USER MOD reduce.3.24.130724 H: found=0, std=0, add=845, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 850 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 9 TYR OH : rot 75:sc= -0.884! USER MOD Set 1.2: B 18 GLN : amide:sc= 0.0371 K(o=-0.85,f=-1.5) USER MOD Single : A 11 ASN : amide:sc= -0.0078 X(o=-0.0078,f=-0.13) USER MOD Single : A 15 LYS NZ :NH3+ 178:sc= 0.947 (180deg=0.913) USER MOD Single : A 18 GLN : amide:sc= -0.336 X(o=-0.34,f=-0.68) USER MOD Single : A 19 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0492) USER MOD Single : A 23 LYS NZ :NH3+ 167:sc= 0.762 (180deg=0.467) USER MOD Single : A 29 LYS NZ :NH3+ -175:sc= 1.17 (180deg=1.07) USER MOD Single : A 31 LYS NZ :NH3+ 159:sc= -0.0707 (180deg=-0.42) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 164:sc= -0.103 (180deg=-0.496) USER MOD Single : B 9 TYR OH : rot -84:sc= -0.107 USER MOD Single : B 11 ASN : amide:sc= 0.123 X(o=0.12,f=0) USER MOD Single : B 15 LYS NZ :NH3+ -174:sc= 0.561 (180deg=0.323) USER MOD Single : B 19 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0426) USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 57 THR OG1 : rot 180:sc=-0.00816 USER MOD Single : B 59 MET CE :methyl -156:sc= -0.194 (180deg=-0.851) USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 61 SER OG : rot -47:sc= 0.104 USER MOD Single : B 64 HIS : no HE2:sc= 0.873 K(o=0.87,f=-4.3!) USER MOD Single : B 65 HIS : no HD1:sc= 0 X(o=0,f=-0.0071) USER MOD Single : B 66 HIS : no HD1:sc= -0.0177 X(o=-0.018,f=0) USER MOD Single : B 67 HIS : no HD1:sc= -0.22 X(o=-0.22,f=-0.0032) USER MOD Single : B 68 HIS : no HD1:sc=-0.000304 X(o=-0.0003,f=0) USER MOD Single : B 69 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 56 N ILE A 4 -5.586 1.569 2.846 1.00 0.00 N ATOM 57 CA ILE A 4 -6.112 0.277 2.462 1.00 0.00 C ATOM 58 C ILE A 4 -7.161 0.425 1.381 1.00 0.00 C ATOM 59 O ILE A 4 -8.021 1.312 1.427 1.00 0.00 O ATOM 60 CB ILE A 4 -6.720 -0.489 3.652 1.00 0.00 C ATOM 61 CG1 ILE A 4 -5.640 -0.876 4.656 1.00 0.00 C ATOM 62 CG2 ILE A 4 -7.457 -1.739 3.181 1.00 0.00 C ATOM 63 CD1 ILE A 4 -5.173 0.252 5.553 1.00 0.00 C ATOM 0 HA ILE A 4 -5.267 -0.299 2.084 1.00 0.00 H new ATOM 0 HB ILE A 4 -7.434 0.175 4.139 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -6.018 -1.686 5.281 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -4.781 -1.268 4.111 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -7.876 -2.260 4.042 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -8.261 -1.453 2.503 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -6.761 -2.398 2.662 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -4.405 -0.118 6.233 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -4.761 1.055 4.943 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -6.017 0.631 6.130 1.00 0.00 H new ATOM 75 N ILE A 5 -7.055 -0.434 0.404 1.00 0.00 N ATOM 76 CA ILE A 5 -8.017 -0.509 -0.669 1.00 0.00 C ATOM 77 C ILE A 5 -8.413 -1.961 -0.840 1.00 0.00 C ATOM 78 O ILE A 5 -7.624 -2.862 -0.540 1.00 0.00 O ATOM 79 CB ILE A 5 -7.438 0.003 -2.007 1.00 0.00 C ATOM 80 CG1 ILE A 5 -6.624 1.287 -1.796 1.00 0.00 C ATOM 81 CG2 ILE A 5 -8.553 0.238 -3.022 1.00 0.00 C ATOM 82 CD1 ILE A 5 -5.943 1.782 -3.052 1.00 0.00 C ATOM 0 H ILE A 5 -6.294 -1.108 0.327 1.00 0.00 H new ATOM 0 HA ILE A 5 -8.869 0.120 -0.412 1.00 0.00 H new ATOM 0 HB ILE A 5 -6.770 -0.763 -2.400 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -7.284 2.068 -1.418 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -5.870 1.108 -1.030 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -8.124 0.598 -3.957 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -9.084 -0.697 -3.203 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -9.249 0.981 -2.632 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -5.386 2.692 -2.829 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.258 1.018 -3.420 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -6.694 1.993 -3.814 1.00 0.00 H new ATOM 94 N GLU A 6 -9.623 -2.190 -1.294 1.00 0.00 N ATOM 95 CA GLU A 6 -10.057 -3.530 -1.606 1.00 0.00 C ATOM 96 C GLU A 6 -9.989 -3.748 -3.108 1.00 0.00 C ATOM 97 O GLU A 6 -10.525 -2.959 -3.889 1.00 0.00 O ATOM 98 CB GLU A 6 -11.472 -3.803 -1.097 1.00 0.00 C ATOM 99 CG GLU A 6 -11.578 -3.923 0.417 1.00 0.00 C ATOM 100 CD GLU A 6 -11.664 -2.581 1.112 1.00 0.00 C ATOM 101 OE1 GLU A 6 -12.736 -1.944 1.033 1.00 0.00 O ATOM 102 OE2 GLU A 6 -10.679 -2.168 1.754 1.00 0.00 O ATOM 0 H GLU A 6 -10.323 -1.466 -1.455 1.00 0.00 H new ATOM 0 HA GLU A 6 -9.390 -4.228 -1.101 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -12.128 -3.000 -1.433 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -11.838 -4.725 -1.550 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -12.459 -4.513 0.668 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -10.712 -4.467 0.794 1.00 0.00 H new ATOM 109 N ALA A 7 -9.302 -4.798 -3.499 1.00 0.00 N ATOM 110 CA ALA A 7 -9.159 -5.158 -4.897 1.00 0.00 C ATOM 111 C ALA A 7 -9.554 -6.616 -5.090 1.00 0.00 C ATOM 112 O ALA A 7 -9.710 -7.357 -4.115 1.00 0.00 O ATOM 113 CB ALA A 7 -7.715 -4.943 -5.334 1.00 0.00 C ATOM 0 H ALA A 7 -8.824 -5.430 -2.856 1.00 0.00 H new ATOM 0 HA ALA A 7 -9.810 -4.530 -5.505 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -7.609 -5.214 -6.384 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -7.447 -3.895 -5.200 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -7.055 -5.566 -4.730 1.00 0.00 H new ATOM 119 N VAL A 8 -9.740 -7.012 -6.332 1.00 0.00 N ATOM 120 CA VAL A 8 -9.959 -8.392 -6.671 1.00 0.00 C ATOM 121 C VAL A 8 -8.916 -8.856 -7.679 1.00 0.00 C ATOM 122 O VAL A 8 -8.840 -8.355 -8.804 1.00 0.00 O ATOM 123 CB VAL A 8 -11.374 -8.621 -7.236 1.00 0.00 C ATOM 124 CG1 VAL A 8 -12.394 -8.659 -6.110 1.00 0.00 C ATOM 125 CG2 VAL A 8 -11.743 -7.551 -8.259 1.00 0.00 C ATOM 0 H VAL A 8 -9.743 -6.380 -7.133 1.00 0.00 H new ATOM 0 HA VAL A 8 -9.865 -8.977 -5.756 1.00 0.00 H new ATOM 0 HB VAL A 8 -11.380 -9.584 -7.746 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -13.389 -8.821 -6.525 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -12.150 -9.471 -5.425 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -12.376 -7.712 -5.571 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -12.747 -7.741 -8.638 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -11.714 -6.570 -7.786 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -11.032 -7.577 -9.085 1.00 0.00 H new ATOM 135 N TYR A 9 -8.078 -9.778 -7.245 1.00 0.00 N ATOM 136 CA TYR A 9 -7.098 -10.414 -8.113 1.00 0.00 C ATOM 137 C TYR A 9 -7.807 -11.266 -9.146 1.00 0.00 C ATOM 138 O TYR A 9 -8.533 -12.191 -8.806 1.00 0.00 O ATOM 139 CB TYR A 9 -6.150 -11.262 -7.258 1.00 0.00 C ATOM 140 CG TYR A 9 -5.138 -12.079 -8.035 1.00 0.00 C ATOM 141 CD1 TYR A 9 -3.911 -11.545 -8.394 1.00 0.00 C ATOM 142 CD2 TYR A 9 -5.410 -13.395 -8.391 1.00 0.00 C ATOM 143 CE1 TYR A 9 -2.986 -12.294 -9.089 1.00 0.00 C ATOM 144 CE2 TYR A 9 -4.490 -14.150 -9.087 1.00 0.00 C ATOM 145 CZ TYR A 9 -3.279 -13.596 -9.430 1.00 0.00 C ATOM 146 OH TYR A 9 -2.357 -14.348 -10.121 1.00 0.00 O ATOM 0 H TYR A 9 -8.055 -10.109 -6.281 1.00 0.00 H new ATOM 0 HA TYR A 9 -6.516 -9.658 -8.639 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -5.614 -10.603 -6.576 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -6.746 -11.938 -6.645 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -3.676 -10.526 -8.125 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -6.358 -13.834 -8.118 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -2.035 -11.862 -9.365 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -4.719 -15.169 -9.361 1.00 0.00 H new ATOM 0 HH TYR A 9 -1.634 -14.616 -9.516 1.00 0.00 H new ATOM 156 N GLU A 10 -7.586 -10.912 -10.397 1.00 0.00 N ATOM 157 CA GLU A 10 -8.186 -11.565 -11.537 1.00 0.00 C ATOM 158 C GLU A 10 -7.208 -11.495 -12.700 1.00 0.00 C ATOM 159 O GLU A 10 -6.507 -10.493 -12.844 1.00 0.00 O ATOM 160 CB GLU A 10 -9.464 -10.834 -11.924 1.00 0.00 C ATOM 161 CG GLU A 10 -10.333 -11.588 -12.913 1.00 0.00 C ATOM 162 CD GLU A 10 -11.339 -10.683 -13.592 1.00 0.00 C ATOM 163 OE1 GLU A 10 -12.097 -9.984 -12.889 1.00 0.00 O ATOM 164 OE2 GLU A 10 -11.353 -10.647 -14.837 1.00 0.00 O ATOM 0 H GLU A 10 -6.968 -10.142 -10.652 1.00 0.00 H new ATOM 0 HA GLU A 10 -8.418 -12.602 -11.294 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -10.045 -10.637 -11.023 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.201 -9.866 -12.351 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -9.701 -12.057 -13.667 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -10.859 -12.390 -12.395 1.00 0.00 H new ATOM 171 N ASN A 11 -7.142 -12.553 -13.498 1.00 0.00 N ATOM 172 CA ASN A 11 -6.314 -12.568 -14.711 1.00 0.00 C ATOM 173 C ASN A 11 -4.823 -12.501 -14.372 1.00 0.00 C ATOM 174 O ASN A 11 -3.990 -12.195 -15.224 1.00 0.00 O ATOM 175 CB ASN A 11 -6.700 -11.396 -15.618 1.00 0.00 C ATOM 176 CG ASN A 11 -6.380 -11.651 -17.080 1.00 0.00 C ATOM 177 OD1 ASN A 11 -5.288 -11.346 -17.552 1.00 0.00 O ATOM 178 ND2 ASN A 11 -7.337 -12.201 -17.813 1.00 0.00 N ATOM 0 H ASN A 11 -7.653 -13.420 -13.331 1.00 0.00 H new ATOM 0 HA ASN A 11 -6.496 -13.508 -15.233 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -7.767 -11.198 -15.514 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -6.176 -10.499 -15.287 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -7.179 -12.384 -18.804 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -8.232 -12.441 -17.386 1.00 0.00 H new ATOM 185 N GLY A 12 -4.491 -12.811 -13.127 1.00 0.00 N ATOM 186 CA GLY A 12 -3.117 -12.700 -12.678 1.00 0.00 C ATOM 187 C GLY A 12 -2.774 -11.284 -12.258 1.00 0.00 C ATOM 188 O GLY A 12 -1.603 -10.907 -12.180 1.00 0.00 O ATOM 0 H GLY A 12 -5.149 -13.138 -12.419 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -2.953 -13.377 -11.840 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -2.447 -13.014 -13.478 1.00 0.00 H new ATOM 192 N VAL A 13 -3.813 -10.506 -11.989 1.00 0.00 N ATOM 193 CA VAL A 13 -3.676 -9.101 -11.627 1.00 0.00 C ATOM 194 C VAL A 13 -4.454 -8.813 -10.358 1.00 0.00 C ATOM 195 O VAL A 13 -5.408 -9.500 -10.076 1.00 0.00 O ATOM 196 CB VAL A 13 -4.303 -8.209 -12.704 1.00 0.00 C ATOM 197 CG1 VAL A 13 -3.919 -6.760 -12.493 1.00 0.00 C ATOM 198 CG2 VAL A 13 -3.936 -8.673 -14.108 1.00 0.00 C ATOM 0 H VAL A 13 -4.779 -10.832 -12.016 1.00 0.00 H new ATOM 0 HA VAL A 13 -2.611 -8.900 -11.507 1.00 0.00 H new ATOM 0 HB VAL A 13 -5.386 -8.294 -12.609 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -4.376 -6.146 -13.269 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -4.270 -6.429 -11.515 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -2.835 -6.660 -12.542 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -4.400 -8.014 -14.842 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -2.853 -8.645 -14.229 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -4.292 -9.692 -14.259 1.00 0.00 H new ATOM 208 N PHE A 14 -4.077 -7.805 -9.607 1.00 0.00 N ATOM 209 CA PHE A 14 -4.972 -7.284 -8.588 1.00 0.00 C ATOM 210 C PHE A 14 -5.696 -6.059 -9.132 1.00 0.00 C ATOM 211 O PHE A 14 -5.071 -5.040 -9.421 1.00 0.00 O ATOM 212 CB PHE A 14 -4.217 -6.904 -7.322 1.00 0.00 C ATOM 213 CG PHE A 14 -3.551 -8.049 -6.622 1.00 0.00 C ATOM 214 CD1 PHE A 14 -4.235 -8.801 -5.684 1.00 0.00 C ATOM 215 CD2 PHE A 14 -2.232 -8.362 -6.892 1.00 0.00 C ATOM 216 CE1 PHE A 14 -3.618 -9.848 -5.032 1.00 0.00 C ATOM 217 CE2 PHE A 14 -1.611 -9.406 -6.242 1.00 0.00 C ATOM 218 CZ PHE A 14 -2.305 -10.150 -5.312 1.00 0.00 C ATOM 0 H PHE A 14 -3.175 -7.333 -9.675 1.00 0.00 H new ATOM 0 HA PHE A 14 -5.688 -8.065 -8.333 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -3.460 -6.162 -7.576 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -4.912 -6.428 -6.630 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -5.265 -8.565 -5.459 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -1.683 -7.783 -7.619 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -4.164 -10.429 -4.304 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -0.580 -9.642 -6.461 1.00 0.00 H new ATOM 0 HZ PHE A 14 -1.819 -10.969 -4.803 1.00 0.00 H new ATOM 228 N LYS A 15 -7.005 -6.156 -9.278 1.00 0.00 N ATOM 229 CA LYS A 15 -7.797 -5.046 -9.781 1.00 0.00 C ATOM 230 C LYS A 15 -8.653 -4.465 -8.679 1.00 0.00 C ATOM 231 O LYS A 15 -9.570 -5.129 -8.209 1.00 0.00 O ATOM 232 CB LYS A 15 -8.729 -5.514 -10.886 1.00 0.00 C ATOM 233 CG LYS A 15 -8.040 -5.934 -12.165 1.00 0.00 C ATOM 234 CD LYS A 15 -9.061 -6.239 -13.251 1.00 0.00 C ATOM 235 CE LYS A 15 -10.003 -7.358 -12.826 1.00 0.00 C ATOM 236 NZ LYS A 15 -11.229 -7.413 -13.669 1.00 0.00 N ATOM 0 H LYS A 15 -7.544 -6.993 -9.055 1.00 0.00 H new ATOM 0 HA LYS A 15 -7.104 -4.295 -10.161 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -9.317 -6.354 -10.514 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -9.430 -4.711 -11.115 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -7.371 -5.142 -12.500 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -7.424 -6.814 -11.980 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -9.637 -5.341 -13.474 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -8.546 -6.523 -14.168 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -9.480 -8.313 -12.886 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -10.287 -7.215 -11.