USER MOD reduce.3.24.130724 H: found=0, std=0, add=1013, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 1011 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 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc= -4.37! C(o=-4.4!,f=-15!) USER MOD Single : A 13 ASN : amide:sc= -10.6! C(o=-11!,f=-14!) USER MOD Single : A 15 ASN :FLIP amide:sc=-0.00563 F(o=-1,f=-0.0056) USER MOD Single : A 16 ASN : amide:sc= -9.22! C(o=-9.2!,f=-13!) USER MOD Single : A 21 THR OG1 : rot 180:sc=-0.00335 USER MOD Single : A 28 HIS : no HD1:sc= -0.342 X(o=-0.34,f=-0.55) USER MOD Single : A 29 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= -1.23 K(o=-1.2,f=-9.5!) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ -176:sc= -0.711 (180deg=-0.758) USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot 68:sc= 0.605 USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 GLN : amide:sc= -0.238 K(o=-0.24,f=-1.9!) USER MOD Single : A 61 THR OG1 : rot 11:sc= 1.2 USER MOD Single : A 63 GLN : amide:sc= -13.4! C(o=-13!,f=-13!) USER MOD Single : A 64 HIS : no HD1:sc= -0.44 X(o=-0.44,f=-0.26) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ -125:sc= -0.435 (180deg=-2.4!) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 HIS : no HD1:sc= -3.95 X(o=-4,f=-3.7) USER MOD Single : A 81 THR OG1 : rot -160:sc= -2.22! USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= -3.35! C(o=-3.4!,f=-5.4!) USER MOD Single : A 105 MET CE :methyl 160:sc= -3.19! (180deg=-4.11!) USER MOD Single : A 106 SER OG : rot 76:sc= 0.196 USER MOD Single : A 111 ASN : amide:sc= -1.45 K(o=-1.5,f=-5.1!) USER MOD Single : A 119 ASN : amide:sc= -10.1! C(o=-10!,f=-13!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 42 N LYS A 3 14.385 11.467 4.294 1.00 0.00 N ATOM 43 CA LYS A 3 13.492 10.987 3.213 1.00 0.00 C ATOM 44 C LYS A 3 13.121 9.524 3.497 1.00 0.00 C ATOM 45 O LYS A 3 13.878 8.788 4.096 1.00 0.00 O ATOM 46 CB LYS A 3 14.220 11.079 1.869 1.00 0.00 C ATOM 47 CG LYS A 3 13.614 10.070 0.897 1.00 0.00 C ATOM 48 CD LYS A 3 13.790 10.561 -0.535 1.00 0.00 C ATOM 49 CE LYS A 3 14.583 9.519 -1.326 1.00 0.00 C ATOM 50 NZ LYS A 3 15.448 10.206 -2.326 1.00 0.00 N ATOM 0 HA LYS A 3 12.591 11.599 3.174 1.00 0.00 H new ATOM 0 HB2 LYS A 3 14.135 12.088 1.464 1.00 0.00 H new ATOM 0 HB3 LYS A 3 15.283 10.878 2.004 1.00 0.00 H new ATOM 0 HG2 LYS A 3 14.095 9.099 1.020 1.00 0.00 H new ATOM 0 HG3 LYS A 3 12.555 9.931 1.116 1.00 0.00 H new ATOM 0 HD2 LYS A 3 12.817 10.725 -0.999 1.00 0.00 H new ATOM 0 HD3 LYS A 3 14.313 11.518 -0.543 1.00 0.00 H new ATOM 0 HE2 LYS A 3 15.195 8.922 -0.650 1.00 0.00 H new ATOM 0 HE3 LYS A 3 13.902 8.833 -1.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 15.987 9.498 -2.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 14.854 10.757 -2.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 16.107 10.843 -1.835 1.00 0.00 H new ATOM 64 N LEU A 4 11.975 9.094 3.046 1.00 0.00 N ATOM 65 CA LEU A 4 11.572 7.678 3.265 1.00 0.00 C ATOM 66 C LEU A 4 10.688 7.225 2.106 1.00 0.00 C ATOM 67 O LEU A 4 10.222 8.022 1.316 1.00 0.00 O ATOM 68 CB LEU A 4 10.817 7.533 4.604 1.00 0.00 C ATOM 69 CG LEU A 4 9.301 7.699 4.425 1.00 0.00 C ATOM 70 CD1 LEU A 4 8.620 6.343 4.616 1.00 0.00 C ATOM 71 CD2 LEU A 4 8.792 8.699 5.458 1.00 0.00 C ATOM 0 H LEU A 4 11.300 9.663 2.535 1.00 0.00 H new ATOM 0 HA LEU A 4 12.463 7.052 3.309 1.00 0.00 H new ATOM 0 HB2 LEU A 4 11.027 6.554 5.035 1.00 0.00 H new ATOM 0 HB3 LEU A 4 11.183 8.278 5.310 1.00 0.00 H new ATOM 0 HG LEU A 4 9.074 8.068 3.425 1.00 0.00 H new ATOM 0 HD11 LEU A 4 7.543 6.456 4.490 1.00 0.00 H new ATOM 0 HD12 LEU A 4 9.000 5.638 3.877 1.00 0.00 H new ATOM 0 HD13 LEU A 4 8.831 5.968 5.617 1.00 0.00 H new ATOM 0 HD21 LEU A 4 7.716 8.826 5.342 1.00 0.00 H new ATOM 0 HD22 LEU A 4 9.007 8.328 6.460 1.00 0.00 H new ATOM 0 HD23 LEU A 4 9.289 9.658 5.311 1.00 0.00 H new ATOM 83 N GLN A 5 10.436 5.956 2.014 1.00 0.00 N ATOM 84 CA GLN A 5 9.566 5.450 0.927 1.00 0.00 C ATOM 85 C GLN A 5 8.715 4.322 1.485 1.00 0.00 C ATOM 86 O GLN A 5 8.913 3.880 2.595 1.00 0.00 O ATOM 87 CB GLN A 5 10.422 4.939 -0.228 1.00 0.00 C ATOM 88 CG GLN A 5 11.405 6.036 -0.630 1.00 0.00 C ATOM 89 CD GLN A 5 12.739 5.812 0.085 1.00 0.00 C ATOM 90 OE1 GLN A 5 12.901 6.195 1.226 1.00 0.00 O ATOM 91 NE2 GLN A 5 13.707 5.199 -0.541 1.00 0.00 N ATOM 0 H GLN A 5 10.797 5.243 2.648 1.00 0.00 H new ATOM 0 HA GLN A 5 8.927 6.250 0.553 1.00 0.00 H new ATOM 0 HB2 GLN A 5 10.961 4.039 0.070 1.00 0.00 H new ATOM 0 HB3 GLN A 5 9.791 4.668 -1.075 1.00 0.00 H new ATOM 0 HG2 GLN A 5 11.553 6.029 -1.710 1.00 0.00 H new ATOM 0 HG3 GLN A 5 11.001 7.014 -0.370 1.00 0.00 H new ATOM 0 HE21 GLN A 5 13.571 4.877 -1.499 1.00 0.00 H new ATOM 0 HE22 GLN A 5 14.599 5.042 -0.072 1.00 0.00 H new ATOM 100 N ILE A 6 7.764 3.856 0.741 1.00 0.00 N ATOM 101 CA ILE A 6 6.912 2.766 1.266 1.00 0.00 C ATOM 102 C ILE A 6 6.659 1.739 0.167 1.00 0.00 C ATOM 103 O ILE A 6 6.032 2.024 -0.833 1.00 0.00 O ATOM 104 CB ILE A 6 5.594 3.368 1.765 1.00 0.00 C ATOM 105 CG1 ILE A 6 5.817 3.922 3.188 1.00 0.00 C ATOM 106 CG2 ILE A 6 4.490 2.303 1.769 1.00 0.00 C ATOM 107 CD1 ILE A 6 4.713 3.450 4.153 1.00 0.00 C ATOM 0 H ILE A 6 7.540 4.178 -0.200 1.00 0.00 H new ATOM 0 HA ILE A 6 7.409 2.262 2.095 1.00 0.00 H new ATOM 0 HB ILE A 6 5.279 4.174 1.102 1.00 0.00 H new ATOM 0 HG12 ILE A 6 6.789 3.598 3.558 1.00 0.00 H new ATOM 0 HG13 ILE A 6 5.835 5.011 3.158 1.00 0.00 H new ATOM 0 HG21 ILE A 6 3.560 2.745 2.126 1.00 0.00 H new ATOM 0 HG22 ILE A 6 4.347 1.923 0.757 1.00 0.00 H new ATOM 0 HG23 ILE A 6 4.778 1.483 2.427 1.00 0.00 H new ATOM 0 HD11 ILE A 6 4.900 3.858 5.147 1.00 0.00 H new ATOM 0 HD12 ILE A 6 3.744 3.797 3.795 1.00 0.00 H new ATOM 0 HD13 ILE A 6 4.713 2.361 4.202 1.00 0.00 H new ATOM 119 N ALA A 7 7.141 0.543 0.358 1.00 0.00 N ATOM 120 CA ALA A 7 6.925 -0.521 -0.655 1.00 0.00 C ATOM 121 C ALA A 7 5.564 -1.154 -0.393 1.00 0.00 C ATOM 122 O ALA A 7 5.463 -2.315 -0.049 1.00 0.00 O ATOM 123 CB ALA A 7 8.015 -1.585 -0.518 1.00 0.00 C ATOM 0 H ALA A 7 7.678 0.258 1.177 1.00 0.00 H new ATOM 0 HA ALA A 7 6.962 -0.101 -1.660 1.00 0.00 H new ATOM 0 HB1 ALA A 7 7.856 -2.366 -1.262 1.00 0.00 H new ATOM 0 HB2 ALA A 7 8.992 -1.127 -0.675 1.00 0.00 H new ATOM 0 HB3 ALA A 7 7.975 -2.021 0.480 1.00 0.00 H new ATOM 129 N VAL A 8 4.514 -0.391 -0.526 1.00 0.00 N ATOM 130 CA VAL A 8 3.164 -0.945 -0.256 1.00 0.00 C ATOM 131 C VAL A 8 2.683 -1.768 -1.442 1.00 0.00 C ATOM 132 O VAL A 8 2.684 -2.982 -1.401 1.00 0.00 O ATOM 133 CB VAL A 8 2.166 0.192 0.048 1.00 0.00 C ATOM 134 CG1 VAL A 8 2.454 1.410 -0.836 1.00 0.00 C ATOM 135 CG2 VAL A 8 0.727 -0.288 -0.205 1.00 0.00 C ATOM 0 H VAL A 8 4.535 0.589 -0.809 1.00 0.00 H new ATOM 0 HA VAL A 8 3.225 -1.595 0.617 1.00 0.00 H new ATOM 0 HB VAL A 8 2.279 0.475 1.094 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.741 2.202 -0.608 1.00 0.00 H new ATOM 0 HG12 VAL A 8 3.466 1.767 -0.645 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.361 1.129 -1.885 1.00 0.00 H new ATOM 0 HG21 VAL A 8 0.030 0.521 0.012 1.00 0.00 H new ATOM 0 HG22 VAL A 8 0.621 -0.588 -1.248 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.508 -1.138 0.441 1.00 0.00 H new ATOM 145 N GLY A 9 2.238 -1.141 -2.485 1.00 0.00 N ATOM 146 CA GLY A 9 1.729 -1.934 -3.618 1.00 0.00 C ATOM 147 C GLY A 9 0.459 -2.618 -3.147 1.00 0.00 C ATOM 148 O GLY A 9 0.479 -3.720 -2.637 1.00 0.00 O ATOM 0 H GLY A 9 2.206 -0.128 -2.600 1.00 0.00 H new ATOM 0 HA2 GLY A 9 1.526 -1.294 -4.476 1.00 0.00 H new ATOM 0 HA3 GLY A 9 2.468 -2.670 -3.936 1.00 0.00 H new ATOM 152 N ILE A 10 -0.646 -1.951 -3.294 1.00 0.00 N ATOM 153 CA ILE A 10 -1.929 -2.546 -2.834 1.00 0.00 C ATOM 154 C ILE A 10 -2.011 -3.944 -3.412 1.00 0.00 C ATOM 155 O ILE A 10 -1.143 -4.365 -4.152 1.00 0.00 O ATOM 156 CB ILE A 10 -3.141 -1.719 -3.293 1.00 0.00 C ATOM 157 CG1 ILE A 10 -2.706 -0.297 -3.653 1.00 0.00 C ATOM 158 CG2 ILE A 10 -4.164 -1.654 -2.152 1.00 0.00 C ATOM 159 CD1 ILE A 10 -3.935 0.537 -4.020 1.00 0.00 C ATOM 0 H ILE A 10 -0.719 -1.023 -3.711 1.00 0.00 H new ATOM 0 HA ILE A 10 -1.951 -2.563 -1.744 1.00 0.00 H new ATOM 0 HB ILE A 10 -3.582 -2.191 -4.171 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -2.183 0.158 -2.812 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -2.007 -0.320 -4.489 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -5.027 -1.069 -2.470 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -4.485 -2.663 -1.893 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -3.708 -1.184 -1.281 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -3.624 1.550 -4.276 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -4.439 0.085 -4.874 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -4.618 0.571 -3.171 1.00 0.00 H new ATOM 171 N ILE A 11 -3.014 -4.686 -3.082 1.00 0.00 N ATOM 172 CA ILE A 11 -3.067 -6.055 -3.627 1.00 0.00 C ATOM 173 C ILE A 11 -4.504 -6.456 -3.970 1.00 0.00 C ATOM 174 O ILE A 11 -5.130 -7.226 -3.267 1.00 0.00 O ATOM 175 CB ILE A 11 -2.464 -7.004 -2.587 1.00 0.00 C ATOM 176 CG1 ILE A 11 -2.950 -6.616 -1.192 1.00 0.00 C ATOM 177 CG2 ILE A 11 -0.938 -6.877 -2.617 1.00 0.00 C ATOM 178 CD1 ILE A 11 -2.220 -7.464 -0.149 1.00 0.00 C ATOM 0 H ILE A 11 -3.785 -4.414 -2.472 1.00 0.00 H new ATOM 0 HA ILE A 11 -2.495 -6.108 -4.553 1.00 0.00 H new ATOM 0 HB ILE A 11 -2.768 -8.025 -2.816 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -2.765 -5.557 -1.011 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -4.026 -6.769 -1.114 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -0.502 -7.550 -1.879 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -0.570 -7.140 -3.609 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -0.654 -5.851 -2.385 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -2.564 -7.190 0.848 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -2.428 -8.519 -0.328 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -1.147 -7.288 -0.223 1.00 0.00 H new ATOM 190 N ARG A 12 -5.017 -5.983 -5.084 1.00 0.00 N ATOM 191 CA ARG A 12 -6.393 -6.400 -5.489 1.00 0.00 C ATOM 192 C ARG A 12 -6.238 -7.782 -6.092 1.00 0.00 C ATOM 193 O ARG A 12 -5.147 -8.145 -6.467 1.00 0.00 O ATOM 194 CB ARG A 12 -7.017 -5.451 -6.528 1.00 0.00 C ATOM 195 CG ARG A 12 -5.956 -4.565 -7.174 1.00 0.00 C ATOM 196 CD ARG A 12 -6.639 -3.571 -8.126 1.00 0.00 C ATOM 197 NE ARG A 12 -6.876 -4.235 -9.441 1.00 0.00 N ATOM 198 CZ ARG A 12 -7.690 -3.699 -10.308 1.00 0.00 C ATOM 199 NH1 ARG A 12 -8.971 -3.938 -10.236 1.00 0.00 N ATOM 200 NH2 ARG A 12 -7.221 -2.936 -11.257 1.00 0.00 N ATOM 0 H ARG A 12 -4.548 -5.337 -5.719 1.00 0.00 H new ATOM 0 HA ARG A 12 -7.058 -6.383 -4.626 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -7.526 -6.033 -7.297 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -7.772 -4.828 -6.048 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -5.398 -4.028 -6.407 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -5.238 -5.176 -7.721 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -7.584 -3.232 -7.701 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -6.014 -2.688 -8.258 1.00 0.00 H new ATOM 0 HE ARG A 12 -6.401 -5.110 -9.662 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -9.336 -4.544 -9.501 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -9.607 -3.519 -10.914 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -6.218 -2.759 -11.321 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -7.857 -2.517 -11.935 1.00 0.00 H new ATOM 214 N ASN A 13 -7.254 -8.598 -6.170 1.00 0.00 N ATOM 215 CA ASN A 13 -6.958 -9.939 -6.733 1.00 0.00 C ATOM 216 C ASN A 13 -8.175 -10.721 -7.256 1.00 0.00 C ATOM 217 O ASN A 13 -8.009 -11.550 -8.091 1.00 0.00 O ATOM 218 CB ASN A 13 -6.233 -10.737 -5.654 1.00 0.00 C ATOM 219 CG ASN A 13 -7.229 -11.198 -4.589 1.00 0.00 C ATOM 220 OD1 ASN A 13 -8.093 -10.448 -4.185 1.00 0.00 O ATOM 221 ND2 ASN A 13 -7.139 -12.408 -4.109 1.00 0.00 N ATOM 0 H ASN A 13 -8.216 -8.411 -5.888 1.00 0.00 H new ATOM 0 HA ASN A 13 -6.345 -9.787 -7.621 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -5.738 -11.600 -6.099 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -5.456 -10.124 -5.197 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -7.795 -12.723 -3.394 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -6.413 -13.039 -4.449 1.00 0.00 H new ATOM 228 N GLU A 14 -9.384 -10.512 -6.836 1.00 0.00 N ATOM 229 CA GLU A 14 -10.472 -11.369 -7.434 1.00 0.00 C ATOM 230 C GLU A 14 -11.082 -10.635 -8.622 1.00 0.00 C ATOM 231 O GLU A 14 -11.566 -11.222 -9.570 1.00 0.00 O ATOM 232 CB GLU A 14 -11.552 -11.657 -6.389 1.00 0.00 C ATOM 233 CG GLU A 14 -12.384 -12.862 -6.838 1.00 0.00 C ATOM 234 CD GLU A 14 -13.243 -13.353 -5.672 1.00 0.00 C ATOM 235 OE1 GLU A 14 -12.692 -13.965 -4.772 1.00 0.00 O ATOM 236 OE2 GLU A 14 -14.438 -13.108 -5.698 1.00 0.00 O ATOM 0 H GLU A 14 -9.673 -9.824 -6.140 1.00 0.00 H new ATOM 0 HA GLU A 14 -10.048 -12.317 -7.764 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -11.093 -11.858 -5.421 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -12.193 -10.785 -6.263 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -13.019 -12.585 -7.680 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -11.728 -13.662 -7.182 1.00 0.00 H new ATOM 243 N ASN A 15 -11.008 -9.358 -8.572 1.00 0.00 N ATOM 244 CA ASN A 15 -11.502 -8.481 -9.660 1.00 0.00 C ATOM 245 C ASN A 15 -10.818 -7.169 -9.372 1.00 0.00 C ATOM 246 O ASN A 15 -10.167 -6.554 -10.193 1.00 0.00 O ATOM 247 CB ASN A 15 -13.023 -8.332 -9.565 1.00 0.00 C ATOM 248 CG ASN A 15 -13.581 -7.861 -10.910 1.00 0.00 C ATOM 249 OD1 ASN A 15 -12.952 -6.933 -11.577 1.00 0.00 O flip ATOM 250 ND2 ASN A 15 -14.602 -8.343 -11.357 1.00 0.00 N flip ATOM 0 H ASN A 15 -10.606 -8.850 -7.784 1.00 0.00 H new ATOM 0 HA ASN A 15 -11.293 -8.862 -10.660 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -13.475 -9.284 -9.287 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -13.280 -7.617 -8.783 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -15.094 -9.069 -10.836 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -14.967 -8.022 -12.254 1.00 0.00 H new ATOM 257 N ASN A 16 -10.933 -6.809 -8.138 1.00 0.00 N ATOM 258 CA ASN A 16 -10.293 -5.615 -7.589 1.00 0.00 C ATOM 259 C ASN A 16 -10.326 -5.812 -6.079 1.00 0.00 C ATOM 260 O ASN A 16 -10.572 -4.885 -5.334 1.00 0.00 O ATOM 261 CB ASN A 16 -11.077 -4.362 -7.981 1.00 0.00 C ATOM 262 CG ASN A 16 -10.374 -3.127 -7.415 1.00 0.00 C ATOM 263 OD1 ASN A 16 -9.452 -3.245 -6.632 1.00 0.00 O ATOM 264 ND2 ASN A 16 -10.771 -1.939 -7.780 1.00 0.00 N ATOM 0 H ASN A 16 -11.480 -7.332 -7.454 1.00 0.00 H new ATOM 0 HA ASN A 16 -9.278 -5.483 -7.964 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -11.148 -4.288 -9.066 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -12.096 -4.422 -7.598 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -10.308 -1.110 -7.408 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -11.545 -1.839 -8.437 1.00 0.00 H new ATOM 271 N GLU A 17 -10.121 -7.032 -5.606 1.00 0.00 N ATOM 272 CA GLU A 17 -10.204 -7.232 -4.130 1.00 0.00 C ATOM 273 C GLU A 17 -8.875 -6.880 -3.483 1.00 0.00 C ATOM 274 O GLU A 17 -8.002 -7.709 -3.317 1.00 0.00 O