USER MOD reduce.3.24.130724 H: found=0, std=0, add=1075, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1071 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 150:sc= 0.625 (180deg=0.248) USER MOD Single : A 7 HIS : no HE2:sc= 0.293 K(o=0.29,f=-1.4) USER MOD Single : A 11 GLN : amide:sc= 0.309 K(o=0.31,f=-3.4!) USER MOD Single : A 12 ASN :FLIP amide:sc= -0.157 F(o=-0.83,f=-0.16) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0.247 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 1.01 K(o=1,f=-1.8!) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= 0.894 K(o=0.89,f=-7.2!) USER MOD Single : A 38 ASN : amide:sc= -0.0668 K(o=-0.067,f=-1.6) USER MOD Single : A 39 CYS SG : rot 6:sc= 0.00858 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 CYS SG : rot 137:sc= 0.675 USER MOD Single : A 45 ASN : amide:sc= -1.16! C(o=-1.2!,f=-4.5!) USER MOD Single : A 49 CYS SG : rot 36:sc= 0.679 USER MOD Single : A 52 CYS SG : rot -144:sc= -0.236 USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 MET CE :methyl -173:sc= 0 (180deg=-0.0669) USER MOD Single : A 61 GLN : amide:sc= 0.0457 X(o=0.046,f=-0.26) USER MOD Single : A 64 CYS SG : rot 180:sc= 0.00584 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 CYS SG : rot 68:sc= 0.574 USER MOD Single : A 70 HIS :FLIP no HD1:sc= -1.31 F(o=-2.5,f=-1.3) USER MOD Single : A 74 THR OG1 : rot -99:sc= 1.72 USER MOD Single : A 75 GLN : amide:sc= 0.547 K(o=0.55,f=-8.5!) USER MOD Single : A 81 GLN : amide:sc=-0.00826 X(o=-0.0083,f=-0.12) USER MOD Single : A 84 GLN : amide:sc= -0.0143 K(o=-0.014,f=-2.1!) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 180:sc= -0.0247 USER MOD Single : A 101 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00482) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 CYS SG : rot 180:sc= 0 USER MOD Single : A 108 CYS SG : rot -37:sc= -0.0477 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 ASN : amide:sc= 1.16 K(o=1.2,f=-3.7!) USER MOD Single : A 124 MET CE :methyl -113:sc=-0.00393 (180deg=-0.113) USER MOD Single : A 128 ASN : amide:sc= 0.125 K(o=0.13,f=-3.3!) USER MOD Single : A 133 MET CE :methyl 174:sc= 0 (180deg=-0.0487) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.442 -16.428 8.756 1.00 0.00 N ATOM 2 CA MET A 1 3.777 -16.974 7.529 1.00 0.00 C ATOM 3 C MET A 1 4.209 -18.438 7.283 1.00 0.00 C ATOM 4 O MET A 1 5.360 -18.771 7.585 1.00 0.00 O ATOM 5 CB MET A 1 4.075 -16.112 6.271 1.00 0.00 C ATOM 6 CG MET A 1 3.394 -14.734 6.228 1.00 0.00 C ATOM 7 SD MET A 1 4.105 -13.465 7.317 1.00 0.00 S ATOM 8 CE MET A 1 3.008 -12.081 6.909 1.00 0.00 C ATOM 0 H1 MET A 1 4.577 -15.402 8.650 1.00 0.00 H new ATOM 0 H2 MET A 1 3.845 -16.615 9.587 1.00 0.00 H new ATOM 0 H3 MET A 1 5.366 -16.887 8.883 1.00 0.00 H new ATOM 0 HA MET A 1 2.702 -16.941 7.705 1.00 0.00 H new ATOM 0 HB2 MET A 1 5.153 -15.966 6.201 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.771 -16.674 5.388 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.427 -14.366 5.203 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.343 -14.861 6.488 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.297 -11.204 7.489 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.088 -11.855 5.846 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.979 -12.350 7.147 1.00 0.00 H new ATOM 18 N PRO A 2 3.329 -19.309 6.726 1.00 0.00 N ATOM 19 CA PRO A 2 3.620 -20.732 6.489 1.00 0.00 C ATOM 20 C PRO A 2 4.513 -20.999 5.263 1.00 0.00 C ATOM 21 O PRO A 2 5.184 -22.030 5.227 1.00 0.00 O ATOM 22 CB PRO A 2 2.247 -21.398 6.321 1.00 0.00 C ATOM 23 CG PRO A 2 1.384 -20.288 5.727 1.00 0.00 C ATOM 24 CD PRO A 2 1.926 -19.031 6.411 1.00 0.00 C ATOM 0 HA PRO A 2 4.194 -21.135 7.323 1.00 0.00 H new ATOM 0 HB2 PRO A 2 2.299 -22.263 5.660 1.00 0.00 H new ATOM 0 HB3 PRO A 2 1.851 -21.748 7.274 1.00 0.00 H new ATOM 0 HG2 PRO A 2 1.485 -20.234 4.643 1.00 0.00 H new ATOM 0 HG3 PRO A 2 0.326 -20.440 5.941 1.00 0.00 H new ATOM 0 HD2 PRO A 2 1.839 -18.164 5.757 1.00 0.00 H new ATOM 0 HD3 PRO A 2 1.361 -18.806 7.316 1.00 0.00 H new ATOM 32 N VAL A 3 4.550 -20.094 4.273 1.00 0.00 N ATOM 33 CA VAL A 3 5.355 -20.217 3.038 1.00 0.00 C ATOM 34 C VAL A 3 5.598 -18.832 2.415 1.00 0.00 C ATOM 35 O VAL A 3 4.791 -17.921 2.607 1.00 0.00 O ATOM 36 CB VAL A 3 4.705 -21.218 2.042 1.00 0.00 C ATOM 37 CG1 VAL A 3 3.359 -20.725 1.484 1.00 0.00 C ATOM 38 CG2 VAL A 3 5.640 -21.581 0.876 1.00 0.00 C ATOM 0 H VAL A 3 4.007 -19.231 4.306 1.00 0.00 H new ATOM 0 HA VAL A 3 6.331 -20.629 3.294 1.00 0.00 H new ATOM 0 HB VAL A 3 4.519 -22.115 2.633 1.00 0.00 H new ATOM 0 HG11 VAL A 3 2.957 -21.468 0.795 1.00 0.00 H new ATOM 0 HG12 VAL A 3 2.658 -20.574 2.305 1.00 0.00 H new ATOM 0 HG13 VAL A 3 3.507 -19.783 0.956 1.00 0.00 H new ATOM 0 HG21 VAL A 3 5.137 -22.283 0.211 1.00 0.00 H new ATOM 0 HG22 VAL A 3 5.899 -20.678 0.323 1.00 0.00 H new ATOM 0 HG23 VAL A 3 6.548 -22.040 1.267 1.00 0.00 H new ATOM 48 N ARG A 4 6.714 -18.672 1.690 1.00 0.00 N ATOM 49 CA ARG A 4 7.155 -17.406 1.078 1.00 0.00 C ATOM 50 C ARG A 4 8.031 -17.636 -0.167 1.00 0.00 C ATOM 51 O ARG A 4 8.683 -18.676 -0.289 1.00 0.00 O ATOM 52 CB ARG A 4 7.867 -16.525 2.131 1.00 0.00 C ATOM 53 CG ARG A 4 9.117 -17.179 2.753 1.00 0.00 C ATOM 54 CD ARG A 4 9.772 -16.271 3.804 1.00 0.00 C ATOM 55 NE ARG A 4 10.894 -16.958 4.475 1.00 0.00 N ATOM 56 CZ ARG A 4 12.152 -17.060 4.054 1.00 0.00 C ATOM 57 NH1 ARG A 4 12.568 -16.523 2.924 1.00 0.00 N ATOM 58 NH2 ARG A 4 13.027 -17.720 4.784 1.00 0.00 N ATOM 0 H ARG A 4 7.356 -19.443 1.506 1.00 0.00 H new ATOM 0 HA ARG A 4 6.270 -16.874 0.729 1.00 0.00 H new ATOM 0 HB2 ARG A 4 8.156 -15.582 1.666 1.00 0.00 H new ATOM 0 HB3 ARG A 4 7.161 -16.285 2.926 1.00 0.00 H new ATOM 0 HG2 ARG A 4 8.840 -18.127 3.214 1.00 0.00 H new ATOM 0 HG3 ARG A 4 9.838 -17.405 1.967 1.00 0.00 H new ATOM 0 HD2 ARG A 4 10.132 -15.359 3.328 1.00 0.00 H new ATOM 0 HD3 ARG A 4 9.030 -15.972 4.544 1.00 0.00 H new ATOM 0 HE ARG A 4 10.679 -17.407 5.365 1.00 0.00 H new ATOM 0 HH11 ARG A 4 11.916 -16.005 2.335 1.00 0.00 H new ATOM 0 HH12 ARG A 4 13.542 -16.625 2.639 1.00 0.00 H new ATOM 0 HH21 ARG A 4 12.738 -18.148 5.664 1.00 0.00 H new ATOM 0 HH22 ARG A 4 13.994 -17.804 4.470 1.00 0.00 H new ATOM 72 N ARG A 5 8.053 -16.650 -1.074 1.00 0.00 N ATOM 73 CA ARG A 5 8.852 -16.652 -2.314 1.00 0.00 C ATOM 74 C ARG A 5 9.886 -15.517 -2.308 1.00 0.00 C ATOM 75 O ARG A 5 9.564 -14.382 -1.950 1.00 0.00 O ATOM 76 CB ARG A 5 7.933 -16.536 -3.545 1.00 0.00 C ATOM 77 CG ARG A 5 7.028 -17.770 -3.712 1.00 0.00 C ATOM 78 CD ARG A 5 6.142 -17.693 -4.965 1.00 0.00 C ATOM 79 NE ARG A 5 6.931 -17.687 -6.214 1.00 0.00 N ATOM 80 CZ ARG A 5 7.466 -18.738 -6.831 1.00 0.00 C ATOM 81 NH1 ARG A 5 7.356 -19.964 -6.359 1.00 0.00 N ATOM 82 NH2 ARG A 5 8.133 -18.563 -7.952 1.00 0.00 N ATOM 0 H ARG A 5 7.499 -15.801 -0.964 1.00 0.00 H new ATOM 0 HA ARG A 5 9.391 -17.598 -2.367 1.00 0.00 H new ATOM 0 HB2 ARG A 5 7.314 -15.643 -3.452 1.00 0.00 H new ATOM 0 HB3 ARG A 5 8.542 -16.410 -4.440 1.00 0.00 H new ATOM 0 HG2 ARG A 5 7.648 -18.665 -3.765 1.00 0.00 H new ATOM 0 HG3 ARG A 5 6.395 -17.873 -2.831 1.00 0.00 H new ATOM 0 HD2 ARG A 5 5.457 -18.541 -4.975 1.00 0.00 H new ATOM 0 HD3 ARG A 5 5.531 -16.791 -4.920 1.00 0.00 H new ATOM 0 HE ARG A 5 7.082 -16.778 -6.651 1.00 0.00 H new ATOM 0 HH11 ARG A 5 6.847 -20.133 -5.492 1.00 0.00 H new ATOM 0 HH12 ARG A 5 7.780 -20.744 -6.861 1.00 0.00 H new ATOM 0 HH21 ARG A 5 8.237 -17.627 -8.343 1.00 0.00 H new ATOM 0 HH22 ARG A 5 8.546 -19.364 -8.430 1.00 0.00 H new ATOM 96 N GLY A 6 11.118 -15.836 -2.717 1.00 0.00 N ATOM 97 CA GLY A 6 12.249 -14.905 -2.861 1.00 0.00 C ATOM 98 C GLY A 6 12.430 -14.478 -4.318 1.00 0.00 C ATOM 99 O GLY A 6 11.617 -13.721 -4.842 1.00 0.00 O ATOM 0 H GLY A 6 11.368 -16.792 -2.969 1.00 0.00 H new ATOM 0 HA2 GLY A 6 12.081 -14.025 -2.239 1.00 0.00 H new ATOM 0 HA3 GLY A 6 13.162 -15.379 -2.502 1.00 0.00 H new ATOM 103 N HIS A 7 13.509 -14.945 -4.958 1.00 0.00 N ATOM 104 CA HIS A 7 13.780 -14.851 -6.411 1.00 0.00 C ATOM 105 C HIS A 7 14.273 -13.448 -6.868 1.00 0.00 C ATOM 106 O HIS A 7 14.350 -13.171 -8.069 1.00 0.00 O ATOM 107 CB HIS A 7 12.556 -15.372 -7.205 1.00 0.00 C ATOM 108 CG HIS A 7 12.883 -16.002 -8.541 1.00 0.00 C ATOM 109 ND1 HIS A 7 13.480 -15.380 -9.616 1.00 0.00 N ATOM 110 CD2 HIS A 7 12.619 -17.289 -8.927 1.00 0.00 C ATOM 111 CE1 HIS A 7 13.583 -16.268 -10.615 1.00 0.00 C ATOM 112 NE2 HIS A 7 13.068 -17.458 -10.246 1.00 0.00 N ATOM 0 H HIS A 7 14.258 -15.424 -4.458 1.00 0.00 H new ATOM 0 HA HIS A 7 14.627 -15.499 -6.637 1.00 0.00 H new ATOM 0 HB2 HIS A 7 12.030 -16.105 -6.593 1.00 0.00 H new ATOM 0 HB3 HIS A 7 11.869 -14.542 -7.370 1.00 0.00 H new ATOM 0 HD1 HIS A 7 13.791 -14.409 -9.646 1.00 0.00 H new ATOM 0 HD2 HIS A 7 12.145 -18.046 -8.319 1.00 0.00 H new ATOM 0 HE1 HIS A 7 14.018 -16.059 -11.581 1.00 0.00 H new ATOM 120 N VAL A 8 14.622 -12.553 -5.932 1.00 0.00 N ATOM 121 CA VAL A 8 15.141 -11.200 -6.226 1.00 0.00 C ATOM 122 C VAL A 8 16.632 -11.291 -6.582 1.00 0.00 C ATOM 123 O VAL A 8 17.463 -11.617 -5.733 1.00 0.00 O ATOM 124 CB VAL A 8 14.906 -10.213 -5.052 1.00 0.00 C ATOM 125 CG1 VAL A 8 15.467 -8.813 -5.358 1.00 0.00 C ATOM 126 CG2 VAL A 8 13.405 -10.069 -4.734 1.00 0.00 C ATOM 0 H VAL A 8 14.552 -12.747 -4.933 1.00 0.00 H new ATOM 0 HA VAL A 8 14.590 -10.802 -7.078 1.00 0.00 H new ATOM 0 HB VAL A 8 15.431 -10.633 -4.194 1.00 0.00 H new ATOM 0 HG11 VAL A 8 15.281 -8.153 -4.510 1.00 0.00 H new ATOM 0 HG12 VAL A 8 16.540 -8.882 -5.536 1.00 0.00 H new ATOM 0 HG13 VAL A 8 14.977 -8.411 -6.245 1.00 0.00 H new ATOM 0 HG21 VAL A 8 13.274 -9.371 -3.907 1.00 0.00 H new ATOM 0 HG22 VAL A 8 12.881 -9.693 -5.613 1.00 0.00 H new ATOM 0 HG23 VAL A 8 12.997 -11.041 -4.457 1.00 0.00 H new ATOM 136 N ALA A 9 16.967 -10.988 -7.840 1.00 0.00 N ATOM 137 CA ALA A 9 18.347 -10.897 -8.328 1.00 0.00 C ATOM 138 C ALA A 9 19.016 -9.563 -7.906 1.00 0.00 C ATOM 139 O ALA A 9 18.316 -8.546 -7.809 1.00 0.00 O ATOM 140 CB ALA A 9 18.328 -11.069 -9.854 1.00 0.00 C ATOM 0 H ALA A 9 16.273 -10.795 -8.562 1.00 0.00 H new ATOM 0 HA ALA A 9 18.949 -11.688 -7.880 1.00 0.00 H new ATOM 0 HB1 ALA A 9 19.345 -11.005 -10.240 1.00 0.00 H new ATOM 0 HB2 ALA A 9 17.905 -12.042 -10.105 1.00 0.00 H new ATOM 0 HB3 ALA A 9 17.720 -10.283 -10.301 1.00 0.00 H new ATOM 146 N PRO A 10 20.346 -9.535 -7.672 1.00 0.00 N ATOM 147 CA PRO A 10 21.057 -8.332 -7.245 1.00 0.00 C ATOM 148 C PRO A 10 21.095 -7.292 -8.371 1.00 0.00 C ATOM 149 O PRO A 10 21.527 -7.575 -9.490 1.00 0.00 O ATOM 150 CB PRO A 10 22.458 -8.799 -6.832 1.00 0.00 C ATOM 151 CG PRO A 10 22.673 -10.065 -7.660 1.00 0.00 C ATOM 152 CD PRO A 10 21.268 -10.661 -7.753 1.00 0.00 C ATOM 0 HA PRO A 10 20.559 -7.837 -6.411 1.00 0.00 H new ATOM 0 HB2 PRO A 10 23.213 -8.044 -7.051 1.00 0.00 H new ATOM 0 HB3 PRO A 10 22.513 -9.005 -5.763 1.00 0.00 H new ATOM 0 HG2 PRO A 10 23.081 -9.838 -8.645 1.00 0.00 H new ATOM 0 HG3 PRO A 10 23.370 -10.749 -7.177 1.00 0.00 H new ATOM 0 HD2 PRO A 10 21.137 -11.206 -8.688 1.00 0.00 H new ATOM 0 HD3 PRO A 10 21.091 -11.369 -6.944 1.00 0.00 H new ATOM 160 N GLN A 11 20.639 -6.077 -8.058 1.00 0.00 N ATOM 161 CA GLN A 11 20.645 -4.922 -8.957 1.00 0.00 C ATOM 162 C GLN A 11 21.994 -4.176 -8.898 1.00 0.00 C ATOM 163 O GLN A 11 22.827 -4.416 -8.018 1.00 0.00 O ATOM 164 CB GLN A 11 19.494 -3.958 -8.591 1.00 0.00 C ATOM 165 CG GLN A 11 18.089 -4.595 -8.522 1.00 0.00 C ATOM 166 CD GLN A 11 17.735 -5.270 -7.186 1.00 0.00 C ATOM 167 OE1 GLN A 11 18.520 -5.369 -6.247 1.00 0.00 O ATOM 168 NE2 GLN A 11 16.517 -5.750 -7.041 1.00 0.00 N ATOM 0 H GLN A 11 20.243 -5.864 -7.143 1.00 0.00 H new ATOM 0 HA GLN A 11 20.501 -5.286 -9.974 1.00 0.00 H new ATOM 0 HB2 GLN A 11 19.716 -3.505 -7.625 1.00 0.00 H new ATOM 0 HB3 GLN A 11 19.472 -3.151 -9.324 1.00 0.00 H new ATOM 0 HG2 GLN A 11 17.348 -3.822 -8.727 1.00 0.00 H new ATOM 0 HG3 GLN A 11 18.005 -5.336 -9.317 1.00 0.00 H new ATOM 0 HE21 GLN A 11 15.847 -5.680 -7.807 1.00 0.00 H new ATOM 0 HE22 GLN A 11 16.244 -6.192 -6.163 1.00 0.00 H new ATOM 177 N ASN A 12 22.189 -3.199 -9.793 1.00 0.00 N ATOM 178 CA ASN A 12 23.213 -2.170 -9.614 1.00 0.00 C ATOM 179 C ASN A 12 22.867 -1.265 -8.413 1.00 0.00 C ATOM 180 O ASN A 12 21.692 -1.050 -8.104 1.00 0.00 O ATOM 181 CB ASN A 12 23.419 -1.383 -10.923 1.00 0.00 C ATOM 182 CG ASN A 12 22.140 -0.874 -11.592 1.00 0.00 C ATOM 183 OD1 ASN A 12 21.316 -0.098 -10.911 1.00 0.00 O flip ATOM 184 ND2 ASN A 12 21.864 -1.183 -12.744 1.00 0.00 N flip ATOM 0 H ASN A 12 21.646 -3.102 -10.651 1.00 0.00 H new ATOM 0 HA ASN A 12 24.166 -2.645 -9.381 1.00 0.00 H new ATOM 0 HB2 ASN A 12 24.065 -0.530 -10.716 1.00 0.00 H new ATOM 0 HB3 ASN A 12 23.950 -2.020 -11.630 1.00 0.00 H new ATOM 0 HD21 ASN A 12 22.495 -1.782 -13.277 1.00 0.00 H new ATOM 0 HD22 ASN A 12 21.003 -0.842 -13.171 1.00 0.00 H new ATOM 191 N THR A 13 23.891 -0.707 -7.760 1.00 0.00 N ATOM 192 CA THR A 13 23.769 0.062 -6.502 1.00 0.00 C ATOM 193 C THR A 13 24.197 1.519 -6.651 1.00 0.00 C ATOM 194 O THR A 13 23.431 2.411 -6.296 1.00 0.00 O ATOM 195 CB THR A 13 24.567 -0.623 -5.384 1.00 0.00 C ATOM 196 OG1 THR A 13 25.884 -0.879 -5.836 1.00 0.00 O ATOM 197 CG2 THR A 13 23.918 -1.950 -4.979 1.00 0.00 C ATOM 0 H THR A 13 24.853 -0.775 -8.093 1.00 0.00 H new ATOM 0 HA THR A 13 22.711 0.075 -6.239 1.00 0.00 H new ATOM 0 HB THR A 13 24.582 0.040 -4.519 1.00 0.00 H new ATOM 0 HG1 THR A 13 26.396 -1.315 -5.123 1.00 0.00 H new ATOM 0 HG21 THR A 13 24.504 -2.414 -4.185 1.00 0.00 H new ATOM 0 HG22 THR A 13 22.905 -1.765 -4.622 1.00 0.00 H new ATOM 0 HG23 THR A 13 23.883 -2.616 -5.841 1.00 0.00 H new ATOM 205 N PHE A 14 25.379 1.774 -7.219 1.00 0.00 N ATOM 206 CA PHE A 14 25.897 3.128 -7.458 1.00 0.00 C ATOM 207 C PHE A 14 25.136 3.844 -8.578 1.00 0.00 C ATOM 208 O PHE A 14 24.744 5.002 -8.438 1.00 0.00 O ATOM 209 CB PHE A 14 27.380 3.021 -7.820 1.00 0.00 C ATOM 210 CG PHE A 14 28.125 4.339 -7.723 1.00 0.00 C ATOM 211 CD1 PHE A 14 28.735 4.718 -6.511 1.00 0.00 C ATOM 212 CD2 PHE A 14 28.189 5.203 -8.835 1.00 0.00 C ATOM 213 CE1 PHE A 14 29.412 5.947 -6.413 1.00 0.00 C ATOM 214 CE2 PHE A 14 28.862 6.433 -8.735 1.00 0.00 C ATOM 215 CZ PHE A 14 29.476 6.805 -7.525 1.00 0.00 C ATOM 0 H PHE A 14 26.013 1.038 -7.530 1.00 0.00 H new ATOM 0 HA PHE A 14 25.762 3.718 -6.551 1.00 0.00 H new ATOM 0 HB2 PHE A 14 27.855 2.295 -7.160 1.00 0.00 H new ATOM 0 HB3 PHE A 14 27.471 2.636 -8.836 1.00 0.00 H new ATOM 0 HD1 PHE A 14 28.683 4.063 -5.654 1.00 0.00 H new ATOM 0 HD2 PHE A 14 27.720 4.919 -9.766 1.00 0.00 H new ATOM 0 HE1 PHE A 14 29.883 6.232 -5.484 1.00 0.00 H new ATOM 0 HE2 PHE A 14 28.908 7.093 -9.588 1.00 0.00 H new ATOM 0 HZ PHE A 14 29.996 7.749 -7.450 1.00 0.00 H new ATOM 225 N LEU A 15 24.901 3.130 -9.686 1.00 0.00 N ATOM 226 CA LEU A 15 24.134 3.630 -10.828 1.00 0.00 C ATOM 227 C LEU A 15 22.685 3.927 -10.427 1.00 0.00 C ATOM 228 O LEU A 15 22.124 4.931 -10.852 1.00 0.00 O ATOM 229 CB LEU A 15 24.223 2.608 -11.977 1.00 0.00 C ATOM 230 CG LEU A 15 23.371 2.983 -13.207 1.00 0.00 C ATOM 231 CD1 LEU A 15 23.787 4.322 -13.835 1.00 0.00 C ATOM 232 CD2 LEU A 15 23.485 1.878 -14.265 1.00 0.00 C ATOM 0 H LEU A 15 25.243 2.178 -9.814 1.00 0.00 H new ATOM 0 HA LEU A 15 24.557 4.574 -11.172 1.00 0.00 H new ATOM 0 HB2 LEU A 15 25.264 2.509 -12.284 1.00 0.00 H new ATOM 0 HB3 LEU A 15 23.905 1.632 -11.609 1.00 0.00 H new ATOM 0 HG LEU A 15 22.342 3.088 -12.862 1.00 0.00 H new ATOM 0 HD11 LEU A 15 23.152 4.533 -14.696 1.00 0.00 H new ATOM 0 HD12 LEU A 15 23.677 5.119 -13.099 1.00 0.00 H new ATOM 0 HD13 LEU A 15 24.827 4.266 -14.156 1.00 0.00 H new ATOM 0 HD21 LEU A 15 22.883 2.143 -15.134 1.00 0.00 H new ATOM 0 HD22 LEU A 15 24.527 1.768 -14.565 1.00 0.00 H new ATOM 0 HD23 LEU A 15 23.126 0.937 -13.848 1.00 0.00 H