USER MOD reduce.3.24.130724 H: found=0, std=0, add=1094, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 1088 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: B 2 ASN : amide:sc= 0.132 K(o=0.13,f=-3.1!) USER MOD Set 1.2: B 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 2 ASN : amide:sc= -0.0107 X(o=-0.011,f=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 13 THR OG1 : rot -76:sc= -0.667 USER MOD Single : A 14 SER OG : rot -77:sc= 0.195 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.0136) USER MOD Single : A 19 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00378) USER MOD Single : A 22 THR OG1 : rot 77:sc= 0.929 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot -140:sc= -0.153 USER MOD Single : A 33 THR OG1 : rot -15:sc= 0.847 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl -153:sc= -1 (180deg=-1.66!) USER MOD Single : B 1 MET N :NH3+ -179:sc= 0.597 (180deg=0.592) USER MOD Single : B 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 13 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 17 SER OG : rot 180:sc= 0 USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 22 THR OG1 : rot -140:sc= -0.67 USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 SER OG : rot 180:sc= 0 USER MOD Single : B 33 THR OG1 : rot 180:sc= 0 USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 49 ASN : amide:sc= 0 K(o=0,f=-2!) USER MOD Single : B 75 LYS NZ :NH3+ -177:sc= 0.00208 (180deg=0.00174) USER MOD Single : B 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 19 N ASN A 2 -9.521 9.054 -0.918 1.00 0.00 N ATOM 20 CA ASN A 2 -8.845 10.220 -1.587 1.00 0.00 C ATOM 21 C ASN A 2 -8.033 11.296 -0.816 1.00 0.00 C ATOM 22 O ASN A 2 -7.955 12.490 -1.126 1.00 0.00 O ATOM 23 CB ASN A 2 -9.690 10.807 -2.725 1.00 0.00 C ATOM 24 CG ASN A 2 -11.119 11.252 -2.360 1.00 0.00 C ATOM 25 OD1 ASN A 2 -12.101 10.569 -2.651 1.00 0.00 O ATOM 26 ND2 ASN A 2 -11.248 12.366 -1.663 1.00 0.00 N ATOM 0 HA ASN A 2 -7.975 9.672 -1.950 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -9.160 11.666 -3.136 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -9.756 10.064 -3.519 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -12.172 12.672 -1.357 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -10.424 12.920 -1.430 1.00 0.00 H new ATOM 33 N LYS A 3 -7.424 10.734 0.210 1.00 0.00 N ATOM 34 CA LYS A 3 -6.776 11.457 1.334 1.00 0.00 C ATOM 35 C LYS A 3 -7.694 12.398 2.195 1.00 0.00 C ATOM 36 O LYS A 3 -7.217 12.961 3.181 1.00 0.00 O ATOM 37 CB LYS A 3 -5.453 12.102 0.832 1.00 0.00 C ATOM 38 CG LYS A 3 -4.327 12.198 1.883 1.00 0.00 C ATOM 39 CD LYS A 3 -2.921 12.496 1.321 1.00 0.00 C ATOM 40 CE LYS A 3 -2.728 13.935 0.810 1.00 0.00 C ATOM 41 NZ LYS A 3 -1.362 14.140 0.295 1.00 0.00 N ATOM 0 H LYS A 3 -7.354 9.721 0.305 1.00 0.00 H new ATOM 0 HA LYS A 3 -6.535 10.709 2.089 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -5.087 11.526 -0.018 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -5.673 13.105 0.466 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -4.587 12.978 2.599 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -4.288 11.259 2.435 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -2.184 12.299 2.099 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -2.716 11.804 0.504 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -3.452 14.144 0.022 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -2.924 14.640 1.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -1.261 15.119 -0.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -0.674 13.963 1.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -1.185 13.483 -0.491 1.00 0.00 H new ATOM 54 N THR A 4 -8.998 12.511 1.857 1.00 0.00 N ATOM 55 CA THR A 4 -10.011 13.317 2.511 1.00 0.00 C ATOM 56 C THR A 4 -11.175 12.430 3.040 1.00 0.00 C ATOM 57 O THR A 4 -11.585 12.642 4.190 1.00 0.00 O ATOM 58 CB THR A 4 -10.394 14.352 1.436 1.00 0.00 C ATOM 59 OG1 THR A 4 -9.304 15.222 1.128 1.00 0.00 O ATOM 60 CG2 THR A 4 -11.530 15.195 1.936 1.00 0.00 C ATOM 0 H THR A 4 -9.380 11.999 1.062 1.00 0.00 H new ATOM 0 HA THR A 4 -9.677 13.825 3.416 1.00 0.00 H new ATOM 0 HB THR A 4 -10.675 13.802 0.538 1.00 0.00 H new ATOM 0 HG1 THR A 4 -9.582 15.864 0.442 1.00 0.00 H new ATOM 0 HG21 THR A 4 -11.801 15.928 1.176 1.00 0.00 H new ATOM 0 HG22 THR A 4 -12.389 14.559 2.150 1.00 0.00 H new ATOM 0 HG23 THR A 4 -11.226 15.712 2.846 1.00 0.00 H new ATOM 68 N GLU A 5 -11.735 11.469 2.250 1.00 0.00 N ATOM 69 CA GLU A 5 -12.604 10.412 2.862 1.00 0.00 C ATOM 70 C GLU A 5 -11.790 9.545 3.923 1.00 0.00 C ATOM 71 O GLU A 5 -12.394 8.893 4.778 1.00 0.00 O ATOM 72 CB GLU A 5 -13.405 9.574 1.819 1.00 0.00 C ATOM 73 CG GLU A 5 -13.937 10.259 0.540 1.00 0.00 C ATOM 74 CD GLU A 5 -14.972 11.361 0.787 1.00 0.00 C ATOM 75 OE1 GLU A 5 -16.165 11.137 0.989 1.00 0.00 O ATOM 76 OE2 GLU A 5 -14.414 12.615 0.758 1.00 0.00 O ATOM 0 H GLU A 5 -11.612 11.400 1.240 1.00 0.00 H new ATOM 0 HA GLU A 5 -13.388 10.923 3.421 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -12.768 8.747 1.506 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -14.260 9.139 2.337 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -13.095 10.686 -0.004 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -14.381 9.500 -0.104 1.00 0.00 H new ATOM 84 N LEU A 6 -10.423 9.603 3.879 1.00 0.00 N ATOM 85 CA LEU A 6 -9.503 9.171 4.948 1.00 0.00 C ATOM 86 C LEU A 6 -9.729 9.959 6.261 1.00 0.00 C ATOM 87 O LEU A 6 -9.985 9.331 7.279 1.00 0.00 O ATOM 88 CB LEU A 6 -8.021 9.353 4.474 1.00 0.00 C ATOM 89 CG LEU A 6 -7.068 8.190 4.788 1.00 0.00 C ATOM 90 CD1 LEU A 6 -5.670 8.427 4.192 1.00 0.00 C ATOM 91 CD2 LEU A 6 -7.051 7.851 6.294 1.00 0.00 C ATOM 0 H LEU A 6 -9.928 9.966 3.065 1.00 0.00 H new ATOM 0 HA LEU A 6 -9.705 8.120 5.153 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -8.022 9.515 3.396 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -7.622 10.258 4.932 1.00 