ATOM 275 CB GLU A 17 -10.603 -8.662 -3.802 1.00 0.00 C ATOM 276 CG GLU A 17 -11.976 -8.946 -4.411 1.00 0.00 C ATOM 277 CD GLU A 17 -12.656 -10.081 -3.642 1.00 0.00 C ATOM 278 OE1 GLU A 17 -12.310 -11.225 -3.884 1.00 0.00 O ATOM 279 OE2 GLU A 17 -13.512 -9.786 -2.824 1.00 0.00 O ATOM 0 H GLU A 17 -9.909 -7.861 -6.161 1.00 0.00 H new ATOM 0 HA GLU A 17 -10.972 -6.571 -3.730 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -9.864 -9.359 -4.197 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.633 -8.807 -2.722 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -12.593 -8.048 -4.375 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -11.870 -9.218 -5.461 1.00 0.00 H new ATOM 286 N ILE A 18 -8.722 -5.633 -3.138 1.00 0.00 N ATOM 287 CA ILE A 18 -7.447 -5.164 -2.522 1.00 0.00 C ATOM 288 C ILE A 18 -7.419 -5.455 -1.023 1.00 0.00 C ATOM 289 O ILE A 18 -8.420 -5.403 -0.340 1.00 0.00 O ATOM 290 CB ILE A 18 -7.290 -3.646 -2.727 1.00 0.00 C ATOM 291 CG1 ILE A 18 -8.667 -2.968 -2.756 1.00 0.00 C ATOM 292 CG2 ILE A 18 -6.567 -3.377 -4.047 1.00 0.00 C ATOM 293 CD1 ILE A 18 -8.501 -1.451 -2.664 1.00 0.00 C ATOM 0 H ILE A 18 -9.432 -4.910 -3.257 1.00 0.00 H new ATOM 0 HA ILE A 18 -6.630 -5.699 -3.006 1.00 0.00 H new ATOM 0 HB ILE A 18 -6.709 -3.239 -1.899 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -9.192 -3.230 -3.674 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -9.277 -3.327 -1.927 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -6.457 -2.302 -4.189 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.582 -3.842 -4.023 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -7.146 -3.795 -4.871 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -9.482 -0.976 -2.685 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -7.994 -1.196 -1.733 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -7.909 -1.098 -3.508 1.00 0.00 H new ATOM 305 N PHE A 19 -6.253 -5.724 -0.513 1.00 0.00 N ATOM 306 CA PHE A 19 -6.084 -5.975 0.951 1.00 0.00 C ATOM 307 C PHE A 19 -5.984 -4.611 1.653 1.00 0.00 C ATOM 308 O PHE A 19 -5.119 -4.383 2.476 1.00 0.00 O ATOM 309 CB PHE A 19 -4.791 -6.769 1.159 1.00 0.00 C ATOM 310 CG PHE A 19 -4.783 -7.442 2.511 1.00 0.00 C ATOM 311 CD1 PHE A 19 -5.792 -8.349 2.852 1.00 0.00 C ATOM 312 CD2 PHE A 19 -3.747 -7.176 3.414 1.00 0.00 C ATOM 313 CE1 PHE A 19 -5.766 -8.990 4.097 1.00 0.00 C ATOM 314 CE2 PHE A 19 -3.722 -7.814 4.660 1.00 0.00 C ATOM 315 CZ PHE A 19 -4.731 -8.722 5.001 1.00 0.00 C ATOM 0 H PHE A 19 -5.391 -5.783 -1.055 1.00 0.00 H new ATOM 0 HA PHE A 19 -6.922 -6.540 1.358 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -4.690 -7.519 0.374 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -3.933 -6.102 1.075 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -6.591 -8.555 2.155 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -2.966 -6.478 3.149 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -6.544 -9.691 4.360 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -2.924 -7.606 5.358 1.00 0.00 H new ATOM 0 HZ PHE A 19 -4.711 -9.216 5.961 1.00 0.00 H new ATOM 325 N ILE A 20 -6.848 -3.695 1.298 1.00 0.00 N ATOM 326 CA ILE A 20 -6.817 -2.331 1.885 1.00 0.00 C ATOM 327 C ILE A 20 -7.483 -2.320 3.248 1.00 0.00 C ATOM 328 O ILE A 20 -8.392 -3.074 3.522 1.00 0.00 O ATOM 329 CB ILE A 20 -7.583 -1.389 0.961 1.00 0.00 C ATOM 330 CG1 ILE A 20 -7.551 0.041 1.501 1.00 0.00 C ATOM 331 CG2 ILE A 20 -9.034 -1.853 0.866 1.00 0.00 C ATOM 332 CD1 ILE A 20 -6.216 0.690 1.143 1.00 0.00 C ATOM 0 H ILE A 20 -7.587 -3.843 0.611 1.00 0.00 H new ATOM 0 HA ILE A 20 -5.780 -2.014 1.995 1.00 0.00 H new ATOM 0 HB ILE A 20 -7.114 -1.404 -0.023 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -8.373 0.619 1.079 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -7.687 0.036 2.582 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -9.588 -1.184 0.207 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -9.067 -2.866 0.465 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -9.486 -1.841 1.858 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -6.192 1.710 1.528 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -5.402 0.116 1.586 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -6.099 0.708 0.059 1.00 0.00 H new ATOM 344 N THR A 21 -7.054 -1.434 4.086 1.00 0.00 N ATOM 345 CA THR A 21 -7.672 -1.324 5.435 1.00 0.00 C ATOM 346 C THR A 21 -9.069 -0.736 5.253 1.00 0.00 C ATOM 347 O THR A 21 -9.261 0.463 5.270 1.00 0.00 O ATOM 348 CB THR A 21 -6.820 -0.413 6.318 1.00 0.00 C ATOM 349 OG1 THR A 21 -7.593 0.039 7.421 1.00 0.00 O ATOM 350 CG2 THR A 21 -6.334 0.787 5.504 1.00 0.00 C ATOM 0 H THR A 21 -6.298 -0.775 3.900 1.00 0.00 H new ATOM 0 HA THR A 21 -7.734 -2.300 5.917 1.00 0.00 H new ATOM 0 HB THR A 21 -5.958 -0.970 6.685 1.00 0.00 H new ATOM 0 HG1 THR A 21 -7.045 0.622 7.987 1.00 0.00 H new ATOM 0 HG21 THR A 21 -5.727 1.434 6.137 1.00 0.00 H new ATOM 0 HG22 THR A 21 -5.736 0.438 4.663 1.00 0.00 H new ATOM 0 HG23 THR A 21 -7.193 1.346 5.131 1.00 0.00 H new ATOM 358 N ARG A 22 -10.039 -1.578 5.039 1.00 0.00 N ATOM 359 CA ARG A 22 -11.420 -1.085 4.809 1.00 0.00 C ATOM 360 C ARG A 22 -12.137 -0.882 6.134 1.00 0.00 C ATOM 361 O ARG A 22 -12.717 -1.805 6.670 1.00 0.00 O ATOM 362 CB ARG A 22 -12.190 -2.106 3.975 1.00 0.00 C ATOM 363 CG ARG A 22 -13.516 -1.493 3.537 1.00 0.00 C ATOM 364 CD ARG A 22 -13.235 -0.233 2.721 1.00 0.00 C ATOM 365 NE ARG A 22 -14.503 0.252 2.113 1.00 0.00 N ATOM 366 CZ ARG A 22 -14.563 1.446 1.592 1.00 0.00 C ATOM 367 NH1 ARG A 22 -13.889 2.427 2.127 1.00 0.00 N ATOM 368 NH2 ARG A 22 -15.297 1.657 0.536 1.00 0.00 N ATOM 0 H ARG A 22 -9.932 -2.592 5.014 1.00 0.00 H new ATOM 0 HA ARG A 22 -11.370 -0.132 4.282 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -11.604 -2.398 3.103 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -12.368 -3.010 4.557 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -14.083 -2.208 2.942 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -14.124 -1.250 4.408 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -12.806 0.539 3.359 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -12.503 -0.446 1.942 1.00 0.00 H new ATOM 0 HE ARG A 22 -15.326 -0.350 2.104 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -13.315 2.260 2.953 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -13.936 3.361 1.719 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -15.823 0.889 0.119 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -15.346 2.590 0.127 1.00 0.00 H new ATOM 382 N ARG A 23 -12.106 0.329 6.646 1.00 0.00 N ATOM 383 CA ARG A 23 -12.789 0.658 7.947 1.00 0.00 C ATOM 384 C ARG A 23 -13.084 -0.624 8.733 1.00 0.00 C ATOM 385 O ARG A 23 -14.201 -1.100 8.762 1.00 0.00 O ATOM 386 CB ARG A 23 -14.105 1.407 7.677 1.00 0.00 C ATOM 387 CG ARG A 23 -14.477 1.319 6.192 1.00 0.00 C ATOM 388 CD ARG A 23 -15.994 1.445 6.035 1.00 0.00 C ATOM 389 NE ARG A 23 -16.587 0.094 5.834 1.00 0.00 N ATOM 390 CZ ARG A 23 -17.871 -0.083 5.986 1.00 0.00 C ATOM 391 NH1 ARG A 23 -18.361 -0.322 7.171 1.00 0.00 N ATOM 392 NH2 ARG A 23 -18.666 -0.023 4.953 1.00 0.00 N ATOM 0 H ARG A 23 -11.628 1.118 6.211 1.00 0.00 H new ATOM 0 HA ARG A 23 -12.125 1.292 8.535 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -14.904 0.981 8.284 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -14.003 2.452 7.971 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -13.976 2.110 5.634 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -14.136 0.371 5.777 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -16.424 1.914 6.920 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -16.230 2.087 5.187 1.00 0.00 H new ATOM 0 HE ARG A 23 -15.990 -0.692 5.578 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -17.741 -0.371 7.979 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -19.365 -0.460 7.289 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -18.284 0.162 4.026 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -19.669 -0.162 5.073 1.00 0.00 H new ATOM 406 N ALA A 24 -12.080 -1.197 9.340 1.00 0.00 N ATOM 407 CA ALA A 24 -12.279 -2.466 10.099 1.00 0.00 C ATOM 408 C ALA A 24 -13.611 -2.426 10.855 1.00 0.00 C ATOM 409 O ALA A 24 -14.451 -3.289 10.693 1.00 0.00 O ATOM 410 CB ALA A 24 -11.132 -2.647 11.096 1.00 0.00 C ATOM 0 H ALA A 24 -11.125 -0.839 9.343 1.00 0.00 H new ATOM 0 HA ALA A 24 -12.294 -3.301 9.399 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -11.276 -3.574 11.652 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -10.185 -2.690 10.558 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -11.117 -1.807 11.790 1.00 0.00 H new ATOM 416 N ALA A 25 -13.814 -1.432 11.675 1.00 0.00 N ATOM 417 CA ALA A 25 -15.095 -1.345 12.430 1.00 0.00 C ATOM 418 C ALA A 25 -16.178 -0.783 11.509 1.00 0.00 C ATOM 419 O ALA A 25 -16.173 -1.017 10.317 1.00 0.00 O ATOM 420 CB ALA A 25 -14.917 -0.420 13.636 1.00 0.00 C ATOM 0 H ALA A 25 -13.150 -0.678 11.854 1.00 0.00 H new ATOM 0 HA ALA A 25 -15.386 -2.336 12.778 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -15.855 -0.357 14.188 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -14.139 -0.817 14.288 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -14.630 0.574 13.293 1.00 0.00 H new ATOM 426 N ASP A 26 -17.106 -0.040 12.044 1.00 0.00 N ATOM 427 CA ASP A 26 -18.179 0.533 11.188 1.00 0.00 C ATOM 428 C ASP A 26 -17.640 1.773 10.471 1.00 0.00 C ATOM 429 O ASP A 26 -17.589 1.823 9.258 1.00 0.00 O ATOM 430 CB ASP A 26 -19.379 0.912 12.057 1.00 0.00 C ATOM 431 CG ASP A 26 -20.072 -0.360 12.548 1.00 0.00 C ATOM 432 OD1 ASP A 26 -20.063 -1.336 11.814 1.00 0.00 O ATOM 433 OD2 ASP A 26 -20.599 -0.338 13.648 1.00 0.00 O ATOM 0 H ASP A 26 -17.167 0.194 13.035 1.00 0.00 H new ATOM 0 HA ASP A 26 -18.495 -0.203 10.449 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -19.052 1.512 12.906 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -20.078 1.523 11.485 1.00 0.00 H new ATOM 438 N ALA A 27 -17.231 2.772 11.214 1.00 0.00 N ATOM 439 CA ALA A 27 -16.679 4.013 10.585 1.00 0.00 C ATOM 440 C ALA A 27 -17.810 4.941 10.135 1.00 0.00 C ATOM 441 O ALA A 27 -17.636 6.141 10.056 1.00 0.00 O ATOM 442 CB ALA A 27 -15.829 3.646 9.362 1.00 0.00 C ATOM 0 H ALA A 27 -17.256 2.782 12.234 1.00 0.00 H new ATOM 0 HA ALA A 27 -16.066 4.524 11.328 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -15.431 4.554 8.910 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -15.005 3.003 9.671 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -16.447 3.119 8.635 1.00 0.00 H new ATOM 448 N HIS A 28 -18.956 4.409 9.807 1.00 0.00 N ATOM 449 CA HIS A 28 -20.056 5.287 9.332 1.00 0.00 C ATOM 450 C HIS A 28 -19.487 6.203 8.251 1.00 0.00 C ATOM 451 O HIS A 28 -19.977 7.286 8.003 1.00 0.00 O ATOM 452 CB HIS A 28 -20.597 6.122 10.495 1.00 0.00 C ATOM 453 CG HIS A 28 -22.037 5.760 10.727 1.00 0.00 C ATOM 454 ND1 HIS A 28 -22.517 4.478 10.515 1.00 0.00 N ATOM 455 CD2 HIS A 28 -23.116 6.501 11.143 1.00 0.00 C ATOM 456 CE1 HIS A 28 -23.831 4.483 10.801 1.00 0.00 C ATOM 457 NE2 HIS A 28 -24.248 5.692 11.189 1.00 0.00 N ATOM 0 H HIS A 28 -19.175 3.414 9.848 1.00 0.00 H new ATOM 0 HA HIS A 28 -20.875 4.689 8.931 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -20.012 5.937 11.396 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -20.507 7.185 10.270 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -23.090 7.551 11.396 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -24.471 3.616 10.726 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -25.193 5.964 11.461 1.00 0.00 H new ATOM 465 N MET A 29 -18.441 5.758 7.608 1.00 0.00 N ATOM 466 CA MET A 29 -17.799 6.563 6.538 1.00 0.00 C ATOM 467 C MET A 29 -17.287 5.607 5.463 1.00 0.00 C ATOM 468 O MET A 29 -17.669 4.454 5.420 1.00 0.00 O ATOM 469 CB MET A 29 -16.624 7.340 7.133 1.00 0.00 C ATOM 470 CG MET A 29 -17.139 8.626 7.783 1.00 0.00 C ATOM 471 SD MET A 29 -15.750 9.747 8.087 1.00 0.00 S ATOM 472 CE MET A 29 -16.352 11.126 7.082 1.00 0.00 C ATOM 0 H MET A 29 -18.000 4.855 7.785 1.00 0.00 H new ATOM 0 HA MET A 29 -18.513 7.265 6.107 1.00 0.00 H new ATOM 0 HB2 MET A 29 -16.107 6.728 7.872 1.00 0.00 H new ATOM 0 HB3 MET A 29 -15.900 7.578 6.354 1.00 0.00 H new ATOM 0 HG2 MET A 29 -17.872 9.106 7.134 1.00 0.00 H new ATOM 0 HG3 MET A 29 -17.645 8.395 8.720 1.00 0.00 H new ATOM 0 HE1 MET A 29 -15.636 11.947 7.125 1.00 0.00 H new ATOM 0 HE2 MET A 29 -16.468 10.799 6.049 1.00 0.00 H new ATOM 0 HE3 MET A 29 -17.315 11.463 7.466 1.00 0.00 H new ATOM 482 N ALA A 30 -16.425 6.057 4.596 1.00 0.00 N ATOM 483 CA ALA A 30 -15.911 5.141 3.545 1.00 0.00 C ATOM 484 C ALA A 30 -14.657 5.727 2.897 1.00 0.00 C ATOM 485 O ALA A 30 -14.299 5.378 1.790 1.00 0.00 O ATOM 486 CB ALA A 30 -16.992 4.930 2.492 1.00 0.00 C ATOM 0 H ALA A 30 -16.058 7.008 4.570 1.00 0.00 H new ATOM 0 HA ALA A 30 -15.650 4.184 3.998 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -16.620 4.258 1.718 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -17.874 4.492 2.959 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -17.256 5.888 2.045 1.00 0.00 H new ATOM 492 N ASN A 31 -13.971 6.598 3.582 1.00 0.00 N ATOM 493 CA ASN A 31 -12.724 7.177 3.010 1.00 0.00 C ATOM 494 C ASN A 31 -11.529 6.474 3.656 1.00 0.00 C ATOM 495 O ASN A 31 -10.410 6.944 3.605 1.00 0.00 O ATOM 496 CB ASN A 31 -12.663 8.676 3.315 1.00 0.00 C ATOM 497 CG ASN A 31 -12.704 9.464 2.005 1.00 0.00 C ATOM 498 OD1 ASN A 31 -12.499 8.911 0.943 1.00 0.00 O ATOM 499 ND2 ASN A 31 -12.959 10.745 2.036 1.00 0.00 N ATOM 0 H ASN A 31 -14.219 6.934 4.513 1.00 0.00 H new ATOM 0 HA ASN A 31 -12.706 7.037 1.929 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -13.500 8.963 3.951 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -11.751 8.910 3.864 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -12.986 11.281 1.168 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -13.131 11.209 2.928 1.00 0.00 H new ATOM 506 N LYS A 32 -11.777 5.353 4.282 1.00 0.00 N ATOM 507 CA LYS A 32 -10.690 4.596 4.961 1.00 0.00 C ATOM 508 C LYS A 32 -9.909 3.736 3.958 1.00 0.00 C ATOM 509 O LYS A 32 -9.709 2.559 4.174 1.00 0.00 O ATOM 510 CB LYS A 32 -11.321 3.681 6.005 1.00 0.00 C ATOM 511 CG LYS A 32 -10.826 4.057 7.399 1.00 0.00 C ATOM 512 CD LYS A 32 -9.347 3.693 7.534 1.00 0.00 C ATOM 513 CE LYS A 32 -8.947 3.735 9.010 1.00 0.00 C ATOM 514 NZ LYS A 32 -8.744 5.150 9.429 1.00 0.00 N ATOM 0 H LYS A 32 -12.701 4.926 4.351 1.00 0.00 H new ATOM 0 HA LYS A 32 -10.001 5.303 5.422 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -12.407 3.762 5.962 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -11.070 2.642 5.789 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -10.965 5.125 7.570 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -11.410 3.534 8.157 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -9.167 2.699 7.125 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -8.736 4.389 6.960 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -9.721 3.271 9.621 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -8.032 3.163 9.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -8.472 5.179 10.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -7.991 5.578 8.