new ATOM 244 N ASP A 16 22.098 3.108 -9.552 1.00 0.00 N ATOM 245 CA ASP A 16 20.720 3.292 -9.067 1.00 0.00 C ATOM 246 C ASP A 16 20.505 4.640 -8.366 1.00 0.00 C ATOM 247 O ASP A 16 19.414 5.206 -8.412 1.00 0.00 O ATOM 248 CB ASP A 16 20.390 2.161 -8.097 1.00 0.00 C ATOM 249 CG ASP A 16 18.879 2.049 -7.839 1.00 0.00 C ATOM 250 OD1 ASP A 16 18.144 1.645 -8.771 1.00 0.00 O ATOM 251 OD2 ASP A 16 18.442 2.353 -6.704 1.00 0.00 O ATOM 0 H ASP A 16 22.564 2.292 -9.155 1.00 0.00 H new ATOM 0 HA ASP A 16 20.061 3.278 -9.935 1.00 0.00 H new ATOM 0 HB2 ASP A 16 20.760 1.218 -8.499 1.00 0.00 H new ATOM 0 HB3 ASP A 16 20.908 2.330 -7.153 1.00 0.00 H new ATOM 256 N THR A 17 21.567 5.186 -7.767 1.00 0.00 N ATOM 257 CA THR A 17 21.567 6.528 -7.162 1.00 0.00 C ATOM 258 C THR A 17 21.439 7.610 -8.227 1.00 0.00 C ATOM 259 O THR A 17 20.841 8.646 -7.963 1.00 0.00 O ATOM 260 CB THR A 17 22.829 6.738 -6.315 1.00 0.00 C ATOM 261 OG1 THR A 17 22.950 5.644 -5.432 1.00 0.00 O ATOM 262 CG2 THR A 17 22.749 8.003 -5.459 1.00 0.00 C ATOM 0 H THR A 17 22.463 4.706 -7.686 1.00 0.00 H new ATOM 0 HA THR A 17 20.699 6.604 -6.507 1.00 0.00 H new ATOM 0 HB THR A 17 23.676 6.829 -6.995 1.00 0.00 H new ATOM 0 HG1 THR A 17 23.752 5.756 -4.881 1.00 0.00 H new ATOM 0 HG21 THR A 17 23.665 8.108 -4.878 1.00 0.00 H new ATOM 0 HG22 THR A 17 22.628 8.872 -6.105 1.00 0.00 H new ATOM 0 HG23 THR A 17 21.897 7.932 -4.783 1.00 0.00 H new ATOM 270 N ILE A 18 21.919 7.375 -9.449 1.00 0.00 N ATOM 271 CA ILE A 18 21.840 8.349 -10.549 1.00 0.00 C ATOM 272 C ILE A 18 20.403 8.408 -11.067 1.00 0.00 C ATOM 273 O ILE A 18 19.862 9.494 -11.253 1.00 0.00 O ATOM 274 CB ILE A 18 22.850 8.004 -11.670 1.00 0.00 C ATOM 275 CG1 ILE A 18 24.254 7.621 -11.138 1.00 0.00 C ATOM 276 CG2 ILE A 18 22.942 9.165 -12.677 1.00 0.00 C ATOM 277 CD1 ILE A 18 24.959 8.672 -10.272 1.00 0.00 C ATOM 0 H ILE A 18 22.376 6.501 -9.709 1.00 0.00 H new ATOM 0 HA ILE A 18 22.113 9.338 -10.180 1.00 0.00 H new ATOM 0 HB ILE A 18 22.469 7.116 -12.173 1.00 0.00 H new ATOM 0 HG12 ILE A 18 24.162 6.704 -10.556 1.00 0.00 H new ATOM 0 HG13 ILE A 18 24.894 7.395 -11.991 1.00 0.00 H new ATOM 0 HG21 ILE A 18 23.655 8.911 -13.461 1.00 0.00 H new ATOM 0 HG22 ILE A 18 21.962 9.340 -13.121 1.00 0.00 H new ATOM 0 HG23 ILE A 18 23.274 10.067 -12.163 1.00 0.00 H new ATOM 0 HD11 ILE A 18 25.931 8.292 -9.959 1.00 0.00 H new ATOM 0 HD12 ILE A 18 25.095 9.587 -10.849 1.00 0.00 H new ATOM 0 HD13 ILE A 18 24.352 8.885 -9.392 1.00 0.00 H new ATOM 289 N ILE A 19 19.744 7.250 -11.193 1.00 0.00 N ATOM 290 CA ILE A 19 18.306 7.176 -11.488 1.00 0.00 C ATOM 291 C ILE A 19 17.502 7.901 -10.400 1.00 0.00 C ATOM 292 O ILE A 19 16.653 8.724 -10.732 1.00 0.00 O ATOM 293 CB ILE A 19 17.854 5.706 -11.678 1.00 0.00 C ATOM 294 CG1 ILE A 19 18.407 5.078 -12.981 1.00 0.00 C ATOM 295 CG2 ILE A 19 16.313 5.624 -11.735 1.00 0.00 C ATOM 296 CD1 ILE A 19 19.881 4.671 -12.990 1.00 0.00 C ATOM 0 H ILE A 19 20.191 6.338 -11.094 1.00 0.00 H new ATOM 0 HA ILE A 19 18.111 7.686 -12.431 1.00 0.00 H new ATOM 0 HB ILE A 19 18.248 5.153 -10.825 1.00 0.00 H new ATOM 0 HG12 ILE A 19 17.811 4.194 -13.209 1.00 0.00 H new ATOM 0 HG13 ILE A 19 18.248 5.788 -13.792 1.00 0.00 H new ATOM 0 HG21 ILE A 19 16.009 4.586 -11.869 1.00 0.00 H new ATOM 0 HG22 ILE A 19 15.894 6.008 -10.805 1.00 0.00 H new ATOM 0 HG23 ILE A 19 15.948 6.220 -12.571 1.00 0.00 H new ATOM 0 HD11 ILE A 19 20.135 4.246 -13.961 1.00 0.00 H new ATOM 0 HD12 ILE A 19 20.502 5.547 -12.804 1.00 0.00 H new ATOM 0 HD13 ILE A 19 20.058 3.929 -12.212 1.00 0.00 H new ATOM 308 N ARG A 20 17.788 7.667 -9.114 1.00 0.00 N ATOM 309 CA ARG A 20 17.064 8.307 -8.005 1.00 0.00 C ATOM 310 C ARG A 20 17.235 9.836 -7.976 1.00 0.00 C ATOM 311 O ARG A 20 16.291 10.555 -7.649 1.00 0.00 O ATOM 312 CB ARG A 20 17.526 7.702 -6.678 1.00 0.00 C ATOM 313 CG ARG A 20 16.951 6.292 -6.441 1.00 0.00 C ATOM 314 CD ARG A 20 17.358 5.712 -5.080 1.00 0.00 C ATOM 315 NE ARG A 20 18.768 5.283 -5.052 1.00 0.00 N ATOM 316 CZ ARG A 20 19.403 4.799 -3.989 1.00 0.00 C ATOM 317 NH1 ARG A 20 18.800 4.631 -2.829 1.00 0.00 N ATOM 318 NH2 ARG A 20 20.676 4.473 -4.066 1.00 0.00 N ATOM 0 H ARG A 20 18.525 7.031 -8.811 1.00 0.00 H new ATOM 0 HA ARG A 20 16.002 8.116 -8.160 1.00 0.00 H new ATOM 0 HB2 ARG A 20 18.615 7.654 -6.664 1.00 0.00 H new ATOM 0 HB3 ARG A 20 17.225 8.356 -5.860 1.00 0.00 H new ATOM 0 HG2 ARG A 20 15.864 6.331 -6.505 1.00 0.00 H new ATOM 0 HG3 ARG A 20 17.293 5.626 -7.233 1.00 0.00 H new ATOM 0 HD2 ARG A 20 17.193 6.460 -4.305 1.00 0.00 H new ATOM 0 HD3 ARG A 20 16.718 4.862 -4.844 1.00 0.00 H new ATOM 0 HE ARG A 20 19.300 5.364 -5.919 1.00 0.00 H new ATOM 0 HH11 ARG A 20 17.815 4.875 -2.726 1.00 0.00 H new ATOM 0 HH12 ARG A 20 19.318 4.257 -2.034 1.00 0.00 H new ATOM 0 HH21 ARG A 20 21.181 4.591 -4.945 1.00 0.00 H new ATOM 0 HH22 ARG A 20 21.158 4.102 -3.247 1.00 0.00 H new ATOM 332 N LYS A 21 18.411 10.351 -8.350 1.00 0.00 N ATOM 333 CA LYS A 21 18.675 11.793 -8.492 1.00 0.00 C ATOM 334 C LYS A 21 17.938 12.416 -9.692 1.00 0.00 C ATOM 335 O LYS A 21 17.438 13.541 -9.598 1.00 0.00 O ATOM 336 CB LYS A 21 20.191 11.994 -8.642 1.00 0.00 C ATOM 337 CG LYS A 21 20.933 11.789 -7.310 1.00 0.00 C ATOM 338 CD LYS A 21 22.450 11.649 -7.497 1.00 0.00 C ATOM 339 CE LYS A 21 23.064 12.908 -8.128 1.00 0.00 C ATOM 340 NZ LYS A 21 24.551 12.845 -8.155 1.00 0.00 N ATOM 0 H LYS A 21 19.221 9.771 -8.567 1.00 0.00 H new ATOM 0 HA LYS A 21 18.300 12.299 -7.602 1.00 0.00 H new ATOM 0 HB2 LYS A 21 20.578 11.295 -9.384 1.00 0.00 H new ATOM 0 HB3 LYS A 21 20.388 12.998 -9.016 1.00 0.00 H new ATOM 0 HG2 LYS A 21 20.728 12.632 -6.650 1.00 0.00 H new ATOM 0 HG3 LYS A 21 20.547 10.897 -6.817 1.00 0.00 H new ATOM 0 HD2 LYS A 21 22.920 11.460 -6.532 1.00 0.00 H new ATOM 0 HD3 LYS A 21 22.661 10.786 -8.128 1.00 0.00 H new ATOM 0 HE2 LYS A 21 22.687 13.026 -9.144 1.00 0.00 H new ATOM 0 HE3 LYS A 21 22.748 13.787 -7.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 24.927 13.712 -8.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 24.912 12.758 -7.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 24.853 12.021 -8.712 1.00 0.00 H new ATOM 354 N PHE A 22 17.869 11.690 -10.814 1.00 0.00 N ATOM 355 CA PHE A 22 17.209 12.128 -12.047 1.00 0.00 C ATOM 356 C PHE A 22 15.679 12.005 -11.956 1.00 0.00 C ATOM 357 O PHE A 22 14.977 12.834 -12.541 1.00 0.00 O ATOM 358 CB PHE A 22 17.745 11.309 -13.238 1.00 0.00 C ATOM 359 CG PHE A 22 19.030 11.820 -13.878 1.00 0.00 C ATOM 360 CD1 PHE A 22 20.183 12.084 -13.108 1.00 0.00 C ATOM 361 CD2 PHE A 22 19.078 12.023 -15.274 1.00 0.00 C ATOM 362 CE1 PHE A 22 21.362 12.541 -13.723 1.00 0.00 C ATOM 363 CE2 PHE A 22 20.257 12.480 -15.889 1.00 0.00 C ATOM 364 CZ PHE A 22 21.401 12.738 -15.114 1.00 0.00 C ATOM 0 H PHE A 22 18.281 10.760 -10.890 1.00 0.00 H new ATOM 0 HA PHE A 22 17.437 13.183 -12.195 1.00 0.00 H new ATOM 0 HB2 PHE A 22 17.912 10.285 -12.903 1.00 0.00 H new ATOM 0 HB3 PHE A 22 16.971 11.271 -14.005 1.00 0.00 H new ATOM 0 HD1 PHE A 22 20.160 11.934 -12.039 1.00 0.00 H new ATOM 0 HD2 PHE A 22 18.202 11.826 -15.874 1.00 0.00 H new ATOM 0 HE1 PHE A 22 22.239 12.741 -13.125 1.00 0.00 H new ATOM 0 HE2 PHE A 22 20.284 12.633 -16.958 1.00 0.00 H new ATOM 0 HZ PHE A 22 22.308 13.087 -15.586 1.00 0.00 H new ATOM 374 N GLU A 23 15.155 10.998 -11.244 1.00 0.00 N ATOM 375 CA GLU A 23 13.708 10.734 -11.180 1.00 0.00 C ATOM 376 C GLU A 23 12.989 11.508 -10.051 1.00 0.00 C ATOM 377 O GLU A 23 13.623 12.069 -9.153 1.00 0.00 O ATOM 378 CB GLU A 23 13.430 9.216 -11.147 1.00 0.00 C ATOM 379 CG GLU A 23 13.463 8.566 -9.758 1.00 0.00 C ATOM 380 CD GLU A 23 13.298 7.035 -9.799 1.00 0.00 C ATOM 381 OE1 GLU A 23 12.684 6.498 -10.754 1.00 0.00 O ATOM 382 OE2 GLU A 23 13.726 6.361 -8.833 1.00 0.00 O ATOM 0 H GLU A 23 15.718 10.345 -10.698 1.00 0.00 H new ATOM 0 HA GLU A 23 13.270 11.127 -12.098 1.00 0.00 H new ATOM 0 HB2 GLU A 23 12.451 9.034 -11.590 1.00 0.00 H new ATOM 0 HB3 GLU A 23 14.164 8.717 -11.780 1.00 0.00 H new ATOM 0 HG2 GLU A 23 14.408 8.810 -9.272 1.00 0.00 H new ATOM 0 HG3 GLU A 23 12.670 8.994 -9.145 1.00 0.00 H new ATOM 389 N GLY A 24 11.648 11.498 -10.060 1.00 0.00 N ATOM 390 CA GLY A 24 10.776 12.143 -9.063 1.00 0.00 C ATOM 391 C GLY A 24 10.655 11.337 -7.770 1.00 0.00 C ATOM 392 O GLY A 24 9.548 11.080 -7.297 1.00 0.00 O ATOM 0 H GLY A 24 11.119 11.022 -10.790 1.00 0.00 H new ATOM 0 HA2 GLY A 24 11.167 13.134 -8.832 1.00 0.00 H new ATOM 0 HA3 GLY A 24 9.784 12.284 -9.492 1.00 0.00 H new ATOM 396 N GLN A 25 11.800 10.944 -7.208 1.00 0.00 N ATOM 397 CA GLN A 25 11.957 10.032 -6.065 1.00 0.00 C ATOM 398 C GLN A 25 11.445 10.610 -4.733 1.00 0.00 C ATOM 399 O GLN A 25 11.362 9.891 -3.742 1.00 0.00 O ATOM 400 CB GLN A 25 13.456 9.673 -5.975 1.00 0.00 C ATOM 401 CG GLN A 25 13.795 8.505 -5.028 1.00 0.00 C ATOM 402 CD GLN A 25 14.581 8.926 -3.777 1.00 0.00 C ATOM 403 OE1 GLN A 25 15.790 8.763 -3.687 1.00 0.00 O ATOM 404 NE2 GLN A 25 13.946 9.494 -2.770 1.00 0.00 N ATOM 0 H GLN A 25 12.700 11.272 -7.558 1.00 0.00 H new ATOM 0 HA GLN A 25 11.342 9.148 -6.234 1.00 0.00 H new ATOM 0 HB2 GLN A 25 13.815 9.426 -6.974 1.00 0.00 H new ATOM 0 HB3 GLN A 25 14.006 10.556 -5.649 1.00 0.00 H new ATOM 0 HG2 GLN A 25 12.869 8.021 -4.718 1.00 0.00 H new ATOM 0 HG3 GLN A 25 14.374 7.762 -5.576 1.00 0.00 H new ATOM 0 HE21 GLN A 25 12.938 9.641 -2.821 1.00 0.00 H new ATOM 0 HE22 GLN A 25 14.463 9.786 -1.941 1.00 0.00 H new ATOM 413 N SER A 26 11.104 11.898 -4.684 1.00 0.00 N ATOM 414 CA SER A 26 10.829 12.667 -3.460 1.00 0.00 C ATOM 415 C SER A 26 9.557 12.243 -2.698 1.00 0.00 C ATOM 416 O SER A 26 9.309 12.756 -1.601 1.00 0.00 O ATOM 417 CB SER A 26 10.717 14.159 -3.834 1.00 0.00 C ATOM 418 OG SER A 26 11.792 14.594 -4.666 1.00 0.00 O ATOM 0 H SER A 26 11.007 12.461 -5.529 1.00 0.00 H new ATOM 0 HA SER A 26 11.659 12.469 -2.782 1.00 0.00 H new ATOM 0 HB2 SER A 26 9.771 14.332 -4.347 1.00 0.00 H new ATOM 0 HB3 SER A 26 10.700 14.759 -2.924 1.00 0.00 H new ATOM 0 HG SER A 26 11.678 15.544 -4.878 1.00 0.00 H new ATOM 424 N ARG A 27 8.748 11.332 -3.266 1.00 0.00 N ATOM 425 CA ARG A 27 7.531 10.790 -2.644 1.00 0.00 C ATOM 426 C ARG A 27 7.693 9.309 -2.279 1.00 0.00 C ATOM 427 O ARG A 27 8.614 8.626 -2.718 1.00 0.00 O ATOM 428 CB ARG A 27 6.271 10.986 -3.509 1.00 0.00 C ATOM 429 CG ARG A 27 6.076 12.364 -4.167 1.00 0.00 C ATOM 430 CD ARG A 27 6.906 12.535 -5.448 1.00 0.00 C ATOM 431 NE ARG A 27 6.353 13.593 -6.312 1.00 0.00 N ATOM 432 CZ ARG A 27 6.487 13.685 -7.631 1.00 0.00 C ATOM 433 NH1 ARG A 27 7.210 12.828 -8.326 1.00 0.00 N ATOM 434 NH2 ARG A 27 5.882 14.657 -8.278 1.00 0.00 N ATOM 0 H ARG A 27 8.928 10.944 -4.192 1.00 0.00 H new ATOM 0 HA ARG A 27 7.389 11.366 -1.729 1.00 0.00 H new ATOM 0 HB2 ARG A 27 6.283 10.234 -4.298 1.00 0.00 H new ATOM 0 HB3 ARG A 27 5.399 10.782 -2.887 1.00 0.00 H new ATOM 0 HG2 ARG A 27 5.021 12.503 -4.402 1.00 0.00 H new ATOM 0 HG3 ARG A 27 6.350 13.143 -3.456 1.00 0.00 H new ATOM 0 HD2 ARG A 27 7.936 12.779 -5.186 1.00 0.00 H new ATOM 0 HD3 ARG A 27 6.931 11.593 -5.995 1.00 0.00 H new ATOM 0 HE ARG A 27 5.814 14.327 -5.852 1.00 0.00 H new ATOM 0 HH11 ARG A 27 7.689 12.063 -7.852 1.00 0.00 H new ATOM 0 HH12 ARG A 27 7.290 12.931 -9.338 1.00 0.00 H new ATOM 0 HH21 ARG A 27 5.315 15.334 -7.767 1.00 0.00 H new ATOM 0 HH22 ARG A 27 5.980 14.734 -9.290 1.00 0.00 H new ATOM 448 N LYS A 28 6.762 8.776 -1.488 1.00 0.00 N ATOM 449 CA LYS A 28 6.800 7.393 -0.999 1.00 0.00 C ATOM 450 C LYS A 28 6.011 6.465 -1.934 1.00 0.00 C ATOM 451 O LYS A 28 4.873 6.772 -2.282 1.00 0.00 O ATOM 452 CB LYS A 28 6.236 7.347 0.434 1.00 0.00 C ATOM 453 CG LYS A 28 6.834 8.408 1.372 1.00 0.00 C ATOM 454 CD LYS A 28 5.915 9.641 1.511 1.00 0.00 C ATOM 455 CE LYS A 28 6.669 10.736 2.271 1.00 0.00 C ATOM 456 NZ LYS A 28 5.949 12.042 2.290 1.00 0.00 N ATOM 0 H LYS A 28 5.948 9.298 -1.163 1.00 0.00 H new ATOM 0 HA LYS A 28 7.832 7.042 -0.985 1.00 0.00 H new ATOM 0 HB2 LYS A 28 5.155 7.480 0.393 1.00 0.00 H new ATOM 0 HB3 LYS A 28 6.420 6.359 0.855 1.00 0.00 H new ATOM 0 HG2 LYS A 28 7.003 7.969 2.355 1.00 0.00 H new ATOM 0 HG3 LYS A 28 7.806 8.721 0.992 1.00 0.00 H new ATOM 0 HD2 LYS A 28 5.617 10.002 0.527 1.00 0.00 H new ATOM 0 HD3 LYS A 28 5.002 9.373 2.043 1.00 0.00 H new ATOM 0 HE2 LYS A 28 6.838 10.407 3.296 1.00 0.00 H new ATOM 0 HE3 LYS A 28 7.649 10.876 1.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 6.510 12.740 2.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 5.810 12.376 1.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 5.024 11.922 2.750 1.00 0.00 H new ATOM 470 N PHE A 29 6.587 5.318 -2.296 1.00 0.00 N ATOM 471 CA PHE A 29 5.965 4.307 -3.158 1.00 0.00 C ATOM 472 C PHE A 29 6.622 2.930 -3.046 1.00 0.00 C ATOM 473 O PHE A 29 7.800 2.813 -2.706 1.00 0.00 O ATOM 474 CB PHE A 29 5.929 4.794 -4.618 1.00 0.00 C ATOM 475 CG PHE A 29 7.270 5.201 -5.209 1.00 0.00 C ATOM 476 CD1 PHE A 29 8.151 4.227 -5.718 1.00 0.00 C ATOM 477 CD2 PHE A 29 7.633 6.561 -5.259 1.00 0.00 C ATOM 478 CE1 PHE A 29 9.391 4.610 -6.261 1.00 0.00 C ATOM 479 CE2 PHE A 29 8.870 6.945 -5.807 1.00 0.00 C ATOM 480 CZ PHE A 29 9.751 5.969 -6.307 1.00 0.00 C ATOM 0 H PHE A 29 7.525 5.058 -1.990 1.00 0.00 H new ATOM 0 HA PHE A 29 4.942 4.177 -2.804 1.00 0.00 H new ATOM 0 HB2 PHE A 29 5.505 4.002 -5.236 1.00 0.00 H new ATOM 0 HB3 PHE A 29 5.251 5.645 -4.682 1.00 0.00 H new ATOM 0 HD1 PHE A 29 7.874 3.183 -5.691 1.00 0.00 H new ATOM 0 HD2 PHE A 29 6.959 7.312 -4.875 1.00 0.00 H new ATOM 0 HE1 PHE A 29 10.067 3.860 -6.643 1.00 0.00 H new ATOM 0 HE2 PHE A 29 9.143 7.989 -5.844 1.00 0.00 H new ATOM 0 HZ PHE A 29 10.702 6.263 -6.726 1.00 0.00 H new ATOM 490 N ILE A 30 5.851 1.887 -3.360 1.00 0.00 N ATOM 491 CA ILE A 30 6.278 0.478 -3.387 1.00 0.00 C ATOM 492 C ILE A 30 5.649 -0.258 -4.576 1.00 0.00 C ATOM 493 O ILE A 30 4.570 0.111 -5.027 1.00 0.00 O ATOM 494 CB ILE A 30 5.968 -0.222 -2.038 1.00 0.00 C ATOM 495 CG1 ILE A 30 4.450 -0.377 -1.783 1.00 0.00 C ATOM 496 CG2 ILE A 30 6.639 0.517 -0.864 1.00 0.00 C ATOM 497 CD1 ILE A 30 4.144 -1.008 -0.422 1.00 0.00 C ATOM 0 H ILE A 30 4.870 2.001 -3.614 1.00 0.00 H new ATOM 0 HA ILE A 30 7.359 0.447 -3.522 1.00 0.00 H new ATOM 0 HB ILE A 30 6.386 -1.226 -2.107 1.00 0.00 H new ATOM 0 HG12 ILE A 30 3.974 0.602 -1.841 1.00 0.00 H new ATOM 0 HG13 ILE A 30 4.014 -0.991 -2.571 1.00 0.00 H new ATOM 0 HG21 ILE A 30 6.405 0.005 0.069 1.00 0.00 H new ATOM 0 HG22 ILE A 30 7.719 0.529 -1.011 1.00 0.00 H new ATOM 0 HG23 ILE A 30 6.268 1.541 -0.819 1.00 0.00 H new ATOM 0 HD11 ILE A 30 3.065 -1.093 -0.295 1.00 0.00 H new ATOM 0 HD12 ILE A 30 4.595 -1.999 -0.371 1.00 0.00 H new ATOM 0 HD13 ILE A 30 4.554 -0.381 0.370 1.00 0.00 H new ATOM 509 N ILE A 31 6.308 -1.303 -5.079 1.00 0.00 N ATOM 510 CA ILE A 31 5.863 -2.143 -6.200 1.00 0.00 C ATOM 511 C ILE A 31 5.508 -3.530 -5.666 1.00 0.00 C ATOM 512 O ILE A 31 6.298 -4.139 -4.941 1.00 0.00 O ATOM 513 CB ILE A 31 6.954 -2.258 -7.296 1.00 0.00 C ATOM 514 CG1 ILE A 31 7.567 -0.877 -7.641 1.00 0.00 C ATOM 515 CG2 ILE A 31 6.363 -2.945 -8.548 1.00 0.00 C ATOM 516 CD1 ILE A 31 8.611 -0.897 -8.764 1.00 0.00 C ATOM 0 H ILE A 31 7.207 -1.603 -4.702 1.00 0.00 H new ATOM 0 HA ILE A 31 4.989 -1.680 -6.658 1.00 0.00 H new ATOM 0 HB ILE A 31 7.768 -2.872 -6.912 1.00 0.00 H new ATOM 0 HG12 ILE A 31 6.762 -0.199 -7.925 1.00 0.00 H new ATOM 0 HG13 ILE A 31 8.028 -0.466 -6.743 1.00 0.00 H new ATOM 0 HG21 ILE A 31 7.132 -3.024 -9.317 1.00 0.00 H new ATOM 0 HG22 ILE A 31 6.010 -3.942 -8.284 1.00 0.00 H new ATOM 0 HG23 ILE A 31 5.530 -2.354 -8.928 1.00 0.00 H new ATOM 0 HD11 ILE A 31 8.982 0.114 -8.934 1.00 0.00 H new ATOM 0 HD12 ILE A 31 9.440 -1.545 -8.479 1.00 0.00 H new ATOM 0 HD13 ILE A 31 8.154 -1.274 -9.679 1.00 0.00 H new ATOM 528 N