0.00 H new ATOM 0 HG LEU A 6 -7.454 7.299 4.294 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -5.023 7.584 4.435 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -5.748 8.525 3.109 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -5.247 9.341 4.609 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -6.365 7.023 6.473 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -6.723 8.723 6.860 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -8.053 7.567 6.614 1.00 0.00 H new ATOM 103 N ILE A 7 -9.667 11.307 6.212 1.00 0.00 N ATOM 104 CA ILE A 7 -9.894 12.242 7.358 1.00 0.00 C ATOM 105 C ILE A 7 -11.206 11.926 8.128 1.00 0.00 C ATOM 106 O ILE A 7 -11.182 11.848 9.359 1.00 0.00 O ATOM 107 CB ILE A 7 -9.858 13.741 6.879 1.00 0.00 C ATOM 108 CG1 ILE A 7 -8.592 14.063 6.037 1.00 0.00 C ATOM 109 CG2 ILE A 7 -9.982 14.758 8.042 1.00 0.00 C ATOM 110 CD1 ILE A 7 -8.646 15.329 5.187 1.00 0.00 C ATOM 0 H ILE A 7 -9.450 11.802 5.347 1.00 0.00 H new ATOM 0 HA ILE A 7 -9.075 12.090 8.061 1.00 0.00 H new ATOM 0 HB ILE A 7 -10.738 13.851 6.245 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -7.742 14.143 6.715 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -8.396 13.217 5.378 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -9.950 15.772 7.644 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -10.927 14.602 8.562 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -9.156 14.616 8.739 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -7.706 15.445 4.647 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -9.467 15.254 4.474 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -8.803 16.194 5.832 1.00 0.00 H new ATOM 122 N ASN A 8 -12.319 11.729 7.391 1.00 0.00 N ATOM 123 CA ASN A 8 -13.604 11.300 8.015 1.00 0.00 C ATOM 124 C ASN A 8 -13.601 9.875 8.662 1.00 0.00 C ATOM 125 O ASN A 8 -14.381 9.656 9.591 1.00 0.00 O ATOM 126 CB ASN A 8 -14.792 11.447 7.021 1.00 0.00 C ATOM 127 CG ASN A 8 -15.082 12.870 6.496 1.00 0.00 C ATOM 128 OD1 ASN A 8 -15.691 13.693 7.176 1.00 0.00 O ATOM 129 ND2 ASN A 8 -14.666 13.182 5.277 1.00 0.00 N ATOM 0 H ASN A 8 -12.363 11.855 6.380 1.00 0.00 H new ATOM 0 HA ASN A 8 -13.734 11.987 8.852 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -14.602 10.800 6.165 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -15.692 11.074 7.509 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -14.851 14.110 4.897 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -14.161 12.494 4.719 1.00 0.00 H new ATOM 136 N ALA A 9 -12.748 8.929 8.208 1.00 0.00 N ATOM 137 CA ALA A 9 -12.527 7.632 8.913 1.00 0.00 C ATOM 138 C ALA A 9 -11.860 7.764 10.296 1.00 0.00 C ATOM 139 O ALA A 9 -12.262 7.109 11.254 1.00 0.00 O ATOM 140 CB ALA A 9 -11.536 6.735 8.125 1.00 0.00 C ATOM 0 H ALA A 9 -12.198 9.034 7.356 1.00 0.00 H new ATOM 0 HA ALA A 9 -13.533 7.222 9.003 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -11.392 5.796 8.659 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -11.940 6.530 7.134 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -10.579 7.248 8.028 1.00 0.00 H new ATOM 146 N VAL A 10 -10.810 8.589 10.355 1.00 0.00 N ATOM 147 CA VAL A 10 -9.947 8.800 11.527 1.00 0.00 C ATOM 148 C VAL A 10 -10.658 9.496 12.650 1.00 0.00 C ATOM 149 O VAL A 10 -10.680 9.020 13.788 1.00 0.00 O ATOM 150 CB VAL A 10 -8.583 9.454 11.179 1.00 0.00 C ATOM 151 CG1 VAL A 10 -7.492 8.973 12.117 1.00 0.00 C ATOM 152 CG2 VAL A 10 -8.158 9.177 9.744 1.00 0.00 C ATOM 0 H VAL A 10 -10.524 9.153 9.555 1.00 0.00 H new ATOM 0 HA VAL A 10 -9.702 7.803 11.893 1.00 0.00 H new ATOM 0 HB VAL A 10 -8.723 10.529 11.296 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -6.548 9.447 11.850 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -7.752 9.235 13.143 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -7.391 7.891 12.033 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -7.198 9.656 9.550 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -8.064 8.102 9.593 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -8.907 9.575 9.059 1.00 0.00 H new ATOM 162 N ALA A 11 -11.254 10.620 12.261 1.00 0.00 N ATOM 163 CA ALA A 11 -12.099 11.370 13.168 1.00 0.00 C ATOM 164 C ALA A 11 -13.411 10.667 13.622 1.00 0.00 C ATOM 165 O ALA A 11 -13.899 10.994 14.707 1.00 0.00 O ATOM 166 CB ALA A 11 -12.301 12.763 12.576 1.00 0.00 C ATOM 0 H ALA A 11 -11.165 11.024 11.329 1.00 0.00 H new ATOM 0 HA ALA A 11 -11.580 11.446 14.124 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -12.935 13.352 13.239 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -11.335 13.255 12.466 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -12.778 12.678 11.600 1.00 0.00 H new ATOM 172 N GLU A 12 -13.952 9.699 12.840 1.00 0.00 N ATOM 173 CA GLU A 12 -15.073 8.842 13.302 1.00 0.00 C ATOM 174 C GLU A 12 -14.573 7.724 14.271 1.00 0.00 C ATOM 175 O GLU A 12 -15.149 7.587 15.354 1.00 0.00 O ATOM 176 CB GLU A 12 -15.868 8.313 12.080 1.00 0.00 C ATOM 177 CG GLU A 12 -17.166 7.549 12.415 1.00 0.00 C ATOM 178 CD GLU A 12 -17.885 7.045 11.162 1.00 0.00 C ATOM 179 OE1 GLU A 12 -17.689 5.934 10.669 1.00 0.00 O ATOM 180 OE2 GLU A 12 -18.761 7.972 10.657 1.00 0.00 O ATOM 0 H GLU A 12 -13.633 9.493 11.893 1.00 0.00 H new ATOM 0 HA GLU A 12 -15.769 9.436 13.894 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -16.119 9.157 11.438 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -15.218 7.656 11.502 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -16.930 6.703 13.061 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -17.834 8.202 12.976 1.00 0.00 H new ATOM 188 N THR A 13 -13.522 6.951 13.911 1.00 0.00 N ATOM 189 CA THR A 13 -12.968 5.874 14.796 1.00 0.00 C ATOM 190 C THR A 13 -12.241 6.237 16.124 1.00 0.00 C ATOM 191 O THR A 13 -12.109 5.393 17.017 1.00 0.00 O ATOM 192 CB THR A 13 -12.032 4.916 14.002 1.00 0.00 C ATOM 193 OG1 THR A 13 -10.912 5.669 13.576 1.00 0.00 O ATOM 194 CG2 THR A 13 -12.592 4.183 12.776 