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -11.824 -8.210 -13.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -11.761 -6.525 -13.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -10.960 -7.542 -14.665 1.00 0.00 H new ATOM 250 N PRO A 16 -8.394 -3.229 -8.249 1.00 0.00 N ATOM 251 CA PRO A 16 -9.177 -2.623 -7.183 1.00 0.00 C ATOM 252 C PRO A 16 -10.659 -2.572 -7.475 1.00 0.00 C ATOM 253 O PRO A 16 -11.132 -2.758 -8.600 1.00 0.00 O ATOM 254 CB PRO A 16 -8.636 -1.196 -7.090 1.00 0.00 C ATOM 255 CG PRO A 16 -7.290 -1.238 -7.719 1.00 0.00 C ATOM 256 CD PRO A 16 -7.322 -2.352 -8.730 1.00 0.00 C ATOM 0 HA PRO A 16 -9.083 -3.206 -6.267 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -9.289 -0.494 -7.609 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -8.574 -0.867 -6.053 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -7.056 -0.287 -8.198 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -6.518 -1.416 -6.970 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -7.531 -1.977 -9.732 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -6.368 -2.876 -8.778 1.00 0.00 H new ATOM 264 N LEU A 17 -11.355 -2.298 -6.416 1.00 0.00 N ATOM 265 CA LEU A 17 -12.728 -1.893 -6.424 1.00 0.00 C ATOM 266 C LEU A 17 -12.701 -0.395 -6.460 1.00 0.00 C ATOM 267 O LEU A 17 -13.095 0.247 -7.434 1.00 0.00 O ATOM 268 CB LEU A 17 -13.476 -2.408 -5.189 1.00 0.00 C ATOM 269 CG LEU A 17 -13.507 -3.932 -5.036 1.00 0.00 C ATOM 270 CD1 LEU A 17 -14.232 -4.327 -3.760 1.00 0.00 C ATOM 271 CD2 LEU A 17 -14.167 -4.582 -6.245 1.00 0.00 C ATOM 0 H LEU A 17 -10.963 -2.353 -5.476 1.00 0.00 H new ATOM 0 HA LEU A 17 -13.260 -2.307 -7.280 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -13.015 -1.978 -4.299 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -14.502 -2.041 -5.226 1.00 0.00 H new ATOM 0 HG LEU A 17 -12.479 -4.288 -4.974 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -14.243 -5.413 -3.669 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -13.717 -3.897 -2.901 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -15.256 -3.955 -3.793 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -14.178 -5.664 -6.115 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -15.190 -4.217 -6.341 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -13.606 -4.330 -7.145 1.00 0.00 H new ATOM 283 N GLN A 18 -12.245 0.132 -5.342 1.00 0.00 N ATOM 284 CA GLN A 18 -12.169 1.576 -5.133 1.00 0.00 C ATOM 285 C GLN A 18 -11.260 2.196 -6.191 1.00 0.00 C ATOM 286 O GLN A 18 -10.276 1.578 -6.599 1.00 0.00 O ATOM 287 CB GLN A 18 -11.591 1.899 -3.753 1.00 0.00 C ATOM 288 CG GLN A 18 -12.270 1.184 -2.597 1.00 0.00 C ATOM 289 CD GLN A 18 -11.535 1.396 -1.282 1.00 0.00 C ATOM 290 OE1 GLN A 18 -10.917 2.439 -1.059 1.00 0.00 O ATOM 291 NE2 GLN A 18 -11.585 0.408 -0.402 1.00 0.00 N ATOM 0 H GLN A 18 -11.916 -0.421 -4.551 1.00 0.00 H new ATOM 0 HA GLN A 18 -13.178 1.982 -5.205 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -10.532 1.643 -3.749 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -11.660 2.974 -3.588 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -13.295 1.543 -2.501 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -12.325 0.117 -2.813 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -12.106 -0.442 -0.619 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -11.103 0.497 0.492 1.00 0.00 H new ATOM 300 N LYS A 19 -11.584 3.402 -6.636 1.00 0.00 N ATOM 301 CA LYS A 19 -10.724 4.108 -7.574 1.00 0.00 C ATOM 302 C LYS A 19 -9.425 4.516 -6.890 1.00 0.00 C ATOM 303 O LYS A 19 -9.403 4.773 -5.687 1.00 0.00 O ATOM 304 CB LYS A 19 -11.435 5.343 -8.133 1.00 0.00 C ATOM 305 CG LYS A 19 -12.593 5.016 -9.054 1.00 0.00 C ATOM 306 CD LYS A 19 -12.127 4.264 -10.288 1.00 0.00 C ATOM 307 CE LYS A 19 -13.293 3.940 -11.206 1.00 0.00 C ATOM 308 NZ LYS A 19 -14.207 2.919 -10.625 1.00 0.00 N ATOM 0 H LYS A 19 -12.428 3.908 -6.366 1.00 0.00 H new ATOM 0 HA LYS A 19 -10.493 3.438 -8.402 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -11.802 5.947 -7.303 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -10.712 5.953 -8.675 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -13.328 4.416 -8.517 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -13.092 5.937 -9.355 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -11.392 4.863 -10.826 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -11.629 3.342 -9.989 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -13.854 4.851 -11.411 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -12.911 3.580 -12.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -14.917 2.645 -11.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -13.658 2.082 -10.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -14.685 3.316 -9.791 1.00 0.00 H new ATOM 322 N VAL A 20 -8.347 4.583 -7.654 1.00 0.00 N ATOM 323 CA VAL A 20 -7.052 4.905 -7.085 1.00 0.00 C ATOM 324 C VAL A 20 -6.438 6.109 -7.759 1.00 0.00 C ATOM 325 O VAL A 20 -6.744 6.447 -8.904 1.00 0.00 O ATOM 326 CB VAL A 20 -6.065 3.721 -7.153 1.00 0.00 C ATOM 327 CG1 VAL A 20 -5.442 3.578 -8.535 1.00 0.00 C ATOM 328 CG2 VAL A 20 -5.007 3.831 -6.071 1.00 0.00 C ATOM 0 H VAL A 20 -8.344 4.420 -8.661 1.00 0.00 H new ATOM 0 HA VAL A 20 -7.235 5.134 -6.035 1.00 0.00 H new ATOM 0 HB VAL A 20 -6.635 2.810 -6.969 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -4.754 2.733 -8.538 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -6.227 3.410 -9.272 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -4.899 4.489 -8.785 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -4.325 2.984 -6.142 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -4.449 4.758 -6.201 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -5.486 3.830 -5.092 1.00 0.00 H new ATOM 338 N ASP A 21 -5.571 6.736 -7.014 1.00 0.00 N ATOM 339 CA ASP A 21 -4.888 7.933 -7.424 1.00 0.00 C ATOM 340 C ASP A 21 -3.395 7.702 -7.409 1.00 0.00 C ATOM 341 O ASP A 21 -2.590 8.626 -7.530 1.00 0.00 O ATOM 342 CB ASP A 21 -5.238 9.017 -6.434 1.00 0.00 C ATOM 343 CG ASP A 21 -4.815 8.665 -5.017 1.00 0.00 C ATOM 344 OD1 ASP A 21 -5.457 7.783 -4.401 1.00 0.00 O ATOM 345 OD2 ASP A 21 -3.838 9.253 -4.512 1.00 0.00 O ATOM 0 H ASP A 21 -5.312 6.421 -6.079 1.00 0.00 H new ATOM 0 HA ASP A 21 -5.186 8.216 -8.433 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -4.757 9.948 -6.733 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -6.314 9.192 -6.456 1.00 0.00 H new ATOM 350 N LEU A 22 -3.043 6.446 -7.295 1.00 0.00 N ATOM 351 CA LEU A 22 -1.663 6.052 -7.093 1.00 0.00 C ATOM 352 C LEU A 22 -0.931 5.805 -8.409 1.00 0.00 C ATOM 353 O LEU A 22 -1.474 6.043 -9.493 1.00 0.00 O ATOM 354 CB LEU A 22 -1.623 4.829 -6.189 1.00 0.00 C ATOM 355 CG LEU A 22 -2.099 5.101 -4.760 1.00 0.00 C ATOM 356 CD1 LEU A 22 -2.218 3.810 -3.974 1.00 0.00 C ATOM 357 CD2 LEU A 22 -1.151 6.062 -4.061 1.00 0.00 C ATOM 0 H LEU A 22 -3.699 5.667 -7.339 1.00 0.00 H new ATOM 0 HA LEU A 22 -1.134 6.874 -6.610 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -2.243 4.046 -6.625 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -0.603 4.447 -6.156 1.00 0.00 H new ATOM 0 HG LEU A 22 -3.087 5.559 -4.811 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -2.558 4.030 -2.962 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -2.936 3.151 -4.463 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -1.246 3.319 -3.931 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -1.503 6.246 -3.046 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -0.152 5.627 -4.026 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -1.117 7.003 -4.609 1.00 0.00 H new ATOM 369 N LYS A 23 0.306 5.338 -8.310 1.00 0.00 N ATOM 370 CA LYS A 23 1.199 5.270 -9.451 1.00 0.00 C ATOM 371 C LYS A 23 1.121 3.912 -10.132 1.00 0.00 C ATOM 372 O LYS A 23 0.261 3.096 -9.811 1.00 0.00 O ATOM 373 CB LYS A 23 2.629 5.514 -8.970 1.00 0.00 C ATOM 374 CG LYS A 23 2.768 6.727 -8.067 1.00 0.00 C ATOM 375 CD LYS A 23 4.146 6.787 -7.428 1.00 0.00 C ATOM 376 CE LYS A 23 4.194 7.810 -6.308 1.00 0.00 C ATOM 377 NZ LYS A 23 3.208 7.504 -5.235 1.00 0.00 N ATOM 0 H LYS A 23 0.714 4.998 -7.439 1.00 0.00 H new ATOM 0 HA LYS A 23 0.902 6.029 -10.174 1.00 0.00 H new ATOM 0 HB2 LYS A 23 2.979 4.631 -8.435 1.00 0.00 H new ATOM 0 HB3 LYS A 23 3.278 5.640 -9.836 1.00 0.00 H new ATOM 0 HG2 LYS A 23 2.593 7.635 -8.645 1.00 0.00 H new ATOM 0 HG3 LYS A 23 2.005 6.693 -7.289 1.00 0.00 H new ATOM 0 HD2 LYS A 23 4.410 5.805 -7.037 1.00 0.00 H new ATOM 0 HD3 LYS A 23 4.889 7.039 -8.185 1.00 0.00 H new ATOM 0 HE2 LYS A 23 5.197 7.836 -5.883 1.00 0.00 H new ATOM 0 HE3 LYS A 23 3.994 8.802 -6.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 3.416 8.084 -4.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 2.248 7.717 -5.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 3.270 6.497 -4.983 1.00 0.00 H new ATOM 391 N GLU A 24 2.002 3.695 -11.097 1.00 0.00 N ATOM 392 CA GLU A 24 2.266 2.363 -11.596 1.00 0.00 C ATOM 393 C GLU A 24 3.442 1.805 -10.821 1.00 0.00 C ATOM 394 O GLU A 24 3.917 2.490 -9.918 1.00 0.00 O ATOM 395 CB GLU A 24 2.511 2.358 -13.111 1.00 0.00 C ATOM 396 CG GLU A 24 2.973 3.681 -13.692 1.00 0.00 C ATOM 397 CD GLU A 24 4.401 4.020 -13.332 1.00 0.00 C ATOM 398 OE1 GLU A 24 5.325 3.471 -13.969 1.00 0.00 O ATOM 399 OE2 GLU A 24 4.607 4.843 -12.420 1.00 0.00 O ATOM 0 H GLU A 24 2.546 4.430 -11.549 1.00 0.00 H new ATOM 0 HA GLU A 24 1.394 1.727 -11.445 1.00 0.00 H new ATOM 0 HB2 GLU A 24 3.258 1.598 -13.340 1.00 0.00 H new ATOM 0 HB3 GLU A 24 1.589 2.061 -13.612 1.00 0.00 H new ATOM 0 HG2 GLU A 24 2.876 3.648 -14.777 1.00 0.00 H new ATOM 0 HG3 GLU A 24 2.317 4.476 -13.337 1.00 0.00 H new ATOM 406 N GLY A 25 3.988 0.661 -11.262 1.00 0.00 N ATOM 407 CA GLY A 25 4.676 -0.286 -10.381 1.00 0.00 C ATOM 408 C GLY A 25 5.184 0.307 -9.096 1.00 0.00 C ATOM 409 O GLY A 25 6.380 0.482 -8.869 1.00 0.00 O ATOM 0 H GLY A 25 3.963 0.370 -12.239 1.00 0.00 H new ATOM 0 HA2 GLY A 25 3.994 -1.102 -10.144 1.00 0.00 H new ATOM 0 HA3 GLY A 25 5.517 -0.720 -10.922 1.00 0.00 H new ATOM 413 N GLU A 26 4.202 0.592 -8.262 1.00 0.00 N ATOM 414 CA GLU A 26 4.388 1.039 -6.909 1.00 0.00 C ATOM 415 C GLU A 26 4.271 -0.174 -5.988 1.00 0.00 C ATOM 416 O GLU A 26 3.425 -1.040 -6.215 1.00 0.00 O ATOM 417 CB GLU A 26 3.323 2.103 -6.606 1.00 0.00 C ATOM 418 CG GLU A 26 3.705 3.033 -5.483 1.00 0.00 C ATOM 419 CD GLU A 26 2.717 4.171 -5.273 1.00 0.00 C ATOM 420 OE1 GLU A 26 1.746 4.290 -6.049 1.00 0.00 O ATOM 421 OE2 GLU A 26 2.929 4.974 -4.335 1.00 0.00 O ATOM 0 H GLU A 26 3.220 0.513 -8.525 1.00 0.00 H new ATOM 0 HA GLU A 26 5.369 1.489 -6.755 1.00 0.00 H new ATOM 0 HB2 GLU A 26 3.140 2.689 -7.506 1.00 0.00 H new ATOM 0 HB3 GLU A 26 2.386 1.606 -6.353 1.00 0.00 H new ATOM 0 HG2 GLU A 26 3.788 2.460 -4.560 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.690 3.451 -5.688 1.00 0.00 H new ATOM 428 N ARG A 27 5.121 -0.245 -4.971 1.00 0.00 N ATOM 429 CA ARG A 27 5.292 -1.474 -4.201 1.00 0.00 C ATOM 430 C ARG A 27 4.405 -1.511 -2.966 1.00 0.00 C ATOM 431 O ARG A 27 4.404 -0.592 -2.137 1.00 0.00 O ATOM 432 CB ARG A 27 6.758 -1.622 -3.820 1.00 0.00 C ATOM 433 CG ARG A 27 7.166 -3.000 -3.329 1.00 0.00 C ATOM 434 CD ARG A 27 8.681 -3.099 -3.256 1.00 0.00 C ATOM 435 NE ARG A 27 9.153 -4.455 -2.981 1.00 0.00 N ATOM 436 CZ ARG A 27 10.388 -4.879 -3.267 1.00 0.00 C ATOM 437 NH1 ARG A 27 11.277 -4.039 -3.794 1.00 0.00 N ATOM 438 NH2 ARG A 27 10.742 -6.127 -3.000 1.00 0.00 N ATOM 0 H ARG A 27 5.703 0.533 -4.659 1.00 0.00 H new ATOM 0 HA ARG A 27 4.985 -2.314 -4.825 1.00 0.00 H new ATOM 0 HB2 ARG A 27 7.369 -1.368 -4.686 1.00 0.00 H new ATOM 