -24.522 -2.691 0.290 1.00 0.00 C ATOM 921 CD LYS A 59 -24.347 -1.437 -0.544 1.00 0.00 C ATOM 922 CE LYS A 59 -25.155 -0.272 -0.001 1.00 0.00 C ATOM 923 NZ LYS A 59 -26.616 -0.469 -0.188 1.00 0.00 N1+ ATOM 0 H LYS A 59 -22.907 -2.844 4.067 1.00 0.00 H new ATOM 0 HA LYS A 59 -25.036 -4.236 2.548 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -24.797 -1.752 2.186 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -23.120 -1.998 1.742 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -23.928 -3.499 -0.137 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -25.564 -3.009 0.257 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -23.292 -1.164 -0.571 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -24.650 -1.640 -1.571 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -24.940 -0.145 1.060 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -24.847 0.646 -0.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -27.128 0.357 0.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -26.824 -0.581 -1.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -26.920 -1.322 0.324 1.00 0.00 H new ATOM 937 N ARG A 60 -21.766 -4.280 2.033 1.00 0.00 N ATOM 938 CA ARG A 60 -20.679 -5.047 1.442 1.00 0.00 C ATOM 939 C ARG A 60 -19.552 -5.253 2.449 1.00 0.00 C ATOM 940 O ARG A 60 -18.999 -4.290 2.978 1.00 0.00 O ATOM 941 CB ARG A 60 -20.103 -4.323 0.219 1.00 0.00 C ATOM 942 CG ARG A 60 -21.143 -3.851 -0.781 1.00 0.00 C ATOM 943 CD ARG A 60 -21.870 -5.004 -1.444 1.00 0.00 C ATOM 944 NE ARG A 60 -22.900 -4.523 -2.361 1.00 0.00 N ATOM 945 CZ ARG A 60 -23.989 -5.212 -2.691 1.00 0.00 C ATOM 946 NH1 ARG A 60 -24.181 -6.435 -2.216 1.00 0.00 N1+ ATOM 947 NH2 ARG A 60 -24.895 -4.681 -3.497 1.00 0.00 N ATOM 0 H ARG A 60 -21.472 -3.400 2.456 1.00 0.00 H new ATOM 0 HA ARG A 60 -21.089 -6.011 1.142 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -19.528 -3.462 0.560 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -19.407 -4.991 -0.288 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -21.866 -3.212 -0.275 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -20.659 -3.242 -1.545 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -21.156 -5.623 -1.988 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -22.325 -5.637 -0.682 1.00 0.00 H new ATOM 0 HE ARG A 60 -22.776 -3.599 -2.775 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -23.491 -6.854 -1.593 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -25.019 -6.957 -2.474 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -24.759 -3.740 -3.867 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -25.729 -5.213 -3.748 1.00 0.00 H new ATOM 961 N GLN A 61 -19.218 -6.506 2.711 1.00 0.00 N ATOM 962 CA GLN A 61 -18.055 -6.836 3.517 1.00 0.00 C ATOM 963 C GLN A 61 -17.180 -7.802 2.741 1.00 0.00 C ATOM 964 O GLN A 61 -17.599 -8.921 2.452 1.00 0.00 O ATOM 965 CB GLN A 61 -18.468 -7.474 4.847 1.00 0.00 C ATOM 966 CG GLN A 61 -19.512 -6.684 5.613 1.00 0.00 C ATOM 967 CD GLN A 61 -19.886 -7.334 6.928 1.00 0.00 C ATOM 968 OE1 GLN A 61 -19.273 -7.069 7.963 1.00 0.00 O ATOM 969 NE2 GLN A 61 -20.897 -8.191 6.899 1.00 0.00 N ATOM 0 H GLN A 61 -19.740 -7.315 2.375 1.00 0.00 H new ATOM 0 HA GLN A 61 -17.508 -5.919 3.737 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -18.854 -8.475 4.654 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -17.583 -7.589 5.473 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -19.134 -5.679 5.803 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -20.405 -6.578 4.998 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -21.378 -8.382 6.020 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -21.194 -8.659 7.755 1.00 0.00 H new ATOM 978 N GLY A 62 -15.985 -7.365 2.380 1.00 0.00 N ATOM 979 CA GLY A 62 -15.083 -8.218 1.637 1.00 0.00 C ATOM 980 C GLY A 62 -13.624 -7.925 1.921 1.00 0.00 C ATOM 981 O GLY A 62 -13.240 -6.774 2.103 1.00 0.00 O ATOM 0 H GLY A 62 -15.623 -6.434 2.588 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -15.293 -9.259 1.881 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -15.272 -8.096 0.570 1.00 0.00 H new ATOM 985 N VAL A 63 -12.813 -8.972 1.959 1.00 0.00 N ATOM 986 CA VAL A 63 -11.381 -8.824 2.155 1.00 0.00 C ATOM 987 C VAL A 63 -10.650 -9.037 0.833 1.00 0.00 C ATOM 988 O VAL A 63 -10.866 -10.036 0.140 1.00 0.00 O ATOM 989 CB VAL A 63 -10.844 -9.798 3.236 1.00 0.00 C ATOM 990 CG1 VAL A 63 -11.221 -11.242 2.927 1.00 0.00 C ATOM 991 CG2 VAL A 63 -9.338 -9.661 3.384 1.00 0.00 C ATOM 0 H VAL A 63 -13.126 -9.937 1.856 1.00 0.00 H new ATOM 0 HA VAL A 63 -11.194 -7.810 2.510 1.00 0.00 H new ATOM 0 HB VAL A 63 -11.313 -9.528 4.182 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -10.828 -11.895 3.706 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -12.306 -11.335 2.889 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -10.799 -11.530 1.964 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -8.983 -10.353 4.147 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -8.857 -9.891 2.433 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -9.093 -8.640 3.678 1.00 0.00 H new ATOM 1001 N GLY A 64 -9.806 -8.087 0.471 1.00 0.00 N ATOM 1002 CA GLY A 64 -9.125 -8.157 -0.798 1.00 0.00 C ATOM 1003 C GLY A 64 -7.828 -7.381 -0.801 1.00 0.00 C ATOM 1004 O GLY A 64 -7.560 -6.596 0.105 1.00 0.00 O ATOM 0 H GLY A 64 -9.581 -7.268 1.035 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -8.921 -9.200 -1.041 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -9.779 -7.770 -1.580 1.00 0.00 H new ATOM 1008 N GLN A 65 -7.028 -7.603 -1.827 1.00 0.00 N ATOM 1009 CA GLN A 65 -5.762 -6.908 -1.985 1.00 0.00 C ATOM 1010 C GLN A 65 -5.942 -5.808 -3.015 1.00 0.00 C ATOM 1011 O GLN A 65 -6.498 -6.043 -4.087 1.00 0.00 O ATOM 1012 CB GLN A 65 -4.671 -7.879 -2.455 1.00 0.00 C ATOM 1013 CG GLN A 65 -4.415 -9.037 -1.499 1.00 0.00 C ATOM 1014 CD GLN A 65 -3.627 -8.658 -0.254 1.00 0.00 C ATOM 1015 OE1 GLN A 65 -3.891 -9.177 0.830 1.00 0.00 O ATOM 1016 NE2 GLN A 65 -2.615 -7.816 -0.401 1.00 0.00 N ATOM 0 H GLN A 65 -7.235 -8.268 -2.573 1.00 0.00 H new ATOM 0 HA GLN A 65 -5.457 -6.486 -1.027 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -4.952 -8.281 -3.428 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -3.743 -7.325 -2.595 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -5.372 -9.460 -1.194 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -3.876 -9.820 -2.032 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -2.423 -7.403 -1.314 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -2.027 -7.580 0.399 1.00 0.00 H new ATOM 1025 N VAL A 66 -5.493 -4.618 -2.688 1.00 0.00 N ATOM 1026 CA VAL A 66 -5.668 -3.473 -3.562 1.00 0.00 C ATOM 1027 C VAL A 66 -4.327 -2.799 -3.827 1.00 0.00 C ATOM 1028 O VAL A 66 -3.684 -2.281 -2.917 1.00 0.00 O ATOM 1029 CB VAL A 66 -6.682 -2.484 -2.934 1.00 0.00 C ATOM 1030 CG1 VAL A 66 -6.609 -1.103 -3.552 1.00 0.00 C ATOM 1031 CG2 VAL A 66 -8.092 -3.031 -3.074 1.00 0.00 C ATOM 0 H VAL A 66 -5.001 -4.414 -1.818 1.00 0.00 H new ATOM 0 HA VAL A 66 -6.066 -3.808 -4.520 1.00 0.00 H new ATOM 0 HB VAL A 66 -6.420 -2.383 -1.881 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -7.341 -0.451 -3.074 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -5.609 -0.693 -3.409 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -6.824 -1.170 -4.618 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -8.800 -2.331 -2.630 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -8.327 -3.165 -4.130 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -8.162 -3.991 -2.562 1.00 0.00 H new ATOM 1041 N ARG A 67 -3.887 -2.849 -5.075 1.00 0.00 N ATOM 1042 CA ARG A 67 -2.624 -2.243 -5.456 1.00 0.00 C ATOM 1043 C ARG A 67 -2.887 -0.911 -6.136 1.00 0.00 C ATOM 1044 O ARG A 67 -3.843 -0.784 -6.895 1.00 0.00 O ATOM 1045 CB ARG A 67 -1.839 -3.161 -6.396 1.00 0.00 C ATOM 1046 CG ARG A 67 -0.483 -2.597 -6.783 1.00 0.00 C ATOM 1047 CD ARG A 67 0.175 -3.395 -7.894 1.00 0.00 C ATOM 1048 NE ARG A 67 0.450 -4.773 -7.503 1.00 0.00 N ATOM 1049 CZ ARG A 67 1.266 -5.578 -8.178 1.00 0.00 C ATOM 1050 NH1 ARG A 67 1.927 -5.120 -9.239 1.00 0.00 N1+ ATOM 1051 NH2 ARG A 67 1.441 -6.834 -7.783 1.00 0.00 N ATOM 0 H ARG A 67 -4.387 -3.303 -5.840 1.00 0.00 H new ATOM 0 HA ARG A 67 -2.028 -2.086 -4.557 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -1.700 -4.130 -5.916 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -2.425 -3.334 -7.299 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -0.600 -1.561 -7.102 1.00 0.00 H new ATOM 0 HG3 ARG A 67 0.168 -2.589 -5.909 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -0.471 -3.392 -8.772 1.00 0.00 H new ATOM 0 HD3 ARG A 67 1.107 -2.910 -8.183 1.00 0.00 H new ATOM 0 HE ARG A 67 -0.008 -5.139 -6.668 1.00 0.00 H new ATOM 0 HH11 ARG A 67 1.808 -4.151 -9.535 1.00 0.00 H new ATOM 0 HH12 ARG A 67 2.553 -5.738 -9.756 1.00 0.00 H new ATOM 0 HH21 ARG A 67 0.949 -7.183 -6.960 1.00 0.00 H new ATOM 0 HH22 ARG A 67 2.067 -7.449 -8.302 1.00 0.00 H new ATOM 1065 N PHE A 68 -2.045 0.070 -5.870 1.00 0.00 N ATOM 1066 CA PHE A 68 -2.216 1.387 -6.441 1.00 0.00 C ATOM 1067 C PHE A 68 -0.905 2.158 -6.454 1.00 0.00 C ATOM 1068 O PHE A 68 -0.016 1.910 -5.640 1.00 0.00 O ATOM 1069 CB PHE A 68 -3.293 2.185 -5.688 1.00 0.00 C ATOM 1070 CG PHE A 68 -3.335 1.959 -4.199 1.00 0.00 C ATOM 1071 CD1 PHE A 68 -2.209 2.135 -3.411 1.00 0.00 C ATOM 1072 CD2 PHE A 68 -4.517 1.578 -3.588 1.00 0.00 C ATOM 1073 CE1 PHE A 68 -2.264 1.934 -2.045 1.00 0.00 C ATOM 1074 CE2 PHE A 68 -4.578 1.374 -2.224 1.00 0.00 C ATOM 1075 CZ PHE A 68 -3.451 1.553 -1.452 1.00 0.00 C ATOM 0 H PHE A 68 -1.234 -0.024 -5.259 1.00 0.00 H new ATOM 0 HA PHE A 68 -2.545 1.252 -7.471 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -3.132 3.247 -5.874 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -4.268 1.933 -6.105 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -1.278 2.433 -3.870 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -5.405 1.438 -4.187 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -1.379 2.075 -1.442 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -5.508 1.075 -1.763 1.00 0.00 H new ATOM 0 HZ PHE A 68 -3.496 1.395 -0.385 1.00 0.00 H new ATOM 1085 N THR A 69 -0.797 3.066 -7.406 1.00 0.00 N ATOM 1086 CA THR A 69 0.319 3.988 -7.475 1.00 0.00 C ATOM 1087 C THR A 69 -0.130 5.332 -6.942 1.00 0.00 C ATOM 1088 O THR A 69 -1.153 5.868 -7.368 1.00 0.00 O ATOM 1089 CB THR A 69 0.839 4.150 -8.912 1.00 0.00 C ATOM 1090 OG1 THR A 69 0.979 2.862 -9.523 1.00 0.00 O ATOM 1091 CG2 THR A 69 2.179 4.867 -8.915 1.00 0.00 C ATOM 0 H THR A 69 -1.481 3.184 -8.153 1.00 0.00 H new ATOM 0 HA THR A 69 1.136 3.588 -6.874 1.00 0.00 H new ATOM 0 HB THR A 69 0.123 4.745 -9.478 1.00 0.00 H new ATOM 0 HG1 THR A 69 1.010 2.964 -10.497 1.00 0.00 H new ATOM 0 HG21 THR A 69 2.533 4.973 -9.941 1.00 0.00 H new ATOM 0 HG22 THR A 69 2.065 5.854 -8.467 1.00 0.00 H new ATOM 0 HG23 THR A 69 2.902 4.289 -8.340 1.00 0.00 H new ATOM 1099 N LEU A 70 0.617 5.852 -5.997 1.00 0.00 N ATOM 1100 CA LEU A 70 0.226 7.052 -5.294 1.00 0.00 C ATOM 1101 C LEU A 70 1.249 8.157 -5.488 1.00 0.00 C ATOM 1102 O LEU A 70 2.455 7.922 -5.411 1.00 0.00 O ATOM 1103 CB LEU A 70 0.069 6.725 -3.818 1.00 0.00 C ATOM 1104 CG LEU A 70 -0.920 5.595 -3.526 1.00 0.00 C ATOM 1105 CD1 LEU A 70 -0.740 5.080 -2.106 1.00 0.00 C ATOM 1106 CD2 LEU A 70 -2.350 6.069 -3.755 1.00 0.00 C ATOM 0 H LEU A 70 1.508 5.458 -5.695 1.00 0.00 H new ATOM 0 HA LEU A 70 -0.722 7.410 -5.696 1.00 0.00 H new ATOM 0 HB2 LEU A 70 1.043 6.453 -3.412 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -0.256 7.622 -3.292 1.00 0.00 H new ATOM 0 HG LEU A 70 -0.719 4.772 -4.212 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -1.452 4.277 -1.917 1.00 0.00 H new ATOM 0 HD12 LEU A 70 0.275 4.702 -1.982 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -0.913 5.892 -1.400 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -3.042 5.254 -3.543 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -2.565 6.909 -3.094 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -2.467 6.384 -4.792 1.00 0.00 H new ATOM 1118 N ASP A 71 0.756 9.352 -5.755 1.00 0.00 N ATOM 1119 CA ASP A 71 1.611 10.513 -5.936 1.00 0.00 C ATOM 1120 C ASP A 71 2.113 11.001 -4.587 1.00 0.00 C ATOM 1121 O ASP A 71 1.452 10.803 -3.574 1.00 0.00 O ATOM 1122 CB ASP A 71 0.833 11.631 -6.628 1.00 0.00 C ATOM 1123 CG ASP A 71 1.726 12.772 -7.068 1.00 0.00 C ATOM 1124 OD1 ASP A 71 2.381 12.649 -8.124 1.00 0.00 O1- ATOM 1125 OD2 ASP A 71 1.790 13.792 -6.353 1.00 0.00 O ATOM 0 H ASP A 71 -0.241 9.546 -5.852 1.00 0.00 H new ATOM 0 HA ASP A 71 2.462 10.231 -6.556 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.314 11.225 -7.496 1.00 0.00 H new ATOM 0 HB3 ASP A 71 0.070 12.012 -5.950 1.00 0.00 H new ATOM 1130 N ARG A 72 3.277 11.640 -4.587 1.00 0.00 N ATOM 1131 CA ARG A 72 3.866 12.212 -3.377 1.00 0.00 C ATOM 1132 C ARG A 72 2.903 13.181 -2.678 1.00 0.00 C ATOM 1133 O ARG A 72 2.977 13.380 -1.465 1.00 0.00 O ATOM 1134 CB ARG A 72 5.170 12.937 -3.729 1.00 0.00 C ATOM 1135 CG ARG A 72 5.792 13.688 -2.562 1.00 0.00 C ATOM 1136 CD ARG A 72 7.020 14.479 -2.981 1.00 0.00 C ATOM 1137 NE ARG A 72 6.748 15.363 -4.111 1.00 0.00 N ATOM 1138 CZ ARG A 72 6.187 16.568 -4.007 1.00 0.00 C ATOM 1139 NH1 ARG A 72 5.774 17.023 -2.832 1.00 0.00 N1+ ATOM 1140 NH2 ARG A 72 6.016 17.314 -5.091 1.00 0.00 N ATOM 0 H ARG A 72 3.841 11.778 -5.425 1.00 0.00 H new ATOM 0 HA ARG A 72 4.072 11.394 -2.687 1.00 0.00 H new ATOM 0 HB2 ARG A 72 5.889 12.209 -4.104 1.00 0.00 H new ATOM 0 HB3 ARG A 72 4.976 13.640 -4.539 1.00 0.00 H new ATOM 0 HG2 ARG A 72 5.054 14.366 -2.133 1.00 0.00 H new ATOM 0 HG3 ARG A 72 6.067 12.979 -1.781 1.00 0.00 H new ATOM 0 HD2 ARG A 72 7.375 15.070 -2.137 1.00 0.00 H new ATOM 0 HD3 ARG A 72 7.821 13.789 -3.246 1.00 0.00 H new ATOM 0 HE ARG A 72 7.004 15.037 -5.043 1.00 0.00 H new ATOM 0 HH11 ARG A 72 5.884 16.450 -1.996 1.00 0.00 H new ATOM 0 HH12 ARG A 72 5.346 17.946 -2.764 1.00 0.00 H new ATOM 0 HH21 ARG A 72 6.314 16.965 -6.002 1.00 0.00 H new ATOM 0 HH22 ARG A 72 5.587 18.236 -5.013 1.00 0.00 H new ATOM 1154 N GLN A 73 1.999 13.782 -3.445 1.00 0.00 N ATOM 1155 CA GLN A 73 1.009 14.689 -2.876 1.00 0.00 C ATOM 1156 C GLN A 73 -0.194 13.910 -2.343 1.00 0.00 C ATOM 1157 O GLN A 73 -1.131 14.486 -1.792 1.00 0.00 O ATOM 1158 CB GLN A 73 0.550 15.705 -3.922 1.00 0.00 C ATOM 1159 CG GLN A 73 1.695 16.460 -4.579 1.00 0.00 C ATOM 1160 CD GLN A 73 1.217 17.491 -5.582 1.00 0.00 C ATOM 1161 OE1 GLN A 73 0.155 18.091 -5.416 1.00 0.00 O ATOM 1162 NE2 GLN A 73 1.977 17.675 -6.650 1.00 0.00 N ATOM 0 H GLN A 73 1.931 13.659 -4.455 1.00 0.00 H new ATOM 0 HA GLN A 73 1.475 15.222 -2.047 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -0.023 15.188 -4.692 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -0.123 16.421 -3.450 1.00 0.00 H new ATOM 0 HG2 GLN A 73 2.287 16.955 -3.809 1.00 0.00 H new ATOM 0 HG3 GLN A 73 2.353 15.750 -5.080 1.00 0.00 H new ATOM 0 HE21 GLN A 73 2.850 17.158 -6.750 1.00 0.00 H new ATOM 0 HE22 GLN A 73 1.689 18.334 -7.373 1.00 0.00 H new ATOM 1171 N GLY A 74 -0.153 12.595 -2.516 1.00 0.00 N ATOM 1172 CA GLY A 74 -1.212 11.735 -2.034 1.00 0.00 C ATOM 1173 C GLY A 74 -2.327 11.555 -3.041 1.00 0.00 C ATOM 1174 O GLY A 74 -3.458 11.235 -2.674 1.00 0.00 O ATOM 0 H GLY A 74 0.607 12.105 -2.989 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -0.795 10.760 -1.782 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -1.623 12.153 -1.115 1.00 0.00 H new ATOM 1178 N HIS A 75 -2.009 11.752 -4.310 1.00 0.00 N ATOM 1179 CA HIS A 75 -3.001 11.661 -5.370 1.00 0.00 C ATOM 1180 C HIS A 75 -2.981 10.273 -6.005 1.00 0.00 C ATOM 1181 O HIS A 75 -1.962 9.849 -6.545 1.00 0.00 O ATOM 1182 CB HIS A 75 -2.731 12.739 -6.428 1.00 0.00 C ATOM 1183 CG HIS A 75 -3.765 12.817 -7.512 1.00 0.00 C ATOM 1184 ND1 HIS A 75 -4.907 13.581 -7.410 1.00 0.00 N ATOM 1185 CD2 HIS A 75 -3.819 12.230 -8.729 1.00 0.00 C ATOM 1186 CE1 HIS A 75 -5.619 13.458 -8.513 1.00 0.00 C ATOM 1187 NE2 HIS A 75 -4.981 12.644 -9.328 1.00 0.00 N ATOM 0 H HIS A 75 -1.068 11.977 -4.632 1.00 0.00 H new ATOM 0 HA HIS A 75 -3.990 11.825 -4.942 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -2.667 13.708 -5.933 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -1.759 12.549 -6.883 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -3.084 11.560 -9.151 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -6.563 13.942 -8.714 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -5.300 12.366 -10.256 1.00 0.00 H new ATOM 1196 N VAL A 76 -4.099 9.565 -5.886 1.00 0.00 N ATOM 1197 CA VAL A 76 -4.304 8.292 -6.577 1.00 0.00 C ATOM 1198 C VAL A 76 -3.952 8.401 -8.065 1.00 0.00 C ATOM 1199 O VAL A 76 -4.521 9.215 -8.800 1.00 0.00 O ATOM 1200 CB VAL A 76 -5.767 7.805 -6.410 1.00 0.00 C ATOM 1201 CG1 VAL A 76 -6.759 8.892 -6.802 1.00 0.00 C ATOM 1202 CG2 VAL A 76 -6.022 6.536 -7.214 1.00 0.00 C ATOM 0 H VAL A 76 -4.889 9.855 -5.309 1.00 0.00 