1.00 0.00 C ATOM 0 H THR A 13 -13.035 7.045 13.019 1.00 0.00 H new ATOM 0 HA THR A 13 -13.904 5.424 15.127 1.00 0.00 H new ATOM 0 HB THR A 13 -11.823 4.114 14.709 1.00 0.00 H new ATOM 0 HG1 THR A 13 -11.166 6.230 12.813 1.00 0.00 H new ATOM 0 HG21 THR A 13 -11.813 3.558 12.339 1.00 0.00 H new ATOM 0 HG22 THR A 13 -13.432 3.558 13.078 1.00 0.00 H new ATOM 0 HG23 THR A 13 -12.929 4.912 12.039 1.00 0.00 H new ATOM 202 N SER A 14 -11.766 7.470 16.202 1.00 0.00 N ATOM 203 CA SER A 14 -10.951 7.979 17.340 1.00 0.00 C ATOM 204 C SER A 14 -11.514 9.224 18.082 1.00 0.00 C ATOM 205 O SER A 14 -11.184 9.390 19.261 1.00 0.00 O ATOM 206 CB SER A 14 -9.519 8.242 16.808 1.00 0.00 C ATOM 207 OG SER A 14 -8.605 8.504 17.866 1.00 0.00 O ATOM 0 H SER A 14 -11.927 8.169 15.477 1.00 0.00 H new ATOM 0 HA SER A 14 -10.969 7.209 18.112 1.00 0.00 H new ATOM 0 HB2 SER A 14 -9.178 7.378 16.238 1.00 0.00 H new ATOM 0 HB3 SER A 14 -9.535 9.089 16.123 1.00 0.00 H new ATOM 0 HG SER A 14 -8.734 9.420 18.190 1.00 0.00 H new ATOM 213 N GLY A 15 -12.311 10.104 17.437 1.00 0.00 N ATOM 214 CA GLY A 15 -12.776 11.368 18.065 1.00 0.00 C ATOM 215 C GLY A 15 -11.688 12.413 18.386 1.00 0.00 C ATOM 216 O GLY A 15 -11.587 12.915 19.508 1.00 0.00 O ATOM 0 H GLY A 15 -12.647 9.966 16.484 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -13.509 11.829 17.403 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -13.295 11.119 18.991 1.00 0.00 H new ATOM 220 N LEU A 16 -10.913 12.730 17.348 1.00 0.00 N ATOM 221 CA LEU A 16 -9.846 13.753 17.359 1.00 0.00 C ATOM 222 C LEU A 16 -10.517 15.065 16.834 1.00 0.00 C ATOM 223 O LEU A 16 -11.507 15.560 17.384 1.00 0.00 O ATOM 224 CB LEU A 16 -8.474 13.126 16.895 1.00 0.00 C ATOM 225 CG LEU A 16 -8.524 12.291 15.603 1.00 0.00 C ATOM 226 CD1 LEU A 16 -9.289 12.883 14.473 1.00 0.00 C ATOM 227 CD2 LEU A 16 -7.453 11.308 15.090 1.00 0.00 C ATOM 0 H LEU A 16 -11.007 12.271 16.442 1.00 0.00 H new ATOM 0 HA LEU A 16 -9.432 14.122 18.297 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -7.755 13.934 16.756 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -8.094 12.495 17.699 1.00 0.00 H new ATOM 0 HG LEU A 16 -9.042 11.555 16.218 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -9.255 12.208 13.618 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -10.325 13.035 14.775 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.848 13.841 14.197 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -7.781 10.872 14.146 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.514 11.840 14.937 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -7.305 10.515 15.824 1.00 0.00 H new ATOM 239 N SER A 17 -9.934 15.605 15.787 1.00 0.00 N ATOM 240 CA SER A 17 -10.470 16.734 14.986 1.00 0.00 C ATOM 241 C SER A 17 -10.357 16.397 13.473 1.00 0.00 C ATOM 242 O SER A 17 -9.543 15.582 13.050 1.00 0.00 O ATOM 243 CB SER A 17 -9.746 18.054 15.314 1.00 0.00 C ATOM 244 OG SER A 17 -9.835 18.385 16.696 1.00 0.00 O ATOM 0 H SER A 17 -9.035 15.271 15.439 1.00 0.00 H new ATOM 0 HA SER A 17 -11.520 16.874 15.243 1.00 0.00 H new ATOM 0 HB2 SER A 17 -8.697 17.972 15.028 1.00 0.00 H new ATOM 0 HB3 SER A 17 -10.177 18.860 14.720 1.00 0.00 H new ATOM 0 HG SER A 17 -9.362 19.227 16.862 1.00 0.00 H new ATOM 250 N LYS A 18 -11.158 17.046 12.615 1.00 0.00 N ATOM 251 CA LYS A 18 -10.978 16.962 11.126 1.00 0.00 C ATOM 252 C LYS A 18 -9.583 17.532 10.708 1.00 0.00 C ATOM 253 O LYS A 18 -8.868 16.874 9.958 1.00 0.00 O ATOM 254 CB LYS A 18 -12.155 17.600 10.340 1.00 0.00 C ATOM 255 CG LYS A 18 -13.546 16.946 10.533 1.00 0.00 C ATOM 256 CD LYS A 18 -13.669 15.492 10.018 1.00 0.00 C ATOM 257 CE LYS A 18 -15.046 14.836 10.243 1.00 0.00 C ATOM 258 NZ LYS A 18 -15.355 14.579 11.663 1.00 0.00 N ATOM 0 H LYS A 18 -11.937 17.636 12.907 1.00 0.00 H new ATOM 0 HA LYS A 18 -10.996 15.908 10.850 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -12.228 18.649 10.626 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -11.910 17.575 9.278 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -13.792 16.960 11.595 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -14.291 17.558 10.025 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -13.448 15.480 8.951 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -12.909 14.883 10.508 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -15.819 15.480 9.823 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -15.084 13.894 9.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -15.901 13.698 11.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -14.469 14.489 12.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -15.913 15.369 12.045 1.00 0.00 H new ATOM 271 N LYS A 19 -9.166 18.685 11.268 1.00 0.00 N ATOM 272 CA LYS A 19 -7.775 19.208 11.153 1.00 0.00 C ATOM 273 C LYS A 19 -6.705 18.245 11.773 1.00 0.00 C ATOM 274 O LYS A 19 -5.649 18.096 11.152 1.00 0.00 O ATOM 275 CB LYS A 19 -7.645 20.633 11.756 1.00 0.00 C ATOM 276 CG LYS A 19 -8.570 21.745 11.196 1.00 0.00 C ATOM 277 CD LYS A 19 -8.375 22.156 9.714 1.00 0.00 C ATOM 278 CE LYS A 19 -9.146 21.350 8.644 1.00 0.00 C ATOM 279 NZ LYS A 19 -10.610 21.509 8.733 1.00 0.00 N ATOM 0 H LYS A 19 -9.780 19.287 11.816 1.00 0.00 H new ATOM 0 HA LYS A 19 -7.568 19.267 10.084 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -7.822 20.560 12.829 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -6.613 20.959 11.625 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -9.603 21.419 11.322 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -8.439 22.634 11.812 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -8.658 23.204 9.615 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -7.312 22.090 9.484 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -8.813 21.663 7.654 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -8.896 20.294 8.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -11.065 20.971 7.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -10.943 21.153 9.