USER MOD reduce.3.24.130724 H: found=0, std=0, add=893, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 895 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 99 HIS : no HE2:sc= 0.205 K(o=0.27,f=-6.2!) USER MOD Set 1.2: A 115 TYR OH : rot -39:sc= 0.0611 USER MOD Set 2.1: A 81 ASN : amide:sc= -0.727 K(o=-0.15,f=-1.4) USER MOD Set 2.2: A 84 HIS : no HE2:sc= 0.575 K(o=-0.15,f=-4.7!) USER MOD Single : A 8 ASN : amide:sc= -0.0278 X(o=-0.028,f=-0.084) USER MOD Single : A 10 SER OG : rot 180:sc= -0.309 USER MOD Single : A 16 THR OG1 : rot 82:sc= 1.27 USER MOD Single : A 22 TYR OH : rot 149:sc= 0.267 USER MOD Single : A 39 SER OG : rot 180:sc= 0.0293 USER MOD Single : A 42 SER OG : rot 99:sc= 1.26 USER MOD Single : A 46 ASN : amide:sc=-0.00713 K(o=-0.0071,f=0.49) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0.013 USER MOD Single : A 60 LYS NZ :NH3+ -167:sc= 1.23 (180deg=0.778) USER MOD Single : A 61 SER OG : rot -69:sc= 1.27 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ -159:sc= -0.0796 (180deg=-0.463) USER MOD Single : A 74 GLN : amide:sc= -0.201 K(o=-0.2,f=-1.1) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0.0845 USER MOD Single : A 82 TYR OH : rot 30:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 ASN : amide:sc= 1.14 K(o=1.1,f=-0.0013) USER MOD Single : A 114 SER OG : rot -104:sc= -1.02 USER MOD Single : A 118 SER OG : rot 62:sc= 1.1 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 71:sc= 1.21 USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=-0.0044) USER MOD Single : A 124 SER OG : rot -92:sc= 1.16 USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 20 N PRO A 2 -8.600 5.534 -13.217 1.00 0.00 N ATOM 21 CA PRO A 2 -8.670 4.618 -12.079 1.00 0.00 C ATOM 22 C PRO A 2 -9.516 5.186 -10.946 1.00 0.00 C ATOM 23 O PRO A 2 -9.981 6.327 -11.020 1.00 0.00 O ATOM 24 CB PRO A 2 -7.209 4.494 -11.652 1.00 0.00 C ATOM 25 CG PRO A 2 -6.592 5.800 -12.022 1.00 0.00 C ATOM 26 CD PRO A 2 -7.341 6.304 -13.230 1.00 0.00 C ATOM 0 HA PRO A 2 -9.136 3.666 -12.333 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -7.124 4.306 -10.582 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -6.717 3.666 -12.161 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -6.664 6.510 -11.198 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -5.532 5.678 -12.246 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -7.528 7.376 -13.165 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -6.779 6.134 -14.148 1.00 0.00 H new ATOM 34 N VAL A 3 -9.711 4.400 -9.898 1.00 0.00 N ATOM 35 CA VAL A 3 -10.475 4.852 -8.746 1.00 0.00 C ATOM 36 C VAL A 3 -9.601 5.756 -7.886 1.00 0.00 C ATOM 37 O VAL A 3 -8.534 5.347 -7.430 1.00 0.00 O ATOM 38 CB VAL A 3 -10.991 3.669 -7.903 1.00 0.00 C ATOM 39 CG1 VAL A 3 -11.886 4.160 -6.771 1.00 0.00 C ATOM 40 CG2 VAL A 3 -11.735 2.671 -8.779 1.00 0.00 C ATOM 0 H VAL A 3 -9.352 3.448 -9.822 1.00 0.00 H new ATOM 0 HA VAL A 3 -11.343 5.403 -9.109 1.00 0.00 H new ATOM 0 HB VAL A 3 -10.131 3.165 -7.462 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -12.238 3.308 -6.190 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -11.320 4.831 -6.125 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -12.741 4.693 -7.188 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -12.091 1.843 -8.166 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -12.584 3.164 -9.252 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -11.063 2.290 -9.548 1.00 0.00 H new ATOM 50 N GLU A 4 -10.048 6.984 -7.681 1.00 0.00 N ATOM 51 CA GLU A 4 -9.242 7.984 -7.003 1.00 0.00 C ATOM 52 C GLU A 4 -10.096 8.820 -6.061 1.00 0.00 C ATOM 53 O GLU A 4 -11.237 9.142 -6.380 1.00 0.00 O ATOM 54 CB GLU A 4 -8.593 8.895 -8.044 1.00 0.00 C ATOM 55 CG GLU A 4 -7.667 9.945 -7.461 1.00 0.00 C ATOM 56 CD GLU A 4 -7.397 11.068 -8.433 1.00 0.00 C ATOM 57 OE1 GLU A 4 -6.916 10.796 -9.552 1.00 0.00 O ATOM 58 OE2 GLU A 4 -7.671 12.234 -8.089 1.00 0.00 O ATOM 0 H GLU A 4 -10.968 7.312 -7.976 1.00 0.00 H new ATOM 0 HA GLU A 4 -8.476 7.477 -6.417 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -8.031 8.281 -8.747 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -9.377 9.394 -8.613 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -8.109 10.352 -6.551 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -6.724 9.478 -7.176 1.00 0.00 H new ATOM 65 N LEU A 5 -9.540 9.159 -4.903 1.00 0.00 N ATOM 66 CA LEU A 5 -10.185 10.083 -3.979 1.00 0.00 C ATOM 67 C LEU A 5 -9.580 11.468 -4.158 1.00 0.00 C ATOM 68 O LEU A 5 -8.401 11.682 -3.877 1.00 0.00 O ATOM 69 CB LEU A 5 -10.014 9.615 -2.529 1.00 0.00 C ATOM 70 CG LEU A 5 -10.611 10.544 -1.466 1.00 0.00 C ATOM 71 CD1 LEU A 5 -12.114 10.699 -1.657 1.00 0.00 C ATOM 72 CD2 LEU A 5 -10.300 10.014 -0.074 1.00 0.00 C ATOM 0 H LEU A 5 -8.639 8.805 -4.581 1.00 0.00 H new ATOM 0 HA LEU A 5 -11.253 10.116 -4.197 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -10.471 8.631 -2.426 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -8.950 9.495 -2.326 1.00 0.00 H new ATOM 0 HG LEU A 5 -10.157 11.529 -1.577 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -12.512 11.363 -0.890 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -12.314 11.122 -2.642 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -12.593 9.723 -1.577 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -10.729 10.681 0.674 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -10.728 9.018 0.040 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -9.220 9.962 0.063 1.00 0.00 H new ATOM 84 N ARG A 6 -10.373 12.402 -4.637 1.00 0.00 N ATOM 85 CA ARG A 6 -9.857 13.726 -4.946 1.00 0.00 C ATOM 86 C ARG A 6 -10.612 14.810 -4.190 1.00 0.00 C ATOM 87 O ARG A 6 -11.386 14.521 -3.282 1.00 0.00 O ATOM 88 CB ARG A 6 -9.908 13.976 -6.452 1.00 0.00 C ATOM 89 CG ARG A 6 -11.244 13.651 -7.090 1.00 0.00 C ATOM 90 CD ARG A 6 -11.201 13.909 -8.584 1.00 0.00 C ATOM 91 NE ARG A 6 -10.107 13.183 -9.233 1.00 0.00 N ATOM 92 CZ ARG A 6 -10.007 12.993 -10.548 1.00 0.00 C ATOM 93 NH1 ARG A 6 -10.927 13.487 -11.370 1.00 0.00 N ATOM 94 NH2 ARG A 6 -8.978 12.315 -11.040 1.00 0.00 N ATOM 0 H ARG A 6 -11.368 12.276 -4.821 1.00 0.00 H new ATOM 0 HA ARG A 6 -8.817 13.767 -4.621 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -9.671 15.023 -6.644 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -9.133 13.380 -6.934 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -11.498 12.608 -6.903 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -12.027 14.256 -6.634 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -12.150 13.611 -9.031 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -11.085 14.978 -8.765 1.00 0.00 H new ATOM 0 HE ARG A 6 -9.373 12.797 -8.639 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -11.715 14.015 -10.995 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -10.845 13.338 -12.376 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -8.267 11.941 -10.412 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -8.898 12.168 -12.046 1.00 0.00 H new ATOM 108 N ALA A 7 -10.378 16.064 -4.575 1.00 0.00 N ATOM 109 CA ALA A 7 -10.996 17.208 -3.912 1.00 0.00 C ATOM 110 C ALA A 7 -12.504 17.241 -4.139 1.00 0.00 C ATOM 111 O ALA A 7 -13.210 18.059 -3.550 1.00 0.00 O ATOM 112 CB ALA A 7 -10.355 18.499 -4.392 1.00 0.00 C ATOM 0 H ALA A 7 -9.761 16.313 -5.348 1.00 0.00 H new ATOM 0 HA ALA A 7 -10.829 17.106 -2.840 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -10.824 19.346 -3.891 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -9.290 18.484 -4.161 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -10.491 18.594 -5.469 1.00 0.00 H new ATOM 118 N ASN A 8 -12.996 16.348 -4.988 1.00 0.00 N ATOM 119 CA ASN A 8 -14.433 16.191 -5.195 1.00 0.00 C ATOM 120 C ASN A 8 -14.988 15.244 -4.128 1.00 0.00 C ATOM 121 O ASN A 8 -15.933 14.493 -4.367 1.00 0.00 O ATOM 122 CB ASN A 8 -14.714 15.648 -6.602 1.00 0.00 C ATOM 123 CG ASN A 8 -16.141 15.911 -7.062 1.00 0.00 C ATOM 124 OD1 ASN A 8 -17.046 15.112 -6.828 1.00 0.00 O ATOM 125 ND2 ASN A 8 -16.354 17.036 -7.728 1.00 0.00 N ATOM 0 H ASN A 8 -12.420 15.719 -5.547 1.00 0.00 H new ATOM 0 HA ASN A 8 -14.924 17.160 -5.107 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -14.020 16.104 -7.308 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -14.524 14.575 -6.617 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -17.291 17.261 -8.063 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -15.581 17.678 -7.906 1.00 0.00 H new ATOM 132 N TRP A 9 -14.381 15.319 -2.944 1.00 0.00 N ATOM 133 CA TRP A 9 -14.726 14.487 -1.804 1.00 0.00 C ATOM 134 C TRP A 9 -16.231 14.489 -1.550 1.00 0.00 C ATOM 135 O TRP A 9 -16.816 15.503 -1.163 1.00 0.00 O ATOM 136 CB TRP A 9 -14.002 15.035 -0.581 1.00 0.00 C ATOM 137 CG TRP A 9 -13.586 14.009 0.412 1.00 0.00 C ATOM 138 CD1 TRP A 9 -12.425 13.309 0.398 1.00 0.00 C ATOM 139 CD2 TRP A 9 -14.302 13.595 1.576 1.00 0.00 C ATOM 140 NE1 TRP A 9 -12.370 12.468 1.483 1.00 0.00 N ATOM 141 CE2 TRP A 9 -13.514 12.627 2.222 1.00 0.00 C ATOM 142 CE3 TRP A 9 -15.536 13.947 2.135 1.00 0.00 C ATOM 143 CZ2 TRP A 9 -13.918 12.008 3.400 1.00 0.00 C ATOM 144 CZ3 TRP A 9 -15.936 13.330 3.303 1.00 0.00 C ATOM 145 CH2 TRP A 9 -15.128 12.371 3.925 1.00 0.00 C ATOM 0 H TRP A 9 -13.622 15.973 -2.752 1.00 0.00 H new ATOM 0 HA TRP A 9 -14.425 13.459 -2.007 1.00 0.00 H new ATOM 0 HB2 TRP A 9 -13.117 15.578 -0.914 1.00 0.00 H new ATOM 0 HB3 TRP A 9 -14.651 15.757 -0.086 1.00 0.00 H new ATOM 0 HD1 TRP A 9 -11.656 13.399 -0.355 1.00 0.00 H new ATOM 0 HE1 TRP A 9 -11.605 11.831 1.703 1.00 0.00 H new ATOM 0 HE3 TRP A 9 -16.163 14.688 1.661 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 -13.298 11.267 3.883 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 -16.887 13.591 3.744 1.00 0.00 H new ATOM 0 HH2 TRP A 9 -15.467 11.907 4.840 1.00 0.00 H new ATOM 156 N SER A 10 -16.845 13.346 -1.777 1.00 0.00 N ATOM 157 CA SER A 10 -18.279 13.202 -1.654 1.00 0.00 C ATOM 158 C SER A 10 -18.604 11.817 -1.116 1.00 0.00 C ATOM 159 O SER A 10 -17.711 10.981 -0.976 1.00 0.00 O ATOM 160 CB SER A 10 -18.933 13.415 -3.025 1.00 0.00 C ATOM 161 OG SER A 10 -20.341 13.242 -2.968 1.00 0.00 O ATOM 0 H SER A 10 -16.362 12.491 -2.052 1.00 0.00 H new ATOM 0 HA SER A 10 -18.669 13.947 -0.961 1.00 0.00 H new ATOM 0 HB2 SER A 10 -18.704 14.418 -3.386 1.00 0.00 H new ATOM 0 HB3 SER A 10 -18.509 12.713 -3.743 1.00 0.00 H new ATOM 0 HG SER A 10 -20.725 13.387 -3.858 1.00 0.00 H new ATOM 167 N GLU A 11 -19.876 11.586 -0.813 1.00 0.00 N ATOM 168 CA GLU A 11 -20.339 10.276 -0.381 1.00 0.00 C ATOM 169 C GLU A 11 -19.996 9.239 -1.439 1.00 0.00 C ATOM 170 O GLU A 11 -19.388 8.214 -1.144 1.00 0.00 O ATOM 171 CB GLU A 11 -21.849 10.304 -0.144 1.00 0.00 C ATOM 172 CG GLU A 11 -22.269 11.235 0.979 1.00 0.00 C ATOM 173 CD GLU A 11 -23.769 11.420 1.042 1.00 0.00 C ATOM 174 OE1 GLU A 11 -24.464 10.526 1.559 1.00 0.00 O ATOM 175 OE2 GLU A 11 -24.259 12.465 0.571 1.00 0.00 O ATOM 0 H GLU A 11 -20.608 12.295 -0.860 1.00 0.00 H new ATOM 0 HA GLU A 11 -19.844 10.012 0.553 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -22.347 10.609 -1.064 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -22.192 9.295 0.084 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -21.914 10.837 1.930 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -21.791 12.205 0.841 1.00 0.00 H new ATOM 182 N GLU A 12 -20.358 9.546 -2.678 1.00 0.00 N ATOM 183 CA GLU A 12 -20.069 8.670 -3.803 1.00 0.00 C ATOM 184 C GLU A 12 -18.564 8.504 -3.994 1.00 0.00 C ATOM 185 O GLU A 12 -18.067 7.385 -4.081 1.00 0.00 O ATOM 186 CB GLU A 12 -20.698 9.227 -5.082 1.00 0.00 C ATOM 187 CG GLU A 12 -22.217 9.232 -5.065 1.00 0.00 C ATOM 188 CD GLU A 12 -22.798 7.834 -5.052 1.00 0.00 C ATOM 189 OE1 GLU A 12 -22.795 7.179 -6.114 1.00 0.00 O ATOM 190 OE2 GLU A 12 -23.266 7.387 -3.984 1.00 0.00 O ATOM 0 H GLU A 12 -20.855 10.401 -2.929 1.00 0.00 H new ATOM 0 HA GLU A 12 -20.499 7.691 -3.589 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -20.342 10.245 -5.237 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -20.355 8.637 -5.932 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -22.566 9.776 -4.187 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -22.586 9.768 -5.940 1.00 0.00 H new ATOM 197 N ASP A 13 -17.854 9.629 -4.041 1.00 0.00 N ATOM 198 CA ASP A 13 -16.409 9.637 -4.285 1.00 0.00 C ATOM 199 C ASP A 13 -15.682 8.770 -3.262 1.00 0.00 C ATOM 200 O ASP A 13 -15.046 7.776 -3.611 1.00 0.00 O ATOM 201 CB ASP A 13 -15.871 11.073 -4.221 1.00 0.00 C ATOM 202 CG ASP A 13 -14.589 11.269 -5.016 1.00 0.00 C ATOM 203 OD1 ASP A 13 -14.681 11.394 -6.256 1.00 0.00 O ATOM 204 OD2 ASP A 13 -13.503 11.326 -4.403 1.00 0.00 O ATOM 0 H ASP A 13 -18.259 10.556 -3.912 1.00 0.00 H new ATOM 0 HA ASP A 13 -16.229 9.228 -5.279 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -16.632 11.756 -4.597 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -15.690 11.340 -3.180 1.00 0.00 H new ATOM 209 N LEU A 14 -15.833 9.129 -1.994 1.00 0.00 N ATOM 210 CA LEU A 14 -15.151 8.447 -0.903 1.00 0.00 C ATOM 211 C LEU A 14 -15.532 6.971 -0.830 1.00 0.00 C ATOM 212 O LEU A 14 -14.661 6.103 -0.751 1.00 0.00 O ATOM 213 CB LEU A 14 -15.487 9.124 0.425 1.00 0.00 C ATOM 214 CG LEU A 14 -14.891 8.456 1.665 1.00 0.00 C ATOM 215 CD1 LEU A 14 -13.385 8.653 1.715 1.00 0.00 C ATOM 216 CD2 LEU A 14 -15.550 8.991 2.923 1.00 0.00 C ATOM 0 H LEU A 14 -16.430 9.899 -1.694 1.00 0.00 H new ATOM 0 HA LEU A 14 -14.080 8.511 -1.095 