ALA A 32 4.350 -4.050 -6.064 1.00 0.00 N ATOM 529 CA ALA A 32 3.842 -5.351 -5.654 1.00 0.00 C ATOM 530 C ALA A 32 3.365 -6.172 -6.857 1.00 0.00 C ATOM 531 O ALA A 32 2.792 -5.630 -7.801 1.00 0.00 O ATOM 532 CB ALA A 32 2.716 -5.091 -4.653 1.00 0.00 C ATOM 0 H ALA A 32 3.721 -3.560 -6.701 1.00 0.00 H new ATOM 0 HA ALA A 32 4.629 -5.946 -5.190 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.302 -6.041 -4.316 1.00 0.00 H new ATOM 0 HB2 ALA A 32 3.109 -4.543 -3.797 1.00 0.00 H new ATOM 0 HB3 ALA A 32 1.932 -4.503 -5.131 1.00 0.00 H new ATOM 538 N ASN A 33 3.585 -7.487 -6.824 1.00 0.00 N ATOM 539 CA ASN A 33 3.131 -8.406 -7.862 1.00 0.00 C ATOM 540 C ASN A 33 1.591 -8.528 -7.889 1.00 0.00 C ATOM 541 O ASN A 33 0.998 -8.995 -6.922 1.00 0.00 O ATOM 542 CB ASN A 33 3.797 -9.761 -7.587 1.00 0.00 C ATOM 543 CG ASN A 33 3.525 -10.724 -8.723 1.00 0.00 C ATOM 544 OD1 ASN A 33 2.446 -11.292 -8.823 1.00 0.00 O ATOM 545 ND2 ASN A 33 4.469 -10.862 -9.627 1.00 0.00 N ATOM 0 H ASN A 33 4.089 -7.947 -6.066 1.00 0.00 H new ATOM 0 HA ASN A 33 3.414 -8.032 -8.846 1.00 0.00 H new ATOM 0 HB2 ASN A 33 4.872 -9.627 -7.465 1.00 0.00 H new ATOM 0 HB3 ASN A 33 3.420 -10.176 -6.652 1.00 0.00 H new ATOM 0 HD21 ASN A 33 4.313 -11.456 -10.441 1.00 0.00 H new ATOM 0 HD22 ASN A 33 5.358 -10.375 -9.515 1.00 0.00 H new ATOM 552 N ALA A 34 0.937 -8.173 -9.001 1.00 0.00 N ATOM 553 CA ALA A 34 -0.531 -8.220 -9.130 1.00 0.00 C ATOM 554 C ALA A 34 -1.088 -9.634 -9.413 1.00 0.00 C ATOM 555 O ALA A 34 -2.277 -9.876 -9.210 1.00 0.00 O ATOM 556 CB ALA A 34 -0.953 -7.232 -10.228 1.00 0.00 C ATOM 0 H ALA A 34 1.410 -7.843 -9.842 1.00 0.00 H new ATOM 0 HA ALA A 34 -0.959 -7.936 -8.169 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -2.037 -7.252 -10.339 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -0.635 -6.226 -9.954 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -0.487 -7.516 -11.172 1.00 0.00 H new ATOM 562 N ARG A 35 -0.247 -10.560 -9.903 1.00 0.00 N ATOM 563 CA ARG A 35 -0.631 -11.946 -10.237 1.00 0.00 C ATOM 564 C ARG A 35 -0.747 -12.841 -8.985 1.00 0.00 C ATOM 565 O ARG A 35 -1.648 -13.677 -8.910 1.00 0.00 O ATOM 566 CB ARG A 35 0.370 -12.538 -11.252 1.00 0.00 C ATOM 567 CG ARG A 35 0.591 -11.721 -12.544 1.00 0.00 C ATOM 568 CD ARG A 35 -0.578 -11.734 -13.542 1.00 0.00 C ATOM 569 NE ARG A 35 -1.727 -10.919 -13.099 1.00 0.00 N ATOM 570 CZ ARG A 35 -2.940 -10.912 -13.648 1.00 0.00 C ATOM 571 NH1 ARG A 35 -3.227 -11.628 -14.715 1.00 0.00 N ATOM 572 NH2 ARG A 35 -3.894 -10.175 -13.121 1.00 0.00 N ATOM 0 H ARG A 35 0.738 -10.365 -10.082 1.00 0.00 H new ATOM 0 HA ARG A 35 -1.622 -11.917 -10.689 1.00 0.00 H new ATOM 0 HB2 ARG A 35 1.332 -12.659 -10.754 1.00 0.00 H new ATOM 0 HB3 ARG A 35 0.027 -13.534 -11.531 1.00 0.00 H new ATOM 0 HG2 ARG A 35 0.799 -10.687 -12.268 1.00 0.00 H new ATOM 0 HG3 ARG A 35 1.480 -12.102 -13.047 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -0.229 -11.365 -14.506 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -0.907 -12.762 -13.694 1.00 0.00 H new ATOM 0 HE ARG A 35 -1.578 -10.305 -12.299 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -2.510 -12.211 -15.146 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -4.167 -11.600 -15.110 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -3.704 -9.610 -12.293 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -4.824 -10.168 -13.540 1.00 0.00 H new ATOM 586 N VAL A 36 0.123 -12.642 -7.990 1.00 0.00 N ATOM 587 CA VAL A 36 0.050 -13.267 -6.651 1.00 0.00 C ATOM 588 C VAL A 36 -1.130 -12.669 -5.870 1.00 0.00 C ATOM 589 O VAL A 36 -1.256 -11.451 -5.787 1.00 0.00 O ATOM 590 CB VAL A 36 1.385 -13.097 -5.880 1.00 0.00 C ATOM 591 CG1 VAL A 36 1.286 -13.505 -4.401 1.00 0.00 C ATOM 592 CG2 VAL A 36 2.496 -13.933 -6.538 1.00 0.00 C ATOM 0 H VAL A 36 0.927 -12.022 -8.090 1.00 0.00 H new ATOM 0 HA VAL A 36 -0.115 -14.338 -6.768 1.00 0.00 H new ATOM 0 HB VAL A 36 1.620 -12.033 -5.923 1.00 0.00 H new ATOM 0 HG11 VAL A 36 2.253 -13.362 -3.919 1.00 0.00 H new ATOM 0 HG12 VAL A 36 0.538 -12.889 -3.903 1.00 0.00 H new ATOM 0 HG13 VAL A 36 0.997 -14.554 -4.331 1.00 0.00 H new ATOM 0 HG21 VAL A 36 3.426 -13.802 -5.985 1.00 0.00 H new ATOM 0 HG22 VAL A 36 2.213 -14.986 -6.529 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.637 -13.604 -7.568 1.00 0.00 H new ATOM 602 N GLU A 37 -1.976 -13.526 -5.285 1.00 0.00 N ATOM 603 CA GLU A 37 -3.268 -13.141 -4.689 1.00 0.00 C ATOM 604 C GLU A 37 -3.136 -12.121 -3.540 1.00 0.00 C ATOM 605 O GLU A 37 -3.882 -11.143 -3.490 1.00 0.00 O ATOM 606 CB GLU A 37 -3.988 -14.418 -4.218 1.00 0.00 C ATOM 607 CG GLU A 37 -5.420 -14.164 -3.732 1.00 0.00 C ATOM 608 CD GLU A 37 -6.113 -15.486 -3.369 1.00 0.00 C ATOM 609 OE1 GLU A 37 -5.987 -15.942 -2.207 1.00 0.00 O ATOM 610 OE2 GLU A 37 -6.796 -16.079 -4.239 1.00 0.00 O ATOM 0 H GLU A 37 -1.781 -14.524 -5.210 1.00 0.00 H new ATOM 0 HA GLU A 37 -3.854 -12.633 -5.455 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -4.012 -15.136 -5.038 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -3.414 -14.874 -3.411 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -5.403 -13.506 -2.863 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -5.987 -13.652 -4.509 1.00 0.00 H new ATOM 617 N ASN A 38 -2.163 -12.308 -2.638 1.00 0.00 N ATOM 618 CA ASN A 38 -1.906 -11.389 -1.517 1.00 0.00 C ATOM 619 C ASN A 38 -1.212 -10.072 -1.935 1.00 0.00 C ATOM 620 O ASN A 38 -1.103 -9.165 -1.114 1.00 0.00 O ATOM 621 CB ASN A 38 -1.119 -12.124 -0.413 1.00 0.00 C ATOM 622 CG ASN A 38 0.278 -12.568 -0.842 1.00 0.00 C ATOM 623 OD1 ASN A 38 1.157 -11.754 -1.092 1.00 0.00 O ATOM 624 ND2 ASN A 38 0.513 -13.863 -0.965 1.00 0.00 N ATOM 0 H ASN A 38 -1.527 -13.105 -2.664 1.00 0.00 H new ATOM 0 HA ASN A 38 -2.876 -11.081 -1.126 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -1.032 -11.470 0.454 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -1.687 -12.999 -0.096 1.00 0.00 H new ATOM 0 HD21 ASN A 38 1.431 -14.188 -1.270 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -0.223 -14.537 -0.755 1.00 0.00 H new ATOM 631 N CYS A 39 -0.729 -9.960 -3.182 1.00 0.00 N ATOM 632 CA CYS A 39 0.038 -8.823 -3.711 1.00 0.00 C ATOM 633 C CYS A 39 1.295 -8.512 -2.872 1.00 0.00 C ATOM 634 O CYS A 39 1.397 -7.461 -2.238 1.00 0.00 O ATOM 635 CB CYS A 39 -0.886 -7.612 -3.934 1.00 0.00 C ATOM 636 SG CYS A 39 -2.126 -7.997 -5.208 1.00 0.00 S ATOM 0 H CYS A 39 -0.869 -10.692 -3.879 1.00 0.00 H new ATOM 0 HA CYS A 39 0.434 -9.100 -4.688 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -1.383 -7.347 -3.001 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -0.297 -6.747 -4.238 1.00 0.00 H new ATOM 0 HG CYS A 39 -2.022 -9.247 -5.551 1.00 0.00 H new ATOM 642 N ALA A 40 2.255 -9.441 -2.847 1.00 0.00 N ATOM 643 CA ALA A 40 3.513 -9.282 -2.117 1.00 0.00 C ATOM 644 C ALA A 40 4.336 -8.089 -2.638 1.00 0.00 C ATOM 645 O ALA A 40 4.491 -7.957 -3.853 1.00 0.00 O ATOM 646 CB ALA A 40 4.322 -10.587 -2.209 1.00 0.00 C ATOM 0 H ALA A 40 2.179 -10.332 -3.338 1.00 0.00 H new ATOM 0 HA ALA A 40 3.280 -9.070 -1.074 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.260 -10.472 -1.666 1.00 0.00 H new ATOM 0 HB2 ALA A 40 3.747 -11.403 -1.772 1.00 0.00 H new ATOM 0 HB3 ALA A 40 4.533 -10.811 -3.255 1.00 0.00 H new ATOM 652 N VAL A 41 4.907 -7.268 -1.744 1.00 0.00 N ATOM 653 CA VAL A 41 5.899 -6.233 -2.123 1.00 0.00 C ATOM 654 C VAL A 41 7.126 -6.917 -2.733 1.00 0.00 C ATOM 655 O VAL A 41 7.767 -7.744 -2.082 1.00 0.00 O ATOM 656 CB VAL A 41 6.337 -5.307 -0.954 1.00 0.00 C ATOM 657 CG1 VAL A 41 7.278 -4.185 -1.418 1.00 0.00 C ATOM 658 CG2 VAL A 41 5.099 -4.671 -0.299 1.00 0.00 C ATOM 0 H VAL A 41 4.701 -7.296 -0.745 1.00 0.00 H new ATOM 0 HA VAL A 41 5.408 -5.582 -2.846 1.00 0.00 H new ATOM 0 HB VAL A 41 6.876 -5.930 -0.240 1.00 0.00 H new ATOM 0 HG11 VAL A 41 7.555 -3.566 -0.565 1.00 0.00 H new ATOM 0 HG12 VAL A 41 8.176 -4.621 -1.857 1.00 0.00 H new ATOM 0 HG13 VAL A 41 6.772 -3.571 -2.163 1.00 0.00 H new ATOM 0 HG21 VAL A 41 5.413 -4.023 0.520 1.00 0.00 H new ATOM 0 HG22 VAL A 41 4.557 -4.083 -1.040 1.00 0.00 H new ATOM 0 HG23 VAL A 41 4.449 -5.455 0.088 1.00 0.00 H new ATOM 668 N ILE A 42 7.439 -6.562 -3.982 1.00 0.00 N ATOM 669 CA ILE A 42 8.631 -7.021 -4.720 1.00 0.00 C ATOM 670 C ILE A 42 9.718 -5.945 -4.791 1.00 0.00 C ATOM 671 O ILE A 42 10.876 -6.266 -5.059 1.00 0.00 O ATOM 672 CB ILE A 42 8.262 -7.514 -6.140 1.00 0.00 C ATOM 673 CG1 ILE A 42 7.529 -6.449 -6.987 1.00 0.00 C ATOM 674 CG2 ILE A 42 7.451 -8.812 -6.024 1.00 0.00 C ATOM 675 CD1 ILE A 42 7.314 -6.856 -8.449 1.00 0.00 C ATOM 0 H ILE A 42 6.856 -5.928 -4.529 1.00 0.00 H new ATOM 0 HA ILE A 42 9.038 -7.862 -4.159 1.00 0.00 H new ATOM 0 HB ILE A 42 9.189 -7.710 -6.680 1.00 0.00 H new ATOM 0 HG12 ILE A 42 6.561 -6.241 -6.532 1.00 0.00 H new ATOM 0 HG13 ILE A 42 8.100 -5.521 -6.959 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.187 -9.166 -7.020 1.00 0.00 H new ATOM 0 HG22 ILE A 42 8.048 -9.570 -5.516 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.542 -8.623 -5.453 1.00 0.00 H new ATOM 0 HD11 ILE A 42 6.794 -6.057 -8.977 1.00 0.00 H new ATOM 0 HD12 ILE A 42 8.279 -7.035 -8.923 1.00 0.00 H new ATOM 0 HD13 ILE A 42 6.716 -7.766 -8.489 1.00 0.00 H new ATOM 687 N TYR A 43 9.357 -4.685 -4.525 1.00 0.00 N ATOM 688 CA TYR A 43 10.286 -3.558 -4.463 1.00 0.00 C ATOM 689 C TYR A 43 9.706 -2.377 -3.672 1.00 0.00 C ATOM 690 O TYR A 43 8.497 -2.171 -3.639 1.00 0.00 O ATOM 691 CB TYR A 43 10.678 -3.130 -5.889 1.00 0.00 C ATOM 692 CG TYR A 43 12.047 -2.479 -5.940 1.00 0.00 C ATOM 693 CD1 TYR A 43 13.200 -3.270 -5.768 1.00 0.00 C ATOM 694 CD2 TYR A 43 12.170 -1.082 -6.083 1.00 0.00 C ATOM 695 CE1 TYR A 43 14.473 -2.670 -5.727 1.00 0.00 C ATOM 696 CE2 TYR A 43 13.442 -0.476 -6.050 1.00 0.00 C ATOM 697 CZ TYR A 43 14.598 -1.270 -5.867 1.00 0.00 C ATOM 698 OH TYR A 43 15.833 -0.695 -5.803 1.00 0.00 O ATOM 0 H TYR A 43 8.390 -4.418 -4.343 1.00 0.00 H new ATOM 0 HA TYR A 43 11.179 -3.883 -3.929 1.00 0.00 H new ATOM 0 HB2 TYR A 43 10.668 -4.002 -6.543 1.00 0.00 H new ATOM 0 HB3 TYR A 43 9.933 -2.434 -6.275 1.00 0.00 H new ATOM 0 HD1 TYR A 43 13.107 -4.341 -5.667 1.00 0.00 H new ATOM 0 HD2 TYR A 43 11.287 -0.475 -6.218 1.00 0.00 H new ATOM 0 HE1 TYR A 43 15.354 -3.280 -5.589 1.00 0.00 H new ATOM 0 HE2 TYR A 43 13.534 0.594 -6.164 1.00 0.00 H new ATOM 0 HH TYR A 43 15.749 0.275 -5.919 1.00 0.00 H new ATOM 708 N CYS A 44 10.556 -1.560 -3.062 1.00 0.00 N ATOM 709 CA CYS A 44 10.162 -0.371 -2.294 1.00 0.00 C ATOM 710 C CYS A 44 11.189 0.773 -2.398 1.00 0.00 C ATOM 711 O CYS A 44 12.359 0.520 -2.688 1.00 0.00 O ATOM 712 CB CYS A 44 9.861 -0.811 -0.850 1.00 0.00 C ATOM 713 SG CYS A 44 11.213 -1.810 -0.163 1.00 0.00 S ATOM 0 H CYS A 44 11.566 -1.704 -3.084 1.00 0.00 H new ATOM 0 HA CYS A 44 9.257 0.061 -2.720 1.00 0.00 H new ATOM 0 HB2 CYS A 44 9.704 0.069 -0.226 1.00 0.00 H new ATOM 0 HB3 CYS A 44 8.935 -1.386 -0.829 1.00 0.00 H new ATOM 0 HG CYS A 44 11.451 -1.437 1.059 1.00 0.00 H new ATOM 719 N ASN A 45 10.743 2.021 -2.199 1.00 0.00 N ATOM 720 CA ASN A 45 11.598 3.223 -2.330 1.00 0.00 C ATOM 721 C ASN A 45 12.552 3.406 -1.112 1.00 0.00 C ATOM 722 O ASN A 45 12.866 2.448 -0.413 1.00 0.00 O ATOM 723 CB ASN A 45 10.689 4.453 -2.593 1.00 0.00 C ATOM 724 CG ASN A 45 11.429 5.682 -3.142 1.00 0.00 C ATOM 725 OD1 ASN A 45 12.590 5.623 -3.521 1.00 0.00 O ATOM 726 ND2 ASN A 45 10.818 6.851 -3.119 1.00 0.00 N ATOM 0 H ASN A 45 9.779 2.232 -1.942 1.00 0.00 H new ATOM 0 HA ASN A 45 12.267 3.103 -3.182 1.00 0.00 H new ATOM 0 HB2 ASN A 45 9.908 4.169 -3.299 1.00 0.00 H new ATOM 0 HB3 ASN A 45 10.193 4.728 -1.663 1.00 0.00 H new ATOM 0 HD21 ASN A 45 11.314 7.692 -3.415 1.00 0.00 H new ATOM 0 HD22 ASN A 45 9.850 6.914 -2.805 1.00 0.00 H new ATOM 733 N ASP A 46 12.987 4.636 -0.807 1.00 0.00 N ATOM 734 CA ASP A 46 13.631 5.018 0.461 1.00 0.00 C ATOM 735 C ASP A 46 12.730 5.899 1.350 1.00 0.00 C ATOM 736 O ASP A 46 12.908 5.927 2.568 1.00 0.00 O ATOM 737 CB ASP A 46 14.939 5.762 0.140 1.00 0.00 C ATOM 738 CG ASP A 46 15.969 4.888 -0.597 1.00 0.00 C ATOM 739 OD1 ASP A 46 16.600 4.023 0.057 1.00 0.00 O ATOM 740 OD2 ASP A 46 16.179 5.093 -1.818 1.00 0.00 O ATOM 0 H ASP A 46 12.898 5.419 -1.455 1.00 0.00 H new ATOM 0 HA ASP A 46 13.827 4.107 1.026 1.00 0.00 H new ATOM 0 HB2 ASP A 46 14.712 6.636 -0.470 1.00 0.00 H new ATOM 0 HB3 ASP A 46 15.379 6.126 1.068 1.00 0.00 H new ATOM 745 N GLY A 47 11.728 6.581 0.771 1.00 0.00 N ATOM 746 CA GLY A 47 10.852 7.510 1.494 1.00 0.00 C ATOM 747 C GLY A 47 9.818 6.789 2.350 1.00 0.00 C ATOM 748 O GLY A 47 9.544 7.213 3.469 1.00 0.00 O ATOM 0 H GLY A 47 11.504 6.500 -0.221 1.00 0.00 H new ATOM 0 HA2 GLY A 47 11.458 8.156 2.129 1.00 0.00 H new ATOM 0 HA3 GLY A 47 10.341 8.154 0.778 1.00 0.00 H new ATOM 752 N PHE A 48 9.281 5.667 1.848 1.00 0.00 N ATOM 753 CA PHE A 48 8.304 4.827 2.559 1.00 0.00 C ATOM 754 C PHE A 48 8.863 4.354 3.921 1.00 0.00 C ATOM 755 O PHE A 48 8.174 4.421 4.939 1.00 0.00 O ATOM 756 CB PHE A 48 7.858 3.665 1.631 1.00 0.00 C ATOM 757 CG PHE A 48 8.700 2.402 1.724 1.00 0.00 C ATOM 758 CD1 PHE A 48 10.060 2.407 1.352 1.00 0.00 C ATOM 759 CD2 PHE A 48 8.155 1.254 2.326 1.00 0.00 C ATOM 760 CE1 PHE A 48 10.889 1.330 1.723 1.00 0.00 C ATOM 761 CE2 PHE A 48 8.981 0.170 2.658 1.00 0.00 C ATOM 762 CZ PHE A 48 10.354 0.221 2.393 1.00 0.00 C ATOM 0 H PHE A 48 9.517 5.312 0.921 1.00 0.00 H new ATOM 0 HA PHE A 48 7.415 5.410 2.800 1.00 0.00 H new ATOM 0 HB2 PHE A 48 6.824 3.411 1.865 1.00 0.00 H new ATOM 0 HB3 PHE A 48 7.874 4.018 0.600 1.00 0.00 H new ATOM 0 HD1 PHE A 48 10.464 3.233 0.785 1.00 0.00 H new ATOM 0 HD2 PHE A 48 7.096 1.207 2.534 1.00 0.00 H new ATOM 0 HE1 PHE A 48 11.943 1.359 1.490 1.00 0.00 H new ATOM 0 HE2 PHE A 48 8.555 -0.708 3.120 1.00 0.00 H new ATOM 0 HZ PHE A 48 10.998 -0.589 2.703 1.00 0.00 H new ATOM 772 N CYS A 49 10.148 3.966 3.947 1.00 0.00 N ATOM 773 CA CYS A 49 10.891 3.525 5.132 1.00 0.00 C ATOM 774 C CYS A 49 10.892 4.585 6.245 1.00 0.00 C ATOM 775 O CYS A 49 10.480 4.291 7.364 1.00 0.00 O ATOM 776 CB CYS A 49 12.299 3.132 4.652 1.00 0.00 C ATOM 777 SG CYS A 49 13.378 2.625 6.019 1.00 0.00 S ATOM 0 H CYS A 49 10.721 3.952 3.103 1.00 0.00 H new ATOM 0 HA CYS A 49 10.411 2.663 5.596 1.00 0.00 H new ATOM 0 HB2 CYS A 49 12.220 2.317 3.933 1.00 0.00 H new ATOM 0 HB3 CYS A 49 12.751 3.975 4.130 1.00 0.00 H new ATOM 0 HG CYS A 49 12.679 1.986 6.910 1.00 0.00 H new ATOM 783 N GLU A 50 11.293 5.821 5.936 1.00 0.00 N ATOM 784 CA GLU A 50 11.353 6.910 6.923 1.00 0.00 C ATOM 785 C GLU A 50 9.964 7.446 7.323 1.00 0.00 C ATOM 786 O GLU A 50 9.779 7.895 8.456 1.00 0.00 O ATOM 787 CB GLU A 50 12.224 8.054 6.388 1.00 0.00 C ATOM 788 CG GLU A 50 13.679 7.613 6.202 1.00 0.00 C ATOM 789 CD GLU A 50 14.568 8.821 5.879 1.00 0.00 C ATOM 790 OE1 GLU A 50 14.628 9.244 4.701 1.00 0.00 O ATOM 791 OE2 GLU A 50 15.213 9.368 6.805 1.00 0.00 O ATOM 0 H GLU A 50 11.585 6.098 4.999 1.00 0.00 H new ATOM 0 HA GLU A 50 11.797 6.491 7.826 1.00 0.00 H new ATOM 0 HB2 GLU A 50 11.824 8.402 5.436 1.00 0.00 H new ATOM 0 HB3 GLU A 50 12.184 8.897 7.078 1.00 0.00 H new ATOM 0 HG2 GLU A 50 14.036 7.123 7.108 1.00 0.00 H new ATOM 0 HG3 GLU A 50 13.743 6.881 5.397 1.00 0.00 H new ATOM 798 N LEU A 51 8.979 7.370 6.418 1.00 0.00 N ATOM 799 CA LEU A 51 7.587 7.782 6.642 1.00 0.00 C ATOM 800 C LEU A 51 6.901 6.921 7.720 1.00 0.00 C ATOM 801 O LEU A 51 6.220 7.471 8.588 1.00 0.00 O ATOM 802 CB LEU A 51 6.913 7.775 5.248 1.00 0.00 C ATOM 803 CG LEU A 51 5.404 8.056 5.080 1.00 0.00 C ATOM 804 CD1 LEU A 51 4.575 6.776 5.186 1.00 0.00 C ATOM 805 CD2 LEU A 51 4.863 9.166 5.986 1.00 0.00 C ATOM 0 H LEU A 51 9.135 7.007 5.477 1.00 0.00 H new ATOM 0 HA LEU A 51 7.507 8.785 7.062 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.441 