0 HB3 ARG A 27 6.989 -0.894 -3.042 1.00 0.00 H new ATOM 0 HG2 ARG A 27 6.733 -3.188 -2.346 1.00 0.00 H new ATOM 0 HG3 ARG A 27 6.775 -3.765 -4.000 1.00 0.00 H new ATOM 0 HD2 ARG A 27 9.108 -2.756 -4.199 1.00 0.00 H new ATOM 0 HD3 ARG A 27 9.046 -2.428 -2.478 1.00 0.00 H new ATOM 0 HE ARG A 27 8.505 -5.113 -2.548 1.00 0.00 H new ATOM 0 HH11 ARG A 27 11.016 -3.071 -3.980 1.00 0.00 H new ATOM 0 HH12 ARG A 27 12.219 -4.364 -4.012 1.00 0.00 H new ATOM 0 HH21 ARG A 27 10.072 -6.767 -2.575 1.00 0.00 H new ATOM 0 HH22 ARG A 27 11.685 -6.448 -3.219 1.00 0.00 H new ATOM 452 N VAL A 28 3.678 -2.603 -2.846 1.00 0.00 N ATOM 453 CA VAL A 28 2.674 -2.763 -1.799 1.00 0.00 C ATOM 454 C VAL A 28 2.584 -4.209 -1.319 1.00 0.00 C ATOM 455 O VAL A 28 3.171 -5.113 -1.924 1.00 0.00 O ATOM 456 CB VAL A 28 1.280 -2.336 -2.290 1.00 0.00 C ATOM 457 CG1 VAL A 28 1.211 -0.836 -2.501 1.00 0.00 C ATOM 458 CG2 VAL A 28 0.918 -3.077 -3.566 1.00 0.00 C ATOM 0 H VAL A 28 3.762 -3.407 -3.468 1.00 0.00 H new ATOM 0 HA VAL A 28 2.990 -2.124 -0.975 1.00 0.00 H new ATOM 0 HB VAL A 28 0.554 -2.597 -1.520 1.00 0.00 H new ATOM 0 HG11 VAL A 28 0.214 -0.563 -2.848 1.00 0.00 H new ATOM 0 HG12 VAL A 28 1.420 -0.326 -1.561 1.00 0.00 H new ATOM 0 HG13 VAL A 28 1.949 -0.539 -3.246 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -0.071 -2.764 -3.901 1.00 0.00 H new ATOM 0 HG22 VAL A 28 1.652 -2.850 -4.339 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.913 -4.150 -3.375 1.00 0.00 H new ATOM 468 N LYS A 29 1.818 -4.417 -0.246 1.00 0.00 N ATOM 469 CA LYS A 29 1.595 -5.730 0.320 1.00 0.00 C ATOM 470 C LYS A 29 0.099 -5.945 0.473 1.00 0.00 C ATOM 471 O LYS A 29 -0.633 -5.040 0.884 1.00 0.00 O ATOM 472 CB LYS A 29 2.272 -5.853 1.677 1.00 0.00 C ATOM 473 CG LYS A 29 3.789 -5.742 1.636 1.00 0.00 C ATOM 474 CD LYS A 29 4.386 -5.985 3.004 1.00 0.00 C ATOM 475 CE LYS A 29 5.819 -5.474 3.097 1.00 0.00 C ATOM 476 NZ LYS A 29 6.789 -6.302 2.326 1.00 0.00 N ATOM 0 H LYS A 29 1.336 -3.668 0.251 1.00 0.00 H new ATOM 0 HA LYS A 29 2.020 -6.484 -0.342 1.00 0.00 H new ATOM 0 HB2 LYS A 29 1.881 -5.078 2.336 1.00 0.00 H new ATOM 0 HB3 LYS A 29 2.002 -6.812 2.118 1.00 0.00 H new ATOM 0 HG2 LYS A 29 4.191 -6.465 0.926 1.00 0.00 H new ATOM 0 HG3 LYS A 29 4.076 -4.752 1.281 1.00 0.00 H new ATOM 0 HD2 LYS A 29 3.775 -5.492 3.760 1.00 0.00 H new ATOM 0 HD3 LYS A 29 4.366 -7.052 3.225 1.00 0.00 H new ATOM 0 HE2 LYS A 29 5.856 -4.448 2.732 1.00 0.00 H new ATOM 0 HE3 LYS A 29 6.122 -5.451 4.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 7.754 -5.955 2.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 6.719 -7.294 2.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 6.572 -6.236 1.311 1.00 0.00 H new ATOM 490 N ILE A 30 -0.345 -7.137 0.153 1.00 0.00 N ATOM 491 CA ILE A 30 -1.770 -7.427 0.075 1.00 0.00 C ATOM 492 C ILE A 30 -2.160 -8.508 1.066 1.00 0.00 C ATOM 493 O ILE A 30 -1.497 -9.530 1.164 1.00 0.00 O ATOM 494 CB ILE A 30 -2.199 -7.910 -1.327 1.00 0.00 C ATOM 495 CG1 ILE A 30 -1.163 -7.570 -2.409 1.00 0.00 C ATOM 496 CG2 ILE A 30 -3.546 -7.307 -1.682 1.00 0.00 C ATOM 497 CD1 ILE A 30 -1.092 -6.101 -2.774 1.00 0.00 C ATOM 0 H ILE A 30 0.259 -7.931 -0.060 1.00 0.00 H new ATOM 0 HA ILE A 30 -2.274 -6.488 0.304 1.00 0.00 H new ATOM 0 HB ILE A 30 -2.275 -8.997 -1.292 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -0.180 -7.894 -2.067 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -1.393 -8.143 -3.307 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -3.848 -7.649 -2.672 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -4.289 -7.619 -0.948 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -3.470 -6.220 -1.681 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -0.335 -5.954 -3.544 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -2.061 -5.772 -3.150 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -0.829 -5.519 -1.891 1.00 0.00 H new ATOM 509 N LYS A 31 -3.243 -8.284 1.776 1.00 0.00 N ATOM 510 CA LYS A 31 -3.756 -9.251 2.718 1.00 0.00 C ATOM 511 C LYS A 31 -5.050 -9.836 2.207 1.00 0.00 C ATOM 512 O LYS A 31 -5.810 -9.175 1.510 1.00 0.00 O ATOM 513 CB LYS A 31 -3.989 -8.609 4.075 1.00 0.00 C ATOM 514 CG LYS A 31 -2.714 -8.308 4.824 1.00 0.00 C ATOM 515 CD LYS A 31 -2.991 -7.617 6.144 1.00 0.00 C ATOM 516 CE LYS A 31 -1.714 -7.062 6.749 1.00 0.00 C ATOM 517 NZ LYS A 31 -1.163 -5.950 5.934 1.00 0.00 N ATOM 0 H LYS A 31 -3.792 -7.427 1.716 1.00 0.00 H new ATOM 0 HA LYS A 31 -3.017 -10.045 2.828 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -4.549 -7.684 3.939 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -4.609 -9.271 4.680 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -2.171 -9.235 5.005 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -2.071 -7.677 4.210 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -3.706 -6.809 5.992 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -3.449 -8.322 6.838 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -1.913 -6.709 7.761 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -0.973 -7.857 6.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -0.529 -5.371 6.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -0.631 -6.340 5.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -1.943 -5.360 5.580 1.00 0.00 H new ATOM 531 N LEU A 32 -5.287 -11.071 2.560 1.00 0.00 N ATOM 532 CA LEU A 32 -6.461 -11.784 2.096 1.00 0.00 C ATOM 533 C LEU A 32 -7.521 -11.849 3.186 1.00 0.00 C ATOM 534 O LEU A 32 -7.200 -11.906 4.375 1.00 0.00 O ATOM 535 CB LEU A 32 -6.073 -13.196 1.663 1.00 0.00 C ATOM 536 CG LEU A 32 -5.444 -13.327 0.270 1.00 0.00 C ATOM 537 CD1 LEU A 32 -6.489 -13.114 -0.811 1.00 0.00 C ATOM 538 CD2 LEU A 32 -4.280 -12.361 0.081 1.00 0.00 C ATOM 0 H LEU A 32 -4.680 -11.614 3.173 1.00 0.00 H new ATOM 0 HA LEU A 32 -6.877 -11.246 1.244 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -5.373 -13.599 2.395 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -6.965 -13.822 1.697 1.00 0.00 H new ATOM 0 HG LEU A 32 -5.050 -14.340 0.185 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -6.023 -13.211 -1.792 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -7.276 -13.861 -0.708 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -6.919 -12.117 -0.710 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -3.862 -12.486 -0.918 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -4.634 -11.337 0.201 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -3.510 -12.569 0.824 1.00 0.00 H new ATOM 606 N VAL A 36 -14.302 -19.261 7.929 1.00 0.00 N ATOM 607 CA VAL A 36 -14.176 -20.012 9.166 1.00 0.00 C ATOM 608 C VAL A 36 -13.160 -21.134 8.972 1.00 0.00 C ATOM 609 O VAL A 36 -13.020 -21.658 7.862 1.00 0.00 O ATOM 610 CB VAL A 36 -15.534 -20.606 9.602 1.00 0.00 C ATOM 611 CG1 VAL A 36 -15.426 -21.293 10.960 1.00 0.00 C ATOM 612 CG2 VAL A 36 -16.610 -19.535 9.630 1.00 0.00 C ATOM 0 HA VAL A 36 -13.839 -19.334 9.950 1.00 0.00 H new ATOM 0 HB VAL A 36 -15.817 -21.358 8.866 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -16.397 -21.701 11.240 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -14.696 -22.101 10.902 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -15.107 -20.569 11.710 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -17.556 -19.978 9.940 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -16.327 -18.753 10.335 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -16.720 -19.104 8.635 1.00 0.00 H new ATOM 622 N GLU A 37 -12.444 -21.486 10.033 1.00 0.00 N ATOM 623 CA GLU A 37 -11.440 -22.528 9.975 1.00 0.00 C ATOM 624 C GLU A 37 -12.076 -23.880 9.650 1.00 0.00 C ATOM 625 O GLU A 37 -13.227 -24.132 10.015 1.00 0.00 O ATOM 626 CB GLU A 37 -10.679 -22.567 11.299 1.00 0.00 C ATOM 627 CG GLU A 37 -11.563 -22.747 12.521 1.00 0.00 C ATOM 628 CD GLU A 37 -10.801 -22.547 13.813 1.00 0.00 C ATOM 629 OE1 GLU A 37 -9.765 -23.218 14.010 1.00 0.00 O ATOM 630 OE2 GLU A 37 -11.226 -21.713 14.638 1.00 0.00 O ATOM 0 H GLU A 37 -12.546 -21.056 10.952 1.00 0.00 H new ATOM 0 HA GLU A 37 -10.735 -22.308 9.174 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -9.955 -23.381 11.265 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -10.113 -21.642 11.407 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -12.390 -22.039 12.476 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -11.998 -23.746 12.509 1.00 0.00 H new ATOM 637 N PRO A 38 -11.339 -24.753 8.939 1.00 0.00 N ATOM 638 CA PRO A 38 -11.862 -26.035 8.449 1.00 0.00 C ATOM 639 C PRO A 38 -12.223 -27.018 9.562 1.00 0.00 C ATOM 640 O PRO A 38 -12.247 -26.675 10.743 1.00 0.00 O ATOM 641 CB PRO A 38 -10.715 -26.603 7.603 1.00 0.00 C ATOM 642 CG PRO A 38 -9.808 -25.451 7.341 1.00 0.00 C ATOM 643 CD PRO A 38 -9.941 -24.552 8.533 1.00 0.00 C ATOM 0 HA PRO A 38 -12.792 -25.884 7.901 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -10.194 -27.401 8.133 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -11.088 -27.029 6.672 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -8.778 -25.784 7.215 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -10.089 -24.931 6.425 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -9.246 -24.827 9.326 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -9.739 -23.511 8.279 1.00 0.00 H new ATOM 651 N ILE A 39 -12.489 -28.252 9.164 1.00 0.00 N ATOM 652 CA ILE A 39 -12.943 -29.285 10.085 1.00 0.00 C ATOM 653 C ILE A 39 -11.763 -30.137 10.545 1.00 0.00 C ATOM 654 O ILE A 39 -10.755 -30.237 9.846 1.00 0.00 O ATOM 655 CB ILE A 39 -14.009 -30.194 9.423 1.00 0.00 C ATOM 656 CG1 ILE A 39 -15.068 -29.340 8.718 1.00 0.00 C ATOM 657 CG2 ILE A 39 -14.668 -31.101 10.458 1.00 0.00 C ATOM 658 CD1 ILE A 39 -16.109 -30.148 7.968 1.00 0.00 C ATOM 0 H ILE A 39 -12.397 -28.566 8.198 1.00 0.00 H new ATOM 0 HA ILE A 39 -13.393 -28.791 10.946 1.00 0.00 H new ATOM 0 HB ILE A 39 -13.511 -30.823 8.685 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -15.570 -28.717 9.458 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -14.572 -28.667 8.019 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -15.413 -31.730 9.969 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -13.911 -31.731 10.924 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -15.152 -30.491 11.221 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -16.823 -29.473 7.496 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -15.620 -30.751 7.203 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -16.634 -30.802 8.665 1.00 0.00 H new ATOM 670 N ASP A 40 -11.891 -30.735 11.722 1.00 0.00 N ATOM 671 CA ASP A 40 -10.845 -31.583 12.285 1.00 0.00 C ATOM 672 C ASP A 40 -11.236 -33.056 12.113 1.00 0.00 C ATOM 673 O ASP A 40 -11.975 -33.399 11.188 1.00 0.00 O ATOM 674 CB ASP A 40 -10.641 -31.230 13.771 1.00 0.00 C ATOM 675 CG ASP A 40 -9.295 -31.675 14.325 1.00 0.00 C ATOM 676 OD1 ASP A 40 -9.182 -32.832 14.782 1.00 0.00 O ATOM 677 OD2 ASP A 40 -8.351 -30.860 14.326 1.00 0.00 O ATOM 0 H ASP A 40 -12.718 -30.648 12.312 1.00 0.00 H new ATOM 0 HA ASP A 40 -9.904 -31.414 11.762 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -10.737 -30.151 13.896 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -11.436 -31.691 14.357 1.00 0.00 H new ATOM 682 N LEU A 41 -10.733 -33.920 12.983 1.00 0.00 N ATOM 683 CA LEU A 41 -11.066 -35.336 12.947 1.00 0.00 C ATOM 684 C LEU A 41 -12.520 -35.542 13.358 1.00 0.00 C ATOM 685 O LEU A 41 -13.058 -34.786 14.172 1.00 0.00 O ATOM 686 CB LEU A 41 -10.135 -36.120 13.881 1.00 0.00 C ATOM 687 CG LEU A 41 -10.348 -37.637 13.904 1.00 0.00 C ATOM 688 CD1 LEU A 41 -10.044 -38.245 12.545 1.00 0.00 C ATOM 689 CD2 LEU A 41 -9.491 -38.278 14.982 1.00 0.00 C ATOM 0 H LEU A 41 -10.087 -33.661 13.729 1.00 0.00 H new ATOM 0 HA LEU A 41 -10.933 -35.704 11.930 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -9.104 -35.920 13.589 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -10.260 -35.738 14.894 1.00 0.00 H new ATOM 0 HG LEU A 41 -11.395 -37.832 14.136 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -10.202 -39.323 12.585 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -10.704 -37.809 11.795 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -9.007 -38.040 12.278 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -9.655 -39.356 14.984 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -8.440 -38.071 14.782 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -9.763 -37.868 15.955 1.00 0.00 H new ATOM 701 N GLY A 42 -13.151 -36.554 12.783 1.00 0.00 N ATOM 702 CA GLY A 42 -14.538 -36.845 13.087 1.00 0.00 C ATOM 703 C GLY A 42 -14.707 -37.622 14.372 1.00 0.00 C ATOM 704 O GLY A 42 -14.438 -37.114 15.465 1.00 0.00 O ATOM 0 H GLY A 42 -12.723 -37.185 12.105 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -15.093 -35.910 13.158 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -14.974 -37.413 12.265 1.00 0.00 H new ATOM 708 N GLU A 43 -15.168 -38.846 14.232 1.00 0.00 N ATOM 709 CA GLU A 43 -15.398 -39.724 15.362 1.00 0.00 C ATOM 710 C GLU A 43 -14.089 -40.051 16.084 1.00 0.00 C ATOM 711 O GLU A 43 -13.042 -40.216 15.453 1.00 0.00 O ATOM 712 CB GLU A 43 -16.104 -41.011 14.908 1.00 0.00 C ATOM 713 CG GLU A 43 -15.442 -41.724 13.730 1.00 0.00 C ATOM 714 CD GLU A 43 -15.794 -41.115 12.384 1.00 0.00 C ATOM 715 OE1 GLU A 43 -16.819 -41.518 11.793 1.00 0.00 O ATOM 716 OE2 GLU A 43 -15.041 -40.241 11.905 1.00 0.00 O ATOM 0 H GLU A 43 -15.395 -39.263 13.329 1.00 0.00 H new ATOM 0 HA GLU A 43 -16.046 -39.203 16.067 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -16.151 -41.700 15.751 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -17.132 -40.769 14.637 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -14.360 -41.699 13.861 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -15.739 -42.773 13.735 1.00 0.00 H new ATOM 723 N PRO A 44 -14.134 -40.122 17.422 1.00 0.00 N ATOM 724 CA PRO A 44 -12.952 -40.398 18.243 1.00 0.00 C ATOM 725 C PRO A 44 -12.434 -41.823 18.065 1.00 0.00 C ATOM 726 O PRO A 44 -13.179 -42.726 17.671 1.00 0.00 O ATOM 727 CB PRO A 44 -13.443 -40.192 19.682 1.00 0.00 C ATOM 728 CG PRO A 44 -14.768 -39.516 19.565 1.00 0.00 C ATOM 729 CD PRO A 44 -15.335 -39.943 18.246 1.00 0.00 C ATOM 0 HA PRO A 44 -12.119 -39.752 17.967 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -13.534 -41.144 20.204 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -12.741 -39.582 20.251 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -15.427 -39.804 20.384 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -14.658 -38.432 19.610 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -15.909 -40.866 18.331 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -16.003 -39.189 17.829 1.00 0.00 H new ATOM 737 N VAL A 45 -11.156 -42.023 18.371 1.00 0.00 N ATOM 738 CA VAL A 45 -10.544 -43.337 18.248 1.00 0.00 C ATOM 739 C VAL A 45 -11.101 -44.268 19.319 1.00 0.00 C ATOM 740 O VAL A 45 -11.472 -43.830 20.408 1.00 0.00 O ATOM 741 CB VAL A 45 -9.010 -43.279 18.378 1.00 0.00 C ATOM 742 CG1 VAL A 45 -8.376 -44.571 17.879 1.00 0.00 C ATOM 743 CG2 VAL A 45 -8.443 -42.077 17.636 1.00 0.00 C ATOM 0 H VAL A 45 -10.527 -41.293 18.705 1.00 0.00 H new ATOM 0 HA VAL A 45 -10.783 -43.714 17.254 1.00 0.00 H new ATOM 0 HB VAL A 45 -8.767 -43.166 19.435 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -7.293 -44.507 17.980 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -8.747 -45.410 18.468 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -8.634 -44.722 16.831 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -7.359 -42.061 17.745 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.701 -42.147 16.579 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -8.863 -41.161 18.052 1.00 0.00 H new ATOM 753 N SER A 46 -11.169 -45.542 18.996 1.00 0.00 N ATOM 754 CA SER A 46 -11.757 -46.527 19.872 1.00 0.00 C ATOM 755 C SER A 46 -10.721 -47.565 20.296 1.00 0.00 C ATOM 756 O SER A 46 -9.521 -47.394 20.056 1.00 0.00 O ATOM 757 CB SER A 46 -12.918 -47.186 19.135 1.00 0.00 C ATOM 758 OG SER A 46 -13.854 -46.210 18.702 1.00 0.00 O ATOM 0 H SER A 46 -10.817 -45.922 18.117 1.00 0.00 H new ATOM 0 HA SER A 46 -12.120 -46.047 20.781 1.00 0.00 H new ATOM 0 HB2 SER A 46 -12.542 -47.743 18.277 1.00 0.00 H new ATOM 0 HB3 SER A 46 -13.411 -47.905 19.790 1.00 0.00 H new ATOM 0 HG SER A 46 -14.591 -46.650 18.230 1.00 0.00 H new ATOM 764 N VAL A 47 -11.184 -48.622 20.949 1.00 0.00 N ATOM 765 CA VAL A 47 -10.309 -49.707 21.371 1.00 0.00 C ATOM 766 C VAL A 47 -9.872 -50.528 20.159 1.00 0.00 C ATOM 767 O VAL A 47 -10.627 -50.663 19.192 1.00 0.00 O ATOM 768 CB VAL A 47 -11.012 -50.625 22.399 1.00 0.00 C ATOM 769 CG1 VAL A 47 -10.051 -51.672 22.949 1.00 0.00 C ATOM 770 CG2 VAL A 47 -11.606 -49.801 23.532 1.00 0.00 C ATOM 0 H VAL A 47 -12.164 -48.751 21.199 1.00 0.00 H new ATOM 0 HA VAL A 47 -9.433 -49.268 21.848 1.00 0.00 H new ATOM 0 HB VAL A 47 -11.820 -51.146 21.886 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -10.573 -52.302 23.669 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -9.677 -52.288 22.131 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -9.215 -51.175 23.441 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -12.096 -50.463 24.245 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -10.812 -49.249 24.036 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -12.336 -49.099 23.128 1.00 0.00 H new ATOM 780 N GLU A 48 -8.655 -51.061 20.204 1.00 0.00 N ATOM 781 CA GLU A 48 -8.112 -51.812 19.085 1.00 0.00 C ATOM 782 C GLU A 48 -8.680 -53.224 19.023 1.00 0.00 C ATOM 783 O GLU A 48 -9.330 -53.697 19.959 1.00 0.00 O ATOM 784 CB GLU A 48 -6.587 -51.855 19.156 1.00 0.00 C ATOM 785 CG GLU A 48 -5.930 -50.522 18.833 1.00 0.00 C ATOM 786 CD GLU A 48 -6.175 -50.092 17.397 1.00 0.00 C ATOM 787 OE1 GLU A 48 -7.276 -49.584 17.098 1.00 0.00 O ATOM 788 OE2 GLU A 48 -5.267 -50.267 16.557 1.00 0.00 O ATOM 0 H GLU A 48 -8.028 -50.985 21.005 1.00 0.00 H new ATOM 0 HA GLU A 48 -8.408 -51.296 18.172 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -6.286 -52.167 20.156 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -6.219 -52.611 18.462 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -6.313 -49.758 19.509 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -4.857 -50.596 19.010 1.00 0.00 H new ATOM 795 N GLU A 49 -8.397 -53.893 17.919 1.00 0.00 N ATOM 796 CA GLU A 49 -9.009 -55.174 17.594 1.00 0.00 C ATOM 797 C GLU A 49 -8.497 -56.297 18.492 1.00 0.00 C ATOM 798 O GLU A 49 -9.178 -57.300 18.700 1.00 0.00 O ATOM 799 CB GLU A 49 -8.723 -55.524 16.133 1.00 0.00 C ATOM 800 CG GLU A 49 -8.870 -54.349 15.175 1.00 0.00 C ATOM 801 CD GLU A 49 -10.241 -53.702 15.222 1.00 0.00 C ATOM 802 OE1 GLU A 49 -11.184 -54.241 14.600 1.00 0.00 O ATOM 803 OE2 GLU A 49 -10.383 -52.647 15.869 1.00 0.00 O ATOM 0 H GLU A 49 -7.733 -53.563 17.218 1.00 0.00 H new ATOM 0 HA GLU A 49 -10.082 -55.077 17.758 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -7.710 -55.918 16.056 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -9.399 -56.320 15.822 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -8.114 -53.600 15.412 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -8.672 -54.691 14.159 1.00 0.00 H new ATOM 810 N ILE A 50 -7.295 -56.118 19.020 1.00 0.00 N ATOM 811 CA ILE A 50 -6.593 -57.182 19.739 1.00 0.00 C ATOM 812 C ILE A 50 -7.257 -57.533 21.077 1.00 0.00 C ATOM 813 O ILE A 50 -6.958 -58.568 21.678 1.00 0.00 O ATOM 814 CB ILE A 50 -5.112 -56.803 19.972 1.00 0.00 C ATOM 815 CG1 ILE A 50 -4.309 -58.014 20.472 1.00 0.00 C ATOM 816 CG2 ILE A 50 -5.006 -55.644 20.958 1.00 0.00 C ATOM 817 CD1 ILE A 50 -2.838 -57.732 20.683 1.00 0.00 C ATOM 0 H ILE A 50 -6.778 -55.240 18.965 1.00 0.00 H new ATOM 0 HA ILE A 50 -6.647 -58.068 19.106 1.00 0.00 H new ATOM 0 HB ILE A 50 -4.688 -56.486 19.019 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -4.740 -58.360 21.411 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -4.413 -58.828 19.754 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.957 -55.391 21.110 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -5.534 -54.778 20.560 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -5.451 -55.934 21.910 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -2.341 -58.636 21.036 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -2.389 -57.416 19.741 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -2.722 -56.941 21.424 1.00 0.00 H new ATOM 829 N LYS A 51 -8.166 -56.696 21.539 1.00 0.00 N ATOM 830 CA LYS A 51 -8.806 -56.939 22.826 1.00 0.00 C ATOM 831 C LYS A 51 -9.951 -57.935 22.680 1.00 0.00 C ATOM 832 O LYS A 51 -10.793 -57.811 21.786 1.00 0.00 O ATOM 833 CB LYS A 51 -9.313 -55.637 23.447 1.00 0.00 C ATOM 834 CG LYS A 51 -9.987 -55.840 24.795 1.00 0.00 C ATOM 835 CD LYS A 51 -10.263 -54.524 25.496 1.00 0.00 C ATOM 836 CE LYS A 51 -10.926 -54.749 26.846 1.00 0.00 C ATOM 837 NZ LYS A 51 -10.167 -55.712 27.695 1.00 0.00 N ATOM 0 H LYS A 51 -8.477 -55.854 21.055 1.00 0.00 H new ATOM 0 HA LYS A 51 -8.056 -57.364 23.493 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -8.476 -54.949 23.566 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -10.018 -55.166 22.762 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -10.924 -56.379 24.654 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -9.353 -56.462 25.427 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -9.329 -53.979 25.633 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -10.906 -53.904 24.871 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -11.013 -53.797 27.369 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -11.939 -55.122 26.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -10.488 -55.633 28.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -10.332 -56.680 27.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -9.151 -55.495 27.643 1.00 0.00 H new ATOM 1211 N ILE B 4 0.265 -12.828 2.867 1.00 0.00 N ATOM 1212 CA ILE B 4 0.248 -11.584 2.155 1.00 0.00 C ATOM 1213 C ILE B 4 1.025 -11.709 0.851 1.00 0.00 C ATOM 1214 O ILE B 4 2.098 -12.314 0.806 1.00 0.00 O ATOM 1215 CB ILE B 4 0.824 -10.428 2.993 1.00 0.00 C ATOM 1216 CG1 ILE B 4 2.270 -10.699 3.422 1.00 0.00 C ATOM 1217 CG2 ILE B 4 -0.056 -10.163 4.207 1.00 0.00 C ATOM 1218 CD1 ILE B 4 2.408 -11.544 4.676 1.00 0.00 C ATOM 0 HA ILE B 4 -0.795 -11.352 1.940 1.00 0.00 H new ATOM 0 HB ILE B 4 0.834 -9.538 2.364 1.00 0.00 H new ATOM 0 HG12 ILE B 4 2.791 -11.198 2.604 1.00 0.00 H new ATOM 0 HG13 ILE B 4 2.772 -9.745 3.585 1.00 0.00 H new ATOM 0 HG21 ILE B 4 0.365 -9.343 4.789 1.00 0.00 H new ATOM 0 HG22 ILE B 4 -1.060 -9.896 3.877 1.00 0.00 H new ATOM 0 HG23 ILE B 4 -0.103 -11.060 4.825 1.00 0.00 H new ATOM 0 HD11 ILE B 4 3.464 -11.685 4.905 1.00 0.00 H new ATOM 0 HD12 ILE B 4 1.920 -11.040 5.510 1.00 0.00 H new ATOM 0 HD13 ILE B 4 1.939 -12.515 4.514 1.00 0.00 H new ATOM 1230 N ILE B 5 0.463 -11.166 -0.214 1.00 0.00 N ATOM 1231 CA ILE B 5 1.138 -11.144 -1.499 1.00 0.00 C ATOM 1232 C ILE B 5 1.782 -9.778 -1.691 1.00 0.00 C ATOM 1233 O ILE B 5 1.407 -8.820 -1.018 1.00 0.00 O ATOM 1234 CB ILE B 5 0.163 -11.429 -2.670 1.00 0.00 C ATOM 1235 CG1 ILE B 5 -0.680 -12.668 -2.368 1.00 0.00 C ATOM 1236 CG2 ILE B 5 0.929 -11.623 -3.972 1.00 0.00 C ATOM 1237 CD1 ILE B 5 -1.662 -13.019 -3.469 1.00 0.00 C ATOM 0 H ILE B 5 -0.461 -10.734 -0.214 1.00 0.00 H new ATOM 0 HA ILE B 5 1.893 -11.930 -1.503 1.00 0.00 H new ATOM 0 HB ILE B 5 -0.498 -10.570 -2.782 1.00 0.00 H new ATOM 0 HG12 ILE B 5 -0.016 -13.516 -2.201 1.00 0.00 H new ATOM 0 HG13 ILE B 5 -1.230 -12.506 -1.441 1.00 0.00 H new ATOM 0 HG21 ILE B 5 0.226 -11.822 -4.781 1.00 0.00 H new ATOM 0 HG22 ILE B 5 1.497 -10.720 -4.198 1.00 0.00 H new ATOM 0 HG23 ILE B 5 1.613 -12.466 -3.870 1.00 0.00 H new ATOM 0 HD11 ILE B 5 -2.225 -13.908 -3.185 1.00 0.00 H new ATOM 0 HD12 ILE B 5 -2.350 -12.188 -3.622 1.00 0.00 H new ATOM 0 HD13 ILE B 5 -1.118 -13.214 -4.393 1.00 0.00 H new ATOM 1249 N GLU B 6 2.754 -9.687 -2.579 1.00 0.00 N ATOM 1250 CA GLU B 6 3.392 -8.416 -2.857 1.00 0.00 C ATOM 1251 C GLU B 6 3.335 -8.120 -4.346 1.00 0.00 C ATOM 1252 O GLU B 6 3.562 -9.010 -5.165 1.00 0.00 O ATOM 1253 CB GLU B 6 4.829 -8.418 -2.349 1.00 0.00 C ATOM 1254 CG GLU B 6 4.917 -8.400 -0.832 1.00 0.00 C ATOM 1255 CD GLU B 6 6.328 -8.215 -0.321 1.00 0.00 C ATOM 1256 OE1 GLU B 6 6.795 -7.057 -0.259 1.00 0.00 O ATOM 1257 OE2 GLU B 6 6.971 -9.217 0.044 1.00 0.00 O ATOM 0 H GLU B 6 3.117 -10.474 -3.117 1.00 0.00 H new ATOM 0 HA GLU B 6 2.855 -7.626 -2.331 1.00 0.00 H new ATOM 0 HB2 GLU B 6 5.342 -9.302 -2.728 1.00 0.00 H new ATOM 0 HB3 GLU B 6 5.352 -7.550 -2.749 1.00 0.00 H new ATOM 0 HG2 GLU B 6 4.289 -7.596 -0.447 1.00 0.00 H new ATOM 0 HG3 GLU B 6 4.515 -9.334 -0.440 1.00 0.00 H new ATOM 1264 N ALA B 7 3.022 -6.879 -4.689 1.00 0.00 N ATOM 1265 CA ALA B 7 2.768 -6.511 -6.074 1.00 0.00 C ATOM 1266 C ALA B 7 3.120 -5.064 -6.346 1.00 0.00 C ATOM 1267 O ALA B 7 3.380 -4.287 -5.423 1.00 0.00 O ATOM 1268 CB ALA B 7 1.300 -6.742 -6.392 1.00 0.00 C ATOM 0 H ALA B 7 2.938 -6.109 -4.026 1.00 0.00 H