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -15.140 10.157 0.386 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -16.571 9.156 0.534 1.00 0.00 H new ATOM 0 HG LEU A 14 -15.086 7.385 1.605 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -12.984 8.169 2.606 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -12.931 8.213 0.827 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -13.158 9.719 1.748 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -15.115 8.506 3.796 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -15.390 10.067 2.988 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -16.620 8.785 2.889 1.00 0.00 H new ATOM 228 N GLU A 15 -16.831 6.692 -0.859 1.00 0.00 N ATOM 229 CA GLU A 15 -17.319 5.337 -0.679 1.00 0.00 C ATOM 230 C GLU A 15 -16.824 4.431 -1.802 1.00 0.00 C ATOM 231 O GLU A 15 -16.433 3.296 -1.556 1.00 0.00 O ATOM 232 CB GLU A 15 -18.844 5.327 -0.619 1.00 0.00 C ATOM 233 CG GLU A 15 -19.417 4.149 0.145 1.00 0.00 C ATOM 234 CD GLU A 15 -19.062 4.174 1.622 1.00 0.00 C ATOM 235 OE1 GLU A 15 -19.722 4.906 2.389 1.00 0.00 O ATOM 236 OE2 GLU A 15 -18.131 3.449 2.029 1.00 0.00 O ATOM 0 H GLU A 15 -17.561 7.389 -1.006 1.00 0.00 H new ATOM 0 HA GLU A 15 -16.930 4.954 0.264 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -19.186 6.251 -0.154 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -19.239 5.316 -1.635 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -20.502 4.145 0.037 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -19.050 3.223 -0.296 1.00 0.00 H new ATOM 243 N THR A 16 -16.819 4.944 -3.032 1.00 0.00 N ATOM 244 CA THR A 16 -16.322 4.179 -4.171 1.00 0.00 C ATOM 245 C THR A 16 -14.862 3.784 -3.952 1.00 0.00 C ATOM 246 O THR A 16 -14.459 2.662 -4.251 1.00 0.00 O ATOM 247 CB THR A 16 -16.442 4.975 -5.489 1.00 0.00 C ATOM 248 OG1 THR A 16 -17.802 5.374 -5.699 1.00 0.00 O ATOM 249 CG2 THR A 16 -15.975 4.144 -6.675 1.00 0.00 C ATOM 0 H THR A 16 -17.152 5.880 -3.263 1.00 0.00 H new ATOM 0 HA THR A 16 -16.938 3.283 -4.252 1.00 0.00 H new ATOM 0 HB THR A 16 -15.806 5.857 -5.407 1.00 0.00 H new ATOM 0 HG1 THR A 16 -17.987 6.187 -5.185 1.00 0.00 H new ATOM 0 HG21 THR A 16 -16.071 4.729 -7.590 1.00 0.00 H new ATOM 0 HG22 THR A 16 -14.932 3.861 -6.533 1.00 0.00 H new ATOM 0 HG23 THR A 16 -16.587 3.246 -6.754 1.00 0.00 H new ATOM 257 N VAL A 17 -14.089 4.714 -3.404 1.00 0.00 N ATOM 258 CA VAL A 17 -12.681 4.486 -3.119 1.00 0.00 C ATOM 259 C VAL A 17 -12.513 3.403 -2.055 1.00 0.00 C ATOM 260 O VAL A 17 -11.793 2.424 -2.260 1.00 0.00 O ATOM 261 CB VAL A 17 -12.006 5.795 -2.659 1.00 0.00 C ATOM 262 CG1 VAL A 17 -10.558 5.569 -2.262 1.00 0.00 C ATOM 263 CG2 VAL A 17 -12.098 6.843 -3.755 1.00 0.00 C ATOM 0 H VAL A 17 -14.421 5.643 -3.146 1.00 0.00 H new ATOM 0 HA VAL A 17 -12.198 4.146 -4.035 1.00 0.00 H new ATOM 0 HB VAL A 17 -12.536 6.153 -1.777 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -10.116 6.513 -1.944 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -10.513 4.853 -1.441 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -10.004 5.178 -3.115 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -11.619 7.763 -3.420 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -11.596 6.478 -4.651 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -13.146 7.042 -3.982 1.00 0.00 H new ATOM 273 N ILE A 18 -13.205 3.570 -0.935 1.00 0.00 N ATOM 274 CA ILE A 18 -13.133 2.613 0.165 1.00 0.00 C ATOM 275 C ILE A 18 -13.612 1.230 -0.278 1.00 0.00 C ATOM 276 O ILE A 18 -12.978 0.215 0.020 1.00 0.00 O ATOM 277 CB ILE A 18 -13.968 3.085 1.376 1.00 0.00 C ATOM 278 CG1 ILE A 18 -13.456 4.441 1.874 1.00 0.00 C ATOM 279 CG2 ILE A 18 -13.923 2.052 2.497 1.00 0.00 C ATOM 280 CD1 ILE A 18 -14.261 5.013 3.020 1.00 0.00 C ATOM 0 H ILE A 18 -13.825 4.362 -0.763 1.00 0.00 H new ATOM 0 HA ILE A 18 -12.087 2.547 0.465 1.00 0.00 H new ATOM 0 HB ILE A 18 -15.005 3.198 1.059 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -12.418 4.334 2.189 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -13.466 5.149 1.046 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -14.517 2.404 3.340 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -14.328 1.106 2.137 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -12.891 1.906 2.816 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -13.839 5.973 3.318 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -15.295 5.154 2.704 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -14.230 4.325 3.865 1.00 0.00 H new ATOM 292 N ARG A 19 -14.722 1.196 -1.002 1.00 0.00 N ATOM 293 CA ARG A 19 -15.276 -0.062 -1.482 1.00 0.00 C ATOM 294 C ARG A 19 -14.342 -0.726 -2.490 1.00 0.00 C ATOM 295 O ARG A 19 -14.212 -1.942 -2.504 1.00 0.00 O ATOM 296 CB ARG A 19 -16.663 0.157 -2.088 1.00 0.00 C ATOM 297 CG ARG A 19 -17.692 0.619 -1.067 1.00 0.00 C ATOM 298 CD ARG A 19 -19.018 0.987 -1.714 1.00 0.00 C ATOM 299 NE ARG A 19 -19.691 -0.171 -2.296 1.00 0.00 N ATOM 300 CZ ARG A 19 -20.988 -0.430 -2.151 1.00 0.00 C ATOM 301 NH1 ARG A 19 -21.759 0.381 -1.440 1.00 0.00 N ATOM 302 NH2 ARG A 19 -21.518 -1.499 -2.726 1.00 0.00 N ATOM 0 H ARG A 19 -15.256 2.023 -1.269 1.00 0.00 H new ATOM 0 HA ARG A 19 -15.376 -0.733 -0.629 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -16.592 0.897 -2.885 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -17.004 -0.772 -2.545 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -17.854 -0.171 -0.334 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -17.302 1.481 -0.525 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -19.668 1.446 -0.969 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -18.846 1.733 -2.490 1.00 0.00 H new ATOM 0 HE ARG A 19 -19.132 -0.822 -2.848 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -21.359 1.210 -1.000 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -22.753 0.176 -1.333 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -20.932 -2.124 -3.280 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -22.512 -1.698 -2.615 1.00 0.00 H new ATOM 316 N ALA A 20 -13.671 0.072 -3.311 1.00 0.00 N ATOM 317 CA ALA A 20 -12.718 -0.465 -4.278 1.00 0.00 C ATOM 318 C ALA A 20 -11.552 -1.148 -3.568 1.00 0.00 C ATOM 319 O ALA A 20 -10.950 -2.086 -4.091 1.00 0.00 O ATOM 320 CB ALA A 20 -12.209 0.640 -5.190 1.00 0.00 C ATOM 0 H ALA A 20 -13.767 1.087 -3.328 1.00 0.00 H new ATOM 0 HA ALA A 20 -13.231 -1.210 -4.886 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -11.500 0.224 -5.905 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -13.047 1.084 -5.727 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -11.715 1.406 -4.593 1.00 0.00 H new ATOM 326 N VAL A 21 -11.240 -0.667 -2.371 1.00 0.00 N ATOM 327 CA VAL A 21 -10.184 -1.251 -1.559 1.00 0.00 C ATOM 328 C VAL A 21 -10.628 -2.594 -0.967 1.00 0.00 C ATOM 329 O VAL A 21 -9.838 -3.539 -0.882 1.00 0.00 O ATOM 330 CB VAL A 21 -9.762 -0.289 -0.424 1.00 0.00 C ATOM 331 CG1 VAL A 21 -8.698 -0.912 0.465 1.00 0.00 C ATOM 332 CG2 VAL A 21 -9.266 1.027 -1.002 1.00 0.00 C ATOM 0 H VAL A 21 -11.707 0.131 -1.941 1.00 0.00 H new ATOM 0 HA VAL A 21 -9.325 -1.422 -2.208 1.00 0.00 H new ATOM 0 HB VAL A 21 -10.640 -0.095 0.193 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -8.424 -0.209 1.252 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -9.088 -1.826 0.914 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -7.818 -1.149 -0.132 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -8.973 1.693 -0.191 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -8.407 0.841 -1.647 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -10.062 1.492 -1.584 1.00 0.00 H new ATOM 342 N TYR A 22 -11.894 -2.679 -0.570 1.00 0.00 N ATOM 343 CA TYR A 22 -12.429 -3.907 0.012 1.00 0.00 C ATOM 344 C TYR A 22 -13.269 -4.681 -1.005 1.00 0.00 C ATOM 345 O TYR A 22 -12.758 -5.551 -1.708 1.00 0.00 O ATOM 346 CB TYR A 22 -13.266 -3.603 1.260 1.00 0.00 C ATOM 347 CG TYR A 22 -12.484 -2.957 2.382 1.00 0.00 C ATOM 348 CD1 TYR A 22 -11.538 -3.676 3.104 1.00 0.00 C ATOM 349 CD2 TYR A 22 -12.694 -1.627 2.721 1.00 0.00 C ATOM 350 CE1 TYR A 22 -10.826 -3.086 4.130 1.00 0.00 C ATOM 351 CE2 TYR A 22 -11.984 -1.031 3.743 1.00 0.00 C ATOM 352 CZ TYR A 22 -11.052 -1.764 4.445 1.00 0.00 C ATOM 353 OH TYR A 22 -10.342 -1.174 5.462 1.00 0.00 O ATOM 0 H TYR A 22 -12.567 -1.916 -0.640 1.00 0.00 H new ATOM 0 HA TYR A 22 -11.581 -4.527 0.302 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -14.091 -2.947 0.981 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -13.706 -4.531 1.625 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -11.357 -4.712 2.859 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -13.425 -1.049 2.176 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -10.096 -3.658 4.683 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -12.158 0.005 3.992 1.00 0.00 H new ATOM 0 HH TYR A 22 -10.220 -0.222 5.266 1.00 0.00 H new ATOM 586 N LEU A 37 -12.023 -2.492 9.619 1.00 0.00 N ATOM 587 CA LEU A 37 -10.952 -1.599 10.062 1.00 0.00 C ATOM 588 C LEU A 37 -11.496 -0.194 10.302 1.00 0.00 C ATOM 589 O LEU A 37 -10.969 0.788 9.779 1.00 0.00 O ATOM 590 CB LEU A 37 -9.828 -1.564 9.020 1.00 0.00 C ATOM 591 CG LEU A 37 -9.135 -2.904 8.764 1.00 0.00 C ATOM 592 CD1 LEU A 37 -8.167 -2.788 7.597 1.00 0.00 C ATOM 593 CD2 LEU A 37 -8.404 -3.375 10.012 1.00 0.00 C ATOM 0 HA LEU A 37 -10.548 -1.978 11.001 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -10.239 -1.200 8.078 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -9.078 -0.841 9.342 1.00 0.00 H new ATOM 0 HG LEU A 37 -9.897 -3.641 8.511 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -7.683 -3.750 7.429 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -8.712 -2.494 6.700 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -7.411 -2.036 7.825 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.918 -4.329 9.810 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -7.653 -2.637 10.294 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.117 -3.496 10.827 1.00 0.00 H new ATOM 605 N VAL A 38 -12.539 -0.111 11.119 1.00 0.00 N ATOM 606 CA VAL A 38 -13.269 1.138 11.315 1.00 0.00 C ATOM 607 C VAL A 38 -12.384 2.238 11.891 1.00 0.00 C ATOM 608 O VAL A 38 -12.647 3.417 11.678 1.00 0.00 O ATOM 609 CB VAL A 38 -14.504 0.945 12.217 1.00 0.00 C ATOM 610 CG1 VAL A 38 -15.522 0.052 11.529 1.00 0.00 C ATOM 611 CG2 VAL A 38 -14.110 0.367 13.568 1.00 0.00 C ATOM 0 H VAL A 38 -12.900 -0.897 11.659 1.00 0.00 H new ATOM 0 HA VAL A 38 -13.603 1.448 10.325 1.00 0.00 H new ATOM 0 HB VAL A 38 -14.956 1.922 12.391 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -16.390 -0.077 12.176 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -15.834 0.511 10.591 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -15.074 -0.921 11.325 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -15.001 0.241 14.184 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -13.629 -0.601 13.424 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -13.417 1.045 14.066 1.00 0.00 H new ATOM 621 N SER A 39 -11.336 1.855 12.605 1.00 0.00 N ATOM 622 CA SER A 39 -10.386 2.818 13.137 1.00 0.00 C ATOM 623 C SER A 39 -9.670 3.536 11.993 1.00 0.00 C ATOM 624 O SER A 39 -9.604 4.770 11.952 1.00 0.00 O ATOM 625 CB SER A 39 -9.384 2.094 14.038 1.00 0.00 C ATOM 626 OG SER A 39 -8.942 0.887 13.434 1.00 0.00 O ATOM 0 H SER A 39 -11.123 0.883 12.829 1.00 0.00 H new ATOM 0 HA SER A 39 -10.914 3.567 13.727 1.00 0.00 H new ATOM 0 HB2 SER A 39 -8.530 2.742 14.233 1.00 0.00 H new ATOM 0 HB3 SER A 39 -9.846 1.876 15.001 1.00 0.00 H new ATOM 0 HG SER A 39 -8.301 0.441 14.026 1.00 0.00 H new ATOM 632 N ALA A 40 -9.178 2.750 11.047 1.00 0.00 N ATOM 633 CA ALA A 40 -8.480 3.283 9.889 1.00 0.00 C ATOM 634 C ALA A 40 -9.453 3.970 8.944 1.00 0.00 C ATOM 635 O ALA A 40 -9.152 5.031 8.394 1.00 0.00 O ATOM 636 CB ALA A 40 -7.725 2.181 9.163 1.00 0.00 C ATOM 0 H ALA A 40 -9.251 1.733 11.060 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.759 4.022 10.238 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.209 2.601 8.299 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -6.996 1.734 9.839 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -8.428 1.417 8.830 1.00 0.00 H new ATOM 642 N GLU A 41 -10.627 3.371 8.763 1.00 0.00 N ATOM 643 CA GLU A 41 -11.634 3.949 7.885 1.00 0.00 C ATOM 644 C GLU A 41 -12.121 5.284 8.437 1.00 0.00 C ATOM 645 O GLU A 41 -12.432 6.190 7.677 1.00 0.00 O ATOM 646 CB GLU A 41 -12.817 3.002 7.672 1.00 0.00 C ATOM 647 CG GLU A 41 -13.742 3.465 6.553 1.00 0.00 C ATOM 648 CD GLU A 41 -14.969 2.597 6.384 1.00 0.00 C ATOM 649 OE1 GLU A 41 -14.827 1.423 6.006 1.00 0.00 O ATOM 650 OE2 GLU A 41 -16.090 3.103 6.605 1.00 0.00 O ATOM 0 H GLU A 41 -10.901 2.495 9.208 1.00 0.00 H new ATOM 0 HA GLU A 41 -11.164 4.114 6.916 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -12.443 2.005 7.440 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -13.385 2.922 8.599 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -14.057 4.489 6.753 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -13.186 3.480 5.616 1.00 0.00 H new ATOM 657 N SER A 42 -12.178 5.408 9.760 1.00 0.00 N ATOM 658 CA SER A 42 -12.522 6.681 10.384 1.00 0.00 C ATOM 659 C SER A 42 -11.482 7.738 10.035 1.00 0.00 C ATOM 660 O SER A 42 -11.822 8.861 9.674 1.00 0.00 O ATOM 661 CB SER A 42 -12.636 6.537 11.903 1.00 0.00 C ATOM 662 OG SER A 42 -13.742 5.725 12.258 1.00 0.00 O ATOM 0 H SER A 42 -11.992 4.649 10.416 1.00 0.00 