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -10.856 22.515 8.642 1.00 0.00 H new ATOM 292 N ASP A 20 -6.946 17.581 12.940 1.00 0.00 N ATOM 293 CA ASP A 20 -5.997 16.547 13.472 1.00 0.00 C ATOM 294 C ASP A 20 -5.933 15.235 12.629 1.00 0.00 C ATOM 295 O ASP A 20 -4.862 14.633 12.569 1.00 0.00 O ATOM 296 CB ASP A 20 -6.261 16.210 14.966 1.00 0.00 C ATOM 297 CG ASP A 20 -5.605 17.192 15.947 1.00 0.00 C ATOM 298 OD1 ASP A 20 -4.413 17.146 16.252 1.00 0.00 O ATOM 299 OD2 ASP A 20 -6.495 18.112 16.437 1.00 0.00 O ATOM 0 H ASP A 20 -7.769 17.735 13.522 1.00 0.00 H new ATOM 0 HA ASP A 20 -5.019 17.021 13.386 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -7.337 16.199 15.142 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -5.894 15.205 15.173 1.00 0.00 H new ATOM 305 N ALA A 21 -7.038 14.794 12.000 1.00 0.00 N ATOM 306 CA ALA A 21 -7.070 13.634 11.076 1.00 0.00 C ATOM 307 C ALA A 21 -6.356 13.895 9.714 1.00 0.00 C ATOM 308 O ALA A 21 -5.691 12.988 9.214 1.00 0.00 O ATOM 309 CB ALA A 21 -8.529 13.167 10.944 1.00 0.00 C ATOM 0 H ALA A 21 -7.949 15.237 12.118 1.00 0.00 H new ATOM 0 HA ALA A 21 -6.479 12.822 11.499 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -8.578 12.313 10.268 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -8.908 12.876 11.924 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -9.137 13.980 10.546 1.00 0.00 H new ATOM 315 N THR A 22 -6.447 15.117 9.139 1.00 0.00 N ATOM 316 CA THR A 22 -5.671 15.556 7.944 1.00 0.00 C ATOM 317 C THR A 22 -4.127 15.483 8.164 1.00 0.00 C ATOM 318 O THR A 22 -3.393 14.897 7.360 1.00 0.00 O ATOM 319 CB THR A 22 -6.127 17.000 7.554 1.00 0.00 C ATOM 320 OG1 THR A 22 -7.528 17.207 7.670 1.00 0.00 O ATOM 321 CG2 THR A 22 -5.772 17.314 6.106 1.00 0.00 C ATOM 0 H THR A 22 -7.071 15.841 9.495 1.00 0.00 H new ATOM 0 HA THR A 22 -5.880 14.868 7.125 1.00 0.00 H new ATOM 0 HB THR A 22 -5.604 17.649 8.257 1.00 0.00 H new ATOM 0 HG1 THR A 22 -7.764 17.328 8.613 1.00 0.00 H new ATOM 0 HG21 THR A 22 -6.101 18.324 5.862 1.00 0.00 H new ATOM 0 HG22 THR A 22 -4.693 17.241 5.972 1.00 0.00 H new ATOM 0 HG23 THR A 22 -6.268 16.602 5.447 1.00 0.00 H new ATOM 329 N LYS A 23 -3.680 16.074 9.283 1.00 0.00 N ATOM 330 CA LYS A 23 -2.288 15.991 9.779 1.00 0.00 C ATOM 331 C LYS A 23 -1.797 14.546 10.015 1.00 0.00 C ATOM 332 O LYS A 23 -0.773 14.175 9.461 1.00 0.00 O ATOM 333 CB LYS A 23 -2.223 16.706 11.160 1.00 0.00 C ATOM 334 CG LYS A 23 -2.297 18.247 11.134 1.00 0.00 C ATOM 335 CD LYS A 23 -2.361 18.849 12.551 1.00 0.00 C ATOM 336 CE LYS A 23 -2.526 20.378 12.544 1.00 0.00 C ATOM 337 NZ LYS A 23 -2.597 20.913 13.915 1.00 0.00 N ATOM 0 H LYS A 23 -4.284 16.635 9.884 1.00 0.00 H new ATOM 0 HA LYS A 23 -1.658 16.447 9.015 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -3.041 16.334 11.777 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -1.295 16.416 11.653 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -1.426 18.642 10.612 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -3.176 18.558 10.569 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -3.194 18.401 13.093 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -1.451 18.589 13.092 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -1.689 20.834 12.016 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -3.431 20.646 11.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -2.708 21.946 13.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -3.411 20.494 14.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -1.722 20.677 14.426 1.00 0.00 H new ATOM 350 N ALA A 24 -2.538 13.788 10.834 1.00 0.00 N ATOM 351 CA ALA A 24 -2.268 12.384 11.200 1.00 0.00 C ATOM 352 C ALA A 24 -2.102 11.378 10.042 1.00 0.00 C ATOM 353 O ALA A 24 -1.264 10.487 10.113 1.00 0.00 O ATOM 354 CB ALA A 24 -3.362 11.992 12.178 1.00 0.00 C ATOM 0 H ALA A 24 -3.380 14.149 11.281 1.00 0.00 H new ATOM 0 HA ALA A 24 -1.274 12.332 11.643 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -3.218 10.957 12.489 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -3.320 12.643 13.051 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -4.334 12.094 11.696 1.00 0.00 H new ATOM 360 N VAL A 25 -2.872 11.554 8.967 1.00 0.00 N ATOM 361 CA VAL A 25 -2.652 10.893 7.654 1.00 0.00 C ATOM 362 C VAL A 25 -1.241 11.294 7.119 1.00 0.00 C ATOM 363 O VAL A 25 -0.403 10.407 6.958 1.00 0.00 O ATOM 364 CB VAL A 25 -3.859 11.424 6.798 1.00 0.00 C ATOM 365 CG1 VAL A 25 -3.580 11.475 5.281 1.00 0.00 C ATOM 366 CG2 VAL A 25 -5.122 10.610 7.098 1.00 0.00 C ATOM 0 H VAL A 25 -3.685 12.170 8.972 1.00 0.00 H new ATOM 0 HA VAL A 25 -2.639 9.803 7.658 1.00 0.00 H new ATOM 0 HB VAL A 25 -4.013 12.460 7.099 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -4.461 11.852 4.761 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -2.735 12.136 5.089 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -3.347 10.473 4.920 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -5.950 10.989 6.498 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -4.946 9.562 6.854 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -5.370 10.699 8.156 1.00 0.00 H new ATOM 376 N ASP A 26 -0.966 12.601 6.907 1.00 0.00 N ATOM 377 CA ASP A 26 0.418 13.080 6.564 1.00 0.00 C ATOM 378 C ASP A 26 1.430 13.151 7.782 1.00 0.00 C ATOM 379 O ASP A 26 2.281 14.033 7.926 1.00 0.00 O ATOM 380 CB ASP A 26 0.284 14.453 5.873 1.00 0.00 C ATOM 381 CG ASP A 26 -0.392 14.451 4.490 1.00 0.00 C ATOM 382 OD1 ASP A 26 0.190 14.135 3.453 1.00 0.00 O ATOM 383 OD2 ASP A 26 -1.710 14.828 4.555 1.00 0.00 O ATOM 0 H ASP A 26 -1.664 13.343 6.963 1.00 0.00 H new ATOM 0 HA ASP A 26 0.863 12.337 5.902 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -0.281 15.114 6.530 1.00 0.00 H new ATOM 0 HB3 ASP A 26 1.280 14.883 5.768 1.00 0.00 H new ATOM 389 N ALA A 27 1.239 12.180 8.665 1.00 0.00 N ATOM 390 CA ALA A 27 2.033 11.846 9.862 1.00 0.00 C ATOM 391 C ALA A 27 2.516 