new ATOM 0 HA ALA B 7 3.399 -7.133 -6.709 1.00 0.00 H new ATOM 0 HB1 ALA B 7 1.105 -6.468 -7.429 1.00 0.00 H new ATOM 0 HB2 ALA B 7 1.057 -7.794 -6.243 1.00 0.00 H new ATOM 0 HB3 ALA B 7 0.684 -6.130 -5.733 1.00 0.00 H new ATOM 1274 N VAL B 8 3.144 -4.728 -7.628 1.00 0.00 N ATOM 1275 CA VAL B 8 3.337 -3.374 -8.068 1.00 0.00 C ATOM 1276 C VAL B 8 2.233 -2.977 -9.053 1.00 0.00 C ATOM 1277 O VAL B 8 1.868 -3.750 -9.931 1.00 0.00 O ATOM 1278 CB VAL B 8 4.718 -3.207 -8.730 1.00 0.00 C ATOM 1279 CG1 VAL B 8 5.830 -3.327 -7.702 1.00 0.00 C ATOM 1280 CG2 VAL B 8 4.920 -4.218 -9.853 1.00 0.00 C ATOM 0 H VAL B 8 3.029 -5.399 -8.388 1.00 0.00 H new ATOM 0 HA VAL B 8 3.290 -2.721 -7.197 1.00 0.00 H new ATOM 0 HB VAL B 8 4.755 -2.208 -9.164 1.00 0.00 H new ATOM 0 HG11 VAL B 8 6.795 -3.206 -8.194 1.00 0.00 H new ATOM 0 HG12 VAL B 8 5.709 -2.553 -6.944 1.00 0.00 H new ATOM 0 HG13 VAL B 8 5.785 -4.308 -7.230 1.00 0.00 H new ATOM 0 HG21 VAL B 8 5.904 -4.074 -10.300 1.00 0.00 H new ATOM 0 HG22 VAL B 8 4.849 -5.228 -9.450 1.00 0.00 H new ATOM 0 HG23 VAL B 8 4.152 -4.076 -10.613 1.00 0.00 H new ATOM 1290 N TYR B 9 1.711 -1.770 -8.896 1.00 0.00 N ATOM 1291 CA TYR B 9 0.659 -1.228 -9.746 1.00 0.00 C ATOM 1292 C TYR B 9 1.068 -1.194 -11.210 1.00 0.00 C ATOM 1293 O TYR B 9 2.236 -1.250 -11.558 1.00 0.00 O ATOM 1294 CB TYR B 9 0.369 0.191 -9.299 1.00 0.00 C ATOM 1295 CG TYR B 9 -0.143 0.342 -7.883 1.00 0.00 C ATOM 1296 CD1 TYR B 9 0.628 -0.048 -6.798 1.00 0.00 C ATOM 1297 CD2 TYR B 9 -1.384 0.908 -7.631 1.00 0.00 C ATOM 1298 CE1 TYR B 9 0.179 0.115 -5.509 1.00 0.00 C ATOM 1299 CE2 TYR B 9 -1.844 1.074 -6.339 1.00 0.00 C ATOM 1300 CZ TYR B 9 -1.055 0.675 -5.281 1.00 0.00 C ATOM 1301 OH TYR B 9 -1.502 0.828 -3.990 1.00 0.00 O ATOM 0 H TYR B 9 2.011 -1.128 -8.162 1.00 0.00 H new ATOM 0 HA TYR B 9 -0.217 -1.870 -9.653 1.00 0.00 H new ATOM 0 HB2 TYR B 9 1.282 0.778 -9.400 1.00 0.00 H new ATOM 0 HB3 TYR B 9 -0.365 0.624 -9.979 1.00 0.00 H new ATOM 0 HD1 TYR B 9 1.599 -0.488 -6.969 1.00 0.00 H new ATOM 0 HD2 TYR B 9 -2.001 1.224 -8.459 1.00 0.00 H new ATOM 0 HE1 TYR B 9 0.794 -0.196 -4.678 1.00 0.00 H new ATOM 0 HE2 TYR B 9 -2.814 1.513 -6.159 1.00 0.00 H new ATOM 0 HH TYR B 9 -1.907 -0.010 -3.683 1.00 0.00 H new ATOM 1311 N GLU B 10 0.083 -1.185 -12.060 1.00 0.00 N ATOM 1312 CA GLU B 10 0.281 -0.963 -13.463 1.00 0.00 C ATOM 1313 C GLU B 10 -0.881 -0.178 -13.987 1.00 0.00 C ATOM 1314 O GLU B 10 -1.961 -0.716 -14.238 1.00 0.00 O ATOM 1315 CB GLU B 10 0.402 -2.275 -14.199 1.00 0.00 C ATOM 1316 CG GLU B 10 0.463 -2.150 -15.713 1.00 0.00 C ATOM 1317 CD GLU B 10 1.714 -1.448 -16.185 1.00 0.00 C ATOM 1318 OE1 GLU B 10 2.820 -1.925 -15.856 1.00 0.00 O ATOM 1319 OE2 GLU B 10 1.597 -0.410 -16.872 1.00 0.00 O ATOM 0 H GLU B 10 -0.891 -1.333 -11.796 1.00 0.00 H new ATOM 0 HA GLU B 10 1.206 -0.409 -13.619 1.00 0.00 H new ATOM 0 HB2 GLU B 10 1.299 -2.788 -13.854 1.00 0.00 H new ATOM 0 HB3 GLU B 10 -0.447 -2.905 -13.934 1.00 0.00 H new ATOM 0 HG2 GLU B 10 0.418 -3.144 -16.159 1.00 0.00 H new ATOM 0 HG3 GLU B 10 -0.412 -1.603 -16.065 1.00 0.00 H new ATOM 1326 N ASN B 11 -0.655 1.104 -14.086 1.00 0.00 N ATOM 1327 CA ASN B 11 -1.679 2.046 -14.510 1.00 0.00 C ATOM 1328 C ASN B 11 -2.892 1.933 -13.615 1.00 0.00 C ATOM 1329 O ASN B 11 -4.020 2.180 -14.048 1.00 0.00 O ATOM 1330 CB ASN B 11 -2.091 1.752 -15.952 1.00 0.00 C ATOM 1331 CG ASN B 11 -2.475 3.001 -16.725 1.00 0.00 C ATOM 1332 OD1 ASN B 11 -1.636 3.622 -17.377 1.00 0.00 O ATOM 1333 ND2 ASN B 11 -3.742 3.377 -16.656 1.00 0.00 N ATOM 0 H ASN B 11 0.245 1.535 -13.876 1.00 0.00 H new ATOM 0 HA ASN B 11 -1.273 3.055 -14.444 1.00 0.00 H new ATOM 0 HB2 ASN B 11 -1.269 1.253 -16.464 1.00 0.00 H new ATOM 0 HB3 ASN B 11 -2.933 1.060 -15.950 1.00 0.00 H new ATOM 0 HD21 ASN B 11 -4.055 4.210 -17.155 1.00 0.00 H new ATOM 0 HD22 ASN B 11 -4.406 2.834 -16.104 1.00 0.00 H new ATOM 1340 N GLY B 12 -2.668 1.583 -12.357 1.00 0.00 N ATOM 1341 CA GLY B 12 -3.776 1.126 -11.572 1.00 0.00 C ATOM 1342 C GLY B 12 -3.498 -0.210 -10.943 1.00 0.00 C ATOM 1343 O GLY B 12 -3.326 -0.336 -9.731 1.00 0.00 O ATOM 0 H GLY B 12 -1.765 1.608 -11.884 1.00 0.00 H new ATOM 0 HA2 GLY B 12 -3.996 1.856 -10.793 1.00 0.00 H new ATOM 0 HA3 GLY B 12 -4.663 1.054 -12.201 1.00 0.00 H new ATOM 1347 N VAL B 13 -3.448 -1.201 -11.801 1.00 0.00 N ATOM 1348 CA VAL B 13 -3.711 -2.588 -11.411 1.00 0.00 C ATOM 1349 C VAL B 13 -2.435 -3.322 -11.039 1.00 0.00 C ATOM 1350 O VAL B 13 -1.406 -3.179 -11.680 1.00 0.00 O ATOM 1351 CB VAL B 13 -4.426 -3.362 -12.535 1.00 0.00 C ATOM 1352 CG1 VAL B 13 -5.813 -2.792 -12.758 1.00 0.00 C ATOM 1353 CG2 VAL B 13 -3.629 -3.330 -13.836 1.00 0.00 C ATOM 0 H VAL B 13 -3.226 -1.081 -12.789 1.00 0.00 H new ATOM 0 HA VAL B 13 -4.359 -2.543 -10.536 1.00 0.00 H new ATOM 0 HB VAL B 13 -4.509 -4.403 -12.222 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -6.310 -3.346 -13.554 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -6.394 -2.877 -11.839 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -5.734 -1.742 -13.041 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -4.165 -3.886 -14.605 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -3.501 -2.297 -14.159 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -2.651 -3.784 -13.675 1.00 0.00 H new ATOM 1363 N PHE B 14 -2.531 -4.153 -10.027 1.00 0.00 N ATOM 1364 CA PHE B 14 -1.354 -4.681 -9.366 1.00 0.00 C ATOM 1365 C PHE B 14 -0.856 -5.958 -10.020 1.00 0.00 C ATOM 1366 O PHE B 14 -1.599 -6.924 -10.166 1.00 0.00 O ATOM 1367 CB PHE B 14 -1.663 -4.981 -7.900 1.00 0.00 C ATOM 1368 CG PHE B 14 -2.226 -3.833 -7.106 1.00 0.00 C ATOM 1369 CD1 PHE B 14 -3.383 -3.187 -7.507 1.00 0.00 C ATOM 1370 CD2 PHE B 14 -1.604 -3.413 -5.947 1.00 0.00 C ATOM 1371 CE1 PHE B 14 -3.905 -2.145 -6.774 1.00 0.00 C ATOM 1372 CE2 PHE B 14 -2.123 -2.374 -5.206 1.00 0.00 C ATOM 1373 CZ PHE B 14 -3.273 -1.740 -5.621 1.00 0.00 C ATOM 0 H PHE B 14 -3.416 -4.481 -9.640 1.00 0.00 H new ATOM 0 HA PHE B 14 -0.578 -3.920 -9.448 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -2.370 -5.809 -7.859 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -0.747 -5.319 -7.416 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -3.884 -3.506 -8.409 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -0.700 -3.905 -5.618 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -4.806 -1.648 -7.102 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -1.628 -2.057 -4.300 1.00 0.00 H new ATOM 0 HZ PHE B 14 -3.679 -0.924 -5.041 1.00 0.00 H new ATOM 1383 N LYS B 15 0.405 -5.957 -10.397 1.00 0.00 N ATOM 1384 CA LYS B 15 1.076 -7.155 -10.829 1.00 0.00 C ATOM 1385 C LYS B 15 1.992 -7.622 -9.716 1.00 0.00 C ATOM 1386 O LYS B 15 2.960 -6.933 -9.389 1.00 0.00 O ATOM 1387 CB LYS B 15 1.925 -6.892 -12.070 1.00 0.00 C ATOM 1388 CG LYS B 15 1.134 -6.558 -13.320 1.00 0.00 C ATOM 1389 CD LYS B 15 1.999 -6.671 -14.567 1.00 0.00 C ATOM 1390 CE LYS B 15 2.164 -5.337 -15.284 1.00 0.00 C ATOM 1391 NZ LYS B 15 3.034 -4.388 -14.535 1.00 0.00 N ATOM 0 H LYS B 15 0.991 -5.122 -10.411 1.00 0.00 H new ATOM 0 HA LYS B 15 0.325 -7.908 -11.069 1.00 0.00 H new ATOM 0 HB2 LYS B 15 2.608 -6.070 -11.858 1.00 0.00 H new ATOM 0 HB3 LYS B 15 2.537 -7.772 -12.268 1.00 0.00 H new ATOM 0 HG2 LYS B 15 0.281 -7.231 -13.404 1.00 0.00 H new ATOM 0 HG3 LYS B 15 0.735 -5.547 -13.242 1.00 0.00 H new ATOM 0 HD2 LYS B 15 2.981 -7.055 -14.291 1.00 0.00 H new ATOM 0 HD3 LYS B 15 1.554 -7.395 -15.250 1.00 0.00 H new ATOM 0 HE2 LYS B 15 2.589 -5.510 -16.273 1.00 0.00 H new ATOM 0 HE3 LYS B 15 1.183 -4.885 -15.433 1.00 0.00 H new ATOM 0 HZ1 LYS B 15 3.032 -3.464 -15.013 1.00 0.00 H new ATOM 0 HZ2 LYS B 15 2.673 -4.278 -13.566 1.00 0.00 H new ATOM 0 HZ3 LYS B 15 4.005 -4.759 -14.503 1.00 0.00 H new ATOM 1405 N PRO B 16 1.707 -8.763 -9.090 1.00 0.00 N ATOM 1406 CA PRO B 16 2.530 -9.215 -7.997 1.00 0.00 C ATOM 1407 C PRO B 16 3.848 -9.808 -8.442 1.00 0.00 C ATOM 1408 O PRO B 16 4.085 -10.059 -9.624 1.00 0.00 O ATOM 1409 CB PRO B 16 1.681 -10.277 -7.306 1.00 0.00 C ATOM 1410 CG PRO B 16 0.707 -10.750 -8.325 1.00 0.00 C ATOM 1411 CD PRO B 16 0.580 -9.666 -9.368 1.00 0.00 C ATOM 0 HA PRO B 16 2.806 -8.381 -7.352 1.00 0.00 H new ATOM 0 HB2 PRO B 16 2.300 -11.099 -6.947 1.00 0.00 H new ATOM 0 HB3 PRO B 16 1.168 -9.862 -6.438 1.00 0.00 H new ATOM 0 HG2 PRO B 16 1.048 -11.681 -8.779 1.00 0.00 H new ATOM 0 HG3 PRO B 16 -0.260 -10.955 -7.865 1.00 0.00 H new ATOM 0 HD2 PRO B 16 0.637 -10.075 -10.377 1.00 0.00 H new ATOM 0 HD3 PRO B 16 -0.375 -9.147 -9.288 1.00 0.00 H new ATOM 1419 N LEU B 17 4.694 -10.028 -7.462 1.00 0.00 N ATOM 1420 CA LEU B 17 5.877 -10.839 -7.631 1.00 0.00 C ATOM 1421 C LEU B 17 5.451 -12.253 -7.313 1.00 0.00 C ATOM 1422 O LEU B 17 6.040 -13.238 -7.762 1.00 0.00 O ATOM 1423 CB LEU B 17 7.004 -10.362 -6.701 1.00 0.00 C ATOM 1424 CG LEU B 17 7.402 -8.884 -6.860 1.00 0.00 C ATOM 1425 CD1 LEU B 17 6.462 -7.970 -6.087 1.00 0.00 C ATOM 1426 CD2 LEU B 17 8.841 -8.669 -6.415 1.00 0.00 C ATOM 0 H LEU B 17 4.580 -9.648 -6.522 1.00 0.00 H new ATOM 0 HA LEU B 17 6.276 -10.769 -8.643 1.00 0.00 H new ATOM 0 HB2 LEU B 17 6.697 -10.530 -5.669 1.00 0.00 H new ATOM 0 HB3 LEU B 17 7.885 -10.980 -6.877 1.00 0.00 H new ATOM 0 HG LEU B 17 7.321 -8.628 -7.916 1.00 0.00 H new ATOM 0 HD11 LEU B 17 6.771 -6.933 -6.220 1.00 0.00 H new ATOM 0 HD12 LEU B 17 5.445 -8.096 -6.458 1.00 0.00 H new ATOM 0 HD13 LEU B 17 6.496 -8.225 -5.028 1.00 0.00 H new ATOM 0 HD21 LEU B 17 9.106 -7.618 -6.534 1.00 0.00 H new ATOM 0 HD22 LEU B 17 8.944 -8.953 -5.368 1.00 0.00 H new ATOM 0 HD23 LEU B 17 9.506 -9.282 -7.024 1.00 0.00 H new ATOM 1438 N GLN B 18 4.376 -12.290 -6.529 1.00 0.00 N ATOM 1439 CA GLN B 18 3.573 -13.470 -6.289 1.00 0.00 C ATOM 1440 C GLN B 18 4.329 -14.760 -6.050 1.00 0.00 C ATOM 1441 O GLN B 18 5.117 -14.845 -5.109 1.00 0.00 O ATOM 1442 CB GLN B 18 2.423 -13.622 -7.267 1.00 0.00 C ATOM 1443 CG GLN B 18 1.182 -14.057 -6.512 1.00 0.00 C ATOM 1444 CD GLN B 18 -0.085 -14.066 -7.333 1.00 0.00 C ATOM 1445 OE1 GLN B 18 -0.355 -14.992 -8.090 1.00 0.00 O ATOM 1446 NE2 GLN B 18 -0.908 -13.056 -7.122 1.00 0.00 N ATOM 0 H GLN B 18 4.035 -11.468 -6.030 1.00 0.00 H new ATOM 0 HA GLN B 18 3.131 -13.266 -5.314 1.00 0.00 H new ATOM 0 HB2 GLN B 18 2.239 -12.678 -7.780 1.00 0.00 H new ATOM 0 HB3 GLN B 18 2.675 -14.357 -8.032 1.00 0.00 H new ATOM 0 HG2 GLN B 18 1.348 -15.058 -6.114 1.00 0.00 H new ATOM 0 HG3 GLN B 18 1.041 -13.394 -5.659 1.00 0.00 H new ATOM 0 HE21 GLN B 18 -0.642 -12.306 -6.483 1.00 0.00 H new ATOM 0 HE22 GLN B 18 -1.810 -13.025 -7.598 1.00 0.00 H new ATOM 1455 N LYS B 19 4.090 -15.744 -6.914 1.00 0.00 N ATOM 1456 CA LYS B 19 4.031 -17.128 -6.545 1.00 0.00 C ATOM 1457 C LYS B 19 2.776 -17.288 -5.706 1.00 0.00 C ATOM 1458 O LYS B 19 1.711 -16.900 -6.176 1.00 0.00 O ATOM 1459 CB LYS B 19 5.293 -17.528 -5.814 1.00 0.00 C ATOM 1460 CG LYS B 19 5.503 -19.010 -5.751 1.00 0.00 C ATOM 1461 CD LYS B 19 6.625 -19.322 -4.794 1.00 0.00 C ATOM 1462 CE LYS B 19 6.829 -20.819 -4.609 1.00 0.00 C ATOM 1463 NZ LYS B 19 7.243 -21.489 -5.874 1.00 0.00 N ATOM 0 H LYS B 19 3.931 -15.582 -7.908 1.00 0.00 H new ATOM 0 HA LYS B 19 3.977 -17.789 -7.410 1.00 0.00 H new ATOM 0 HB2 LYS B 19 6.150 -17.068 -6.306 1.00 0.00 H new ATOM 0 HB3 LYS B 19 5.257 -17.131 -4.800 1.00 0.00 H new ATOM 0 HG2 LYS B 19 4.587 -19.504 -5.426 1.00 0.00 H new ATOM 0 HG3 LYS B 19 5.739 -19.396 -6.742 1.00 0.00 H new ATOM 0 HD2 LYS B 19 7.548 -18.875 -5.162 1.00 0.00 H new ATOM 0 HD3 LYS B 19 6.413 -18.865 -3.828 1.00 0.00 H new ATOM 0 HE2 LYS B 19 7.587 -20.989 -3.844 1.00 0.00 H new ATOM 0 HE3 LYS B 19 5.904 -21.268 -4.247 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 7.436 -22.494 -5.688 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 6.480 -21.408 -6.576 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 8.102 -21.034 -6.243 1.00 0.00 H new ATOM 1477 N VAL B 20 2.852 -17.866 -4.525 1.00 0.00 N ATOM 1478 CA VAL B 20 1.669 -17.980 -3.675 1.00 0.00 C ATOM 1479 C VAL B 20 0.662 -18.975 -4.302 1.00 0.00 C ATOM 1480 O VAL B 20 0.864 -19.452 -5.421 1.00 0.00 O ATOM 1481 CB VAL B 20 1.052 -16.561 -3.530 1.00 0.00 C ATOM 1482 CG1 VAL B 20 -0.162 -16.514 -2.620 1.00 0.00 C ATOM 1483 CG2 VAL B 20 2.091 -15.541 -3.070 1.00 0.00 C ATOM 0 H VAL B 20 3.705 -18.262 -4.129 1.00 0.00 H new ATOM 0 HA VAL B 20 1.931 -18.364 -2.689 1.00 0.00 H new ATOM 0 HB VAL B 20 0.708 -16.296 -4.530 1.00 0.00 H new ATOM 0 HG11 VAL B 20 -0.538 -15.492 -2.567 1.00 0.00 H new ATOM 0 HG12 VAL B 20 -0.940 -17.167 -3.017 1.00 0.00 H new ATOM 0 