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -9.627 5.682 9.294 1.00 0.00 H new ATOM 528 N LEU A 33 -9.460 4.300 2.873 1.00 0.00 N ATOM 529 CA LEU A 33 -8.689 3.486 1.887 1.00 0.00 C ATOM 530 C LEU A 33 -7.220 3.925 1.922 1.00 0.00 C ATOM 531 O LEU A 33 -6.807 4.780 1.173 1.00 0.00 O ATOM 532 CB LEU A 33 -9.256 3.712 0.478 1.00 0.00 C ATOM 533 CG LEU A 33 -10.675 3.154 0.380 1.00 0.00 C ATOM 534 CD1 LEU A 33 -11.064 3.051 -1.094 1.00 0.00 C ATOM 535 CD2 LEU A 33 -10.740 1.764 1.016 1.00 0.00 C ATOM 0 H LEU A 33 -9.590 5.281 2.625 1.00 0.00 H new ATOM 0 HA LEU A 33 -8.767 2.429 2.140 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -9.260 4.777 0.247 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.616 3.229 -0.260 1.00 0.00 H new ATOM 0 HG LEU A 33 -11.361 3.817 0.907 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -12.076 2.654 -1.176 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -11.024 4.040 -1.551 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -10.370 2.386 -1.608 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -11.756 1.376 0.940 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -10.056 1.093 0.496 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -10.454 1.831 2.066 1.00 0.00 H new ATOM 547 N GLU A 34 -6.434 3.358 2.799 1.00 0.00 N ATOM 548 CA GLU A 34 -4.994 3.759 2.886 1.00 0.00 C ATOM 549 C GLU A 34 -4.136 2.858 1.980 1.00 0.00 C ATOM 550 O GLU A 34 -4.493 2.585 0.852 1.00 0.00 O ATOM 551 CB GLU A 34 -4.531 3.638 4.339 1.00 0.00 C ATOM 552 CG GLU A 34 -3.412 4.648 4.602 1.00 0.00 C ATOM 553 CD GLU A 34 -2.251 3.957 5.319 1.00 0.00 C ATOM 554 OE1 GLU A 34 -2.430 2.826 5.739 1.00 0.00 O ATOM 555 OE2 GLU A 34 -1.204 4.570 5.435 1.00 0.00 O ATOM 0 H GLU A 34 -6.724 2.636 3.459 1.00 0.00 H new ATOM 0 HA GLU A 34 -4.882 4.790 2.551 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -5.367 3.820 5.015 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -4.176 2.626 4.536 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -3.067 5.077 3.661 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -3.788 5.472 5.209 1.00 0.00 H new ATOM 562 N PHE A 35 -3.003 2.396 2.456 1.00 0.00 N ATOM 563 CA PHE A 35 -2.145 1.515 1.605 1.00 0.00 C ATOM 564 C PHE A 35 -1.349 0.548 2.500 1.00 0.00 C ATOM 565 O PHE A 35 -0.571 0.977 3.327 1.00 0.00 O ATOM 566 CB PHE A 35 -1.153 2.354 0.782 1.00 0.00 C ATOM 567 CG PHE A 35 -1.504 3.825 0.845 1.00 0.00 C ATOM 568 CD1 PHE A 35 -1.279 4.549 2.022 1.00 0.00 C ATOM 569 CD2 PHE A 35 -2.043 4.464 -0.278 1.00 0.00 C ATOM 570 CE1 PHE A 35 -1.594 5.913 2.074 1.00 0.00 C ATOM 571 CE2 PHE A 35 -2.356 5.828 -0.224 1.00 0.00 C ATOM 572 CZ PHE A 35 -2.131 6.552 0.952 1.00 0.00 C ATOM 0 H PHE A 35 -2.639 2.590 3.389 1.00 0.00 H new ATOM 0 HA PHE A 35 -2.792 0.958 0.928 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -0.142 2.201 1.159 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -1.161 2.019 -0.255 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -0.863 4.057 2.889 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -2.217 3.905 -1.186 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -1.422 6.472 2.982 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -2.771 6.321 -1.090 1.00 0.00 H new ATOM 0 HZ PHE A 35 -2.372 7.604 0.993 1.00 0.00 H new ATOM 582 N PRO A 36 -1.567 -0.733 2.305 1.00 0.00 N ATOM 583 CA PRO A 36 -0.873 -1.782 3.086 1.00 0.00 C ATOM 584 C PRO A 36 0.607 -1.872 2.683 1.00 0.00 C ATOM 585 O PRO A 36 0.946 -2.554 1.738 1.00 0.00 O ATOM 586 CB PRO A 36 -1.591 -3.078 2.683 1.00 0.00 C ATOM 587 CG PRO A 36 -2.421 -2.769 1.409 1.00 0.00 C ATOM 588 CD PRO A 36 -2.525 -1.245 1.302 1.00 0.00 C ATOM 0 HA PRO A 36 -0.900 -1.584 4.158 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -0.870 -3.872 2.489 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -2.238 -3.425 3.488 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -1.940 -3.186 0.524 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -3.411 -3.220 1.475 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -2.271 -0.900 0.300 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.538 -0.901 1.510 1.00 0.00 H new ATOM 596 N GLY A 37 1.499 -1.203 3.374 1.00 0.00 N ATOM 597 CA GLY A 37 2.934 -1.296 2.975 1.00 0.00 C ATOM 598 C GLY A 37 3.809 -1.691 4.163 1.00 0.00 C ATOM 599 O GLY A 37 3.490 -2.594 4.913 1.00 0.00 O ATOM 0 H GLY A 37 1.300 -0.610 4.179 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.046 -2.030 2.177 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.267 -0.338 2.576 1.00 0.00 H new ATOM 603 N GLY A 38 4.927 -1.035 4.325 1.00 0.00 N ATOM 604 CA GLY A 38 5.837 -1.378 5.450 1.00 0.00 C ATOM 605 C GLY A 38 7.203 -0.702 5.263 1.00 0.00 C ATOM 606 O GLY A 38 8.223 -1.254 5.628 1.00 0.00 O ATOM 0 H GLY A 38 5.248 -0.275 3.724 1.00 0.00 H new ATOM 0 HA2 GLY A 38 5.394 -1.060 6.394 1.00 0.00 H new ATOM 0 HA3 GLY A 38 5.964 -2.459 5.506 1.00 0.00 H new ATOM 610 N LYS A 39 7.215 0.497 4.722 1.00 0.00 N ATOM 611 CA LYS A 39 8.497 1.255 4.525 1.00 0.00 C ATOM 612 C LYS A 39 9.509 0.460 3.690 1.00 0.00 C ATOM 613 O LYS A 39 10.068 -0.514 4.146 1.00 0.00 O ATOM 614 CB LYS A 39 9.116 1.568 5.894 1.00 0.00 C ATOM 615 CG LYS A 39 10.555 2.082 5.725 1.00 0.00 C ATOM 616 CD LYS A 39 10.533 3.519 5.204 1.00 0.00 C ATOM 617 CE LYS A 39 11.887 3.871 4.578 1.00 0.00 C ATOM 618 NZ LYS A 39 12.984 3.423 5.481 1.00 0.00 N ATOM 0 H LYS A 39 6.380 0.989 4.405 1.00 0.00 H new ATOM 0 HA LYS A 39 8.262 2.174 3.988 1.00 0.00 H new ATOM 0 HB2 LYS A 39 8.514 2.316 6.410 1.00 0.00 H new ATOM 0 HB3 LYS A 39 9.113 0.672 6.515 1.00 0.00 H new ATOM 0 HG2 LYS A 39 11.081 2.039 6.679 1.00 0.00 H new ATOM 0 HG3 LYS A 39 11.101 1.442 5.031 1.00 0.00 H new ATOM 0 HD2 LYS A 39 9.740 3.634 4.465 1.00 0.00 H new ATOM 0 HD3 LYS A 39 10.310 4.207 6.020 1.00 0.00 H new ATOM 0 HE2 LYS A 39 11.985 3.392 3.604 1.00 0.00 H new ATOM 0 HE3 LYS A 39 11.954 4.946 4.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 13.900 3.722 5.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 12.855 3.848 6.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 12.964 2.386 5.563 1.00 0.00 H new ATOM 632 N ILE A 40 9.782 0.898 2.485 1.00 0.00 N ATOM 633 CA ILE A 40 10.802 0.185 1.648 1.00 0.00 C ATOM 634 C ILE A 40 12.192 0.658 2.064 1.00 0.00 C ATOM 635 O ILE A 40 12.400 1.818 2.346 1.00 0.00 O ATOM 636 CB ILE A 40 10.588 0.473 0.148 1.00 0.00 C ATOM 637 CG1 ILE A 40 11.923 0.315 -0.623 1.00 0.00 C ATOM 638 CG2 ILE A 40 10.031 1.888 -0.045 1.00 0.00 C ATOM 639 CD1 ILE A 40 12.679 1.651 -0.686 1.00 0.00 C ATOM 0 H ILE A 40 9.348 1.710 2.046 1.00 0.00 H new ATOM 0 HA ILE A 40 10.700 -0.889 1.805 1.00 0.00 H new ATOM 0 HB ILE A 40 9.868 -0.244 -0.247 1.00 0.00 H new ATOM 0 HG12 ILE A 40 12.543 -0.436 -0.134 1.00 0.00 H new ATOM 0 HG13 ILE A 40 11.724 -0.043 -1.633 1.00 0.00 H new ATOM 0 HG21 ILE A 40 9.884 2.079 -1.108 1.00 0.00 H new ATOM 0 HG22 ILE A 40 9.077 1.978 0.475 1.00 0.00 H new ATOM 0 HG23 ILE A 40 10.735 2.615 0.361 1.00 0.00 H new ATOM 0 HD11 ILE A 40 13.613 1.515 -1.232 1.00 0.00 H new ATOM 0 HD12 ILE A 40 12.065 2.393 -1.196 1.00 0.00 H new ATOM 0 HD13 ILE A 40 12.897 1.994 0.325 1.00 0.00 H new ATOM 651 N GLU A 41 13.149 -0.220 2.091 1.00 0.00 N ATOM 652 CA GLU A 41 14.518 0.214 2.478 1.00 0.00 C ATOM 653 C GLU A 41 15.523 -0.925 2.258 1.00 0.00 C ATOM 654 O GLU A 41 16.684 -0.693 1.984 1.00 0.00 O ATOM 655 CB GLU A 41 14.507 0.642 3.947 1.00 0.00 C ATOM 656 CG GLU A 41 14.572 -0.591 4.852 1.00 0.00 C ATOM 657 CD GLU A 41 14.693 -0.147 6.311 1.00 0.00 C ATOM 658 OE1 GLU A 41 15.586 0.633 6.601 1.00 0.00 O ATOM 659 OE2 GLU A 41 13.893 -0.594 7.115 1.00 0.00 O ATOM 0 H GLU A 41 13.047 -1.209 1.865 1.00 0.00 H new ATOM 0 HA GLU A 41 14.823 1.056 1.857 1.00 0.00 H new ATOM 0 HB2 GLU A 41 15.354 1.297 4.150 1.00 0.00 H new ATOM 0 HB3 GLU A 41 13.604 1.213 4.161 1.00 0.00 H new ATOM 0 HG2 GLU A 41 13.678 -1.200 4.719 1.00 0.00 H new ATOM 0 HG3 GLU A 41 15.425 -1.212 4.578 1.00 0.00 H new ATOM 666 N MET A 42 15.092 -2.149 2.387 1.00 0.00 N ATOM 667 CA MET A 42 16.028 -3.293 2.196 1.00 0.00 C ATOM 668 C MET A 42 16.698 -3.198 0.823 1.00 0.00 C ATOM 669 O MET A 42 16.124 -2.703 -0.128 1.00 0.00 O ATOM 670 CB MET A 42 15.252 -4.606 2.293 1.00 0.00 C ATOM 671 CG MET A 42 14.641 -4.731 3.688 1.00 0.00 C ATOM 672 SD MET A 42 15.965 -4.879 4.914 1.00 0.00 S ATOM 673 CE MET A 42 15.539 -6.532 5.512 1.00 0.00 C ATOM 0 H MET A 42 14.132 -2.407 2.616 1.00 0.00 H new ATOM 0 HA MET A 42 16.794 -3.261 2.970 1.00 0.00 H new ATOM 0 HB2 MET A 42 14.468 -4.635 1.536 1.00 0.00 H new ATOM 0 HB3 MET A 42 15.915 -5.449 2.097 1.00 0.00 H new ATOM 0 HG2 MET A 42 14.024 -3.859 3.906 1.00 0.00 H new ATOM 0 HG3 MET A 42 13.988 -5.603 3.734 1.00 0.00 H new ATOM 0 HE1 MET A 42 16.242 -6.830 6.290 1.00 0.00 H new ATOM 0 HE2 MET A 42 14.528 -6.522 5.920 1.00 0.00 H new ATOM 0 HE3 MET A 42 15.590 -7.242 4.686 1.00 0.00 H new ATOM 683 N GLY A 43 17.909 -3.673 0.713 1.00 0.00 N ATOM 684 CA GLY A 43 18.617 -3.618 -0.596 1.00 0.00 C ATOM 685 C GLY A 43 18.591 -2.189 -1.139 1.00 0.00 C ATOM 686 O GLY A 43 18.966 -1.249 -0.468 1.00 0.00 O ATOM 0 H GLY A 43 18.439 -4.097 1.475 1.00 0.00 H new ATOM 0 HA2 GLY A 43 19.647 -3.953 -0.477 1.00 0.00 H new ATOM 0 HA3 GLY A 43 18.142 -4.295 -1.306 1.00 0.00 H new ATOM 690 N GLU A 44 18.150 -2.025 -2.354 1.00 0.00 N ATOM 691 CA GLU A 44 18.096 -0.662 -2.955 1.00 0.00 C ATOM 692 C GLU A 44 17.208 -0.679 -4.204 1.00 0.00 C ATOM 693 O GLU A 44 17.273 0.206 -5.033 1.00 0.00 O ATOM 694 CB GLU A 44 19.510 -0.222 -3.341 1.00 0.00 C ATOM 695 CG GLU A 44 20.184 -1.327 -4.157 1.00 0.00 C ATOM 696 CD GLU A 44 20.003 -1.043 -5.648 1.00 0.00 C ATOM 697 OE1 GLU A 44 20.035 0.119 -6.018 1.00 0.00 O ATOM 698 OE2 GLU A 44 19.836 -1.992 -6.396 1.00 0.00 O ATOM 0 H GLU A 44 17.823 -2.778 -2.960 1.00 0.00 H new ATOM 0 HA GLU A 44 17.679 0.036 -2.229 1.00 0.00 H new ATOM 0 HB2 GLU A 44 19.470 0.700 -3.921 1.00 0.00 H new ATOM 0 HB3 GLU A 44 20.093 -0.010 -2.445 1.00 0.00 H new ATOM 0 HG2 GLU A 44 21.245 -1.379 -3.912 1.00 0.00 H new ATOM 0 HG3 GLU A 44 19.751 -2.295 -3.905 1.00 0.00 H new ATOM 705 N THR A 45 16.378 -1.677 -4.344 1.00 0.00 N ATOM 706 CA THR A 45 15.486 -1.751 -5.529 1.00 0.00 C ATOM 707 C THR A 45 14.085 -2.087 -5.032 1.00 0.00 C ATOM 708 O THR A 45 13.941 -2.926 -4.181 1.00 0.00 O ATOM 709 CB THR A 45 15.996 -2.857 -6.459 1.00 0.00 C ATOM 710 OG1 THR A 45 17.260 -2.479 -6.986 1.00 0.00 O ATOM 711 CG2 THR A 45 15.009 -3.079 -7.608 1.00 0.00 C ATOM 0 H THR A 45 16.281 -2.447 -3.682 1.00 0.00 H new ATOM 0 HA THR A 45 15.471 -0.808 -6.075 1.00 0.00 H new ATOM 0 HB THR A 45 16.093 -3.784 -5.893 1.00 0.00 H new ATOM 0 HG1 THR A 45 17.924 -2.465 -6.265 1.00 0.00 H new ATOM 0 HG21 THR A 45 15.383 -3.867 -8.262 1.00 0.00 H new ATOM 0 HG22 THR A 45 14.040 -3.372 -7.204 1.00 0.00 H new ATOM 0 HG23 THR A 45 14.900 -2.156 -8.178 1.00 0.00 H new ATOM 719 N PRO A 46 13.087 -1.435 -5.567 1.00 0.00 N ATOM 720 CA PRO A 46 11.694 -1.683 -5.155 1.00 0.00 C ATOM 721 C PRO A 46 11.400 -3.186 -5.155 1.00 0.00 C ATOM 722 O PRO A 46 10.448 -3.632 -4.556 1.00 0.00 O ATOM 723 CB PRO A 46 10.842 -0.924 -6.176 1.00 0.00 C ATOM 724 CG PRO A 46 11.811 -0.111 -7.077 1.00 0.00 C ATOM 725 CD PRO A 46 13.250 -0.421 -6.621 1.00 0.00 C ATOM 0 HA PRO A 46 11.483 -1.343 -4.141 1.00 0.00 H new ATOM 0 HB2 PRO A 46 10.252 -1.618 -6.775 1.00 0.00 H new ATOM 0 HB3 PRO A 46 10.139 -0.261 -5.672 1.00 0.00 H new ATOM 0 HG2 PRO A 46 11.676 -0.381 -8.124 1.00 0.00 H new ATOM 0 HG3 PRO A 46 11.605 0.956 -6.994 1.00 0.00 H new ATOM 0 HD2 PRO A 46 13.856 -0.798 -7.445 1.00 0.00 H new ATOM 0 HD3 PRO A 46 13.748 0.471 -6.241 1.00 0.00 H new ATOM 733 N GLU A 47 12.225 -3.974 -5.796 1.00 0.00 N ATOM 734 CA GLU A 47 11.999 -5.442 -5.788 1.00 0.00 C ATOM 735 C GLU A 47 12.420 -5.984 -4.421 1.00 0.00 C ATOM 736 O GLU A 47 11.618 -6.119 -3.535 1.00 0.00 O ATOM 737 CB GLU A 47 12.846 -6.099 -6.881 1.00 0.00 C ATOM 738 CG GLU A 47 11.981 -6.379 -8.110 1.00 0.00 C ATOM 739 CD GLU A 47 12.843 -6.296 -9.371 1.00 0.00 C ATOM 740 OE1 GLU A 47 13.849 -6.984 -9.424 1.00 0.00 O ATOM 741 OE2 GLU A 47 12.483 -5.545 -10.264 1.00 0.00 O ATOM 0 H GLU A 47 13.041 -3.661 -6.322 1.00 0.00 H new ATOM 0 HA GLU A 47 10.948 -5.662 -5.975 1.00 0.00 H new ATOM 0 HB2 GLU A 47 13.677 -5.447 -7.151 1.00 0.00 H new ATOM 0 HB3 GLU A 47 13.278 -7.028 -6.510 1.00 0.00 H new ATOM 0 HG2 GLU A 47 11.528 -7.367 -8.031 1.00 0.00 H new ATOM 0 HG3 GLU A 47 11.166 -5.658 -8.166 1.00 0.00 H new ATOM 748 N GLN A 48 13.673 -6.285 -4.234 1.00 0.00 N ATOM 749 CA GLN A 48 14.111 -6.810 -2.906 1.00 0.00 C ATOM 750 C GLN A 48 13.497 -5.976 -1.796 1.00 0.00 C ATOM 751 O GLN A 48 13.177 -6.470 -0.741 1.00 0.00 O ATOM 752 CB GLN A 48 15.629 -6.731 -2.781 1.00 0.00 C ATOM 753 CG GLN A 48 16.249 -7.894 -3.549 1.00 0.00 C ATOM 754 CD GLN A 48 17.625 -8.219 -2.968 1.00 0.00 C ATOM 755 OE1 GLN A 48 18.627 -7.702 -3.421 1.00 0.00 O ATOM 756 NE2 GLN A 48 17.716 -9.060 -1.975 1.00 0.00 N ATOM 0 H GLN A 48 14.409 -6.193 -4.934 1.00 0.00 H new ATOM 0 HA GLN A 48 13.787 -7.847 -2.823 1.00 0.00 H new ATOM 0 HB2 GLN A 48 15.991 -5.782 -3.177 1.00 0.00 H new ATOM 0 HB3 GLN A 48 15.924 -6.772 -1.732 1.00 0.00 H new ATOM 0 HG2 GLN A 48 15.602 -8.769 -3.488 1.00 0.00 H new ATOM 0 HG3 GLN A 48 16.340 -7.638 -4.605 1.00 0.00 H new ATOM 0 HE21 GLN A 48 16.875 -9.494 -1.595 1.00 0.00 H new ATOM 0 HE22 GLN A 48 18.629 -9.284 -1.578 1.00 0.00 H new ATOM 765 N ALA A 49 13.345 -4.713 -2.020 1.00 0.00 N ATOM 766 CA ALA A 49 12.765 -3.844 -0.972 1.00 0.00 C ATOM 767 C ALA A 49 11.331 -4.268 -0.691 1.00 0.00 C ATOM 768 O ALA A 49 11.014 -4.684 0.389 1.00 0.00 O ATOM 769 CB ALA A 49 12.772 -2.391 -1.436 1.00 0.00 C ATOM 0 H ALA A 49 13.598 -4.240 -2.887 1.00 0.00 H new ATOM 0 HA ALA A 49 13.363 -3.939 -0.066 1.00 0.00 H new ATOM 0 HB1 ALA A 49 12.343 -1.759 -0.658 1.00 0.00 H new ATOM 0 HB2 ALA A 49 13.797 -2.077 -1.635 1.00 0.00 H new ATOM 0 HB3 ALA A 49 12.181 -2.297 -2.347 1.00 0.00 H new ATOM 775 N VAL A 50 10.459 -4.151 -1.646 1.00 0.00 N ATOM 776 CA VAL A 50 9.037 -4.531 -1.402 1.00 0.00 C ATOM 777 C VAL A 50 8.916 -6.040 -1.170 1.00 0.00 C ATOM 778 O VAL A 50 8.345 -6.482 -0.202 1.00 0.00 O ATOM 779 CB VAL A 50 8.187 -4.094 -2.606 1.00 0.00 C ATOM 780 CG1 VAL A 50 8.253 -5.132 -3.730 1.00 0.00 C ATOM 781 CG2 VAL A 50 6.729 -3.924 -2.178 1.00 0.00 C ATOM 0 H VAL A 50 10.664 -3.810 -2.585 1.00 0.00 H new ATOM 0 HA VAL A 50 8.675 -4.028 -0.505 1.00 0.00 H new ATOM 0 HB VAL A 50 8.585 -3.147 -2.972 1.00 0.00 H new ATOM 0 HG11 VAL A 50 7.643 -4.798 -4.570 1.00 0.00 H new ATOM 0 HG12 VAL A 50 9.286 -5.250 -4.056 1.00 0.00 H new ATOM 0 HG13 VAL A 50 7.877 -6.088 -3.365 1.00 0.00 H new ATOM 0 HG21 VAL A 50 6.132 -3.614 -3.036 1.00 0.00 H new ATOM 0 HG22 VAL A 50 6.350 -4.871 -1.795 1.00 0.00 H new ATOM 0 HG23 VAL A 50 6.665 -3.165 -1.398 1.00 0.00 H new ATOM 791 N VAL A 51 9.451 -6.821 -2.050 1.00 0.00 N ATOM 792 CA VAL A 51 9.380 -8.303 -1.917 1.00 0.00 C ATOM 793 C VAL A 51 9.869 -8.749 -0.529 1.00 0.00 C ATOM 794 O VAL A 51 9.267 -9.586 0.113 1.00 0.00 O ATOM 795 CB VAL A 51 10.268 -8.913 -3.004 1.00 0.00 C ATOM 796 CG1 