H new ATOM 0 HA SER A 42 -13.492 6.995 9.998 1.00 0.00 H new ATOM 0 HB2 SER A 42 -11.719 6.101 12.300 1.00 0.00 H new ATOM 0 HB3 SER A 42 -12.743 7.522 12.358 1.00 0.00 H new ATOM 0 HG SER A 42 -13.433 4.814 12.444 1.00 0.00 H new ATOM 668 N LEU A 43 -10.211 7.361 10.113 1.00 0.00 N ATOM 669 CA LEU A 43 -9.124 8.275 9.783 1.00 0.00 C ATOM 670 C LEU A 43 -9.273 8.805 8.356 1.00 0.00 C ATOM 671 O LEU A 43 -8.908 9.943 8.065 1.00 0.00 O ATOM 672 CB LEU A 43 -7.771 7.579 9.950 1.00 0.00 C ATOM 673 CG LEU A 43 -7.418 7.165 11.380 1.00 0.00 C ATOM 674 CD1 LEU A 43 -6.113 6.383 11.402 1.00 0.00 C ATOM 675 CD2 LEU A 43 -7.321 8.390 12.281 1.00 0.00 C ATOM 0 H LEU A 43 -9.908 6.431 10.401 1.00 0.00 H new ATOM 0 HA LEU A 43 -9.171 9.120 10.470 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -7.758 6.690 9.319 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -6.991 8.244 9.579 1.00 0.00 H new ATOM 0 HG LEU A 43 -8.212 6.521 11.758 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -5.878 6.097 12.427 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -6.215 5.487 10.789 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -5.310 7.004 11.005 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -7.069 8.077 13.294 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -6.547 9.058 11.904 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -8.278 8.912 12.290 1.00 0.00 H new ATOM 687 N LEU A 44 -9.806 7.978 7.468 1.00 0.00 N ATOM 688 CA LEU A 44 -10.028 8.391 6.088 1.00 0.00 C ATOM 689 C LEU A 44 -11.354 9.144 5.936 1.00 0.00 C ATOM 690 O LEU A 44 -11.403 10.230 5.361 1.00 0.00 O ATOM 691 CB LEU A 44 -10.006 7.175 5.162 1.00 0.00 C ATOM 692 CG LEU A 44 -10.095 7.499 3.669 1.00 0.00 C ATOM 693 CD1 LEU A 44 -8.888 8.308 3.223 1.00 0.00 C ATOM 694 CD2 LEU A 44 -10.216 6.223 2.850 1.00 0.00 C ATOM 0 H LEU A 44 -10.092 7.021 7.676 1.00 0.00 H new ATOM 0 HA LEU A 44 -9.222 9.069 5.809 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -9.088 6.615 5.343 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -10.836 6.520 5.427 1.00 0.00 H new ATOM 0 HG LEU A 44 -10.990 8.099 3.503 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -8.971 8.528 2.159 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -8.848 9.241 3.784 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -7.979 7.736 3.406 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -10.278 6.475 1.791 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -9.342 5.595 3.023 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -11.115 5.683 3.148 1.00 0.00 H new ATOM 706 N ARG A 45 -12.423 8.566 6.479 1.00 0.00 N ATOM 707 CA ARG A 45 -13.775 9.092 6.296 1.00 0.00 C ATOM 708 C ARG A 45 -13.979 10.404 7.057 1.00 0.00 C ATOM 709 O ARG A 45 -14.857 11.195 6.716 1.00 0.00 O ATOM 710 CB ARG A 45 -14.814 8.048 6.735 1.00 0.00 C ATOM 711 CG ARG A 45 -16.242 8.392 6.334 1.00 0.00 C ATOM 712 CD ARG A 45 -17.230 7.295 6.721 1.00 0.00 C ATOM 713 NE ARG A 45 -16.939 6.008 6.073 1.00 0.00 N ATOM 714 CZ ARG A 45 -17.568 5.551 4.981 1.00 0.00 C ATOM 715 NH1 ARG A 45 -18.515 6.269 4.392 1.00 0.00 N ATOM 716 NH2 ARG A 45 -17.260 4.353 4.496 1.00 0.00 N ATOM 0 H ARG A 45 -12.378 7.725 7.055 1.00 0.00 H new ATOM 0 HA ARG A 45 -13.910 9.304 5.235 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -14.549 7.082 6.304 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -14.768 7.937 7.818 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -16.536 9.328 6.810 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -16.286 8.555 5.257 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -17.213 7.163 7.803 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -18.239 7.611 6.454 1.00 0.00 H new ATOM 0 HE ARG A 45 -16.210 5.424 6.482 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -18.773 7.181 4.769 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -18.986 5.909 3.562 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -16.547 3.785 4.954 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -17.736 4.001 3.665 1.00 0.00 H new ATOM 730 N ASN A 46 -13.179 10.637 8.088 1.00 0.00 N ATOM 731 CA ASN A 46 -13.251 11.896 8.821 1.00 0.00 C ATOM 732 C ASN A 46 -12.224 12.893 8.281 1.00 0.00 C ATOM 733 O ASN A 46 -12.123 14.017 8.767 1.00 0.00 O ATOM 734 CB ASN A 46 -13.053 11.681 10.328 1.00 0.00 C ATOM 735 CG ASN A 46 -14.170 10.862 10.958 1.00 0.00 C ATOM 736 OD1 ASN A 46 -14.073 9.641 11.087 1.00 0.00 O ATOM 737 ND2 ASN A 46 -15.246 11.527 11.350 1.00 0.00 N ATOM 0 H ASN A 46 -12.480 9.980 8.434 1.00 0.00 H new ATOM 0 HA ASN A 46 -14.249 12.309 8.673 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -12.101 11.179 10.497 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -12.995 12.650 10.824 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -16.028 11.028 11.774 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -15.293 12.539 11.228 1.00 0.00 H new ATOM 744 N GLY A 47 -11.464 12.467 7.274 1.00 0.00 N ATOM 745 CA GLY A 47 -10.559 13.366 6.575 1.00 0.00 C ATOM 746 C GLY A 47 -9.270 13.657 7.323 1.00 0.00 C ATOM 747 O GLY A 47 -8.930 14.821 7.546 1.00 0.00 O ATOM 0 H GLY A 47 -11.459 11.508 6.928 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -10.313 12.934 5.605 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -11.075 14.307 6.384 1.00 0.00 H new ATOM 751 N LYS A 48 -8.548 12.616 7.714 1.00 0.00 N ATOM 752 CA LYS A 48 -7.251 12.797 8.354 1.00 0.00 C ATOM 753 C LYS A 48 -6.113 12.208 7.521 1.00 0.00 C ATOM 754 O LYS A 48 -5.107 12.874 7.280 1.00 0.00 O ATOM 755 CB LYS A 48 -7.246 12.157 9.743 1.00 0.00 C ATOM 756 CG LYS A 48 -7.973 12.968 10.800 1.00 0.00 C ATOM 757 CD LYS A 48 -7.881 12.301 12.161 1.00 0.00 C ATOM 758 CE LYS A 48 -8.100 13.292 13.289 1.00 0.00 C ATOM 759 NZ LYS A 48 -9.470 13.871 13.291 1.00 0.00 N ATOM 0 H LYS A 48 -8.835 11.644 7.601 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.087 13.871 8.442 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -7.704 11.170 9.678 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.214 12.009 10.060 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -7.545 13.969 10.853 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -9.020 13.083 10.518 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -8.623 11.505 12.227 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -6.902 11.834 12.272 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -7.919 12.796 14.242 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -7.370 14.097 13.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -9.563 14.540 14.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -9.637 14.370 12.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -10.169 13.109 13.399 1.00 0.00 H new ATOM 773 N ILE A 49 -6.274 10.970 7.067 1.00 0.00 N ATOM 774 CA ILE A 49 -5.178 10.264 6.408 1.00 0.00 C ATOM 775 C ILE A 49 -5.342 10.231 4.892 1.00 0.00 C ATOM 776 O ILE A 49 -6.372 10.637 4.352 1.00 0.00 O ATOM 777 CB ILE A 49 -5.032 8.816 6.920 1.00 0.00 C ATOM 778 CG1 ILE A 49 -6.286 8.001 6.592 1.00 0.00 C ATOM 779 CG2 ILE A 49 -4.759 8.815 8.418 1.00 0.00 C ATOM 780 CD1 ILE A 49 -6.149 6.522 6.895 1.00 0.00 C ATOM 0 H ILE A 49 -7.141 10.438 7.141 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.278 10.826 6.657 1.00 0.00 H new ATOM 0 HB ILE A 49 -4.186 8.349 6.416 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -7.127 8.402 7.157 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -6.523 8.126 5.536 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -4.658 7.788 8.769 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -3.837 9.360 8.620 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -5.587 9.296 8.939 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -7.076 6.010 6.637 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -5.329 6.105 6.310 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -5.943 6.386 7.957 1.00 0.00 H new ATOM 792 N THR A 50 -4.308 9.738 4.226 1.00 0.00 N ATOM 793 CA THR A 50 -4.297 9.613 2.778 1.00 0.00 C ATOM 794 C THR A 50 -4.758 8.218 2.349 1.00 0.00 C ATOM 795 O THR A 50 -5.051 7.369 3.194 1.00 0.00 O ATOM 796 CB THR A 50 -2.882 9.878 2.234 1.00 0.00 C ATOM 797 OG1 THR A 50 -1.931 9.067 2.940 1.00 0.00 O ATOM 798 CG2 THR A 50 -2.511 11.346 2.384 1.00 0.00 C ATOM 0 H THR A 50 -3.452 9.413 4.676 1.00 0.00 H new ATOM 0 HA THR A 50 -4.987 10.351 2.369 1.00 0.00 H new ATOM 0 HB THR A 50 -2.867 9.622 1.174 1.00 0.00 H new ATOM 0 HG1 THR A 50 -1.032 9.237 2.590 1.00 0.00 H new ATOM 0 HG21 THR A 50 -1.507 11.509 1.993 1.00 0.00 H new ATOM 0 HG22 THR A 50 -3.221 11.959 1.829 1.00 0.00 H new ATOM 0 HG23 THR A 50 -2.539 11.623 3.438 1.00 0.00 H new ATOM 806 N VAL A 51 -4.806 7.972 1.041 1.00 0.00 N ATOM 807 CA VAL A 51 -5.258 6.680 0.531 1.00 0.00 C ATOM 808 C VAL A 51 -4.164 5.629 0.670 1.00 0.00 C ATOM 809 O VAL A 51 -4.442 4.480 1.015 1.00 0.00 O ATOM 810 CB VAL A 51 -5.726 6.768 -0.939 1.00 0.00 C ATOM 811 CG1 VAL A 51 -6.066 5.389 -1.494 1.00 0.00 C ATOM 812 CG2 VAL A 51 -6.931 7.688 -1.057 1.00 0.00 C ATOM 0 H VAL A 51 -4.540 8.644 0.321 1.00 0.00 H new ATOM 0 HA VAL A 51 -6.115 6.383 1.135 1.00 0.00 H new ATOM 0 HB VAL A 51 -4.905 7.179 -1.527 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -6.392 5.484 -2.530 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -5.184 4.751 -1.448 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -6.866 4.945 -0.901 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -7.249 7.740 -2.098 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -7.747 7.299 -0.448 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.662 8.686 -0.710 1.00 0.00 H new ATOM 822 N ARG A 52 -2.915 6.020 0.429 1.00 0.00 N ATOM 823 CA ARG A 52 -1.795 5.100 0.612 1.00 0.00 C ATOM 824 C ARG A 52 -1.695 4.678 2.075 1.00 0.00 C ATOM 825 O ARG A 52 -1.277 3.563 2.382 1.00 0.00 O ATOM 826 CB ARG A 52 -0.473 5.718 0.148 1.00 0.00 C ATOM 827 CG ARG A 52 -0.098 6.998 0.873 1.00 0.00 C ATOM 828 CD ARG A 52 1.323 7.423 0.550 1.00 0.00 C ATOM 829 NE ARG A 52 1.613 8.754 1.071 1.00 0.00 N ATOM 830 CZ ARG A 52 2.741 9.096 1.694 1.00 0.00 C ATOM 831 NH1 ARG A 52 3.727 8.219 1.844 1.00 0.00 N ATOM 832 NH2 ARG A 52 2.889 10.327 2.158 1.00 0.00 N ATOM 0 H ARG A 52 -2.655 6.954 0.111 1.00 0.00 H new ATOM 0 HA ARG A 52 -1.983 4.221 -0.004 1.00 0.00 H new ATOM 0 HB2 ARG A 52 0.325 4.988 0.286 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -0.536 5.924 -0.921 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -0.789 7.793 0.592 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -0.200 6.852 1.948 1.00 0.00 H new ATOM 0 HD2 ARG A 52 2.024 6.704 0.974 1.00 0.00 H new ATOM 0 HD3 ARG A 52 1.470 7.413 -0.530 1.00 0.00 H new ATOM 0 HE ARG A 52 0.902 9.475 0.950 1.00 0.00 H new ATOM 0 HH11 ARG A 52 3.626 7.271 1.481 1.00 0.00 H new ATOM 0 HH12 ARG A 52 4.585 8.493 2.323 1.00 0.00 H new ATOM 0 HH21 ARG A 52 2.141 11.010 2.038 1.00 0.00 H new ATOM 0 HH22 ARG A 52 3.751 10.592 2.635 1.00 0.00 H new ATOM 846 N GLU A 53 -2.096 5.572 2.974 1.00 0.00 N ATOM 847 CA GLU A 53 -2.132 5.263 4.394 1.00 0.00 C ATOM 848 C GLU A 53 -3.218 4.228 4.670 1.00 0.00 C ATOM 849 O GLU A 53 -3.021 3.284 5.437 1.00 0.00 O ATOM 850 CB GLU A 53 -2.400 6.531 5.200 1.00 0.00 C ATOM 851 CG GLU A 53 -2.340 6.320 6.701 1.00 0.00 C ATOM 852 CD GLU A 53 -0.971 5.875 7.164 1.00 0.00 C ATOM 853 OE1 GLU A 53 -0.065 6.728 7.247 1.00 0.00 O ATOM 854 OE2 GLU A 53 -0.789 4.675 7.445 1.00 0.00 O ATOM 0 H GLU A 53 -2.400 6.517 2.741 1.00 0.00 H new ATOM 0 HA GLU A 53 -1.167 4.855 4.694 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -1.671 7.291 4.919 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -3.384 6.919 4.935 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -2.608 7.247 7.207 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -3.079 5.573 6.990 1.00 0.00 H new ATOM 861 N PHE A 54 -4.361 4.411 4.022 1.00 0.00 N ATOM 862 CA PHE A 54 -5.466 3.472 4.131 1.00 0.00 C ATOM 863 C PHE A 54 -5.036 2.106 3.603 1.00 0.00 C ATOM 864 O PHE A 54 -5.366 1.069 4.180 1.00 0.00 O ATOM 865 CB PHE A 54 -6.678 4.000 3.358 1.00 0.00 C ATOM 866 CG PHE A 54 -7.951 3.254 3.628 1.00 0.00 C ATOM 867 CD1 PHE A 54 -8.604 3.397 4.841 1.00 0.00 C ATOM 868 CD2 PHE A 54 -8.504 2.425 2.666 1.00 0.00 C ATOM 869 CE1 PHE A 54 -9.784 2.726 5.090 1.00 0.00 C ATOM 870 CE2 PHE A 54 -9.683 1.749 2.911 1.00 0.00 C ATOM 871 CZ PHE A 54 -10.324 1.901 4.124 1.00 0.00 C ATOM 0 H PHE A 54 -4.546 5.207 3.412 1.00 0.00 H new ATOM 0 HA PHE A 54 -5.749 3.364 5.178 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -6.825 5.051 3.609 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -6.462 3.954 2.291 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -8.185 4.041 5.600 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -8.008 2.306 1.714 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -10.284 2.846 6.040 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -10.103 1.102 2.155 1.00 0.00 H new ATOM 0 HZ PHE A 54 -11.247 1.375 4.317 1.00 0.00 H new ATOM 881 N VAL A 55 -4.282 2.117 2.506 1.00 0.00 N ATOM 882 CA VAL A 55 -3.704 0.896 1.960 1.00 0.00 C ATOM 883 C VAL A 55 -2.770 0.247 2.975 1.00 0.00 C ATOM 884 O VAL A 55 -2.828 -0.960 3.180 1.00 0.00 O ATOM 885 CB VAL A 55 -2.928 1.154 0.644 1.00 0.00 C ATOM 886 CG1 VAL A 55 -2.177 -0.094 0.198 1.00 0.00 C ATOM 887 CG2 VAL A 55 -3.871 1.613 -0.455 1.00 0.00 C ATOM 0 H VAL A 55 -4.058 2.961 1.978 1.00 0.00 H new ATOM 0 HA VAL A 55 -4.534 