8.507 4.637 1.00 0.00 H new ATOM 0 HB3 LEU A 51 7.104 6.796 4.809 1.00 0.00 H new ATOM 0 HG LEU A 51 5.296 8.444 4.067 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.519 7.015 5.063 1.00 0.00 H new ATOM 0 HD12 LEU A 51 4.882 6.078 4.407 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.732 6.321 6.164 1.00 0.00 H new ATOM 0 HD21 LEU A 51 3.797 9.298 5.803 1.00 0.00 H new ATOM 0 HD22 LEU A 51 5.021 8.893 7.029 1.00 0.00 H new ATOM 0 HD23 LEU A 51 5.386 10.098 5.771 1.00 0.00 H new ATOM 817 N CYS A 52 7.107 5.598 7.715 1.00 0.00 N ATOM 818 CA CYS A 52 6.504 4.681 8.698 1.00 0.00 C ATOM 819 C CYS A 52 7.441 4.254 9.849 1.00 0.00 C ATOM 820 O CYS A 52 6.969 3.949 10.947 1.00 0.00 O ATOM 821 CB CYS A 52 5.987 3.461 7.931 1.00 0.00 C ATOM 822 SG CYS A 52 4.829 2.567 8.999 1.00 0.00 S ATOM 0 H CYS A 52 7.698 5.129 7.028 1.00 0.00 H new ATOM 0 HA CYS A 52 5.698 5.217 9.200 1.00 0.00 H new ATOM 0 HB2 CYS A 52 5.492 3.772 7.011 1.00 0.00 H new ATOM 0 HB3 CYS A 52 6.816 2.814 7.644 1.00 0.00 H new ATOM 0 HG CYS A 52 4.957 1.288 8.803 1.00 0.00 H new ATOM 828 N GLY A 53 8.755 4.206 9.616 1.00 0.00 N ATOM 829 CA GLY A 53 9.770 3.811 10.602 1.00 0.00 C ATOM 830 C GLY A 53 10.078 2.310 10.614 1.00 0.00 C ATOM 831 O GLY A 53 10.733 1.838 11.543 1.00 0.00 O ATOM 0 H GLY A 53 9.156 4.448 8.710 1.00 0.00 H new ATOM 0 HA2 GLY A 53 10.691 4.358 10.400 1.00 0.00 H new ATOM 0 HA3 GLY A 53 9.433 4.110 11.595 1.00 0.00 H new ATOM 835 N TYR A 54 9.612 1.553 9.611 1.00 0.00 N ATOM 836 CA TYR A 54 10.001 0.154 9.382 1.00 0.00 C ATOM 837 C TYR A 54 11.277 0.057 8.504 1.00 0.00 C ATOM 838 O TYR A 54 12.067 0.999 8.466 1.00 0.00 O ATOM 839 CB TYR A 54 8.775 -0.632 8.870 1.00 0.00 C ATOM 840 CG TYR A 54 7.953 -0.067 7.721 1.00 0.00 C ATOM 841 CD1 TYR A 54 8.523 0.719 6.701 1.00 0.00 C ATOM 842 CD2 TYR A 54 6.573 -0.356 7.682 1.00 0.00 C ATOM 843 CE1 TYR A 54 7.714 1.237 5.673 1.00 0.00 C ATOM 844 CE2 TYR A 54 5.763 0.149 6.649 1.00 0.00 C ATOM 845 CZ TYR A 54 6.330 0.960 5.642 1.00 0.00 C ATOM 846 OH TYR A 54 5.550 1.482 4.654 1.00 0.00 O ATOM 0 H TYR A 54 8.943 1.901 8.924 1.00 0.00 H new ATOM 0 HA TYR A 54 10.299 -0.324 10.315 1.00 0.00 H new ATOM 0 HB2 TYR A 54 9.122 -1.620 8.569 1.00 0.00 H new ATOM 0 HB3 TYR A 54 8.101 -0.775 9.715 1.00 0.00 H new ATOM 0 HD1 TYR A 54 9.583 0.925 6.708 1.00 0.00 H new ATOM 0 HD2 TYR A 54 6.134 -0.971 8.453 1.00 0.00 H new ATOM 0 HE1 TYR A 54 8.155 1.851 4.902 1.00 0.00 H new ATOM 0 HE2 TYR A 54 4.709 -0.083 6.626 1.00 0.00 H new ATOM 0 HH TYR A 54 4.623 1.192 4.781 1.00 0.00 H new ATOM 856 N SER A 55 11.473 -1.050 7.777 1.00 0.00 N ATOM 857 CA SER A 55 12.613 -1.264 6.863 1.00 0.00 C ATOM 858 C SER A 55 12.210 -2.176 5.692 1.00 0.00 C ATOM 859 O SER A 55 11.291 -2.994 5.831 1.00 0.00 O ATOM 860 CB SER A 55 13.799 -1.917 7.610 1.00 0.00 C ATOM 861 OG SER A 55 14.298 -1.115 8.674 1.00 0.00 O ATOM 0 H SER A 55 10.832 -1.843 7.805 1.00 0.00 H new ATOM 0 HA SER A 55 12.912 -0.288 6.481 1.00 0.00 H new ATOM 0 HB2 SER A 55 13.484 -2.882 8.007 1.00 0.00 H new ATOM 0 HB3 SER A 55 14.604 -2.112 6.901 1.00 0.00 H new ATOM 0 HG SER A 55 15.044 -1.577 9.110 1.00 0.00 H new ATOM 867 N ARG A 56 12.947 -2.123 4.569 1.00 0.00 N ATOM 868 CA ARG A 56 12.772 -3.039 3.422 1.00 0.00 C ATOM 869 C ARG A 56 12.716 -4.503 3.880 1.00 0.00 C ATOM 870 O ARG A 56 11.761 -5.195 3.563 1.00 0.00 O ATOM 871 CB ARG A 56 13.880 -2.788 2.372 1.00 0.00 C ATOM 872 CG ARG A 56 13.859 -3.826 1.231 1.00 0.00 C ATOM 873 CD ARG A 56 14.856 -3.549 0.102 1.00 0.00 C ATOM 874 NE ARG A 56 14.410 -2.474 -0.808 1.00 0.00 N ATOM 875 CZ ARG A 56 15.156 -1.961 -1.787 1.00 0.00 C ATOM 876 NH1 ARG A 56 16.358 -2.426 -2.067 1.00 0.00 N ATOM 877 NH2 ARG A 56 14.717 -0.965 -2.521 1.00 0.00 N ATOM 0 H ARG A 56 13.689 -1.437 4.428 1.00 0.00 H new ATOM 0 HA ARG A 56 11.813 -2.833 2.947 1.00 0.00 H new ATOM 0 HB2 ARG A 56 13.759 -1.789 1.952 1.00 0.00 H new ATOM 0 HB3 ARG A 56 14.853 -2.812 2.863 1.00 0.00 H new ATOM 0 HG2 ARG A 56 14.067 -4.811 1.649 1.00 0.00 H new ATOM 0 HG3 ARG A 56 12.854 -3.864 0.810 1.00 0.00 H new ATOM 0 HD2 ARG A 56 15.819 -3.277 0.533 1.00 0.00 H new ATOM 0 HD3 ARG A 56 15.011 -4.463 -0.472 1.00 0.00 H new ATOM 0 HE ARG A 56 13.470 -2.100 -0.679 1.00 0.00 H new ATOM 0 HH11 ARG A 56 16.743 -3.201 -1.528 1.00 0.00 H new ATOM 0 HH12 ARG A 56 16.902 -2.010 -2.823 1.00 0.00 H new ATOM 0 HH21 ARG A 56 13.792 -0.572 -2.346 1.00 0.00 H new ATOM 0 HH22 ARG A 56 15.301 -0.584 -3.266 1.00 0.00 H new ATOM 891 N ALA A 57 13.653 -4.950 4.716 1.00 0.00 N ATOM 892 CA ALA A 57 13.695 -6.314 5.267 1.00 0.00 C ATOM 893 C ALA A 57 12.402 -6.755 5.994 1.00 0.00 C ATOM 894 O ALA A 57 12.109 -7.951 6.034 1.00 0.00 O ATOM 895 CB ALA A 57 14.900 -6.390 6.213 1.00 0.00 C ATOM 0 H ALA A 57 14.423 -4.365 5.039 1.00 0.00 H new ATOM 0 HA ALA A 57 13.787 -7.009 4.432 1.00 0.00 H new ATOM 0 HB1 ALA A 57 14.963 -7.390 6.642 1.00 0.00 H new ATOM 0 HB2 ALA A 57 15.813 -6.175 5.658 1.00 0.00 H new ATOM 0 HB3 ALA A 57 14.781 -5.659 7.013 1.00 0.00 H new ATOM 901 N GLU A 58 11.626 -5.808 6.538 1.00 0.00 N ATOM 902 CA GLU A 58 10.371 -6.068 7.254 1.00 0.00 C ATOM 903 C GLU A 58 9.152 -6.000 6.322 1.00 0.00 C ATOM 904 O GLU A 58 8.221 -6.784 6.491 1.00 0.00 O ATOM 905 CB GLU A 58 10.186 -5.034 8.376 1.00 0.00 C ATOM 906 CG GLU A 58 11.394 -4.932 9.310 1.00 0.00 C ATOM 907 CD GLU A 58 11.638 -6.225 10.107 1.00 0.00 C ATOM 908 OE1 GLU A 58 10.822 -6.553 11.000 1.00 0.00 O ATOM 909 OE2 GLU A 58 12.659 -6.911 9.862 1.00 0.00 O ATOM 0 H GLU A 58 11.860 -4.816 6.491 1.00 0.00 H new ATOM 0 HA GLU A 58 10.438 -7.075 7.665 1.00 0.00 H new ATOM 0 HB2 GLU A 58 9.995 -4.057 7.932 1.00 0.00 H new ATOM 0 HB3 GLU A 58 9.304 -5.296 8.961 1.00 0.00 H new ATOM 0 HG2 GLU A 58 12.283 -4.698 8.724 1.00 0.00 H new ATOM 0 HG3 GLU A 58 11.243 -4.105 10.004 1.00 0.00 H new ATOM 916 N VAL A 59 9.154 -5.068 5.357 1.00 0.00 N ATOM 917 CA VAL A 59 8.045 -4.842 4.402 1.00 0.00 C ATOM 918 C VAL A 59 8.147 -5.756 3.163 1.00 0.00 C ATOM 919 O VAL A 59 7.160 -5.962 2.458 1.00 0.00 O ATOM 920 CB VAL A 59 7.971 -3.339 4.016 1.00 0.00 C ATOM 921 CG1 VAL A 59 6.858 -3.025 2.997 1.00 0.00 C ATOM 922 CG2 VAL A 59 7.696 -2.508 5.278 1.00 0.00 C ATOM 0 H VAL A 59 9.940 -4.435 5.211 1.00 0.00 H new ATOM 0 HA VAL A 59 7.112 -5.113 4.896 1.00 0.00 H new ATOM 0 HB VAL A 59 8.928 -3.089 3.557 1.00 0.00 H new ATOM 0 HG11 VAL A 59 6.862 -1.959 2.771 1.00 0.00 H new ATOM 0 HG12 VAL A 59 7.033 -3.590 2.082 1.00 0.00 H new ATOM 0 HG13 VAL A 59 5.891 -3.304 3.417 1.00 0.00 H new ATOM 0 HG21 VAL A 59 7.643 -1.452 5.014 1.00 0.00 H new ATOM 0 HG22 VAL A 59 6.749 -2.820 5.720 1.00 0.00 H new ATOM 0 HG23 VAL A 59 8.500 -2.662 5.997 1.00 0.00 H new ATOM 932 N MET A 60 9.309 -6.364 2.911 1.00 0.00 N ATOM 933 CA MET A 60 9.476 -7.387 1.863 1.00 0.00 C ATOM 934 C MET A 60 8.888 -8.736 2.309 1.00 0.00 C ATOM 935 O MET A 60 8.943 -9.081 3.490 1.00 0.00 O ATOM 936 CB MET A 60 10.955 -7.520 1.483 1.00 0.00 C ATOM 937 CG MET A 60 11.434 -6.309 0.673 1.00 0.00 C ATOM 938 SD MET A 60 10.797 -6.156 -1.020 1.00 0.00 S ATOM 939 CE MET A 60 11.698 -7.514 -1.812 1.00 0.00 C ATOM 0 H MET A 60 10.166 -6.164 3.427 1.00 0.00 H new ATOM 0 HA MET A 60 8.925 -7.070 0.978 1.00 0.00 H new ATOM 0 HB2 MET A 60 11.557 -7.617 2.386 1.00 0.00 H new ATOM 0 HB3 MET A 60 11.103 -8.430 0.902 1.00 0.00 H new ATOM 0 HG2 MET A 60 11.165 -5.406 1.221 1.00 0.00 H new ATOM 0 HG3 MET A 60 12.522 -6.341 0.625 1.00 0.00 H new ATOM 0 HE1 MET A 60 11.522 -7.489 -2.887 1.00 0.00 H new ATOM 0 HE2 MET A 60 12.765 -7.406 -1.616 1.00 0.00 H new ATOM 0 HE3 MET A 60 11.350 -8.465 -1.409 1.00 0.00 H new ATOM 949 N GLN A 61 8.281 -9.472 1.362 1.00 0.00 N ATOM 950 CA GLN A 61 7.462 -10.676 1.627 1.00 0.00 C ATOM 951 C GLN A 61 6.262 -10.344 2.550 1.00 0.00 C ATOM 952 O GLN A 61 5.867 -11.137 3.406 1.00 0.00 O ATOM 953 CB GLN A 61 8.327 -11.873 2.110 1.00 0.00 C ATOM 954 CG GLN A 61 9.116 -12.571 0.984 1.00 0.00 C ATOM 955 CD GLN A 61 10.201 -11.713 0.324 1.00 0.00 C ATOM 956 OE1 GLN A 61 10.994 -11.039 0.970 1.00 0.00 O ATOM 957 NE2 GLN A 61 10.274 -11.701 -0.991 1.00 0.00 N ATOM 0 H GLN A 61 8.345 -9.245 0.370 1.00 0.00 H new ATOM 0 HA GLN A 61 7.027 -11.009 0.685 1.00 0.00 H new ATOM 0 HB2 GLN A 61 9.028 -11.520 2.866 1.00 0.00 H new ATOM 0 HB3 GLN A 61 7.679 -12.604 2.593 1.00 0.00 H new ATOM 0 HG2 GLN A 61 9.581 -13.469 1.390 1.00 0.00 H new ATOM 0 HG3 GLN A 61 8.414 -12.895 0.216 1.00 0.00 H new ATOM 0 HE21 GLN A 61 9.621 -12.257 -1.543 1.00 0.00 H new ATOM 0 HE22 GLN A 61 10.984 -11.136 -1.457 1.00 0.00 H new ATOM 966 N ARG A 62 5.673 -9.150 2.377 1.00 0.00 N ATOM 967 CA ARG A 62 4.397 -8.740 2.986 1.00 0.00 C ATOM 968 C ARG A 62 3.398 -8.307 1.902 1.00 0.00 C ATOM 969 O ARG A 62 3.843 -7.860 0.837 1.00 0.00 O ATOM 970 CB ARG A 62 4.613 -7.573 3.971 1.00 0.00 C ATOM 971 CG ARG A 62 5.525 -7.900 5.157 1.00 0.00 C ATOM 972 CD ARG A 62 4.931 -8.951 6.098 1.00 0.00 C ATOM 973 NE ARG A 62 5.881 -9.329 7.156 1.00 0.00 N ATOM 974 CZ ARG A 62 6.792 -10.297 7.119 1.00 0.00 C ATOM 975 NH1 ARG A 62 6.964 -11.080 6.073 1.00 0.00 N ATOM 976 NH2 ARG A 62 7.557 -10.490 8.172 1.00 0.00 N ATOM 0 H ARG A 62 6.083 -8.422 1.792 1.00 0.00 H new ATOM 0 HA ARG A 62 3.995 -9.596 3.528 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.036 -6.729 3.426 1.00 0.00 H new ATOM 0 HB3 ARG A 62 3.643 -7.253 4.353 1.00 0.00 H new ATOM 0 HG2 ARG A 62 6.484 -8.257 4.783 1.00 0.00 H new ATOM 0 HG3 ARG A 62 5.722 -6.987 5.719 1.00 0.00 H new ATOM 0 HD2 ARG A 62 4.018 -8.562 6.550 1.00 0.00 H new ATOM 0 HD3 ARG A 62 4.651 -9.836 5.526 1.00 0.00 H new ATOM 0 HE ARG A 62 5.836 -8.785 8.018 1.00 0.00 H new ATOM 0 HH11 ARG A 62 6.384 -10.957 5.243 1.00 0.00 H new ATOM 0 HH12 ARG A 62 7.677 -11.809 6.093 1.00 0.00 H new ATOM 0 HH21 ARG A 62 7.446 -9.902 8.998 1.00 0.00 H new ATOM 0 HH22 ARG A 62 8.261 -11.228 8.162 1.00 0.00 H new ATOM 990 N PRO A 63 2.078 -8.400 2.163 1.00 0.00 N ATOM 991 CA PRO A 63 1.050 -7.882 1.270 1.00 0.00 C ATOM 992 C PRO A 63 1.102 -6.349 1.257 1.00 0.00 C ATOM 993 O PRO A 63 1.246 -5.714 2.303 1.00 0.00 O ATOM 994 CB PRO A 63 -0.275 -8.416 1.821 1.00 0.00 C ATOM 995 CG PRO A 63 -0.017 -8.604 3.312 1.00 0.00 C ATOM 996 CD PRO A 63 1.469 -8.957 3.369 1.00 0.00 C ATOM 0 HA PRO A 63 1.185 -8.198 0.236 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -1.090 -7.715 1.644 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -0.554 -9.356 1.344 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -0.237 -7.698 3.876 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -0.636 -9.398 3.730 1.00 0.00 H new ATOM 0 HD2 PRO A 63 1.932 -8.541 4.264 1.00 0.00 H new ATOM 0 HD3 PRO A 63 1.609 -10.037 3.410 1.00 0.00 H new ATOM 1004 N CYS A 64 0.982 -5.743 0.072 1.00 0.00 N ATOM 1005 CA CYS A 64 1.102 -4.291 -0.116 1.00 0.00 C ATOM 1006 C CYS A 64 -0.013 -3.467 0.560 1.00 0.00 C ATOM 1007 O CYS A 64 0.128 -2.251 0.705 1.00 0.00 O ATOM 1008 CB CYS A 64 1.186 -4.022 -1.623 1.00 0.00 C ATOM 1009 SG CYS A 64 -0.410 -4.388 -2.415 1.00 0.00 S ATOM 0 H CYS A 64 0.797 -6.250 -0.793 1.00 0.00 H new ATOM 0 HA CYS A 64 2.008 -3.954 0.388 1.00 0.00 H new ATOM 0 HB2 CYS A 64 1.458 -2.981 -1.800 1.00 0.00 H new ATOM 0 HB3 CYS A 64 1.970 -4.636 -2.066 1.00 0.00 H new ATOM 0 HG CYS A 64 -0.325 -4.154 -3.691 1.00 0.00 H new ATOM 1015 N THR A 65 -1.081 -4.133 1.022 1.00 0.00 N ATOM 1016 CA THR A 65 -2.189 -3.564 1.806 1.00 0.00 C ATOM 1017 C THR A 65 -1.725 -2.911 3.107 1.00 0.00 C ATOM 1018 O THR A 65 -2.411 -2.007 3.585 1.00 0.00 O ATOM 1019 CB THR A 65 -3.217 -4.650 2.144 1.00 0.00 C ATOM 1020 OG1 THR A 65 -2.548 -5.714 2.789 1.00 0.00 O ATOM 1021 CG2 THR A 65 -3.909 -5.200 0.896 1.00 0.00 C ATOM 0 H THR A 65 -1.202 -5.131 0.851 1.00 0.00 H new ATOM 0 HA THR A 65 -2.636 -2.791 1.181 1.00 0.00 H new ATOM 0 HB THR A 65 -3.979 -4.204 2.783 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.192 -6.417 3.014 1.00 0.00 H new ATOM 0 HG21 THR A 65 -4.628 -5.966 1.186 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.428 -4.391 0.382 1.00 0.00 H new ATOM 0 HG23 THR A 65 -3.165 -5.635 0.229 1.00 0.00 H new ATOM 1029 N CYS A 66 -0.582 -3.348 3.664 1.00 0.00 N ATOM 1030 CA CYS A 66 0.017 -2.798 4.890 1.00 0.00 C ATOM 1031 C CYS A 66 -0.937 -2.869 6.109 1.00 0.00 C ATOM 1032 O CYS A 66 -0.961 -1.964 6.943 1.00 0.00 O ATOM 1033 CB CYS A 66 0.563 -1.383 4.611 1.00 0.00 C ATOM 1034 SG CYS A 66 1.861 -1.430 3.339 1.00 0.00 S ATOM 0 H CYS A 66 -0.037 -4.112 3.264 1.00 0.00 H new ATOM 0 HA CYS A 66 0.860 -3.426 5.177 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -0.249 -0.733 4.284 1.00 0.00 H new ATOM 0 HB3 CYS A 66 0.964 -0.955 5.530 1.00 0.00 H new ATOM 0 HG CYS A 66 1.335 -1.752 2.194 1.00 0.00 H new ATOM 1040 N ASP A 67 -1.700 -3.963 6.232 1.00 0.00 N ATOM 1041 CA ASP A 67 -2.726 -4.170 7.271 1.00 0.00 C ATOM 1042 C ASP A 67 -2.180 -4.030 8.706 1.00 0.00 C ATOM 1043 O ASP A 67 -2.886 -3.597 9.620 1.00 0.00 O ATOM 1044 CB ASP A 67 -3.348 -5.557 7.055 1.00 0.00 C ATOM 1045 CG ASP A 67 -4.450 -5.875 8.080 1.00 0.00 C ATOM 1046 OD1 ASP A 67 -5.592 -5.385 7.911 1.00 0.00 O ATOM 1047 OD2 ASP A 67 -4.179 -6.646 9.033 1.00 0.00 O ATOM 0 H ASP A 67 -1.620 -4.754 5.593 1.00 0.00 H new ATOM 0 HA ASP A 67 -3.477 -3.387 7.171 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -3.765 -5.612 6.049 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -2.568 -6.315 7.118 1.00 0.00 H new ATOM 1052 N PHE A 68 -0.891 -4.336 8.880 1.00 0.00 N ATOM 1053 CA PHE A 68 -0.141 -4.204 10.128 1.00 0.00 C ATOM 1054 C PHE A 68 -0.139 -2.771 10.684 1.00 0.00 C ATOM 1055 O PHE A 68 0.059 -2.582 11.886 1.00 0.00 O ATOM 1056 CB PHE A 68 1.310 -4.667 9.896 1.00 0.00 C ATOM 1057 CG PHE A 68 1.441 -5.845 8.951 1.00 0.00 C ATOM 1058 CD1 PHE A 68 1.246 -7.155 9.419 1.00 0.00 C ATOM 1059 CD2 PHE A 68 1.644 -5.605 7.579 1.00 0.00 C ATOM 1060 CE1 PHE A 68 1.242 -8.228 8.511 1.00 0.00 C ATOM 1061 CE2 PHE A 68 1.623 -6.676 6.667 1.00 0.00 C ATOM 1062 CZ PHE A 68 1.418 -7.988 7.136 1.00 0.00 C ATOM 0 H PHE A 68 -0.318 -4.699 8.118 1.00 0.00 H new ATOM 0 HA PHE A 68 -0.638 -4.829 10.870 1.00 0.00 H new ATOM 0 HB2 PHE A 68 1.888 -3.832 9.500 1.00 0.00 H new ATOM 0 HB3 PHE A 68 1.753 -4.934 10.856 1.00 0.00 H new ATOM 0 HD1 PHE A 68 1.100 -7.337 10.473 1.00 0.00 H new ATOM 0 HD2 PHE A 68 1.816 -4.599 7.226 1.00 0.00 H new ATOM 0 HE1 PHE A 68 1.104 -9.237 8.869 1.00 0.00 H new ATOM 0 HE2 PHE A 68 1.763 -6.493 5.612 1.00 0.00 H new ATOM 0 HZ PHE A 68 1.396 -8.812 6.438 1.00 0.00 H new ATOM 1072 N LEU A 69 -0.342 -1.762 9.822 1.00 0.00 N ATOM 1073 CA LEU A 69 -0.296 -0.350 10.203 1.00 0.00 C ATOM 1074 C LEU A 69 -1.600 0.169 10.833 1.00 0.00 C ATOM 1075 O LEU A 69 -1.636 1.300 11.321 1.00 0.00 O ATOM 1076 CB LEU A 69 0.091 0.519 8.991 1.00 0.00 C ATOM 1077 CG LEU A 69 1.416 0.147 8.296 1.00 0.00 C ATOM 1078 CD1 LEU A 69 1.733 1.220 7.243 1.00 0.00 C ATOM 1079 CD2 LEU A 69 2.580 -0.001 9.286 1.00 0.00 C ATOM 0 H LEU A 69 -0.544 -1.910 8.833 1.00 0.00 H new ATOM 0 HA LEU A 69 0.467 -0.273 10.978 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.712 0.462 8.256 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.152 1.557 9.317 1.00 0.00 H new ATOM 0 HG LEU A 69 1.295 -0.827 7.822 1.00 0.00 H new ATOM 0 HD11 LEU A 69 2.668 0.972 6.741 1.00 0.00 H new ATOM 0 HD12 LEU A 69 0.927 1.260 6.510 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.829 2.191 7.730 1.00 0.00 H new ATOM 0 HD21 LEU A 69 3.488 -0.263 8.743 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.732 0.941 9.813 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.348 -0.786 10.006 1.00 0.00 H new ATOM 1091 N HIS A 70 -2.677 -0.618 10.816 1.00 0.00 N ATOM 1092 CA HIS A 70 -3.977 -0.227 11.347 1.00 