VAL A 51 11.724 -8.836 -2.564 1.00 0.00 C ATOM 797 CG2 VAL A 51 9.889 -10.371 -3.235 1.00 0.00 C ATOM 0 H VAL A 51 9.948 -6.493 -2.878 1.00 0.00 H new ATOM 0 HA VAL A 51 8.349 -8.637 -2.029 1.00 0.00 H new ATOM 0 HB VAL A 51 10.129 -8.358 -3.932 1.00 0.00 H new ATOM 0 HG11 VAL A 51 12.361 -9.269 -3.335 1.00 0.00 H new ATOM 0 HG12 VAL A 51 12.002 -7.794 -2.407 1.00 0.00 H new ATOM 0 HG13 VAL A 51 11.853 -9.390 -1.634 1.00 0.00 H new ATOM 0 HG21 VAL A 51 10.527 -10.794 -4.010 1.00 0.00 H new ATOM 0 HG22 VAL A 51 10.021 -10.932 -2.310 1.00 0.00 H new ATOM 0 HG23 VAL A 51 8.847 -10.431 -3.550 1.00 0.00 H new ATOM 807 N ARG A 52 10.961 -8.202 -0.071 1.00 0.00 N ATOM 808 CA ARG A 52 11.501 -8.592 1.261 1.00 0.00 C ATOM 809 C ARG A 52 10.635 -7.958 2.351 1.00 0.00 C ATOM 810 O ARG A 52 10.340 -8.569 3.358 1.00 0.00 O ATOM 811 CB ARG A 52 12.951 -8.112 1.371 1.00 0.00 C ATOM 812 CG ARG A 52 13.804 -8.846 0.334 1.00 0.00 C ATOM 813 CD ARG A 52 14.732 -9.828 1.048 1.00 0.00 C ATOM 814 NE ARG A 52 15.122 -10.916 0.109 1.00 0.00 N ATOM 815 CZ ARG A 52 16.112 -11.710 0.408 1.00 0.00 C ATOM 816 NH1 ARG A 52 16.453 -11.880 1.656 1.00 0.00 N ATOM 817 NH2 ARG A 52 16.761 -12.332 -0.537 1.00 0.00 N ATOM 0 H ARG A 52 11.506 -7.496 -0.566 1.00 0.00 H new ATOM 0 HA ARG A 52 11.481 -9.675 1.381 1.00 0.00 H new ATOM 0 HB2 ARG A 52 13.004 -7.036 1.207 1.00 0.00 H new ATOM 0 HB3 ARG A 52 13.334 -8.301 2.374 1.00 0.00 H new ATOM 0 HG2 ARG A 52 13.164 -9.378 -0.369 1.00 0.00 H new ATOM 0 HG3 ARG A 52 14.388 -8.131 -0.245 1.00 0.00 H new ATOM 0 HD2 ARG A 52 15.620 -9.309 1.409 1.00 0.00 H new ATOM 0 HD3 ARG A 52 14.232 -10.248 1.921 1.00 0.00 H new ATOM 0 HE ARG A 52 14.615 -11.040 -0.767 1.00 0.00 H new ATOM 0 HH11 ARG A 52 15.946 -11.392 2.394 1.00 0.00 H new ATOM 0 HH12 ARG A 52 17.227 -12.500 1.893 1.00 0.00 H new ATOM 0 HH21 ARG A 52 16.494 -12.198 -1.512 1.00 0.00 H new ATOM 0 HH22 ARG A 52 17.535 -12.953 -0.301 1.00 0.00 H new ATOM 831 N GLU A 53 10.187 -6.752 2.131 1.00 0.00 N ATOM 832 CA GLU A 53 9.292 -6.093 3.127 1.00 0.00 C ATOM 833 C GLU A 53 7.949 -6.813 3.076 1.00 0.00 C ATOM 834 O GLU A 53 7.103 -6.655 3.931 1.00 0.00 O ATOM 835 CB GLU A 53 9.079 -4.622 2.766 1.00 0.00 C ATOM 836 CG GLU A 53 10.427 -3.909 2.697 1.00 0.00 C ATOM 837 CD GLU A 53 10.592 -2.993 3.912 1.00 0.00 C ATOM 838 OE1 GLU A 53 9.712 -2.997 4.757 1.00 0.00 O ATOM 839 OE2 GLU A 53 11.595 -2.301 3.975 1.00 0.00 O ATOM 0 H GLU A 53 10.402 -6.194 1.305 1.00 0.00 H new ATOM 0 HA GLU A 53 9.738 -6.144 4.120 1.00 0.00 H new ATOM 0 HB2 GLU A 53 8.566 -4.543 1.808 1.00 0.00 H new ATOM 0 HB3 GLU A 53 8.441 -4.144 3.509 1.00 0.00 H new ATOM 0 HG2 GLU A 53 11.235 -4.641 2.669 1.00 0.00 H new ATOM 0 HG3 GLU A 53 10.494 -3.326 1.779 1.00 0.00 H new ATOM 846 N LEU A 54 7.767 -7.609 2.061 1.00 0.00 N ATOM 847 CA LEU A 54 6.510 -8.367 1.892 1.00 0.00 C ATOM 848 C LEU A 54 6.562 -9.597 2.798 1.00 0.00 C ATOM 849 O LEU A 54 5.787 -9.744 3.721 1.00 0.00 O ATOM 850 CB LEU A 54 6.424 -8.792 0.418 1.00 0.00 C ATOM 851 CG LEU A 54 5.405 -7.931 -0.347 1.00 0.00 C ATOM 852 CD1 LEU A 54 4.031 -8.051 0.292 1.00 0.00 C ATOM 853 CD2 LEU A 54 5.831 -6.465 -0.313 1.00 0.00 C ATOM 0 H LEU A 54 8.458 -7.766 1.327 1.00 0.00 H new ATOM 0 HA LEU A 54 5.638 -7.769 2.157 1.00 0.00 H new ATOM 0 HB2 LEU A 54 7.405 -8.700 -0.048 1.00 0.00 H new ATOM 0 HB3 LEU A 54 6.138 -9.842 0.355 1.00 0.00 H new ATOM 0 HG LEU A 54 5.364 -8.283 -1.378 1.00 0.00 H new ATOM 0 HD11 LEU A 54 3.319 -7.437 -0.259 1.00 0.00 H new ATOM 0 HD12 LEU A 54 3.708 -9.092 0.267 1.00 0.00 H new ATOM 0 HD13 LEU A 54 4.080 -7.711 1.326 1.00 0.00 H new ATOM 0 HD21 LEU A 54 5.104 -5.862 -0.857 1.00 0.00 H new ATOM 0 HD22 LEU A 54 5.883 -6.125 0.721 1.00 0.00 H new ATOM 0 HD23 LEU A 54 6.811 -6.360 -0.779 1.00 0.00 H new ATOM 865 N GLN A 55 7.484 -10.473 2.531 1.00 0.00 N ATOM 866 CA GLN A 55 7.623 -11.712 3.364 1.00 0.00 C ATOM 867 C GLN A 55 7.842 -11.339 4.833 1.00 0.00 C ATOM 868 O GLN A 55 7.150 -11.818 5.709 1.00 0.00 O ATOM 869 CB GLN A 55 8.812 -12.572 2.895 1.00 0.00 C ATOM 870 CG GLN A 55 9.625 -11.851 1.814 1.00 0.00 C ATOM 871 CD GLN A 55 10.978 -12.542 1.646 1.00 0.00 C ATOM 872 OE1 GLN A 55 12.009 -11.964 1.929 1.00 0.00 O ATOM 873 NE2 GLN A 55 11.020 -13.765 1.193 1.00 0.00 N ATOM 0 H GLN A 55 8.156 -10.391 1.768 1.00 0.00 H new ATOM 0 HA GLN A 55 6.702 -12.285 3.253 1.00 0.00 H new ATOM 0 HB2 GLN A 55 9.455 -12.802 3.744 1.00 0.00 H new ATOM 0 HB3 GLN A 55 8.446 -13.522 2.506 1.00 0.00 H new ATOM 0 HG2 GLN A 55 9.081 -11.859 0.869 1.00 0.00 H new ATOM 0 HG3 GLN A 55 9.770 -10.806 2.090 1.00 0.00 H new ATOM 0 HE21 GLN A 55 10.155 -14.251 0.955 1.00 0.00 H new ATOM 0 HE22 GLN A 55 11.918 -14.235 1.077 1.00 0.00 H new ATOM 882 N GLU A 56 8.804 -10.503 5.117 1.00 0.00 N ATOM 883 CA GLU A 56 9.057 -10.130 6.540 1.00 0.00 C ATOM 884 C GLU A 56 7.738 -9.772 7.226 1.00 0.00 C ATOM 885 O GLU A 56 7.625 -9.830 8.435 1.00 0.00 O ATOM 886 CB GLU A 56 10.018 -8.936 6.613 1.00 0.00 C ATOM 887 CG GLU A 56 9.516 -7.792 5.735 1.00 0.00 C ATOM 888 CD GLU A 56 8.615 -6.856 6.551 1.00 0.00 C ATOM 889 OE1 GLU A 56 8.149 -7.276 7.597 1.00 0.00 O ATOM 890 OE2 GLU A 56 8.413 -5.728 6.118 1.00 0.00 O ATOM 0 H GLU A 56 9.421 -10.065 4.433 1.00 0.00 H new ATOM 0 HA GLU A 56 9.510 -10.980 7.050 1.00 0.00 H new ATOM 0 HB2 GLU A 56 10.109 -8.597 7.645 1.00 0.00 H new ATOM 0 HB3 GLU A 56 11.013 -9.242 6.289 1.00 0.00 H new ATOM 0 HG2 GLU A 56 10.362 -7.235 5.332 1.00 0.00 H new ATOM 0 HG3 GLU A 56 8.963 -8.192 4.885 1.00 0.00 H new ATOM 897 N GLU A 57 6.737 -9.403 6.473 1.00 0.00 N ATOM 898 CA GLU A 57 5.438 -9.048 7.098 1.00 0.00 C ATOM 899 C GLU A 57 4.671 -10.328 7.432 1.00 0.00 C ATOM 900 O GLU A 57 4.887 -10.946 8.455 1.00 0.00 O ATOM 901 CB GLU A 57 4.624 -8.179 6.130 1.00 0.00 C ATOM 902 CG GLU A 57 4.821 -6.712 6.503 1.00 0.00 C ATOM 903 CD GLU A 57 5.063 -5.869 5.250 1.00 0.00 C ATOM 904 OE1 GLU A 57 4.601 -6.264 4.194 1.00 0.00 O ATOM 905 OE2 GLU A 57 5.715 -4.838 5.373 1.00 0.00 O ATOM 0 H GLU A 57 6.766 -9.333 5.456 1.00 0.00 H new ATOM 0 HA GLU A 57 5.611 -8.486 8.016 1.00 0.00 H new ATOM 0 HB2 GLU A 57 4.946 -8.354 5.103 1.00 0.00 H new ATOM 0 HB3 GLU A 57 3.568 -8.443 6.182 1.00 0.00 H new ATOM 0 HG2 GLU A 57 3.942 -6.344 7.032 1.00 0.00 H new ATOM 0 HG3 GLU A 57 5.667 -6.614 7.183 1.00 0.00 H new ATOM 912 N VAL A 58 3.777 -10.730 6.578 1.00 0.00 N ATOM 913 CA VAL A 58 2.994 -11.963 6.831 1.00 0.00 C ATOM 914 C VAL A 58 3.838 -13.184 6.459 1.00 0.00 C ATOM 915 O VAL A 58 4.425 -13.823 7.310 1.00 0.00 O ATOM 916 CB VAL A 58 1.734 -11.889 5.985 1.00 0.00 C ATOM 917 CG1 VAL A 58 0.874 -13.125 6.207 1.00 0.00 C ATOM 918 CG2 VAL A 58 0.960 -10.628 6.377 1.00 0.00 C ATOM 0 H VAL A 58 3.554 -10.250 5.706 1.00 0.00 H new ATOM 0 HA VAL A 58 2.722 -12.052 7.883 1.00 0.00 H new ATOM 0 HB VAL A 58 2.000 -11.848 4.929 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -0.025 -13.058 5.594 1.00 0.00 H new ATOM 0 HG12 VAL A 58 1.438 -14.015 5.928 1.00 0.00 H new ATOM 0 HG13 VAL A 58 0.593 -13.189 7.258 1.00 0.00 H new ATOM 0 HG21 VAL A 58 0.051 -10.558 5.779 1.00 0.00 H new ATOM 0 HG22 VAL A 58 0.696 -10.677 7.434 1.00 0.00 H new ATOM 0 HG23 VAL A 58 1.580 -9.750 6.198 1.00 0.00 H new ATOM 928 N GLY A 59 3.935 -13.507 5.194 1.00 0.00 N ATOM 929 CA GLY A 59 4.776 -14.672 4.803 1.00 0.00 C ATOM 930 C GLY A 59 4.052 -15.588 3.803 1.00 0.00 C ATOM 931 O GLY A 59 4.071 -16.794 3.946 1.00 0.00 O ATOM 0 H GLY A 59 3.474 -13.020 4.426 1.00 0.00 H new ATOM 0 HA2 GLY A 59 5.707 -14.316 4.362 1.00 0.00 H new ATOM 0 HA3 GLY A 59 5.042 -15.243 5.692 1.00 0.00 H new ATOM 935 N ILE A 60 3.439 -15.048 2.781 1.00 0.00 N ATOM 936 CA ILE A 60 2.760 -15.932 1.787 1.00 0.00 C ATOM 937 C ILE A 60 3.786 -16.341 0.720 1.00 0.00 C ATOM 938 O ILE A 60 4.847 -16.831 1.053 1.00 0.00 O ATOM 939 CB ILE A 60 1.565 -15.201 1.167 1.00 0.00 C ATOM 940 CG1 ILE A 60 2.005 -13.846 0.617 1.00 0.00 C ATOM 941 CG2 ILE A 60 0.516 -14.978 2.253 1.00 0.00 C ATOM 942 CD1 ILE A 60 1.614 -13.737 -0.857 1.00 0.00 C ATOM 0 H ILE A 60 3.379 -14.047 2.593 1.00 0.00 H new ATOM 0 HA ILE A 60 2.377 -16.830 2.272 1.00 0.00 H new ATOM 0 HB ILE A 60 1.155 -15.799 0.353 1.00 0.00 H new ATOM 0 HG12 ILE A 60 1.539 -13.042 1.187 1.00 0.00 H new ATOM 0 HG13 ILE A 60 3.083 -13.731 0.727 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -0.343 -14.458 1.828 1.00 0.00 H new ATOM 0 HG22 ILE A 60 0.196 -15.940 2.653 1.00 0.00 H new ATOM 0 HG23 ILE A 60 0.944 -14.376 3.055 1.00 0.00 H new ATOM 0 HD11 ILE A 60 1.929 -12.769 -1.246 1.00 0.00 H new ATOM 0 HD12 ILE A 60 2.101 -14.532 -1.422 1.00 0.00 H new ATOM 0 HD13 ILE A 60 0.533 -13.833 -0.955 1.00 0.00 H new ATOM 954 N THR A 61 3.514 -16.168 -0.550 1.00 0.00 N ATOM 955 CA THR A 61 4.541 -16.586 -1.552 1.00 0.00 C ATOM 956 C THR A 61 4.337 -15.893 -2.920 1.00 0.00 C ATOM 957 O THR A 61 5.162 -15.095 -3.319 1.00 0.00 O ATOM 958 CB THR A 61 4.496 -18.117 -1.697 1.00 0.00 C ATOM 959 OG1 THR A 61 5.289 -18.706 -0.675 1.00 0.00 O ATOM 960 CG2 THR A 61 5.040 -18.542 -3.065 1.00 0.00 C ATOM 0 H THR A 61 2.655 -15.769 -0.927 1.00 0.00 H new ATOM 0 HA THR A 61 5.523 -16.276 -1.195 1.00 0.00 H new ATOM 0 HB THR A 61 3.462 -18.450 -1.610 1.00 0.00 H new ATOM 0 HG1 THR A 61 5.536 -18.022 -0.018 1.00 0.00 H new ATOM 0 HG21 THR A 61 5.001 -19.628 -3.151 1.00 0.00 H new ATOM 0 HG22 THR A 61 4.434 -18.094 -3.853 1.00 0.00 H new ATOM 0 HG23 THR A 61 6.072 -18.207 -3.166 1.00 0.00 H new ATOM 968 N PRO A 62 3.277 -16.234 -3.614 1.00 0.00 N ATOM 969 CA PRO A 62 3.000 -15.668 -4.951 1.00 0.00 C ATOM 970 C PRO A 62 2.992 -14.144 -4.937 1.00 0.00 C ATOM 971 O PRO A 62 3.947 -13.497 -5.319 1.00 0.00 O ATOM 972 CB PRO A 62 1.620 -16.221 -5.331 1.00 0.00 C ATOM 973 CG PRO A 62 1.120 -17.089 -4.153 1.00 0.00 C ATOM 974 CD PRO A 62 2.263 -17.189 -3.132 1.00 0.00 C ATOM 0 HA PRO A 62 3.773 -15.944 -5.669 1.00 0.00 H new ATOM 0 HB2 PRO A 62 0.923 -15.407 -5.529 1.00 0.00 H new ATOM 0 HB3 PRO A 62 1.684 -16.814 -6.243 1.00 0.00 H new ATOM 0 HG2 PRO A 62 0.237 -16.643 -3.696 1.00 0.00 H new ATOM 0 HG3 PRO A 62 0.831 -18.080 -4.503 1.00 0.00 H new ATOM 0 HD2 PRO A 62 1.922 -16.933 -2.129 1.00 0.00 H new ATOM 0 HD3 PRO A 62 2.664 -18.202 -3.083 1.00 0.00 H new ATOM 982 N GLN A 63 1.908 -13.581 -4.525 1.00 0.00 N ATOM 983 CA GLN A 63 1.772 -12.104 -4.498 1.00 0.00 C ATOM 984 C GLN A 63 2.417 -11.506 -5.750 1.00 0.00 C ATOM 985 O GLN A 63 3.346 -10.728 -5.681 1.00 0.00 O ATOM 986 CB GLN A 63 2.417 -11.533 -3.233 1.00 0.00 C ATOM 987 CG GLN A 63 1.408 -10.608 -2.538 1.00 0.00 C ATOM 988 CD GLN A 63 1.872 -9.146 -2.597 1.00 0.00 C ATOM 989 OE1 GLN A 63 1.511 -8.354 -1.750 1.00 0.00 O ATOM 990 NE2 GLN A 63 2.661 -8.748 -3.556 1.00 0.00 N ATOM 0 H GLN A 63 1.087 -14.090 -4.197 1.00 0.00 H new ATOM 0 HA GLN A 63 0.714 -11.842 -4.487 1.00 0.00 H new ATOM 0 HB2 GLN A 63 2.713 -12.340 -2.563 1.00 0.00 H new ATOM 0 HB3 GLN A 63 3.322 -10.981 -3.487 1.00 0.00 H new ATOM 0 HG2 GLN A 63 0.433 -10.703 -3.015 1.00 0.00 H new ATOM 0 HG3 GLN A 63 1.285 -10.913 -1.499 1.00 0.00 H new ATOM 0 HE21 GLN A 63 2.968 -9.408 -4.271 1.00 0.00 H new ATOM 0 HE22 GLN A 63 2.971 -7.777 -3.591 1.00 0.00 H new ATOM 999 N HIS A 64 1.911 -11.855 -6.898 1.00 0.00 N ATOM 1000 CA HIS A 64 2.460 -11.292 -8.159 1.00 0.00 C ATOM 1001 C HIS A 64 2.444 -9.782 -8.009 1.00 0.00 C ATOM 1002 O HIS A 64 1.410 -9.159 -8.099 1.00 0.00 O ATOM 1003 CB HIS A 64 1.558 -11.699 -9.318 1.00 0.00 C ATOM 1004 CG HIS A 64 2.374 -12.298 -10.427 1.00 0.00 C ATOM 1005 ND1 HIS A 64 1.830 -13.182 -11.346 1.00 0.00 N ATOM 1006 CD2 HIS A 64 3.691 -12.148 -10.785 1.00 0.00 C ATOM 1007 CE1 HIS A 64 2.807 -13.527 -12.203 1.00 0.00 C ATOM 1008 NE2 HIS A 64 3.962 -12.925 -11.909 1.00 0.00 N ATOM 0 H HIS A 64 1.137 -12.509 -7.017 1.00 0.00 H new ATOM 0 HA HIS A 64 3.469 -11.655 -8.353 1.00 0.00 H new ATOM 0 HB2 HIS A 64 0.815 -12.419 -8.974 1.00 0.00 H new ATOM 0 HB3 HIS A 64 1.013 -10.830 -9.687 1.00 0.00 H new ATOM 0 HD2 HIS A 64 4.408 -11.523 -10.273 1.00 0.00 H new ATOM 0 HE1 HIS A 64 2.674 -14.209 -13.030 1.00 0.00 H new ATOM 0 HE2 HIS A 64 4.851 -13.015 -12.401 1.00 0.00 H new ATOM 1016 N PHE A 65 3.563 -9.191 -7.737 1.00 0.00 N ATOM 1017 CA PHE A 65 3.576 -7.717 -7.530 1.00 0.00 C ATOM 1018 C PHE A 65 3.949 -6.978 -8.814 1.00 0.00 C ATOM 1019 O PHE A 65 4.769 -7.414 -9.596 1.00 0.00 O ATOM 1020 CB PHE A 65 4.565 -7.356 -6.416 1.00 0.00 C ATOM 1021 CG PHE A 65 5.663 -8.391 -6.338 1.00 0.00 C ATOM 1022 CD1 PHE A 65 6.740 -8.333 -7.227 1.00 0.00 C ATOM 1023 CD2 PHE A 65 5.599 -9.411 -5.380 1.00 0.00 C ATOM 1024 CE1 PHE A 65 7.758 -9.291 -7.159 1.00 0.00 C ATOM 1025 CE2 PHE A 65 6.616 -10.370 -5.312 1.00 0.00 C ATOM 1026 CZ PHE A 65 7.696 -10.310 -6.201 1.00 0.00 C ATOM 0 H PHE A 65 4.467 -9.656 -7.648 1.00 0.00 H new ATOM 0 HA PHE A 65 2.571 -7.408 -7.242 1.00 0.00 H new ATOM 0 HB2 PHE A 65 4.995 -6.373 -6.606 1.00 0.00 H new ATOM 0 HB3 PHE A 65 4.043 -7.296 -5.461 1.00 0.00 H new ATOM 0 HD1 PHE A 65 6.787 -7.548 -7.967 1.00 0.00 H new ATOM 0 HD2 PHE A 65 4.766 -9.457 -4.695 1.00 0.00 H new ATOM 0 HE1 PHE A 65 8.591 -9.244 -7.845 1.00 0.00 H new ATOM 0 HE2 PHE A 65 6.568 -11.157 -4.574 1.00 0.00 H new ATOM 0 HZ PHE A 65 8.481 -11.050 -6.148 1.00 0.00 H new ATOM 1036 N SER A 66 3.342 -5.840 -9.008 1.00 0.00 N ATOM 1037 CA SER A 66 3.619 -5.002 -10.205 1.00 0.00 C ATOM 1038 C SER A 66 3.565 -3.542 -9.762 1.00 0.00 C ATOM 1039 O SER A 66 2.796 -3.189 -8.898 1.00 0.00 O ATOM 1040 CB SER A 66 2.556 -5.248 -11.273 1.00 0.00 C ATOM 1041 OG SER A 66 3.188 -5.512 -12.519 1.00 0.00 O ATOM 0 H SER A 66 2.649 -5.448 -8.370 1.00 0.00 H new ATOM 0 HA SER A 66 4.594 -5.248 -10.625 1.00 0.00 H new ATOM 0 HB2 SER A 66 1.926 -6.090 -10.987 1.00 0.00 H new ATOM 0 HB3 SER A 66 1.905 -4.378 -11.360 1.00 0.00 H new ATOM 0 HG SER A 66 2.506 -5.672 -13.204 1.00 0.00 H new ATOM 1047 N LEU A 67 4.379 -2.696 -10.323 1.00 0.00 N ATOM 1048 CA LEU A 67 4.371 -1.264 -9.889 1.00 0.00 C ATOM 1049 C LEU A 67 3.063 -0.580 -10.295 1.00 0.00 C ATOM 1050 O LEU A 67 2.301 -0.156 -9.462 1.00 0.00 O ATOM 1051 CB LEU A 67 5.561 -0.530 -10.525 1.00 0.00 C ATOM 1052 CG LEU A 67 5.746 0.874 -9.910 1.00 0.00 C ATOM 1053 CD1 LEU A 67 5.022 1.909 -10.770 1.00 0.00 C ATOM 1054 CD2 LEU A 67 5.188 0.927 -8.481 1.00 0.00 C ATOM 0 H LEU A 67 5.047 -2.926 -11.059 1.00 0.00 H new ATOM 0 HA LEU A 67 4.454 -1.228 -8.803 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.470 -1.115 -10.383 1.00 0.00 H new ATOM 0 HB3 LEU A 67 5.404 -0.441 -11.600 1.00 0.00 H new ATOM 0 HG LEU A 67 6.813 1.094 -9.876 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.153 2.900 -10.335 1.00 0.00 H new ATOM 0 HD12 LEU A 67 5.436 1.898 -11.778 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.960 1.669 -10.811 1.00 0.00 H new ATOM 0 HD21 LEU A 67 5.331 1.927 -8.071 1.00 0.00 H new ATOM 0 HD22 LEU A 67 4.124 0.690 -8.497 1.00 0.00 H new ATOM 0 HD23 LEU A 67 5.712 0.202 -7.859 1.00 0.00 H new ATOM 1066 N PHE A 68 2.814 -0.457 -11.564 1.00 0.00 N ATOM 1067 CA PHE A 68 1.572 0.208 -12.046 1.00 0.00 C ATOM 1068 C PHE A 68 1.799 1.727 -12.064 1.00 0.00 C ATOM 1069 O PHE A 68 1.622 2.370 -13.076 1.00 0.00 O ATOM 1070 CB PHE