HG13 VAL B 20 0.119 -16.849 -1.621 1.00 0.00 H new ATOM 0 HG21 VAL B 20 1.623 -14.561 -2.980 1.00 0.00 H new ATOM 0 HG22 VAL B 20 2.493 -15.842 -2.102 1.00 0.00 H new ATOM 0 HG23 VAL B 20 2.900 -15.491 -3.799 1.00 0.00 H new ATOM 1493 N ASP B 21 -0.391 -19.319 -3.570 1.00 0.00 N ATOM 1494 CA ASP B 21 -1.328 -20.358 -4.009 1.00 0.00 C ATOM 1495 C ASP B 21 -2.755 -19.819 -4.086 1.00 0.00 C ATOM 1496 O ASP B 21 -3.735 -20.562 -4.153 1.00 0.00 O ATOM 1497 CB ASP B 21 -1.223 -21.532 -3.041 1.00 0.00 C ATOM 1498 CG ASP B 21 -2.138 -22.703 -3.371 1.00 0.00 C ATOM 1499 OD1 ASP B 21 -2.093 -23.202 -4.515 1.00 0.00 O ATOM 1500 OD2 ASP B 21 -2.888 -23.148 -2.475 1.00 0.00 O ATOM 0 H ASP B 21 -0.621 -18.897 -2.670 1.00 0.00 H new ATOM 0 HA ASP B 21 -1.070 -20.690 -5.015 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -0.192 -21.885 -3.028 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -1.452 -21.180 -2.035 1.00 0.00 H new ATOM 1505 N LEU B 22 -2.853 -18.514 -4.103 1.00 0.00 N ATOM 1506 CA LEU B 22 -4.136 -17.834 -4.164 1.00 0.00 C ATOM 1507 C LEU B 22 -4.625 -17.739 -5.605 1.00 0.00 C ATOM 1508 O LEU B 22 -3.874 -18.038 -6.536 1.00 0.00 O ATOM 1509 CB LEU B 22 -4.001 -16.471 -3.512 1.00 0.00 C ATOM 1510 CG LEU B 22 -3.654 -16.541 -2.022 1.00 0.00 C ATOM 1511 CD1 LEU B 22 -3.350 -15.169 -1.473 1.00 0.00 C ATOM 1512 CD2 LEU B 22 -4.783 -17.190 -1.236 1.00 0.00 C ATOM 0 H LEU B 22 -2.049 -17.886 -4.075 1.00 0.00 H new ATOM 0 HA LEU B 22 -4.888 -18.403 -3.617 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -3.229 -15.903 -4.031 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -4.936 -15.924 -3.634 1.00 0.00 H new ATOM 0 HG LEU B 22 -2.761 -17.156 -1.915 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -3.107 -15.247 -0.413 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -2.503 -14.742 -2.009 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -4.221 -14.526 -1.599 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -4.515 -17.230 -0.180 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -5.694 -16.605 -1.358 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -4.949 -18.202 -1.606 1.00 0.00 H new ATOM 1524 N LYS B 23 -5.879 -17.335 -5.806 1.00 0.00 N ATOM 1525 CA LYS B 23 -6.511 -17.541 -7.093 1.00 0.00 C ATOM 1526 C LYS B 23 -7.296 -16.339 -7.591 1.00 0.00 C ATOM 1527 O LYS B 23 -7.350 -15.300 -6.941 1.00 0.00 O ATOM 1528 CB LYS B 23 -7.407 -18.765 -6.996 1.00 0.00 C ATOM 1529 CG LYS B 23 -6.622 -20.060 -6.873 1.00 0.00 C ATOM 1530 CD LYS B 23 -7.181 -20.967 -5.794 1.00 0.00 C ATOM 1531 CE LYS B 23 -6.217 -22.106 -5.491 1.00 0.00 C ATOM 1532 NZ LYS B 23 -6.742 -23.018 -4.444 1.00 0.00 N ATOM 0 H LYS B 23 -6.460 -16.874 -5.106 1.00 0.00 H new ATOM 0 HA LYS B 23 -5.721 -17.692 -7.829 1.00 0.00 H new ATOM 0 HB2 LYS B 23 -8.065 -18.661 -6.133 1.00 0.00 H new ATOM 0 HB3 LYS B 23 -8.044 -18.814 -7.879 1.00 0.00 H new ATOM 0 HG2 LYS B 23 -6.636 -20.584 -7.829 1.00 0.00 H new ATOM 0 HG3 LYS B 23 -5.580 -19.832 -6.650 1.00 0.00 H new ATOM 0 HD2 LYS B 23 -7.366 -20.390 -4.888 1.00 0.00 H new ATOM 0 HD3 LYS B 23 -8.141 -21.373 -6.115 1.00 0.00 H new ATOM 0 HE2 LYS B 23 -6.028 -22.672 -6.403 1.00 0.00 H new ATOM 0 HE3 LYS B 23 -5.261 -21.695 -5.167 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 -6.054 -23.778 -4.269 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 -6.899 -22.484 -3.565 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 -7.641 -23.431 -4.763 1.00 0.00 H new ATOM 1546 N GLU B 24 -7.893 -16.500 -8.769 1.00 0.00 N ATOM 1547 CA GLU B 24 -8.607 -15.431 -9.426 1.00 0.00 C ATOM 1548 C GLU B 24 -9.973 -15.213 -8.801 1.00 0.00 C ATOM 1549 O GLU B 24 -10.656 -16.154 -8.394 1.00 0.00 O ATOM 1550 CB GLU B 24 -8.734 -15.744 -10.909 1.00 0.00 C ATOM 1551 CG GLU B 24 -7.402 -16.040 -11.576 1.00 0.00 C ATOM 1552 CD GLU B 24 -7.531 -16.247 -13.066 1.00 0.00 C ATOM 1553 OE1 GLU B 24 -8.188 -17.221 -13.483 1.00 0.00 O ATOM 1554 OE2 GLU B 24 -6.969 -15.442 -13.828 1.00 0.00 O ATOM 0 H GLU B 24 -7.890 -17.378 -9.287 1.00 0.00 H new ATOM 0 HA GLU B 24 -8.044 -14.506 -9.301 1.00 0.00 H new ATOM 0 HB2 GLU B 24 -9.395 -16.601 -11.037 1.00 0.00 H new ATOM 0 HB3 GLU B 24 -9.205 -14.900 -11.413 1.00 0.00 H new ATOM 0 HG2 GLU B 24 -6.714 -15.216 -11.386 1.00 0.00 H new ATOM 0 HG3 GLU B 24 -6.965 -16.931 -11.126 1.00 0.00 H new ATOM 1561 N GLY B 25 -10.362 -13.955 -8.781 1.00 0.00 N ATOM 1562 CA GLY B 25 -11.447 -13.505 -7.957 1.00 0.00 C ATOM 1563 C GLY B 25 -11.153 -13.823 -6.520 1.00 0.00 C ATOM 1564 O GLY B 25 -11.838 -14.626 -5.885 1.00 0.00 O ATOM 0 H GLY B 25 -9.929 -13.220 -9.340 1.00 0.00 H new ATOM 0 HA2 GLY B 25 -11.590 -12.431 -8.081 1.00 0.00 H new ATOM 0 HA3 GLY B 25 -12.375 -13.988 -8.264 1.00 0.00 H new ATOM 1568 N GLU B 26 -10.119 -13.176 -6.017 1.00 0.00 N ATOM 1569 CA GLU B 26 -9.773 -13.251 -4.612 1.00 0.00 C ATOM 1570 C GLU B 26 -9.808 -11.871 -3.965 1.00 0.00 C ATOM 1571 O GLU B 26 -9.386 -10.876 -4.562 1.00 0.00 O ATOM 1572 CB GLU B 26 -8.405 -13.917 -4.450 1.00 0.00 C ATOM 1573 CG GLU B 26 -8.500 -15.365 -4.025 1.00 0.00 C ATOM 1574 CD GLU B 26 -9.040 -15.538 -2.617 1.00 0.00 C ATOM 1575 OE1 GLU B 26 -10.268 -15.414 -2.420 1.00 0.00 O ATOM 1576 OE2 GLU B 26 -8.238 -15.795 -1.699 1.00 0.00 O ATOM 0 H GLU B 26 -9.497 -12.586 -6.570 1.00 0.00 H new ATOM 0 HA GLU B 26 -10.514 -13.862 -4.097 1.00 0.00 H new ATOM 0 HB2 GLU B 26 -7.863 -13.856 -5.394 1.00 0.00 H new ATOM 0 HB3 GLU B 26 -7.823 -13.365 -3.712 1.00 0.00 H new ATOM 0 HG2 GLU B 26 -9.143 -15.901 -4.723 1.00 0.00 H new ATOM 0 HG3 GLU B 26 -7.512 -15.821 -4.088 1.00 0.00 H new ATOM 1583 N ARG B 27 -10.325 -11.829 -2.742 1.00 0.00 N ATOM 1584 CA ARG B 27 -10.543 -10.578 -2.033 1.00 0.00 C ATOM 1585 C ARG B 27 -9.313 -10.187 -1.237 1.00 0.00 C ATOM 1586 O ARG B 27 -8.827 -10.951 -0.398 1.00 0.00 O ATOM 1587 CB ARG B 27 -11.733 -10.704 -1.093 1.00 0.00 C ATOM 1588 CG ARG B 27 -12.038 -9.431 -0.334 1.00 0.00 C ATOM 1589 CD ARG B 27 -12.729 -8.408 -1.213 1.00 0.00 C ATOM 1590 NE ARG B 27 -14.161 -8.330 -0.920 1.00 0.00 N ATOM 1591 CZ ARG B 27 -14.772 -7.227 -0.481 1.00 0.00 C ATOM 1592 NH1 ARG B 27 -14.080 -6.105 -0.335 1.00 0.00 N ATOM 1593 NH2 ARG B 27 -16.065 -7.251 -0.189 1.00 0.00 N ATOM 0 H ARG B 27 -10.603 -12.659 -2.218 1.00 0.00 H new ATOM 0 HA ARG B 27 -10.745 -9.804 -2.773 1.00 0.00 H new ATOM 0 HB2 ARG B 27 -12.612 -10.994 -1.669 1.00 0.00 H new ATOM 0 HB3 ARG B 27 -11.540 -11.506 -0.380 1.00 0.00 H new ATOM 0 HG2 ARG B 27 -12.670 -9.661 0.523 1.00 0.00 H new ATOM 0 HG3 ARG B 27 -11.112 -9.009 0.057 1.00 0.00 H new ATOM 0 HD2 ARG B 27 -12.272 -7.430 -1.063 1.00 0.00 H new ATOM 0 HD3 ARG B 27 -12.585 -8.670 -2.261 1.00 0.00 H new ATOM 0 HE ARG B 27 -14.726 -9.168 -1.059 1.00 0.00 H new ATOM 0 HH11 ARG B 27 -13.085 -6.087 -0.558 1.00 0.00 H new ATOM 0 HH12 ARG B 27 -14.543 -5.260 0.000 1.00 0.00 H new ATOM 0 HH21 ARG B 27 -16.597 -8.114 -0.299 1.00 0.00 H new ATOM 0 HH22 ARG B 27 -16.528 -6.406 0.146 1.00 0.00 H new ATOM 1607 N VAL B 28 -8.846 -8.980 -1.475 1.00 0.00 N ATOM 1608 CA VAL B 28 -7.581 -8.525 -0.905 1.00 0.00 C ATOM 1609 C VAL B 28 -7.653 -7.092 -0.366 1.00 0.00 C ATOM 1610 O VAL B 28 -8.401 -6.252 -0.875 1.00 0.00 O ATOM 1611 CB VAL B 28 -6.436 -8.622 -1.941 1.00 0.00 C ATOM 1612 CG1 VAL B 28 -6.199 -10.065 -2.365 1.00 0.00 C ATOM 1613 CG2 VAL B 28 -6.730 -7.756 -3.157 1.00 0.00 C ATOM 0 H VAL B 28 -9.319 -8.290 -2.059 1.00 0.00 H new ATOM 0 HA VAL B 28 -7.376 -9.189 -0.066 1.00 0.00 H new ATOM 0 HB VAL B 28 -5.528 -8.253 -1.464 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -5.389 -10.102 -3.093 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -5.930 -10.661 -1.493 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -7.108 -10.467 -2.813 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -5.911 -7.841 -3.871 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -7.656 -8.089 -3.626 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -6.834 -6.716 -2.847 1.00 0.00 H new ATOM 1623 N LYS B 29 -6.873 -6.848 0.682 1.00 0.00 N ATOM 1624 CA LYS B 29 -6.702 -5.534 1.271 1.00 0.00 C ATOM 1625 C LYS B 29 -5.250 -5.117 1.136 1.00 0.00 C ATOM 1626 O LYS B 29 -4.337 -5.912 1.355 1.00 0.00 O ATOM 1627 CB LYS B 29 -7.096 -5.555 2.736 1.00 0.00 C ATOM 1628 CG LYS B 29 -8.553 -5.885 2.968 1.00 0.00 C ATOM 1629 CD LYS B 29 -8.887 -5.802 4.441 1.00 0.00 C ATOM 1630 CE LYS B 29 -10.254 -6.400 4.740 1.00 0.00 C ATOM 1631 NZ LYS B 29 -10.567 -6.395 6.192 1.00 0.00 N ATOM 0 H LYS B 29 -6.334 -7.575 1.151 1.00 0.00 H new ATOM 0 HA LYS B 29 -7.342 -4.821 0.751 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -6.479 -6.286 3.259 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -6.878 -4.582 3.176 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -9.182 -5.194 2.407 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -8.769 -6.887 2.596 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -8.125 -6.327 5.017 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -8.867 -4.760 4.761 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -11.019 -5.838 4.204 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -10.290 -7.423 4.367 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -11.507 -6.812 6.346 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -9.853 -6.953 6.703 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -10.560 -5.417 6.545 1.00 0.00 H new ATOM 1645 N ILE B 30 -5.040 -3.874 0.798 1.00 0.00 N ATOM 1646 CA ILE B 30 -3.713 -3.410 0.407 1.00 0.00 C ATOM 1647 C ILE B 30 -3.193 -2.359 1.362 1.00 0.00 C ATOM 1648 O ILE B 30 -3.954 -1.593 1.941 1.00 0.00 O ATOM 1649 CB ILE B 30 -3.743 -2.791 -1.001 1.00 0.00 C ATOM 1650 CG1 ILE B 30 -4.695 -3.575 -1.902 1.00 0.00 C ATOM 1651 CG2 ILE B 30 -2.345 -2.771 -1.603 1.00 0.00 C ATOM 1652 CD1 ILE B 30 -5.077 -2.849 -3.172 1.00 0.00 C ATOM 0 H ILE B 30 -5.763 -3.155 0.782 1.00 0.00 H new ATOM 0 HA ILE B 30 -3.059 -4.282 0.425 1.00 0.00 H new ATOM 0 HB ILE B 30 -4.101 -1.764 -0.921 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -4.230 -4.525 -2.165 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -5.601 -3.807 -1.342 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -2.384 -2.330 -2.599 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -1.685 -2.179 -0.970 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -1.964 -3.790 -1.672 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -5.754 -3.471 -3.757 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -5.572 -1.911 -2.920 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -4.180 -2.641 -3.756 1.00 0.00 H new ATOM 1664 N LYS B 31 -1.892 -2.351 1.524 1.00 0.00 N ATOM 1665 CA LYS B 31 -1.202 -1.281 2.183 1.00 0.00 C ATOM 1666 C LYS B 31 0.044 -0.968 1.390 1.00 0.00 C ATOM 1667 O LYS B 31 0.499 -1.793 0.600 1.00 0.00 O ATOM 1668 CB LYS B 31 -0.849 -1.631 3.608 1.00 0.00 C ATOM 1669 CG LYS B 31 -0.054 -2.897 3.738 1.00 0.00 C ATOM 1670 CD LYS B 31 1.382 -2.635 4.165 1.00 0.00 C ATOM 1671 CE LYS B 31 1.452 -1.845 5.469 1.00 0.00 C ATOM 1672 NZ LYS B 31 2.848 -1.707 5.964 1.00 0.00 N ATOM 0 H LYS B 31 -1.280 -3.098 1.196 1.00 0.00 H new ATOM 0 HA LYS B 31 -1.855 -0.410 2.229 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -0.281 -0.809 4.045 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -1.767 -1.728 4.187 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -0.534 -3.552 4.466 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -0.057 -3.425 2.784 1.00 0.00 H new ATOM 0 HD2 LYS B 31 1.904 -3.584 4.287 1.00 0.00 H new ATOM 0 HD3 LYS B 31 1.900 -2.085 3.379 1.00 0.00 H new ATOM 0 HE2 LYS B 31 1.022 -0.855 5.316 1.00 0.00 H new ATOM 0 HE3 LYS B 31 0.846 -2.342 6.227 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 2.850 -1.164 6.851 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 3.251 -2.651 6.135 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 3.421 -1.210 5.253 1.00 0.00 H new ATOM 1686 N LEU B 32 0.600 0.193 1.613 1.00 0.00 N ATOM 1687 CA LEU B 32 1.688 0.674 0.795 1.00 0.00 C ATOM 1688 C LEU B 32 2.953 0.799 1.608 1.00 0.00 C ATOM 1689 O LEU B 32 2.928 1.269 2.748 1.00 0.00 O ATOM 1690 CB LEU B 32 1.336 2.028 0.176 1.00 0.00 C ATOM 1691 CG LEU B 32 0.243 2.004 -0.899 1.00 0.00 C ATOM 1692 CD1 LEU B 32 -1.142 1.915 -0.282 1.00 0.00 C ATOM 1693 CD2 LEU B 32 0.352 3.225 -1.791 1.00 0.00 C ATOM 0 H LEU B 32 0.317 0.829 2.359 1.00 0.00 H new ATOM 0 HA LEU B 32 1.854 -0.049 -0.003 1.00 0.00 H new ATOM 0 HB2 LEU B 32 1.020 2.700 0.974 1.00 0.00 H new ATOM 