0.00 C ATOM 1093 C HIS A 70 -3.971 -0.175 12.893 1.00 0.00 C ATOM 1094 O HIS A 70 -3.635 -1.159 13.564 1.00 0.00 O ATOM 1095 CB HIS A 70 -5.043 -1.204 10.817 1.00 0.00 C ATOM 1096 CG HIS A 70 -5.144 -1.334 9.308 1.00 0.00 C ATOM 1097 ND1 HIS A 70 -4.579 -0.533 8.345 1.00 0.00 N flip ATOM 1098 CD2 HIS A 70 -5.847 -2.312 8.639 1.00 0.00 C flip ATOM 1099 CE1 HIS A 70 -4.952 -1.015 7.086 1.00 0.00 C flip ATOM 1100 NE2 HIS A 70 -5.712 -2.098 7.320 1.00 0.00 N flip ATOM 0 H HIS A 70 -2.667 -1.560 10.426 1.00 0.00 H new ATOM 0 HA HIS A 70 -4.213 0.782 11.009 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -4.840 -2.191 11.233 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -6.015 -0.891 11.199 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -6.410 -3.113 9.096 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -4.684 -0.602 6.125 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -6.130 -2.679 6.594 1.00 0.00 H new ATOM 1108 N GLY A 71 -4.365 0.974 13.456 1.00 0.00 N ATOM 1109 CA GLY A 71 -4.547 1.225 14.892 1.00 0.00 C ATOM 1110 C GLY A 71 -6.031 1.339 15.287 1.00 0.00 C ATOM 1111 O GLY A 71 -6.900 0.923 14.514 1.00 0.00 O ATOM 0 H GLY A 71 -4.577 1.798 12.893 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -4.084 0.418 15.460 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -4.030 2.145 15.165 1.00 0.00 H new ATOM 1115 N PRO A 72 -6.349 1.918 16.465 1.00 0.00 N ATOM 1116 CA PRO A 72 -7.728 2.073 16.939 1.00 0.00 C ATOM 1117 C PRO A 72 -8.531 3.112 16.135 1.00 0.00 C ATOM 1118 O PRO A 72 -9.753 2.995 16.050 1.00 0.00 O ATOM 1119 CB PRO A 72 -7.601 2.471 18.415 1.00 0.00 C ATOM 1120 CG PRO A 72 -6.253 3.186 18.484 1.00 0.00 C ATOM 1121 CD PRO A 72 -5.410 2.425 17.461 1.00 0.00 C ATOM 0 HA PRO A 72 -8.288 1.147 16.809 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -8.417 3.124 18.725 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -7.625 1.599 19.068 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -6.342 4.242 18.229 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -5.819 3.135 19.483 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -4.669 3.079 17.002 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -4.865 1.609 17.934 1.00 0.00 H new ATOM 1129 N ARG A 73 -7.864 4.103 15.520 1.00 0.00 N ATOM 1130 CA ARG A 73 -8.501 5.130 14.678 1.00 0.00 C ATOM 1131 C ARG A 73 -8.796 4.658 13.242 1.00 0.00 C ATOM 1132 O ARG A 73 -9.520 5.349 12.520 1.00 0.00 O ATOM 1133 CB ARG A 73 -7.600 6.384 14.642 1.00 0.00 C ATOM 1134 CG ARG A 73 -7.580 7.174 15.964 1.00 0.00 C ATOM 1135 CD ARG A 73 -8.906 7.906 16.219 1.00 0.00 C ATOM 1136 NE ARG A 73 -8.860 8.689 17.467 1.00 0.00 N ATOM 1137 CZ ARG A 73 -9.830 9.460 17.951 1.00 0.00 C ATOM 1138 NH1 ARG A 73 -10.986 9.602 17.333 1.00 0.00 N ATOM 1139 NH2 ARG A 73 -9.649 10.112 19.079 1.00 0.00 N ATOM 0 H ARG A 73 -6.853 4.215 15.595 1.00 0.00 H new ATOM 0 HA ARG A 73 -9.468 5.355 15.128 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -6.582 6.082 14.395 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -7.940 7.041 13.842 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -7.378 6.492 16.790 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -6.765 7.898 15.941 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -9.124 8.568 15.381 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -9.718 7.181 16.273 1.00 0.00 H new ATOM 0 HE ARG A 73 -8.000 8.634 18.013 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -11.158 9.112 16.455 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -11.708 10.202 17.733 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -8.766 10.026 19.582 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -10.392 10.703 19.451 1.00 0.00 H new ATOM 1153 N THR A 74 -8.218 3.532 12.798 1.00 0.00 N ATOM 1154 CA THR A 74 -8.204 3.110 11.387 1.00 0.00 C ATOM 1155 C THR A 74 -9.583 2.668 10.901 1.00 0.00 C ATOM 1156 O THR A 74 -10.323 1.984 11.606 1.00 0.00 O ATOM 1157 CB THR A 74 -7.141 2.037 11.152 1.00 0.00 C ATOM 1158 OG1 THR A 74 -5.917 2.542 11.624 1.00 0.00 O ATOM 1159 CG2 THR A 74 -6.988 1.741 9.667 1.00 0.00 C ATOM 0 H THR A 74 -7.740 2.878 13.418 1.00 0.00 H new ATOM 0 HA THR A 74 -7.936 3.980 10.787 1.00 0.00 H new ATOM 0 HB THR A 74 -7.433 1.121 11.666 1.00 0.00 H new ATOM 0 HG1 THR A 74 -5.394 2.888 10.871 1.00 0.00 H new ATOM 0 HG21 THR A 74 -6.226 0.975 9.525 1.00 0.00 H new ATOM 0 HG22 THR A 74 -7.938 1.387 9.267 1.00 0.00 H new ATOM 0 HG23 THR A 74 -6.690 2.650 9.144 1.00 0.00 H new ATOM 1167 N GLN A 75 -9.922 3.085 9.681 1.00 0.00 N ATOM 1168 CA GLN A 75 -11.243 2.949 9.075 1.00 0.00 C ATOM 1169 C GLN A 75 -11.343 1.601 8.342 1.00 0.00 C ATOM 1170 O GLN A 75 -10.734 1.420 7.285 1.00 0.00 O ATOM 1171 CB GLN A 75 -11.491 4.123 8.099 1.00 0.00 C ATOM 1172 CG GLN A 75 -11.442 5.529 8.731 1.00 0.00 C ATOM 1173 CD GLN A 75 -10.035 6.056 9.044 1.00 0.00 C ATOM 1174 OE1 GLN A 75 -9.014 5.507 8.645 1.00 0.00 O ATOM 1175 NE2 GLN A 75 -9.921 7.138 9.779 1.00 0.00 N ATOM 0 H GLN A 75 -9.254 3.546 9.063 1.00 0.00 H new ATOM 0 HA GLN A 75 -12.006 2.976 9.853 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -10.748 4.075 7.303 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -12.467 3.986 7.633 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -11.934 6.230 8.057 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -12.021 5.515 9.654 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -10.757 7.612 10.122 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -8.997 7.505 10.007 1.00 0.00 H new ATOM 1184 N ARG A 76 -12.147 0.659 8.854 1.00 0.00 N ATOM 1185 CA ARG A 76 -12.282 -0.688 8.269 1.00 0.00 C ATOM 1186 C ARG A 76 -12.827 -0.665 6.832 1.00 0.00 C ATOM 1187 O ARG A 76 -12.440 -1.508 6.020 1.00 0.00 O ATOM 1188 CB ARG A 76 -13.149 -1.562 9.197 1.00 0.00 C ATOM 1189 CG ARG A 76 -13.266 -3.037 8.771 1.00 0.00 C ATOM 1190 CD ARG A 76 -11.915 -3.768 8.704 1.00 0.00 C ATOM 1191 NE ARG A 76 -12.069 -5.138 8.184 1.00 0.00 N ATOM 1192 CZ ARG A 76 -12.147 -5.503 6.909 1.00 0.00 C ATOM 1193 NH1 ARG A 76 -12.150 -4.630 5.919 1.00 0.00 N ATOM 1194 NH2 ARG A 76 -12.228 -6.782 6.607 1.00 0.00 N ATOM 0 H ARG A 76 -12.722 0.806 9.683 1.00 0.00 H new ATOM 0 HA ARG A 76 -11.286 -1.124 8.192 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -12.734 -1.521 10.204 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -14.150 -1.132 9.247 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -13.917 -3.558 9.473 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -13.745 -3.087 7.793 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -11.229 -3.210 8.066 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -11.469 -3.803 9.698 1.00 0.00 H new ATOM 0 HE ARG A 76 -12.121 -5.885 8.876 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -12.091 -3.632 6.119 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -12.211 -4.954 4.954 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -12.230 -7.482 7.349 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -12.288 -7.073 5.631 1.00 0.00 H new ATOM 1208 N ARG A 77 -13.658 0.332 6.492 1.00 0.00 N ATOM 1209 CA ARG A 77 -14.180 0.575 5.134 1.00 0.00 C ATOM 1210 C ARG A 77 -13.063 0.998 4.164 1.00 0.00 C ATOM 1211 O ARG A 77 -13.030 0.531 3.028 1.00 0.00 O ATOM 1212 CB ARG A 77 -15.303 1.631 5.210 1.00 0.00 C ATOM 1213 CG ARG A 77 -16.173 1.736 3.941 1.00 0.00 C ATOM 1214 CD ARG A 77 -17.049 0.496 3.717 1.00 0.00 C ATOM 1215 NE ARG A 77 -17.968 0.683 2.584 1.00 0.00 N ATOM 1216 CZ ARG A 77 -18.971 -0.120 2.241 1.00 0.00 C ATOM 1217 NH1 ARG A 77 -19.240 -1.234 2.893 1.00 0.00 N ATOM 1218 NH2 ARG A 77 -19.734 0.192 1.218 1.00 0.00 N ATOM 0 H ARG A 77 -13.997 1.012 7.172 1.00 0.00 H new ATOM 0 HA ARG A 77 -14.592 -0.353 4.737 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -15.947 1.397 6.058 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -14.855 2.605 5.409 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -16.810 2.617 4.015 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -15.528 1.881 3.074 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -16.414 -0.371 3.533 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -17.621 0.286 4.620 1.00 0.00 H new ATOM 0 HE ARG A 77 -17.822 1.510 2.005 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -18.669 -1.507 3.693 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -20.019 -1.822 2.598 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -19.556 1.047 0.691 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -20.505 -0.421 0.951 1.00 0.00 H new ATOM 1232 N ALA A 78 -12.102 1.810 4.612 1.00 0.00 N ATOM 1233 CA ALA A 78 -10.932 2.206 3.820 1.00 0.00 C ATOM 1234 C ALA A 78 -9.933 1.048 3.660 1.00 0.00 C ATOM 1235 O ALA A 78 -9.461 0.792 2.554 1.00 0.00 O ATOM 1236 CB ALA A 78 -10.286 3.417 4.496 1.00 0.00 C ATOM 0 H ALA A 78 -12.114 2.217 5.547 1.00 0.00 H new ATOM 0 HA ALA A 78 -11.248 2.472 2.811 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.412 3.730 3.924 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -11.004 4.236 4.539 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -9.981 3.149 5.507 1.00 0.00 H new ATOM 1242 N ALA A 79 -9.688 0.277 4.728 1.00 0.00 N ATOM 1243 CA ALA A 79 -8.898 -0.962 4.662 1.00 0.00 C ATOM 1244 C ALA A 79 -9.457 -1.944 3.612 1.00 0.00 C ATOM 1245 O ALA A 79 -8.696 -2.605 2.904 1.00 0.00 O ATOM 1246 CB ALA A 79 -8.880 -1.584 6.063 1.00 0.00 C ATOM 0 H ALA A 79 -10.032 0.494 5.663 1.00 0.00 H new ATOM 0 HA ALA A 79 -7.881 -0.733 4.343 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -8.300 -2.507 6.044 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -8.427 -0.885 6.766 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -9.901 -1.804 6.377 1.00 0.00 H new ATOM 1252 N ALA A 80 -10.788 -1.974 3.461 1.00 0.00 N ATOM 1253 CA ALA A 80 -11.484 -2.728 2.421 1.00 0.00 C ATOM 1254 C ALA A 80 -11.249 -2.125 1.032 1.00 0.00 C ATOM 1255 O ALA A 80 -10.853 -2.843 0.120 1.00 0.00 O ATOM 1256 CB ALA A 80 -12.978 -2.746 2.759 1.00 0.00 C ATOM 0 H ALA A 80 -11.421 -1.461 4.075 1.00 0.00 H new ATOM 0 HA ALA A 80 -11.093 -3.745 2.392 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -13.517 -3.305 1.994 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -13.126 -3.222 3.728 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -13.355 -1.724 2.795 1.00 0.00 H new ATOM 1262 N GLN A 81 -11.437 -0.809 0.866 1.00 0.00 N ATOM 1263 CA GLN A 81 -11.242 -0.156 -0.429 1.00 0.00 C ATOM 1264 C GLN A 81 -9.807 -0.332 -0.949 1.00 0.00 C ATOM 1265 O GLN A 81 -9.646 -0.556 -2.143 1.00 0.00 O ATOM 1266 CB GLN A 81 -11.630 1.330 -0.364 1.00 0.00 C ATOM 1267 CG GLN A 81 -13.095 1.674 -0.040 1.00 0.00 C ATOM 1268 CD GLN A 81 -14.121 0.633 -0.488 1.00 0.00 C ATOM 1269 OE1 GLN A 81 -14.402 0.465 -1.668 1.00 0.00 O ATOM 1270 NE2 GLN A 81 -14.690 -0.120 0.434 1.00 0.00 N ATOM 0 H GLN A 81 -11.724 -0.178 1.614 1.00 0.00 H new ATOM 0 HA GLN A 81 -11.905 -0.647 -1.141 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -11.000 1.809 0.385 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -11.384 1.783 -1.324 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -13.189 1.814 1.037 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -13.340 2.627 -0.508 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -14.459 0.017 1.418 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -15.361 -0.839 0.163 1.00 0.00 H new ATOM 1279 N ILE A 82 -8.770 -0.317 -0.093 1.00 0.00 N ATOM 1280 CA ILE A 82 -7.391 -0.658 -0.512 1.00 0.00 C ATOM 1281 C ILE A 82 -7.303 -2.092 -1.055 1.00 0.00 C ATOM 1282 O ILE A 82 -6.711 -2.297 -2.112 1.00 0.00 O ATOM 1283 CB ILE A 82 -6.397 -0.408 0.651 1.00 0.00 C ATOM 1284 CG1 ILE A 82 -6.296 1.113 0.893 1.00 0.00 C ATOM 1285 CG2 ILE A 82 -4.997 -0.985 0.355 1.00 0.00 C ATOM 1286 CD1 ILE A 82 -5.597 1.507 2.192 1.00 0.00 C ATOM 0 H ILE A 82 -8.857 -0.073 0.894 1.00 0.00 H new ATOM 0 HA ILE A 82 -7.109 -0.001 -1.335 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.772 -0.917 1.539 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.762 1.566 0.057 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -7.301 1.534 0.895 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -4.336 -0.785 1.198 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -5.072 -2.061 0.200 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -4.593 -0.516 -0.542 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -5.573 2.593 2.277 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -6.141 1.089 3.039 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -4.578 1.120 2.189 1.00 0.00 H new ATOM 1298 N ALA A 83 -7.914 -3.075 -0.385 1.00 0.00 N ATOM 1299 CA ALA A 83 -7.933 -4.466 -0.850 1.00 0.00 C ATOM 1300 C ALA A 83 -8.726 -4.637 -2.160 1.00 0.00 C ATOM 1301 O ALA A 83 -8.296 -5.368 -3.052 1.00 0.00 O ATOM 1302 CB ALA A 83 -8.510 -5.347 0.266 1.00 0.00 C ATOM 0 H ALA A 83 -8.409 -2.929 0.495 1.00 0.00 H new ATOM 0 HA ALA A 83 -6.912 -4.772 -1.076 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -8.531 -6.386 -0.064 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -7.886 -5.262 1.156 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -9.523 -5.020 0.500 1.00 0.00 H new ATOM 1308 N GLN A 84 -9.864 -3.948 -2.302 1.00 0.00 N ATOM 1309 CA GLN A 84 -10.658 -3.950 -3.534 1.00 0.00 C ATOM 1310 C GLN A 84 -9.960 -3.197 -4.681 1.00 0.00 C ATOM 1311 O GLN A 84 -10.139 -3.578 -5.836 1.00 0.00 O ATOM 1312 CB GLN A 84 -12.070 -3.386 -3.278 1.00 0.00 C ATOM 1313 CG GLN A 84 -13.071 -4.418 -2.720 1.00 0.00 C ATOM 1314 CD GLN A 84 -13.054 -4.586 -1.202 1.00 0.00 C ATOM 1315 OE1 GLN A 84 -13.712 -3.857 -0.470 1.00 0.00 O ATOM 1316 NE2 GLN A 84 -12.347 -5.568 -0.674 1.00 0.00 N ATOM 0 H GLN A 84 -10.261 -3.371 -1.561 1.00 0.00 H new ATOM 0 HA GLN A 84 -10.754 -4.988 -3.851 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -11.995 -2.554 -2.578 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -12.463 -2.983 -4.211 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -14.076 -4.128 -3.026 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -12.865 -5.385 -3.179 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -11.796 -6.180 -1.276 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -12.352 -5.714 0.335 1.00 0.00 H new ATOM 1325 N ALA A 85 -9.114 -2.194 -4.405 1.00 0.00 N ATOM 1326 CA ALA A 85 -8.346 -1.495 -5.441 1.00 0.00 C ATOM 1327 C ALA A 85 -7.399 -2.442 -6.215 1.00 0.00 C ATOM 1328 O ALA A 85 -7.140 -2.227 -7.399 1.00 0.00 O ATOM 1329 CB ALA A 85 -7.577 -0.329 -4.813 1.00 0.00 C ATOM 0 H ALA A 85 -8.945 -1.847 -3.461 1.00 0.00 H new ATOM 0 HA ALA A 85 -9.050 -1.105 -6.175 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -7.007 0.189 -5.585 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -8.280 0.366 -4.354 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -6.895 -0.710 -4.053 1.00 0.00 H new ATOM 1335 N LEU A 86 -6.927 -3.516 -5.562 1.00 0.00 N ATOM 1336 CA LEU A 86 -6.088 -4.575 -6.147 1.00 0.00 C ATOM 1337 C LEU A 86 -6.868 -5.534 -7.071 1.00 0.00 C ATOM 1338 O LEU A 86 -6.259 -6.311 -7.806 1.00 0.00 O ATOM 1339 CB LEU A 86 -5.417 -5.384 -5.017 1.00 0.00 C ATOM 1340 CG LEU A 86 -4.666 -4.565 -3.949 1.00 0.00 C ATOM 1341 CD1 LEU A 86 -4.181 -5.492 -2.829 1.00 0.00 C ATOM 1342 CD2 LEU A 86 -3.487 -3.774 -4.526 1.00 0.00 C ATOM 0 H LEU A 86 -7.127 -3.677 -4.575 1.00 0.00 H new ATOM 0 HA LEU A 86 -5.341 -4.078 -6.766 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -6.184 -5.977 -4.518 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -4.715 -6.085 -5.468 1.00 0.00 H new ATOM 0 HG LEU A 86 -5.371 -3.835 -3.550 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.651 -4.908 -2.077 