A 68 0.374 -0.188 -11.146 1.00 0.00 C ATOM 1071 CG PHE A 68 -0.272 1.033 -10.522 1.00 0.00 C ATOM 1072 CD1 PHE A 68 -1.096 1.860 -11.297 1.00 0.00 C ATOM 1073 CD2 PHE A 68 -0.045 1.338 -9.175 1.00 0.00 C ATOM 1074 CE1 PHE A 68 -1.691 2.990 -10.725 1.00 0.00 C ATOM 1075 CE2 PHE A 68 -0.642 2.468 -8.602 1.00 0.00 C ATOM 1076 CZ PHE A 68 -1.465 3.293 -9.378 1.00 0.00 C ATOM 0 H PHE A 68 3.429 -0.795 -12.304 1.00 0.00 H new ATOM 0 HA PHE A 68 1.335 -0.117 -13.059 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -0.364 -0.731 -11.737 1.00 0.00 H new ATOM 0 HB3 PHE A 68 0.714 -0.864 -10.361 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -1.272 1.625 -12.336 1.00 0.00 H new ATOM 0 HD2 PHE A 68 0.591 0.702 -8.577 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -2.325 3.628 -11.323 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.468 2.703 -7.562 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.926 4.164 -8.936 1.00 0.00 H new ATOM 1086 N GLU A 69 2.208 2.288 -10.953 1.00 0.00 N ATOM 1087 CA GLU A 69 2.469 3.762 -10.883 1.00 0.00 C ATOM 1088 C GLU A 69 2.560 4.187 -9.421 1.00 0.00 C ATOM 1089 O GLU A 69 1.696 3.888 -8.621 1.00 0.00 O ATOM 1090 CB GLU A 69 1.339 4.550 -11.555 1.00 0.00 C ATOM 1091 CG GLU A 69 1.671 6.042 -11.514 1.00 0.00 C ATOM 1092 CD GLU A 69 2.671 6.367 -12.626 1.00 0.00 C ATOM 1093 OE1 GLU A 69 3.861 6.267 -12.374 1.00 0.00 O ATOM 1094 OE2 GLU A 69 2.229 6.708 -13.711 1.00 0.00 O ATOM 0 H GLU A 69 2.374 1.784 -10.082 1.00 0.00 H new ATOM 0 HA GLU A 69 3.404 3.972 -11.403 1.00 0.00 H new ATOM 0 HB2 GLU A 69 1.214 4.221 -12.587 1.00 0.00 H new ATOM 0 HB3 GLU A 69 0.395 4.361 -11.044 1.00 0.00 H new ATOM 0 HG2 GLU A 69 0.763 6.632 -11.641 1.00 0.00 H new ATOM 0 HG3 GLU A 69 2.090 6.307 -10.543 1.00 0.00 H new ATOM 1101 N LYS A 70 3.602 4.883 -9.067 1.00 0.00 N ATOM 1102 CA LYS A 70 3.759 5.326 -7.657 1.00 0.00 C ATOM 1103 C LYS A 70 3.796 6.858 -7.593 1.00 0.00 C ATOM 1104 O LYS A 70 3.556 7.533 -8.574 1.00 0.00 O ATOM 1105 CB LYS A 70 5.063 4.746 -7.105 1.00 0.00 C ATOM 1106 CG LYS A 70 6.255 5.566 -7.610 1.00 0.00 C ATOM 1107 CD LYS A 70 7.559 4.868 -7.224 1.00 0.00 C ATOM 1108 CE LYS A 70 8.139 5.523 -5.969 1.00 0.00 C ATOM 1109 NZ LYS A 70 9.286 6.398 -6.348 1.00 0.00 N ATOM 0 H LYS A 70 4.354 5.165 -9.696 1.00 0.00 H new ATOM 0 HA LYS A 70 2.917 4.975 -7.060 1.00 0.00 H new ATOM 0 HB2 LYS A 70 5.041 4.753 -6.015 1.00 0.00 H new ATOM 0 HB3 LYS A 70 5.168 3.706 -7.415 1.00 0.00 H new ATOM 0 HG2 LYS A 70 6.198 5.680 -8.693 1.00 0.00 H new ATOM 0 HG3 LYS A 70 6.227 6.568 -7.182 1.00 0.00 H new ATOM 0 HD2 LYS A 70 7.377 3.809 -7.043 1.00 0.00 H new ATOM 0 HD3 LYS A 70 8.274 4.932 -8.044 1.00 0.00 H new ATOM 0 HE2 LYS A 70 7.371 6.110 -5.465 1.00 0.00 H new ATOM 0 HE3 LYS A 70 8.468 4.758 -5.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 10.129 6.120 -5.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 9.480 6.295 -7.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 9.050 7.389 -6.139 1.00 0.00 H new ATOM 1123 N LEU A 71 4.095 7.413 -6.448 1.00 0.00 N ATOM 1124 CA LEU A 71 4.144 8.901 -6.339 1.00 0.00 C ATOM 1125 C LEU A 71 5.293 9.329 -5.424 1.00 0.00 C ATOM 1126 O LEU A 71 6.101 8.529 -4.995 1.00 0.00 O ATOM 1127 CB LEU A 71 2.821 9.427 -5.763 1.00 0.00 C ATOM 1128 CG LEU A 71 2.384 8.586 -4.555 1.00 0.00 C ATOM 1129 CD1 LEU A 71 3.470 8.610 -3.474 1.00 0.00 C ATOM 1130 CD2 LEU A 71 1.091 9.170 -3.974 1.00 0.00 C ATOM 0 H LEU A 71 4.306 6.905 -5.589 1.00 0.00 H new ATOM 0 HA LEU A 71 4.302 9.315 -7.335 1.00 0.00 H new ATOM 0 HB2 LEU A 71 2.937 10.469 -5.464 1.00 0.00 H new ATOM 0 HB3 LEU A 71 2.048 9.400 -6.531 1.00 0.00 H new ATOM 0 HG LEU A 71 2.221 7.558 -4.879 1.00 0.00 H new ATOM 0 HD11 LEU A 71 3.149 8.010 -2.622 1.00 0.00 H new ATOM 0 HD12 LEU A 71 4.395 8.200 -3.879 1.00 0.00 H new ATOM 0 HD13 LEU A 71 3.639 9.637 -3.151 1.00 0.00 H new ATOM 0 HD21 LEU A 71 0.777 8.576 -3.116 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.266 10.199 -3.659 1.00 0.00 H new ATOM 0 HD23 LEU A 71 0.310 9.151 -4.734 1.00 0.00 H new ATOM 1142 N GLU A 72 5.352 10.594 -5.113 1.00 0.00 N ATOM 1143 CA GLU A 72 6.420 11.109 -4.212 1.00 0.00 C ATOM 1144 C GLU A 72 5.955 12.448 -3.639 1.00 0.00 C ATOM 1145 O GLU A 72 6.126 13.487 -4.245 1.00 0.00 O ATOM 1146 CB GLU A 72 7.720 11.302 -4.997 1.00 0.00 C ATOM 1147 CG GLU A 72 8.911 11.211 -4.038 1.00 0.00 C ATOM 1148 CD GLU A 72 10.160 11.774 -4.717 1.00 0.00 C ATOM 1149 OE1 GLU A 72 10.165 12.956 -5.019 1.00 0.00 O ATOM 1150 OE2 GLU A 72 11.092 11.014 -4.924 1.00 0.00 O ATOM 0 H GLU A 72 4.698 11.301 -5.449 1.00 0.00 H new ATOM 0 HA GLU A 72 6.606 10.398 -3.407 1.00 0.00 H new ATOM 0 HB2 GLU A 72 7.805 10.542 -5.774 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.715 12.270 -5.498 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.699 11.767 -3.125 1.00 0.00 H new ATOM 0 HG3 GLU A 72 9.079 10.174 -3.748 1.00 0.00 H new ATOM 1157 N TYR A 73 5.360 12.431 -2.480 1.00 0.00 N ATOM 1158 CA TYR A 73 4.871 13.695 -1.872 1.00 0.00 C ATOM 1159 C TYR A 73 5.985 14.298 -1.026 1.00 0.00 C ATOM 1160 O TYR A 73 6.829 13.595 -0.506 1.00 0.00 O ATOM 1161 CB TYR A 73 3.660 13.397 -0.987 1.00 0.00 C ATOM 1162 CG TYR A 73 2.545 14.362 -1.306 1.00 0.00 C ATOM 1163 CD1 TYR A 73 1.948 14.349 -2.572 1.00 0.00 C ATOM 1164 CD2 TYR A 73 2.106 15.267 -0.334 1.00 0.00 C ATOM 1165 CE1 TYR A 73 0.910 15.242 -2.866 1.00 0.00 C ATOM 1166 CE2 TYR A 73 1.069 16.159 -0.626 1.00 0.00 C ATOM 1167 CZ TYR A 73 0.471 16.148 -1.892 1.00 0.00 C ATOM 1168 OH TYR A 73 -0.552 17.028 -2.180 1.00 0.00 O ATOM 0 H TYR A 73 5.191 11.591 -1.926 1.00 0.00 H new ATOM 0 HA TYR A 73 4.581 14.396 -2.654 1.00 0.00 H new ATOM 0 HB2 TYR A 73 3.324 12.373 -1.147 1.00 0.00 H new ATOM 0 HB3 TYR A 73 3.937 13.481 0.064 1.00 0.00 H new ATOM 0 HD1 TYR A 73 2.288 13.650 -3.322 1.00 0.00 H new ATOM 0 HD2 TYR A 73 2.568 15.277 0.642 1.00 0.00 H new ATOM 0 HE1 TYR A 73 0.449 15.232 -3.842 1.00 0.00 H new ATOM 0 HE2 TYR A 73 0.729 16.857 0.125 1.00 0.00 H new ATOM 0 HH TYR A 73 -0.734 17.586 -1.395 1.00 0.00 H new ATOM 1178 N GLU A 74 6.006 15.591 -0.884 1.00 0.00 N ATOM 1179 CA GLU A 74 7.081 16.208 -0.070 1.00 0.00 C ATOM 1180 C GLU A 74 6.476 16.972 1.110 1.00 0.00 C ATOM 1181 O GLU A 74 5.493 17.676 0.975 1.00 0.00 O ATOM 1182 CB GLU A 74 7.895 17.170 -0.937 1.00 0.00 C ATOM 1183 CG GLU A 74 9.385 16.889 -0.748 1.00 0.00 C ATOM 1184 CD GLU A 74 10.147 17.307 -2.007 1.00 0.00 C ATOM 1185 OE1 GLU A 74 9.966 18.434 -2.438 1.00 0.00 O ATOM 1186 OE2 GLU A 74 10.898 16.494 -2.519 1.00 0.00 O ATOM 0 H GLU A 74 5.333 16.240 -1.292 1.00 0.00 H new ATOM 0 HA GLU A 74 7.731 15.421 0.311 1.00 0.00 H new ATOM 0 HB2 GLU A 74 7.622 17.051 -1.986 1.00 0.00 H new ATOM 0 HB3 GLU A 74 7.671 18.201 -0.664 1.00 0.00 H new ATOM 0 HG2 GLU A 74 9.762 17.435 0.116 1.00 0.00 H new ATOM 0 HG3 GLU A 74 9.544 15.829 -0.549 1.00 0.00 H new ATOM 1193 N PHE A 75 7.068 16.840 2.263 1.00 0.00 N ATOM 1194 CA PHE A 75 6.555 17.554 3.466 1.00 0.00 C ATOM 1195 C PHE A 75 7.511 18.710 3.791 1.00 0.00 C ATOM 1196 O PHE A 75 8.554 18.826 3.180 1.00 0.00 O ATOM 1197 CB PHE A 75 6.504 16.563 4.635 1.00 0.00 C ATOM 1198 CG PHE A 75 5.085 16.077 4.829 1.00 0.00 C ATOM 1199 CD1 PHE A 75 4.184 16.096 3.755 1.00 0.00 C ATOM 1200 CD2 PHE A 75 4.672 15.601 6.078 1.00 0.00 C ATOM 1201 CE1 PHE A 75 2.873 15.639 3.934 1.00 0.00 C ATOM 1202 CE2 PHE A 75 3.360 15.143 6.255 1.00 0.00 C ATOM 1203 CZ PHE A 75 2.461 15.163 5.183 1.00 0.00 C ATOM 0 H PHE A 75 7.893 16.263 2.426 1.00 0.00 H new ATOM 0 HA PHE A 75 5.556 17.952 3.288 1.00 0.00 H new ATOM 0 HB2 PHE A 75 7.164 15.718 4.438 1.00 0.00 H new ATOM 0 HB3 PHE A 75 6.863 17.042 5.546 1.00 0.00 H new ATOM 0 HD1 PHE A 75 4.501 16.463 2.790 1.00 0.00 H new ATOM 0 HD2 PHE A 75 5.365 15.587 6.906 1.00 0.00 H new ATOM 0 HE1 PHE A 75 2.179 15.654 3.107 1.00 0.00 H new ATOM 0 HE2 PHE A 75 3.042 14.774 7.219 1.00 0.00 H new ATOM 0 HZ PHE A 75 1.449 14.811 5.320 1.00 0.00 H new ATOM 1213 N PRO A 76 7.137 19.535 4.737 1.00 0.00 N ATOM 1214 CA PRO A 76 7.970 20.682 5.138 1.00 0.00 C ATOM 1215 C PRO A 76 9.429 20.245 5.312 1.00 0.00 C ATOM 1216 O PRO A 76 10.345 20.942 4.925 1.00 0.00 O ATOM 1217 CB PRO A 76 7.360 21.154 6.465 1.00 0.00 C ATOM 1218 CG PRO A 76 6.044 20.358 6.681 1.00 0.00 C ATOM 1219 CD PRO A 76 5.878 19.398 5.491 1.00 0.00 C ATOM 0 HA PRO A 76 7.982 21.479 4.394 1.00 0.00 H new ATOM 0 HB2 PRO A 76 8.053 20.981 7.289 1.00 0.00 H new ATOM 0 HB3 PRO A 76 7.160 22.225 6.436 1.00 0.00 H new ATOM 0 HG2 PRO A 76 6.082 19.803 7.618 1.00 0.00 H new ATOM 0 HG3 PRO A 76 5.193 21.036 6.747 1.00 0.00 H new ATOM 0 HD2 PRO A 76 5.724 18.372 5.826 1.00 0.00 H new ATOM 0 HD3 PRO A 76 5.017 19.667 4.880 1.00 0.00 H new ATOM 1227 N ASP A 77 9.648 19.091 5.874 1.00 0.00 N ATOM 1228 CA ASP A 77 11.043 18.598 6.053 1.00 0.00 C ATOM 1229 C ASP A 77 10.996 17.086 6.156 1.00 0.00 C ATOM 1230 O ASP A 77 11.684 16.472 6.948 1.00 0.00 O ATOM 1231 CB ASP A 77 11.650 19.194 7.324 1.00 0.00 C ATOM 1232 CG ASP A 77 12.407 20.475 6.972 1.00 0.00 C ATOM 1233 OD1 ASP A 77 13.158 20.451 6.011 1.00 0.00 O ATOM 1234 OD2 ASP A 77 12.221 21.460 7.667 1.00 0.00 O ATOM 0 H ASP A 77 8.920 18.465 6.219 1.00 0.00 H new ATOM 0 HA ASP A 77 11.662 18.898 5.208 1.00 0.00 H new ATOM 0 HB2 ASP A 77 10.865 19.410 8.049 1.00 0.00 H new ATOM 0 HB3 ASP A 77 12.325 18.476 7.789 1.00 0.00 H new ATOM 1239 N ARG A 78 10.168 16.486 5.356 1.00 0.00 N ATOM 1240 CA ARG A 78 10.036 15.017 5.384 1.00 0.00 C ATOM 1241 C ARG A 78 9.719 14.520 3.975 1.00 0.00 C ATOM 1242 O ARG A 78 8.603 14.606 3.509 1.00 0.00 O ATOM 1243 CB ARG A 78 8.897 14.651 6.337 1.00 0.00 C ATOM 1244 CG ARG A 78 9.273 13.431 7.183 1.00 0.00 C ATOM 1245 CD ARG A 78 10.575 13.684 7.955 1.00 0.00 C ATOM 1246 NE ARG A 78 10.261 14.041 9.369 1.00 0.00 N ATOM 1247 CZ ARG A 78 9.212 14.768 9.646 1.00 0.00 C ATOM 1248 NH1 ARG A 78 9.080 15.950 9.111 1.00 0.00 N ATOM 1249 NH2 ARG A 78 8.294 14.311 10.454 1.00 0.00 N ATOM 0 H ARG A 78 9.572 16.960 4.677 1.00 0.00 H new ATOM 0 HA ARG A 78 10.962 14.554 5.726 1.00 0.00 H new ATOM 0 HB2 ARG A 78 8.674 15.497 6.988 1.00 0.00 H new ATOM 0 HB3 ARG A 78 7.992 14.440 5.767 1.00 0.00 H new ATOM 0 HG2 ARG A 78 8.468 13.206 7.883 1.00 0.00 H new ATOM 0 HG3 ARG A 78 9.390 12.559 6.540 1.00 0.00 H new ATOM 0 HD2 ARG A 78 11.205 12.795 7.926 1.00 0.00 H new ATOM 0 HD3 ARG A 78 11.138 14.489 7.483 1.00 0.00 H new ATOM 0 HE ARG A 78 10.868 13.716 10.122 1.00 0.00 H new ATOM 0 HH11 ARG A 78 9.796 16.306 8.477 1.00 0.00 H new ATOM 0 HH12 ARG A 78 8.261 16.519 9.326 1.00 0.00 H new ATOM 0 HH21 ARG A 78 8.396 13.385 10.870 1.00 0.00 H new ATOM 0 HH22 ARG A 78 7.475 14.880 10.670 1.00 0.00 H new ATOM 1263 N HIS A 79 10.695 14.001 3.291 1.00 0.00 N ATOM 1264 CA HIS A 79 10.445 13.491 1.913 1.00 0.00 C ATOM 1265 C HIS A 79 9.760 12.127 2.025 1.00 0.00 C ATOM 1266 O HIS A 79 10.130 11.313 2.845 1.00 0.00 O ATOM 1267 CB HIS A 79 11.778 13.323 1.180 1.00 0.00 C ATOM 1268 CG HIS A 79 12.150 14.606 0.489 1.00 0.00 C ATOM 1269 ND1 HIS A 79 12.917 14.624 -0.666 1.00 0.00 N ATOM 1270 CD2 HIS A 79 11.880 15.921 0.779 1.00 0.00 C ATOM 1271 CE1 HIS A 79 13.081 15.911 -1.024 1.00 0.00 C ATOM 1272 NE2 HIS A 79 12.467 16.743 -0.177 1.00 0.00 N ATOM 0 H HIS A 79 11.655 13.907 3.623 1.00 0.00 H new ATOM 0 HA HIS A 79 9.817 14.191 1.362 1.00 0.00 H new ATOM 0 HB2 HIS A 79 12.558 13.042 1.887 1.00 0.00 H new ATOM 0 HB3 HIS A 79 11.702 12.516 0.451 1.00 0.00 H new ATOM 0 HD2 HIS A 79 11.299 16.265 1.622 1.00 0.00 H new ATOM 0 HE1 HIS A 79 13.641 16.232 -1.890 1.00 0.00 H new ATOM 0 HE2 HIS A 79 12.436 17.762 -0.222 1.00 0.00 H new ATOM 1280 N ILE A 80 8.759 11.864 1.226 1.00 0.00 N ATOM 1281 CA ILE A 80 8.074 10.544 1.330 1.00 0.00 C ATOM 1282 C ILE A 80 7.890 9.921 -0.055 1.00 0.00 C ATOM 1283 O ILE A 80 7.786 10.599 -1.058 1.00 0.00 O ATOM 1284 CB ILE A 80 6.688 10.710 1.971 1.00 0.00 C ATOM 1285 CG1 ILE A 80 6.831 10.983 3.470 1.00 0.00 C ATOM 1286 CG2 ILE A 80 5.884 9.421 1.779 1.00 0.00 C ATOM 1287 CD1 ILE A 80 7.494 12.340 3.691 1.00 0.00 C ATOM 0 H ILE A 80 8.391 12.497 0.516 1.00 0.00 H new ATOM 0 HA ILE A 80 8.697 9.896 1.947 1.00 0.00 H new ATOM 0 HB ILE A 80 6.177 11.548 1.497 1.00 0.00 H new ATOM 0 HG12 ILE A 80 5.851 10.966 3.947 1.00 0.00 H new ATOM 0 HG13 ILE A 80 7.426 10.198 3.936 1.00 0.00 H new ATOM 0 HG21 ILE A 80 4.900 9.535 2.233 1.00 0.00 H new ATOM 0 HG22 ILE A 80 5.771 9.218 0.714 1.00 0.00 H new ATOM 0 HG23 ILE A 80 6.408 8.591 2.253 1.00 0.00 H new ATOM 0 HD11 ILE A 80 7.592 12.527 4.760 1.00 0.00 H new ATOM 0 HD12 ILE A 80 8.482 12.342 3.230 1.00 0.00 H new ATOM 0 HD13 ILE A 80 6.882 13.122 3.241 1.00 0.00 H new ATOM 1299 N THR A 81 7.813 8.622 -0.089 1.00 0.00 N ATOM 1300 CA THR A 81 7.593 7.899 -1.367 1.00 0.00 C ATOM 1301 C THR A 81 6.655 6.729 -1.077 1.00 0.00 C ATOM 1302 O THR A 81 6.636 6.204 0.019 1.00 0.00 O ATOM 1303 CB THR A 81 8.919 7.361 -1.897 1.00 0.00 C ATOM 1304 OG1 THR A 81 9.956 8.287 -1.601 1.00 0.00 O ATOM 1305 CG2 THR A 81 8.826 7.162 -3.412 1.00 0.00 C ATOM 0 H THR A 81 7.895 8.021 0.731 1.00 0.00 H new ATOM 0 HA THR A 81 7.166 8.569 -2.113 1.00 0.00 H new ATOM 0 HB THR A 81 9.138 6.405 -1.422 1.00 0.00 H new ATOM 0 HG1 THR A 81 10.721 8.121 -2.191 1.00 0.00 H new ATOM 0 HG21 THR A 81 9.774 6.778 -3.787 1.00 0.00 H new ATOM 0 HG22 THR A 81 8.032 6.451 -3.637 1.00 0.00 H new ATOM 0 HG23 THR A 81 8.606 8.116 -3.891 1.00 0.00 H new ATOM 1313 N LEU A 82 5.869 6.317 -2.026 1.00 0.00 N ATOM 1314 CA LEU A 82 4.941 5.187 -1.757 1.00 0.00 C ATOM 1315 C LEU A 82 4.903 4.246 -2.958 1.00 0.00 C ATOM 1316 O LEU A 82 3.975 4.263 -3.741 1.00 0.00 O ATOM 1317 CB LEU A 82 3.541 5.742 -1.490 1.00 0.00 C ATOM 1318 CG LEU A 82 2.804 4.817 -0.522 1.00 0.00 C ATOM 1319 CD1 LEU A 82 2.499 5.571 0.773 1.00 0.00 C ATOM 1320 CD2 LEU A 82 1.494 4.354 -1.162 1.00 0.00 C ATOM 0 H LEU A 82 5.827 6.708 -2.967 1.00 0.00 H new ATOM 0 HA LEU A 82 5.288 4.631 -0.886 1.00 0.00 H new ATOM 0 HB2 LEU A 82 3.610 6.746 -1.070 1.00 0.00 H new ATOM 0 HB3 LEU A 82 2.986 5.825 -2.425 1.00 0.00 H new ATOM 0 HG LEU A 82 3.428 3.952 -0.299 1.00 0.00 H new ATOM 0 HD11 LEU A 82 1.973 4.911 1.463 1.00 0.00 H new ATOM 0 HD12 LEU A 82 3.432 5.904 1.229 1.00 0.00 H new ATOM 0 HD13 LEU A 82 1.874 6.436 0.552 1.00 0.00 H new ATOM 0 HD21 LEU A 82 0.966 3.694 -0.474 1.00 0.00 H new ATOM 0 HD22 LEU A 82 0.871 5.221 -1.383 1.00 0.00 H new ATOM 0 HD23 LEU A 82 1.710 3.817 -2.086 1.00 0.00 H new ATOM 1332 N TRP A 83 5.903 3.420 -3.112 1.00 0.00 N ATOM 1333 CA TRP A 83 5.907 2.478 -4.267 1.00 0.00 C ATOM 1334 C TRP A 83 4.566 1.737 -4.311 1.00 0.00 C ATOM 1335 O TRP A 83 4.242 0.968 -3.428 1.00 0.00 O ATOM 1336 CB TRP A 83 7.048 1.473 -4.107 1.00 0.00 C ATOM 1337 CG TRP A 83 8.356 2.179 -4.260 1.00 0.00 C ATOM 1338 CD1 TRP A 83 9.056 2.743 -3.248 1.00 0.00 C ATOM 1339 CD2 TRP A 83 9.132 2.407 -5.471 1.00 0.00 C ATOM 1340 NE1 TRP A 83 10.210 3.305 -3.762 1.00 0.00 N ATOM 1341 CE2 TRP A 83 10.303 3.125 -5.128 1.00 0.00 C ATOM 1342 CE3 TRP A 83 8.936 2.068 -6.823 1.00 0.00 C ATOM 1343 CZ2 TRP A 83 11.246 3.491 -6.089 1.00 0.00 C ATOM 1344 CZ3 TRP A 83 9.884 2.435 -7.794 1.00 0.00 C ATOM 