0.226 1.739 1.00 0.00 H new ATOM 0 HB VAL A 55 -2.202 1.944 0.837 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -1.641 0.115 -0.728 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -1.466 -0.386 0.971 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -2.886 -0.905 0.032 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -3.305 1.788 -1.370 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.622 0.844 -0.635 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -4.363 2.537 -0.150 1.00 0.00 H new ATOM 897 N ARG A 56 -1.934 1.060 3.619 1.00 0.00 N ATOM 898 CA ARG A 56 -0.963 0.564 4.592 1.00 0.00 C ATOM 899 C ARG A 56 -1.654 -0.182 5.726 1.00 0.00 C ATOM 900 O ARG A 56 -1.198 -1.244 6.146 1.00 0.00 O ATOM 901 CB ARG A 56 -0.123 1.716 5.159 1.00 0.00 C ATOM 902 CG ARG A 56 0.946 1.254 6.140 1.00 0.00 C ATOM 903 CD ARG A 56 2.070 2.272 6.296 1.00 0.00 C ATOM 904 NE ARG A 56 1.644 3.519 6.935 1.00 0.00 N ATOM 905 CZ ARG A 56 2.423 4.235 7.753 1.00 0.00 C ATOM 906 NH1 ARG A 56 3.580 3.745 8.176 1.00 0.00 N ATOM 907 NH2 ARG A 56 2.023 5.421 8.184 1.00 0.00 N ATOM 0 H ARG A 56 -1.910 2.071 3.483 1.00 0.00 H new ATOM 0 HA ARG A 56 -0.303 -0.131 4.073 1.00 0.00 H new ATOM 0 HB2 ARG A 56 0.354 2.248 4.336 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -0.782 2.426 5.658 1.00 0.00 H new ATOM 0 HG2 ARG A 56 0.488 1.070 7.112 1.00 0.00 H new ATOM 0 HG3 ARG A 56 1.363 0.306 5.799 1.00 0.00 H new ATOM 0 HD2 ARG A 56 2.873 1.828 6.884 1.00 0.00 H new ATOM 0 HD3 ARG A 56 2.483 2.499 5.313 1.00 0.00 H new ATOM 0 HE ARG A 56 0.702 3.860 6.746 1.00 0.00 H new ATOM 0 HH11 ARG A 56 3.880 2.817 7.878 1.00 0.00 H new ATOM 0 HH12 ARG A 56 4.170 4.296 8.800 1.00 0.00 H new ATOM 0 HH21 ARG A 56 1.118 5.791 7.892 1.00 0.00 H new ATOM 0 HH22 ARG A 56 2.619 5.965 8.808 1.00 0.00 H new ATOM 921 N ALA A 57 -2.758 0.372 6.207 1.00 0.00 N ATOM 922 CA ALA A 57 -3.528 -0.262 7.269 1.00 0.00 C ATOM 923 C ALA A 57 -3.988 -1.654 6.848 1.00 0.00 C ATOM 924 O ALA A 57 -3.767 -2.636 7.558 1.00 0.00 O ATOM 925 CB ALA A 57 -4.721 0.602 7.646 1.00 0.00 C ATOM 0 H ALA A 57 -3.141 1.259 5.879 1.00 0.00 H new ATOM 0 HA ALA A 57 -2.884 -0.367 8.142 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -5.286 0.115 8.441 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -4.371 1.574 7.993 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -5.362 0.737 6.775 1.00 0.00 H new ATOM 931 N VAL A 58 -4.597 -1.737 5.673 1.00 0.00 N ATOM 932 CA VAL A 58 -5.118 -3.001 5.161 1.00 0.00 C ATOM 933 C VAL A 58 -3.979 -3.911 4.687 1.00 0.00 C ATOM 934 O VAL A 58 -4.161 -5.110 4.494 1.00 0.00 O ATOM 935 CB VAL A 58 -6.116 -2.768 4.002 1.00 0.00 C ATOM 936 CG1 VAL A 58 -6.868 -4.048 3.660 1.00 0.00 C ATOM 937 CG2 VAL A 58 -7.094 -1.653 4.349 1.00 0.00 C ATOM 0 H VAL A 58 -4.744 -0.941 5.052 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.645 -3.491 5.980 1.00 0.00 H new ATOM 0 HB VAL A 58 -5.544 -2.466 3.125 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -7.562 -3.855 2.842 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -6.158 -4.818 3.359 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -7.423 -4.389 4.534 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -7.787 -1.506 3.520 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -7.652 -1.925 5.245 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -6.544 -0.730 4.530 1.00 0.00 H new ATOM 947 N ALA A 59 -2.813 -3.327 4.462 1.00 0.00 N ATOM 948 CA ALA A 59 -1.639 -4.095 4.071 1.00 0.00 C ATOM 949 C ALA A 59 -0.881 -4.601 5.291 1.00 0.00 C ATOM 950 O ALA A 59 0.029 -5.413 5.170 1.00 0.00 O ATOM 951 CB ALA A 59 -0.722 -3.261 3.195 1.00 0.00 C ATOM 0 H ALA A 59 -2.653 -2.323 4.543 1.00 0.00 H new ATOM 0 HA ALA A 59 -1.982 -4.958 3.500 1.00 0.00 H new ATOM 0 HB1 ALA A 59 0.149 -3.852 2.913 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -1.258 -2.953 2.297 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -0.398 -2.377 3.745 1.00 0.00 H new ATOM 957 N LYS A 60 -1.245 -4.098 6.461 1.00 0.00 N ATOM 958 CA LYS A 60 -0.588 -4.495 7.696 1.00 0.00 C ATOM 959 C LYS A 60 -1.561 -5.246 8.614 1.00 0.00 C ATOM 960 O LYS A 60 -1.264 -5.506 9.783 1.00 0.00 O ATOM 961 CB LYS A 60 -0.022 -3.253 8.395 1.00 0.00 C ATOM 962 CG LYS A 60 0.952 -3.558 9.525 1.00 0.00 C ATOM 963 CD LYS A 60 1.496 -2.285 10.151 1.00 0.00 C ATOM 964 CE LYS A 60 2.360 -1.500 9.175 1.00 0.00 C ATOM 965 NZ LYS A 60 2.856 -0.230 9.772 1.00 0.00 N ATOM 0 H LYS A 60 -1.992 -3.414 6.581 1.00 0.00 H new ATOM 0 HA LYS A 60 0.232 -5.174 7.462 1.00 0.00 H new ATOM 0 HB2 LYS A 60 0.482 -2.632 7.654 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -0.850 -2.666 8.793 1.00 0.00 H new ATOM 0 HG2 LYS A 60 0.451 -4.154 10.288 1.00 0.00 H new ATOM 0 HG3 LYS A 60 1.778 -4.158 9.143 1.00 0.00 H new ATOM 0 HD2 LYS A 60 0.667 -1.661 10.485 1.00 0.00 H new ATOM 0 HD3 LYS A 60 2.082 -2.536 11.035 1.00 0.00 H new ATOM 0 HE2 LYS A 60 3.208 -2.112 8.867 1.00 0.00 H new ATOM 0 HE3 LYS A 60 1.784 -1.278 8.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 3.249 0.375 9.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 2.069 0.264 10.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 3.597 -0.441 10.471 1.00 0.00 H new ATOM 979 N SER A 61 -2.722 -5.602 8.078 1.00 0.00 N ATOM 980 CA SER A 61 -3.719 -6.345 8.838 1.00 0.00 C ATOM 981 C SER A 61 -4.701 -7.032 7.895 1.00 0.00 C ATOM 982 O SER A 61 -4.675 -6.786 6.689 1.00 0.00 O ATOM 983 CB SER A 61 -4.460 -5.416 9.806 1.00 0.00 C ATOM 984 OG SER A 61 -5.059 -4.327 9.127 1.00 0.00 O ATOM 0 H SER A 61 -2.996 -5.388 7.119 1.00 0.00 H new ATOM 0 HA SER A 61 -3.209 -7.111 9.423 1.00 0.00 H new ATOM 0 HB2 SER A 61 -5.226 -5.980 10.338 1.00 0.00 H new ATOM 0 HB3 SER A 61 -3.763 -5.040 10.555 1.00 0.00 H new ATOM 0 HG SER A 61 -4.361 -3.731 8.784 1.00 0.00 H new ATOM 990 N GLU A 62 -5.562 -7.886 8.457 1.00 0.00 N ATOM 991 CA GLU A 62 -6.535 -8.661 7.677 1.00 0.00 C ATOM 992 C GLU A 62 -5.837 -9.659 6.751 1.00 0.00 C ATOM 993 O GLU A 62 -4.608 -9.739 6.731 1.00 0.00 O ATOM 994 CB GLU A 62 -7.464 -7.740 6.874 1.00 0.00 C ATOM 995 CG GLU A 62 -8.412 -6.930 7.742 1.00 0.00 C ATOM 996 CD GLU A 62 -9.303 -7.811 8.593 1.00 0.00 C ATOM 997 OE1 GLU A 62 -10.289 -8.362 8.058 1.00 0.00 O ATOM 998 OE2 GLU A 62 -9.014 -7.973 9.796 1.00 0.00 O ATOM 0 H GLU A 62 -5.605 -8.060 9.461 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.144 -9.224 8.384 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -6.859 -7.058 6.276 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -8.047 -8.343 6.178 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -7.835 -6.268 8.388 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.031 -6.296 7.107 1.00 0.00 H new ATOM 1005 N LEU A 63 -6.640 -10.464 6.044 1.00 0.00 N ATOM 1006 CA LEU A 63 -6.146 -11.454 5.069 1.00 0.00 C ATOM 1007 C LEU A 63 -5.477 -12.643 5.780 1.00 0.00 C ATOM 1008 O LEU A 63 -5.340 -13.724 5.205 1.00 0.00 O ATOM 1009 CB LEU A 63 -5.198 -10.781 4.058 1.00 0.00 C ATOM 1010 CG LEU A 63 -4.990 -11.510 2.722 1.00 0.00 C ATOM 1011 CD1 LEU A 63 -4.597 -10.516 1.640 1.00 0.00 C ATOM 1012 CD2 LEU A 63 -3.916 -12.582 2.837 1.00 0.00 C ATOM 0 H LEU A 63 -7.656 -10.450 6.130 1.00 0.00 H new ATOM 0 HA LEU A 63 -6.996 -11.852 4.514 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -5.579 -9.782 3.846 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -4.225 -10.656 4.534 1.00 0.00 H new ATOM 0 HG LEU A 63 -5.931 -11.991 2.456 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -4.452 -11.043 0.697 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -5.387 -9.774 1.523 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -3.670 -10.017 1.923 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -3.793 -13.079 1.875 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -2.973 -12.122 3.131 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -4.212 -13.314 3.588 1.00 0.00 H new ATOM 1024 N TYR A 64 -5.091 -12.419 7.040 1.00 0.00 N ATOM 1025 CA TYR A 64 -4.536 -13.445 7.931 1.00 0.00 C ATOM 1026 C TYR A 64 -3.051 -13.677 7.668 1.00 0.00 C ATOM 1027 O TYR A 64 -2.439 -12.975 6.863 1.00 0.00 O ATOM 1028 CB TYR A 64 -5.315 -14.764 7.843 1.00 0.00 C ATOM 1029 CG TYR A 64 -6.787 -14.627 8.156 1.00 0.00 C ATOM 1030 CD1 TYR A 64 -7.219 -14.100 9.367 1.00 0.00 C ATOM 1031 CD2 TYR A 64 -7.747 -15.019 7.233 1.00 0.00 C ATOM 1032 CE1 TYR A 64 -8.565 -13.972 9.649 1.00 0.00 C ATOM 1033 CE2 TYR A 64 -9.095 -14.894 7.506 1.00 0.00 C ATOM 1034 CZ TYR A 64 -9.499 -14.371 8.716 1.00 0.00 C ATOM 1035 OH TYR A 64 -10.842 -14.244 8.994 1.00 0.00 O ATOM 0 H TYR A 64 -5.157 -11.501 7.479 1.00 0.00 H new ATOM 0 HA TYR A 64 -4.642 -13.065 8.947 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -5.204 -15.174 6.839 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -4.872 -15.483 8.532 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -6.490 -13.785 10.100 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -7.434 -15.429 6.284 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -8.885 -13.561 10.595 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -9.828 -15.204 6.776 1.00 0.00 H new ATOM 0 HH TYR A 64 -11.366 -14.570 8.232 1.00 0.00 H new ATOM 1045 N LYS A 65 -2.475 -14.641 8.397 1.00 0.00 N ATOM 1046 CA LYS A 65 -1.039 -14.957 8.338 1.00 0.00 C ATOM 1047 C LYS A 65 -0.193 -13.869 9.005 1.00 0.00 C ATOM 1048 O LYS A 65 0.987 -14.083 9.268 1.00 0.00 O ATOM 1049 CB LYS A 65 -0.579 -15.203 6.895 1.00 0.00 C ATOM 1050 CG LYS A 65 -1.325 -16.345 6.217 1.00 0.00 C ATOM 1051 CD LYS A 65 -1.268 -17.624 7.045 1.00 0.00 C ATOM 1052 CE LYS A 65 0.042 -18.372 6.862 1.00 0.00 C ATOM 1053 NZ LYS A 65 0.205 -18.868 5.469 1.00 0.00 N ATOM 0 H LYS A 65 -2.994 -15.229 9.049 1.00 0.00 H new ATOM 0 HA LYS A 65 -0.890 -15.880 8.899 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -0.718 -14.291 6.315 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.489 -15.422 6.893 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -2.365 -16.059 6.061 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -0.893 -16.529 5.233 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -1.399 -17.378 8.099 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -2.097 -18.273 6.764 1.00 0.00 H new ATOM 0 HE2 LYS A 65 0.874 -17.714 7.113 1.00 0.00 H new ATOM 0 HE3 LYS A 65 0.080 -19.213 7.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 0.893 -19.647 5.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -0.711 -19.209 5.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 0.546 -18.095 4.863 1.00 0.00 H new ATOM 1185 N PHE A 73 8.527 -21.330 2.054 1.00 0.00 N ATOM 1186 CA PHE A 73 9.366 -20.530 1.173 1.00 0.00 C ATOM 1187 C PHE A 73 9.112 -19.042 1.382 1.00 0.00 C ATOM 1188 O PHE A 73 8.142 -18.493 0.859 1.00 0.00 O ATOM 1189 CB PHE A 73 9.114 -20.896 -0.291 1.00 0.00 C ATOM 1190 CG PHE A 73 9.334 -22.349 -0.594 1.00 0.00 C ATOM 1191 CD1 PHE A 73 10.616 -22.855 -0.737 1.00 0.00 C ATOM 1192 CD2 PHE A 73 8.258 -23.207 -0.738 1.00 0.00 C ATOM 1193 CE1 PHE A 73 10.819 -24.191 -1.017 1.00 0.00 C ATOM 1194 CE2 PHE A 73 8.455 -24.545 -1.018 1.00 0.00 C ATOM 1195 CZ PHE A 73 9.737 -25.037 -1.158 1.00 0.00 C ATOM 0 HA PHE A 73 10.406 -20.745 1.419 1.00 0.00 H new ATOM 0 HB2 PHE A 73 8.090 -20.630 -0.552 1.00 0.00 H new ATOM 0 HB3 PHE A 73 9.770 -20.298 -0.924 1.00 0.00 H new ATOM 0 HD1 PHE A 73 11.465 -22.197 -0.628 1.00 0.00 H new ATOM 0 HD2 PHE A 73 7.253 -22.826 -0.630 1.00 0.00 H new ATOM 0 HE1 PHE A 73 11.823 -24.574 -1.126 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.607 -25.205 -1.127 1.00 0.00 H new ATOM 0 HZ PHE A 73 9.894 -26.083 -1.378 1.00 0.00 H new ATOM 1205 N GLN A 74 9.986 -18.401 2.151 1.00 0.00 N ATOM 1206 CA GLN A 74 9.879 -16.968 2.418 1.00 0.00 C ATOM 1207 C GLN A 74 10.091 -16.161 1.142 1.00 0.00 C ATOM 1208 O GLN A 74 9.596 -15.044 1.007 1.00 0.00 O ATOM 1209 CB GLN A 74 10.888 -16.548 3.489 1.00 0.00 C ATOM 1210 CG GLN A 74 10.684 -17.260 4.816 1.00 0.00 C ATOM 1211 CD GLN A 74 9.287 -17.064 5.375 1.00 0.00 C ATOM 1212 OE1 GLN A 74 8.652 -16.035 5.152 1.00 0.00 O ATOM 1213 NE2 GLN A 74 8.791 -18.061 6.090 1.00 0.00 N ATOM 0 H GLN A 74 10.781 -18.853 2.603 1.00 0.00 H new ATOM 0 HA GLN A 74 8.874 -16.764 2.787 1.00 0.00 H new ATOM 0 HB2 GLN A 74 11.896 -16.749 3.128 1.00 0.00 H new ATOM 0 HB3 GLN A 74 10.814 -15.472 3.646 1.00 0.00 H new ATOM 0 HG2 GLN A 74 10.873 -18.326 4.685 1.00 0.00 H new ATOM 0 HG3 GLN A 74 11.415 -16.893 5.537 1.00 0.00 H new ATOM 0 HE21 GLN A 74 9.349 -18.899 6.253 1.00 0.00 H new ATOM 0 HE22 GLN A 74 7.850 -17.992 6.478 1.00 0.00 H new ATOM 1222 N THR A 75 10.821 -16.745 0.211 1.00 0.00 N ATOM 1223 CA THR A 75 11.054 -16.139 -1.086 1.00 0.00 C ATOM 1224 C THR A 75 9.738 -15.914 -1.832 1.00 0.00 C ATOM 1225 O THR A 75 9.501 -14.846 -2.396 1.00 0.00 O ATOM 1226 CB THR A 75 11.974 -17.046 -1.914 1.00 0.00 C ATOM 1227 OG1 THR A 75 11.713 -18.416 -1.565 1.00 0.00 O ATOM 1228 CG2 THR A 75 13.439 -16.718 -1.661 1.00 0.00 C ATOM 0 H THR A 75 11.269 -17.653 0.333 1.00 0.00 H new ATOM 0 HA THR A 75 11.528 -15.169 -0.936 1.00 0.00 H new ATOM 0 HB THR A 75 11.772 -16.883 -2.973 1.00 0.00 H new ATOM 0 HG1 THR A 75 12.295 -19.004 -2.090 1.00 0.00 H new ATOM 0 HG21 THR A 75 14.068 -17.376 -2.261 1.00 0.00 H new ATOM 0 HG22 THR A 75 13.632 -15.681 -1.936 1.00 0.00 H new ATOM 0 HG23 THR A 75 13.667 -16.862 -0.605 1.00 0.00 H new ATOM 1236 N ARG A 76 8.867 -16.916 -1.801 1.00 0.00 N ATOM 1237 CA ARG A 76 