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -5.037 -5.985 -2.368 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -3.510 -6.244 -3.244 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -2.997 -3.217 -3.727 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -2.774 -4.463 -4.979 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -3.851 -3.079 -5.283 1.00 0.00 H new ATOM 1354 N LEU A 87 -8.207 -5.497 -7.044 1.00 0.00 N ATOM 1355 CA LEU A 87 -9.072 -6.257 -7.960 1.00 0.00 C ATOM 1356 C LEU A 87 -9.372 -5.480 -9.257 1.00 0.00 C ATOM 1357 O LEU A 87 -9.810 -6.079 -10.243 1.00 0.00 O ATOM 1358 CB LEU A 87 -10.382 -6.640 -7.241 1.00 0.00 C ATOM 1359 CG LEU A 87 -10.213 -7.399 -5.907 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -11.596 -7.680 -5.306 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -9.447 -8.719 -6.076 1.00 0.00 C ATOM 0 H LEU A 87 -8.729 -4.930 -6.376 1.00 0.00 H new ATOM 0 HA LEU A 87 -8.538 -7.162 -8.250 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -10.951 -5.730 -7.051 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -10.979 -7.254 -7.915 1.00 0.00 H new ATOM 0 HG LEU A 87 -9.626 -6.767 -5.240 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -11.481 -8.216 -4.364 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -12.113 -6.737 -5.127 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -12.178 -8.287 -6.000 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -9.356 -9.213 -5.109 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -9.988 -9.368 -6.765 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -8.453 -8.515 -6.474 1.00 0.00 H new ATOM 1373 N GLY A 88 -9.137 -4.161 -9.267 1.00 0.00 N ATOM 1374 CA GLY A 88 -9.380 -3.268 -10.407 1.00 0.00 C ATOM 1375 C GLY A 88 -8.184 -3.155 -11.358 1.00 0.00 C ATOM 1376 O GLY A 88 -7.029 -3.299 -10.955 1.00 0.00 O ATOM 0 H GLY A 88 -8.760 -3.671 -8.456 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -10.245 -3.629 -10.964 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -9.633 -2.276 -10.034 1.00 0.00 H new ATOM 1380 N ALA A 89 -8.472 -2.845 -12.626 1.00 0.00 N ATOM 1381 CA ALA A 89 -7.479 -2.621 -13.689 1.00 0.00 C ATOM 1382 C ALA A 89 -7.074 -1.140 -13.864 1.00 0.00 C ATOM 1383 O ALA A 89 -6.262 -0.823 -14.735 1.00 0.00 O ATOM 1384 CB ALA A 89 -8.078 -3.176 -14.987 1.00 0.00 C ATOM 0 H ALA A 89 -9.432 -2.739 -12.954 1.00 0.00 H new ATOM 0 HA ALA A 89 -6.556 -3.132 -13.416 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -7.372 -3.030 -15.805 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -8.281 -4.240 -14.868 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -9.007 -2.652 -15.212 1.00 0.00 H new ATOM 1390 N GLU A 90 -7.663 -0.237 -13.074 1.00 0.00 N ATOM 1391 CA GLU A 90 -7.556 1.222 -13.196 1.00 0.00 C ATOM 1392 C GLU A 90 -7.055 1.866 -11.886 1.00 0.00 C ATOM 1393 O GLU A 90 -7.127 1.268 -10.809 1.00 0.00 O ATOM 1394 CB GLU A 90 -8.928 1.792 -13.599 1.00 0.00 C ATOM 1395 CG GLU A 90 -9.310 1.429 -15.040 1.00 0.00 C ATOM 1396 CD GLU A 90 -10.651 2.068 -15.428 1.00 0.00 C ATOM 1397 OE1 GLU A 90 -11.714 1.437 -15.214 1.00 0.00 O ATOM 1398 OE2 GLU A 90 -10.655 3.206 -15.956 1.00 0.00 O ATOM 0 H GLU A 90 -8.257 -0.517 -12.293 1.00 0.00 H new ATOM 0 HA GLU A 90 -6.821 1.459 -13.966 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -9.690 1.414 -12.917 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -8.914 2.877 -13.492 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -8.531 1.766 -15.723 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -9.376 0.346 -15.141 1.00 0.00 H new ATOM 1405 N GLU A 91 -6.527 3.092 -11.987 1.00 0.00 N ATOM 1406 CA GLU A 91 -5.958 3.857 -10.868 1.00 0.00 C ATOM 1407 C GLU A 91 -7.012 4.190 -9.795 1.00 0.00 C ATOM 1408 O GLU A 91 -8.162 4.510 -10.115 1.00 0.00 O ATOM 1409 CB GLU A 91 -5.306 5.130 -11.439 1.00 0.00 C ATOM 1410 CG GLU A 91 -4.496 5.946 -10.428 1.00 0.00 C ATOM 1411 CD GLU A 91 -3.974 7.235 -11.082 1.00 0.00 C ATOM 1412 OE1 GLU A 91 -2.964 7.182 -11.825 1.00 0.00 O ATOM 1413 OE2 GLU A 91 -4.589 8.311 -10.886 1.00 0.00 O ATOM 0 H GLU A 91 -6.482 3.594 -12.874 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.206 3.251 -10.363 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -4.652 4.847 -12.264 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -6.087 5.766 -11.855 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -5.118 6.192 -9.567 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -3.660 5.353 -10.058 1.00 0.00 H new ATOM 1420 N ARG A 92 -6.607 4.122 -8.517 1.00 0.00 N ATOM 1421 CA ARG A 92 -7.503 4.238 -7.357 1.00 0.00 C ATOM 1422 C ARG A 92 -6.791 4.824 -6.138 1.00 0.00 C ATOM 1423 O ARG A 92 -5.772 4.293 -5.693 1.00 0.00 O ATOM 1424 CB ARG A 92 -8.075 2.841 -7.048 1.00 0.00 C ATOM 1425 CG ARG A 92 -9.118 2.770 -5.917 1.00 0.00 C ATOM 1426 CD ARG A 92 -10.324 3.699 -6.117 1.00 0.00 C ATOM 1427 NE ARG A 92 -11.446 3.308 -5.242 1.00 0.00 N ATOM 1428 CZ ARG A 92 -12.640 3.894 -5.180 1.00 0.00 C ATOM 1429 NH1 ARG A 92 -12.937 4.962 -5.896 1.00 0.00 N ATOM 1430 NH2 ARG A 92 -13.571 3.404 -4.388 1.00 0.00 N ATOM 0 H ARG A 92 -5.631 3.982 -8.257 1.00 0.00 H new ATOM 0 HA ARG A 92 -8.311 4.929 -7.597 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -8.528 2.447 -7.958 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -7.247 2.180 -6.793 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -9.474 1.744 -5.830 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -8.633 3.020 -4.974 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -10.034 4.728 -5.904 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -10.643 3.667 -7.159 1.00 0.00 H new ATOM 0 HE ARG A 92 -11.292 2.511 -4.624 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -12.241 5.365 -6.523 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -13.863 5.384 -5.822 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -13.377 2.577 -3.823 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -14.486 3.852 -4.339 1.00 0.00 H new ATOM 1444 N LYS A 93 -7.374 5.873 -5.549 1.00 0.00 N ATOM 1445 CA LYS A 93 -6.952 6.455 -4.267 1.00 0.00 C ATOM 1446 C LYS A 93 -7.934 6.108 -3.125 1.00 0.00 C ATOM 1447 O LYS A 93 -9.147 6.112 -3.329 1.00 0.00 O ATOM 1448 CB LYS A 93 -6.769 7.981 -4.406 1.00 0.00 C ATOM 1449 CG LYS A 93 -5.882 8.359 -5.605 1.00 0.00 C ATOM 1450 CD LYS A 93 -5.360 9.801 -5.565 1.00 0.00 C ATOM 1451 CE LYS A 93 -6.509 10.823 -5.533 1.00 0.00 C ATOM 1452 NZ LYS A 93 -6.020 12.221 -5.707 1.00 0.00 N ATOM 0 H LYS A 93 -8.174 6.355 -5.960 1.00 0.00 H new ATOM 0 HA LYS A 93 -5.991 6.015 -4.000 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -7.745 8.453 -4.517 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -6.326 8.376 -3.491 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -5.033 7.677 -5.645 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -6.450 8.214 -6.524 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -4.729 9.935 -4.686 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -4.734 9.985 -6.438 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -7.224 10.589 -6.321 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -7.041 10.741 -4.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -6.827 12.877 -5.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -5.357 12.455 -4.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -5.535 12.308 -6.623 1.00 0.00 H new ATOM 1466 N VAL A 94 -7.409 5.823 -1.928 1.00 0.00 N ATOM 1467 CA VAL A 94 -8.168 5.561 -0.682 1.00 0.00 C ATOM 1468 C VAL A 94 -7.479 6.294 0.472 1.00 0.00 C ATOM 1469 O VAL A 94 -6.251 6.308 0.537 1.00 0.00 O ATOM 1470 CB VAL A 94 -8.271 4.045 -0.367 1.00 0.00 C ATOM 1471 CG1 VAL A 94 -9.052 3.802 0.930 1.00 0.00 C ATOM 1472 CG2 VAL A 94 -8.924 3.295 -1.524 1.00 0.00 C ATOM 0 H VAL A 94 -6.401 5.764 -1.786 1.00 0.00 H new ATOM 0 HA VAL A 94 -9.186 5.926 -0.814 1.00 0.00 H new ATOM 0 HB VAL A 94 -7.258 3.665 -0.233 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -9.108 2.731 1.126 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -8.544 4.296 1.758 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -10.059 4.206 0.829 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -8.986 2.234 -1.281 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -9.927 3.688 -1.692 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -8.327 3.427 -2.426 1.00 0.00 H new ATOM 1482 N GLU A 95 -8.258 6.902 1.369 1.00 0.00 N ATOM 1483 CA GLU A 95 -7.756 7.662 2.516 1.00 0.00 C ATOM 1484 C GLU A 95 -7.980 6.898 3.835 1.00 0.00 C ATOM 1485 O GLU A 95 -9.073 6.383 4.070 1.00 0.00 O ATOM 1486 CB GLU A 95 -8.462 9.026 2.534 1.00 0.00 C ATOM 1487 CG GLU A 95 -7.858 10.003 3.547 1.00 0.00 C ATOM 1488 CD GLU A 95 -8.670 11.308 3.580 1.00 0.00 C ATOM 1489 OE1 GLU A 95 -8.679 12.055 2.573 1.00 0.00 O ATOM 1490 OE2 GLU A 95 -9.322 11.593 4.613 1.00 0.00 O ATOM 0 H GLU A 95 -9.276 6.879 1.317 1.00 0.00 H new ATOM 0 HA GLU A 95 -6.680 7.806 2.420 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -8.412 9.467 1.539 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -9.517 8.879 2.765 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.846 9.549 4.538 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -6.823 10.218 3.283 1.00 0.00 H new ATOM 1497 N ILE A 96 -6.963 6.819 4.704 1.00 0.00 N ATOM 1498 CA ILE A 96 -6.932 5.891 5.854 1.00 0.00 C ATOM 1499 C ILE A 96 -5.923 6.322 6.933 1.00 0.00 C ATOM 1500 O ILE A 96 -4.875 6.880 6.615 1.00 0.00 O ATOM 1501 CB ILE A 96 -6.655 4.453 5.336 1.00 0.00 C ATOM 1502 CG1 ILE A 96 -6.827 3.408 6.455 1.00 0.00 C ATOM 1503 CG2 ILE A 96 -5.277 4.322 4.661 1.00 0.00 C ATOM 1504 CD1 ILE A 96 -6.855 1.961 5.949 1.00 0.00 C ATOM 0 H ILE A 96 -6.128 7.401 4.632 1.00 0.00 H new ATOM 0 HA ILE A 96 -7.905 5.912 6.345 1.00 0.00 H new ATOM 0 HB ILE A 96 -7.402 4.252 4.568 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -6.012 3.518 7.170 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -7.753 3.613 6.992 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -5.136 3.297 4.318 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -5.223 5.000 3.810 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.495 4.576 5.377 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.979 1.283 6.793 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -7.687 1.834 5.256 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.919 1.736 5.437 1.00 0.00 H new ATOM 1516 N ALA A 97 -6.211 6.071 8.214 1.00 0.00 N ATOM 1517 CA ALA A 97 -5.267 6.341 9.309 1.00 0.00 C ATOM 1518 C ALA A 97 -4.274 5.185 9.517 1.00 0.00 C ATOM 1519 O ALA A 97 -4.683 4.048 9.756 1.00 0.00 O ATOM 1520 CB ALA A 97 -6.048 6.666 10.593 1.00 0.00 C ATOM 0 H ALA A 97 -7.100 5.677 8.523 1.00 0.00 H new ATOM 0 HA ALA A 97 -4.663 7.207 9.039 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -5.348 6.866 11.404 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -6.672 7.545 10.427 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -6.679 5.818 10.859 1.00 0.00 H new ATOM 1526 N PHE A 98 -2.977 5.495 9.487 1.00 0.00 N ATOM 1527 CA PHE A 98 -1.857 4.610 9.818 1.00 0.00 C ATOM 1528 C PHE A 98 -1.094 5.110 11.054 1.00 0.00 C ATOM 1529 O PHE A 98 -1.054 6.312 11.337 1.00 0.00 O ATOM 1530 CB PHE A 98 -0.897 4.569 8.615 1.00 0.00 C ATOM 1531 CG PHE A 98 -1.371 3.883 7.341 1.00 0.00 C ATOM 1532 CD1 PHE A 98 -2.420 2.941 7.347 1.00 0.00 C ATOM 1533 CD2 PHE A 98 -0.696 4.156 6.135 1.00 0.00 C ATOM 1534 CE1 PHE A 98 -2.769 2.262 6.165 1.00 0.00 C ATOM 1535 CE2 PHE A 98 -1.052 3.488 4.950 1.00 0.00 C ATOM 1536 CZ PHE A 98 -2.083 2.534 4.967 1.00 0.00 C ATOM 0 H PHE A 98 -2.661 6.426 9.215 1.00 0.00 H new ATOM 0 HA PHE A 98 -2.248 3.617 10.041 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -0.635 5.597 8.363 1.00 0.00 H new ATOM 0 HB3 PHE A 98 0.020 4.076 8.937 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -2.957 2.740 8.262 1.00 0.00 H new ATOM 0 HD2 PHE A 98 0.101 4.884 6.120 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -3.564 1.531 6.177 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -0.534 3.708 4.028 1.00 0.00 H new ATOM 0 HZ PHE A 98 -2.349 2.010 4.061 1.00 0.00 H new ATOM 1546 N TYR A 99 -0.437 4.188 11.767 1.00 0.00 N ATOM 1547 CA TYR A 99 0.561 4.511 12.796 1.00 0.00 C ATOM 1548 C TYR A 99 2.009 4.510 12.255 1.00 0.00 C ATOM 1549 O TYR A 99 2.332 3.824 11.280 1.00 0.00 O ATOM 1550 CB TYR A 99 0.389 3.589 14.021 1.00 0.00 C ATOM 1551 CG TYR A 99 1.356 2.419 14.146 1.00 0.00 C ATOM 1552 CD1 TYR A 99 1.443 1.446 13.131 1.00 0.00 C ATOM 1553 CD2 TYR A 99 2.179 2.311 15.285 1.00 0.00 C ATOM 1554 CE1 TYR A 99 2.359 0.381 13.234 1.00 0.00 C ATOM 1555 CE2 TYR A 99 3.092 1.245 15.403 1.00 0.00 C ATOM 1556 CZ TYR A 99 3.188 0.278 14.375 1.00 0.00 C ATOM 1557 OH TYR A 99 4.075 -0.752 14.480 1.00 0.00 O ATOM 0 H TYR A 99 -0.584 3.186 11.645 1.00 0.00 H new ATOM 0 HA TYR A 99 0.378 5.536 13.117 1.00 0.00 H new ATOM 0 HB2 TYR A 99 0.478 4.199 14.920 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -0.625 3.190 14.005 1.00 0.00 H new ATOM 0 HD1 TYR A 99 0.801 1.517 12.265 1.00 0.00 H new ATOM 0 HD2 TYR A 99 2.109 3.049 16.071 1.00 0.00 H new ATOM 0 HE1 TYR A 99 2.428 -0.354 12.445 1.00 0.00 H new ATOM 0 HE2 TYR A 99 3.719 1.166 16.279 1.00 0.00 H new ATOM 0 HH TYR A 99 4.568 -0.675 15.324 1.00 0.00 H new ATOM 1567 N ARG A 100 2.878 5.263 12.932 1.00 0.00 N ATOM 1568 CA ARG A 100 4.339 5.275 12.806 1.00 0.00 C ATOM 1569 C ARG A 100 4.969 4.535 13.998 1.00 0.00 C ATOM 1570 O ARG A 100 4.410 4.519 15.094 1.00 0.00 O ATOM 1571 CB ARG A 100 4.783 6.746 12.740 1.00 0.00 C ATOM 1572 CG ARG A 100 6.290 6.946 12.502 1.00 0.00 C ATOM 1573 CD ARG A 100 6.637 8.429 12.336 1.00 0.00 C ATOM 1574 NE ARG A 100 6.136 8.944 11.048 1.00 0.00 N ATOM 1575 CZ ARG A 100 5.760 10.184 10.758 1.00 0.00 C ATOM 1576 NH1 ARG A 100 5.809 11.165 11.637 1.00 0.00 N ATOM 1577 NH2 ARG A 100 5.322 10.447 9.545 1.00 0.00 N ATOM 0 H ARG A 100 2.557 5.929 13.634 1.00 0.00 H new ATOM 0 HA ARG A 100 4.668 4.760 11.904 1.00 0.00 H new ATOM 0 HB2 ARG A 100 4.232 7.243 11.941 1.00 0.00 H new ATOM 0 HB3 ARG A 100 4.506 7.238 13.672 1.00 0.00 H new ATOM 0 HG2 ARG A 100 6.851 6.531 13.340 1.00 0.00 H new ATOM 0 HG3 ARG A 100 6.595 6.397 11.611 1.00 0.00 H new ATOM 0 HD2 ARG A 100 6.203 9.002 13.155 1.00 0.00 H new ATOM 0 HD3 ARG A 100 7.717 8.562 12.390 1.00 0.00 H new ATOM 0 HE ARG A 100 6.070 8.266 10.289 1.00 0.00 H new ATOM 0 HH11 ARG A 100 6.146 10.986 12.583 1.00 0.00 H new ATOM 0 HH12 ARG A 100 5.510 12.103 11.371 1.00 0.00 H new ATOM 0 HH21 ARG A 100 5.276 9.704 8.847 1.00 0.00 H new ATOM 0 HH22 ARG A 100 5.029 11.393 9.303 1.00 0.00 H new ATOM 1591 N LYS A 101 6.149 3.936 13.806 1.00 0.00 N ATOM 1592 CA LYS A 101 6.823 3.083 14.810 1.00 0.00 C ATOM 1593 C LYS A 101 7.163 3.790 16.144 1.00 0.00 C ATOM 1594 O LYS A 101 7.268 3.133 17.181 1.00 0.00 O ATOM 1595 CB LYS A 101 8.103 2.477 14.188 1.00 0.00 C ATOM 1596 CG LYS A 101 8.006 0.967 13.938 1.00 0.00 C ATOM 1597 CD LYS A 101 7.258 0.640 12.636 1.00 0.00 C ATOM 1598 CE LYS A 101 6.965 -0.860 12.463 1.00 0.00 C ATOM 1599 NZ LYS A 101 8.150 -1.746 12.666 1.00 0.00 N ATOM 0 H LYS A 101 6.677 4.027 12.938 1.00 0.00 H new ATOM 0 HA LYS A 101 6.106 2.306 15.075 1.00 0.00 H new ATOM 0 HB2 LYS A 101 8.312 2.981 13.244 1.00 0.00 H new ATOM 0 HB3 LYS A 101 8.947 2.674 14.849 1.00 0.00 H new ATOM 0 HG2 LYS A 101 9.009 0.543 13.895 1.00 0.00 H new ATOM 0 HG3 LYS A 101 7.495 0.494 14.777 1.00 0.00 H new ATOM 0 HD2 LYS A 101 6.318 1.191 12.617 1.00 0.00 H new ATOM 0 HD3 LYS A 101 7.849 0.988 11.789 1.00 0.00 H new ATOM 0 HE2 LYS A 101 6.185 -1.149 13.167 1.00 0.00 H new ATOM 0 HE3 LYS A 101 6.568 -1.027 11.