H new ATOM 0 HA VAL A 76 -3.636 7.561 -6.122 1.00 0.00 H new ATOM 0 HB VAL A 76 -5.914 7.575 -5.355 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -7.776 8.520 -6.674 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -6.610 9.766 -6.168 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -6.602 9.169 -7.845 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -7.056 6.220 -7.076 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -5.840 6.732 -8.271 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -5.353 5.747 -6.871 1.00 0.00 H new ATOM 1212 N LEU A 77 -2.996 7.593 -8.495 1.00 0.00 N ATOM 1213 CA LEU A 77 -2.528 7.628 -9.873 1.00 0.00 C ATOM 1214 C LEU A 77 -2.963 6.379 -10.620 1.00 0.00 C ATOM 1215 O LEU A 77 -3.548 6.459 -11.700 1.00 0.00 O ATOM 1216 CB LEU A 77 -1.004 7.742 -9.911 1.00 0.00 C ATOM 1217 CG LEU A 77 -0.429 8.928 -9.145 1.00 0.00 C ATOM 1218 CD1 LEU A 77 1.084 8.835 -9.078 1.00 0.00 C ATOM 1219 CD2 LEU A 77 -0.859 10.238 -9.786 1.00 0.00 C ATOM 0 H LEU A 77 -2.527 6.903 -7.908 1.00 0.00 H new ATOM 0 HA LEU A 77 -2.967 8.499 -10.359 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -0.576 6.825 -9.507 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.685 7.811 -10.951 1.00 0.00 H new ATOM 0 HG LEU A 77 -0.819 8.902 -8.127 1.00 0.00 H new ATOM 0 HD11 LEU A 77 1.477 9.690 -8.528 1.00 0.00 H new ATOM 0 HD12 LEU A 77 1.370 7.914 -8.570 1.00 0.00 H new ATOM 0 HD13 LEU A 77 1.494 8.834 -10.088 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -0.439 11.073 -9.225 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -0.500 10.275 -10.815 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -1.947 10.307 -9.778 1.00 0.00 H new ATOM 1231 N ALA A 78 -2.680 5.229 -10.032 1.00 0.00 N ATOM 1232 CA ALA A 78 -2.981 3.953 -10.659 1.00 0.00 C ATOM 1233 C ALA A 78 -3.669 3.033 -9.677 1.00 0.00 C ATOM 1234 O ALA A 78 -3.492 3.181 -8.475 1.00 0.00 O ATOM 1235 CB ALA A 78 -1.705 3.294 -11.147 1.00 0.00 C ATOM 0 H ALA A 78 -2.239 5.153 -9.115 1.00 0.00 H new ATOM 0 HA ALA A 78 -3.642 4.137 -11.506 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -1.945 2.339 -11.615 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -1.216 3.942 -11.875 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -1.036 3.127 -10.303 1.00 0.00 H new ATOM 1241 N VAL A 79 -4.442 2.090 -10.190 1.00 0.00 N ATOM 1242 CA VAL A 79 -5.057 1.065 -9.366 1.00 0.00 C ATOM 1243 C VAL A 79 -4.993 -0.270 -10.095 1.00 0.00 C ATOM 1244 O VAL A 79 -5.468 -0.396 -11.225 1.00 0.00 O ATOM 1245 CB VAL A 79 -6.532 1.377 -9.017 1.00 0.00 C ATOM 1246 CG1 VAL A 79 -7.113 0.275 -8.141 1.00 0.00 C ATOM 1247 CG2 VAL A 79 -6.668 2.728 -8.326 1.00 0.00 C ATOM 0 H VAL A 79 -4.659 2.014 -11.184 1.00 0.00 H new ATOM 0 HA VAL A 79 -4.501 1.030 -8.429 1.00 0.00 H new ATOM 0 HB VAL A 79 -7.093 1.422 -9.951 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -8.151 0.508 -7.904 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -7.067 -0.675 -8.673 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -6.537 0.202 -7.218 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -7.717 2.915 -8.095 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.088 2.724 -7.403 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -6.296 3.513 -8.985 1.00 0.00 H new ATOM 1257 N THR A 80 -4.390 -1.247 -9.456 1.00 0.00 N ATOM 1258 CA THR A 80 -4.262 -2.573 -10.017 1.00 0.00 C ATOM 1259 C THR A 80 -4.966 -3.575 -9.110 1.00 0.00 C ATOM 1260 O THR A 80 -4.484 -3.879 -8.018 1.00 0.00 O ATOM 1261 CB THR A 80 -2.776 -2.954 -10.174 1.00 0.00 C ATOM 1262 OG1 THR A 80 -2.099 -1.949 -10.944 1.00 0.00 O ATOM 1263 CG2 THR A 80 -2.627 -4.305 -10.857 1.00 0.00 C ATOM 0 H THR A 80 -3.974 -1.144 -8.531 1.00 0.00 H new ATOM 0 HA THR A 80 -4.725 -2.587 -11.004 1.00 0.00 H new ATOM 0 HB THR A 80 -2.333 -3.020 -9.180 1.00 0.00 H new ATOM 0 HG1 THR A 80 -1.155 -2.192 -11.041 1.00 0.00 H new ATOM 0 HG21 THR A 80 -1.569 -4.549 -10.955 1.00 0.00 H new ATOM 0 HG22 THR A 80 -3.122 -5.071 -10.260 1.00 0.00 H new ATOM 0 HG23 THR A 80 -3.083 -4.265 -11.846 1.00 0.00 H new ATOM 1271 N LEU A 81 -6.125 -4.054 -9.541 1.00 0.00 N ATOM 1272 CA LEU A 81 -6.890 -4.988 -8.735 1.00 0.00 C ATOM 1273 C LEU A 81 -6.171 -6.325 -8.635 1.00 0.00 C ATOM 1274 O LEU A 81 -6.046 -7.064 -9.612 1.00 0.00 O ATOM 1275 CB LEU A 81 -8.295 -5.194 -9.292 1.00 0.00 C ATOM 1276 CG LEU A 81 -9.221 -5.997 -8.375 1.00 0.00 C ATOM 1277 CD1 LEU A 81 -9.545 -5.208 -7.114 1.00 0.00 C ATOM 1278 CD2 LEU A 81 -10.494 -6.387 -9.107 1.00 0.00 C ATOM 0 H LEU A 81 -6.551 -3.813 -10.436 1.00 0.00 H new ATOM 0 HA LEU A 81 -6.982 -4.556 -7.738 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -8.745 -4.220 -9.482 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -8.222 -5.704 -10.253 1.00 0.00 H new ATOM 0 HG LEU A 81 -8.703 -6.910 -8.082 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -10.204 -5.796 -6.476 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -8.623 -4.986 -6.577 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -10.040 -4.276 -7.385 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -11.138 -6.957 -8.438 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -11.016 -5.488 -9.434 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -10.242 -6.997 -9.975 1.00 0.00 H new ATOM 1290 N VAL A 82 -5.692 -6.609 -7.444 1.00 0.00 N ATOM 1291 CA VAL A 82 -4.970 -7.835 -7.164 1.00 0.00 C ATOM 1292 C VAL A 82 -5.903 -8.850 -6.505 1.00 0.00 C ATOM 1293 O VAL A 82 -6.026 -9.983 -6.967 1.00 0.00 O ATOM 1294 CB VAL A 82 -3.756 -7.542 -6.257 1.00 0.00 C ATOM 1295 CG1 VAL A 82 -2.461 -7.613 -7.051 1.00 0.00 C ATOM 1296 CG2 VAL A 82 -3.891 -6.167 -5.626 1.00 0.00 C ATOM 0 H VAL A 82 -5.792 -5.994 -6.637 1.00 0.00 H new ATOM 0 HA VAL A 82 -4.605 -8.256 -8.101 1.00 0.00 H new ATOM 0 HB VAL A 82 -3.729 -8.298 -5.472 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -1.618 -7.403 -6.392 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -2.349 -8.610 -7.477 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -2.486 -6.876 -7.854 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -3.028 -5.973 -4.989 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -3.941 -5.411 -6.409 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -4.801 -6.129 -5.027 1.00 0.00 H new ATOM 1306 N SER A 83 -6.560 -8.417 -5.429 1.00 0.00 N ATOM 1307 CA SER A 83 -7.617 -9.193 -4.774 1.00 0.00 C ATOM 1308 C SER A 83 -7.081 -10.487 -4.143 1.00 0.00 C ATOM 1309 O SER A 83 -5.889 -10.793 -4.225 1.00 0.00 O ATOM 1310 CB SER A 83 -8.741 -9.487 -5.773 1.00 0.00 C ATOM 1311 OG SER A 83 -9.856 -10.094 -5.139 1.00 0.00 O ATOM 0 H SER A 83 -6.375 -7.517 -4.985 1.00 0.00 H new ATOM 0 HA SER A 83 -8.017 -8.593 -3.956 1.00 0.00 H new ATOM 0 HB2 SER A 83 -9.054 -8.560 -6.253 1.00 0.00 H new ATOM 0 HB3 SER A 83 -8.367 -10.142 -6.560 1.00 0.00 H new ATOM 0 HG SER A 83 -10.556 -10.267 -5.803 1.00 0.00 H new ATOM 1317 N SER A 84 -7.977 -11.223 -3.492 1.00 0.00 N ATOM 1318 CA SER A 84 -7.610 -12.431 -2.772 1.00 0.00 C ATOM 1319 C SER A 84 -8.645 -13.531 -2.982 1.00 0.00 C ATOM 1320 O SER A 84 -8.376 -14.523 -3.656 1.00 0.00 O ATOM 1321 CB SER A 84 -7.469 -12.142 -1.276 1.00 0.00 C ATOM 1322 OG SER A 84 -6.492 -11.150 -1.035 1.00 0.00 O ATOM 0 H SER A 84 -8.971 -10.998 -3.451 1.00 0.00 H new ATOM 0 HA SER A 84 -6.652 -12.772 -3.165 1.00 0.00 H new ATOM 0 HB2 SER A 84 -8.428 -11.816 -0.874 1.00 0.00 H new ATOM 0 HB3 SER A 84 -7.198 -13.058 -0.750 1.00 0.00 H new ATOM 0 HG SER A 84 -6.424 -10.985 -0.071 1.00 0.00 H new ATOM 1328 N ALA A 85 -9.831 -13.348 -2.414 1.00 0.00 N ATOM 1329 CA ALA A 85 -10.848 -14.389 -2.442 1.00 0.00 C ATOM 1330 C ALA A 85 -11.874 -14.164 -3.548 1.00 0.00 C ATOM 1331 O ALA A 85 -11.836 -14.827 -4.585 1.00 0.00 O ATOM 1332 CB ALA A 85 -11.540 -14.493 -1.091 1.00 0.00 C ATOM 0 H ALA A 85 -10.110 -12.494 -1.932 1.00 0.00 H new ATOM 0 HA ALA A 85 -10.340 -15.329 -2.658 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -12.297 -15.276 -1.129 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -10.805 -14.736 -0.324 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -12.014 -13.541 -0.851 1.00 0.00 H new ATOM 1338 N GLY A 86 -12.782 -13.220 -3.331 1.00 0.00 N ATOM 1339 CA GLY A 86 -13.852 -12.998 -4.278 1.00 0.00 C ATOM 1340 C GLY A 86 -14.732 -11.835 -3.887 1.00 0.00 C ATOM 1341 O GLY A 86 -15.631 -11.983 -3.060 1.00 0.00 O ATOM 0 H GLY A 86 -12.794 -12.606 -2.516 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -13.428 -12.814 -5.265 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -14.459 -13.900 -4.355 1.00 0.00 H new ATOM 1345 N LEU A 87 -14.474 -10.674 -4.469 1.00 0.00 N ATOM 1346 CA LEU A 87 -15.285 -9.491 -4.195 1.00 0.00 C ATOM 1347 C LEU A 87 -15.920 -8.972 -5.488 1.00 0.00 C ATOM 1348 O LEU A 87 -15.553 -7.902 -5.972 1.00 0.00 O ATOM 1349 CB LEU A 87 -14.458 -8.347 -3.567 1.00 0.00 C ATOM 1350 CG LEU A 87 -13.475 -8.695 -2.433 1.00 0.00 C ATOM 1351 CD1 LEU A 87 -14.124 -9.585 -1.389 1.00 0.00 C ATOM 1352 CD2 LEU A 87 -12.201 -9.325 -2.978 1.00 0.00 C ATOM 0 H LEU A 87 -13.714 -10.523 -5.132 1.00 0.00 H new ATOM 0 HA LEU A 87 -16.053 -9.797 -3.484 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -13.889 -7.870 -4.366 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -15.156 -7.603 -3.185 1.00 0.00 H new ATOM 0 HG LEU A 87 -13.199 -7.761 -1.943 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -13.402 -9.811 -0.604 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -14.982 -9.071 -0.956 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -14.454 -10.513 -1.856 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -11.529 -9.559 -2.152 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -12.449 -10.241 -3.515 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -11.712 -8.627 -3.658 1.00 0.00 H new ATOM 1364 N PRO A 88 -16.875 -9.716 -6.079 1.00 0.00 N ATOM 1365 CA PRO A 88 -17.520 -9.314 -7.331 1.00 0.00 C ATOM 1366 C PRO A 88 -18.576 -8.233 -7.113 1.00 0.00 C ATOM 1367 O PRO A 88 -18.411 -7.094 -7.554 1.00 0.00 O ATOM 1368 CB PRO A 88 -18.165 -10.615 -7.847 1.00 0.00 C ATOM 1369 CG PRO A 88 -17.731 -11.692 -6.898 1.00 0.00 C ATOM 1370 CD PRO A 88 -17.396 -11.002 -5.608 1.00 0.00 C ATOM 0 HA PRO A 88 -16.810 -8.878 -8.034 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -19.251 -10.530 -7.871 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -17.840 -10.836 -8.864 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -18.524 -12.426 -6.753 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -16.867 -12.230 -7.288 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -18.272 -10.879 -4.971 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -16.656 -11.555 -5.029 1.00 0.00 H new ATOM 1378 N SER A 89 -19.650 -8.587 -6.417 1.00 0.00 N ATOM 1379 CA SER A 89 -20.712 -7.637 -6.108 1.00 0.00 C ATOM 1380 C SER A 89 -20.235 -6.659 -5.033 1.00 0.00 C ATOM 1381 O SER A 89 -20.797 -5.584 -4.844 1.00 0.00 O ATOM 1382 CB SER A 89 -21.968 -8.390 -5.649 1.00 0.00 C ATOM 1383 OG SER A 89 -23.101 -7.538 -5.584 1.00 0.00 O ATOM 0 H SER A 89 -19.809 -9.527 -6.055 1.00 0.00 H new ATOM 0 HA SER A 89 -20.963 -7.067 -7.003 1.00 0.00 H new ATOM 0 HB2 SER A 89 -22.170 -9.211 -6.336 1.00 0.00 H new ATOM 0 HB3 SER A 89 -21.789 -8.831 -4.669 1.00 0.00 H new ATOM 0 HG SER A 89 -23.881 -8.053 -5.290 1.00 0.00 H new ATOM 1389 N LEU A 90 -19.182 -7.058 -4.331 1.00 0.00 N ATOM 1390 CA LEU A 90 -18.608 -6.258 -3.255 1.00 0.00 C ATOM 1391 C LEU A 90 -17.789 -5.094 -3.798 1.00 0.00 C ATOM 1392 O LEU A 90 -17.715 -4.034 -3.167 1.00 0.00 O ATOM 1393 CB LEU A 90 -17.716 -7.140 -2.386 1.00 0.00 C ATOM 1394 CG LEU A 90 -18.424 -8.310 -1.727 1.00 0.00 C ATOM 1395 CD1 LEU A 90 -17.407 -9.328 -1.247 1.00 0.00 C ATOM 1396 CD2 LEU A 90 -19.271 -7.820 -0.573 1.00 0.00 C ATOM 0 H LEU A 90 -18.702 -7.944 -4.491 1.00 0.00 H new ATOM 0 HA LEU A 90 -19.428 -5.850 -2.664 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -16.902 -7.525 -3.000 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -17.265 -6.523 -1.609 1.00 0.00 H new ATOM 0 HG LEU A 90 -19.077 -8.789 -2.457 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -17.924 -10.164 -0.775 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -16.828 -9.692 -2.096 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -16.738 -8.861 -0.524 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -19.775 -8.666 -0.107 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -18.635 -7.327 0.162 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -20.014 -7.113 -0.942 1.00 0.00 H new ATOM 1408 N ASP A 91 -17.194 -5.301 -4.971 1.00 0.00 N ATOM 1409 CA ASP A 91 -16.235 -4.350 -5.546 1.00 0.00 C ATOM 1410 C ASP A 91 -16.810 -2.943 -5.627 1.00 0.00 C ATOM 1411 O ASP A 91 -16.167 -1.984 -5.216 1.00 0.00 O ATOM 1412 CB ASP A 91 -15.810 -4.798 -6.948 1.00 0.00 C ATOM 1413 CG ASP A 91 -14.711 -3.929 -7.541 1.00 0.00 C ATOM 1414 OD1 ASP A 91 -15.024 -2.875 -8.142 1.00 0.00 O1- ATOM 1415 OD2 ASP A 91 -13.524 -4.298 -7.415 1.00 0.00 O ATOM 0 H ASP A 91 -17.359 -6.125 -5.549 1.00 0.00 H new ATOM 0 HA ASP A 91 -15.369 -4.332 -4.884 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -15.465 -5.831 -6.905 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -16.677 -4.779 -7.608 1.00 0.00 H new ATOM 1420 N ARG A 92 -18.039 -2.838 -6.106 1.00 0.00 N ATOM 1421 CA ARG A 92 -18.642 -1.540 -6.388 1.00 0.00 C ATOM 1422 C ARG A 92 -18.580 -0.589 -5.186 1.00 0.00 C ATOM 1423 O ARG A 92 -18.109 0.531 -5.319 1.00 0.00 O ATOM 1424 CB ARG A 92 -20.090 -1.724 -6.857 1.00 0.00 C ATOM 1425 CG ARG A 92 -20.961 -2.497 -5.879 1.00 0.00 C ATOM 1426 CD ARG A 92 -22.297 -2.877 -6.490 1.00 0.00 C ATOM 1427 NE ARG A 92 -22.140 -3.876 -7.543 1.00 0.00 N ATOM 1428 CZ ARG A 92 -23.117 -4.672 -7.970 1.00 0.00 C ATOM 1429 NH1 ARG A 92 -24.344 -4.555 -7.473 1.00 0.00 N1+ ATOM 1430 NH2 ARG A 92 -22.866 -5.583 -8.898 1.00 0.00 N ATOM 0 H ARG A 92 -18.641 -3.636 -6.309 1.00 0.00 H new ATOM 0 HA ARG A 92 -18.059 -1.077 -7.185 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -20.534 -0.743 -7.027 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -20.088 -2.243 -7.815 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -20.438 -3.399 -5.561 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -21.128 -1.894 -4.987 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -22.956 -3.266 -5.714 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -22.777 -1.988 -6.899 1.00 0.00 H new ATOM 0 HE ARG A 92 -21.223 -3.970 -7.979 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -24.541 -3.852 -6.760 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -25.089 -5.168 -7.804 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -21.926 -5.673 -9.283 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -23.613 -6.195 -9.227 1.00 0.00 H new ATOM 1444 N GLU A 93 -19.022 -1.042 -4.018 1.00 0.00 N ATOM 1445 CA GLU A 93 -19.123 -0.180 -2.852 1.00 0.00 C ATOM 1446 C GLU A 93 -17.772 0.092 -2.176 1.00 0.00 C ATOM 1447 O GLU A 93 -17.363 1.252 -1.999 1.00 0.00 O ATOM 1448 CB GLU A 93 -20.072 -0.824 -1.851 1.00 0.00 C ATOM 1449 CG GLU A 93 -21.508 -0.333 -1.947 1.00 0.00 C ATOM 1450 CD GLU A 93 -22.220 -0.818 -3.194 1.00 0.00 C ATOM 1451 OE1 GLU A 93 -22.608 -2.006 -3.237 1.00 0.00 O1- ATOM 1452 OE2 GLU A 93 -22.399 -0.016 -4.132 1.00 0.00 O ATOM 0 H GLU A 93 -19.316 -2.005 -3.856 1.00 0.00 H new ATOM 0 HA GLU A 93 -19.498 0.785 -3.192 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -20.059 -1.904 -1.998 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -19.702 -0.635 -0.843 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -22.059 -0.667 -1.068 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -21.515 0.757 -1.933 1.00 0.00 H new ATOM 1459 N ILE A 94 -17.069 -0.973 -1.807 1.00 0.00 N ATOM 1460 CA ILE A 94 -15.852 -0.830 -1.013 1.00 0.00 C ATOM 1461 C ILE A 94 -14.730 -0.205 -1.826 1.00 0.00 C ATOM 1462 O ILE A 94 -13.899 0.536 -1.296 1.00 0.00 O ATOM 1463 CB ILE A 94 -15.374 -2.170 -0.412 1.00 0.00 C ATOM 1464 CG1 ILE A 94 -15.261 -3.251 -1.493 1.00 0.00 C ATOM 1465 CG2 ILE A 94 -16.316 -2.612 0.705 1.00 0.00 C ATOM 1466 CD1 ILE A 94 -14.734 -4.574 -0.979 1.00 0.00 C ATOM 0 H ILE A 94 -17.316 -1.935 -2.041 1.00 0.00 H new ATOM 0 HA ILE A 94 -16.108 -0.166 -0.187 1.00 0.00 H new ATOM 0 HB ILE A 94 -14.380 -2.022 0.011 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -16.243 -3.410 -1.939 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -14.605 -2.892 -2.286 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -15.969 -3.558 1.121 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -16.331 -1.855 1.489 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -17.321 -2.739 0.304 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -14.682 -5.289 -1.800 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -13.738 -4.431 -0.559 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -15.402 -4.956 -0.207 1.00 0.00 H new ATOM 1478 N GLN A 95 -14.708 -0.490 -3.112 1.00 0.00 N ATOM 1479 CA GLN A 95 -13.731 0.101 -3.981 1.00 0.00 C ATOM 1480 C GLN A 95 -14.184 1.478 -4.432 1.00 0.00 C ATOM 1481 O GLN A 95 -13.393 2.270 -4.911 1.00 0.00 O ATOM 1482 CB GLN A 95 -13.511 -0.769 -5.188 1.00 0.00 C ATOM 1483 CG GLN A 95 -13.131 -2.212 -4.867 1.00 0.00 C ATOM 1484 CD GLN A 95 -11.764 -2.348 -4.238 1.00 0.00 C ATOM 1485 OE1 GLN A 95 -10.873 -1.532 -4.466 1.00 0.00 O ATOM 1486 NE2 GLN A 95 -11.581 -3.403 -3.465 1.00 0.00 N ATOM 0 H GLN A 95 -15.358 -1.128 -3.571 1.00 0.00 H new ATOM 0 HA GLN A 95 -12.797 0.194 -3.427 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -14.420 -0.771 -5.789 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -12.725 -0.327 -5.800 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -13.876 -2.635 -4.193 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -13.161 -2.800 -5.784 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -12.348 -4.055 -3.302 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -10.673 -3.566 -3.031 1.00 0.00 H new ATOM 1495 N ALA A 96 -15.465 1.756 -4.304 1.00 0.00 N ATOM 1496 CA ALA A 96 -15.966 3.075 -4.662 1.00 0.00 C ATOM 1497 C ALA A 96 -15.193 4.141 -3.910 1.00 0.00 C ATOM 1498 O ALA A 96 -14.583 5.016 -4.522 1.00 0.00 O ATOM 1499 CB ALA A 96 -17.452 3.211 -4.364 1.00 0.00 C ATOM 0 H ALA A 96 -16.170 1.103 -3.962 1.00 0.00 H new ATOM 0 HA ALA A 96 -15.826 3.205 -5.735 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -17.790 4.209 -4.644 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -18.007 2.466 -4.935 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -17.625 3.055 -3.299 1.00 0.00 H new ATOM 1505 N LEU A 97 -15.152 4.048 -2.590 1.00 0.00 N ATOM 1506 CA LEU A 97 -14.378 5.025 -1.837 1.00 0.00 C ATOM 1507 C LEU A 97 -12.867 4.759 -1.930 1.00 0.00 C ATOM 1508 O LEU A 97 -12.113 5.650 -2.309 1.00 0.00 O ATOM 1509 CB LEU A 97 -14.888 5.225 -0.381 1.00 0.00 C ATOM 1510 CG LEU A 97 -14.714 4.117 0.685 1.00 0.00 C ATOM 1511 CD1 LEU A 97 -15.205 2.751 0.234 1.00 0.00 C ATOM 1512 CD2 LEU A 97 -13.292 4.071 1.245 1.00 0.00 C ATOM 0 H LEU A 97 -15.625 3.336 -2.034 1.00 0.00 H new ATOM 0 HA LEU A 97 -14.545 5.988 -2.319 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -14.402 6.120 0.007 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -15.954 5.443 -0.444 1.00 0.00 H new ATOM 0 HG LEU A 97 -15.371 4.400 1.508 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -15.050 2.027 1.034 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -16.267 2.807 -0.005 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -14.650 2.439 -0.651 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -13.219 3.278 1.989 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -12.588 3.875 0.436 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -13.053 5.028 1.710 1.00 0.00 H new ATOM 1524 N VAL A 98 -12.434 3.538 -1.629 1.00 0.00 N ATOM 1525 CA VAL A 98 -10.995 3.205 -1.625 1.00 0.00 C ATOM 1526 C VAL A 98 -10.344 3.286 -3.011 1.00 0.00 C ATOM 1527 O VAL A 98 -9.301 3.924 -3.173 1.00 0.00 O ATOM 1528 CB VAL A 98 -10.736 1.793 -1.047 1.00 0.00 C ATOM 1529 CG1 VAL A 98 -9.263 1.418 -1.152 1.00 0.00 C ATOM 1530 CG2 VAL A 98 -11.195 1.722 0.398 1.00 0.00 C ATOM 0 H VAL A 98 -13.047 2.760 -1.385 1.00 0.00 H new ATOM 0 HA VAL A 98 -10.538 3.963 -0.988 1.00 0.00 H new ATOM 0 HB VAL A 98 -11.310 1.077 -1.636 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -9.111 0.421 -0.738 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -8.959 1.427 -2.199 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -8.664 2.138 -0.594 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -11.006 0.723 0.791 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -10.647 2.454 0.990 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -12.262 1.938 0.452 1.00 0.00 H new ATOM 1540 N LYS A 99 -10.961 2.661 -4.008 1.00 0.00 N ATOM 1541 CA LYS A 99 -10.348 2.540 -5.332 1.00 0.00 C ATOM 1542 C LYS A 99 -10.403 3.874 -6.084 1.00 0.00 C ATOM 1543 O LYS A 99 -9.539 4.162 -6.910 1.00 0.00 O ATOM 1544 CB LYS A 99 -11.034 1.423 -6.147 1.00 0.00 C ATOM 1545 CG LYS A 99 -10.364 1.118 -7.479 1.00 0.00 C ATOM 1546 CD LYS A 99 -11.159 0.104 -8.292 1.00 0.00 C ATOM 1547 CE LYS A 99 -11.265 -1.238 -7.581 1.00 0.00 C ATOM 1548 NZ LYS A 99 -12.109 -2.200 -8.338 1.00 0.00 N1+ ATOM 0 H LYS A 99 -11.882 2.231 -3.928 1.00 0.00 H new ATOM 0 HA LYS A 99 -9.300 2.272 -5.199 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -11.055 0.513 -5.548 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -12.070 1.708 -6.331 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -10.257 2.039 -8.052 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -9.359 0.734 -7.301 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -12.159 0.494 -8.481 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -10.683 -0.036 -9.262 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -10.268 -1.657 -7.446 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -11.686 -1.090 -6.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -12.395 -2.979 -7.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -12.956 -1.713 -8.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -11.567 -2.582 -9.139 1.00 0.00 H new ATOM 1562 N ARG A 100 -11.417 4.691 -5.798 1.00 0.00 N ATOM 1563 CA ARG A 100 -11.512 6.009 -6.415 1.00 0.00 C ATOM 1564 C ARG A 100 -10.561 6.995 -5.739 1.00 0.00 C ATOM 1565 O ARG A 100 -9.905 7.795 -6.409 1.00 0.00 O ATOM 1566 CB ARG A 100 -12.967 6.504 -6.361 1.00 0.00 C ATOM 1567 CG ARG A 100 -13.189 7.971 -6.715 1.00 0.00 C ATOM 1568 CD ARG A 100 -12.926 8.884 -5.524 1.00 0.00 C ATOM 1569 NE ARG A 100 -13.628 10.159 -5.637 1.00 0.00 N ATOM 1570 CZ ARG A 100 -13.820 10.995 -4.615 1.00 0.00 C ATOM 1571 NH1 ARG A 100 -13.324 10.706 -3.417 1.00 0.00 N1+ ATOM 1572 NH2 ARG A 100 -14.509 12.113 -4.792 1.00 0.00 N ATOM 0 H ARG A 100 -12.173 4.466 -5.152 1.00 0.00 H new ATOM 0 HA ARG A 100 -11.212 5.935 -7.460 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -13.563 5.893 -7.039 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -13.351 6.331 -5.356 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -12.533 8.250 -7.539 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -14.213 8.111 -7.062 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -13.236 8.381 -4.608 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -11.855 9.068 -5.440 1.00 0.00 H new ATOM 0 HE ARG A 100 -13.993 10.426 -6.551 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -12.796 9.844 -3.278 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -13.471 11.346 -2.636 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -14.893 12.335 -5.710 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -14.655 12.751 -4.010 1.00 0.00 H new ATOM 1586 N ALA A 101 -10.493 6.945 -4.414 1.00 0.00 N ATOM 1587 CA ALA A 101 -9.687 7.895 -3.664 1.00 0.00 C ATOM 1588 C ALA A 101 -8.567 7.204 -2.905 1.00 0.00 C ATOM 1589 O ALA A 101 -8.633 7.056 -1.687 1.00 0.00 O ATOM 1590 CB ALA A 101 -10.555 8.687 -2.703 1.00 0.00 C ATOM 0 H ALA A 101 -10.985 6.259 -3.841 1.00 0.00 H new ATOM 0 HA ALA A 101 -9.234 8.578 -4.383 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -9.935 9.393 -2.150 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -11.314 9.232 -3.264 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -11.040 8.005 -2.004 1.00 0.00 H new ATOM 1596 N SER A 102 -7.545 6.774 -3.626 1.00 0.00 N ATOM 1597 CA SER A 102 -6.381 6.179 -2.997 1.00 0.00 C ATOM 1598 C SER A 102 -5.421 7.269 -2.515 1.00 0.00 C ATOM 1599 O SER A 102 -4.797 7.966 -3.315 1.00 0.00 O ATOM 1600 CB SER A 102 -5.692 5.225 -3.969 1.00 0.00 C ATOM 1601 OG SER A 102 -6.622 4.299 -4.506 1.00 0.00 O ATOM 0 H SER A 102 -7.499 6.826 -4.644 1.00 0.00 H new ATOM 0 HA SER A 102 -6.700 5.606 -2.126 1.00 0.00 H new ATOM 0 HB2 SER A 102 -5.229 5.792 -4.776 1.00 0.00 H new ATOM 0 HB3 SER A 102 -4.893 4.690 -3.456 1.00 0.00 H new ATOM 0 HG SER A 102 -7.422 4.274 -3.941 1.00 0.00 H new ATOM 1607 N PRO A 103 -5.336 7.449 -1.191 1.00 0.00 N ATOM 1608 CA PRO A 103 -4.544 8.491 -0.556 1.00 0.00 C ATOM 1609 C PRO A 103 -3.165 8.022 -0.082 1.00 0.00 C ATOM 1610 O PRO A 103 -3.016 6.932 0.466 1.00 0.00 O ATOM 1611 CB PRO A 103 -5.422 8.866 0.649 1.00 0.00 C ATOM 1612 CG PRO A 103 -6.406 7.741 0.823 1.00 0.00 C ATOM 1613 CD PRO A 103 -6.051 6.680 -0.182 1.00 0.00 C ATOM 0 HA PRO A 103 -4.319 9.306 -1.244 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -4.816 8.995 1.546 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -5.938 9.810 0.475 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -6.359 7.342 1.836 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -7.425 8.094 0.666 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -5.428 5.898 0.252 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -6.936 6.193 -0.591 1.00 0.00 H new ATOM 1621 N LEU A 104 -2.163 8.868 -0.291 1.00 0.00 N ATOM 1622 CA LEU A 104 -0.812 8.620 0.206 1.00 0.00 C ATOM 1623 C LEU A 104 -0.441 9.705 1.221 1.00 0.00 C ATOM 1624 O LEU A 104 0.056 10.767 0.849 1.00 0.00 O ATOM 1625 CB LEU A 104 0.182 8.623 -0.961 1.00 0.00 C ATOM 1626 CG LEU A 104 1.639 8.294 -0.609 1.00 0.00 C ATOM 1627 CD1 LEU A 104 1.792 6.837 -0.196 1.00 0.00 C ATOM 1628 CD2 LEU A 104 2.547 8.607 -1.785 1.00 0.00 C ATOM 0 H LEU A 104 -2.262 9.742 -0.807 1.00 0.00 H new ATOM 0 HA LEU A 104 -0.774 7.645 0.692 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -0.161 7.905 -1.706 1.00 0.00 H new ATOM 0 HB3 LEU A 104 0.156 9.606 -1.431 1.00 0.00 H new ATOM 0 HG LEU A 104 1.929 8.915 0.239 1.00 0.00 H new ATOM 0 HD11 LEU A 104 2.835 6.635 0.047 1.00 0.00 H new ATOM 0 HD12 LEU A 104 1.171 6.639 0.678 1.00 0.00 H new ATOM 0 HD13 LEU A 104 1.479 6.191 -1.017 1.00 0.00 H new ATOM 0 HD21 LEU A 104 3.578 8.369 -1.522 1.00 0.00 H new ATOM 0 HD22 LEU A 104 2.245 8.011 -2.646 1.00 0.00 H new ATOM 0 HD23 LEU A 104 2.471 9.666 -2.032 1.00 0.00 H new ATOM 1640 N PRO A 105 -0.707 9.466 2.516 1.00 0.00 N ATOM 1641 CA PRO A 105 -0.506 10.478 3.556 1.00 0.00 C ATOM 1642 C PRO A 105 0.947 10.622 3.995 1.00 0.00 C ATOM 1643 O PRO A 105 1.420 11.733 4.244 1.00 0.00 O ATOM 1644 CB PRO A 105 -1.370 9.975 4.709 1.00 0.00 C ATOM 1645 CG PRO A 105 -1.480 8.499 4.519 1.00 0.00 C ATOM 1646 CD PRO A 105 -1.232 8.203 3.060 1.00 0.00 C ATOM 0 HA PRO A 105 -0.774 11.472 3.198 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -0.916 10.213 5.671 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -2.353 10.446 4.696 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -0.754 7.978 5.143 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -2.468 8.148 4.818 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -0.518 7.389 2.935 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -2.149 7.903 2.554 1.00 0.00 H new ATOM 1654 N THR A 106 1.643 9.507 4.099 1.00 0.00 N ATOM 1655 CA THR A 106 3.036 9.519 4.503 1.00 0.00 C ATOM 1656 C THR A 106 3.928 9.321 3.284 1.00 0.00 C ATOM 1657 O THR A 106 3.937 8.245 2.694 1.00 0.00 O ATOM 1658 CB THR A 106 3.315 8.421 5.546 1.00 0.00 C ATOM 1659 OG1 THR A 106 2.366 8.523 6.620 1.00 0.00 O ATOM 1660 CG2 THR A 106 4.726 8.549 6.100 1.00 0.00 C ATOM 0 H THR A 106 1.266 8.579 3.909 1.00 0.00 H new ATOM 0 HA THR A 106 3.256 10.485 4.958 1.00 0.00 H new ATOM 0 HB THR A 106 3.219 7.450 5.060 1.00 0.00 H new ATOM 0 HG1 THR A 106 2.544 7.822 7.282 1.00 0.00 H new ATOM 0 HG21 THR A 106 4.901 7.763 6.835 1.00 0.00 H new ATOM 0 HG22 THR A 106 5.446 8.453 5.287 1.00 0.00 H new ATOM 0 HG23 THR A 106 4.843 9.523 6.575 1.00 0.00 H new ATOM 1668 N PRO A 107 4.666 10.372 2.888 1.00 0.00 N ATOM 1669 CA PRO A 107 5.506 10.358 1.682 1.00 0.00 C ATOM 1670 C PRO A 107 6.601 9.294 1.731 1.00 0.00 C ATOM 1671 O PRO A 107 7.578 9.425 2.469 1.00 0.00 O ATOM 1672 CB PRO A 107 6.133 11.759 1.656 1.00 0.00 C ATOM 1673 CG PRO A 107 5.260 12.590 2.529 1.00 0.00 C ATOM 1674 CD PRO A 107 4.743 11.663 3.590 1.00 0.00 C ATOM 0 HA PRO A 107 4.919 10.119 0.796 1.00 0.00 H new ATOM 0 HB2 PRO A 107 7.158 11.739 2.027 1.00 0.00 H new ATOM 0 HB3 PRO A 107 6.169 12.156 0.642 1.00 0.00 H new ATOM 0 HG2 PRO A 107 5.819 13.415 2.969 1.00 0.00 H new ATOM 0 HG3 PRO A 107 4.441 13.028 1.959 1.00 0.00 H new ATOM 0 HD2 PRO A 107 5.413 11.617 4.448 1.00 0.00 H new ATOM 0 HD3 PRO A 107 3.769 11.979 3.963 1.00 0.00 H new ATOM 1682 N PRO A 108 6.448 8.224 0.938 1.00 0.00 N ATOM 1683 CA PRO A 108 7.426 7.151 0.847 1.00 0.00 C ATOM 1684 C PRO A 108 8.460 7.424 -0.235 1.00 0.00 C ATOM 1685 O PRO A 108 8.512 6.732 -1.255 1.00 0.00 O ATOM 1686 CB PRO A 108 6.549 5.959 0.476 1.00 0.00 C ATOM 1687 CG PRO A 108 5.500 6.546 -0.406 1.00 0.00 C ATOM 1688 CD PRO A 108 5.288 7.964 0.067 1.00 0.00 C ATOM 0 HA PRO A 108 8.006 7.012 1.759 1.00 0.00 H new ATOM 0 HB2 PRO A 108 7.120 5.188 -0.041 1.00 0.00 H new ATOM 0 HB3 PRO A 108 6.113 5.493 1.360 1.00 0.00 H new ATOM 0 HG2 PRO A 108 5.815 6.528 -1.449 1.00 0.00 H new ATOM 0 HG3 PRO A 108 4.575 5.973 -0.343 1.00 0.00 H new ATOM 0 HD2 PRO A 108 5.251 8.663 -0.769 1.00 0.00 H new ATOM 0 HD3 PRO A 108 4.349 8.068 0.611 1.00 0.00 H new ATOM 1696 N ALA A 109 9.271 8.450 -0.020 1.00 0.00 N ATOM 1697 CA ALA A 109 10.319 8.803 -0.964 1.00 0.00 C ATOM 1698 C ALA A 109 11.247 7.625 -1.189 1.00 0.00 C ATOM 1699 O ALA A 109 11.614 7.311 -2.321 1.00 0.00 O ATOM 1700 CB ALA A 109 11.105 10.007 -0.476 1.00 0.00 C ATOM 0 H ALA A 109 9.222 9.053 0.801 1.00 0.00 H new ATOM 0 HA ALA A 109 9.848 9.064 -1.912 1.00 0.00 H new ATOM 0 HB1 ALA A 109 11.883 10.251 -1.199 1.00 0.00 H new ATOM 0 HB2 ALA A 109 10.434 10.858 -0.364 1.00 0.00 H new ATOM 0 HB3 ALA A 109 11.563 9.777 0.486 1.00 0.00 H new ATOM 1706 N ASP A 110 11.563 6.935 -0.100 1.00 0.00 N ATOM 1707 CA ASP A 110 12.478 5.803 -0.136 1.00 0.00 C ATOM 1708 C ASP A 110 11.816 4.591 -0.777 1.00 0.00 C ATOM 1709 O ASP A 110 12.413 3.516 -0.866 1.00 0.00 O ATOM 1710 CB ASP A 110 12.940 5.446 1.279 1.00 0.00 C ATOM 1711 CG ASP A 110 13.605 6.604 1.994 1.00 0.00 C ATOM 1712 OD1 ASP A 110 12.880 7.498 2.490 1.00 0.00 O1- ATOM 1713 OD2 ASP A 110 14.846 6.629 2.066 1.00 0.00 O ATOM 0 H ASP A 110 11.194 7.143 0.828 1.00 0.00 H new ATOM 0 HA ASP A 110 13.342 6.089 -0.735 1.00 0.00 H new ATOM 0 HB2 ASP A 110 12.082 5.111 1.862 1.00 0.00 H new ATOM 0 HB3 ASP A 110 13.637 4.609 1.228 1.00 0.00 H new ATOM 1718 N ALA A 111 10.575 4.764 -1.209 1.00 0.00 N ATOM 1719 CA ALA A 111 9.826 3.687 -1.826 1.00 0.00 C ATOM 1720 C ALA A 111 9.603 3.936 -3.316 1.00 0.00 C ATOM 1721 O ALA A 111 9.471 2.987 -4.085 1.00 0.00 O ATOM 1722 CB ALA A 111 8.496 3.489 -1.116 1.00 0.00 C ATOM 0 H ALA A 111 10.067 5.646 -1.141 1.00 0.00 H new ATOM 0 HA ALA A 111 10.417 2.777 -1.728 1.00 0.00 H new ATOM 0 HB1 ALA A 111 7.947 2.677 -1.592 1.00 0.00 H new ATOM 0 HB2 ALA A 111 8.675 3.241 -0.070 1.00 0.00 H new ATOM 0 HB3 ALA A 111 7.911 4.407 -1.176 1.00 0.00 H new ATOM 1728 N TYR A 112 9.557 5.202 -3.742 1.00 0.00 N ATOM 1729 CA TYR A 112 9.341 5.475 -5.159 1.00 0.00 C ATOM 1730 C TYR A 112 10.584 5.920 -5.878 1.00 0.00 C ATOM 1731 O TYR A 112 10.516 6.450 -6.988 1.00 0.00 O ATOM 1732 CB TYR A 112 8.181 6.409 -5.472 1.00 0.00 C ATOM 1733 CG TYR A 112 7.908 7.562 -4.548 1.00 0.00 C ATOM 1734 CD1 TYR A 112 8.845 8.548 -4.287 1.00 0.00 C ATOM 1735 CD2 TYR A 112 6.660 7.669 -3.968 1.00 0.00 C ATOM 1736 CE1 TYR A 112 8.535 9.609 -3.455 1.00 0.00 C ATOM 1737 CE2 TYR A 112 6.337 8.713 -3.145 1.00 0.00 C ATOM 1738 CZ TYR A 112 7.277 9.687 -2.884 1.00 0.00 C ATOM 1739 OH TYR A 112 6.965 10.736 -2.050 1.00 0.00 O ATOM 0 H TYR A 112 9.663 6.025 -3.148 1.00 0.00 H new ATOM 0 HA TYR A 112 9.054 4.498 -5.547 1.00 0.00 H new ATOM 0 HB2 TYR A 112 8.346 6.818 -6.469 1.00 0.00 H new ATOM 0 HB3 TYR A 112 7.275 5.805 -5.521 1.00 0.00 H new ATOM 0 HD1 TYR A 112 9.825 8.488 -4.736 1.00 0.00 H new ATOM 0 HD2 TYR A 112 5.919 6.909 -4.169 1.00 0.00 H new ATOM 0 HE1 TYR A 112 9.271 10.373 -3.252 1.00 0.00 H new ATOM 0 HE2 TYR A 112 5.353 8.774 -2.703 1.00 0.00 H new ATOM 0 HH TYR A 112 6.042 10.640 -1.735 1.00 0.00 H new ATOM 1749 N VAL A 113 11.712 5.691 -5.266 1.00 0.00 N ATOM 1750 CA VAL A 113 12.964 5.846 -5.977 1.00 0.00 C ATOM 1751 C VAL A 113 13.095 4.686 -6.966 1.00 0.00 C ATOM 1752 O VAL A 113 13.691 3.650 -6.675 1.00 0.00 O ATOM 1753 CB VAL A 113 14.186 5.902 -5.026 1.00 0.00 C ATOM 1754 CG1 VAL A 113 14.319 7.291 -4.421 1.00 0.00 C ATOM 1755 CG2 VAL A 113 14.074 4.866 -3.913 1.00 0.00 C ATOM 0 H VAL A 113 11.798 5.401 -4.292 1.00 0.00 H new ATOM 0 HA VAL A 113 12.953 6.800 -6.504 1.00 0.00 H new ATOM 0 HB VAL A 113 15.074 5.675 -5.615 1.00 0.00 H new ATOM 0 HG11 VAL A 113 15.181 7.317 -3.755 1.00 0.00 H new ATOM 0 HG12 VAL A 113 14.454 8.023 -5.217 1.00 0.00 H new ATOM 0 HG13 VAL A 113 13.418 7.530 -3.857 1.00 0.00 H new ATOM 0 HG21 VAL A 113 14.948 4.933 -3.264 1.00 0.00 H new ATOM 0 HG22 VAL A 113 13.173 5.055 -3.329 1.00 0.00 H new ATOM 0 HG23 VAL A 