7.583 -16.821 -2.482 1.00 0.00 C ATOM 1238 C ARG A 76 6.653 -15.878 -1.722 1.00 0.00 C ATOM 1239 O ARG A 76 5.696 -15.342 -2.282 1.00 0.00 O ATOM 1240 CB ARG A 76 6.940 -18.201 -2.638 1.00 0.00 C ATOM 1241 CG ARG A 76 7.882 -19.246 -3.216 1.00 0.00 C ATOM 1242 CD ARG A 76 7.131 -20.313 -4.000 1.00 0.00 C ATOM 1243 NE ARG A 76 6.757 -19.841 -5.334 1.00 0.00 N ATOM 1244 CZ ARG A 76 6.483 -20.648 -6.356 1.00 0.00 C ATOM 1245 NH1 ARG A 76 6.420 -21.958 -6.171 1.00 0.00 N ATOM 1246 NH2 ARG A 76 6.259 -20.145 -7.562 1.00 0.00 N ATOM 0 H ARG A 76 9.026 -17.798 -1.314 1.00 0.00 H new ATOM 0 HA ARG A 76 7.754 -16.417 -3.480 1.00 0.00 H new ATOM 0 HB2 ARG A 76 6.586 -18.541 -1.665 1.00 0.00 H new ATOM 0 HB3 ARG A 76 6.065 -18.115 -3.283 1.00 0.00 H new ATOM 0 HG2 ARG A 76 8.608 -18.760 -3.868 1.00 0.00 H new ATOM 0 HG3 ARG A 76 8.443 -19.716 -2.408 1.00 0.00 H new ATOM 0 HD2 ARG A 76 7.753 -21.204 -4.090 1.00 0.00 H new ATOM 0 HD3 ARG A 76 6.235 -20.604 -3.452 1.00 0.00 H new ATOM 0 HE ARG A 76 6.703 -18.834 -5.489 1.00 0.00 H new ATOM 0 HH11 ARG A 76 6.582 -22.350 -5.243 1.00 0.00 H new ATOM 0 HH12 ARG A 76 6.210 -22.574 -6.956 1.00 0.00 H new ATOM 0 HH21 ARG A 76 6.296 -19.136 -7.709 1.00 0.00 H new ATOM 0 HH22 ARG A 76 6.049 -20.767 -8.343 1.00 0.00 H new ATOM 1260 N VAL A 77 6.949 -15.677 -0.440 1.00 0.00 N ATOM 1261 CA VAL A 77 6.236 -14.694 0.369 1.00 0.00 C ATOM 1262 C VAL A 77 6.557 -13.293 -0.147 1.00 0.00 C ATOM 1263 O VAL A 77 5.733 -12.374 -0.069 1.00 0.00 O ATOM 1264 CB VAL A 77 6.622 -14.805 1.864 1.00 0.00 C ATOM 1265 CG1 VAL A 77 5.775 -13.882 2.727 1.00 0.00 C ATOM 1266 CG2 VAL A 77 6.498 -16.242 2.346 1.00 0.00 C ATOM 0 H VAL A 77 7.679 -16.183 0.061 1.00 0.00 H new ATOM 0 HA VAL A 77 5.167 -14.888 0.286 1.00 0.00 H new ATOM 0 HB VAL A 77 7.662 -14.493 1.959 1.00 0.00 H new ATOM 0 HG11 VAL A 77 6.072 -13.985 3.771 1.00 0.00 H new ATOM 0 HG12 VAL A 77 5.921 -12.850 2.408 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.723 -14.149 2.621 1.00 0.00 H new ATOM 0 HG21 VAL A 77 6.774 -16.298 3.399 1.00 0.00 H new ATOM 0 HG22 VAL A 77 5.469 -16.580 2.222 1.00 0.00 H new ATOM 0 HG23 VAL A 77 7.162 -16.880 1.763 1.00 0.00 H new ATOM 1276 N ILE A 78 7.760 -13.149 -0.702 1.00 0.00 N ATOM 1277 CA ILE A 78 8.175 -11.905 -1.335 1.00 0.00 C ATOM 1278 C ILE A 78 7.333 -11.652 -2.578 1.00 0.00 C ATOM 1279 O ILE A 78 6.719 -10.593 -2.707 1.00 0.00 O ATOM 1280 CB ILE A 78 9.672 -11.918 -1.725 1.00 0.00 C ATOM 1281 CG1 ILE A 78 10.544 -12.190 -0.497 1.00 0.00 C ATOM 1282 CG2 ILE A 78 10.070 -10.602 -2.382 1.00 0.00 C ATOM 1283 CD1 ILE A 78 10.345 -11.198 0.628 1.00 0.00 C ATOM 0 H ILE A 78 8.466 -13.885 -0.724 1.00 0.00 H new ATOM 0 HA ILE A 78 8.026 -11.106 -0.608 1.00 0.00 H new ATOM 0 HB ILE A 78 9.830 -12.721 -2.445 1.00 0.00 H new ATOM 0 HG12 ILE A 78 10.330 -13.192 -0.126 1.00 0.00 H new ATOM 0 HG13 ILE A 78 11.592 -12.178 -0.798 1.00 0.00 H new ATOM 0 HG21 ILE A 78 11.127 -10.633 -2.648 1.00 0.00 H new ATOM 0 HG22 ILE A 78 9.474 -10.449 -3.282 1.00 0.00 H new ATOM 0 HG23 ILE A 78 9.895 -9.781 -1.687 1.00 0.00 H new ATOM 0 HD11 ILE A 78 10.997 -11.458 1.462 1.00 0.00 H new ATOM 0 HD12 ILE A 78 10.588 -10.195 0.276 1.00 0.00 H new ATOM 0 HD13 ILE A 78 9.306 -11.225 0.958 1.00 0.00 H new ATOM 1295 N GLU A 79 7.294 -12.637 -3.483 1.00 0.00 N ATOM 1296 CA GLU A 79 6.459 -12.536 -4.686 1.00 0.00 C ATOM 1297 C GLU A 79 5.017 -12.198 -4.331 1.00 0.00 C ATOM 1298 O GLU A 79 4.379 -11.390 -5.009 1.00 0.00 O ATOM 1299 CB GLU A 79 6.469 -13.832 -5.505 1.00 0.00 C ATOM 1300 CG GLU A 79 7.705 -14.023 -6.367 1.00 0.00 C ATOM 1301 CD GLU A 79 8.898 -14.521 -5.588 1.00 0.00 C ATOM 1302 OE1 GLU A 79 8.984 -15.746 -5.357 1.00 0.00 O ATOM 1303 OE2 GLU A 79 9.764 -13.699 -5.230 1.00 0.00 O ATOM 0 H GLU A 79 7.825 -13.505 -3.407 1.00 0.00 H new ATOM 0 HA GLU A 79 6.889 -11.734 -5.286 1.00 0.00 H new ATOM 0 HB2 GLU A 79 6.383 -14.678 -4.823 1.00 0.00 H new ATOM 0 HB3 GLU A 79 5.588 -13.848 -6.147 1.00 0.00 H new ATOM 0 HG2 GLU A 79 7.479 -14.730 -7.165 1.00 0.00 H new ATOM 0 HG3 GLU A 79 7.959 -13.076 -6.843 1.00 0.00 H new ATOM 1310 N LEU A 80 4.518 -12.825 -3.268 1.00 0.00 N ATOM 1311 CA LEU A 80 3.153 -12.612 -2.801 1.00 0.00 C ATOM 1312 C LEU A 80 2.889 -11.121 -2.613 1.00 0.00 C ATOM 1313 O LEU A 80 2.013 -10.552 -3.262 1.00 0.00 O ATOM 1314 CB LEU A 80 2.930 -13.364 -1.476 1.00 0.00 C ATOM 1315 CG LEU A 80 1.468 -13.662 -1.089 1.00 0.00 C ATOM 1316 CD1 LEU A 80 1.418 -14.523 0.163 1.00 0.00 C ATOM 1317 CD2 LEU A 80 0.666 -12.387 -0.862 1.00 0.00 C ATOM 0 H LEU A 80 5.048 -13.493 -2.708 1.00 0.00 H new ATOM 0 HA LEU A 80 2.458 -12.997 -3.547 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.469 -14.310 -1.527 1.00 0.00 H new ATOM 0 HB3 LEU A 80 3.383 -12.782 -0.673 1.00 0.00 H new ATOM 0 HG LEU A 80 1.018 -14.199 -1.924 1.00 0.00 H new ATOM 0 HD11 LEU A 80 0.379 -14.725 0.424 1.00 0.00 H new ATOM 0 HD12 LEU A 80 1.936 -15.464 -0.022 1.00 0.00 H new ATOM 0 HD13 LEU A 80 1.903 -13.998 0.986 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -0.358 -12.645 -0.591 1.00 0.00 H new ATOM 0 HD22 LEU A 80 1.120 -11.810 -0.056 1.00 0.00 H new ATOM 0 HD23 LEU A 80 0.661 -11.793 -1.776 1.00 0.00 H new ATOM 1329 N ASN A 81 3.672 -10.486 -1.750 1.00 0.00 N ATOM 1330 CA ASN A 81 3.421 -9.097 -1.384 1.00 0.00 C ATOM 1331 C ASN A 81 3.963 -8.125 -2.420 1.00 0.00 C ATOM 1332 O ASN A 81 3.511 -6.984 -2.497 1.00 0.00 O ATOM 1333 CB ASN A 81 3.966 -8.786 0.006 1.00 0.00 C ATOM 1334 CG ASN A 81 3.102 -9.407 1.084 1.00 0.00 C ATOM 1335 OD1 ASN A 81 2.082 -8.833 1.477 1.00 0.00 O ATOM 1336 ND2 ASN A 81 3.493 -10.579 1.563 1.00 0.00 N ATOM 0 H ASN A 81 4.481 -10.907 -1.293 1.00 0.00 H new ATOM 0 HA ASN A 81 2.340 -8.964 -1.358 1.00 0.00 H new ATOM 0 HB2 ASN A 81 4.986 -9.161 0.092 1.00 0.00 H new ATOM 0 HB3 ASN A 81 4.011 -7.706 0.149 1.00 0.00 H new ATOM 0 HD21 ASN A 81 2.944 -11.043 2.286 1.00 0.00 H new ATOM 0 HD22 ASN A 81 4.343 -11.017 1.208 1.00 0.00 H new ATOM 1343 N TYR A 82 4.910 -8.580 -3.227 1.00 0.00 N ATOM 1344 CA TYR A 82 5.390 -7.789 -4.352 1.00 0.00 C ATOM 1345 C TYR A 82 4.240 -7.591 -5.337 1.00 0.00 C ATOM 1346 O TYR A 82 4.028 -6.506 -5.866 1.00 0.00 O ATOM 1347 CB TYR A 82 6.556 -8.508 -5.036 1.00 0.00 C ATOM 1348 CG TYR A 82 7.581 -7.593 -5.673 1.00 0.00 C ATOM 1349 CD1 TYR A 82 7.276 -6.833 -6.794 1.00 0.00 C ATOM 1350 CD2 TYR A 82 8.867 -7.509 -5.154 1.00 0.00 C ATOM 1351 CE1 TYR A 82 8.223 -6.016 -7.380 1.00 0.00 C ATOM 1352 CE2 TYR A 82 9.819 -6.698 -5.738 1.00 0.00 C ATOM 1353 CZ TYR A 82 9.494 -5.955 -6.851 1.00 0.00 C ATOM 1354 OH TYR A 82 10.447 -5.158 -7.443 1.00 0.00 O ATOM 0 H TYR A 82 5.360 -9.489 -3.125 1.00 0.00 H new ATOM 0 HA TYR A 82 5.743 -6.819 -4.001 1.00 0.00 H new ATOM 0 HB2 TYR A 82 7.058 -9.137 -4.301 1.00 0.00 H new ATOM 0 HB3 TYR A 82 6.156 -9.171 -5.803 1.00 0.00 H new ATOM 0 HD1 TYR A 82 6.282 -6.881 -7.215 1.00 0.00 H new ATOM 0 HD2 TYR A 82 9.126 -8.088 -4.280 1.00 0.00 H new ATOM 0 HE1 TYR A 82 7.968 -5.427 -8.249 1.00 0.00 H new ATOM 0 HE2 TYR A 82 10.815 -6.646 -5.324 1.00 0.00 H new ATOM 0 HH TYR A 82 10.012 -4.390 -7.869 1.00 0.00 H new ATOM 1364 N LYS A 83 3.483 -8.657 -5.548 1.00 0.00 N ATOM 1365 CA LYS A 83 2.315 -8.630 -6.422 1.00 0.00 C ATOM 1366 C LYS A 83 1.099 -8.090 -5.664 1.00 0.00 C ATOM 1367 O LYS A 83 0.087 -7.726 -6.258 1.00 0.00 O ATOM 1368 CB LYS A 83 2.047 -10.049 -6.942 1.00 0.00 C ATOM 1369 CG LYS A 83 0.965 -10.146 -8.008 1.00 0.00 C ATOM 1370 CD LYS A 83 0.801 -11.582 -8.491 1.00 0.00 C ATOM 1371 CE LYS A 83 2.068 -12.093 -9.162 1.00 0.00 C ATOM 1372 NZ LYS A 83 2.028 -13.563 -9.399 1.00 0.00 N ATOM 0 H LYS A 83 3.659 -9.566 -5.119 1.00 0.00 H new ATOM 0 HA LYS A 83 2.503 -7.969 -7.268 1.00 0.00 H new ATOM 0 HB2 LYS A 83 2.974 -10.453 -7.348 1.00 0.00 H new ATOM 0 HB3 LYS A 83 1.765 -10.682 -6.100 1.00 0.00 H new ATOM 0 HG2 LYS A 83 0.019 -9.784 -7.605 1.00 0.00 H new ATOM 0 HG3 LYS A 83 1.220 -9.502 -8.850 1.00 0.00 H new ATOM 0 HD2 LYS A 83 0.551 -12.225 -7.647 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -0.031 -11.638 -9.192 1.00 0.00 H new ATOM 0 HE2 LYS A 83 2.207 -11.578 -10.112 1.00 0.00 H new ATOM 0 HE3 LYS A 83 2.929 -11.851 -8.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 2.911 -13.865 -9.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 1.922 -14.058 -8.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 1.222 -13.794 -10.015 1.00 0.00 H new ATOM 1386 N HIS A 84 1.221 -8.044 -4.346 1.00 0.00 N ATOM 1387 CA HIS A 84 0.141 -7.599 -3.472 1.00 0.00 C ATOM 1388 C HIS A 84 0.113 -6.075 -3.333 1.00 0.00 C ATOM 1389 O HIS A 84 -0.956 -5.476 -3.336 1.00 0.00 O ATOM 1390 CB HIS A 84 0.303 -8.266 -2.096 1.00 0.00 C ATOM 1391 CG HIS A 84 -0.691 -7.848 -1.053 1.00 0.00 C ATOM 1392 ND1 HIS A 84 -0.359 -7.698 0.280 1.00 0.00 N ATOM 1393 CD2 HIS A 84 -2.016 -7.584 -1.140 1.00 0.00 C ATOM 1394 CE1 HIS A 84 -1.434 -7.357 0.964 1.00 0.00 C ATOM 1395 NE2 HIS A 84 -2.456 -7.280 0.129 1.00 0.00 N ATOM 0 H HIS A 84 2.071 -8.314 -3.850 1.00 0.00 H new ATOM 0 HA HIS A 84 -0.810 -7.894 -3.916 1.00 0.00 H new ATOM 0 HB2 HIS A 84 0.235 -9.346 -2.225 1.00 0.00 H new ATOM 0 HB3 HIS A 84 1.305 -8.052 -1.724 1.00 0.00 H new ATOM 0 HD1 HIS A 84 0.573 -7.830 0.674 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -2.616 -7.607 -2.038 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -1.473 -7.172 2.027 1.00 0.00 H new ATOM 1404 N LEU A 85 1.277 -5.464 -3.147 1.00 0.00 N ATOM 1405 CA LEU A 85 1.359 -4.011 -2.978 1.00 0.00 C ATOM 1406 C LEU A 85 1.873 -3.295 -4.222 1.00 0.00 C ATOM 1407 O LEU A 85 1.737 -2.084 -4.331 1.00 0.00 O ATOM 1408 CB LEU A 85 2.239 -3.668 -1.782 1.00 0.00 C ATOM 1409 CG LEU A 85 1.645 -4.043 -0.428 1.00 0.00 C ATOM 1410 CD1 LEU A 85 2.627 -3.730 0.683 1.00 0.00 C ATOM 1411 CD2 LEU A 85 0.329 -3.309 -0.208 1.00 0.00 C ATOM 0 H LEU A 85 2.175 -5.946 -3.109 1.00 0.00 H new ATOM 0 HA LEU A 85 0.342 -3.659 -2.804 1.00 0.00 H new ATOM 0 HB2 LEU A 85 3.198 -4.174 -1.896 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.441 -2.597 -1.791 1.00 0.00 H new ATOM 0 HG LEU A 85 1.446 -5.115 -0.416 1.00 0.00 H new ATOM 0 HD11 LEU A 85 2.189 -4.003 1.643 1.00 0.00 H new ATOM 0 HD12 LEU A 85 3.545 -4.298 0.528 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.855 -2.664 0.678 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -0.084 -3.586 0.762 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.503 -2.233 -0.235 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -0.376 -3.582 -0.994 1.00 0.00 H new ATOM 1423 N LEU A 86 2.489 -4.028 -5.144 1.00 0.00 N ATOM 1424 CA LEU A 86 2.994 -3.417 -6.375 1.00 0.00 C ATOM 1425 C LEU A 86 2.301 -4.000 -7.604 1.00 0.00 C ATOM 1426 O LEU A 86 2.500 -3.530 -8.723 1.00 0.00 O ATOM 1427 CB LEU A 86 4.511 -3.593 -6.483 1.00 0.00 C ATOM 1428 CG LEU A 86 5.325 -2.939 -5.361 1.00 0.00 C ATOM 1429 CD1 LEU A 86 6.802 -3.265 -5.515 1.00 0.00 C ATOM 1430 CD2 LEU A 86 5.115 -1.432 -5.350 1.00 0.00 C ATOM 0 H LEU A 86 2.651 -5.032 -5.068 1.00 0.00 H new ATOM 0 HA LEU A 86 2.770 -2.351 -6.334 1.00 0.00 H new ATOM 0 HB2 LEU A 86 4.737 -4.659 -6.500 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.841 -3.182 -7.437 1.00 0.00 H new ATOM 0 HG LEU A 86 4.977 -3.341 -4.410 1.00 0.00 H new ATOM 0 HD11 LEU A 86 7.365 -2.793 -4.710 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.943 -4.345 -5.471 1.00 0.00 H new ATOM 0 HD13 LEU A 86 7.159 -2.892 -6.475 1.00 0.00 H new ATOM 0 HD21 LEU A 86 5.702 -0.989 -4.546 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.433 -1.013 -6.305 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.059 -1.213 -5.192 1.00 0.00 H new ATOM 1442 N GLY A 87 1.481 -5.020 -7.385 1.00 0.00 N ATOM 1443 CA GLY A 87 0.697 -5.613 -8.457 1.00 0.00 C ATOM 1444 C GLY A 87 1.522 -6.181 -9.601 1.00 0.00 C ATOM 1445 O GLY A 87 1.079 -6.154 -10.751 1.00 0.00 O ATOM 0 H GLY A 87 1.343 -5.454 -6.472 1.00 0.00 H new ATOM 0 HA2 GLY A 87 0.079 -6.409 -8.041 1.00 0.00 H new ATOM 0 HA3 GLY A 87 0.019 -4.858 -8.855 1.00 0.00 H new ATOM 1449 N ARG A 88 2.715 -6.688 -9.301 1.00 0.00 N ATOM 1450 CA ARG A 88 3.568 -7.302 -10.318 1.00 0.00 C ATOM 1451 C ARG A 88 4.674 -8.134 -9.680 1.00 0.00 C ATOM 1452 O ARG A 88 4.895 -8.064 -8.473 1.00 0.00 O ATOM 1453 CB ARG A 88 4.158 -6.246 -11.276 1.00 0.00 C ATOM 1454 CG ARG A 88 4.445 -4.893 -10.638 1.00 0.00 C ATOM 1455 CD ARG A 88 5.580 -4.952 -9.630 1.00 0.00 C ATOM 1456 NE ARG A 88 6.885 -5.086 -10.273 1.00 0.00 N ATOM 1457 CZ ARG A 88 7.732 -4.069 -10.438 1.00 0.00 C ATOM 1458 NH1 ARG A 88 7.406 -2.857 -10.009 1.00 0.00 N ATOM 1459 NH2 ARG A 88 8.904 -4.264 -11.023 1.00 0.00 N ATOM 0 H ARG A 88 3.114 -6.686 -8.362 1.00 0.00 H new ATOM 0 HA ARG A 88 2.940 -7.970 -10.908 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.084 -6.636 -11.698 1.00 0.00 H new ATOM 0 HB3 ARG A 88 3.466 -6.101 -12.105 1.00 0.00 H new ATOM 0 HG2 ARG A 88 4.693 -4.173 -11.418 1.00 0.00 H new ATOM 0 HG3 ARG A 88 3.544 -4.530 -10.144 1.00 0.00 H new ATOM 0 HD2 ARG A 88 5.569 -4.049 -9.020 1.00 0.00 H new ATOM 0 HD3 ARG A 88 5.421 -5.794 -8.956 1.00 0.00 H new ATOM 0 HE ARG A 88 7.163 -6.006 -10.614 1.00 0.00 H new ATOM 0 HH11 ARG A 88 6.507 -2.702 -9.553 1.00 0.00 H new ATOM 0 HH12 ARG A 88 8.054 -2.080 -10.136 1.00 0.00 H new ATOM 0 HH21 ARG A 88 9.162 -5.195 -11.350 1.00 0.00 H new ATOM 0 HH22 ARG A 88 9.548 -3.483 -11.147 1.00 0.00 H new ATOM 1473 N ALA A 89 5.354 -8.926 -10.498 1.00 0.00 N ATOM 1474 CA ALA A 89 6.414 -9.803 -10.017 1.00 0.00 C ATOM 1475 C ALA A 89 7.697 -9.021 -9.739 1.00 0.00 C ATOM 1476 O ALA A 89 7.896 -7.926 -10.279 1.00 0.00 O ATOM 1477 CB ALA A 89 6.674 -10.904 -11.035 1.00 0.00 C ATOM 0 H ALA A 89 5.189 -8.979 -11.503 1.00 0.00 H new ATOM 0 HA ALA A 89 6.089 -10.251 -9.078 1.00 0.00 H new ATOM 0 HB1 ALA A 89 7.467 -11.557 -10.670 1.00 0.00 H new ATOM 0 HB2 ALA A 89 5.764 -11.486 -11.182 1.00 0.00 H new ATOM 0 HB3 ALA A 89 6.977 -10.459 -11.983 1.00 0.00 H new ATOM 1483 N PRO A 90 8.576 -9.563 -8.873 1.00 0.00 N ATOM 1484 CA PRO A 90 9.872 -8.950 -8.564 1.00 0.00 C ATOM 1485 C PRO A 90 10.736 -8.788 -9.808 1.00 0.00 C ATOM 1486 O PRO A 90 11.109 -9.769 -10.454 1.00 0.00 O ATOM 1487 CB PRO A 90 10.524 -9.934 -7.589 1.00 0.00 C ATOM 1488 CG PRO A 90 9.394 -10.719 -7.022 1.00 0.00 C ATOM 1489 CD PRO A 90 8.370 -10.811 -8.116 1.00 0.00 C ATOM 0 HA PRO A 90 9.757 -7.947 -8.153 1.00 0.00 H new ATOM 0 HB2 PRO A 90 11.237 -10.581 -8.099 1.00 0.00 H new ATOM 0 HB3 PRO A 90 11.072 -9.410 -6.806 1.00 0.00 H new ATOM 0 HG2 PRO A 90 9.724 -11.710 -6.711 1.00 0.00 H new ATOM 0 HG3 PRO A 90 8.981 -10.229 -6.140 1.00 0.00 H new ATOM 0 HD2 PRO A 90 8.525 -11.691 -8.740 1.00 0.00 H new ATOM 0 HD3 PRO A 90 7.358 -10.878 -7.716 1.00 0.00 H new ATOM 1497 N TYR A 91 11.050 -7.546 -10.143 1.00 0.00 N ATOM 1498 CA TYR A 91 11.819 -7.265 -11.345 1.00 0.00 C ATOM 1499 C TYR A 91 13.309 -7.351 -11.050 1.00 0.00 C ATOM 1500 O TYR A 91 14.107 -7.701 -11.918 1.00 0.00 O ATOM 1501 CB TYR A 91 11.459 -5.883 -11.891 1.00 0.00 C ATOM 1502 CG TYR A 91 11.772 -5.710 -13.356 1.00 0.00 C ATOM 1503 CD1 TYR A 91 10.900 -6.188 -14.323 1.00 0.00 C ATOM 1504 CD2 TYR A 91 12.935 -5.077 -13.775 1.00 0.00 C ATOM 1505 CE1 TYR A 91 11.176 -6.045 -15.666 1.00 0.00 C ATOM 1506 CE2 TYR A 91 13.216 -4.928 -15.117 1.00 0.00 C ATOM 1507 CZ TYR A 91 12.334 -5.413 -16.059 1.00 0.00 C ATOM 1508 OH TYR A 91 12.616 -5.276 -17.399 1.00 0.00 O ATOM 0 H TYR A 91 10.786 -6.722 -9.603 1.00 0.00 H new ATOM 0 HA TYR A 91 11.574 -8.011 -12.101 1.00 0.00 H new ATOM 0 HB2 TYR A 91 10.395 -5.705 -11.732 1.00 0.00 H new ATOM 0 HB3 TYR A 91 11.997 -5.125 -11.321 1.00 0.00 H new ATOM 0 HD1 TYR A 91 9.989 -6.681 -14.018 1.00 0.00 H new ATOM 0 HD2 TYR A 91 13.629 -4.696 -13.040 1.00 0.00 H new ATOM 0 HE1 TYR A 91 10.488 -6.427 -16.406 1.00 0.00 H new ATOM 0 HE2 TYR A 91 14.124 -4.433 -15.429 1.00 0.00 H new ATOM 0 HH TYR A 91 13.469 -4.807 -17.507 1.00 0.00 H new ATOM 1518 N ASP A 92 13.672 -7.054 -9.813 1.00 0.00 N ATOM 1519 CA ASP A 92 15.063 -7.100 -9.394 1.00 0.00 C ATOM 1520 C ASP A 92 15.244 -8.137 -8.295 1.00 0.00 C ATOM 1521 O ASP A 92 14.405 -8.259 -7.402 1.00 0.00 O ATOM 1522 CB ASP A 92 15.521 -5.720 -8.914 1.00 0.00 C ATOM 1523 CG ASP A 92 16.888 -5.758 -8.267 1.00 0.00 C ATOM 1524 OD1 ASP A 92 17.888 -5.954 -8.984 1.00 0.00 O ATOM 1525 OD2 ASP A 92 16.963 -5.610 -7.034 1.00 0.00 O ATOM 0 H ASP A 92 13.020 -6.777 -9.079 1.00 0.00 H new ATOM 0 HA ASP A 92 15.678 -7.387 -10.247 1.00 0.00 H new ATOM 0 HB2 ASP A 92 15.541 -5.033 -9.760 1.00 0.00 H new ATOM 0 HB3 ASP A 92 14.796 -5.327 -8.201 1.00 0.00 H new ATOM 1530 N GLU A 93 16.331 -8.889 -8.372 1.00 0.00 N ATOM 1531 CA GLU A 93 16.583 -9.972 -7.433 1.00 0.00 C ATOM 1532 C GLU A 93 17.057 -9.434 -6.085 1.00 0.00 C ATOM 1533 O GLU A 93 16.802 -10.038 -5.041 1.00 0.00 O ATOM 1534 CB GLU A 93 17.607 -10.942 -8.026 1.00 0.00 C ATOM 1535 CG GLU A 93 17.892 -12.155 -7.155 1.00 0.00 C ATOM 1536 CD GLU A 93 18.749 -13.183 -7.862 1.00 0.00 C ATOM 1537 OE1 GLU A 93 19.977 -12.974 -7.968 1.00 0.00 O ATOM 1538 OE2 GLU A 93 18.199 -14.201 -8.325 1.00 0.00 O ATOM 0 H GLU A 93 17.056 -8.768 -9.079 1.00 0.00 H new ATOM 0 HA GLU A 93 15.650 -10.507 -7.260 1.00 0.00 H new ATOM 0 HB2 GLU A 93 17.249 -11.282 -8.998 1.00 0.00 H new ATOM 0 HB3 GLU A 93 18.540 -10.406 -8.200 1.00 0.00 H new ATOM 0 HG2 GLU A 93 18.393 -11.834 -6.242 1.00 0.00 H new ATOM 0 HG3 GLU A 93 16.950 -12.614 -6.857 1.00 0.00 H new ATOM 1545 N SER A 94 17.722 -8.287 -6.098 1.00 0.00 N ATOM 1546 CA SER A 94 18.187 -7.678 -4.864 1.00 0.00 C ATOM 1547 C SER A 94 16.996 -7.146 -4.070 1.00 0.00 C ATOM 1548 O SER A 94 17.048 -7.065 -2.846 1.00 0.00 O ATOM 1549 CB SER A 94 19.194 -6.562 -5.147 1.00 0.00 C ATOM 1550 OG SER A 94 19.805 -6.102 -3.951 1.00 0.00 O ATOM 0 H SER A 94 17.949 -7.764 -6.944 1.00 0.00 H new ATOM 0 HA SER A 94 18.696 -8.437 -4.271 1.00 0.00 H new ATOM 0 HB2 SER A 94 19.960 -6.926 -5.832 1.00 0.00 H new ATOM 0 HB3 SER A 94 18.690 -5.732 -5.643 1.00 0.00 H new ATOM 0 HG SER A 94 20.445 -5.390 -4.163 1.00 0.00 H new ATOM 1556 N GLU A 95 15.920 -6.792 -4.777 1.00 0.00 N ATOM 1557 CA GLU A 95 14.664 -6.414 -4.132 1.00 0.00 C ATOM 1558 C GLU A 95 14.189 -7.535 -3.215 1.00 0.00 C ATOM 1559 O GLU A 95 13.791 -7.292 -2.074 1.00 0.00 O ATOM 1560 CB GLU A 95 13.583 -6.117 -5.176 1.00 0.00 C ATOM 1561 CG GLU A 95 13.802 -4.825 -5.945 1.00 0.00 C ATOM 1562 CD GLU A 95 13.660 -3.601 -5.068 1.00 0.00 C ATOM 1563 OE1 GLU A 95 12.511 -3.230 -4.746 1.00 0.00 O ATOM 1564 OE2 GLU A 95 14.693 -3.009 -4.693 1.00 0.00 O ATOM 0 H GLU A 95 15.895 -6.760 -5.796 1.00 0.00 H new ATOM 0 HA GLU A 95 14.842 -5.513 -3.545 1.00 0.00 H new ATOM 0 HB2 GLU A 95 13.539 -6.945 -5.883 1.00 0.00 H new ATOM 0 HB3 GLU A 95 12.615 -6.071 -4.678 1.00 0.00 H new ATOM 0 HG2 GLU A 95 14.796 -4.835 -6.392 1.00 0.00 H new ATOM 0 HG3 GLU A 95 13.085 -4.767 -6.764 1.00 0.00 H new ATOM 1571 N VAL A 96 14.247 -8.761 -3.719 1.00 0.00 N ATOM 1572 CA VAL A 96 13.873 -9.929 -2.935 1.00 0.00 C ATOM 1573 C VAL A 96 14.746 -10.023 -1.689 1.00 0.00 C ATOM 1574 O VAL A 96 14.246 -10.167 -0.575 1.00 0.00 O ATOM 1575 CB VAL A 96 14.011 -11.231 -3.756 1.00 0.00 C ATOM 1576 CG1 VAL A 96 13.557 -12.434 -2.943 1.00 0.00 C ATOM 1577 CG2 VAL A 96 13.219 -11.133 -5.051 1.00 0.00 C ATOM 0 H VAL A 96 14.550 -8.972 -4.670 1.00 0.00 H new ATOM 0 HA VAL A 96 12.828 -9.813 -2.648 1.00 0.00 H new ATOM 0 HB VAL A 96 15.064 -11.366 -4.004 1.00 0.00 H new ATOM 0 HG11 VAL A 96 13.663 -13.339 -3.542 1.00 0.00 H new ATOM 0 HG12 VAL A 96 14.170 -12.519 -2.045 1.00 0.00 H new ATOM 0 HG13 VAL A 96 12.512 -12.308 -2.659 1.00 0.00 H new ATOM 0 HG21 VAL A 96 13.328 -12.059 -5.615 1.00 0.00 H new ATOM 0 HG22 VAL A 96 12.166 -10.970 -4.822 1.00 0.00 H new ATOM 0 HG23 VAL A 96 13.594 -10.300 -5.645 1.00 0.00 H new ATOM 1587 N ILE A 97 16.051 -9.907 -1.894 1.00 0.00 N ATOM 1588 CA ILE A 97 17.018 -9.954 -0.804 1.00 0.00 C ATOM 1589 C ILE A 97 16.747 -8.854 0.224 1.00 0.00 C ATOM 1590 O ILE A 97 16.666 -9.117 1.422 1.00 0.00 O ATOM 1591 CB ILE A 97 18.455 -9.799 -1.338 1.00 0.00 C ATOM 1592 CG1 ILE A 97 18.749 -10.874 -2.386 1.00 0.00 C ATOM 1593 CG2 ILE A 97 19.459 -9.879 -0.198 1.00 0.00 C ATOM 1594 CD1 ILE A 97 20.108 -10.728 -3.035 1.00 0.00 C ATOM 0 H ILE A 97 16.468 -9.778 -2.816 1.00 0.00 H new ATOM 0 HA ILE A 97 16.913 -10.926 -0.322 1.00 0.00 H new ATOM 0 HB ILE A 97 18.547 -8.820 -1.808 1.00 0.00 H new ATOM 0 HG12 ILE A 97 18.683 -11.856 -1.917 1.00 0.00 H new ATOM 0 HG13 ILE A 97 17.981 -10.837 -3.158 1.00 0.00 H new ATOM 0 HG21 ILE A 97 20.468 -9.768 -0.594 1.00 0.00 H new ATOM 0 HG22 ILE A 97 19.260 -9.082 0.519 1.00 0.00 H new ATOM 0 HG23 ILE A 97 19.369 -10.845 0.299 1.00 0.00 H new ATOM 0 HD11 ILE A 97 20.249 -11.523 -3.767 1.00 0.00 H new ATOM 0 HD12 ILE A 97 20.171 -9.761 -3.533 1.00 0.00 H new ATOM 0 HD13 ILE A 97 20.884 -10.795 -2.273 1.00 0.00 H new ATOM 1606 N PHE A 98 16.597 -7.628 -0.263 1.00 0.00 N ATOM 1607 CA PHE A 98 16.351 -6.469 0.590 1.00 0.00 C ATOM 1608 C PHE A 98 15.097 -6.655 1.436 1.00 0.00 C ATOM 1609 O PHE A 98 15.106 -6.386 2.634 1.00 0.00 O ATOM 1610 CB PHE A 98 16.227 -5.203 -0.267 1.00 0.00 C ATOM 1611 CG PHE A 98 15.843 -3.972 0.508 1.00 0.00 C ATOM 1612 CD1 PHE A 98 16.770 -3.316 1.300 1.00 0.00 C ATOM 1613 CD2 PHE A 98 14.549 -3.477 0.445 1.00 0.00 C ATOM 1614 CE1 PHE A 98 16.415 -2.188 2.016 1.00 0.00 C ATOM 1615 CE2 PHE A 98 14.189 -2.350 1.158 1.00 0.00 C ATOM 1616 CZ PHE A 98 15.122 -1.705 1.945 1.00 0.00 C ATOM 0 H PHE A 98 16.642 -7.408 -1.258 1.00 0.00 H new ATOM 0 HA PHE A 98 17.198 -6.365 1.268 1.00 0.00 H new ATOM 0 HB2 PHE A 98 17.178 -5.022 -0.768 1.00 0.00 H new ATOM 0 HB3 PHE A 98 15.484 -5.376 -1.046 1.00 0.00 H new ATOM 0 HD1 PHE A 98 17.782 -3.690 1.359 1.00 0.00 H new ATOM 0 HD2 PHE A 98 13.815 -3.978 -0.168 1.00 0.00 H new ATOM 0 HE1 PHE A 98 17.147 -1.685 2.630 1.00 0.00 H new ATOM 0 HE2 PHE A 98 13.178 -1.974 1.100 1.00 0.00 H new ATOM 0 HZ PHE A 98 14.842 -0.825 2.504 1.00 0.00 H new ATOM 1626 N HIS A 99 14.024 -7.127 0.817 1.00 0.00 N ATOM 1627 CA HIS A 99 12.765 -7.293 1.529 1.00 0.00 C ATOM 1628 C HIS A 99 12.816 -8.489 2.471 1.00 0.00 C ATOM 1629 O HIS A 99 12.131 -8.510 3.487 1.00 0.00 O ATOM 1630 CB HIS A 99 11.591 -7.393 0.550 1.00 0.00 C ATOM 1631 CG HIS A 99 11.241 -6.067 -0.054 1.00 0.00 C ATOM 1632 ND1 HIS A 99 10.550 -5.102 0.632 1.00 0.00 N ATOM 1633 CD2 HIS A 99 11.531 -5.529 -1.263 1.00 0.00 C ATOM 1634 CE1 HIS A 99 10.429 -4.028 -0.118 1.00 0.00 C ATOM 1635 NE2 HIS A 99 11.017 -4.254 -1.277 1.00 0.00 N ATOM 0 H HIS A 99 13.999 -7.399 -0.166 1.00 0.00 H new ATOM 0 HA HIS A 99 12.606 -6.406 2.143 1.00 0.00 H new ATOM 0 HB2 HIS A 99 11.841 -8.097 -0.244 1.00 0.00 H new ATOM 0 HB3 HIS A 99 10.721 -7.795 1.069 1.00 0.00 H new ATOM 0 HD1 HIS A 99 10.185 -5.202 1.579 1.00 0.00 H new ATOM 0 HD2 HIS A 99 12.067 -6.012 -2.067 1.00 0.00 H new ATOM 0 HE1 HIS A 99 9.931 -3.113 0.168 1.00 0.00 H new ATOM 1644 N LEU A 100 13.644 -9.475 2.146 1.00 0.00 N ATOM 1645 CA LEU A 100 13.897 -10.576 3.068 1.00 0.00 C ATOM 1646 C LEU A 100 14.671 -10.068 4.277 1.00 0.00 C ATOM 1647 O LEU A 100 14.312 -10.344 5.418 1.00 0.00 O ATOM 1648 CB LEU A 100 14.680 -11.700 2.381 1.00 0.00 C ATOM 1649 CG LEU A 100 13.865 -12.585 1.437 1.00 0.00 C ATOM 1650 CD1 LEU A 100 14.774 -13.554 0.695 1.00 0.00 C ATOM 1651 CD2 LEU A 100 12.799 -13.343 2.213 1.00 0.00 C ATOM 0 H LEU A 100 14.147 -9.535 1.261 1.00 0.00 H new ATOM 0 HA LEU A 100 12.938 -10.979 3.393 1.00 0.00 H new ATOM 0 HB2 LEU A 100 15.501 -11.256 1.818 1.00 0.00 H new ATOM 0 HB3 LEU A 100 15.126 -12.332 3.149 1.00 0.00 H new ATOM 0 HG LEU A 100 13.373 -11.947 0.703 1.00 0.00 H new ATOM 0 HD11 LEU A 100 14.176 -14.175 0.028 1.00 0.00 H new ATOM 0 HD12 LEU A 100 15.504 -12.993 0.111 1.00 0.00 H new ATOM 0 HD13 LEU A 100 15.293 -14.188 1.413 1.00 0.00 H new ATOM 0 HD21 LEU A 100 12.227 -13.969 1.528 1.00 0.00 H new ATOM 0 HD22 LEU A 100 13.275 -13.971 2.967 1.00 0.00 H new ATOM 0 HD23 LEU A 100 12.131 -12.634 2.701 1.00 0.00 H new ATOM 1663 N ASP A 101 15.723 -9.303 4.007 1.00 0.00 N ATOM 1664 CA ASP A 101 16.559 -8.724 5.056 1.00 0.00 C ATOM 1665 C ASP A 101 15.736 -7.821 5.967 1.00 0.00 C ATOM 1666 O ASP A 101 15.841 -7.890 7.195 1.00 0.00 O ATOM 1667 CB ASP A 101 17.704 -7.927 4.425 1.00 0.00 C ATOM 1668 CG ASP A 101 18.632 -7.307 5.450 1.00 0.00 C ATOM 1669 OD1 ASP A 101 19.562 -8.001 5.914 1.00 0.00 O ATOM 1670 OD2 ASP A 101 18.459 -6.118 5.777 1.00 0.00 O ATOM 0 H ASP A 101 16.020 -9.067 3.060 1.00 0.00 H new ATOM 0 HA ASP A 101 16.971 -9.534 5.658 1.00 0.00 H new ATOM 0 HB2 ASP A 101 18.280 -8.584 3.773 1.00 0.00 H new ATOM 0 HB3 ASP A 101 17.288 -7.139 3.797 1.00 0.00 H new ATOM 1675 N LEU A 102 14.905 -6.992 5.352 1.00 0.00 N ATOM 1676 CA LEU A 102 14.048 -6.070 6.083 1.00 0.00 C ATOM 1677 C LEU A 102 13.033 -6.838 6.930 1.00 0.00 C ATOM 1678 O LEU A 102 12.884 -6.571 8.125 1.00 0.00 O ATOM 1679 CB LEU A 102 13.339 -5.134 5.099 1.00 0.00 C ATOM 1680 CG LEU A 102 12.576 -3.967 5.727 1.00 0.00 C ATOM 1681 CD1 LEU A 102 13.494 -3.151 6.622 1.00 0.00 C ATOM 1682 CD2 LEU A 102 11.978 -3.084 4.643 1.00 0.00 C ATOM 0 H LEU A 102 14.806 -6.939 4.338 1.00 0.00 H new ATOM 0 HA LEU A 102 14.662 -5.472 6.756 1.00 0.00 H new ATOM 0 HB2 LEU A 102 14.082 -4.730 4.411 1.00 0.00 H new ATOM 0 HB3 LEU A 102 12.641 -5.723 4.505 1.00 0.00 H new ATOM 0 HG LEU A 102 11.767 -4.371 6.336 1.00 0.00 H new ATOM 0 HD11 LEU A 102 12.934 -2.325 7.060 1.00 0.00 H new ATOM 0 HD12 LEU A 102 13.886 -3.786 7.417 1.00 0.00 H new ATOM 0 HD13 LEU A 102 14.321 -2.756 6.032 1.00 0.00 H new ATOM 0 HD21 LEU A 102 11.438 -2.257 5.104 1.00 0.00 H new ATOM 0 HD22 LEU A 102 12.776 -2.690 4.014 1.00 0.00 H new ATOM 0 HD23 LEU A 102 11.291 -3.671 4.033 1.00 0.00 H new ATOM 1694 N TYR A 103 12.358 -7.803 6.305 1.00 0.00 N ATOM 1695 CA TYR A 103 11.380 -8.647 6.994 1.00 0.00 C ATOM 1696 C TYR A 103 12.001 -9.365 8.195 1.00 0.00 C ATOM 1697 O TYR A 103 11.410 -9.411 9.274 1.00 0.00 O ATOM 1698 CB TYR A 103 10.792 -9.670 6.010 1.00 0.00 C ATOM 1699 CG TYR A 103 10.124 -10.860 6.671 1.00 0.00 C ATOM 1700 CD1 TYR A 103 8.913 -10.732 7.337 1.00 0.00 C ATOM 1701 CD2 TYR A 103 10.721 -12.116 6.633 1.00 0.00 C ATOM 1702 CE1 TYR A 103 8.319 -11.818 7.950 1.00 0.00 C ATOM 1703 CE2 TYR A 103 10.130 -13.204 7.239 1.00 0.00 C ATOM 1704 CZ TYR A 103 8.931 -13.051 7.897 1.00 0.00 C ATOM 1705 OH TYR A 103 8.352 -14.133 8.520 1.00 0.00 O ATOM 0 H TYR A 103 12.472 -8.021 5.315 1.00 0.00 H new ATOM 0 HA TYR A 103 10.584 -8.004 7.370 1.00 0.00 H new ATOM 0 HB2 TYR A 103 10.064 -9.167 5.373 1.00 0.00 H new ATOM 0 HB3 TYR A 103 11.589 -10.031 5.360 1.00 0.00 H new ATOM 0 HD1 TYR A 103 8.427 -9.768 7.377 1.00 0.00 H new ATOM 0 HD2 TYR A 103 11.663 -12.241 6.120 1.00 0.00 H new ATOM 0 HE1 TYR A 103 7.379 -11.701 8.469 1.00 0.00 H new ATOM 0 HE2 TYR A 103 10.606 -14.173 7.198 1.00 0.00 H new ATOM 0 HH TYR A 103 8.912 -14.926 8.385 1.00 0.00 H new