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 7.876 -2.735 12.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 8.902 -1.477 12.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 8.497 -1.643 13.641 1.00 0.00 H new ATOM 1613 N ASP A 102 7.314 5.118 16.132 1.00 0.00 N ATOM 1614 CA ASP A 102 7.518 5.961 17.325 1.00 0.00 C ATOM 1615 C ASP A 102 6.268 6.116 18.221 1.00 0.00 C ATOM 1616 O ASP A 102 6.373 6.579 19.360 1.00 0.00 O ATOM 1617 CB ASP A 102 8.049 7.336 16.884 1.00 0.00 C ATOM 1618 CG ASP A 102 7.083 8.209 16.055 1.00 0.00 C ATOM 1619 OD1 ASP A 102 5.960 7.763 15.731 1.00 0.00 O ATOM 1620 OD2 ASP A 102 7.493 9.344 15.699 1.00 0.00 O ATOM 0 H ASP A 102 7.298 5.658 15.267 1.00 0.00 H new ATOM 0 HA ASP A 102 8.248 5.448 17.951 1.00 0.00 H new ATOM 0 HB2 ASP A 102 8.335 7.894 17.776 1.00 0.00 H new ATOM 0 HB3 ASP A 102 8.956 7.181 16.300 1.00 0.00 H new ATOM 1625 N GLY A 103 5.099 5.716 17.711 1.00 0.00 N ATOM 1626 CA GLY A 103 3.794 5.766 18.375 1.00 0.00 C ATOM 1627 C GLY A 103 2.878 6.898 17.894 1.00 0.00 C ATOM 1628 O GLY A 103 1.764 7.020 18.406 1.00 0.00 O ATOM 0 H GLY A 103 5.035 5.327 16.770 1.00 0.00 H new ATOM 0 HA2 GLY A 103 3.286 4.814 18.221 1.00 0.00 H new ATOM 0 HA3 GLY A 103 3.951 5.874 19.448 1.00 0.00 H new ATOM 1632 N SER A 104 3.302 7.720 16.932 1.00 0.00 N ATOM 1633 CA SER A 104 2.453 8.773 16.339 1.00 0.00 C ATOM 1634 C SER A 104 1.532 8.224 15.228 1.00 0.00 C ATOM 1635 O SER A 104 1.780 7.150 14.677 1.00 0.00 O ATOM 1636 CB SER A 104 3.317 9.924 15.792 1.00 0.00 C ATOM 1637 OG SER A 104 4.034 10.593 16.829 1.00 0.00 O ATOM 0 H SER A 104 4.242 7.680 16.538 1.00 0.00 H new ATOM 0 HA SER A 104 1.814 9.153 17.136 1.00 0.00 H new ATOM 0 HB2 SER A 104 4.022 9.532 15.059 1.00 0.00 H new ATOM 0 HB3 SER A 104 2.681 10.639 15.271 1.00 0.00 H new ATOM 0 HG SER A 104 4.571 11.315 16.442 1.00 0.00 H new ATOM 1643 N CYS A 105 0.474 8.963 14.867 1.00 0.00 N ATOM 1644 CA CYS A 105 -0.481 8.590 13.814 1.00 0.00 C ATOM 1645 C CYS A 105 -0.661 9.711 12.775 1.00 0.00 C ATOM 1646 O CYS A 105 -0.305 10.873 12.999 1.00 0.00 O ATOM 1647 CB CYS A 105 -1.827 8.215 14.464 1.00 0.00 C ATOM 1648 SG CYS A 105 -1.682 6.662 15.401 1.00 0.00 S ATOM 0 H CYS A 105 0.253 9.856 15.308 1.00 0.00 H new ATOM 0 HA CYS A 105 -0.084 7.730 13.275 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -2.151 9.016 15.128 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -2.591 8.110 13.694 1.00 0.00 H new ATOM 0 HG CYS A 105 -2.829 6.371 15.939 1.00 0.00 H new ATOM 1654 N PHE A 106 -1.248 9.349 11.632 1.00 0.00 N ATOM 1655 CA PHE A 106 -1.568 10.259 10.529 1.00 0.00 C ATOM 1656 C PHE A 106 -2.549 9.627 9.537 1.00 0.00 C ATOM 1657 O PHE A 106 -2.536 8.418 9.307 1.00 0.00 O ATOM 1658 CB PHE A 106 -0.287 10.736 9.808 1.00 0.00 C ATOM 1659 CG PHE A 106 0.576 9.650 9.180 1.00 0.00 C ATOM 1660 CD1 PHE A 106 0.318 9.225 7.859 1.00 0.00 C ATOM 1661 CD2 PHE A 106 1.653 9.081 9.900 1.00 0.00 C ATOM 1662 CE1 PHE A 106 1.123 8.230 7.268 1.00 0.00 C ATOM 1663 CE2 PHE A 106 2.445 8.070 9.316 1.00 0.00 C ATOM 1664 CZ PHE A 106 2.176 7.644 8.001 1.00 0.00 C ATOM 0 H PHE A 106 -1.522 8.385 11.442 1.00 0.00 H new ATOM 0 HA PHE A 106 -2.057 11.131 10.964 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -0.576 11.439 9.026 1.00 0.00 H new ATOM 0 HB3 PHE A 106 0.323 11.288 10.523 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -0.497 9.662 7.301 1.00 0.00 H new ATOM 0 HD2 PHE A 106 1.870 9.422 10.901 1.00 0.00 H new ATOM 0 HE1 PHE A 106 0.933 7.916 6.252 1.00 0.00 H new ATOM 0 HE2 PHE A 106 3.254 7.625 9.875 1.00 0.00 H new ATOM 0 HZ PHE A 106 2.777 6.867 7.553 1.00 0.00 H new ATOM 1674 N LEU A 107 -3.370 10.471 8.907 1.00 0.00 N ATOM 1675 CA LEU A 107 -4.129 10.121 7.707 1.00 0.00 C ATOM 1676 C LEU A 107 -3.189 10.073 6.503 1.00 0.00 C ATOM 1677 O LEU A 107 -2.601 11.081 6.101 1.00 0.00 O ATOM 1678 CB LEU A 107 -5.257 11.134 7.450 1.00 0.00 C ATOM 1679 CG LEU A 107 -6.615 10.902 8.140 1.00 0.00 C ATOM 1680 CD1 LEU A 107 -7.209 9.519 7.849 1.00 0.00 C ATOM 1681 CD2 LEU A 107 -6.520 11.127 9.654 1.00 0.00 C ATOM 0 H LEU A 107 -3.527 11.429 9.221 1.00 0.00 H new ATOM 0 HA LEU A 107 -4.582 9.141 7.859 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -4.895 12.118 7.749 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -5.432 11.172 6.375 1.00 0.00 H new ATOM 0 HG LEU A 107 -7.294 11.640 7.713 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -8.165 9.418 8.363 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -7.361 9.407 6.775 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -6.524 8.747 8.201 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -7.495 10.955 10.109 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -5.794 10.435 10.080 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -6.203 12.151 9.850 1.00 0.00 H new ATOM 1693 N CYS A 108 -3.109 8.897 5.900 1.00 0.00 N ATOM 1694 CA CYS A 108 -2.409 8.609 4.663 1.00 0.00 C ATOM 1695 C CYS A 108 -3.417 8.532 3.506 1.00 0.00 C ATOM 1696 O CYS A 108 -4.476 7.909 3.621 1.00 0.00 O ATOM 1697 CB CYS A 108 -1.683 7.270 4.856 1.00 0.00 C ATOM 1698 SG CYS A 108 -0.491 7.020 3.511 1.00 0.00 S ATOM 0 H CYS A 108 -3.560 8.068 6.288 1.00 0.00 H new ATOM 0 HA CYS A 108 -1.690 9.391 4.419 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -1.169 7.260 5.817 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -2.405 6.453 4.872 1.00 0.00 H new ATOM 0 HG CYS A 108 -0.989 7.474 2.400 1.00 0.00 H new ATOM 1704 N LEU A 109 -3.063 9.111 2.364 1.00 0.00 N ATOM 1705 CA LEU A 109 -3.654 8.803 1.069 1.00 0.00 C ATOM 1706 C LEU A 109 -2.824 7.676 0.444 1.00 0.00 C ATOM 1707 O LEU A 109 -1.621 7.839 0.247 1.00 0.00 O ATOM 1708 CB LEU A 109 -3.648 10.089 0.216 1.00 0.00 C ATOM 1709 CG LEU A 109 -4.539 10.042 -1.043 1.00 0.00 C ATOM 1710 CD1 LEU A 109 -6.029 9.896 -0.697 1.00 0.00 C ATOM 1711 CD2 LEU A 109 -4.331 11.336 -1.841 1.00 0.00 C ATOM 0 H LEU A 109 -2.338 9.826 2.313 1.00 0.00 H new ATOM 0 HA LEU A 109 -4.688 8.466 1.147 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -3.971 10.922 0.840 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -2.623 10.299 -0.090 1.00 0.00 H new ATOM 0 HG LEU A 109 -4.251 9.168 -1.628 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -6.615 9.868 -1.616 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -6.184 8.973 -0.139 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -6.346 10.744 -0.090 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -4.955 11.317 -2.734 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -4.606 12.192 -1.225 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -3.284 11.420 -2.132 1.00 0.00 H new ATOM 1723 N VAL A 110 -3.459 6.537 0.170 1.00 0.00 N ATOM 1724 CA VAL A 110 -2.869 5.413 -0.574 1.00 0.00 C ATOM 1725 C VAL A 110 -3.395 5.480 -2.006 1.00 0.00 C ATOM 1726 O VAL A 110 -4.609 5.464 -2.195 1.00 0.00 O ATOM 1727 CB VAL A 110 -3.218 4.041 0.052 1.00 0.00 C ATOM 1728 CG1 VAL A 110 -2.460 2.913 -0.660 1.00 0.00 C ATOM 1729 CG2 VAL A 110 -2.908 4.005 1.557 1.00 0.00 C ATOM 0 H VAL A 110 -4.420 6.361 0.464 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.783 5.501 -0.543 1.00 0.00 H new ATOM 0 HB VAL A 110 -4.290 3.892 -0.077 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.719 1.957 -0.205 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.735 2.899 -1.715 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -1.387 3.080 -0.567 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -3.167 3.025 1.958 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.846 4.192 1.714 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -3.491 4.772 2.067 1.00 0.00 H new ATOM 1739 N ASP A 111 -2.516 5.558 -3.004 1.00 0.00 N ATOM 1740 CA ASP A 111 -2.857 5.600 -4.426 1.00 0.00 C ATOM 1741 C ASP A 111 -2.233 4.399 -5.144 1.00 0.00 C ATOM 1742 O ASP A 111 -1.012 4.336 -5.268 1.00 0.00 O ATOM 1743 CB ASP A 111 -2.345 6.929 -4.998 1.00 0.00 C ATOM 1744 CG ASP A 111 -2.377 6.999 -6.534 1.00 0.00 C ATOM 1745 OD1 ASP A 111 -3.325 6.465 -7.153 1.00 0.00 O ATOM 1746 OD2 ASP A 111 -1.445 7.620 -7.098 1.00 0.00 O ATOM 0 H ASP A 111 -1.510 5.595 -2.839 1.00 0.00 H new ATOM 0 HA ASP A 111 -3.936 5.541 -4.571 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -2.947 7.743 -4.594 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -1.322 7.090 -4.658 1.00 0.00 H new ATOM 1751 N VAL A 112 -3.056 3.457 -5.616 1.00 0.00 N ATOM 1752 CA VAL A 112 -2.585 2.345 -6.458 1.00 0.00 C ATOM 1753 C VAL A 112 -2.600 2.764 -7.925 1.00 0.00 C ATOM 1754 O VAL A 112 -3.619 3.206 -8.451 1.00 0.00 O ATOM 1755 CB VAL A 112 -3.333 1.015 -6.233 1.00 0.00 C ATOM 1756 CG1 VAL A 112 -4.837 1.097 -6.414 1.00 0.00 C ATOM 1757 CG2 VAL A 112 -2.810 -0.114 -7.125 1.00 0.00 C ATOM 0 H VAL A 112 -4.059 3.440 -5.429 1.00 0.00 H new ATOM 0 HA VAL A 112 -1.560 2.134 -6.152 1.00 0.00 H new ATOM 0 HB VAL A 112 -3.129 0.794 -5.185 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -5.279 0.117 -6.236 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -5.250 1.815 -5.706 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -5.064 1.419 -7.430 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -3.372 -1.026 -6.925 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -2.931 0.164 -8.172 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -1.754 -0.285 -6.914 1.00 0.00 H new ATOM 1767 N VAL A 113 -1.456 2.584 -8.576 1.00 0.00 N ATOM 1768 CA VAL A 113 -1.227 2.847 -9.994 1.00 0.00 C ATOM 1769 C VAL A 113 -0.964 1.489 -10.663 1.00 0.00 C ATOM 1770 O VAL A 113 0.048 0.857 -10.345 1.00 0.00 O ATOM 1771 CB VAL A 113 -0.041 3.822 -10.172 1.00 0.00 C ATOM 1772 CG1 VAL A 113 0.299 4.030 -11.657 1.00 0.00 C ATOM 1773 CG2 VAL A 113 -0.330 5.187 -9.529 1.00 0.00 C ATOM 0 H VAL A 113 -0.621 2.233 -8.107 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.090 3.325 -10.458 1.00 0.00 H new ATOM 0 HB VAL A 113 0.812 3.365 -9.670 1.00 0.00 H new ATOM 0 HG11 VAL A 113 1.137 4.721 -11.745 1.00 0.00 H new ATOM 0 HG12 VAL A 113 0.568 3.074 -12.106 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -0.567 4.443 -12.174 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.526 5.846 -9.674 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -1.211 5.629 -9.994 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -0.510 5.056 -8.462 1.00 0.00 H new ATOM 1783 N PRO A 114 -1.865 0.994 -11.533 1.00 0.00 N ATOM 1784 CA PRO A 114 -1.713 -0.303 -12.181 1.00 0.00 C ATOM 1785 C PRO A 114 -0.664 -0.221 -13.292 1.00 0.00 C ATOM 1786 O PRO A 114 -0.702 0.678 -14.131 1.00 0.00 O ATOM 1787 CB PRO A 114 -3.100 -0.657 -12.725 1.00 0.00 C ATOM 1788 CG PRO A 114 -3.726 0.708 -12.995 1.00 0.00 C ATOM 1789 CD PRO A 114 -3.148 1.586 -11.889 1.00 0.00 C ATOM 0 HA PRO A 114 -1.362 -1.072 -11.493 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -3.036 -1.257 -13.633 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -3.681 -1.231 -12.004 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -3.463 1.082 -13.984 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -4.814 0.667 -12.949 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -3.022 2.613 -12.232 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -3.815 1.618 -11.028 1.00 0.00 H new ATOM 1797 N VAL A 115 0.261 -1.182 -13.299 1.00 0.00 N ATOM 1798 CA VAL A 115 1.272 -1.343 -14.359 1.00 0.00 C ATOM 1799 C VAL A 115 0.883 -2.526 -15.245 1.00 0.00 C ATOM 1800 O VAL A 115 0.854 -3.669 -14.789 1.00 0.00 O ATOM 1801 CB VAL A 115 2.689 -1.540 -13.775 1.00 0.00 C ATOM 1802 CG1 VAL A 115 3.750 -1.728 -14.872 1.00 0.00 C ATOM 1803 CG2 VAL A 115 3.096 -0.350 -12.893 1.00 0.00 C ATOM 0 H VAL A 115 0.335 -1.882 -12.561 1.00 0.00 H new ATOM 0 HA VAL A 115 1.299 -0.431 -14.955 1.00 0.00 H new ATOM 0 HB VAL A 115 2.645 -2.448 -13.173 1.00 0.00 H new ATOM 0 HG11 VAL A 115 4.729 -1.863 -14.412 1.00 0.00 H new ATOM 0 HG12 VAL A 115 3.505 -2.607 -15.468 1.00 0.00 H new ATOM 0 HG13 VAL A 115 3.769 -0.848 -15.515 1.00 0.00 H new ATOM 0 HG21 VAL A 115 4.097 -0.517 -12.496 1.00 0.00 H new ATOM 0 HG22 VAL A 115 3.089 0.563 -13.488 1.00 0.00 H new ATOM 0 HG23 VAL A 115 2.391 -0.251 -12.068 1.00 0.00 H new ATOM 1813 N LYS A 116 0.608 -2.253 -16.524 1.00 0.00 N ATOM 1814 CA LYS A 116 0.381 -3.283 -17.544 1.00 0.00 C ATOM 1815 C LYS A 116 1.690 -3.751 -18.207 1.00 0.00 C ATOM 1816 O LYS A 116 2.671 -3.008 -18.283 1.00 0.00 O ATOM 1817 CB LYS A 116 -0.622 -2.791 -18.600 1.00 0.00 C ATOM 1818 CG LYS A 116 -2.035 -2.687 -18.010 1.00 0.00 C ATOM 1819 CD LYS A 116 -3.071 -2.325 -19.082 1.00 0.00 C ATOM 1820 CE LYS A 116 -4.427 -2.922 -18.682 1.00 0.00 C ATOM 1821 NZ LYS A 116 -5.481 -2.633 -19.695 1.00 0.00 N ATOM 0 H LYS A 116 0.536 -1.302 -16.885 1.00 0.00 H new ATOM 0 HA LYS A 116 -0.043 -4.148 -17.035 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.309 -1.818 -18.978 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -0.628 -3.476 -19.448 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -2.307 -3.635 -17.547 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -2.046 -1.933 -17.223 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -3.150 -1.242 -19.180 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -2.760 -2.711 -20.053 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -4.327 -4.000 -18.559 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -4.731 -2.518 -17.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -6.382 -3.053 -19.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -5.595 -1.604 -19.