113 14.021 3.868 -4.349 1.00 0.00 H new ATOM 1765 N ASN A 114 12.536 4.920 -8.156 1.00 0.00 N ATOM 1766 CA ASN A 114 12.358 3.914 -9.212 1.00 0.00 C ATOM 1767 C ASN A 114 11.227 4.373 -10.130 1.00 0.00 C ATOM 1768 O ASN A 114 10.990 3.793 -11.191 1.00 0.00 O ATOM 1769 CB ASN A 114 12.024 2.503 -8.670 1.00 0.00 C ATOM 1770 CG ASN A 114 10.577 2.329 -8.206 1.00 0.00 C ATOM 1771 OD1 ASN A 114 9.970 1.282 -8.425 1.00 0.00 O ATOM 1772 ND2 ASN A 114 10.027 3.327 -7.532 1.00 0.00 N ATOM 0 H ASN A 114 12.184 5.840 -8.421 1.00 0.00 H new ATOM 0 HA ASN A 114 13.306 3.830 -9.743 1.00 0.00 H new ATOM 0 HB2 ASN A 114 12.234 1.769 -9.448 1.00 0.00 H new ATOM 0 HB3 ASN A 114 12.689 2.281 -7.836 1.00 0.00 H new ATOM 0 HD21 ASN A 114 9.074 3.240 -7.178 1.00 0.00 H new ATOM 0 HD22 ASN A 114 10.556 4.183 -7.366 1.00 0.00 H new ATOM 1779 N GLY A 115 10.525 5.420 -9.695 1.00 0.00 N ATOM 1780 CA GLY A 115 9.421 5.967 -10.460 1.00 0.00 C ATOM 1781 C GLY A 115 8.356 6.582 -9.566 1.00 0.00 C ATOM 1782 O GLY A 115 8.300 7.800 -9.396 1.00 0.00 O ATOM 0 H GLY A 115 10.707 5.902 -8.815 1.00 0.00 H new ATOM 0 HA2 GLY A 115 9.797 6.724 -11.148 1.00 0.00 H new ATOM 0 HA3 GLY A 115 8.974 5.179 -11.066 1.00 0.00 H new ATOM 1786 N THR A 116 7.509 5.731 -9.006 1.00 0.00 N ATOM 1787 CA THR A 116 6.427 6.135 -8.126 1.00 0.00 C ATOM 1788 C THR A 116 6.092 4.921 -7.258 1.00 0.00 C ATOM 1789 O THR A 116 6.692 3.860 -7.459 1.00 0.00 O ATOM 1790 CB THR A 116 5.188 6.591 -8.930 1.00 0.00 C ATOM 1791 OG1 THR A 116 5.596 7.207 -10.159 1.00 0.00 O ATOM 1792 CG2 THR A 116 4.366 7.594 -8.139 1.00 0.00 C ATOM 0 H THR A 116 7.557 4.723 -9.154 1.00 0.00 H new ATOM 0 HA THR A 116 6.728 6.985 -7.514 1.00 0.00 H new ATOM 0 HB THR A 116 4.583 5.708 -9.134 1.00 0.00 H new ATOM 0 HG1 THR A 116 4.804 7.491 -10.661 1.00 0.00 H new ATOM 0 HG21 THR A 116 3.500 7.899 -8.727 1.00 0.00 H new ATOM 0 HG22 THR A 116 4.030 7.136 -7.209 1.00 0.00 H new ATOM 0 HG23 THR A 116 4.977 8.468 -7.913 1.00 0.00 H new ATOM 1800 N VAL A 117 5.178 5.030 -6.298 1.00 0.00 N ATOM 1801 CA VAL A 117 4.909 3.883 -5.448 1.00 0.00 C ATOM 1802 C VAL A 117 3.670 3.163 -5.919 1.00 0.00 C ATOM 1803 O VAL A 117 2.549 3.631 -5.755 1.00 0.00 O ATOM 1804 CB VAL A 117 4.711 4.247 -3.947 1.00 0.00 C ATOM 1805 CG1 VAL A 117 6.025 4.601 -3.284 1.00 0.00 C ATOM 1806 CG2 VAL A 117 3.706 5.379 -3.762 1.00 0.00 C ATOM 0 H VAL A 117 4.632 5.867 -6.096 1.00 0.00 H new ATOM 0 HA VAL A 117 5.793 3.250 -5.525 1.00 0.00 H new ATOM 0 HB VAL A 117 4.308 3.358 -3.462 1.00 0.00 H new ATOM 0 HG11 VAL A 117 5.849 4.850 -2.237 1.00 0.00 H new ATOM 0 HG12 VAL A 117 6.704 3.751 -3.346 1.00 0.00 H new ATOM 0 HG13 VAL A 117 6.469 5.458 -3.791 1.00 0.00 H new ATOM 0 HG21 VAL A 117 3.599 5.600 -2.700 1.00 0.00 H new ATOM 0 HG22 VAL A 117 4.059 6.268 -4.284 1.00 0.00 H new ATOM 0 HG23 VAL A 117 2.741 5.079 -4.169 1.00 0.00 H new ATOM 1816 N GLU A 118 3.905 2.021 -6.528 1.00 0.00 N ATOM 1817 CA GLU A 118 2.849 1.093 -6.824 1.00 0.00 C ATOM 1818 C GLU A 118 2.988 -0.041 -5.840 1.00 0.00 C ATOM 1819 O GLU A 118 3.931 -0.829 -5.919 1.00 0.00 O ATOM 1820 CB GLU A 118 2.970 0.572 -8.256 1.00 0.00 C ATOM 1821 CG GLU A 118 1.756 -0.211 -8.725 1.00 0.00 C ATOM 1822 CD GLU A 118 1.999 -0.930 -10.036 1.00 0.00 C ATOM 1823 OE1 GLU A 118 2.086 -0.253 -11.083 1.00 0.00 O1- ATOM 1824 OE2 GLU A 118 2.108 -2.178 -10.026 1.00 0.00 O ATOM 0 H GLU A 118 4.831 1.716 -6.828 1.00 0.00 H new ATOM 0 HA GLU A 118 1.874 1.574 -6.740 1.00 0.00 H new ATOM 0 HB2 GLU A 118 3.129 1.415 -8.928 1.00 0.00 H new ATOM 0 HB3 GLU A 118 3.852 -0.064 -8.329 1.00 0.00 H new ATOM 0 HG2 GLU A 118 1.480 -0.938 -7.961 1.00 0.00 H new ATOM 0 HG3 GLU A 118 0.911 0.468 -8.838 1.00 0.00 H new ATOM 1831 N LEU A 119 2.070 -0.122 -4.910 1.00 0.00 N ATOM 1832 CA LEU A 119 2.206 -1.071 -3.831 1.00 0.00 C ATOM 1833 C LEU A 119 0.870 -1.708 -3.514 1.00 0.00 C ATOM 1834 O LEU A 119 -0.184 -1.089 -3.672 1.00 0.00 O ATOM 1835 CB LEU A 119 2.822 -0.388 -2.599 1.00 0.00 C ATOM 1836 CG LEU A 119 1.950 0.652 -1.888 1.00 0.00 C ATOM 1837 CD1 LEU A 119 1.324 0.039 -0.658 1.00 0.00 C ATOM 1838 CD2 LEU A 119 2.769 1.878 -1.511 1.00 0.00 C ATOM 0 H LEU A 119 1.227 0.451 -4.876 1.00 0.00 H new ATOM 0 HA LEU A 119 2.881 -1.869 -4.139 1.00 0.00 H new ATOM 0 HB2 LEU A 119 3.088 -1.161 -1.878 1.00 0.00 H new ATOM 0 HB3 LEU A 119 3.750 0.096 -2.905 1.00 0.00 H new ATOM 0 HG LEU A 119 1.161 0.970 -2.569 1.00 0.00 H new ATOM 0 HD11 LEU A 119 0.705 0.782 -0.156 1.00 0.00 H new ATOM 0 HD12 LEU A 119 0.706 -0.811 -0.949 1.00 0.00 H new ATOM 0 HD13 LEU A 119 2.108 -0.298 0.020 1.00 0.00 H new ATOM 0 HD21 LEU A 119 2.129 2.602 -1.008 1.00 0.00 H new ATOM 0 HD22 LEU A 119 3.579 1.583 -0.843 1.00 0.00 H new ATOM 0 HD23 LEU A 119 3.187 2.327 -2.412 1.00 0.00 H new ATOM 1850 N THR A 120 0.921 -2.957 -3.097 1.00 0.00 N ATOM 1851 CA THR A 120 -0.279 -3.710 -2.827 1.00 0.00 C ATOM 1852 C THR A 120 -0.647 -3.629 -1.352 1.00 0.00 C ATOM 1853 O THR A 120 0.080 -4.124 -0.491 1.00 0.00 O ATOM 1854 CB THR A 120 -0.104 -5.181 -3.231 1.00 0.00 C ATOM 1855 OG1 THR A 120 0.327 -5.270 -4.599 1.00 0.00 O ATOM 1856 CG2 THR A 120 -1.405 -5.937 -3.049 1.00 0.00 C ATOM 0 H THR A 120 1.788 -3.471 -2.938 1.00 0.00 H new ATOM 0 HA THR A 120 -1.083 -3.273 -3.419 1.00 0.00 H new ATOM 0 HB THR A 120 0.655 -5.629 -2.589 1.00 0.00 H new ATOM 0 HG1 THR A 120 0.437 -6.212 -4.847 1.00 0.00 H new ATOM 0 HG21 THR A 120 -1.265 -6.978 -3.340 1.00 0.00 H new ATOM 0 HG22 THR A 120 -1.710 -5.890 -2.004 1.00 0.00 H new ATOM 0 HG23 THR A 120 -2.177 -5.487 -3.673 1.00 0.00 H new ATOM 1864 N LEU A 121 -1.766 -2.989 -1.072 1.00 0.00 N ATOM 1865 CA LEU A 121 -2.282 -2.911 0.278 1.00 0.00 C ATOM 1866 C LEU A 121 -3.598 -3.650 0.372 1.00 0.00 C ATOM 1867 O LEU A 121 -4.509 -3.415 -0.418 1.00 0.00 O ATOM 1868 CB LEU A 121 -2.466 -1.457 0.713 1.00 0.00 C ATOM 1869 CG LEU A 121 -1.168 -0.743 1.060 1.00 0.00 C ATOM 1870 CD1 LEU A 121 -1.436 0.681 1.504 1.00 0.00 C ATOM 1871 CD2 LEU A 121 -0.421 -1.524 2.129 1.00 0.00 C ATOM 0 H LEU A 121 -2.338 -2.512 -1.769 1.00 0.00 H new ATOM 0 HA LEU A 121 -1.558 -3.377 0.947 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -2.966 -0.910 -0.086 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -3.126 -1.429 1.580 1.00 0.00 H new ATOM 0 HG LEU A 121 -0.543 -0.693 0.168 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -0.493 1.170 1.746 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -1.931 1.226 0.700 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -2.077 0.673 2.385 1.00 0.00 H new ATOM 0 HD21 LEU A 121 0.508 -1.009 2.374 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -1.040 -1.601 3.023 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -0.194 -2.523 1.758 1.00 0.00 H new ATOM 1883 N PRO A 122 -3.714 -4.577 1.318 1.00 0.00 N ATOM 1884 CA PRO A 122 -4.949 -5.300 1.516 1.00 0.00 C ATOM 1885 C PRO A 122 -5.974 -4.426 2.206 1.00 0.00 C ATOM 1886 O PRO A 122 -5.758 -3.968 3.331 1.00 0.00 O ATOM 1887 CB PRO A 122 -4.563 -6.479 2.422 1.00 0.00 C ATOM 1888 CG PRO A 122 -3.082 -6.383 2.633 1.00 0.00 C ATOM 1889 CD PRO A 122 -2.679 -4.982 2.271 1.00 0.00 C ATOM 0 HA PRO A 122 -5.394 -5.622 0.574 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -5.095 -6.429 3.372 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -4.828 -7.429 1.958 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -2.825 -6.603 3.669 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -2.556 -7.109 2.013 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -2.657 -4.330 3.144 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -1.685 -4.951 1.825 1.00 0.00 H new ATOM 1897 N ILE A 123 -7.084 -4.187 1.539 1.00 0.00 N ATOM 1898 CA ILE A 123 -8.179 -3.502 2.172 1.00 0.00 C ATOM 1899 C ILE A 123 -9.104 -4.568 2.741 1.00 0.00 C ATOM 1900 O ILE A 123 -9.905 -5.189 2.038 1.00 0.00 O ATOM 1901 CB ILE A 123 -8.921 -2.535 1.198 1.00 0.00 C ATOM 1902 CG1 ILE A 123 -9.682 -3.283 0.103 1.00 0.00 C ATOM 1903 CG2 ILE A 123 -7.928 -1.569 0.551 1.00 0.00 C ATOM 1904 CD1 ILE A 123 -10.569 -2.381 -0.726 1.00 0.00 C ATOM 0 H ILE A 123 -7.246 -4.456 0.569 1.00 0.00 H new ATOM 0 HA ILE A 123 -7.807 -2.859 2.969 1.00 0.00 H new ATOM 0 HB ILE A 123 -9.647 -1.983 1.794 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -8.967 -3.781 -0.552 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -10.292 -4.062 0.560 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -8.459 -0.900 -0.126 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -7.433 -0.983 1.326 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.182 -2.134 -0.008 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -11.081 -2.972 -1.485 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -11.306 -1.902 -0.081 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -9.960 -1.617 -1.210 1.00 0.00 H new ATOM 1916 N ASP A 124 -8.945 -4.844 4.014 1.00 0.00 N ATOM 1917 CA ASP A 124 -9.653 -5.960 4.589 1.00 0.00 C ATOM 1918 C ASP A 124 -10.900 -5.523 5.324 1.00 0.00 C ATOM 1919 O ASP A 124 -10.870 -4.699 6.239 1.00 0.00 O ATOM 1920 CB ASP A 124 -8.734 -6.762 5.517 1.00 0.00 C ATOM 1921 CG ASP A 124 -8.105 -5.921 6.615 1.00 0.00 C ATOM 1922 OD1 ASP A 124 -7.269 -5.043 6.298 1.00 0.00 O1- ATOM 1923 OD2 ASP A 124 -8.423 -6.150 7.801 1.00 0.00 O ATOM 0 H ASP A 124 -8.347 -4.325 4.657 1.00 0.00 H new ATOM 0 HA ASP A 124 -9.969 -6.601 3.766 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -9.305 -7.572 5.971 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -7.944 -7.223 4.924 1.00 0.00 H new ATOM 1928 N PHE A 125 -12.002 -6.074 4.870 1.00 0.00 N ATOM 1929 CA PHE A 125 -13.250 -6.042 5.590 1.00 0.00 C ATOM 1930 C PHE A 125 -13.585 -7.477 5.966 1.00 0.00 C ATOM 1931 O PHE A 125 -13.293 -8.396 5.198 1.00 0.00 O ATOM 1932 CB PHE A 125 -14.351 -5.431 4.718 1.00 0.00 C ATOM 1933 CG PHE A 125 -14.061 -4.024 4.257 1.00 0.00 C ATOM 1934 CD1 PHE A 125 -13.363 -3.793 3.078 1.00 0.00 C ATOM 1935 CD2 PHE A 125 -14.488 -2.932 4.997 1.00 0.00 C ATOM 1936 CE1 PHE A 125 -13.097 -2.507 2.651 1.00 0.00 C ATOM 1937 CE2 PHE A 125 -14.224 -1.644 4.572 1.00 0.00 C ATOM 1938 CZ PHE A 125 -13.527 -1.431 3.399 1.00 0.00 C ATOM 0 H PHE A 125 -12.055 -6.564 3.977 1.00 0.00 H new ATOM 0 HA PHE A 125 -13.170 -5.425 6.485 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -14.501 -6.065 3.844 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -15.286 -5.433 5.278 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -13.024 -4.631 2.487 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -15.033 -3.090 5.916 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -12.553 -2.344 1.732 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -14.563 -0.803 5.158 1.00 0.00 H new ATOM 0 HZ PHE A 125 -13.319 -0.424 3.068 1.00 0.00 H new ATOM 1948 N SER A 126 -14.148 -7.691 7.139 1.00 0.00 N ATOM 1949 CA SER A 126 -14.514 -9.036 7.546 1.00 0.00 C ATOM 1950 C SER A 126 -15.620 -9.579 6.643 1.00 0.00 C ATOM 1951 O SER A 126 -16.788 -9.210 6.775 1.00 0.00 O ATOM 1952 CB SER A 126 -14.946 -9.044 9.009 1.00 0.00 C ATOM 1953 OG SER A 126 -13.920 -8.517 9.838 1.00 0.00 O ATOM 0 H SER A 126 -14.360 -6.962 7.820 1.00 0.00 H new ATOM 0 HA SER A 126 -13.645 -9.687 7.445 1.00 0.00 H new ATOM 0 HB2 SER A 126 -15.855 -8.455 9.128 1.00 0.00 H new ATOM 0 HB3 SER A 126 -15.183 -10.062 9.318 1.00 0.00 H new ATOM 0 HG SER A 126 -14.216 -8.529 10.772 1.00 0.00 H new ATOM 1959 N LEU A 127 -15.227 -10.458 5.725 1.00 0.00 N ATOM 1960 CA LEU A 127 -16.125 -11.031 4.726 1.00 0.00 C ATOM 1961 C LEU A 127 -17.032 -12.090 5.355 1.00 0.00 C ATOM 1962 O LEU A 127 -16.989 -13.263 4.987 1.00 0.00 O ATOM 1963 CB LEU A 127 -15.288 -11.650 3.599 1.00 0.00 C ATOM 1964 CG LEU A 127 -15.776 -11.385 2.173 1.00 0.00 C ATOM 1965 CD1 LEU A 127 -14.731 -11.821 1.165 1.00 0.00 C ATOM 1966 CD2 LEU A 127 -17.088 -12.094 1.899 1.00 0.00 C ATOM 0 H LEU A 127 -14.267 -10.796 5.653 1.00 0.00 H new ATOM 0 HA LEU A 127 -16.761 -10.243 4.322 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -14.267 -11.279 3.687 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -15.249 -12.728 3.753 1.00 0.00 H new ATOM 0 HG LEU A 127 -15.941 -10.312 2.073 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -15.095 -11.625 0.156 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -13.809 -11.264 1.333 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -14.537 -12.887 1.280 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -17.408 -11.886 0.878 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -16.954 -13.168 2.025 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -17.846 -11.738 2.596 1.00 0.00 H new ATOM 1978 N ARG A 128 -17.846 -11.666 6.310 1.00 0.00 N ATOM 1979 CA ARG A 128 -18.763 -12.558 6.987 1.00 0.00 C ATOM 1980 C ARG A 128 -19.996 -12.806 6.128 1.00 0.00 C ATOM 1981 O ARG A 128 -20.459 -13.941 6.002 1.00 0.00 O ATOM 1982 CB ARG A 128 -19.166 -11.962 8.333 1.00 0.00 C ATOM 1983 CG ARG A 128 -18.001 -11.789 9.297 1.00 0.00 C ATOM 1984 CD ARG A 128 -18.456 -11.198 10.619 1.00 0.00 C ATOM 1985 NE ARG A 128 -19.011 -9.856 10.458 1.00 0.00 N ATOM 1986 CZ ARG A 128 -20.253 -9.518 10.798 1.00 0.00 C ATOM 1987 NH1 ARG A 128 -21.071 -10.418 11.336 1.00 0.00 N1+ ATOM 1988 NH2 ARG A 128 -20.668 -8.272 10.605 1.00 0.00 N ATOM 0 H ARG A 128 -17.887 -10.699 6.633 1.00 0.00 H new ATOM 0 HA ARG A 128 -18.265 -13.513 7.156 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -19.635 -10.992 8.166 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -19.916 -12.604 8.795 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -17.527 -12.754 9.473 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -17.248 -11.141 8.847 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -19.206 -11.849 11.068 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -17.613 -11.161 11.309 1.00 0.00 H new ATOM 0 HE ARG A 128 -18.410 -9.134 10.061 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -20.748 -11.373 11.490 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -22.021 -10.153 11.595 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -20.037 -7.581 10.199 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -21.618 -8.005 10.863 1.00 0.00 H new ATOM 2002 N GLY A 129 -20.515 -11.741 5.531 1.00 0.00 N ATOM 2003 CA GLY A 129 -21.675 -11.866 4.678 1.00 0.00 C ATOM 2004 C GLY A 129 -22.112 -10.543 4.084 1.00 0.00 C ATOM 2005 O GLY A 129 -22.312 -9.565 4.805 1.00 0.00 O ATOM 0 H GLY A 129 -20.151 -10.793 5.624 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -21.454 -12.566 3.872 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -22.498 -12.291 5.252 1.00 0.00 H new ATOM 2009 N ALA A 130 -22.235 -10.516 2.767 1.00 0.00 N ATOM 2010 CA ALA A 130 -22.726 -9.349 2.048 1.00 0.00 C ATOM 2011 C ALA A 130 -23.513 -9.810 0.832 1.00 0.00 C ATOM 2012 O ALA A 130 -23.067 -9.672 -0.306 1.00 0.00 O ATOM 2013 CB ALA A 130 -21.572 -8.460 1.634 1.00 0.00 C ATOM 0 H ALA A 130 -21.997 -11.304 2.164 1.00 0.00 H new ATOM 0 HA ALA A 130 -23.379 -8.768 2.699 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -21.956 -7.592 1.098 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -21.031 -8.129 2.521 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -20.897 -9.018 0.985 1.00 0.00 H new ATOM 2019 N GLY A 131 -24.684 -10.367 1.089 1.00 0.00 N ATOM 2020 CA GLY A 131 -25.400 -11.094 0.064 1.00 0.00 C ATOM 2021 C GLY A 131 -25.029 -12.558 0.131 1.00 0.00 C ATOM 2022 O GLY A 131 -25.428 -13.367 -0.706 1.00 0.00 O ATOM 0 H GLY A 131 -25.154 -10.329 1.994 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -26.475 -10.974 0.201 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -25.157 -10.691 -0.919 1.00 0.00 H new ATOM 2026 N PHE A 132 -24.237 -12.876 1.144 1.00 0.00 N ATOM 2027 CA PHE A 132 -23.771 -14.210 1.394 1.00 0.00 C ATOM 2028 C PHE A 132 -24.454 -14.758 2.635 1.00 0.00 C ATOM 2029 O PHE A 132 -25.285 -15.676 2.503 1.00 0.00 O ATOM 2030 CB PHE A 132 -22.258 -14.187 1.592 1.00 0.00 C ATOM 2031 CG PHE A 132 -21.492 -13.699 0.394 1.00 0.00 C ATOM 2032 CD1 PHE A 132 -21.300 -14.521 -0.703 1.00 0.00 C ATOM 2033 CD2 PHE A 132 -20.962 -12.418 0.370 1.00 0.00 C ATOM 2034 CE1 PHE A 132 -20.595 -14.075 -1.805 1.00 0.00 C ATOM 2035 CE2 PHE A 132 -20.256 -11.965 -0.729 1.00 0.00 C ATOM 2036 CZ PHE A 132 -20.071 -12.796 -1.819 1.00 0.00 C ATOM 2037 OXT PHE A 132 -24.179 -14.236 3.739 1.00 0.00 O ATOM 0 H PHE A 132 -23.900 -12.193 1.822 1.00 0.00 H new ATOM 0 HA PHE A 132 -24.009 -14.851 0.545 1.00 0.00 H new ATOM 0 HB2 PHE A 132 -22.023 -13.550 2.445 1.00 0.00 H new ATOM 0 HB3 PHE A 132 -21.919 -15.192 1.842 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -21.706 -15.522 -0.698 1.00 0.00 H new ATOM 0 HD2 PHE A 132 -21.102 -11.766 1.220 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -20.454 -14.726 -2.655 1.00 0.00 H new ATOM 0 HE2 PHE A 132 -19.850 -10.964 -0.736 1.00 0.00 H new ATOM 0 HZ PHE A 132 -19.519 -12.447 -2.679 1.00 0.00 H new TER 2047 PHE A 132