1345 CH2 TRP A 83 11.036 3.146 -7.427 1.00 0.00 C ATOM 0 H TRP A 83 6.711 3.357 -2.493 1.00 0.00 H new ATOM 0 HA TRP A 83 6.050 3.033 -5.194 1.00 0.00 H new ATOM 0 HB2 TRP A 83 6.992 0.995 -3.129 1.00 0.00 H new ATOM 0 HB3 TRP A 83 6.959 0.683 -4.853 1.00 0.00 H new ATOM 0 HD1 TRP A 83 8.761 2.752 -2.209 1.00 0.00 H new ATOM 0 HE1 TRP A 83 10.908 3.793 -3.201 1.00 0.00 H new ATOM 0 HE3 TRP A 83 8.051 1.522 -7.116 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 12.132 4.037 -5.801 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 9.724 2.168 -8.828 1.00 0.00 H new ATOM 0 HH2 TRP A 83 11.760 3.427 -8.178 1.00 0.00 H new ATOM 1356 N PHE A 84 3.779 1.973 -5.327 1.00 0.00 N ATOM 1357 CA PHE A 84 2.452 1.296 -5.424 1.00 0.00 C ATOM 1358 C PHE A 84 2.584 -0.014 -6.193 1.00 0.00 C ATOM 1359 O PHE A 84 2.102 -0.134 -7.291 1.00 0.00 O ATOM 1360 CB PHE A 84 1.475 2.195 -6.179 1.00 0.00 C ATOM 1361 CG PHE A 84 0.761 3.099 -5.203 1.00 0.00 C ATOM 1362 CD1 PHE A 84 1.347 4.305 -4.802 1.00 0.00 C ATOM 1363 CD2 PHE A 84 -0.491 2.727 -4.701 1.00 0.00 C ATOM 1364 CE1 PHE A 84 0.679 5.140 -3.897 1.00 0.00 C ATOM 1365 CE2 PHE A 84 -1.159 3.561 -3.798 1.00 0.00 C ATOM 1366 CZ PHE A 84 -0.575 4.766 -3.395 1.00 0.00 C ATOM 0 H PHE A 84 3.998 2.607 -6.096 1.00 0.00 H new ATOM 0 HA PHE A 84 2.089 1.098 -4.415 1.00 0.00 H new ATOM 0 HB2 PHE A 84 2.010 2.791 -6.918 1.00 0.00 H new ATOM 0 HB3 PHE A 84 0.752 1.587 -6.723 1.00 0.00 H new ATOM 0 HD1 PHE A 84 2.313 4.592 -5.190 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -0.942 1.796 -5.011 1.00 0.00 H new ATOM 0 HE1 PHE A 84 1.130 6.071 -3.586 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -2.126 3.274 -3.412 1.00 0.00 H new ATOM 0 HZ PHE A 84 -1.090 5.409 -2.697 1.00 0.00 H new ATOM 1376 N TRP A 85 3.207 -1.004 -5.631 1.00 0.00 N ATOM 1377 CA TRP A 85 3.336 -2.297 -6.361 1.00 0.00 C ATOM 1378 C TRP A 85 2.007 -3.069 -6.290 1.00 0.00 C ATOM 1379 O TRP A 85 1.797 -3.875 -5.407 1.00 0.00 O ATOM 1380 CB TRP A 85 4.451 -3.131 -5.724 1.00 0.00 C ATOM 1381 CG TRP A 85 5.777 -2.670 -6.246 1.00 0.00 C ATOM 1382 CD1 TRP A 85 6.543 -1.710 -5.678 1.00 0.00 C ATOM 1383 CD2 TRP A 85 6.503 -3.129 -7.424 1.00 0.00 C ATOM 1384 NE1 TRP A 85 7.690 -1.548 -6.435 1.00 0.00 N ATOM 1385 CE2 TRP A 85 7.713 -2.401 -7.520 1.00 0.00 C ATOM 1386 CE3 TRP A 85 6.232 -4.096 -8.409 1.00 0.00 C ATOM 1387 CZ2 TRP A 85 8.620 -2.623 -8.556 1.00 0.00 C ATOM 1388 CZ3 TRP A 85 7.144 -4.323 -9.453 1.00 0.00 C ATOM 1389 CH2 TRP A 85 8.336 -3.586 -9.527 1.00 0.00 C ATOM 0 H TRP A 85 3.632 -0.979 -4.704 1.00 0.00 H new ATOM 0 HA TRP A 85 3.580 -2.101 -7.405 1.00 0.00 H new ATOM 0 HB2 TRP A 85 4.420 -3.031 -4.639 1.00 0.00 H new ATOM 0 HB3 TRP A 85 4.305 -4.187 -5.951 1.00 0.00 H new ATOM 0 HD1 TRP A 85 6.299 -1.160 -4.781 1.00 0.00 H new ATOM 0 HE1 TRP A 85 8.429 -0.879 -6.218 1.00 0.00 H new ATOM 0 HE3 TRP A 85 5.317 -4.668 -8.362 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 9.536 -2.054 -8.607 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 6.927 -5.069 -10.203 1.00 0.00 H new ATOM 0 HH2 TRP A 85 9.032 -3.763 -10.333 1.00 0.00 H new ATOM 1400 N LEU A 86 1.099 -2.833 -7.206 1.00 0.00 N ATOM 1401 CA LEU A 86 -0.203 -3.568 -7.154 1.00 0.00 C ATOM 1402 C LEU A 86 0.021 -5.049 -7.458 1.00 0.00 C ATOM 1403 O LEU A 86 0.642 -5.405 -8.438 1.00 0.00 O ATOM 1404 CB LEU A 86 -1.170 -2.988 -8.188 1.00 0.00 C ATOM 1405 CG LEU A 86 -1.995 -1.870 -7.552 1.00 0.00 C ATOM 1406 CD1 LEU A 86 -2.641 -2.371 -6.255 1.00 0.00 C ATOM 1407 CD2 LEU A 86 -1.075 -0.683 -7.260 1.00 0.00 C ATOM 0 H LEU A 86 1.200 -2.173 -7.977 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.626 -3.460 -6.155 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -0.615 -2.602 -9.043 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -1.829 -3.771 -8.563 1.00 0.00 H new ATOM 0 HG LEU A 86 -2.786 -1.559 -8.234 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.227 -1.569 -5.807 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -3.292 -3.217 -6.476 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -1.863 -2.684 -5.558 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -1.653 0.122 -6.806 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -0.286 -0.994 -6.576 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.630 -0.330 -8.190 1.00 0.00 H new ATOM 1419 N VAL A 87 -0.489 -5.917 -6.626 1.00 0.00 N ATOM 1420 CA VAL A 87 -0.306 -7.380 -6.872 1.00 0.00 C ATOM 1421 C VAL A 87 -1.684 -8.016 -7.113 1.00 0.00 C ATOM 1422 O VAL A 87 -2.690 -7.493 -6.675 1.00 0.00 O ATOM 1423 CB VAL A 87 0.416 -8.041 -5.668 1.00 0.00 C ATOM 1424 CG1 VAL A 87 1.130 -6.978 -4.815 1.00 0.00 C ATOM 1425 CG2 VAL A 87 -0.583 -8.801 -4.783 1.00 0.00 C ATOM 0 H VAL A 87 -1.022 -5.680 -5.790 1.00 0.00 H new ATOM 0 HA VAL A 87 0.317 -7.536 -7.753 1.00 0.00 H new ATOM 0 HB VAL A 87 1.150 -8.741 -6.067 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.630 -7.461 -3.976 1.00 0.00 H new ATOM 0 HG12 VAL A 87 1.867 -6.456 -5.426 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.399 -6.262 -4.439 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.054 -9.256 -3.945 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.334 -8.108 -4.404 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.071 -9.579 -5.370 1.00 0.00 H new ATOM 1435 N GLU A 88 -1.755 -9.122 -7.820 1.00 0.00 N ATOM 1436 CA GLU A 88 -3.103 -9.723 -8.083 1.00 0.00 C ATOM 1437 C GLU A 88 -3.096 -11.263 -8.061 1.00 0.00 C ATOM 1438 O GLU A 88 -3.831 -11.881 -8.805 1.00 0.00 O ATOM 1439 CB GLU A 88 -3.595 -9.270 -9.464 1.00 0.00 C ATOM 1440 CG GLU A 88 -3.712 -7.743 -9.518 1.00 0.00 C ATOM 1441 CD GLU A 88 -2.912 -7.213 -10.709 1.00 0.00 C ATOM 1442 OE1 GLU A 88 -1.733 -6.952 -10.537 1.00 0.00 O ATOM 1443 OE2 GLU A 88 -3.492 -7.078 -11.774 1.00 0.00 O ATOM 0 H GLU A 88 -0.960 -9.623 -8.217 1.00 0.00 H new ATOM 0 HA GLU A 88 -3.760 -9.381 -7.283 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -2.905 -9.615 -10.234 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -4.563 -9.723 -9.678 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -4.758 -7.451 -9.610 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -3.339 -7.306 -8.592 1.00 0.00 H new ATOM 1450 N ARG A 89 -2.319 -11.910 -7.229 1.00 0.00 N ATOM 1451 CA ARG A 89 -2.378 -13.407 -7.238 1.00 0.00 C ATOM 1452 C ARG A 89 -1.793 -14.009 -5.945 1.00 0.00 C ATOM 1453 O ARG A 89 -1.124 -15.023 -5.964 1.00 0.00 O ATOM 1454 CB ARG A 89 -1.667 -13.939 -8.503 1.00 0.00 C ATOM 1455 CG ARG A 89 -0.228 -14.390 -8.214 1.00 0.00 C ATOM 1456 CD ARG A 89 -0.171 -15.915 -8.150 1.00 0.00 C ATOM 1457 NE ARG A 89 0.620 -16.419 -9.308 1.00 0.00 N ATOM 1458 CZ ARG A 89 1.051 -17.649 -9.325 1.00 0.00 C ATOM 1459 NH1 ARG A 89 2.095 -17.984 -8.617 1.00 0.00 N ATOM 1460 NH2 ARG A 89 0.442 -18.544 -10.053 1.00 0.00 N ATOM 0 H ARG A 89 -1.668 -11.488 -6.566 1.00 0.00 H new ATOM 0 HA ARG A 89 -3.421 -13.721 -7.269 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -2.233 -14.776 -8.911 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -1.656 -13.160 -9.266 1.00 0.00 H new ATOM 0 HG2 ARG A 89 0.442 -14.024 -8.992 1.00 0.00 H new ATOM 0 HG3 ARG A 89 0.115 -13.963 -7.271 1.00 0.00 H new ATOM 0 HD2 ARG A 89 0.286 -16.236 -7.214 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -1.178 -16.331 -8.172 1.00 0.00 H new ATOM 0 HE ARG A 89 0.825 -15.798 -10.091 1.00 0.00 H new ATOM 0 HH11 ARG A 89 2.573 -17.283 -8.051 1.00 0.00 H new ATOM 0 HH12 ARG A 89 2.433 -18.946 -8.630 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -0.372 -18.281 -10.609 1.00 0.00 H new ATOM 0 HH22 ARG A 89 0.780 -19.506 -10.066 1.00 0.00 H new ATOM 1474 N TRP A 90 -2.062 -13.424 -4.807 1.00 0.00 N ATOM 1475 CA TRP A 90 -1.521 -14.014 -3.546 1.00 0.00 C ATOM 1476 C TRP A 90 -2.191 -15.367 -3.290 1.00 0.00 C ATOM 1477 O TRP A 90 -3.258 -15.647 -3.798 1.00 0.00 O ATOM 1478 CB TRP A 90 -1.741 -13.061 -2.362 1.00 0.00 C ATOM 1479 CG TRP A 90 -3.125 -13.198 -1.816 1.00 0.00 C ATOM 1480 CD1 TRP A 90 -3.575 -14.253 -1.103 1.00 0.00 C ATOM 1481 CD2 TRP A 90 -4.235 -12.260 -1.908 1.00 0.00 C ATOM 1482 NE1 TRP A 90 -4.895 -14.028 -0.756 1.00 0.00 N ATOM 1483 CE2 TRP A 90 -5.346 -12.812 -1.229 1.00 0.00 C ATOM 1484 CE3 TRP A 90 -4.385 -10.998 -2.511 1.00 0.00 C ATOM 1485 CZ2 TRP A 90 -6.564 -12.135 -1.150 1.00 0.00 C ATOM 1486 CZ3 TRP A 90 -5.608 -10.314 -2.433 1.00 0.00 C ATOM 1487 CH2 TRP A 90 -6.696 -10.881 -1.753 1.00 0.00 C ATOM 0 H TRP A 90 -2.622 -12.579 -4.696 1.00 0.00 H new ATOM 0 HA TRP A 90 -0.447 -14.164 -3.653 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -1.014 -13.275 -1.578 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -1.572 -12.033 -2.682 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -2.998 -15.129 -0.846 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -5.465 -14.680 -0.217 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -3.554 -10.553 -3.037 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -7.399 -12.577 -0.626 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -5.712 -9.345 -2.899 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -7.634 -10.349 -1.695 1.00 0.00 H new ATOM 1498 N GLU A 91 -1.556 -16.222 -2.532 1.00 0.00 N ATOM 1499 CA GLU A 91 -2.141 -17.571 -2.276 1.00 0.00 C ATOM 1500 C GLU A 91 -3.263 -17.480 -1.225 1.00 0.00 C ATOM 1501 O GLU A 91 -4.207 -16.732 -1.385 1.00 0.00 O ATOM 1502 CB GLU A 91 -1.032 -18.513 -1.791 1.00 0.00 C ATOM 1503 CG GLU A 91 -0.355 -17.923 -0.551 1.00 0.00 C ATOM 1504 CD GLU A 91 0.507 -18.996 0.115 1.00 0.00 C ATOM 1505 OE1 GLU A 91 1.189 -19.709 -0.603 1.00 0.00 O ATOM 1506 OE2 GLU A 91 0.471 -19.087 1.331 1.00 0.00 O ATOM 0 H GLU A 91 -0.659 -16.045 -2.080 1.00 0.00 H new ATOM 0 HA GLU A 91 -2.572 -17.960 -3.199 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -1.450 -19.492 -1.557 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -0.297 -18.661 -2.582 1.00 0.00 H new ATOM 0 HG2 GLU A 91 0.261 -17.068 -0.831 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -1.107 -17.559 0.149 1.00 0.00 H new ATOM 1513 N GLY A 92 -3.192 -18.249 -0.167 1.00 0.00 N ATOM 1514 CA GLY A 92 -4.274 -18.211 0.862 1.00 0.00 C ATOM 1515 C GLY A 92 -4.520 -16.775 1.338 1.00 0.00 C ATOM 1516 O GLY A 92 -5.631 -16.284 1.302 1.00 0.00 O ATOM 0 H GLY A 92 -2.432 -18.901 0.028 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -5.193 -18.624 0.446 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -3.998 -18.838 1.710 1.00 0.00 H new ATOM 1520 N GLU A 93 -3.501 -16.106 1.803 1.00 0.00 N ATOM 1521 CA GLU A 93 -3.688 -14.712 2.303 1.00 0.00 C ATOM 1522 C GLU A 93 -2.596 -13.806 1.720 1.00 0.00 C ATOM 1523 O GLU A 93 -1.632 -14.290 1.172 1.00 0.00 O ATOM 1524 CB GLU A 93 -3.588 -14.723 3.831 1.00 0.00 C ATOM 1525 CG GLU A 93 -2.211 -15.244 4.249 1.00 0.00 C ATOM 1526 CD GLU A 93 -2.293 -15.822 5.662 1.00 0.00 C ATOM 1527 OE1 GLU A 93 -2.905 -16.866 5.820 1.00 0.00 O ATOM 1528 OE2 GLU A 93 -1.742 -15.211 6.563 1.00 0.00 O ATOM 0 H GLU A 93 -2.547 -16.463 1.859 1.00 0.00 H new ATOM 0 HA GLU A 93 -4.663 -14.333 1.997 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -3.743 -13.718 4.223 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -4.371 -15.354 4.253 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -1.872 -16.009 3.551 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -1.479 -14.437 4.217 1.00 0.00 H new ATOM 1535 N PRO A 94 -2.784 -12.515 1.854 1.00 0.00 N ATOM 1536 CA PRO A 94 -1.815 -11.519 1.354 1.00 0.00 C ATOM 1537 C PRO A 94 -0.614 -11.428 2.304 1.00 0.00 C ATOM 1538 O PRO A 94 -0.452 -12.239 3.195 1.00 0.00 O ATOM 1539 CB PRO A 94 -2.587 -10.196 1.376 1.00 0.00 C ATOM 1540 CG PRO A 94 -3.891 -10.434 2.179 1.00 0.00 C ATOM 1541 CD PRO A 94 -3.982 -11.938 2.485 1.00 0.00 C ATOM 0 HA PRO A 94 -1.432 -11.772 0.365 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -1.989 -9.410 1.838 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -2.815 -9.868 0.362 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -3.883 -9.855 3.103 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -4.759 -10.107 1.606 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -3.994 -12.125 3.559 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -4.894 -12.372 2.076 1.00 0.00 H new ATOM 1549 N TRP A 95 0.215 -10.432 2.136 1.00 0.00 N ATOM 1550 CA TRP A 95 1.387 -10.276 3.043 1.00 0.00 C ATOM 1551 C TRP A 95 2.071 -8.931 2.791 1.00 0.00 C ATOM 1552 O TRP A 95 3.260 -8.790 2.988 1.00 0.00 O ATOM 1553 CB TRP A 95 2.390 -11.417 2.810 1.00 0.00 C ATOM 1554 CG TRP A 95 3.091 -11.262 1.500 1.00 0.00 C ATOM 1555 CD1 TRP A 95 2.685 -10.479 0.479 1.00 0.00 C ATOM 1556 CD2 TRP A 95 4.323 -11.905 1.056 1.00 0.00 C ATOM 1557 NE1 TRP A 95 3.595 -10.596 -0.559 1.00 0.00 N ATOM 1558 CE2 TRP A 95 4.617 -11.465 -0.252 1.00 0.00 C ATOM 1559 CE3 TRP A 95 5.205 -12.819 1.657 1.00 0.00 C ATOM 1560 CZ2 TRP A 95 5.744 -11.913 -0.942 1.00 0.00 C ATOM 1561 CZ3 TRP A 95 6.340 -13.275 0.966 1.00 0.00 C ATOM 1562 CH2 TRP A 95 6.609 -12.822 -0.332 1.00 0.00 C ATOM 0 H TRP A 95 0.130 -9.721 1.410 1.00 0.00 H new ATOM 0 HA TRP A 95 1.038 -10.312 4.075 1.00 0.00 H new ATOM 0 HB2 TRP A 95 3.122 -11.432 3.617 1.00 0.00 H new ATOM 0 HB3 TRP A 95 1.868 -12.374 2.835 1.00 0.00 H new ATOM 0 HD1 TRP A 95 1.798 -9.863 0.472 1.00 0.00 H new ATOM 0 HE1 TRP A 95 3.517 -10.097 -1.445 1.00 0.00 H new ATOM 0 HE3 TRP A 95 5.009 -13.174 2.658 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 5.945 -11.558 -1.942 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 7.009 -13.979 1.438 1.00 0.00 H new ATOM 0 HH2 TRP A 95 7.483 -13.175 -0.859 1.00 0.00 H new ATOM 1573 N GLY A 96 1.337 -7.941 2.359 1.00 0.00 N ATOM 1574 CA GLY A 96 1.967 -6.615 2.094 1.00 0.00 C ATOM 1575 C GLY A 96 1.406 -5.546 3.030 1.00 0.00 C ATOM 1576 O GLY A 96 1.752 -4.385 2.935 1.00 0.00 O ATOM 0 H GLY A 96 0.334 -7.992 2.179 1.00 0.00 H new ATOM 0 HA2 GLY A 96 3.047 -6.688 2.225 1.00 0.00 H new ATOM 0 HA3 GLY A 96 1.791 -6.325 1.058 1.00 0.00 H new ATOM 1580 N LYS A 97 0.551 -5.916 3.936 1.00 0.00 N ATOM 1581 CA LYS A 97 -0.014 -4.902 4.870 1.00 0.00 C ATOM 1582 C LYS A 97 1.029 -4.560 5.931 1.00 0.00 C ATOM 1583 O LYS A 97 1.681 -5.429 6.476 1.00 0.00 O ATOM 1584 CB LYS A 97 -1.265 -5.466 5.545 1.00 0.00 C ATOM 1585 CG LYS A 97 -0.924 -6.791 6.229 1.00 0.00 C ATOM 1586 CD LYS A 97 -1.846 -6.992 7.429 1.00 0.00 C ATOM 1587 CE LYS A 97 -2.077 -8.490 7.653 1.00 0.00 C ATOM 1588 NZ LYS A 97 -2.788 -8.700 8.946 1.00 0.00 N ATOM 0 H LYS A 97 0.218 -6.871 4.072 1.00 0.00 H new ATOM 0 HA LYS A 97 -0.280 -4.003 4.315 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -1.648 -4.755 6.277 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -2.052 -5.618 4.806 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -1.038 -7.616 5.526 1.00 0.00 H new ATOM 0 HG3 LYS A 97 0.117 -6.789 6.552 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -1.404 -6.545 8.319 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -2.797 -6.488 7.258 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -2.663 -8.904 6.833 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -1.123 -9.018 7.