ATOM 1715 N GLU A 104 13.184 -9.924 7.999 1.00 0.00 N ATOM 1716 CA GLU A 104 13.872 -10.655 9.058 1.00 0.00 C ATOM 1717 C GLU A 104 14.252 -9.743 10.219 1.00 0.00 C ATOM 1718 O GLU A 104 13.920 -10.020 11.373 1.00 0.00 O ATOM 1719 CB GLU A 104 15.126 -11.328 8.502 1.00 0.00 C ATOM 1720 CG GLU A 104 14.833 -12.539 7.632 1.00 0.00 C ATOM 1721 CD GLU A 104 14.340 -13.723 8.436 1.00 0.00 C ATOM 1722 OE1 GLU A 104 15.172 -14.375 9.103 1.00 0.00 O ATOM 1723 OE2 GLU A 104 13.133 -14.032 8.389 1.00 0.00 O ATOM 0 H GLU A 104 13.691 -9.887 7.115 1.00 0.00 H new ATOM 0 HA GLU A 104 13.184 -11.412 9.435 1.00 0.00 H new ATOM 0 HB2 GLU A 104 15.690 -10.600 7.919 1.00 0.00 H new ATOM 0 HB3 GLU A 104 15.763 -11.633 9.332 1.00 0.00 H new ATOM 0 HG2 GLU A 104 14.085 -12.274 6.885 1.00 0.00 H new ATOM 0 HG3 GLU A 104 15.736 -12.821 7.091 1.00 0.00 H new ATOM 1730 N ASN A 105 14.933 -8.649 9.909 1.00 0.00 N ATOM 1731 CA ASN A 105 15.505 -7.796 10.947 1.00 0.00 C ATOM 1732 C ASN A 105 14.475 -6.861 11.567 1.00 0.00 C ATOM 1733 O ASN A 105 14.233 -6.919 12.774 1.00 0.00 O ATOM 1734 CB ASN A 105 16.676 -6.977 10.396 1.00 0.00 C ATOM 1735 CG ASN A 105 17.902 -7.827 10.115 1.00 0.00 C ATOM 1736 OD1 ASN A 105 18.741 -8.034 10.992 1.00 0.00 O ATOM 1737 ND2 ASN A 105 18.018 -8.317 8.892 1.00 0.00 N ATOM 0 H ASN A 105 15.103 -8.331 8.955 1.00 0.00 H new ATOM 0 HA ASN A 105 15.864 -8.463 11.731 1.00 0.00 H new ATOM 0 HB2 ASN A 105 16.366 -6.479 9.478 1.00 0.00 H new ATOM 0 HB3 ASN A 105 16.936 -6.196 11.110 1.00 0.00 H new ATOM 0 HD21 ASN A 105 18.825 -8.890 8.647 1.00 0.00 H new ATOM 0 HD22 ASN A 105 17.300 -8.122 8.194 1.00 0.00 H new ATOM 1744 N GLU A 106 13.851 -6.018 10.754 1.00 0.00 N ATOM 1745 CA GLU A 106 12.983 -4.972 11.284 1.00 0.00 C ATOM 1746 C GLU A 106 11.525 -5.408 11.312 1.00 0.00 C ATOM 1747 O GLU A 106 10.675 -4.719 11.878 1.00 0.00 O ATOM 1748 CB GLU A 106 13.129 -3.683 10.475 1.00 0.00 C ATOM 1749 CG GLU A 106 14.531 -3.097 10.513 1.00 0.00 C ATOM 1750 CD GLU A 106 14.565 -1.644 10.090 1.00 0.00 C ATOM 1751 OE1 GLU A 106 14.299 -0.769 10.945 1.00 0.00 O ATOM 1752 OE2 GLU A 106 14.864 -1.363 8.913 1.00 0.00 O ATOM 0 H GLU A 106 13.927 -6.036 9.737 1.00 0.00 H new ATOM 0 HA GLU A 106 13.297 -4.784 12.311 1.00 0.00 H new ATOM 0 HB2 GLU A 106 12.855 -3.881 9.439 1.00 0.00 H new ATOM 0 HB3 GLU A 106 12.424 -2.943 10.855 1.00 0.00 H new ATOM 0 HG2 GLU A 106 14.932 -3.187 11.523 1.00 0.00 H new ATOM 0 HG3 GLU A 106 15.182 -3.678 9.859 1.00 0.00 H new ATOM 1759 N GLY A 107 11.236 -6.538 10.692 1.00 0.00 N ATOM 1760 CA GLY A 107 9.889 -7.063 10.714 1.00 0.00 C ATOM 1761 C GLY A 107 9.119 -6.749 9.451 1.00 0.00 C ATOM 1762 O GLY A 107 9.507 -5.874 8.673 1.00 0.00 O ATOM 0 H GLY A 107 11.909 -7.102 10.174 1.00 0.00 H new ATOM 0 HA2 GLY A 107 9.927 -8.144 10.852 1.00 0.00 H new ATOM 0 HA3 GLY A 107 9.357 -6.650 11.571 1.00 0.00 H new ATOM 1766 N PHE A 108 8.012 -7.446 9.260 1.00 0.00 N ATOM 1767 CA PHE A 108 7.207 -7.283 8.063 1.00 0.00 C ATOM 1768 C PHE A 108 6.394 -5.997 8.142 1.00 0.00 C ATOM 1769 O PHE A 108 6.087 -5.378 7.125 1.00 0.00 O ATOM 1770 CB PHE A 108 6.288 -8.492 7.884 1.00 0.00 C ATOM 1771 CG PHE A 108 5.600 -8.535 6.552 1.00 0.00 C ATOM 1772 CD1 PHE A 108 6.295 -8.920 5.417 1.00 0.00 C ATOM 1773 CD2 PHE A 108 4.266 -8.191 6.435 1.00 0.00 C ATOM 1774 CE1 PHE A 108 5.669 -8.962 4.189 1.00 0.00 C ATOM 1775 CE2 PHE A 108 3.636 -8.231 5.209 1.00 0.00 C ATOM 1776 CZ PHE A 108 4.338 -8.616 4.085 1.00 0.00 C ATOM 0 H PHE A 108 7.650 -8.133 9.922 1.00 0.00 H new ATOM 0 HA PHE A 108 7.867 -7.216 7.198 1.00 0.00 H new ATOM 0 HB2 PHE A 108 6.873 -9.403 8.011 1.00 0.00 H new ATOM 0 HB3 PHE A 108 5.535 -8.484 8.672 1.00 0.00 H new ATOM 0 HD1 PHE A 108 7.338 -9.190 5.495 1.00 0.00 H new ATOM 0 HD2 PHE A 108 3.712 -7.888 7.312 1.00 0.00 H new ATOM 0 HE1 PHE A 108 6.220 -9.265 3.311 1.00 0.00 H new ATOM 0 HE2 PHE A 108 2.593 -7.961 5.128 1.00 0.00 H new ATOM 0 HZ PHE A 108 3.845 -8.646 3.124 1.00 0.00 H new ATOM 1786 N ASP A 109 6.068 -5.592 9.365 1.00 0.00 N ATOM 1787 CA ASP A 109 5.347 -4.345 9.600 1.00 0.00 C ATOM 1788 C ASP A 109 6.131 -3.174 9.022 1.00 0.00 C ATOM 1789 O ASP A 109 5.574 -2.310 8.337 1.00 0.00 O ATOM 1790 CB ASP A 109 5.121 -4.128 11.103 1.00 0.00 C ATOM 1791 CG ASP A 109 4.320 -5.242 11.748 1.00 0.00 C ATOM 1792 OD1 ASP A 109 4.934 -6.223 12.222 1.00 0.00 O ATOM 1793 OD2 ASP A 109 3.077 -5.138 11.804 1.00 0.00 O ATOM 0 H ASP A 109 6.293 -6.112 10.213 1.00 0.00 H new ATOM 0 HA ASP A 109 4.377 -4.408 9.106 1.00 0.00 H new ATOM 0 HB2 ASP A 109 6.087 -4.046 11.602 1.00 0.00 H new ATOM 0 HB3 ASP A 109 4.603 -3.181 11.254 1.00 0.00 H new ATOM 1798 N ALA A 110 7.437 -3.175 9.278 1.00 0.00 N ATOM 1799 CA ALA A 110 8.321 -2.130 8.780 1.00 0.00 C ATOM 1800 C ALA A 110 8.491 -2.245 7.273 1.00 0.00 C ATOM 1801 O ALA A 110 8.597 -1.239 6.572 1.00 0.00 O ATOM 1802 CB ALA A 110 9.675 -2.199 9.473 1.00 0.00 C ATOM 0 H ALA A 110 7.906 -3.893 9.830 1.00 0.00 H new ATOM 0 HA ALA A 110 7.867 -1.164 9.003 1.00 0.00 H new ATOM 0 HB1 ALA A 110 10.322 -1.411 9.088 1.00 0.00 H new ATOM 0 HB2 ALA A 110 9.541 -2.066 10.547 1.00 0.00 H new ATOM 0 HB3 ALA A 110 10.133 -3.170 9.281 1.00 0.00 H new ATOM 1808 N ASP A 111 8.514 -3.479 6.776 1.00 0.00 N ATOM 1809 CA ASP A 111 8.620 -3.720 5.340 1.00 0.00 C ATOM 1810 C ASP A 111 7.447 -3.077 4.612 1.00 0.00 C ATOM 1811 O ASP A 111 7.633 -2.390 3.608 1.00 0.00 O ATOM 1812 CB ASP A 111 8.673 -5.220 5.040 1.00 0.00 C ATOM 1813 CG ASP A 111 8.932 -5.501 3.572 1.00 0.00 C ATOM 1814 OD1 ASP A 111 10.086 -5.329 3.129 1.00 0.00 O ATOM 1815 OD2 ASP A 111 7.989 -5.886 2.857 1.00 0.00 O ATOM 0 H ASP A 111 8.461 -4.325 7.344 1.00 0.00 H new ATOM 0 HA ASP A 111 9.547 -3.270 4.985 1.00 0.00 H new ATOM 0 HB2 ASP A 111 9.457 -5.682 5.641 1.00 0.00 H new ATOM 0 HB3 ASP A 111 7.731 -5.682 5.336 1.00 0.00 H new ATOM 1820 N ILE A 112 6.245 -3.270 5.151 1.00 0.00 N ATOM 1821 CA ILE A 112 5.039 -2.657 4.599 1.00 0.00 C ATOM 1822 C ILE A 112 5.170 -1.137 4.544 1.00 0.00 C ATOM 1823 O ILE A 112 4.815 -0.507 3.541 1.00 0.00 O ATOM 1824 CB ILE A 112 3.787 -3.029 5.432 1.00 0.00 C ATOM 1825 CG1 ILE A 112 3.514 -4.533 5.354 1.00 0.00 C ATOM 1826 CG2 ILE A 112 2.565 -2.242 4.971 1.00 0.00 C ATOM 1827 CD1 ILE A 112 3.202 -5.027 3.958 1.00 0.00 C ATOM 0 H ILE A 112 6.080 -3.849 5.974 1.00 0.00 H new ATOM 0 HA ILE A 112 4.920 -3.044 3.587 1.00 0.00 H new ATOM 0 HB ILE A 112 3.987 -2.765 6.471 1.00 0.00 H new ATOM 0 HG12 ILE A 112 4.383 -5.070 5.733 1.00 0.00 H new ATOM 0 HG13 ILE A 112 2.678 -4.775 6.010 1.00 0.00 H new ATOM 0 HG21 ILE A 112 1.702 -2.524 5.574 1.00 0.00 H new ATOM 0 HG22 ILE A 112 2.755 -1.175 5.086 1.00 0.00 H new ATOM 0 HG23 ILE A 112 2.364 -2.464 3.923 1.00 0.00 H new ATOM 0 HD11 ILE A 112 3.020 -6.101 3.984 1.00 0.00 H new ATOM 0 HD12 ILE A 112 2.315 -4.518 3.582 1.00 0.00 H new ATOM 0 HD13 ILE A 112 4.046 -4.818 3.301 1.00 0.00 H new ATOM 1839 N ASP A 113 5.692 -0.555 5.619 1.00 0.00 N ATOM 1840 CA ASP A 113 5.868 0.892 5.704 1.00 0.00 C ATOM 1841 C ASP A 113 6.773 1.401 4.589 1.00 0.00 C ATOM 1842 O ASP A 113 6.589 2.511 4.088 1.00 0.00 O ATOM 1843 CB ASP A 113 6.458 1.291 7.060 1.00 0.00 C ATOM 1844 CG ASP A 113 5.519 1.016 8.214 1.00 0.00 C ATOM 1845 OD1 ASP A 113 4.295 1.179 8.043 1.00 0.00 O ATOM 1846 OD2 ASP A 113 5.995 0.656 9.307 1.00 0.00 O ATOM 0 H ASP A 113 6.002 -1.065 6.446 1.00 0.00 H new ATOM 0 HA ASP A 113 4.883 1.347 5.595 1.00 0.00 H new ATOM 0 HB2 ASP A 113 7.390 0.748 7.219 1.00 0.00 H new ATOM 0 HB3 ASP A 113 6.706 2.352 7.045 1.00 0.00 H new ATOM 1851 N SER A 114 7.730 0.570 4.192 1.00 0.00 N ATOM 1852 CA SER A 114 8.707 0.934 3.174 1.00 0.00 C ATOM 1853 C SER A 114 8.040 1.223 1.829 1.00 0.00 C ATOM 1854 O SER A 114 8.381 2.197 1.155 1.00 0.00 O ATOM 1855 CB SER A 114 9.725 -0.190 3.026 1.00 0.00 C ATOM 1856 OG SER A 114 10.166 -0.621 4.298 1.00 0.00 O ATOM 0 H SER A 114 7.850 -0.372 4.565 1.00 0.00 H new ATOM 0 HA SER A 114 9.209 1.848 3.492 1.00 0.00 H new ATOM 0 HB2 SER A 114 9.279 -1.025 2.486 1.00 0.00 H new ATOM 0 HB3 SER A 114 10.574 0.154 2.436 1.00 0.00 H new ATOM 0 HG SER A 114 11.065 -0.269 4.469 1.00 0.00 H new ATOM 1862 N TYR A 115 7.077 0.381 1.450 1.00 0.00 N ATOM 1863 CA TYR A 115 6.367 0.542 0.179 1.00 0.00 C ATOM 1864 C TYR A 115 5.624 1.869 0.144 1.00 0.00 C ATOM 1865 O TYR A 115 5.729 2.634 -0.813 1.00 0.00 O ATOM 1866 CB TYR A 115 5.363 -0.597 -0.037 1.00 0.00 C ATOM 1867 CG TYR A 115 5.985 -1.961 -0.200 1.00 0.00 C ATOM 1868 CD1 TYR A 115 6.296 -2.735 0.906 1.00 0.00 C ATOM 1869 CD2 TYR A 115 6.241 -2.482 -1.460 1.00 0.00 C ATOM 1870 CE1 TYR A 115 6.850 -3.990 0.764 1.00 0.00 C ATOM 1871 CE2 TYR A 115 6.797 -3.738 -1.612 1.00 0.00 C ATOM 1872 CZ TYR A 115 7.099 -4.488 -0.495 1.00 0.00 C ATOM 1873 OH TYR A 115 7.653 -5.739 -0.638 1.00 0.00 O ATOM 0 H TYR A 115 6.771 -0.419 2.004 1.00 0.00 H new ATOM 0 HA TYR A 115 7.111 0.520 -0.617 1.00 0.00 H new ATOM 0 HB2 TYR A 115 4.677 -0.624 0.810 1.00 0.00 H new ATOM 0 HB3 TYR A 115 4.768 -0.376 -0.923 1.00 0.00 H new ATOM 0 HD1 TYR A 115 6.101 -2.349 1.896 1.00 0.00 H new ATOM 0 HD2 TYR A 115 6.002 -1.897 -2.336 1.00 0.00 H new ATOM 0 HE1 TYR A 115 7.088 -4.580 1.637 1.00 0.00 H new ATOM 0 HE2 TYR A 115 6.994 -4.130 -2.599 1.00 0.00 H new ATOM 0 HH TYR A 115 8.333 -5.877 0.054 1.00 0.00 H new ATOM 1883 N ILE A 116 4.897 2.138 1.217 1.00 0.00 N ATOM 1884 CA ILE A 116 4.031 3.303 1.298 1.00 0.00 C ATOM 1885 C ILE A 116 4.842 4.593 1.425 1.00 0.00 C ATOM 1886 O ILE A 116 4.382 5.671 1.043 1.00 0.00 O ATOM 1887 CB ILE A 116 3.065 3.167 2.497 1.00 0.00 C ATOM 1888 CG1 ILE A 116 2.305 1.836 2.409 1.00 0.00 C ATOM 1889 CG2 ILE A 116 2.093 4.338 2.557 1.00 0.00 C ATOM 1890 CD1 ILE A 116 1.435 1.706 1.175 1.00 0.00 C ATOM 0 H ILE A 116 4.891 1.556 2.055 1.00 0.00 H new ATOM 0 HA ILE A 116 3.455 3.355 0.374 1.00 0.00 H new ATOM 0 HB ILE A 116 3.653 3.179 3.415 1.00 0.00 H new ATOM 0 HG12 ILE A 116 3.024 1.017 2.423 1.00 0.00 H new ATOM 0 HG13 ILE A 116 1.680 1.726 3.295 1.00 0.00 H new ATOM 0 HG21 ILE A 116 1.426 4.214 3.411 1.00 0.00 H new ATOM 0 HG22 ILE A 116 2.651 5.269 2.664 1.00 0.00 H new ATOM 0 HG23 ILE A 116 1.505 4.370 1.640 1.00 0.00 H new ATOM 0 HD11 ILE A 116 0.931 0.739 1.185 1.00 0.00 H new ATOM 0 HD12 ILE A 116 0.691 2.503 1.169 1.00 0.00 H new ATOM 0 HD13 ILE A 116 2.056 1.782 0.282 1.00 0.00 H new ATOM 1902 N ASP A 117 6.054 4.476 1.948 1.00 0.00 N ATOM 1903 CA ASP A 117 6.915 5.637 2.152 1.00 0.00 C ATOM 1904 C ASP A 117 7.593 6.055 0.855 1.00 0.00 C ATOM 1905 O ASP A 117 7.849 7.239 0.643 1.00 0.00 O ATOM 1906 CB ASP A 117 7.980 5.332 3.209 1.00 0.00 C ATOM 1907 CG ASP A 117 8.866 6.529 3.506 1.00 0.00 C ATOM 1908 OD1 ASP A 117 9.888 6.715 2.807 1.00 0.00 O ATOM 1909 OD2 ASP A 117 8.545 7.288 4.442 1.00 0.00 O ATOM 0 H ASP A 117 6.466 3.589 2.240 1.00 0.00 H new ATOM 0 HA ASP A 117 6.286 6.458 2.496 1.00 0.00 H new ATOM 0 HB2 ASP A 117 7.492 5.008 4.128 1.00 0.00 H new ATOM 0 HB3 ASP A 117 8.599 4.502 2.867 1.00 0.00 H new ATOM 1914 N SER A 118 7.850 5.080 -0.017 1.00 0.00 N ATOM 1915 CA SER A 118 8.616 5.304 -1.245 1.00 0.00 C ATOM 1916 C SER A 118 8.018 6.427 -2.100 1.00 0.00 C ATOM 1917 O SER A 118 6.973 6.254 -2.732 1.00 0.00 O ATOM 1918 CB SER A 118 8.683 4.009 -2.054 1.00 0.00 C ATOM 1919 OG SER A 118 9.318 2.977 -1.313 1.00 0.00 O ATOM 0 H SER A 118 7.535 4.118 0.106 1.00 0.00 H new ATOM 0 HA SER A 118 9.621 5.613 -0.958 1.00 0.00 H new ATOM 0 HB2 SER A 118 7.676 3.696 -2.330 1.00 0.00 H new ATOM 0 HB3 SER A 118 9.228 4.184 -2.982 1.00 0.00 H new ATOM 0 HG SER A 118 8.799 2.789 -0.503 1.00 0.00 H new ATOM 1925 N PRO A 119 8.693 7.593 -2.136 1.00 0.00 N ATOM 1926 CA PRO A 119 8.195 8.784 -2.830 1.00 0.00 C ATOM 1927 C PRO A 119 8.103 8.599 -4.342 1.00 0.00 C ATOM 1928 O PRO A 119 7.112 8.995 -4.956 1.00 0.00 O ATOM 1929 CB PRO A 119 9.223 9.869 -2.484 1.00 0.00 C ATOM 1930 CG PRO A 119 10.456 9.130 -2.094 1.00 0.00 C ATOM 1931 CD PRO A 119 9.996 7.836 -1.488 1.00 0.00 C ATOM 0 HA PRO A 119 7.179 9.026 -2.518 1.00 0.00 H new ATOM 0 HB2 PRO A 119 9.409 10.522 -3.337 1.00 0.00 H new ATOM 0 HB3 PRO A 119 8.869 10.501 -1.670 1.00 0.00 H new ATOM 0 HG2 PRO A 119 11.092 8.949 -2.961 1.00 0.00 H new ATOM 0 HG3 PRO A 119 11.046 9.706 -1.381 1.00 0.00 H new ATOM 0 HD2 PRO A 119 10.700 7.028 -1.687 1.00 0.00 H new ATOM 0 HD3 PRO A 119 9.897 7.913 -0.405 1.00 0.00 H new ATOM 1939 N GLU A 120 9.130 7.989 -4.933 1.00 0.00 N ATOM 1940 CA GLU A 120 9.182 7.776 -6.381 1.00 0.00 C ATOM 1941 C GLU A 120 7.910 7.102 -6.884 1.00 0.00 C ATOM 1942 O GLU A 120 7.208 7.630 -7.747 1.00 0.00 O ATOM 1943 CB GLU A 120 10.398 6.914 -6.745 1.00 0.00 C ATOM 1944 CG GLU A 120 10.502 6.566 -8.226 1.00 0.00 C ATOM 1945 CD GLU A 120 10.969 7.726 -9.081 1.00 0.00 C ATOM 1946 OE1 GLU A 120 10.180 8.664 -9.311 1.00 0.00 O ATOM 1947 OE2 GLU A 120 12.134 7.702 -9.532 1.00 0.00 O ATOM 0 H GLU A 120 9.942 7.632 -4.429 1.00 0.00 H new ATOM 0 HA GLU A 120 9.270 8.751 -6.860 1.00 0.00 H new ATOM 0 HB2 GLU A 120 11.304 7.439 -6.443 1.00 0.00 H new ATOM 0 HB3 GLU A 120 10.359 5.990 -6.169 1.00 0.00 H new ATOM 0 HG2 GLU A 120 11.193 5.732 -8.349 1.00 0.00 H new ATOM 0 HG3 GLU A 120 9.529 6.229 -8.583 1.00 0.00 H new ATOM 1954 N TYR A 121 7.604 5.949 -6.312 1.00 0.00 N ATOM 1955 CA TYR A 121 6.506 5.121 -6.791 1.00 0.00 C ATOM 1956 C TYR A 121 5.155 5.698 -6.385 1.00 0.00 C ATOM 1957 O TYR A 121 4.202 5.668 -7.161 1.00 0.00 O ATOM 1958 CB TYR A 121 6.668 3.696 -6.264 1.00 0.00 C ATOM 