0 HB3 LEU B 32 2.240 2.453 -0.260 1.00 0.00 H new ATOM 0 HG LEU B 32 0.392 1.111 -1.507 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -1.892 1.900 -1.073 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -1.219 1.002 0.309 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -1.310 2.779 0.361 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -0.431 3.193 -2.549 1.00 0.00 H new ATOM 0 HD22 LEU B 32 0.238 4.127 -1.189 1.00 0.00 H new ATOM 0 HD23 LEU B 32 1.327 3.234 -2.277 1.00 0.00 H new ATOM 1761 N VAL B 36 12.080 5.791 3.686 1.00 0.00 N ATOM 1762 CA VAL B 36 12.375 6.658 4.802 1.00 0.00 C ATOM 1763 C VAL B 36 13.347 7.731 4.354 1.00 0.00 C ATOM 1764 O VAL B 36 14.136 7.511 3.431 1.00 0.00 O ATOM 1765 CB VAL B 36 12.966 5.862 5.986 1.00 0.00 C ATOM 1766 CG1 VAL B 36 14.257 5.165 5.589 1.00 0.00 C ATOM 1767 CG2 VAL B 36 13.187 6.750 7.202 1.00 0.00 C ATOM 0 HA VAL B 36 11.448 7.119 5.143 1.00 0.00 H new ATOM 0 HB VAL B 36 12.237 5.099 6.259 1.00 0.00 H new ATOM 0 HG11 VAL B 36 14.650 4.613 6.443 1.00 0.00 H new ATOM 0 HG12 VAL B 36 14.060 4.474 4.769 1.00 0.00 H new ATOM 0 HG13 VAL B 36 14.988 5.908 5.270 1.00 0.00 H new ATOM 0 HG21 VAL B 36 13.604 6.156 8.015 1.00 0.00 H new ATOM 0 HG22 VAL B 36 13.880 7.552 6.946 1.00 0.00 H new ATOM 0 HG23 VAL B 36 12.236 7.179 7.517 1.00 0.00 H new ATOM 1777 N GLU B 37 13.268 8.889 4.978 1.00 0.00 N ATOM 1778 CA GLU B 37 14.165 9.978 4.672 1.00 0.00 C ATOM 1779 C GLU B 37 15.584 9.593 5.078 1.00 0.00 C ATOM 1780 O GLU B 37 15.885 9.460 6.265 1.00 0.00 O ATOM 1781 CB GLU B 37 13.692 11.229 5.400 1.00 0.00 C ATOM 1782 CG GLU B 37 12.297 11.663 4.977 1.00 0.00 C ATOM 1783 CD GLU B 37 11.778 12.828 5.782 1.00 0.00 C ATOM 1784 OE1 GLU B 37 11.185 12.597 6.857 1.00 0.00 O ATOM 1785 OE2 GLU B 37 11.959 13.981 5.345 1.00 0.00 O ATOM 0 H GLU B 37 12.585 9.098 5.706 1.00 0.00 H new ATOM 0 HA GLU B 37 14.167 10.185 3.602 1.00 0.00 H new ATOM 0 HB2 GLU B 37 13.700 11.044 6.474 1.00 0.00 H new ATOM 0 HB3 GLU B 37 14.394 12.041 5.211 1.00 0.00 H new ATOM 0 HG2 GLU B 37 12.310 11.934 3.921 1.00 0.00 H new ATOM 0 HG3 GLU B 37 11.612 10.821 5.081 1.00 0.00 H new ATOM 1792 N PRO B 38 16.465 9.388 4.087 1.00 0.00 N ATOM 1793 CA PRO B 38 17.781 8.805 4.316 1.00 0.00 C ATOM 1794 C PRO B 38 18.771 9.774 4.938 1.00 0.00 C ATOM 1795 O PRO B 38 18.498 10.971 5.084 1.00 0.00 O ATOM 1796 CB PRO B 38 18.232 8.409 2.909 1.00 0.00 C ATOM 1797 CG PRO B 38 17.557 9.387 2.011 1.00 0.00 C ATOM 1798 CD PRO B 38 16.243 9.720 2.666 1.00 0.00 C ATOM 0 HA PRO B 38 17.734 7.978 5.024 1.00 0.00 H new ATOM 0 HB2 PRO B 38 19.316 8.462 2.810 1.00 0.00 H new ATOM 0 HB3 PRO B 38 17.940 7.386 2.672 1.00 0.00 H new ATOM 0 HG2 PRO B 38 18.166 10.282 1.882 1.00 0.00 H new ATOM 0 HG3 PRO B 38 17.401 8.962 1.019 1.00 0.00 H new ATOM 0 HD2 PRO B 38 15.986 10.771 2.536 1.00 0.00 H new ATOM 0 HD3 PRO B 38 15.425 9.137 2.242 1.00 0.00 H new ATOM 1806 N ILE B 39 19.925 9.241 5.291 1.00 0.00 N ATOM 1807 CA ILE B 39 20.989 10.023 5.878 1.00 0.00 C ATOM 1808 C ILE B 39 21.709 10.847 4.817 1.00 0.00 C ATOM 1809 O ILE B 39 21.440 10.714 3.618 1.00 0.00 O ATOM 1810 CB ILE B 39 22.010 9.128 6.623 1.00 0.00 C ATOM 1811 CG1 ILE B 39 22.886 8.304 5.652 1.00 0.00 C ATOM 1812 CG2 ILE B 39 21.290 8.214 7.604 1.00 0.00 C ATOM 1813 CD1 ILE B 39 22.160 7.190 4.916 1.00 0.00 C ATOM 0 H ILE B 39 20.149 8.252 5.178 1.00 0.00 H new ATOM 0 HA ILE B 39 20.529 10.696 6.601 1.00 0.00 H new ATOM 0 HB ILE B 39 22.681 9.787 7.174 1.00 0.00 H new ATOM 0 HG12 ILE B 39 23.321 8.981 4.917 1.00 0.00 H new ATOM 0 HG13 ILE B 39 23.713 7.869 6.213 1.00 0.00 H new ATOM 0 HG21 ILE B 39 22.018 7.590 8.122 1.00 0.00 H new ATOM 0 HG22 ILE B 39 20.747 8.817 8.332 1.00 0.00 H new ATOM 0 HG23 ILE B 39 20.588 7.580 7.062 1.00 0.00 H new ATOM 0 HD11 ILE B 39 22.859 6.671 4.260 1.00 0.00 H new ATOM 0 HD12 ILE B 39 21.748 6.485 5.638 1.00 0.00 H new ATOM 0 HD13 ILE B 39 21.351 7.614 4.321 1.00 0.00 H new ATOM 1825 N ASP B 40 22.619 11.695 5.262 1.00 0.00 N ATOM 1826 CA ASP B 40 23.390 12.533 4.359 1.00 0.00 C ATOM 1827 C ASP B 40 24.650 11.806 3.910 1.00 0.00 C ATOM 1828 O ASP B 40 25.321 11.159 4.716 1.00 0.00 O ATOM 1829 CB ASP B 40 23.753 13.849 5.044 1.00 0.00 C ATOM 1830 CG ASP B 40 24.631 14.729 4.181 1.00 0.00 C ATOM 1831 OD1 ASP B 40 24.123 15.303 3.196 1.00 0.00 O ATOM 1832 OD2 ASP B 40 25.832 14.872 4.497 1.00 0.00 O ATOM 0 H ASP B 40 22.843 11.822 6.249 1.00 0.00 H new ATOM 0 HA ASP B 40 22.783 12.751 3.480 1.00 0.00 H new ATOM 0 HB2 ASP B 40 22.840 14.388 5.296 1.00 0.00 H new ATOM 0 HB3 ASP B 40 24.267 13.637 5.982 1.00 0.00 H new ATOM 1837 N LEU B 41 24.961 11.903 2.625 1.00 0.00 N ATOM 1838 CA LEU B 41 26.113 11.213 2.065 1.00 0.00 C ATOM 1839 C LEU B 41 27.185 12.218 1.655 1.00 0.00 C ATOM 1840 O LEU B 41 26.873 13.312 1.180 1.00 0.00 O ATOM 1841 CB LEU B 41 25.685 10.367 0.857 1.00 0.00 C ATOM 1842 CG LEU B 41 26.788 9.522 0.216 1.00 0.00 C ATOM 1843 CD1 LEU B 41 27.327 8.499 1.206 1.00 0.00 C ATOM 1844 CD2 LEU B 41 26.265 8.828 -1.032 1.00 0.00 C ATOM 0 H LEU B 41 24.430 12.454 1.950 1.00 0.00 H new ATOM 0 HA LEU B 41 26.530 10.553 2.825 1.00 0.00 H new ATOM 0 HB2 LEU B 41 24.879 9.703 1.169 1.00 0.00 H new ATOM 0 HB3 LEU B 41 25.274 11.032 0.098 1.00 0.00 H new ATOM 0 HG LEU B 41 27.605 10.184 -0.070 1.00 0.00 H new ATOM 0 HD11 LEU B 41 28.110 7.909 0.730 1.00 0.00 H new ATOM 0 HD12 LEU B 41 27.738 9.014 2.074 1.00 0.00 H new ATOM 0 HD13 LEU B 41 26.519 7.840 1.524 1.00 0.00 H new ATOM 0 HD21 LEU B 41 27.061 8.231 -1.477 1.00 0.00 H new ATOM 0 HD22 LEU B 41 25.431 8.179 -0.765 1.00 0.00 H new ATOM 0 HD23 LEU B 41 25.928 9.576 -1.750 1.00 0.00 H new ATOM 1856 N GLY B 42 28.439 11.843 1.841 1.00 0.00 N ATOM 1857 CA GLY B 42 29.535 12.708 1.489 1.00 0.00 C ATOM 1858 C GLY B 42 30.354 12.130 0.366 1.00 0.00 C ATOM 1859 O GLY B 42 30.972 11.074 0.506 1.00 0.00 O ATOM 0 H GLY B 42 28.716 10.944 2.234 1.00 0.00 H new ATOM 0 HA2 GLY B 42 29.150 13.684 1.195 1.00 0.00 H new ATOM 0 HA3 GLY B 42 30.170 12.865 2.361 1.00 0.00 H new ATOM 1863 N GLU B 43 30.341 12.819 -0.750 1.00 0.00 N ATOM 1864 CA GLU B 43 31.053 12.391 -1.940 1.00 0.00 C ATOM 1865 C GLU B 43 32.565 12.552 -1.760 1.00 0.00 C ATOM 1866 O GLU B 43 33.050 13.630 -1.409 1.00 0.00 O ATOM 1867 CB GLU B 43 30.564 13.170 -3.175 1.00 0.00 C ATOM 1868 CG GLU B 43 30.701 14.687 -3.085 1.00 0.00 C ATOM 1869 CD GLU B 43 29.633 15.346 -2.237 1.00 0.00 C ATOM 1870 OE1 GLU B 43 29.828 15.463 -1.008 1.00 0.00 O ATOM 1871 OE2 GLU B 43 28.602 15.769 -2.797 1.00 0.00 O ATOM 0 H GLU B 43 29.835 13.697 -0.863 1.00 0.00 H new ATOM 0 HA GLU B 43 30.844 11.333 -2.098 1.00 0.00 H new ATOM 0 HB2 GLU B 43 31.119 12.823 -4.046 1.00 0.00 H new ATOM 0 HB3 GLU B 43 29.516 12.926 -3.347 1.00 0.00 H new ATOM 0 HG2 GLU B 43 31.681 14.931 -2.674 1.00 0.00 H new ATOM 0 HG3 GLU B 43 30.664 15.106 -4.090 1.00 0.00 H new ATOM 1878 N PRO B 44 33.325 11.469 -1.971 1.00 0.00 N ATOM 1879 CA PRO B 44 34.781 11.483 -1.821 1.00 0.00 C ATOM 1880 C PRO B 44 35.478 12.195 -2.980 1.00 0.00 C ATOM 1881 O PRO B 44 34.841 12.562 -3.972 1.00 0.00 O ATOM 1882 CB PRO B 44 35.148 9.998 -1.799 1.00 0.00 C ATOM 1883 CG PRO B 44 34.069 9.323 -2.571 1.00 0.00 C ATOM 1884 CD PRO B 44 32.819 10.139 -2.357 1.00 0.00 C ATOM 0 HA PRO B 44 35.096 12.025 -0.929 1.00 0.00 H new ATOM 0 HB2 PRO B 44 36.124 9.826 -2.252 1.00 0.00 H new ATOM 0 HB3 PRO B 44 35.199 9.619 -0.778 1.00 0.00 H new ATOM 0 HG2 PRO B 44 34.323 9.272 -3.630 1.00 0.00 H new ATOM 0 HG3 PRO B 44 33.928 8.298 -2.227 1.00 0.00 H new ATOM 0 HD2 PRO B 44 32.215 10.189 -3.263 1.00 0.00 H new ATOM 0 HD3 PRO B 44 32.190 9.709 -1.577 1.00 0.00 H new ATOM 1892 N VAL B 45 36.785 12.389 -2.852 1.00 0.00 N ATOM 1893 CA VAL B 45 37.561 13.067 -3.879 1.00 0.00 C ATOM 1894 C VAL B 45 38.673 12.151 -4.373 1.00 0.00 C ATOM 1895 O VAL B 45 39.136 11.277 -3.640 1.00 0.00 O ATOM 1896 CB VAL B 45 38.196 14.372 -3.349 1.00 0.00 C ATOM 1897 CG1 VAL B 45 38.618 15.279 -4.494 1.00 0.00 C ATOM 1898 CG2 VAL B 45 37.258 15.104 -2.401 1.00 0.00 C ATOM 0 H VAL B 45 37.329 12.085 -2.045 1.00 0.00 H new ATOM 0 HA VAL B 45 36.879 13.317 -4.692 1.00 0.00 H new ATOM 0 HB VAL B 45 39.088 14.095 -2.787 1.00 0.00 H new ATOM 0 HG11 VAL B 45 39.062 16.190 -4.092 1.00 0.00 H new ATOM 0 HG12 VAL B 45 39.349 14.763 -5.116 1.00 0.00 H new ATOM 0 HG13 VAL B 45 37.746 15.535 -5.096 1.00 0.00 H new ATOM 0 HG21 VAL B 45 37.737 16.017 -2.048 1.00 0.00 H new ATOM 0 HG22 VAL B 45 36.336 15.357 -2.925 1.00 0.00 H new ATOM 0 HG23 VAL B 45 37.027 14.463 -1.550 1.00 0.00 H new ATOM 1908 N SER B 46 39.082 12.340 -5.612 1.00 0.00 N ATOM 1909 CA SER B 46 40.177 11.599 -6.186 1.00 0.00 C ATOM 1910 C SER B 46 41.223 12.567 -6.727 1.00 0.00 C ATOM 1911 O SER B 46 40.966 13.766 -6.830 1.00 0.00 O ATOM 1912 CB SER B 46 39.656 10.708 -7.303 1.00 0.00 C ATOM 1913 OG SER B 46 38.604 9.876 -6.841 1.00 0.00 O ATOM 0 H SER B 46 38.659 13.016 -6.248 1.00 0.00 H new ATOM 0 HA SER B 46 40.638 10.975 -5.420 1.00 0.00 H new ATOM 0 HB2 SER B 46 39.301 11.324 -8.129 1.00 0.00 H new ATOM 0 HB3 SER B 46 40.468 10.092 -7.691 1.00 0.00 H new ATOM 0 HG SER B 46 38.284 9.314 -7.577 1.00 0.00 H new ATOM 1919 N VAL B 47 42.393 12.049 -7.073 1.00 0.00 N ATOM 1920 CA VAL B 47 43.480 12.885 -7.570 1.00 0.00 C ATOM 1921 C VAL B 47 44.104 12.256 -8.808 1.00 0.00 C ATOM 1922 O VAL B 47 44.482 11.086 -8.793 1.00 0.00 O ATOM 1923 CB VAL B 47 44.586 13.089 -6.509 1.00 0.00 C ATOM 1924 CG1 VAL B 47 45.642 14.059 -7.018 1.00 0.00 C ATOM 1925 CG2 VAL B 47 44.000 13.578 -5.190 1.00 0.00 C ATOM 0 H VAL B 47 42.615 11.055 -7.019 1.00 0.00 H new ATOM 0 HA VAL B 47 43.048 13.856 -7.813 1.00 0.00 H new ATOM 0 HB VAL B 47 45.060 12.124 -6.328 1.00 0.00 H new ATOM 0 HG11 VAL B 47 46.412 14.190 -6.258 1.00 0.00 H new ATOM 0 HG12 VAL B 47 46.093 13.661 -7.927 1.00 0.00 H new ATOM 0 HG13 VAL B 47 45.178 15.021 -7.234 1.00 0.00 H new ATOM 0 HG21 VAL B 47 44.801 13.712 -4.463 1.00 0.00 H new ATOM 0 HG22 VAL B 47 43.491 14.529 -5.348 1.00 0.00 H new ATOM 0 HG23 VAL B 47 43.288 12.843 -4.813 1.00 0.00 H new ATOM 1935 N GLU B 48 44.199 13.029 -9.879 1.00 0.00 N ATOM 1936 CA GLU B 48 44.858 12.565 -11.089 1.00 0.00 C ATOM 1937 C GLU B 48 46.241 13.184 -11.168 1.00 0.00 C ATOM 1938 O GLU B 48 46.393 14.358 -11.506 1.00 0.00 O ATOM 1939 CB GLU B 48 44.062 12.946 -12.328 1.00 0.00 C ATOM 1940 CG GLU B 48 42.569 12.703 -12.205 1.00 0.00 C ATOM 1941 CD GLU B 48 41.825 13.034 -13.483 1.00 0.00 C ATOM 1942 OE1 GLU B 48 41.720 12.149 -14.358 1.00 0.00 O ATOM 1943 OE2 GLU B 48 41.345 14.180 -13.623 1.00 0.00 O ATOM 0 H GLU B 48 43.829 13.978 -9.935 1.00 0.00 H new ATOM 0 HA GLU B 48 44.930 11.478 -11.051 1.00 0.00 H new ATOM 0 HB2 GLU B 48 44.231 14.001 -12.545 1.00 0.00 H new ATOM 0 HB3 GLU B 48 44.442 12.381 -13.179 1.00 0.00 H new ATOM 0 HG2 GLU B 48 42.393 11.659 -11.945 1.00 0.00 H new ATOM 0 HG3 GLU B 48 42.171 13.306 -11.389 1.00 0.00 H new ATOM 1950 N GLU B 49 47.235 12.391 -10.842 1.00 0.00 N ATOM 1951 CA GLU B 49 48.617 12.859 -10.790 1.00 0.00 C ATOM 1952 C GLU B 49 49.281 12.762 -12.156 1.00 0.00 C ATOM 1953 O GLU B 49 50.219 13.495 -12.464 1.00 0.00 O ATOM 1954 CB GLU B 49 49.400 12.050 -9.759 1.00 0.00 C ATOM 1955 CG GLU B 49 48.789 12.117 -8.370 1.00 0.00 C ATOM 1956 CD GLU B 49 49.534 11.272 -7.368 1.00 0.00 C ATOM 1957 OE1 GLU B 49 49.385 10.034 -7.399 1.00 0.00 O ATOM 1958 OE2 GLU B 49 50.271 11.843 -6.540 1.00 0.00 O ATOM 0 H GLU B 49 47.118 11.406 -10.605 1.00 0.00 H new ATOM 0 HA GLU B 49 48.614 13.908 -10.494 1.00 0.00 H new ATOM 0 HB2 GLU B 49 49.447 11.009 -10.080 1.00 0.00 H new ATOM 0 HB3 GLU B 49 50.425 12.418 -9.718 1.00 0.00 H new ATOM 0 HG2 GLU B 49 48.780 13.153 -8.031 1.00 0.00 H new ATOM 0 HG3 GLU B 49 47.751 11.788 -8.417 1.00 0.00 H new ATOM 1965 N ILE B 50 48.779 11.846 -12.963 1.00 0.00 N ATOM 1966 CA ILE B 50 49.315 11.604 -14.300 1.00 0.00 C ATOM 1967 C ILE B 50 48.701 12.583 -15.304 1.00 0.00 C ATOM 1968 O ILE B 50 49.022 12.581 -16.494 1.00 0.00 O ATOM 1969 CB ILE B 50 49.029 10.145 -14.731 1.00 0.00 C ATOM 1970 CG1 ILE B 50 49.792 9.793 -16.014 1.00 0.00 C ATOM 1971 CG2 ILE B 50 47.529 9.925 -14.920 1.00 0.00 C ATOM 1972 CD1 ILE B 50 49.641 8.348 -16.437 1.00 0.00 C ATOM 0 H ILE B 50 47.991 11.248 -12.716 1.00 0.00 H new ATOM 0 HA ILE B 50 50.394 11.759 -14.279 1.00 0.00 H new ATOM 0 HB ILE B 50 49.377 9.483 -13.938 1.00 0.00 H new ATOM 0 HG12 ILE B 50 49.443 10.437 -16.821 1.00 0.00 H new ATOM 0 HG13 ILE B 50 50.850 10.010 -15.868 1.00 0.00 H new