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -2.943 -9.717 9.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -2.213 -8.320 9.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -3.705 -8.210 8.922 1.00 0.00 H new ATOM 1602 N GLU A 98 1.190 -3.304 6.244 1.00 0.00 N ATOM 1603 CA GLU A 98 2.186 -2.936 7.284 1.00 0.00 C ATOM 1604 C GLU A 98 1.581 -3.294 8.645 1.00 0.00 C ATOM 1605 O GLU A 98 1.266 -4.440 8.902 1.00 0.00 O ATOM 1606 CB GLU A 98 2.483 -1.432 7.199 1.00 0.00 C ATOM 1607 CG GLU A 98 3.663 -1.045 8.115 1.00 0.00 C ATOM 1608 CD GLU A 98 4.573 -2.254 8.404 1.00 0.00 C ATOM 1609 OE1 GLU A 98 5.144 -2.790 7.463 1.00 0.00 O ATOM 1610 OE2 GLU A 98 4.682 -2.621 9.562 1.00 0.00 O ATOM 0 H GLU A 98 0.680 -2.525 5.828 1.00 0.00 H new ATOM 0 HA GLU A 98 3.124 -3.472 7.140 1.00 0.00 H new ATOM 0 HB2 GLU A 98 2.715 -1.162 6.169 1.00 0.00 H new ATOM 0 HB3 GLU A 98 1.596 -0.866 7.485 1.00 0.00 H new ATOM 0 HG2 GLU A 98 4.246 -0.254 7.644 1.00 0.00 H new ATOM 0 HG3 GLU A 98 3.280 -0.644 9.053 1.00 0.00 H new ATOM 1617 N GLY A 99 1.365 -2.335 9.505 1.00 0.00 N ATOM 1618 CA GLY A 99 0.729 -2.646 10.807 1.00 0.00 C ATOM 1619 C GLY A 99 -0.775 -2.423 10.648 1.00 0.00 C ATOM 1620 O GLY A 99 -1.492 -2.189 11.601 1.00 0.00 O ATOM 0 H GLY A 99 1.602 -1.354 9.358 1.00 0.00 H new ATOM 0 HA2 GLY A 99 0.935 -3.676 11.098 1.00 0.00 H new ATOM 0 HA3 GLY A 99 1.131 -2.006 11.593 1.00 0.00 H new ATOM 1624 N GLN A 100 -1.246 -2.474 9.429 1.00 0.00 N ATOM 1625 CA GLN A 100 -2.690 -2.246 9.156 1.00 0.00 C ATOM 1626 C GLN A 100 -3.434 -3.587 9.093 1.00 0.00 C ATOM 1627 O GLN A 100 -2.820 -4.629 8.986 1.00 0.00 O ATOM 1628 CB GLN A 100 -2.816 -1.496 7.822 1.00 0.00 C ATOM 1629 CG GLN A 100 -2.750 -2.469 6.638 1.00 0.00 C ATOM 1630 CD GLN A 100 -3.182 -1.742 5.363 1.00 0.00 C ATOM 1631 OE1 GLN A 100 -3.765 -2.337 4.479 1.00 0.00 O ATOM 1632 NE2 GLN A 100 -2.923 -0.470 5.230 1.00 0.00 N ATOM 0 H GLN A 100 -0.681 -2.667 8.602 1.00 0.00 H new ATOM 0 HA GLN A 100 -3.135 -1.653 9.955 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -3.758 -0.949 7.796 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -2.017 -0.760 7.737 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -1.737 -2.855 6.525 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -3.399 -3.326 6.820 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -2.434 0.031 5.971 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -3.210 0.023 4.385 1.00 0.00 H new ATOM 1641 N PRO A 101 -4.741 -3.516 9.162 1.00 0.00 N ATOM 1642 CA PRO A 101 -5.591 -4.717 9.114 1.00 0.00 C ATOM 1643 C PRO A 101 -5.497 -5.364 7.734 1.00 0.00 C ATOM 1644 O PRO A 101 -5.412 -6.569 7.608 1.00 0.00 O ATOM 1645 CB PRO A 101 -7.016 -4.200 9.361 1.00 0.00 C ATOM 1646 CG PRO A 101 -6.943 -2.657 9.477 1.00 0.00 C ATOM 1647 CD PRO A 101 -5.475 -2.244 9.292 1.00 0.00 C ATOM 0 HA PRO A 101 -5.293 -5.468 9.846 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -7.676 -4.491 8.544 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -7.427 -4.633 10.273 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -7.571 -2.186 8.721 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -7.313 -2.328 10.448 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -5.348 -1.621 8.407 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -5.116 -1.665 10.143 1.00 0.00 H new ATOM 1655 N GLY A 102 -5.520 -4.570 6.697 1.00 0.00 N ATOM 1656 CA GLY A 102 -5.444 -5.138 5.324 1.00 0.00 C ATOM 1657 C GLY A 102 -6.599 -6.118 5.133 1.00 0.00 C ATOM 1658 O GLY A 102 -6.632 -7.175 5.731 1.00 0.00 O ATOM 0 H GLY A 102 -5.588 -3.553 6.743 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -5.498 -4.341 4.582 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -4.490 -5.645 5.178 1.00 0.00 H new ATOM 1662 N GLU A 103 -7.557 -5.784 4.318 1.00 0.00 N ATOM 1663 CA GLU A 103 -8.702 -6.726 4.127 1.00 0.00 C ATOM 1664 C GLU A 103 -9.172 -6.715 2.676 1.00 0.00 C ATOM 1665 O GLU A 103 -9.352 -5.673 2.077 1.00 0.00 O ATOM 1666 CB GLU A 103 -9.867 -6.325 5.038 1.00 0.00 C ATOM 1667 CG GLU A 103 -10.115 -4.816 4.939 1.00 0.00 C ATOM 1668 CD GLU A 103 -11.016 -4.372 6.093 1.00 0.00 C ATOM 1669 OE1 GLU A 103 -12.181 -4.734 6.082 1.00 0.00 O ATOM 1670 OE2 GLU A 103 -10.526 -3.677 6.968 1.00 0.00 O ATOM 0 H GLU A 103 -7.602 -4.917 3.783 1.00 0.00 H new ATOM 0 HA GLU A 103 -8.364 -7.730 4.383 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -10.767 -6.869 4.752 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -9.644 -6.598 6.069 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -9.168 -4.278 4.975 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -10.583 -4.575 3.984 1.00 0.00 H new ATOM 1677 N TRP A 104 -9.389 -7.872 2.106 1.00 0.00 N ATOM 1678 CA TRP A 104 -9.866 -7.917 0.700 1.00 0.00 C ATOM 1679 C TRP A 104 -11.065 -6.982 0.575 1.00 0.00 C ATOM 1680 O TRP A 104 -12.011 -7.060 1.333 1.00 0.00 O ATOM 1681 CB TRP A 104 -10.278 -9.346 0.326 1.00 0.00 C ATOM 1682 CG TRP A 104 -9.302 -10.312 0.913 1.00 0.00 C ATOM 1683 CD1 TRP A 104 -7.963 -10.266 0.732 1.00 0.00 C ATOM 1684 CD2 TRP A 104 -9.559 -11.463 1.771 1.00 0.00 C ATOM 1685 NE1 TRP A 104 -7.380 -11.312 1.422 1.00 0.00 N ATOM 1686 CE2 TRP A 104 -8.322 -12.079 2.079 1.00 0.00 C ATOM 1687 CE3 TRP A 104 -10.731 -12.027 2.306 1.00 0.00 C ATOM 1688 CZ2 TRP A 104 -8.251 -13.212 2.890 1.00 0.00 C ATOM 1689 CZ3 TRP A 104 -10.663 -13.168 3.124 1.00 0.00 C ATOM 1690 CH2 TRP A 104 -9.425 -13.759 3.414 1.00 0.00 C ATOM 0 H TRP A 104 -9.257 -8.779 2.553 1.00 0.00 H new ATOM 0 HA TRP A 104 -9.069 -7.603 0.026 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -11.282 -9.556 0.696 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -10.308 -9.456 -0.758 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -7.434 -9.531 0.143 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -6.377 -11.495 1.443 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -11.690 -11.580 2.087 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -7.295 -13.663 3.111 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -11.569 -13.592 3.531 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -9.379 -14.636 4.042 1.00 0.00 H new ATOM 1701 N MET A 105 -11.024 -6.095 -0.367 1.00 0.00 N ATOM 1702 CA MET A 105 -12.144 -5.141 -0.547 1.00 0.00 C ATOM 1703 C MET A 105 -12.729 -5.362 -1.936 1.00 0.00 C ATOM 1704 O MET A 105 -12.056 -5.171 -2.924 1.00 0.00 O ATOM 1705 CB MET A 105 -11.598 -3.714 -0.426 1.00 0.00 C ATOM 1706 CG MET A 105 -12.672 -2.788 0.140 1.00 0.00 C ATOM 1707 SD MET A 105 -12.937 -1.410 -1.001 1.00 0.00 S ATOM 1708 CE MET A 105 -14.726 -1.270 -0.777 1.00 0.00 C ATOM 0 H MET A 105 -10.255 -5.987 -1.028 1.00 0.00 H new ATOM 0 HA MET A 105 -12.916 -5.292 0.208 1.00 0.00 H new ATOM 0 HB2 MET A 105 -10.721 -3.705 0.222 1.00 0.00 H new ATOM 0 HB3 MET A 105 -11.276 -3.355 -1.404 1.00 0.00 H new ATOM 0 HG2 MET A 105 -13.602 -3.338 0.286 1.00 0.00 H new ATOM 0 HG3 MET A 105 -12.367 -2.413 1.117 1.00 0.00 H new ATOM 0 HE1 MET A 105 -15.057 -0.282 -1.098 1.00 0.00 H new ATOM 0 HE2 MET A 105 -15.228 -2.032 -1.373 1.00 0.00 H new ATOM 0 HE3 MET A 105 -14.973 -1.411 0.275 1.00 0.00 H new ATOM 1718 N SER A 106 -13.964 -5.778 -2.027 1.00 0.00 N ATOM 1719 CA SER A 106 -14.566 -6.027 -3.371 1.00 0.00 C ATOM 1720 C SER A 106 -15.008 -4.704 -4.005 1.00 0.00 C ATOM 1721 O SER A 106 -16.088 -4.597 -4.553 1.00 0.00 O ATOM 1722 CB SER A 106 -15.770 -6.956 -3.227 1.00 0.00 C ATOM 1723 OG SER A 106 -15.670 -8.000 -4.187 1.00 0.00 O ATOM 0 H SER A 106 -14.580 -5.956 -1.234 1.00 0.00 H new ATOM 0 HA SER A 106 -13.820 -6.494 -4.014 1.00 0.00 H new ATOM 0 HB2 SER A 106 -15.805 -7.373 -2.220 1.00 0.00 H new ATOM 0 HB3 SER A 106 -16.695 -6.398 -3.373 1.00 0.00 H new ATOM 0 HG SER A 106 -14.996 -8.649 -3.896 1.00 0.00 H new ATOM 1729 N LEU A 107 -14.176 -3.703 -3.950 1.00 0.00 N ATOM 1730 CA LEU A 107 -14.529 -2.397 -4.562 1.00 0.00 C ATOM 1731 C LEU A 107 -14.244 -2.479 -6.065 1.00 0.00 C ATOM 1732 O LEU A 107 -13.468 -3.298 -6.511 1.00 0.00 O ATOM 1733 CB LEU A 107 -13.693 -1.289 -3.890 1.00 0.00 C ATOM 1734 CG LEU A 107 -13.381 -0.155 -4.871 1.00 0.00 C ATOM 1735 CD1 LEU A 107 -13.251 1.163 -4.102 1.00 0.00 C ATOM 1736 CD2 LEU A 107 -12.068 -0.465 -5.595 1.00 0.00 C ATOM 0 H LEU A 107 -13.260 -3.736 -3.503 1.00 0.00 H new ATOM 0 HA LEU A 107 -15.584 -2.163 -4.417 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -14.235 -0.892 -3.032 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -12.762 -1.712 -3.511 1.00 0.00 H new ATOM 0 HG LEU A 107 -14.186 -0.065 -5.601 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -13.029 1.971 -4.799 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -14.187 1.377 -3.585 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -12.445 1.081 -3.373 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -11.840 0.339 -6.295 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -11.262 -0.551 -4.866 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -12.166 -1.404 -6.140 1.00 0.00 H new ATOM 1748 N VAL A 108 -14.863 -1.645 -6.848 1.00 0.00 N ATOM 1749 CA VAL A 108 -14.624 -1.687 -8.316 1.00 0.00 C ATOM 1750 C VAL A 108 -13.946 -0.391 -8.761 1.00 0.00 C ATOM 1751 O VAL A 108 -14.348 0.690 -8.375 1.00 0.00 O ATOM 1752 CB VAL A 108 -15.961 -1.840 -9.038 1.00 0.00 C ATOM 1753 CG1 VAL A 108 -15.780 -1.518 -10.519 1.00 0.00 C ATOM 1754 CG2 VAL A 108 -16.455 -3.280 -8.884 1.00 0.00 C ATOM 0 H VAL A 108 -15.525 -0.935 -6.536 1.00 0.00 H new ATOM 0 HA VAL A 108 -13.979 -2.531 -8.559 1.00 0.00 H new ATOM 0 HB VAL A 108 -16.691 -1.155 -8.606 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -16.734 -1.627 -11.034 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -15.424 -0.494 -10.628 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -15.052 -2.203 -10.954 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -17.409 -3.394 -9.398 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -15.725 -3.963 -9.318 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -16.583 -3.510 -7.826 1.00 0.00 H new ATOM 1764 N GLY A 109 -12.918 -0.494 -9.569 1.00 0.00 N ATOM 1765 CA GLY A 109 -12.204 0.731 -10.039 1.00 0.00 C ATOM 1766 C GLY A 109 -12.105 1.718 -8.881 1.00 0.00 C ATOM 1767 O GLY A 109 -12.884 2.644 -8.769 1.00 0.00 O ATOM 0 H GLY A 109 -12.544 -1.375 -9.922 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -11.209 0.472 -10.400 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -12.739 1.182 -10.875 1.00 0.00 H new ATOM 1771 N LEU A 110 -11.169 1.506 -8.004 1.00 0.00 N ATOM 1772 CA LEU A 110 -11.023 2.405 -6.832 1.00 0.00 C ATOM 1773 C LEU A 110 -11.208 3.859 -7.243 1.00 0.00 C ATOM 1774 O LEU A 110 -11.195 4.194 -8.408 1.00 0.00 O ATOM 1775 CB LEU A 110 -9.641 2.226 -6.223 1.00 0.00 C ATOM 1776 CG LEU A 110 -9.797 1.854 -4.756 1.00 0.00 C ATOM 1777 CD1 LEU A 110 -8.511 1.194 -4.253 1.00 0.00 C ATOM 1778 CD2 LEU A 110 -10.071 3.125 -3.955 1.00 0.00 C ATOM 0 H LEU A 110 -10.494 0.743 -8.049 1.00 0.00 H new ATOM 0 HA LEU A 110 -11.788 2.148 -6.100 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -9.093 1.448 -6.754 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -9.064 3.145 -6.320 1.00 0.00 H new ATOM 0 HG LEU A 110 -10.624 1.154 -4.636 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -8.625 0.929 -3.202 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -8.312 0.294 -4.835 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -7.678 1.889 -4.363 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -10.185 2.873 -2.901 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -9.238 3.817 -4.075 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -10.986 3.593 -4.317 1.00 0.00 H new ATOM 1790 N ASN A 111 -11.382 4.719 -6.279 1.00 0.00 N ATOM 1791 CA ASN A 111 -11.573 6.162 -6.569 1.00 0.00 C ATOM 1792 C ASN A 111 -11.246 6.961 -5.308 1.00 0.00 C ATOM 1793 O ASN A 111 -11.402 6.480 -4.205 1.00 0.00 O ATOM 1794 CB ASN A 111 -13.030 6.404 -6.960 1.00 0.00 C ATOM 1795 CG ASN A 111 -13.111 7.577 -7.938 1.00 0.00 C ATOM 1796 OD1 ASN A 111 -12.741 7.451 -9.088 1.00 0.00 O ATOM 1797 ND2 ASN A 111 -13.585 8.722 -7.528 1.00 0.00 N ATOM 0 H ASN A 111 -11.400 4.477 -5.288 1.00 0.00 H new ATOM 0 HA ASN A 111 -10.921 6.473 -7.385 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -13.448 5.507 -7.417 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -13.625 6.616 -6.072 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -13.644 9.510 -8.173 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -13.896 8.829 -6.562 1.00 0.00 H new ATOM 1804 N ALA A 112 -10.796 8.173 -5.456 1.00 0.00 N ATOM 1805 CA ALA A 112 -10.473 8.995 -4.256 1.00 0.00 C ATOM 1806 C ALA A 112 -11.714 9.069 -3.369 1.00 0.00 C ATOM 1807 O ALA A 112 -11.634 9.312 -2.181 1.00 0.00 O ATOM 1808 CB ALA A 112 -10.067 10.404 -4.692 1.00 0.00 C ATOM 0 H ALA A 112 -10.637 8.631 -6.353 1.00 0.00 H new ATOM 0 HA ALA A 112 -9.648 8.544 -3.705 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -9.831 11.003 -3.813 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -9.191 10.347 -5.338 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -10.889 10.867 -5.237 1.00 0.00 H new ATOM 1814 N ASP A 113 -12.866 8.847 -3.945 1.00 0.00 N ATOM 1815 CA ASP A 113 -14.126 8.886 -3.155 1.00 0.00 C ATOM 1816 C ASP A 113 -13.904 8.168 -1.825 1.00 0.00 C ATOM 1817 O ASP A 113 -14.419 8.560 -0.796 1.00 0.00 O ATOM 1818 CB ASP A 113 -15.222 8.165 -3.945 1.00 0.00 C ATOM 1819 CG ASP A 113 -16.422 9.096 -4.134 1.00 0.00 C ATOM 1820 OD1 ASP A 113 -16.208 10.294 -4.229 1.00 0.00 O ATOM 1821 OD2 ASP A 113 -17.534 8.596 -4.180 1.00 0.00 O ATOM 0 H ASP A 113 -12.986 8.639 -4.936 1.00 0.00 H new ATOM 0 HA ASP A 113 -14.421 9.918 -2.967 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -14.837 7.851 -4.915 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -15.530 7.262 -3.417 1.00 0.00 H new ATOM 1826 N ASP A 114 -13.140 7.114 -1.849 1.00 0.00 N ATOM 1827 CA ASP A 114 -12.866 6.345 -0.605 1.00 0.00 C ATOM 1828 C ASP A 114 -11.372 6.439 -0.261 1.00 0.00 C ATOM 1829 O ASP A 114 -10.937 6.013 0.790 1.00 0.00 O ATOM 1830 CB ASP A 114 -13.250 4.883 -0.843 1.00 0.00 C ATOM 1831 CG ASP A 114 -14.770 4.769 -0.980 1.00 0.00 C ATOM 1832 OD1 ASP A 114 -15.465 5.437 -0.232 1.00 0.00 O ATOM 1833 OD2 ASP A 114 -15.213 4.017 -1.832 1.00 0.00 O ATOM 0 H ASP A 114 -12.688 6.748 -2.687 1.00 0.00 H new ATOM 0 HA ASP A 114 -13.446 6.752 0.223 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -12.764 4.511 -1.745 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -12.902 4.265 -0.015 1.00 0.00 H new ATOM 1838 N PHE A 115 -10.585 6.991 -1.150 1.00 0.00 N ATOM 1839 CA PHE A 115 -9.116 7.118 -0.897 1.00 0.00 C ATOM 1840 C PHE A 115 -8.788 8.555 -0.453 1.00 0.00 C ATOM 1841 O PHE A 115 -9.092 9.497 -1.159 1.00 0.00 O ATOM 1842 CB PHE A 115 -8.368 6.812 -2.197 1.00 0.00 C ATOM 1843 CG PHE A 115 -7.340 5.720 -1.978 1.00 0.00 C ATOM 1844 CD1 PHE A 115 -6.291 5.904 -1.069 1.00 0.00 C ATOM 1845 CD2 PHE A 115 -7.432 4.530 -2.704 1.00 0.00 C ATOM 1846 CE1 PHE A 115 -5.339 4.890 -0.888 1.00 0.00 C ATOM 1847 CE2 PHE A 115 -6.482 3.520 -2.524 1.00 0.00 C ATOM 1848 CZ PHE A 115 -5.436 3.698 -1.614 1.00 0.00 C