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -5.203 -3.040 -20.611 1.00 0.00 H new ATOM 1835 N ASN A 117 1.686 -4.990 -18.708 1.00 0.00 N ATOM 1836 CA ASN A 117 2.798 -5.582 -19.456 1.00 0.00 C ATOM 1837 C ASN A 117 2.645 -5.356 -20.972 1.00 0.00 C ATOM 1838 O ASN A 117 1.712 -4.696 -21.433 1.00 0.00 O ATOM 1839 CB ASN A 117 2.951 -7.069 -19.068 1.00 0.00 C ATOM 1840 CG ASN A 117 1.995 -8.010 -19.790 1.00 0.00 C ATOM 1841 OD1 ASN A 117 2.373 -8.660 -20.751 1.00 0.00 O ATOM 1842 ND2 ASN A 117 0.736 -8.078 -19.401 1.00 0.00 N ATOM 0 H ASN A 117 0.893 -5.622 -18.602 1.00 0.00 H new ATOM 0 HA ASN A 117 3.726 -5.078 -19.184 1.00 0.00 H new ATOM 0 HB2 ASN A 117 3.974 -7.382 -19.274 1.00 0.00 H new ATOM 0 HB3 ASN A 117 2.797 -7.169 -17.994 1.00 0.00 H new ATOM 0 HD21 ASN A 117 0.078 -8.674 -19.904 1.00 0.00 H new ATOM 0 HD22 ASN A 117 0.420 -7.535 -18.598 1.00 0.00 H new ATOM 1849 N GLU A 118 3.540 -5.969 -21.742 1.00 0.00 N ATOM 1850 CA GLU A 118 3.574 -5.906 -23.212 1.00 0.00 C ATOM 1851 C GLU A 118 2.314 -6.472 -23.911 1.00 0.00 C ATOM 1852 O GLU A 118 2.039 -6.106 -25.055 1.00 0.00 O ATOM 1853 CB GLU A 118 4.847 -6.600 -23.729 1.00 0.00 C ATOM 1854 CG GLU A 118 4.985 -8.056 -23.262 1.00 0.00 C ATOM 1855 CD GLU A 118 6.179 -8.734 -23.951 1.00 0.00 C ATOM 1856 OE1 GLU A 118 6.019 -9.279 -25.070 1.00 0.00 O ATOM 1857 OE2 GLU A 118 7.294 -8.743 -23.376 1.00 0.00 O ATOM 0 H GLU A 118 4.288 -6.543 -21.354 1.00 0.00 H new ATOM 0 HA GLU A 118 3.586 -4.848 -23.472 1.00 0.00 H new ATOM 0 HB2 GLU A 118 4.848 -6.575 -24.819 1.00 0.00 H new ATOM 0 HB3 GLU A 118 5.719 -6.036 -23.397 1.00 0.00 H new ATOM 0 HG2 GLU A 118 5.117 -8.086 -22.180 1.00 0.00 H new ATOM 0 HG3 GLU A 118 4.070 -8.604 -23.486 1.00 0.00 H new ATOM 1864 N ASP A 119 1.525 -7.322 -23.239 1.00 0.00 N ATOM 1865 CA ASP A 119 0.266 -7.893 -23.756 1.00 0.00 C ATOM 1866 C ASP A 119 -0.986 -7.098 -23.320 1.00 0.00 C ATOM 1867 O ASP A 119 -2.110 -7.462 -23.678 1.00 0.00 O ATOM 1868 CB ASP A 119 0.153 -9.370 -23.331 1.00 0.00 C ATOM 1869 CG ASP A 119 1.186 -10.274 -24.025 1.00 0.00 C ATOM 1870 OD1 ASP A 119 1.191 -10.334 -25.279 1.00 0.00 O ATOM 1871 OD2 ASP A 119 1.956 -10.971 -23.320 1.00 0.00 O ATOM 0 H ASP A 119 1.747 -7.642 -22.296 1.00 0.00 H new ATOM 0 HA ASP A 119 0.302 -7.824 -24.843 1.00 0.00 H new ATOM 0 HB2 ASP A 119 0.282 -9.443 -22.251 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -0.850 -9.732 -23.558 1.00 0.00 H new ATOM 1876 N GLY A 120 -0.811 -6.016 -22.546 1.00 0.00 N ATOM 1877 CA GLY A 120 -1.898 -5.125 -22.114 1.00 0.00 C ATOM 1878 C GLY A 120 -2.722 -5.646 -20.932 1.00 0.00 C ATOM 1879 O GLY A 120 -3.851 -5.196 -20.745 1.00 0.00 O ATOM 0 H GLY A 120 0.104 -5.731 -22.197 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -1.472 -4.159 -21.844 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -2.566 -4.954 -22.958 1.00 0.00 H new ATOM 1883 N ALA A 121 -2.170 -6.558 -20.123 1.00 0.00 N ATOM 1884 CA ALA A 121 -2.753 -7.031 -18.858 1.00 0.00 C ATOM 1885 C ALA A 121 -1.958 -6.466 -17.672 1.00 0.00 C ATOM 1886 O ALA A 121 -0.752 -6.261 -17.796 1.00 0.00 O ATOM 1887 CB ALA A 121 -2.769 -8.569 -18.850 1.00 0.00 C ATOM 0 H ALA A 121 -1.277 -7.002 -20.336 1.00 0.00 H new ATOM 0 HA ALA A 121 -3.780 -6.678 -18.764 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -3.200 -8.924 -17.914 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -3.368 -8.931 -19.686 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -1.750 -8.944 -18.945 1.00 0.00 H new ATOM 1893 N VAL A 122 -2.602 -6.217 -16.534 1.00 0.00 N ATOM 1894 CA VAL A 122 -1.950 -5.663 -15.325 1.00 0.00 C ATOM 1895 C VAL A 122 -1.232 -6.768 -14.544 1.00 0.00 C ATOM 1896 O VAL A 122 -1.838 -7.762 -14.154 1.00 0.00 O ATOM 1897 CB VAL A 122 -2.910 -4.806 -14.462 1.00 0.00 C ATOM 1898 CG1 VAL A 122 -4.211 -5.532 -14.113 1.00 0.00 C ATOM 1899 CG2 VAL A 122 -2.254 -4.268 -13.181 1.00 0.00 C ATOM 0 H VAL A 122 -3.600 -6.392 -16.413 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.183 -4.960 -15.650 1.00 0.00 H new ATOM 0 HB VAL A 122 -3.157 -3.955 -15.096 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -4.841 -4.880 -13.508 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -4.738 -5.796 -15.030 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -3.983 -6.438 -13.552 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -2.979 -3.676 -12.622 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -1.916 -5.103 -12.567 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -1.401 -3.643 -13.444 1.00 0.00 H new ATOM 1909 N ILE A 123 0.080 -6.590 -14.343 1.00 0.00 N ATOM 1910 CA ILE A 123 0.971 -7.602 -13.722 1.00 0.00 C ATOM 1911 C ILE A 123 1.689 -7.102 -12.464 1.00 0.00 C ATOM 1912 O ILE A 123 2.021 -7.902 -11.593 1.00 0.00 O ATOM 1913 CB ILE A 123 1.961 -8.198 -14.753 1.00 0.00 C ATOM 1914 CG1 ILE A 123 3.195 -7.331 -15.099 1.00 0.00 C ATOM 1915 CG2 ILE A 123 1.231 -8.654 -16.028 1.00 0.00 C ATOM 1916 CD1 ILE A 123 2.964 -5.894 -15.575 1.00 0.00 C ATOM 0 H ILE A 123 0.566 -5.733 -14.607 1.00 0.00 H new ATOM 0 HA ILE A 123 0.317 -8.405 -13.383 1.00 0.00 H new ATOM 0 HB ILE A 123 2.382 -9.062 -14.238 1.00 0.00 H new ATOM 0 HG12 ILE A 123 3.831 -7.290 -14.214 1.00 0.00 H new ATOM 0 HG13 ILE A 123 3.760 -7.851 -15.873 1.00 0.00 H new ATOM 0 HG21 ILE A 123 1.953 -9.068 -16.732 1.00 0.00 H new ATOM 0 HG22 ILE A 123 0.495 -9.416 -15.773 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.727 -7.801 -16.483 1.00 0.00 H new ATOM 0 HD11 ILE A 123 3.924 -5.419 -15.777 1.00 0.00 H new ATOM 0 HD12 ILE A 123 2.366 -5.904 -16.486 1.00 0.00 H new ATOM 0 HD13 ILE A 123 2.438 -5.335 -14.802 1.00 0.00 H new ATOM 1928 N MET A 124 1.859 -5.788 -12.321 1.00 0.00 N ATOM 1929 CA MET A 124 2.316 -5.123 -11.089 1.00 0.00 C ATOM 1930 C MET A 124 1.402 -3.956 -10.687 1.00 0.00 C ATOM 1931 O MET A 124 0.824 -3.271 -11.531 1.00 0.00 O ATOM 1932 CB MET A 124 3.761 -4.629 -11.268 1.00 0.00 C ATOM 1933 CG MET A 124 4.766 -5.787 -11.321 1.00 0.00 C ATOM 1934 SD MET A 124 6.437 -5.288 -11.811 1.00 0.00 S ATOM 1935 CE MET A 124 6.168 -5.035 -13.586 1.00 0.00 C ATOM 0 H MET A 124 1.678 -5.131 -13.080 1.00 0.00 H new ATOM 0 HA MET A 124 2.276 -5.856 -10.284 1.00 0.00 H new ATOM 0 HB2 MET A 124 3.833 -4.045 -12.186 1.00 0.00 H new ATOM 0 HB3 MET A 124 4.020 -3.962 -10.445 1.00 0.00 H new ATOM 0 HG2 MET A 124 4.812 -6.260 -10.340 1.00 0.00 H new ATOM 0 HG3 MET A 124 4.402 -6.539 -12.021 1.00 0.00 H new ATOM 0 HE1 MET A 124 6.722 -5.786 -14.149 1.00 0.00 H new ATOM 0 HE2 MET A 124 5.105 -5.125 -13.809 1.00 0.00 H new ATOM 0 HE3 MET A 124 6.515 -4.041 -13.869 1.00 0.00 H new ATOM 1945 N PHE A 125 1.328 -3.697 -9.385 1.00 0.00 N ATOM 1946 CA PHE A 125 0.754 -2.491 -8.790 1.00 0.00 C ATOM 1947 C PHE A 125 1.877 -1.658 -8.174 1.00 0.00 C ATOM 1948 O PHE A 125 2.722 -2.192 -7.463 1.00 0.00 O ATOM 1949 CB PHE A 125 -0.262 -2.908 -7.713 1.00 0.00 C ATOM 1950 CG PHE A 125 -1.530 -3.545 -8.247 1.00 0.00 C ATOM 1951 CD1 PHE A 125 -2.352 -2.838 -9.148 1.00 0.00 C ATOM 1952 CD2 PHE A 125 -1.907 -4.835 -7.827 1.00 0.00 C ATOM 1953 CE1 PHE A 125 -3.525 -3.428 -9.648 1.00 0.00 C ATOM 1954 CE2 PHE A 125 -3.086 -5.420 -8.321 1.00 0.00 C ATOM 1955 CZ PHE A 125 -3.884 -4.723 -9.244 1.00 0.00 C ATOM 0 H PHE A 125 1.681 -4.349 -8.684 1.00 0.00 H new ATOM 0 HA PHE A 125 0.247 -1.893 -9.547 1.00 0.00 H new ATOM 0 HB2 PHE A 125 0.220 -3.608 -7.031 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -0.532 -2.028 -7.129 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -2.079 -1.839 -9.455 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -1.290 -5.376 -7.125 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -4.150 -2.886 -10.342 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -3.379 -6.406 -7.991 1.00 0.00 H new ATOM 0 HZ PHE A 125 -4.775 -5.185 -9.643 1.00 0.00 H new ATOM 1965 N ILE A 126 1.868 -0.345 -8.398 1.00 0.00 N ATOM 1966 CA ILE A 126 2.652 0.609 -7.600 1.00 0.00 C ATOM 1967 C ILE A 126 1.674 1.244 -6.614 1.00 0.00 C ATOM 1968 O ILE A 126 0.684 1.815 -7.064 1.00 0.00 O ATOM 1969 CB ILE A 126 3.330 1.680 -8.488 1.00 0.00 C ATOM 1970 CG1 ILE A 126 4.181 1.051 -9.615 1.00 0.00 C ATOM 1971 CG2 ILE A 126 4.197 2.605 -7.608 1.00 0.00 C ATOM 1972 CD1 ILE A 126 4.594 2.061 -10.694 1.00 0.00 C ATOM 0 H ILE A 126 1.318 0.092 -9.137 1.00 0.00 H new ATOM 0 HA ILE A 126 3.465 0.102 -7.080 1.00 0.00 H new ATOM 0 HB ILE A 126 2.545 2.262 -8.971 1.00 0.00 H new ATOM 0 HG12 ILE A 126 5.076 0.606 -9.181 1.00 0.00 H new ATOM 0 HG13 ILE A 126 3.617 0.242 -10.080 1.00 0.00 H new ATOM 0 HG21 ILE A 126 4.675 3.359 -8.233 1.00 0.00 H new ATOM 0 HG22 ILE A 126 3.568 3.095 -6.865 1.00 0.00 H new ATOM 0 HG23 ILE A 126 4.962 2.015 -7.103 1.00 0.00 H new ATOM 0 HD11 ILE A 126 5.189 1.557 -11.456 1.00 0.00 H new ATOM 0 HD12 ILE A 126 3.702 2.488 -11.153 1.00 0.00 H new ATOM 0 HD13 ILE A 126 5.185 2.857 -10.240 1.00 0.00 H new ATOM 1984 N LEU A 127 1.916 1.145 -5.307 1.00 0.00 N ATOM 1985 CA LEU A 127 1.142 1.855 -4.284 1.00 0.00 C ATOM 1986 C LEU A 127 1.996 3.026 -3.800 1.00 0.00 C ATOM 1987 O LEU A 127 3.121 2.814 -3.350 1.00 0.00 O ATOM 1988 CB LEU A 127 0.788 0.922 -3.106 1.00 0.00 C ATOM 1989 CG LEU A 127 -0.533 0.151 -3.300 1.00 0.00 C ATOM 1990 CD1 LEU A 127 -0.432 -0.918 -4.397 1.00 0.00 C ATOM 1991 CD2 LEU A 127 -0.942 -0.520 -1.984 1.00 0.00 C ATOM 0 H LEU A 127 2.662 0.565 -4.923 1.00 0.00 H new ATOM 0 HA LEU A 127 0.200 2.209 -4.704 1.00 0.00 H new ATOM 0 HB2 LEU A 127 1.598 0.207 -2.965 1.00 0.00 H new ATOM 0 HB3 LEU A 127 0.722 1.514 -2.193 1.00 0.00 H new ATOM 0 HG LEU A 127 -1.284 0.878 -3.609 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -1.388 -1.432 -4.494 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -0.178 -0.444 -5.345 1.00 0.00 H new ATOM 0 HD13 LEU A 127 0.342 -1.639 -4.133 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -1.876 -1.063 -2.127 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.162 -1.215 -1.672 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -1.079 0.240 -1.215 1.00 0.00 H new ATOM 2003 N ASN A 128 1.470 4.246 -3.888 1.00 0.00 N ATOM 2004 CA ASN A 128 2.101 5.459 -3.361 1.00 0.00 C ATOM 2005 C ASN A 128 1.454 5.879 -2.030 1.00 0.00 C ATOM 2006 O ASN A 128 0.259 5.652 -1.841 1.00 0.00 O ATOM 2007 CB ASN A 128 2.031 6.618 -4.370 1.00 0.00 C ATOM 2008 CG ASN A 128 2.207 6.192 -5.826 1.00 0.00 C ATOM 2009 OD1 ASN A 128 3.276 5.787 -6.259 1.00 0.00 O ATOM 2010 ND2 ASN A 128 1.164 6.267 -6.630 1.00 0.00 N ATOM 0 H ASN A 128 0.572 4.425 -4.338 1.00 0.00 H new ATOM 0 HA ASN A 128 3.151 5.226 -3.185 1.00 0.00 H new ATOM 0 HB2 ASN A 128 1.069 7.120 -4.264 1.00 0.00 H new ATOM 0 HB3 ASN A 128 2.801 7.348 -4.121 1.00 0.00 H new ATOM 0 HD21 ASN A 128 1.252 5.988 -7.607 1.00 0.00 H new ATOM 0 HD22 ASN A 128 0.269 6.604 -6.275 1.00 0.00 H new ATOM 2017 N PHE A 129 2.219 6.527 -1.143 1.00 0.00 N ATOM 2018 CA PHE A 129 1.762 7.021 0.163 1.00 0.00 C ATOM 2019 C PHE A 129 2.014 8.531 0.288 1.00 0.00 C ATOM 2020 O PHE A 129 3.094 9.013 -0.054 1.00 0.00 O ATOM 2021 CB PHE A 129 2.463 6.238 1.290 1.00 0.00 C ATOM 2022 CG PHE A 129 2.348 4.730 1.173 1.00 0.00 C ATOM 2023 CD1 PHE A 129 1.098 4.111 1.342 1.00 0.00 C ATOM 2024 CD2 PHE A 129 3.481 3.947 0.883 1.00 0.00 C ATOM 2025 CE1 PHE A 129 0.974 2.715 1.225 1.00 0.00 C ATOM 2026 CE2 PHE A 129 3.359 2.551 0.766 1.00 0.00 C ATOM 2027 CZ PHE A 129 2.106 1.934 0.935 1.00 0.00 C ATOM 0 H PHE A 129 3.203 6.728 -1.319 1.00 0.00 H new ATOM 0 HA PHE A 129 0.687 6.861 0.251 1.00 0.00 H new ATOM 0 HB2 PHE A 129 3.519 6.510 1.302 1.00 0.00 H new ATOM 0 HB3 PHE A 129 2.043 6.549 2.247 1.00 0.00 H new ATOM 0 HD1 PHE A 129 0.227 4.711 1.563 1.00 0.00 H new ATOM 0 HD2 PHE A 129 4.444 4.418 0.750 1.00 0.00 H new ATOM 0 HE1 PHE A 129 0.011 2.244 1.358 1.00 0.00 H new ATOM 0 HE2 PHE A 129 4.230 1.951 0.546 1.00 0.00 H new ATOM 0 HZ PHE A 129 2.014 0.862 0.842 1.00 0.00 H new ATOM 2037 N GLU A 130 1.033 9.275 0.801 1.00 0.00 N ATOM 2038 CA GLU A 130 1.094 10.725 1.016 1.00 0.00 C ATOM 2039 C GLU A 130 0.371 11.068 2.323 1.00 0.00 C ATOM 2040 O GLU A 130 -0.735 10.589 2.547 1.00 0.00 O ATOM 2041 CB GLU A 130 0.411 11.454 -0.157 1.00 0.00 C ATOM 2042 CG GLU A 130 1.324 11.582 -1.382 1.00 0.00 C ATOM 2043 CD GLU A 130 0.647 12.410 -2.485 1.00 0.00 C ATOM 2044 OE1 GLU A 130 0.738 13.660 -2.449 1.00 0.00 O ATOM 2045 OE2 GLU A 130 0.030 11.820 -3.403 1.00 0.00 O ATOM 0 H GLU A 130 0.141 8.872 1.089 1.00 0.00 H new ATOM 0 HA GLU A 130 2.135 11.042 1.076 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -0.494 10.915 -0.437 1.00 0.00 H new ATOM 0 HB3 GLU A 130 0.103 12.448 0.167 1.00 0.00 H new ATOM 0 HG2 GLU A 130 2.264 12.053 -1.093 1.00 0.00 H new ATOM 0 HG3 GLU A 130 1.568 10.591 -1.764 1.00 0.00 H new ATOM 2052 N VAL A 131 0.952 11.907 3.183 1.00 0.00 N ATOM 2053 CA VAL A 131 0.287 12.337 4.430 1.00 0.00 C ATOM 2054 C VAL A 131 -0.714 13.443 4.091 1.00 0.00 C ATOM 2055 O VAL A 131 -0.313 14.519 3.647 1.00 0.00 O ATOM 2056 CB VAL A 131 1.283 12.815 5.511 1.00 0.00 C ATOM 2057 CG1 VAL A 131 0.538 13.235 6.790 1.00 0.00 C ATOM 2058 CG2 VAL A 131 2.301 11.718 5.852 1.00 0.00 C ATOM 0 H VAL A 131 1.881 12.306 3.045 1.00 0.00 H new ATOM 0 HA VAL A 131 -0.225 11.475 4.856 1.00 0.00 H new ATOM 0 HB VAL A 131 1.816 13.675 5.106 1.00 0.00 H new ATOM 0 HG11 VAL A 131 1.258 13.568 7.538 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -0.149 14.049 6.560 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -0.023 12.386 7.180 1.00 0.00 H new ATOM 0 HG21 VAL A 131 2.988 12.084 6.615 1.00 0.00 H new ATOM 0 HG22 VAL A 131 1.777 10.839 6.227 1.00 0.00 H new ATOM 0 HG23 VAL A 131 2.862 11.451 4.956 1.00 0.00 H new ATOM 2068 N VAL A 132 -2.005 13.175 4.306 1.00 0.00 N ATOM 2069 CA VAL A 132 -3.088 14.145 4.031 1.00 0.00 C ATOM 2070 C VAL A 132 -3.502 14.955 5.273 1.00 0.00 C ATOM 2071 O VAL A 132 -3.979 16.080 5.131 1.00 0.00 O ATOM 2072 CB VAL A 132 -4.293 13.468 3.336 1.00 0.00 C ATOM 2073 CG1 VAL A 132 -5.189 12.662 4.266 1.00 0.00 C ATOM 2074 CG2 VAL A 132 -5.124 14.470 2.520 1.00 0.00 C ATOM 0 H VAL A 132 -2.336 12.284 4.675 1.00 0.00 H new ATOM 0 HA VAL A 132 -2.681 14.875 3.331 1.00 0.00 H new ATOM 0 HB VAL A 132 -3.842 12.747 2.655 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -6.007 12.224 3.694 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -4.607 11.868 4.734 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -5.596 13.316 5.037 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -5.959 13.952 2.049 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -5.506 15.249 3.180 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -4.497 14.921 1.751 1.00 0.00 H new ATOM 2084 N MET A 133 -3.281 14.417 6.484 1.00 0.00 N ATOM 2085 CA MET A 133 -3.599 15.069 7.766 1.00 0.00 C ATOM 2086 C MET A 133 -2.870 14.375 8.930 1.00 0.00 C ATOM 2087 O MET A 133 -3.173 13.230 9.257 1.00 0.00 O ATOM 2088 CB MET A 133 -5.134 15.121 7.948 1.00 0.00 C ATOM 2089 CG MET A 133 -5.593 15.545 9.348 1.00 0.00 C ATOM 2090 SD MET A 133 -4.983 17.149 9.940 1.00 0.00 S ATOM 2091 CE MET A 133 -5.802 18.257 8.763 1.00 0.00 C ATOM 0 H MET A 133 -2.866 13.493 6.602 1.00 0.00 H new ATOM 0 HA MET A 133 -3.237 16.097 7.761 1.00 0.00 H new ATOM 0 HB2 MET A 133 -5.551 15.814 7.217 1.00 0.00 H new ATOM 0 HB3 MET A 133 -5.547 14.137 7.726 1.00 0.00 H new ATOM 0 HG2 MET A 133 -6.683 15.568 9.359 1.00 0.00 H new ATOM 0 HG3 MET A 133 -5.283 14.778 10.057 1.00 0.00 H new ATOM 0 HE1 MET A 133 -5.619 19.292 9.050 1.00 0.00 H new ATOM 0 HE2 MET A 133 -5.406 18.083 7.763 1.00 0.00 H new ATOM 0 HE3 MET A 133 -6.875 18.063 8.767 1.00 0.00 H new ATOM 2101 N GLU A 134 -1.901 15.040 9.562 1.00 0.00 N ATOM 2102 CA GLU A 134 -1.143 14.473 10.687 1.00 0.00 C ATOM 2103 C GLU A 134 -1.946 14.571 11.999 1.00 0.00 C ATOM 2104 O GLU A 134 -2.415 15.656 12.362 1.00 0.00 O ATOM 2105 CB GLU A 134 0.222 15.173 10.794 1.00 0.00 C ATOM 2106 CG GLU A 134 1.139 14.514 11.831 1.00 0.00 C ATOM 2107 CD GLU A 134 2.528 15.170 11.831 1.00 0.00 C ATOM 2108 OE1 GLU A 134 2.688 16.258 12.437 1.00 0.00 O ATOM 2109 OE2 GLU A 134 3.475 14.603 11.232 1.00 0.00 O ATOM 0 H GLU A 134 -1.617 15.987 9.311 1.00 0.00 H new ATOM 0 HA GLU A 134 -0.968 13.413 10.505 1.00 0.00 H new ATOM 0 HB2 GLU A 134 0.711 15.159 9.820 1.00 0.00 H new ATOM 0 HB3 GLU A 134 0.071 16.219 11.060 1.00 0.00 H new ATOM 0 HG2 GLU A 134 0.693 14.598 12.822 1.00 0.00 H new ATOM 0 HG3 GLU A 134 1.235 13.450 11.614 1.00 0.00 H new ATOM 2116 N LYS A 135 -2.091 13.438 12.709 1.00 0.00 N ATOM 2117 CA LYS A 135 -2.825 13.320 13.987 1.00 0.00 C ATOM 2118 C LYS A 135 -1.922 12.849 15.146 1.00 0.00 C ATOM 2119 O LYS A 135 -2.041 11.689 15.617 1.00 0.00 O ATOM 2120 CB LYS A 135 -4.081 12.450 13.797 1.00 0.00 C ATOM 2121 CG LYS A 135 -5.076 13.099 12.812 1.00 0.00 C ATOM 2122 CD LYS A 135 -6.520 12.854 13.261 1.00 0.00 C ATOM 2123 CE LYS A 135 -7.516 13.584 12.347 1.00 0.00 C ATOM 2124 NZ LYS A 135 -8.917 13.436 12.832 1.00 0.00 N ATOM 2125 OXT LYS A 135 -1.109 13.682 15.623 1.00 0.00 O ATOM 0 H LYS A 135 -1.690 12.552 12.403 1.00 0.00 H new ATOM 0 HA LYS A 135 -3.159 14.314 14.284 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -3.791 11.467 13.427 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -4.568 12.298 14.760 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -4.886 14.171 12.749 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -4.926 12.689 11.813 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -6.730 11.784 13.252 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -6.647 13.195 14.288 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -7.257 14.642 12.298 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -7.438 13.189 11.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -9.561 13.941 12.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -9.172 12.428 12.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -8.997 13.835 13.789 1.00 0.00 H new TER 2139 LYS A 135