ATOM 0 HG21 ILE B 50 47.348 8.894 -15.223 1.00 0.00 H new ATOM 0 HG22 ILE B 50 47.011 10.124 -13.982 1.00 0.00 H new ATOM 0 HG23 ILE B 50 47.156 10.600 -15.690 1.00 0.00 H new ATOM 0 HD11 ILE B 50 50.209 8.175 -17.351 1.00 0.00 H new ATOM 0 HD12 ILE B 50 50.017 7.697 -15.648 1.00 0.00 H new ATOM 0 HD13 ILE B 50 48.588 8.130 -16.617 1.00 0.00 H new ATOM 2090 N THR B 57 52.849 23.112 -30.992 1.00 0.00 N ATOM 2091 CA THR B 57 52.999 24.311 -31.802 1.00 0.00 C ATOM 2092 C THR B 57 53.674 23.980 -33.133 1.00 0.00 C ATOM 2093 O THR B 57 54.194 22.878 -33.315 1.00 0.00 O ATOM 2094 CB THR B 57 53.797 25.397 -31.047 1.00 0.00 C ATOM 2095 OG1 THR B 57 53.667 26.663 -31.711 1.00 0.00 O ATOM 2096 CG2 THR B 57 55.269 25.028 -30.938 1.00 0.00 C ATOM 0 HA THR B 57 52.003 24.704 -32.006 1.00 0.00 H new ATOM 0 HB THR B 57 53.385 25.470 -30.041 1.00 0.00 H new ATOM 0 HG1 THR B 57 54.176 27.343 -31.222 1.00 0.00 H new ATOM 0 HG21 THR B 57 55.802 25.813 -30.402 1.00 0.00 H new ATOM 0 HG22 THR B 57 55.369 24.087 -30.398 1.00 0.00 H new ATOM 0 HG23 THR B 57 55.692 24.920 -31.937 1.00 0.00 H new ATOM 2104 N TRP B 58 53.655 24.931 -34.058 1.00 0.00 N ATOM 2105 CA TRP B 58 54.220 24.737 -35.383 1.00 0.00 C ATOM 2106 C TRP B 58 55.171 25.881 -35.722 1.00 0.00 C ATOM 2107 O TRP B 58 54.913 27.034 -35.380 1.00 0.00 O ATOM 2108 CB TRP B 58 53.095 24.651 -36.418 1.00 0.00 C ATOM 2109 CG TRP B 58 53.576 24.494 -37.831 1.00 0.00 C ATOM 2110 CD1 TRP B 58 53.420 25.390 -38.846 1.00 0.00 C ATOM 2111 CD2 TRP B 58 54.292 23.381 -38.383 1.00 0.00 C ATOM 2112 NE1 TRP B 58 53.981 24.900 -39.999 1.00 0.00 N ATOM 2113 CE2 TRP B 58 54.528 23.670 -39.742 1.00 0.00 C ATOM 2114 CE3 TRP B 58 54.751 22.167 -37.862 1.00 0.00 C ATOM 2115 CZ2 TRP B 58 55.205 22.788 -40.583 1.00 0.00 C ATOM 2116 CZ3 TRP B 58 55.425 21.296 -38.695 1.00 0.00 C ATOM 2117 CH2 TRP B 58 55.647 21.609 -40.044 1.00 0.00 C ATOM 0 H TRP B 58 53.249 25.855 -33.910 1.00 0.00 H new ATOM 0 HA TRP B 58 54.784 23.804 -35.398 1.00 0.00 H new ATOM 0 HB2 TRP B 58 52.450 23.808 -36.169 1.00 0.00 H new ATOM 0 HB3 TRP B 58 52.484 25.551 -36.351 1.00 0.00 H new ATOM 0 HD1 TRP B 58 52.927 26.347 -38.756 1.00 0.00 H new ATOM 0 HE1 TRP B 58 53.989 25.375 -40.902 1.00 0.00 H new ATOM 0 HE3 TRP B 58 54.581 21.915 -36.826 1.00 0.00 H new ATOM 0 HZ2 TRP B 58 55.375 23.026 -41.623 1.00 0.00 H new ATOM 0 HZ3 TRP B 58 55.787 20.358 -38.301 1.00 0.00 H new ATOM 0 HH2 TRP B 58 56.177 20.906 -40.670 1.00 0.00 H new ATOM 2128 N MET B 59 56.273 25.558 -36.386 1.00 0.00 N ATOM 2129 CA MET B 59 57.255 26.564 -36.755 1.00 0.00 C ATOM 2130 C MET B 59 57.493 26.561 -38.259 1.00 0.00 C ATOM 2131 O MET B 59 57.815 25.527 -38.847 1.00 0.00 O ATOM 2132 CB MET B 59 58.574 26.321 -36.011 1.00 0.00 C ATOM 2133 CG MET B 59 59.666 27.318 -36.371 1.00 0.00 C ATOM 2134 SD MET B 59 61.151 27.117 -35.366 1.00 0.00 S ATOM 2135 CE MET B 59 60.504 27.510 -33.744 1.00 0.00 C ATOM 0 H MET B 59 56.507 24.609 -36.679 1.00 0.00 H new ATOM 0 HA MET B 59 56.865 27.541 -36.470 1.00 0.00 H new ATOM 0 HB2 MET B 59 58.390 26.367 -34.938 1.00 0.00 H new ATOM 0 HB3 MET B 59 58.926 25.313 -36.231 1.00 0.00 H new ATOM 0 HG2 MET B 59 59.926 27.202 -37.423 1.00 0.00 H new ATOM 0 HG3 MET B 59 59.283 28.331 -36.247 1.00 0.00 H new ATOM 0 HE1 MET B 59 61.316 27.848 -33.100 1.00 0.00 H new ATOM 0 HE2 MET B 59 59.758 28.300 -33.831 1.00 0.00 H new ATOM 0 HE3 MET B 59 60.043 26.622 -33.311 1.00 0.00 H new ATOM 2145 N SER B 60 57.317 27.721 -38.872 1.00 0.00 N ATOM 2146 CA SER B 60 57.564 27.882 -40.292 1.00 0.00 C ATOM 2147 C SER B 60 59.056 28.041 -40.567 1.00 0.00 C ATOM 2148 O SER B 60 59.768 28.713 -39.821 1.00 0.00 O ATOM 2149 CB SER B 60 56.794 29.091 -40.818 1.00 0.00 C ATOM 2150 OG SER B 60 55.395 28.914 -40.649 1.00 0.00 O ATOM 0 H SER B 60 57.002 28.570 -38.402 1.00 0.00 H new ATOM 0 HA SER B 60 57.218 26.987 -40.810 1.00 0.00 H new ATOM 0 HB2 SER B 60 57.117 29.990 -40.292 1.00 0.00 H new ATOM 0 HB3 SER B 60 57.021 29.240 -41.874 1.00 0.00 H new ATOM 0 HG SER B 60 54.922 29.701 -40.991 1.00 0.00 H new ATOM 2156 N SER B 61 59.514 27.421 -41.638 1.00 0.00 N ATOM 2157 CA SER B 61 60.912 27.479 -42.025 1.00 0.00 C ATOM 2158 C SER B 61 61.088 28.474 -43.173 1.00 0.00 C ATOM 2159 O SER B 61 62.075 28.435 -43.909 1.00 0.00 O ATOM 2160 CB SER B 61 61.385 26.081 -42.434 1.00 0.00 C ATOM 2161 OG SER B 61 62.801 25.990 -42.458 1.00 0.00 O ATOM 0 H SER B 61 58.930 26.865 -42.263 1.00 0.00 H new ATOM 0 HA SER B 61 61.516 27.818 -41.183 1.00 0.00 H new ATOM 0 HB2 SER B 61 60.985 25.344 -41.738 1.00 0.00 H new ATOM 0 HB3 SER B 61 60.988 25.837 -43.419 1.00 0.00 H new ATOM 0 HG SER B 61 63.170 26.763 -42.933 1.00 0.00 H new ATOM 2167 N LEU B 62 60.106 29.372 -43.303 1.00 0.00 N ATOM 2168 CA LEU B 62 60.067 30.366 -44.361 1.00 0.00 C ATOM 2169 C LEU B 62 59.884 29.696 -45.724 1.00 0.00 C ATOM 2170 O LEU B 62 59.573 28.503 -45.796 1.00 0.00 O ATOM 2171 CB LEU B 62 61.316 31.247 -44.339 1.00 0.00 C ATOM 2172 CG LEU B 62 61.376 32.298 -43.219 1.00 0.00 C ATOM 2173 CD1 LEU B 62 61.582 31.652 -41.853 1.00 0.00 C ATOM 2174 CD2 LEU B 62 62.481 33.303 -43.500 1.00 0.00 C ATOM 0 H LEU B 62 59.311 29.423 -42.666 1.00 0.00 H new ATOM 0 HA LEU B 62 59.208 31.014 -44.185 1.00 0.00 H new ATOM 0 HB2 LEU B 62 62.191 30.602 -44.253 1.00 0.00 H new ATOM 0 HB3 LEU B 62 61.392 31.761 -45.297 1.00 0.00 H new ATOM 0 HG LEU B 62 60.418 32.817 -43.198 1.00 0.00 H new ATOM 0 HD11 LEU B 62 61.619 32.426 -41.086 1.00 0.00 H new ATOM 0 HD12 LEU B 62 60.755 30.973 -41.643 1.00 0.00 H new ATOM 0 HD13 LEU B 62 62.519 31.095 -41.852 1.00 0.00 H new ATOM 0 HD21 LEU B 62 62.513 34.042 -42.699 1.00 0.00 H new ATOM 0 HD22 LEU B 62 63.439 32.785 -43.554 1.00 0.00 H new ATOM 0 HD23 LEU B 62 62.285 33.804 -44.448 1.00 0.00 H new ATOM 2186 N GLU B 63 60.051 30.456 -46.802 1.00 0.00 N ATOM 2187 CA GLU B 63 59.829 29.935 -48.144 1.00 0.00 C ATOM 2188 C GLU B 63 60.800 30.578 -49.135 1.00 0.00 C ATOM 2189 O GLU B 63 61.492 31.541 -48.796 1.00 0.00 O ATOM 2190 CB GLU B 63 58.376 30.192 -48.558 1.00 0.00 C ATOM 2191 CG GLU B 63 57.654 28.951 -49.063 1.00 0.00 C ATOM 2192 CD GLU B 63 58.140 28.513 -50.426 1.00 0.00 C ATOM 2193 OE1 GLU B 63 59.218 27.884 -50.516 1.00 0.00 O ATOM 2194 OE2 GLU B 63 57.460 28.823 -51.419 1.00 0.00 O ATOM 0 H GLU B 63 60.339 31.434 -46.771 1.00 0.00 H new ATOM 0 HA GLU B 63 60.012 28.860 -48.148 1.00 0.00 H new ATOM 0 HB2 GLU B 63 57.831 30.597 -47.705 1.00 0.00 H new ATOM 0 HB3 GLU B 63 58.359 30.954 -49.338 1.00 0.00 H new ATOM 0 HG2 GLU B 63 57.796 28.137 -48.352 1.00 0.00 H new ATOM 0 HG3 GLU B 63 56.584 29.151 -49.109 1.00 0.00 H new ATOM 2201 N HIS B 64 60.854 30.039 -50.346 1.00 0.00 N ATOM 2202 CA HIS B 64 61.789 30.514 -51.361 1.00 0.00 C ATOM 2203 C HIS B 64 61.331 31.844 -51.953 1.00 0.00 C ATOM 2204 O HIS B 64 60.135 32.106 -52.078 1.00 0.00 O ATOM 2205 CB HIS B 64 61.983 29.460 -52.469 1.00 0.00 C ATOM 2206 CG HIS B 64 60.821 29.279 -53.409 1.00 0.00 C ATOM 2207 ND1 HIS B 64 59.744 28.462 -53.139 1.00 0.00 N ATOM 2208 CD2 HIS B 64 60.597 29.791 -54.644 1.00 0.00 C ATOM 2209 CE1 HIS B 64 58.911 28.478 -54.165 1.00 0.00 C ATOM 2210 NE2 HIS B 64 59.406 29.275 -55.089 1.00 0.00 N ATOM 0 H HIS B 64 60.259 29.269 -50.651 1.00 0.00 H new ATOM 0 HA HIS B 64 62.751 30.677 -50.875 1.00 0.00 H new ATOM 0 HB2 HIS B 64 62.861 29.733 -53.054 1.00 0.00 H new ATOM 0 HB3 HIS B 64 62.199 28.501 -51.999 1.00 0.00 H new ATOM 0 HD1 HIS B 64 59.611 27.928 -52.280 1.00 0.00 H new ATOM 0 HD2 HIS B 64 61.237 30.477 -55.178 1.00 0.00 H new ATOM 0 HE1 HIS B 64 57.983 27.931 -54.234 1.00 0.00 H new ATOM 2219 N HIS B 65 62.295 32.676 -52.319 1.00 0.00 N ATOM 2220 CA HIS B 65 62.005 33.992 -52.878 1.00 0.00 C ATOM 2221 C HIS B 65 62.994 34.310 -53.992 1.00 0.00 C ATOM 2222 O HIS B 65 64.094 33.756 -54.024 1.00 0.00 O ATOM 2223 CB HIS B 65 62.066 35.071 -51.783 1.00 0.00 C ATOM 2224 CG HIS B 65 63.452 35.357 -51.269 1.00 0.00 C ATOM 2225 ND1 HIS B 65 64.167 36.479 -51.626 1.00 0.00 N ATOM 2226 CD2 HIS B 65 64.250 34.661 -50.424 1.00 0.00 C ATOM 2227 CE1 HIS B 65 65.344 36.459 -51.030 1.00 0.00 C ATOM 2228 NE2 HIS B 65 65.420 35.367 -50.294 1.00 0.00 N ATOM 0 H HIS B 65 63.289 32.464 -52.239 1.00 0.00 H new ATOM 0 HA HIS B 65 60.996 33.983 -53.291 1.00 0.00 H new ATOM 0 HB2 HIS B 65 61.639 35.994 -52.175 1.00 0.00 H new ATOM 0 HB3 HIS B 65 61.439 34.760 -50.948 1.00 0.00 H new ATOM 0 HD2 HIS B 65 64.010 33.725 -49.942 1.00 0.00 H new ATOM 0 HE1 HIS B 65 66.114 37.209 -51.128 1.00 0.00 H new ATOM 0 HE2 HIS B 65 66.218 35.092 -49.722 1.00 0.00 H new ATOM 2237 N HIS B 66 62.608 35.191 -54.900 1.00 0.00 N ATOM 2238 CA HIS B 66 63.474 35.566 -56.007 1.00 0.00 C ATOM 2239 C HIS B 66 63.526 37.073 -56.186 1.00 0.00 C ATOM 2240 O HIS B 66 62.612 37.676 -56.743 1.00 0.00 O ATOM 2241 CB HIS B 66 63.021 34.913 -57.315 1.00 0.00 C ATOM 2242 CG HIS B 66 63.317 33.448 -57.395 1.00 0.00 C ATOM 2243 ND1 HIS B 66 62.380 32.508 -57.763 1.00 0.00 N ATOM 2244 CD2 HIS B 66 64.461 32.765 -57.167 1.00 0.00 C ATOM 2245 CE1 HIS B 66 62.936 31.312 -57.756 1.00 0.00 C ATOM 2246 NE2 HIS B 66 64.197 31.440 -57.395 1.00 0.00 N ATOM 0 H HIS B 66 61.702 35.660 -54.893 1.00 0.00 H new ATOM 0 HA HIS B 66 64.473 35.207 -55.760 1.00 0.00 H new ATOM 0 HB2 HIS B 66 61.948 35.064 -57.433 1.00 0.00 H new ATOM 0 HB3 HIS B 66 63.507 35.418 -58.150 1.00 0.00 H new ATOM 0 HD2 HIS B 66 65.408 33.186 -56.862 1.00 0.00 H new ATOM 0 HE1 HIS B 66 62.441 30.385 -58.004 1.00 0.00 H new ATOM 0 HE2 HIS B 66 64.867 30.677 -57.301 1.00 0.00 H new ATOM 2255 N HIS B 67 64.592 37.676 -55.695 1.00 0.00 N ATOM 2256 CA HIS B 67 64.847 39.085 -55.933 1.00 0.00 C ATOM 2257 C HIS B 67 65.994 39.197 -56.929 1.00 0.00 C ATOM 2258 O HIS B 67 67.158 39.032 -56.561 1.00 0.00 O ATOM 2259 CB HIS B 67 65.188 39.798 -54.619 1.00 0.00 C ATOM 2260 CG HIS B 67 65.141 41.295 -54.707 1.00 0.00 C ATOM 2261 ND1 HIS B 67 66.269 42.086 -54.709 1.00 0.00 N ATOM 2262 CD2 HIS B 67 64.089 42.145 -54.784 1.00 0.00 C ATOM 2263 CE1 HIS B 67 65.915 43.356 -54.782 1.00 0.00 C ATOM 2264 NE2 HIS B 67 64.600 43.418 -54.831 1.00 0.00 N ATOM 0 H HIS B 67 65.299 37.210 -55.126 1.00 0.00 H new ATOM 0 HA HIS B 67 63.958 39.566 -56.341 1.00 0.00 H new ATOM 0 HB2 HIS B 67 64.493 39.468 -53.847 1.00 0.00 H new ATOM 0 HB3 HIS B 67 66.185 39.494 -54.301 1.00 0.00 H new ATOM 0 HD2 HIS B 67 63.044 41.872 -54.805 1.00 0.00 H new ATOM 0 HE1 HIS B 67 66.589 44.200 -54.799 1.00 0.00 H new ATOM 0 HE2 HIS B 67 64.050 44.275 -54.894 1.00 0.00 H new ATOM 2273 N HIS B 68 65.650 39.439 -58.193 1.00 0.00 N ATOM 2274 CA HIS B 68 66.604 39.335 -59.302 1.00 0.00 C ATOM 2275 C HIS B 68 67.884 40.130 -59.038 1.00 0.00 C ATOM 2276 O HIS B 68 68.989 39.627 -59.234 1.00 0.00 O ATOM 2277 CB HIS B 68 65.961 39.800 -60.613 1.00 0.00 C ATOM 2278 CG HIS B 68 66.745 39.414 -61.832 1.00 0.00 C ATOM 2279 ND1 HIS B 68 66.449 38.307 -62.596 1.00 0.00 N ATOM 2280 CD2 HIS B 68 67.814 39.999 -62.425 1.00 0.00 C ATOM 2281 CE1 HIS B 68 67.305 38.222 -63.597 1.00 0.00 C ATOM 2282 NE2 HIS B 68 68.144 39.236 -63.517 1.00 0.00 N ATOM 0 H HIS B 68 64.709 39.711 -58.479 1.00 0.00 H new ATOM 0 HA HIS B 68 66.878 38.284 -59.388 1.00 0.00 H new ATOM 0 HB2 HIS B 68 64.958 39.378 -60.687 1.00 0.00 H new ATOM 0 HB3 HIS B 68 65.850 40.884 -60.590 1.00 0.00 H new ATOM 0 HD2 HIS B 68 68.314 40.899 -62.099 1.00 0.00 H new ATOM 0 HE1 HIS B 68 67.316 37.452 -64.354 1.00 0.00 H new ATOM 0 HE2 HIS B 68 68.912 39.423 -64.161 1.00 0.00 H new ATOM 2291 N HIS B 69 67.734 41.367 -58.605 1.00 0.00 N ATOM 2292 CA HIS B 69 68.883 42.194 -58.282 1.00 0.00 C ATOM 2293 C HIS B 69 68.653 42.909 -56.960 1.00 0.00 C ATOM 2294 O HIS B 69 69.243 42.488 -55.941 1.00 0.00 O ATOM 2295 CB HIS B 69 69.155 43.204 -59.402 1.00 0.00 C ATOM 2296 CG HIS B 69 70.345 44.075 -59.141 1.00 0.00 C ATOM 2297 ND1 HIS B 69 71.642 43.645 -59.315 1.00 0.00 N ATOM 2298 CD2 HIS B 69 70.430 45.355 -58.703 1.00 0.00 C ATOM 2299 CE1 HIS B 69 72.473 44.620 -58.996 1.00 0.00 C ATOM 2300 NE2 HIS B 69 71.762 45.667 -58.622 1.00 0.00 N ATOM 2301 OXT HIS B 69 67.869 43.873 -56.946 1.00 0.00 O ATOM 0 H HIS B 69 66.831 41.821 -58.469 1.00 0.00 H new ATOM 0 HA HIS B 69 69.759 41.553 -58.186 1.00 0.00 H new ATOM 0 HB2 HIS B 69 69.306 42.666 -60.338 1.00 0.00 H new ATOM 0 HB3 HIS B 69 68.275 43.834 -59.535 1.00 0.00 H new ATOM 0 HD2 HIS B 69 69.603 46.007 -58.463 1.00 0.00 H new ATOM 0 HE1 HIS B 69 73.551 44.569 -59.035 1.00 0.00 H new ATOM 0 HE2 HIS B 69 72.143 46.564 -58.321 1.00 0.00 H new