ATOM 0 H PHE A 115 -10.899 7.362 -2.047 1.00 0.00 H new ATOM 0 HA PHE A 115 -8.815 6.422 -0.114 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -9.076 6.503 -2.966 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -7.876 7.714 -2.561 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -6.215 6.824 -0.509 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -8.240 4.390 -3.407 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -4.530 5.030 -0.187 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -6.556 2.602 -3.088 1.00 0.00 H new ATOM 0 HZ PHE A 115 -4.704 2.917 -1.472 1.00 0.00 H new ATOM 1858 N PRO A 116 -8.174 8.680 0.702 1.00 0.00 N ATOM 1859 CA PRO A 116 -7.791 9.996 1.258 1.00 0.00 C ATOM 1860 C PRO A 116 -6.980 10.816 0.246 1.00 0.00 C ATOM 1861 O PRO A 116 -6.245 10.269 -0.546 1.00 0.00 O ATOM 1862 CB PRO A 116 -6.927 9.663 2.479 1.00 0.00 C ATOM 1863 CG PRO A 116 -7.015 8.134 2.715 1.00 0.00 C ATOM 1864 CD PRO A 116 -7.813 7.529 1.550 1.00 0.00 C ATOM 0 HA PRO A 116 -8.665 10.597 1.508 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -5.893 9.965 2.310 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -7.279 10.206 3.356 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -6.018 7.696 2.764 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -7.504 7.921 3.666 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -7.217 6.802 0.998 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -8.701 7.007 1.908 1.00 0.00 H new ATOM 1872 N PRO A 117 -7.135 12.117 0.314 1.00 0.00 N ATOM 1873 CA PRO A 117 -6.421 13.044 -0.584 1.00 0.00 C ATOM 1874 C PRO A 117 -4.903 12.943 -0.373 1.00 0.00 C ATOM 1875 O PRO A 117 -4.128 13.233 -1.262 1.00 0.00 O ATOM 1876 CB PRO A 117 -6.926 14.440 -0.188 1.00 0.00 C ATOM 1877 CG PRO A 117 -7.924 14.266 0.985 1.00 0.00 C ATOM 1878 CD PRO A 117 -8.035 12.764 1.287 1.00 0.00 C ATOM 0 HA PRO A 117 -6.605 12.820 -1.635 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -6.093 15.077 0.110 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -7.412 14.925 -1.035 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -7.578 14.808 1.865 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -8.899 14.676 0.721 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -7.735 12.543 2.311 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -9.060 12.412 1.172 1.00 0.00 H new ATOM 1886 N ALA A 118 -4.472 12.544 0.797 1.00 0.00 N ATOM 1887 CA ALA A 118 -3.002 12.435 1.053 1.00 0.00 C ATOM 1888 C ALA A 118 -2.316 11.803 -0.155 1.00 0.00 C ATOM 1889 O ALA A 118 -1.321 12.298 -0.649 1.00 0.00 O ATOM 1890 CB ALA A 118 -2.759 11.554 2.279 1.00 0.00 C ATOM 0 H ALA A 118 -5.070 12.290 1.583 1.00 0.00 H new ATOM 0 HA ALA A 118 -2.596 13.431 1.228 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -1.688 11.476 2.464 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -3.246 11.997 3.148 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -3.170 10.560 2.100 1.00 0.00 H new ATOM 1896 N ASN A 119 -2.843 10.714 -0.638 1.00 0.00 N ATOM 1897 CA ASN A 119 -2.223 10.051 -1.819 1.00 0.00 C ATOM 1898 C ASN A 119 -3.016 10.432 -3.069 1.00 0.00 C ATOM 1899 O ASN A 119 -3.501 9.592 -3.790 1.00 0.00 O ATOM 1900 CB ASN A 119 -2.247 8.532 -1.630 1.00 0.00 C ATOM 1901 CG ASN A 119 -0.842 8.040 -1.269 1.00 0.00 C ATOM 1902 OD1 ASN A 119 -0.300 7.181 -1.932 1.00 0.00 O ATOM 1903 ND2 ASN A 119 -0.225 8.553 -0.240 1.00 0.00 N ATOM 0 H ASN A 119 -3.675 10.254 -0.267 1.00 0.00 H new ATOM 0 HA ASN A 119 -1.188 10.375 -1.926 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -2.951 8.264 -0.842 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -2.590 8.047 -2.544 1.00 0.00 H new ATOM 0 HD21 ASN A 119 0.711 8.232 0.006 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -0.679 9.275 0.319 1.00 0.00 H new ATOM 1910 N GLU A 120 -3.156 11.702 -3.312 1.00 0.00 N ATOM 1911 CA GLU A 120 -3.925 12.182 -4.497 1.00 0.00 C ATOM 1912 C GLU A 120 -3.230 11.834 -5.827 1.00 0.00 C ATOM 1913 O GLU A 120 -3.888 11.448 -6.769 1.00 0.00 O ATOM 1914 CB GLU A 120 -4.062 13.696 -4.400 1.00 0.00 C ATOM 1915 CG GLU A 120 -5.508 14.059 -4.057 1.00 0.00 C ATOM 1916 CD GLU A 120 -5.624 15.572 -3.865 1.00 0.00 C ATOM 1917 OE1 GLU A 120 -4.753 16.279 -4.344 1.00 0.00 O ATOM 1918 OE2 GLU A 120 -6.582 15.998 -3.241 1.00 0.00 O ATOM 0 H GLU A 120 -2.764 12.443 -2.731 1.00 0.00 H new ATOM 0 HA GLU A 120 -4.896 11.688 -4.491 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -3.388 14.084 -3.636 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -3.774 14.159 -5.344 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -6.175 13.731 -4.854 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -5.818 13.542 -3.149 1.00 0.00 H new ATOM 1925 N PRO A 121 -1.933 12.017 -5.892 1.00 0.00 N ATOM 1926 CA PRO A 121 -1.172 11.758 -7.132 1.00 0.00 C ATOM 1927 C PRO A 121 -1.380 10.332 -7.649 1.00 0.00 C ATOM 1928 O PRO A 121 -1.350 10.090 -8.840 1.00 0.00 O ATOM 1929 CB PRO A 121 0.292 12.002 -6.746 1.00 0.00 C ATOM 1930 CG PRO A 121 0.307 12.592 -5.315 1.00 0.00 C ATOM 1931 CD PRO A 121 -1.119 12.489 -4.757 1.00 0.00 C ATOM 0 HA PRO A 121 -1.501 12.404 -7.946 1.00 0.00 H new ATOM 0 HB2 PRO A 121 0.858 11.071 -6.782 1.00 0.00 H new ATOM 0 HB3 PRO A 121 0.764 12.689 -7.448 1.00 0.00 H new ATOM 0 HG2 PRO A 121 1.006 12.045 -4.682 1.00 0.00 H new ATOM 0 HG3 PRO A 121 0.638 13.631 -5.332 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -1.167 11.793 -3.919 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -1.471 13.453 -4.391 1.00 0.00 H new ATOM 1939 N VAL A 122 -1.588 9.387 -6.785 1.00 0.00 N ATOM 1940 CA VAL A 122 -1.792 7.991 -7.259 1.00 0.00 C ATOM 1941 C VAL A 122 -3.287 7.657 -7.243 1.00 0.00 C ATOM 1942 O VAL A 122 -3.794 6.989 -8.120 1.00 0.00 O ATOM 1943 CB VAL A 122 -1.029 7.044 -6.337 1.00 0.00 C ATOM 1944 CG1 VAL A 122 -1.701 5.667 -6.317 1.00 0.00 C ATOM 1945 CG2 VAL A 122 0.408 6.899 -6.841 1.00 0.00 C ATOM 0 H VAL A 122 -1.626 9.516 -5.774 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.422 7.882 -8.278 1.00 0.00 H new ATOM 0 HB VAL A 122 -1.030 7.453 -5.327 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -1.147 5.001 -5.656 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -2.725 5.767 -5.956 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -1.710 5.252 -7.325 1.00 0.00 H new ATOM 0 HG21 VAL A 122 0.957 6.223 -6.185 1.00 0.00 H new ATOM 0 HG22 VAL A 122 0.399 6.495 -7.853 1.00 0.00 H new ATOM 0 HG23 VAL A 122 0.893 7.875 -6.844 1.00 0.00 H new ATOM 1955 N ILE A 123 -3.991 8.110 -6.249 1.00 0.00 N ATOM 1956 CA ILE A 123 -5.446 7.818 -6.178 1.00 0.00 C ATOM 1957 C ILE A 123 -6.094 8.301 -7.465 1.00 0.00 C ATOM 1958 O ILE A 123 -7.022 7.709 -7.964 1.00 0.00 O ATOM 1959 CB ILE A 123 -6.061 8.553 -4.989 1.00 0.00 C ATOM 1960 CG1 ILE A 123 -5.667 7.835 -3.703 1.00 0.00 C ATOM 1961 CG2 ILE A 123 -7.588 8.559 -5.116 1.00 0.00 C ATOM 1962 CD1 ILE A 123 -5.605 8.840 -2.555 1.00 0.00 C ATOM 0 H ILE A 123 -3.622 8.671 -5.481 1.00 0.00 H new ATOM 0 HA ILE A 123 -5.608 6.747 -6.053 1.00 0.00 H new ATOM 0 HB ILE A 123 -5.698 9.580 -4.970 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -6.390 7.052 -3.476 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -4.699 7.349 -3.827 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -8.022 9.085 -4.265 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -7.874 9.064 -6.039 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.956 7.533 -5.134 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -5.323 8.326 -1.636 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -4.865 9.607 -2.783 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -6.582 9.305 -2.425 1.00 0.00 H new ATOM 1974 N ALA A 124 -5.597 9.375 -8.003 1.00 0.00 N ATOM 1975 CA ALA A 124 -6.161 9.917 -9.268 1.00 0.00 C ATOM 1976 C ALA A 124 -6.209 8.806 -10.310 1.00 0.00 C ATOM 1977 O ALA A 124 -7.124 8.708 -11.104 1.00 0.00 O ATOM 1978 CB ALA A 124 -5.246 11.033 -9.770 1.00 0.00 C ATOM 0 H ALA A 124 -4.816 9.907 -7.618 1.00 0.00 H new ATOM 0 HA ALA A 124 -7.166 10.302 -9.096 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -5.646 11.442 -10.698 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -5.190 11.822 -9.020 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -4.248 10.632 -9.950 1.00 0.00 H new ATOM 1984 N LYS A 125 -5.205 7.988 -10.316 1.00 0.00 N ATOM 1985 CA LYS A 125 -5.127 6.881 -11.302 1.00 0.00 C ATOM 1986 C LYS A 125 -6.000 5.697 -10.877 1.00 0.00 C ATOM 1987 O LYS A 125 -6.615 5.060 -11.704 1.00 0.00 O ATOM 1988 CB LYS A 125 -3.676 6.447 -11.408 1.00 0.00 C ATOM 1989 CG LYS A 125 -2.870 7.612 -11.978 1.00 0.00 C ATOM 1990 CD LYS A 125 -3.457 8.028 -13.327 1.00 0.00 C ATOM 1991 CE LYS A 125 -2.325 8.366 -14.299 1.00 0.00 C ATOM 1992 NZ LYS A 125 -2.437 7.506 -15.509 1.00 0.00 N ATOM 0 H LYS A 125 -4.419 8.038 -9.668 1.00 0.00 H new ATOM 0 HA LYS A 125 -5.496 7.228 -12.267 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -3.292 6.162 -10.428 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -3.587 5.572 -12.052 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -2.889 8.454 -11.286 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -1.826 7.322 -12.098 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -4.069 7.222 -13.732 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -4.110 8.891 -13.200 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -2.375 9.418 -14.581 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -1.359 8.211 -13.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -1.668 7.735 -16.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -2.369 6.506 -15.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -3.353 7.675 -15.972 1.00 0.00 H new ATOM 2006 N LEU A 126 -6.077 5.390 -9.608 1.00 0.00 N ATOM 2007 CA LEU A 126 -6.944 4.246 -9.194 1.00 0.00 C ATOM 2008 C LEU A 126 -8.359 4.568 -9.648 1.00 0.00 C ATOM 2009 O LEU A 126 -9.088 3.726 -10.128 1.00 0.00 O ATOM 2010 CB LEU A 126 -6.933 4.082 -7.671 1.00 0.00 C ATOM 2011 CG LEU A 126 -5.574 3.564 -7.165 1.00 0.00 C ATOM 2012 CD1 LEU A 126 -4.442 3.879 -8.155 1.00 0.00 C ATOM 2013 CD2 LEU A 126 -5.270 4.241 -5.830 1.00 0.00 C ATOM 0 H LEU A 126 -5.588 5.871 -8.853 1.00 0.00 H new ATOM 0 HA LEU A 126 -6.579 3.320 -9.639 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -7.156 5.039 -7.200 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -7.720 3.389 -7.374 1.00 0.00 H new ATOM 0 HG LEU A 126 -5.633 2.481 -7.056 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.499 3.498 -7.763 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -4.654 3.405 -9.113 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -4.368 4.958 -8.292 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -4.310 3.888 -5.453 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -5.229 5.321 -5.971 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -6.053 3.998 -5.112 1.00 0.00 H new ATOM 2025 N LYS A 127 -8.728 5.807 -9.507 1.00 0.00 N ATOM 2026 CA LYS A 127 -10.076 6.259 -9.935 1.00 0.00 C ATOM 2027 C LYS A 127 -10.432 5.576 -11.247 1.00 0.00 C ATOM 2028 O LYS A 127 -11.563 5.203 -11.492 1.00 0.00 O ATOM 2029 CB LYS A 127 -10.017 7.767 -10.154 1.00 0.00 C ATOM 2030 CG LYS A 127 -9.409 8.430 -8.917 1.00 0.00 C ATOM 2031 CD LYS A 127 -10.207 9.689 -8.566 1.00 0.00 C ATOM 2032 CE LYS A 127 -9.632 10.887 -9.324 1.00 0.00 C ATOM 2033 NZ LYS A 127 -10.720 11.557 -10.090 1.00 0.00 N ATOM 0 H LYS A 127 -8.141 6.538 -9.106 1.00 0.00 H new ATOM 0 HA LYS A 127 -10.824 6.012 -9.182 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -9.418 7.996 -11.036 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -11.017 8.160 -10.338 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -9.419 7.735 -8.077 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -8.367 8.688 -9.105 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -11.257 9.551 -8.826 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -10.165 9.871 -7.492 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -9.178 11.590 -8.625 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -8.844 10.558 -10.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -10.330 12.372 -10.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -11.133 10.884 -10.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -11.457 11.884 -9.433 1.00 0.00 H new ATOM 2047 N ARG A 128 -9.459 5.419 -12.092 1.00 0.00 N ATOM 2048 CA ARG A 128 -9.692 4.770 -13.404 1.00 0.00 C ATOM 2049 C ARG A 128 -9.532 3.250 -13.258 1.00 0.00 C ATOM 2050 O ARG A 128 -10.378 2.487 -13.678 1.00 0.00 O ATOM 2051 CB ARG A 128 -8.668 5.301 -14.418 1.00 0.00 C ATOM 2052 CG ARG A 128 -8.164 6.689 -13.996 1.00 0.00 C ATOM 2053 CD ARG A 128 -8.024 7.580 -15.234 1.00 0.00 C ATOM 2054 NE ARG A 128 -7.812 8.993 -14.804 1.00 0.00 N ATOM 2055 CZ ARG A 128 -7.387 9.884 -15.659 1.00 0.00 C ATOM 2056 NH1 ARG A 128 -7.891 9.929 -16.863 1.00 0.00 N ATOM 2057 NH2 ARG A 128 -6.458 10.730 -15.310 1.00 0.00 N ATOM 0 H ARG A 128 -8.498 5.717 -11.926 1.00 0.00 H new ATOM 0 HA ARG A 128 -10.700 4.994 -13.752 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -7.829 4.610 -14.492 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -9.122 5.358 -15.407 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -8.859 7.140 -13.287 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -7.204 6.600 -13.488 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -7.186 7.244 -15.845 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -8.919 7.506 -15.852 1.00 0.00 H new ATOM 0 HE ARG A 128 -8.000 9.264 -13.839 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -8.618 9.268 -17.137 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -7.558 10.626 -17.530 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -6.064 10.695 -14.370 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -6.125 11.426 -15.977 1.00 0.00 H new ATOM 2071 N LEU A 129 -8.446 2.818 -12.660 1.00 0.00 N ATOM 2072 CA LEU A 129 -8.193 1.351 -12.470 1.00 0.00 C ATOM 2073 C LEU A 129 -8.766 0.556 -13.646 1.00 0.00 C ATOM 2074 O LEU A 129 -8.069 0.416 -14.637 1.00 0.00 O ATOM 2075 CB LEU A 129 -8.838 0.874 -11.164 1.00 0.00 C ATOM 2076 CG LEU A 129 -7.804 0.132 -10.316 1.00 0.00 C ATOM 2077 CD1 LEU A 129 -6.539 0.979 -10.174 1.00 0.00 C ATOM 2078 CD2 LEU A 129 -8.387 -0.141 -8.929 1.00 0.00 C ATOM 2079 OXT LEU A 129 -9.891 0.097 -13.534 1.00 0.00 O ATOM 0 H LEU A 129 -7.715 3.426 -12.291 1.00 0.00 H new ATOM 0 HA LEU A 129 -7.116 1.187 -12.422 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -9.232 1.726 -10.610 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -9.681 0.218 -11.382 1.00 0.00 H new ATOM 0 HG LEU A 129 -7.552 -0.810 -10.803 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -5.808 0.443 -9.569 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -6.119 1.175 -11.161 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -6.786 1.924 -9.691 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -7.652 -0.670 -8.323 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -8.641 0.804 -8.449 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -9.285 -0.752 -9.025 1.00 0.00 H new