1959 CG TYR A 121 8.041 3.123 -6.538 1.00 0.00 C ATOM 1960 CD1 TYR A 121 8.412 2.736 -7.819 1.00 0.00 C ATOM 1961 CD2 TYR A 121 8.974 2.991 -5.516 1.00 0.00 C ATOM 1962 CE1 TYR A 121 9.671 2.230 -8.074 1.00 0.00 C ATOM 1963 CE2 TYR A 121 10.235 2.490 -5.765 1.00 0.00 C ATOM 1964 CZ TYR A 121 10.579 2.110 -7.046 1.00 0.00 C ATOM 1965 OH TYR A 121 11.838 1.617 -7.299 1.00 0.00 O ATOM 0 H TYR A 121 8.103 5.562 -5.511 1.00 0.00 H new ATOM 0 HA TYR A 121 6.537 5.104 -7.880 1.00 0.00 H new ATOM 0 HB2 TYR A 121 6.483 3.687 -5.190 1.00 0.00 H new ATOM 0 HB3 TYR A 121 5.914 3.056 -6.722 1.00 0.00 H new ATOM 0 HD1 TYR A 121 7.704 2.832 -8.629 1.00 0.00 H new ATOM 0 HD2 TYR A 121 8.708 3.285 -4.512 1.00 0.00 H new ATOM 0 HE1 TYR A 121 9.942 1.930 -9.075 1.00 0.00 H new ATOM 0 HE2 TYR A 121 10.950 2.396 -4.961 1.00 0.00 H new ATOM 0 HH TYR A 121 12.355 1.598 -6.467 1.00 0.00 H new ATOM 1975 N THR A 122 5.082 6.245 -5.181 1.00 0.00 N ATOM 1976 CA THR A 122 3.839 6.815 -4.685 1.00 0.00 C ATOM 1977 C THR A 122 3.437 8.050 -5.491 1.00 0.00 C ATOM 1978 O THR A 122 2.274 8.216 -5.851 1.00 0.00 O ATOM 1979 CB THR A 122 3.950 7.189 -3.192 1.00 0.00 C ATOM 1980 OG1 THR A 122 4.311 6.032 -2.425 1.00 0.00 O ATOM 1981 CG2 THR A 122 2.637 7.751 -2.670 1.00 0.00 C ATOM 0 H THR A 122 5.866 6.306 -4.531 1.00 0.00 H new ATOM 0 HA THR A 122 3.070 6.051 -4.800 1.00 0.00 H new ATOM 0 HB THR A 122 4.720 7.954 -3.091 1.00 0.00 H new ATOM 0 HG1 THR A 122 5.244 5.795 -2.610 1.00 0.00 H new ATOM 0 HG21 THR A 122 2.744 8.006 -1.616 1.00 0.00 H new ATOM 0 HG22 THR A 122 2.374 8.645 -3.235 1.00 0.00 H new ATOM 0 HG23 THR A 122 1.851 7.005 -2.785 1.00 0.00 H new ATOM 1989 N ASN A 123 4.406 8.900 -5.801 1.00 0.00 N ATOM 1990 CA ASN A 123 4.122 10.145 -6.506 1.00 0.00 C ATOM 1991 C ASN A 123 3.830 9.894 -7.985 1.00 0.00 C ATOM 1992 O ASN A 123 3.075 10.637 -8.610 1.00 0.00 O ATOM 1993 CB ASN A 123 5.289 11.122 -6.351 1.00 0.00 C ATOM 1994 CG ASN A 123 5.017 12.468 -6.999 1.00 0.00 C ATOM 1995 OD1 ASN A 123 5.354 12.688 -8.162 1.00 0.00 O ATOM 1996 ND2 ASN A 123 4.404 13.376 -6.251 1.00 0.00 N ATOM 0 H ASN A 123 5.390 8.753 -5.578 1.00 0.00 H new ATOM 0 HA ASN A 123 3.230 10.586 -6.060 1.00 0.00 H new ATOM 0 HB2 ASN A 123 5.496 11.269 -5.291 1.00 0.00 H new ATOM 0 HB3 ASN A 123 6.184 10.685 -6.793 1.00 0.00 H new ATOM 0 HD21 ASN A 123 4.195 14.297 -6.636 1.00 0.00 H new ATOM 0 HD22 ASN A 123 4.141 13.153 -5.291 1.00 0.00 H new ATOM 2003 N SER A 124 4.415 8.843 -8.544 1.00 0.00 N ATOM 2004 CA SER A 124 4.203 8.534 -9.951 1.00 0.00 C ATOM 2005 C SER A 124 2.857 7.840 -10.170 1.00 0.00 C ATOM 2006 O SER A 124 2.175 8.093 -11.165 1.00 0.00 O ATOM 2007 CB SER A 124 5.350 7.677 -10.491 1.00 0.00 C ATOM 2008 OG SER A 124 5.626 6.587 -9.631 1.00 0.00 O ATOM 0 H SER A 124 5.033 8.197 -8.052 1.00 0.00 H new ATOM 0 HA SER A 124 4.185 9.474 -10.503 1.00 0.00 H new ATOM 0 HB2 SER A 124 5.093 7.305 -11.483 1.00 0.00 H new ATOM 0 HB3 SER A 124 6.244 8.291 -10.603 1.00 0.00 H new ATOM 0 HG SER A 124 6.319 6.845 -8.988 1.00 0.00 H new ATOM 2014 N PHE A 125 2.472 6.970 -9.242 1.00 0.00 N ATOM 2015 CA PHE A 125 1.209 6.251 -9.363 1.00 0.00 C ATOM 2016 C PHE A 125 0.053 7.084 -8.820 1.00 0.00 C ATOM 2017 O PHE A 125 -1.028 7.116 -9.412 1.00 0.00 O ATOM 2018 CB PHE A 125 1.287 4.915 -8.619 1.00 0.00 C ATOM 2019 CG PHE A 125 0.041 4.077 -8.743 1.00 0.00 C ATOM 2020 CD1 PHE A 125 -0.138 3.239 -9.830 1.00 0.00 C ATOM 2021 CD2 PHE A 125 -0.949 4.129 -7.772 1.00 0.00 C ATOM 2022 CE1 PHE A 125 -1.278 2.470 -9.950 1.00 0.00 C ATOM 2023 CE2 PHE A 125 -2.092 3.360 -7.889 1.00 0.00 C ATOM 2024 CZ PHE A 125 -2.257 2.530 -8.978 1.00 0.00 C ATOM 0 H PHE A 125 3.011 6.747 -8.405 1.00 0.00 H new ATOM 0 HA PHE A 125 1.027 6.060 -10.421 1.00 0.00 H new ATOM 0 HB2 PHE A 125 2.135 4.347 -9.000 1.00 0.00 H new ATOM 0 HB3 PHE A 125 1.480 5.108 -7.564 1.00 0.00 H new ATOM 0 HD1 PHE A 125 0.624 3.186 -10.594 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -0.825 4.777 -6.917 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -1.404 1.821 -10.804 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -2.856 3.409 -7.127 1.00 0.00 H new ATOM 0 HZ PHE A 125 -3.149 1.929 -9.070 1.00 0.00 H new ATOM 2034 N GLY A 126 0.292 7.777 -7.717 1.00 0.00 N ATOM 2035 CA GLY A 126 -0.746 8.579 -7.106 1.00 0.00 C ATOM 2036 C GLY A 126 -1.060 8.129 -5.692 1.00 0.00 C ATOM 2037 O GLY A 126 -1.352 6.957 -5.459 1.00 0.00 O ATOM 0 H GLY A 126 1.190 7.798 -7.233 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -0.435 9.624 -7.092 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -1.650 8.523 -7.712 1.00 0.00 H new ATOM 2041 N ASP A 127 -0.996 9.067 -4.754 1.00 0.00 N ATOM 2042 CA ASP A 127 -1.277 8.793 -3.346 1.00 0.00 C ATOM 2043 C ASP A 127 -2.729 8.373 -3.168 1.00 0.00 C ATOM 2044 O ASP A 127 -3.038 7.396 -2.486 1.00 0.00 O ATOM 2045 CB ASP A 127 -1.005 10.059 -2.518 1.00 0.00 C ATOM 2046 CG ASP A 127 -1.112 9.854 -1.014 1.00 0.00 C ATOM 2047 OD1 ASP A 127 -2.100 9.257 -0.545 1.00 0.00 O ATOM 2048 OD2 ASP A 127 -0.206 10.331 -0.291 1.00 0.00 O ATOM 0 H ASP A 127 -0.748 10.038 -4.946 1.00 0.00 H new ATOM 0 HA ASP A 127 -0.632 7.982 -3.007 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -0.006 10.426 -2.753 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -1.709 10.835 -2.819 1.00 0.00 H new ATOM 2053 N TRP A 128 -3.614 9.110 -3.821 1.00 0.00 N ATOM 2054 CA TRP A 128 -5.044 8.959 -3.614 1.00 0.00 C ATOM 2055 C TRP A 128 -5.669 8.007 -4.631 1.00 0.00 C ATOM 2056 O TRP A 128 -6.888 7.993 -4.807 1.00 0.00 O ATOM 2057 CB TRP A 128 -5.718 10.331 -3.690 1.00 0.00 C ATOM 2058 CG TRP A 128 -5.203 11.311 -2.673 1.00 0.00 C ATOM 2059 CD1 TRP A 128 -4.127 12.141 -2.807 1.00 0.00 C ATOM 2060 CD2 TRP A 128 -5.744 11.565 -1.371 1.00 0.00 C ATOM 2061 NE1 TRP A 128 -3.962 12.887 -1.665 1.00 0.00 N ATOM 2062 CE2 TRP A 128 -4.940 12.551 -0.768 1.00 0.00 C ATOM 2063 CE3 TRP A 128 -6.823 11.050 -0.650 1.00 0.00 C ATOM 2064 CZ2 TRP A 128 -5.189 13.037 0.512 1.00 0.00 C ATOM 2065 CZ3 TRP A 128 -7.069 11.532 0.621 1.00 0.00 C ATOM 2066 CH2 TRP A 128 -6.253 12.515 1.192 1.00 0.00 C ATOM 0 H TRP A 128 -3.363 9.824 -4.504 1.00 0.00 H new ATOM 0 HA TRP A 128 -5.199 8.525 -2.626 1.00 0.00 H new ATOM 0 HB2 TRP A 128 -5.571 10.744 -4.688 1.00 0.00 H new ATOM 0 HB3 TRP A 128 -6.792 10.207 -3.552 1.00 0.00 H new ATOM 0 HD1 TRP A 128 -3.498 12.202 -3.683 1.00 0.00 H new ATOM 0 HE1 TRP A 128 -3.229 13.579 -1.511 1.00 0.00 H new ATOM 0 HE3 TRP A 128 -7.455 10.287 -1.079 1.00 0.00 H new ATOM 0 HZ2 TRP A 128 -4.564 13.800 0.952 1.00 0.00 H new ATOM 0 HZ3 TRP A 128 -7.905 11.144 1.183 1.00 0.00 H new ATOM 0 HH2 TRP A 128 -6.468 12.868 2.190 1.00 0.00 H new ATOM 2077 N VAL A 129 -4.842 7.204 -5.283 1.00 0.00 N ATOM 2078 CA VAL A 129 -5.327 6.272 -6.291 1.00 0.00 C ATOM 2079 C VAL A 129 -5.392 4.849 -5.731 1.00 0.00 C ATOM 2080 O VAL A 129 -4.463 4.390 -5.067 1.00 0.00 O ATOM 2081 CB VAL A 129 -4.435 6.291 -7.554 1.00 0.00 C ATOM 2082 CG1 VAL A 129 -4.987 5.365 -8.628 1.00 0.00 C ATOM 2083 CG2 VAL A 129 -4.294 7.708 -8.092 1.00 0.00 C ATOM 0 H VAL A 129 -3.833 7.178 -5.133 1.00 0.00 H new ATOM 0 HA VAL A 129 -6.331 6.593 -6.570 1.00 0.00 H new ATOM 0 HB VAL A 129 -3.447 5.929 -7.271 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -4.340 5.398 -9.505 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -5.026 4.346 -8.244 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -5.991 5.687 -8.905 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -3.663 7.699 -8.980 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -5.278 8.099 -8.350 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -3.840 8.343 -7.331 1.00 0.00 H new ATOM 2093 N VAL A 130 -6.496 4.161 -5.997 1.00 0.00 N ATOM 2094 CA VAL A 130 -6.687 2.801 -5.516 1.00 0.00 C ATOM 2095 C VAL A 130 -5.890 1.806 -6.360 1.00 0.00 C ATOM 2096 O VAL A 130 -6.012 1.784 -7.588 1.00 0.00 O ATOM 2097 CB VAL A 130 -8.180 2.406 -5.519 1.00 0.00 C ATOM 2098 CG1 VAL A 130 -8.371 0.975 -5.033 1.00 0.00 C ATOM 2099 CG2 VAL A 130 -8.986 3.371 -4.665 1.00 0.00 C ATOM 0 H VAL A 130 -7.275 4.526 -6.546 1.00 0.00 H new ATOM 0 HA VAL A 130 -6.322 2.768 -4.489 1.00 0.00 H new ATOM 0 HB VAL A 130 -8.542 2.463 -6.546 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -9.432 0.725 -5.046 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -7.829 0.293 -5.688 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -7.989 0.882 -4.017 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -10.036 3.078 -4.678 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -8.615 3.347 -3.640 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -8.886 4.381 -5.064 1.00 0.00 H new ATOM 2109 N PRO A 131 -5.049 0.991 -5.695 1.00 0.00 N ATOM 2110 CA PRO A 131 -4.208 -0.029 -6.338 1.00 0.00 C ATOM 2111 C PRO A 131 -4.912 -0.857 -7.415 1.00 0.00 C ATOM 2112 O PRO A 131 -5.950 -1.470 -7.167 1.00 0.00 O ATOM 2113 CB PRO A 131 -3.840 -0.936 -5.169 1.00 0.00 C ATOM 2114 CG PRO A 131 -3.781 -0.034 -3.992 1.00 0.00 C ATOM 2115 CD PRO A 131 -4.825 1.027 -4.230 1.00 0.00 C ATOM 0 HA PRO A 131 -3.375 0.437 -6.865 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -4.583 -1.721 -5.029 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -2.883 -1.429 -5.337 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -3.983 -0.581 -3.071 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -2.790 0.409 -3.889 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -5.742 0.814 -3.681 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -4.479 2.008 -3.904 1.00 0.00 H new ATOM 2123 N TYR A 132 -4.327 -0.874 -8.610 1.00 0.00 N ATOM 2124 CA TYR A 132 -4.760 -1.787 -9.660 1.00 0.00 C ATOM 2125 C TYR A 132 -3.573 -2.643 -10.106 1.00 0.00 C ATOM 2126 O TYR A 132 -2.430 -2.333 -9.761 1.00 0.00 O ATOM 2127 CB TYR A 132 -5.382 -1.025 -10.846 1.00 0.00 C ATOM 2128 CG TYR A 132 -4.438 -0.125 -11.633 1.00 0.00 C ATOM 2129 CD1 TYR A 132 -3.374 -0.655 -12.350 1.00 0.00 C ATOM 2130 CD2 TYR A 132 -4.636 1.248 -11.688 1.00 0.00 C ATOM 2131 CE1 TYR A 132 -2.535 0.144 -13.097 1.00 0.00 C ATOM 2132 CE2 TYR A 132 -3.796 2.062 -12.430 1.00 0.00 C ATOM 2133 CZ TYR A 132 -2.748 1.503 -13.134 1.00 0.00 C ATOM 2134 OH TYR A 132 -1.922 2.302 -13.892 1.00 0.00 O ATOM 0 H TYR A 132 -3.552 -0.265 -8.874 1.00 0.00 H new ATOM 0 HA TYR A 132 -5.538 -2.440 -9.264 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -5.814 -1.753 -11.533 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -6.203 -0.415 -10.469 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -3.199 -1.720 -12.322 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -5.458 1.689 -11.144 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -1.716 -0.293 -13.649 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -3.960 3.129 -12.458 1.00 0.00 H new ATOM 0 HH TYR A 132 -2.207 3.236 -13.812 1.00 0.00 H new ATOM 2144 N TYR A 133 -3.833 -3.706 -10.860 1.00 0.00 N ATOM 2145 CA TYR A 133 -2.766 -4.596 -11.322 1.00 0.00 C ATOM 2146 C TYR A 133 -1.861 -3.870 -12.311 1.00 0.00 C ATOM 2147 O TYR A 133 -2.348 -3.172 -13.198 1.00 0.00 O ATOM 2148 CB TYR A 133 -3.357 -5.847 -11.972 1.00 0.00 C ATOM 2149 CG TYR A 133 -2.350 -6.956 -12.178 1.00 0.00 C ATOM 2150 CD1 TYR A 133 -1.963 -7.767 -11.119 1.00 0.00 C ATOM 2151 CD2 TYR A 133 -1.787 -7.192 -13.424 1.00 0.00 C ATOM 2152 CE1 TYR A 133 -1.044 -8.782 -11.296 1.00 0.00 C ATOM 2153 CE2 TYR A 133 -0.866 -8.205 -13.610 1.00 0.00 C ATOM 2154 CZ TYR A 133 -0.498 -8.997 -12.542 1.00 0.00 C ATOM 2155 OH TYR A 133 0.416 -10.010 -12.722 1.00 0.00 O ATOM 0 H TYR A 133 -4.769 -3.974 -11.165 1.00 0.00 H new ATOM 0 HA TYR A 133 -2.172 -4.898 -10.459 1.00 0.00 H new ATOM 0 HB2 TYR A 133 -4.172 -6.218 -11.351 1.00 0.00 H new ATOM 0 HB3 TYR A 133 -3.789 -5.576 -12.936 1.00 0.00 H new ATOM 0 HD1 TYR A 133 -2.388 -7.601 -10.140 1.00 0.00 H new ATOM 0 HD2 TYR A 133 -2.073 -6.574 -14.262 1.00 0.00 H new ATOM 0 HE1 TYR A 133 -0.755 -9.404 -10.462 1.00 0.00 H new ATOM 0 HE2 TYR A 133 -0.437 -8.376 -14.586 1.00 0.00 H new ATOM 0 HH TYR A 133 0.703 -10.029 -13.659 1.00 0.00 H new ATOM 2165 N ARG A 134 -0.548 -4.069 -12.154 1.00 0.00 N ATOM 2166 CA ARG A 134 0.487 -3.330 -12.894 1.00 0.00 C ATOM 2167 C ARG A 134 0.664 -1.938 -12.292 1.00 0.00 C ATOM 2168 O ARG A 134 1.239 -1.037 -12.908 1.00 0.00 O ATOM 2169 CB ARG A 134 0.190 -3.236 -14.401 1.00 0.00 C ATOM 2170 CG ARG A 134 1.430 -2.935 -15.229 1.00 0.00 C ATOM 2171 CD ARG A 134 1.090 -2.509 -16.645 1.00 0.00 C ATOM 2172 NE ARG A 134 2.293 -2.363 -17.463 1.00 0.00 N ATOM 2173 CZ ARG A 134 3.088 -1.289 -17.464 1.00 0.00 C ATOM 2174 NH1 ARG A 134 2.793 -0.216 -16.738 1.00 0.00 N ATOM 2175 NH2 ARG A 134 4.185 -1.295 -18.203 1.00 0.00 N ATOM 0 H ARG A 134 -0.167 -4.755 -11.503 1.00 0.00 H new ATOM 0 HA ARG A 134 1.417 -3.890 -12.796 1.00 0.00 H new ATOM 0 HB2 ARG A 134 -0.248 -4.175 -14.739 1.00 0.00 H new ATOM 0 HB3 ARG A 134 -0.553 -2.457 -14.572 1.00 0.00 H new ATOM 0 HG2 ARG A 134 2.005 -2.147 -14.743 1.00 0.00 H new ATOM 0 HG3 ARG A 134 2.066 -3.820 -15.261 1.00 0.00 H new ATOM 0 HD2 ARG A 134 0.427 -3.246 -17.099 1.00 0.00 H new ATOM 0 HD3 ARG A 134 0.547 -1.564 -16.622 1.00 0.00 H new ATOM 0 HE ARG A 134 2.544 -3.137 -18.078 1.00 0.00 H new ATOM 0 HH11 ARG A 134 1.948 -0.203 -16.167 1.00 0.00 H new ATOM 0 HH12 ARG A 134 3.412 0.595 -16.751 1.00 0.00 H new ATOM 0 HH21 ARG A 134 4.417 -2.114 -18.765 1.00 0.00 H new ATOM 0 HH22 ARG A 134 4.799 -0.480 -18.211 1.00 0.00 H new