10.367 9.748 1.00 0.00 C ATOM 392 O ALA A 27 3.712 10.088 9.863 1.00 0.00 O ATOM 393 CB ALA A 27 1.238 12.198 11.117 1.00 0.00 C ATOM 0 H ALA A 27 0.452 11.540 8.560 1.00 0.00 H new ATOM 0 HA ALA A 27 2.943 12.442 9.938 1.00 0.00 H new ATOM 0 HB1 ALA A 27 1.826 11.951 12.001 1.00 0.00 H new ATOM 0 HB2 ALA A 27 1.012 13.264 11.118 1.00 0.00 H new ATOM 0 HB3 ALA A 27 0.308 11.630 11.129 1.00 0.00 H new ATOM 399 N VAL A 28 1.566 9.439 9.482 1.00 0.00 N ATOM 400 CA VAL A 28 1.823 8.022 9.083 1.00 0.00 C ATOM 401 C VAL A 28 2.587 8.008 7.726 1.00 0.00 C ATOM 402 O VAL A 28 3.731 7.565 7.645 1.00 0.00 O ATOM 403 CB VAL A 28 0.459 7.245 8.920 1.00 0.00 C ATOM 404 CG1 VAL A 28 0.581 5.756 8.565 1.00 0.00 C ATOM 405 CG2 VAL A 28 -0.384 7.261 10.168 1.00 0.00 C ATOM 0 H VAL A 28 0.571 9.655 9.539 1.00 0.00 H new ATOM 0 HA VAL A 28 2.418 7.534 9.855 1.00 0.00 H new ATOM 0 HB VAL A 28 0.007 7.795 8.095 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -0.414 5.320 8.477 1.00 0.00 H new ATOM 0 HG12 VAL A 28 1.109 5.650 7.617 1.00 0.00 H new ATOM 0 HG13 VAL A 28 1.135 5.239 9.348 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -1.308 6.710 9.990 1.00 0.00 H new ATOM 0 HG22 VAL A 28 0.166 6.793 10.985 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -0.621 8.291 10.434 1.00 0.00 H new ATOM 415 N PHE A 29 1.897 8.541 6.704 1.00 0.00 N ATOM 416 CA PHE A 29 2.379 8.640 5.295 1.00 0.00 C ATOM 417 C PHE A 29 3.608 9.568 5.102 1.00 0.00 C ATOM 418 O PHE A 29 4.369 9.323 4.167 1.00 0.00 O ATOM 419 CB PHE A 29 1.186 8.864 4.309 1.00 0.00 C ATOM 420 CG PHE A 29 0.046 7.830 4.461 1.00 0.00 C ATOM 421 CD1 PHE A 29 0.314 6.457 4.376 1.00 0.00 C ATOM 422 CD2 PHE A 29 -1.193 8.250 4.948 1.00 0.00 C ATOM 423 CE1 PHE A 29 -0.603 5.530 4.854 1.00 0.00 C ATOM 424 CE2 PHE A 29 -2.100 7.328 5.454 1.00 0.00 C ATOM 425 CZ PHE A 29 -1.791 5.972 5.422 1.00 0.00 C ATOM 0 H PHE A 29 0.962 8.929 6.827 1.00 0.00 H new ATOM 0 HA PHE A 29 2.801 7.672 5.024 1.00 0.00 H new ATOM 0 HB2 PHE A 29 0.780 9.863 4.466 1.00 0.00 H new ATOM 0 HB3 PHE A 29 1.561 8.829 3.286 1.00 0.00 H new ATOM 0 HD1 PHE A 29 1.240 6.118 3.936 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -1.448 9.299 4.931 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -0.394 4.473 4.785 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -3.039 7.662 5.870 1.00 0.00 H new ATOM 0 HZ PHE A 29 -2.481 5.256 5.843 1.00 0.00 H new ATOM 435 N ASP A 30 3.855 10.564 5.984 1.00 0.00 N ATOM 436 CA ASP A 30 5.143 11.313 6.006 1.00 0.00 C ATOM 437 C ASP A 30 6.338 10.412 6.443 1.00 0.00 C ATOM 438 O ASP A 30 7.373 10.421 5.783 1.00 0.00 O ATOM 439 CB ASP A 30 5.002 12.535 6.941 1.00 0.00 C ATOM 440 CG ASP A 30 6.096 13.604 6.812 1.00 0.00 C ATOM 441 OD1 ASP A 30 6.859 13.902 7.729 1.00 0.00 O ATOM 442 OD2 ASP A 30 6.111 14.192 5.572 1.00 0.00 O ATOM 0 H ASP A 30 3.185 10.870 6.689 1.00 0.00 H new ATOM 0 HA ASP A 30 5.363 11.650 4.993 1.00 0.00 H new ATOM 0 HB2 ASP A 30 4.037 13.005 6.751 1.00 0.00 H new ATOM 0 HB3 ASP A 30 4.986 12.180 7.972 1.00 0.00 H new ATOM 448 N SER A 31 6.171 9.651 7.541 1.00 0.00 N ATOM 449 CA SER A 31 7.187 8.672 8.029 1.00 0.00 C ATOM 450 C SER A 31 7.408 7.425 7.132 1.00 0.00 C ATOM 451 O SER A 31 8.523 6.898 7.153 1.00 0.00 O ATOM 452 CB SER A 31 6.890 8.187 9.442 1.00 0.00 C ATOM 453 OG SER A 31 6.835 9.276 10.352 1.00 0.00 O ATOM 0 H SER A 31 5.333 9.690 8.121 1.00 0.00 H new ATOM 0 HA SER A 31 8.106 9.257 8.000 1.00 0.00 H new ATOM 0 HB2 SER A 31 5.942 7.650 9.454 1.00 0.00 H new ATOM 0 HB3 SER A 31 7.660 7.483 9.758 1.00 0.00 H new ATOM 0 HG SER A 31 7.266 9.020 11.194 1.00 0.00 H new ATOM 459 N ILE A 32 6.395 6.925 6.370 1.00 0.00 N ATOM 460 CA ILE A 32 6.632 5.981 5.262 1.00 0.00 C ATOM 461 C ILE A 32 7.583 6.717 4.241 1.00 0.00 C ATOM 462 O ILE A 32 8.549 6.093 3.814 1.00 0.00 O ATOM 463 CB ILE A 32 5.349 5.517 4.474 1.00 0.00 C ATOM 464 CG1 ILE A 32 4.212 4.603 5.010 1.00 0.00 C ATOM 465 CG2 ILE A 32 5.900 4.676 3.280 1.00 0.00 C ATOM 466 CD1 ILE A 32 3.238 4.889 6.159 1.00 0.00 C ATOM 0 H ILE A 32 5.413 7.165 6.509 1.00 0.00 H new ATOM 0 HA ILE A 32 7.047 5.075 5.704 1.00 0.00 H new ATOM 0 HB ILE A 32 4.845 6.479 4.381 1.00 0.00 H new ATOM 0 HG12 ILE A 32 3.581 4.397 4.146 1.00 0.00 H new ATOM 0 HG13 ILE A 32 4.701 3.667 5.278 1.00 0.00 H new ATOM 0 HG21 ILE A 32 5.068 4.312 2.677 1.00 0.00 H new ATOM 0 HG22 ILE A 32 6.549 5.299 2.665 1.00 0.00 H new ATOM 0 HG23 ILE A 32 6.468 3.828 3.663 1.00 0.00 H new ATOM 0 HD11 ILE A 32 2.562 4.043 6.282 1.00 0.00 H new ATOM 0 HD12 ILE A 32 3.798 5.043 7.081 1.00 0.00 H new ATOM 0 HD13 ILE A 32 2.660 5.785 5.932 1.00 0.00 H new ATOM 478 N THR A 33 7.269 7.943 3.772 1.00 0.00 N ATOM 479 CA THR A 33 8.175 8.666 2.835 1.00 0.00 C ATOM 480 C THR A 33 9.574 9.010 3.402 1.00 0.00 C ATOM 481 O THR A 33 10.474 9.234 2.609 1.00 0.00 O ATOM 482 CB THR A 33 7.540 9.868 2.105 1.00 0.00 C ATOM 483 OG1 THR A 33 7.284 10.964 2.977 1.00 0.00 O ATOM 484 CG2 THR A 33 6.255 9.465 1.392 1.00 0.00 C ATOM 0 H THR A 33 6.417 8.449 4.015 1.00 0.00 H new ATOM 0 HA THR A 33 8.345 7.909 2.070 1.00 0.00 H new ATOM 0 HB THR A 33 8.272 10.195 1.366 1.00 0.00 H new ATOM 0 HG1 THR A 33 7.339 10.662 3.908 1.00 0.00 H new ATOM 0 HG21 THR A 33 5.831 10.333 0.887 1.00 0.00 H new ATOM 0 HG22 THR A 33 6.474 8.689 0.658 1.00 0.00 H new ATOM 0 HG23 THR A 33 5.539 9.084 2.120 1.00 0.00 H new ATOM 492 N GLU A 34 9.772 9.044 4.726 1.00 0.00 N ATOM 493 CA GLU A 34 11.131 9.042 5.319 1.00 0.00 C ATOM 494 C GLU A 34 11.721 7.605 5.394 1.00 0.00 C ATOM 495 O GLU A 34 12.947 7.498 5.446 1.00 0.00 O ATOM 496 CB GLU A 34 11.168 9.761 6.695 1.00 0.00 C ATOM 497 CG GLU A 34 11.271 11.302 6.654 1.00 0.00 C ATOM 498 CD GLU A 34 9.953 12.028 6.380 1.00 0.00 C ATOM 499 OE1 GLU A 34 9.626 12.454 5.273 1.00 0.00 O ATOM 500 OE2 GLU A 34 9.183 12.138 7.510 1.00 0.00 O ATOM 0 H GLU A 34 9.017 9.073 5.411 1.00 0.00 H new ATOM 0 HA GLU A 34 11.773 9.617 4.651 1.00 0.00 H new ATOM 0 HB2 GLU A 34 10.267 9.492 7.247 1.00 0.00 H new ATOM 0 HB3 GLU A 34 12.016 9.375 7.261 1.00 0.00 H new ATOM 0 HG2 GLU A 34 11.670 11.650 7.607 1.00 0.00 H new ATOM 0 HG3 GLU A 34 11.991 11.583 5.885 1.00 0.00 H new ATOM 508 N ALA A 35 10.919 6.512 5.385 1.00 0.00 N ATOM 509 CA ALA A 35 11.447 5.155 5.170 1.00 0.00 C ATOM 510 C ALA A 35 11.869 4.972 3.699 1.00 0.00 C ATOM 511 O ALA A 35 13.068 4.939 3.428 1.00 0.00 O ATOM 512 CB ALA A 35 10.419 4.082 5.599 1.00 0.00 C ATOM 0 H ALA A 35 9.909 6.550 5.524 1.00 0.00 H new ATOM 0 HA ALA A 35 12.330 5.026 5.796 1.00 0.00 H new ATOM 0 HB1 ALA A 35 10.836 3.090 5.429 1.00 0.00 H new ATOM 0 HB2 ALA A 35 10.188 4.202 6.658 1.00 0.00 H new ATOM 0 HB3 ALA A 35 9.507 4.197 5.013 1.00 0.00 H new ATOM 518 N LEU A 36 10.929 4.929 2.743 1.00 0.00 N ATOM 519 CA LEU A 36 11.236 4.656 1.327 1.00 0.00 C ATOM 520 C LEU A 36 12.127 5.693 0.668 1.00 0.00 C ATOM 521 O LEU A 36 13.081 5.282 0.000 1.00 0.00 O ATOM 522 CB LEU A 36 9.914 4.465 0.590 1.00 0.00 C ATOM 523 CG LEU A 36 9.134 3.143 1.000 1.00 0.00 C ATOM 524 CD1 LEU A 36 9.753 2.164 2.044 1.00 0.00 C ATOM 525 CD2 LEU A 36 7.641 2.877 1.135 1.00 0.00 C ATOM 0 H LEU A 36 9.937 5.082 2.927 1.00 0.00 H new ATOM 0 HA LEU A 36 11.833 3.746 1.274 1.00 0.00 H new ATOM 0 HB2 LEU A 36 9.275 5.327 0.782 1.00 0.00 H new ATOM 0 HB3 LEU A 36 10.107 4.444 -0.483 1.00 0.00 H new ATOM 0 HG LEU A 36 9.332 3.080 -0.070 1.00 0.00 H new ATOM 0 HD11 LEU A 36 9.079 1.321 2.196 1.00 0.00 H new ATOM 0 HD12 LEU A 36 10.713 1.800 1.677 1.00 0.00 H new ATOM 0 HD13 LEU A 36 9.901 2.686 2.989 1.00 0.00 H new ATOM 0 HD21 LEU A 36 7.482 1.842 1.438 1.00 0.00 H new ATOM 0 HD22 LEU A 36 7.219 3.544 1.886 1.00 0.00 H new ATOM 0 HD23 LEU A 36 7.152 3.054 0.177 1.00 0.00 H new ATOM 537 N ARG A 37 11.886 7.007 0.876 1.00 0.00 N ATOM 538 CA ARG A 37 12.798 7.997 0.297 1.00 0.00 C ATOM 539 C ARG A 37 14.233 7.963 0.914 1.00 0.00 C ATOM 540 O ARG A 37 15.159 8.340 0.189 1.00 0.00 O ATOM 541 CB ARG A 37 12.218 9.412 0.391 1.00 0.00 C ATOM 542 CG ARG A 37 12.794 10.463 -0.563 1.00 0.00 C ATOM 543 CD ARG A 37 12.126 11.805 -0.245 1.00 0.00 C ATOM 544 NE ARG A 37 12.501 12.841 -1.239 1.00 0.00 N ATOM 545 CZ ARG A 37 11.658 13.743 -1.778 1.00 0.00 C ATOM 546 NH1 ARG A 37 10.366 13.839 -1.470 1.00 0.00 N ATOM 547 NH2 ARG A 37 12.143 14.585 -2.671 1.00 0.00 N ATOM 0 H ARG A 37 11.106 7.386 1.414 1.00 0.00 H new ATOM 0 HA ARG A 37 12.900 7.718 -0.752 1.00 0.00 H new ATOM 0 HB2 ARG A 37 11.144 9.350 0.218 1.00 0.00 H new ATOM 0 HB3 ARG A 37 12.357 9.768 1.412 1.00 0.00 H new ATOM 0 HG2 ARG A 37 13.875 10.537 -0.442 1.00 0.00 H new ATOM 0 HG3 ARG A 37 12.608 10.180 -1.599 1.00 0.00 H new ATOM 0 HD2 ARG A 37 11.043 11.682 -0.236 1.00 0.00 H new ATOM 0 HD3 ARG A 37 12.418 12.132 0.753 1.00 0.00 H new ATOM 0 HE ARG A 37 13.476 12.873 -1.538 1.00 0.00 H new ATOM 0 HH11 ARG A 37 9.956 13.204 -0.785 1.00 0.00 H new ATOM 0 HH12 ARG A 37 9.786 14.548 -1.919 1.00 0.00 H new ATOM 0 HH21 ARG A 37 13.128 14.540 -2.933 1.00 0.00 H new ATOM 0 HH22 ARG A 37 11.533 15.281 -3.100 1.00 0.00 H new ATOM 560 N LYS A 38 14.436 7.541 2.201 1.00 0.00 N ATOM 561 CA LYS A 38 15.802 7.546 2.795 1.00 0.00 C ATOM 562 C LYS A 38 16.558 6.162 2.737 1.00 0.00 C ATOM 563 O LYS A 38 17.585 6.009 3.405 1.00 0.00 O ATOM 564 CB LYS A 38 15.672 8.077 4.252 1.00 0.00 C ATOM 565 CG LYS A 38 16.939 8.718 4.867 1.00 0.00 C ATOM 566 CD LYS A 38 16.749 9.236 6.309 1.00 0.00 C ATOM 567 CE LYS A 38 16.586 8.128 7.370 1.00 0.00 C ATOM 568 NZ LYS A 38 16.444 8.693 8.723 1.00 0.00 N ATOM 0 H LYS A 38 13.699 7.206 2.822 1.00 0.00 H new ATOM 0 HA LYS A 38 16.432 8.198 2.190 1.00 0.00 H new ATOM 0 HB2 LYS A 38 14.870 8.815 4.276 1.00 0.00 H new ATOM 0 HB3 LYS A 38 15.363 7.249 4.891 1.00 0.00 H new ATOM 0 HG2 LYS A 38 17.744 7.984 4.860 1.00 0.00 H new ATOM 0 HG3 LYS A 38 17.257 9.546 4.234 1.00 0.00 H new ATOM 0 HD2 LYS A 38 17.607 9.854 6.576 1.00 0.00 H new ATOM 0 HD3 LYS A 38 15.871 9.881 6.337 1.00 0.00 H new ATOM 0 HE2 LYS A 38 15.711 7.522 7.134 1.00 0.00 H new ATOM 0 HE3 LYS A 38 17.450 7.464 7.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 16.336 7.921 9.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 17.290 9.251 8.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 15.605 9.307 8.757 1.00 0.00 H new ATOM 581 N GLY A 39 16.095 5.158 1.955 1.00 0.00 N ATOM 582 CA GLY A 39 16.660 3.779 1.984 1.00 0.00 C ATOM 583 C GLY A 39 16.374 3.005 3.305 1.00 0.00 C ATOM 584 O GLY A 39 17.286 2.429 3.902 1.00 0.00 O ATOM 0 H GLY A 39 15.328 5.274 1.292 1.00 0.00 H new ATOM 0 HA2 GLY A 39 16.252 3.212 1.147 1.00 0.00 H new ATOM 0 HA3 GLY A 39 17.738 3.836 1.834 1.00 0.00 H new ATOM 588 N ASP A 40 15.098 3.017 3.730 1.00 0.00 N ATOM 589 CA ASP A 40 14.631 2.471 5.034 1.00 0.00 C ATOM 590 C ASP A 40 13.275 1.723 4.910 1.00 0.00 C ATOM 591 O ASP A 40 12.499 1.902 3.965 1.00 0.00 O ATOM 592 CB ASP A 40 14.680 3.585 6.125 1.00 0.00 C ATOM 593 CG ASP A 40 16.063 3.814 6.751 1.00 0.00 C ATOM 594 OD1 ASP A 40 16.843 4.686 6.368 1.00 0.00 O ATOM 595 OD2 ASP A 40 16.321 2.938 7.773 1.00 0.00 O ATOM 0 H ASP A 40 14.341 3.412 3.172 1.00 0.00 H new ATOM 0 HA ASP A 40 15.317 1.692 5.367 1.00 0.00 H new ATOM 0 HB2 ASP A 40 14.337 4.521 5.684 1.00 0.00 H new ATOM 0 HB3 ASP A 40 13.976 3.329 6.917 1.00 0.00 H new ATOM 601 N LYS A 41 13.037 0.835 5.896 1.00 0.00 N ATOM 602 CA LYS A 41 11.816 -0.004 5.978 1.00 0.00 C ATOM 603 C LYS A 41 10.845 0.590 7.033 1.00 0.00 C ATOM 604 O LYS A 41 11.246 1.138 8.068 1.00 0.00 O ATOM 605 CB LYS A 41 12.128 -1.472 6.394 1.00 0.00 C ATOM 606 CG LYS A 41 13.186 -2.224 5.556 1.00 0.00 C ATOM 607 CD LYS A 41 13.244 -3.725 5.900 1.00 0.00 C ATOM 608 CE LYS A 41 14.349 -4.464 5.127 1.00 0.00 C ATOM 609 NZ LYS A 41 14.339 -5.909 5.420 1.00 0.00 N ATOM 0 H LYS A 41 13.688 0.676 6.665 1.00 0.00 H new ATOM 0 HA LYS A 41 11.372 -0.010 4.983 1.00 0.00 H new ATOM 0 HB2 LYS A 41 12.458 -1.468 7.433 1.00 0.00 H new ATOM 0 HB3 LYS A 41 11.199 -2.040 6.357 1.00 0.00 H new ATOM 0 HG2 LYS A 41 12.959 -2.105 4.497 1.00 0.00 H new ATOM 0 HG3 LYS A 41 14.165 -1.776 5.725 1.00 0.00 H new ATOM 0 HD2 LYS A 41 13.413 -3.843 6.970 1.00 0.00 H new ATOM 0 HD3 LYS A 41 12.280 -4.183 5.677 1.00 0.00 H new ATOM 0 HE2 LYS A 41 14.213 -4.308 4.057 1.00 0.00 H new ATOM 0 HE3 LYS A 41 15.321 -4.045 5.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 15.096 -6.377 4.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 14.493 -6.058 6.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 13.420 -6.312 5.147 1.00 0.00 H new ATOM 622 N VAL A 42 9.545 0.379 6.791 1.00 0.00 N ATOM 623 CA VAL A 42 8.451 0.814 7.666 1.00 0.00 C ATOM 624 C VAL A 42 8.208 -0.381 8.657 1.00 0.00 C ATOM 625 O VAL A 42 9.151 -1.059 9.082 1.00 0.00 O ATOM 626 CB VAL A 42 7.338 1.184 6.618 1.00 0.00 C ATOM 627 CG1 VAL A 42 6.173 1.948 7.215 1.00 0.00 C ATOM 628 CG2 VAL A 42 7.744 2.173 5.498 1.00 0.00 C ATOM 0 H VAL A 42 9.217 -0.112 5.959 1.00 0.00 H new ATOM 0 HA VAL A 42 8.573 1.673 8.326 1.00 0.00 H new ATOM 0 HB VAL A 42 7.116 0.183 6.247 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.445 2.169 6.435 1.00 0.00 H new ATOM 0 HG12 VAL A 42 5.702 1.345 7.991 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.534 2.880 7.649 1.00 0.00 H new ATOM 0 HG21 VAL A 42 6.892 2.348 4.841 1.00 0.00 H new ATOM 0 HG22 VAL A 42 8.059 3.117 5.943 1.00 0.00 H new ATOM 0 HG23 VAL A 42 8.567 1.751 4.921 1.00 0.00 H new ATOM 638 N GLN A 43 6.967 -0.521 9.122 1.00 0.00 N ATOM 639 CA GLN A 43 6.413 -1.711 9.815 1.00 0.00 C ATOM 640 C GLN A 43 5.023 -1.451 10.464 1.00 0.00 C ATOM 641 O GLN A 43 4.779 -0.392 11.046 1.00 0.00 O ATOM 642 CB GLN A 43 7.311 -2.861 10.367 1.00 0.00 C ATOM 643 CG GLN A 43 7.860 -3.783 9.259 1.00 0.00 C ATOM 644 CD GLN A 43 8.878 -4.822 9.749 1.00 0.00 C ATOM 645 OE1 GLN A 43 8.532 -5.777 10.443 1.00 0.00 O ATOM 646 NE2 GLN A 43 10.146 -4.668 9.395 1.00 0.00 N ATOM 0 H GLN A 43 6.276 0.223 9.027 1.00 0.00 H new ATOM 0 HA GLN A 43 6.256 -2.365 8.957 1.00 0.00 H new ATOM 0 HB2 GLN A 43 8.146 -2.429 10.919 1.00 0.00 H new ATOM 0 HB3 GLN A 43 6.735 -3.457 11.075 1.00 0.00 H new ATOM 0 HG2 GLN A 43 7.025 -4.303 8.789 1.00 0.00 H new ATOM 0 HG3 GLN A 43 8.327 -3.168 8.490 1.00 0.00 H new ATOM 0 HE21 GLN A 43 10.422 -3.872 8.819 1.00 0.00 H new ATOM 0 HE22 GLN A 43 10.846 -5.345 9.698 1.00 0.00 H new ATOM 655 N LEU A 44 4.117 -2.440 10.324 1.00 0.00 N ATOM 656 CA LEU A 44 2.722 -2.405 10.827 1.00 0.00 C ATOM 657 C LEU A 44 2.379 -3.873 11.210 1.00 0.00 C ATOM 658 O LEU A 44 2.307 -4.744 10.334 1.00 0.00 O ATOM 659 CB LEU A 44 1.720 -1.915 9.735 1.00 0.00 C ATOM 660 CG LEU A 44 1.785 -0.417 9.338 1.00 0.00 C ATOM 661 CD1 LEU A 44 1.099 -0.176 7.979 1.00 0.00 C ATOM 662 CD2 LEU A 44 1.163 0.487 10.419 1.00 0.00 C ATOM 0 H LEU A 44 4.339 -3.312 9.844 1.00 0.00 H new ATOM 0 HA LEU A 44 2.639 -1.714 11.666 1.00 0.00 H new ATOM 0 HB2 LEU A 44 1.881 -2.510 8.836 1.00 0.00 H new ATOM 0 HB3 LEU A 44 0.709 -2.129 10.082 1.00 0.00 H new ATOM 0 HG LEU A 44 2.839 -0.154 9.248 1.00 0.00 H new ATOM 0 HD11 LEU A 44 1.159 0.882 7.724 1.00 0.00 H new ATOM 0 HD12 LEU A 44 1.600 -0.764 7.209 1.00 0.00 H new ATOM 0 HD13 LEU A 44 0.053 -0.476 8.041 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.228 1.528 10.104 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.117 0.216 10.563 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.703 0.357 11.357 1.00 0.00 H new ATOM 674 N ILE A 45 2.150 -4.171 12.505 1.00 0.00 N ATOM 675 CA ILE A 45 1.791 -5.547 12.959 1.00 0.00 C ATOM 676 C ILE A 45 0.290 -5.826 12.621 1.00 0.00 C ATOM 677 O ILE A 45 -0.588 -4.967 12.769 1.00 0.00 O ATOM 678 CB ILE A 45 2.242 -5.820 14.431 1.00 0.00 C ATOM 679 CG1 ILE A 45 2.330 -7.342 14.752 1.00 0.00 C ATOM 680 CG2 ILE A 45 1.369 -5.074 15.455 1.00 0.00 C ATOM 681 CD1 ILE A 45 3.108 -7.706 16.027 1.00 0.00 C ATOM 0 H ILE A 45 2.205 -3.486 13.259 1.00 0.00 H new ATOM 0 HA ILE A 45 2.358 -6.295 12.405 1.00 0.00 H new ATOM 0 HB ILE A 45 3.252 -5.419 14.519 1.00 0.00 H new ATOM 0 HG12 ILE A 45 1.318 -7.736 14.840 1.00 0.00 H new ATOM 0 HG13 ILE A 45 2.796 -7.847 13.906 1.00 0.00 H new ATOM 0 HG21 ILE A 45 1.721 -5.295 16.463 1.00 0.00 H new ATOM 0 HG22 ILE A 45 1.434 -4.001 15.275 1.00 0.00 H new ATOM 0 HG23 ILE A 45 0.333 -5.397 15.354 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.108 -8.788 16.157 1.00 0.00 H new ATOM 0 HD12 ILE A 45 4.135 -7.351 15.941 1.00 0.00 H new ATOM 0 HD13 ILE A 45 2.633 -7.237 16.889 1.00 0.00 H new ATOM 693 N GLY A 46 0.044 -7.045 12.133 1.00 0.00 N ATOM 694 CA GLY A 46 -1.293 -7.458 11.636 1.00 0.00 C ATOM 695 C GLY A 46 -1.819 -6.837 10.302 1.00 0.00 C ATOM 696 O GLY A 46 -2.998 -7.030 9.993 1.00 0.00 O ATOM 0 H GLY A 46 0.752 -7.776 12.067 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -1.281 -8.541 11.515 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -2.020 -7.232 12.416 1.00 0.00 H new ATOM 700 N PHE A 47 -0.976 -6.126 9.516 1.00 0.00 N ATOM 701 CA PHE A 47 -1.397 -5.386 8.307 1.00 0.00 C ATOM 702 C PHE A 47 -0.290 -5.180 7.229 1.00 0.00 C ATOM 703 O PHE A 47 -0.649 -5.246 6.049 1.00 0.00 O ATOM 704 CB PHE A 47 -1.921 -3.990 8.759 1.00 0.00 C ATOM 705 CG PHE A 47 -2.791 -3.306 7.686 1.00 0.00 C ATOM 706 CD1 PHE A 47 -4.146 -3.634 7.568 1.00 0.00 C ATOM 707 CD2 PHE A 47 -2.194 -2.497 6.711 1.00 0.00 C ATOM 708 CE1 PHE A 47 -4.873 -3.198 6.464 1.00 0.00 C ATOM 709 CE2 PHE A 47 -2.922 -2.093 5.595 1.00 0.00 C ATOM 710 CZ PHE A 47 -4.253 -2.465 5.463 1.00 0.00 C ATOM 0 H PHE A 47 0.023 -6.051 9.707 1.00 0.00 H new ATOM 0 HA PHE A 47 -2.160 -5.997 7.825 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -2.502 -4.103 9.674 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -1.073 -3.348 8.997 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -4.628 -4.225 8.333 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -1.166 -2.186 6.825 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -5.925 -3.432 6.387 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -2.451 -1.490 4.832 1.00 0.00 H new ATOM 0 HZ PHE A 47 -4.807 -2.183 4.579 1.00 0.00 H new ATOM 720 N GLY A 48 0.978 -4.849 7.571 1.00 0.00 N ATOM 721 CA GLY A 48 1.990 -4.542 6.542 1.00 0.00 C ATOM 722 C GLY A 48 3.478 -4.430 6.911 1.00 0.00 C ATOM 723 O GLY A 48 3.886 -4.370 8.070 1.00 0.00 O ATOM 0 H GLY A 48 1.316 -4.789 8.532 1.00 0.00 H new ATOM 0 HA2 GLY A 48 1.908 -5.310 5.773 1.00 0.00 H new ATOM 0 HA3 GLY A 48 1.702 -3.597 6.081 1.00 0.00 H new ATOM 727 N ASN A 49 4.280 -4.404 5.835 1.00 0.00 N ATOM 728 CA ASN A 49 5.750 -4.218 5.897 1.00 0.00 C ATOM 729 C ASN A 49 6.135 -3.595 4.528 1.00 0.00 C ATOM 730 O ASN A 49 6.296 -4.310 3.534 1.00 0.00 O ATOM 731 CB ASN A 49 6.506 -5.547 6.210 1.00 0.00 C ATOM 732 CG ASN A 49 8.055 -5.504 6.204 1.00 0.00 C ATOM 733 OD1 ASN A 49 8.699 -4.460 6.080 1.00 0.00 O ATOM 734 ND2 ASN A 49 8.687 -6.659 6.338 1.00 0.00 N ATOM 0 H ASN A 49 3.928 -4.512 4.884 1.00 0.00 H new ATOM 0 HA ASN A 49 6.044 -3.564 6.718 1.00 0.00 H new ATOM 0 HB2 ASN A 49 6.182 -5.896 7.191 1.00 0.00 H new ATOM 0 HB3 ASN A 49 6.187 -6.295 5.484 1.00 0.00 H new ATOM 0 HD21 ASN A 49 9.707 -6.685 6.339 1.00 0.00 H new ATOM 0 HD22 ASN A 49 8.154 -7.523 6.441 1.00 0.00 H new ATOM 741 N PHE A 50 6.295 -2.262 4.480 1.00 0.00 N ATOM 742 CA PHE A 50 6.735 -1.568 3.241 1.00 0.00 C ATOM 743 C PHE A 50 8.276 -1.542 3.178 1.00 0.00 C ATOM 744 O PHE A 50 8.955 -1.370 4.201 1.00 0.00 O ATOM 745 CB PHE A 50 6.362 -0.064 3.159 1.00 0.00 C ATOM 746 CG PHE A 50 4.934 0.430 3.181 1.00 0.00 C ATOM 747 CD1 PHE A 50 4.258 0.402 4.402 1.00 0.00 C ATOM 748 CD2 PHE A 50 4.443 1.217 2.130 1.00 0.00 C ATOM 749 CE1 PHE A 50 3.064 1.088 4.556 1.00 0.00 C ATOM 750 CE2 PHE A 50 3.239 1.901 2.284 1.00 0.00 C ATOM 751 CZ PHE A 50 2.555 1.817 3.493 1.00 0.00 C ATOM 0 H PHE A 50 6.130 -1.641 5.273 1.00 0.00 H new ATOM 0 HA PHE A 50 6.238 -2.125 2.447 1.00 0.00 H new ATOM 0 HB2 PHE A 50 6.873 0.427 3.987 1.00 0.00 H new ATOM 0 HB3 PHE A 50 6.807 0.316 2.239 1.00 0.00 H new ATOM 0 HD1 PHE A 50 4.668 -0.157 5.230 1.00 0.00 H new ATOM 0 HD2 PHE A 50 4.995 1.293 1.205 1.00 0.00 H new ATOM 0 HE1 PHE A 50 2.534 1.055 5.497 1.00 0.00 H new ATOM 0 HE2 PHE A 50 2.840 2.491 1.472 1.00 0.00 H new ATOM 0 HZ PHE A 50 1.611 2.329 3.605 1.00 0.00 H new ATOM 761 N GLU A 51 8.803 -1.621 1.945 1.00 0.00 N ATOM 762 CA GLU A 51 10.250 -1.415 1.716 1.00 0.00 C ATOM 763 C GLU A 51 10.589 -1.108 0.245 1.00 0.00 C ATOM 764 O GLU A 51 9.869 -1.476 -0.687 1.00 0.00 O ATOM 765 CB GLU A 51 11.138 -2.557 2.311 1.00 0.00 C ATOM 766 CG GLU A 51 10.921 -3.967 1.711 1.00 0.00 C ATOM 767 CD GLU A 51 11.737 -5.047 2.423 1.00 0.00 C ATOM 768 OE1 GLU A 51 11.344 -5.640 3.427 1.00 0.00 O ATOM 769 OE2 GLU A 51 12.946 -5.271 1.814 1.00 0.00 O ATOM 0 H GLU A 51 8.264 -1.822 1.103 1.00 0.00 H new ATOM 0 HA GLU A 51 10.505 -0.517 2.279 1.00 0.00 H new ATOM 0 HB2 GLU A 51 12.185 -2.284 2.177 1.00 0.00 H new ATOM 0 HB3 GLU A 51 10.957 -2.609 3.385 1.00 0.00 H new ATOM 0 HG2 GLU A 51 9.863 -4.222 1.767 1.00 0.00 H new ATOM 0 HG3 GLU A 51 11.190 -3.953 0.655 1.00 0.00 H new ATOM 777 N VAL A 52 11.736 -0.438 0.045 1.00 0.00 N ATOM 778 CA VAL A 52 12.190 0.026 -1.266 1.00 0.00 C ATOM 779 C VAL A 52 13.055 -1.077 -1.973 1.00 0.00 C ATOM 780 O VAL A 52 13.638 -1.956 -1.325 1.00 0.00 O ATOM 781 CB VAL A 52 12.822 1.423 -0.902 1.00 0.00 C ATOM 782 CG1 VAL A 52 14.347 1.419 -0.945 1.00 0.00 C ATOM 783 CG2 VAL A 52 12.180 2.548 -1.722 1.00 0.00 C ATOM 0 H VAL A 52 12.378 -0.203 0.802 1.00 0.00 H new ATOM 0 HA VAL A 52 11.448 0.180 -2.049 1.00 0.00 H new ATOM 0 HB VAL A 52 12.586 1.627 0.142 1.00 0.00 H new ATOM 0 HG11 VAL A 52 14.721 2.409 -0.685 1.00 0.00 H new ATOM 0 HG12 VAL A 52 14.729 0.688 -0.232 1.00 0.00 H new ATOM 0 HG13 VAL A 52 14.682 1.157 -1.949 1.00 0.00 H new ATOM 0 HG21 VAL A 52 12.635 3.501 -1.451 1.00 0.00 H new ATOM 0 HG22 VAL A 52 12.338 2.360 -2.784 1.00 0.00 H new ATOM 0 HG23 VAL A 52 11.110 2.584 -1.515 1.00 0.00 H new ATOM 793 N ARG A 53 13.149 -0.987 -3.309 1.00 0.00 N ATOM 794 CA ARG A 53 13.920 -1.953 -4.135 1.00 0.00 C ATOM 795 C ARG A 53 14.902 -1.149 -5.033 1.00 0.00 C ATOM 796 O ARG A 53 14.545 -0.717 -6.134 1.00 0.00 O ATOM 797 CB ARG A 53 12.929 -2.836 -4.945 1.00 0.00 C ATOM 798 CG ARG A 53 13.600 -4.026 -5.676 1.00 0.00 C ATOM 799 CD ARG A 53 12.872 -4.536 -6.940 1.00 0.00 C ATOM 800 NE ARG A 53 12.814 -3.555 -8.058 1.00 0.00 N ATOM 801 CZ ARG A 53 13.835 -3.240 -8.881 1.00 0.00 C ATOM 802 NH1 ARG A 53 15.050 -3.779 -8.802 1.00 0.00 N ATOM 803 NH2 ARG A 53 13.617 -2.340 -9.821 1.00 0.00 N ATOM 0 H ARG A 53 12.699 -0.250 -3.852 1.00 0.00 H new ATOM 0 HA ARG A 53 14.513 -2.631 -3.521 1.00 0.00 H new ATOM 0 HB2 ARG A 53 12.166 -3.222 -4.269 1.00 0.00 H new ATOM 0 HB3 ARG A 53 12.419 -2.212 -5.679 1.00 0.00 H new ATOM 0 HG2 ARG A 53 14.612 -3.732 -5.956 1.00 0.00 H new ATOM 0 HG3 ARG A 53 13.692 -4.854 -4.973 1.00 0.00 H new ATOM 0 HD2 ARG A 53 13.371 -5.439 -7.292 1.00 0.00 H new ATOM 0 HD3 ARG A 53 11.855 -4.819 -6.669 1.00 0.00 H new ATOM 0 HE ARG A 53 11.925 -3.080 -8.215 1.00 0.00 H new ATOM 0 HH11 ARG A 53 15.253 -4.476 -8.086 1.00 0.00 H new ATOM 0 HH12 ARG A 53 15.778 -3.495 -9.458 1.00 0.00 H new ATOM 0 HH21 ARG A 53 12.698 -1.906 -9.908 1.00 0.00 H new ATOM 0 HH22 ARG A 53 14.367 -2.078 -10.460 1.00 0.00 H new ATOM 1134 N LYS A 75 15.087 3.469 -6.547 1.00 0.00 N ATOM 1135 CA LYS A 75 14.486 2.752 -5.387 1.00 0.00 C ATOM 1136 C LYS A 75 12.954 2.707 -5.635 1.00 0.00 C ATOM 1137 O LYS A 75 12.330 3.744 -5.878 1.00 0.00 O ATOM 1138 CB LYS A 75 14.832 3.343 -4.001 1.00 0.00 C ATOM 1139 CG LYS A 75 16.224 4.003 -3.823 1.00 0.00 C ATOM 1140 CD LYS A 75 16.501 4.591 -2.422 1.00 0.00 C ATOM 1141 CE LYS A 75 15.641 5.803 -2.005 1.00 0.00 C ATOM 1142 NZ LYS A 75 15.915 7.024 -2.787 1.00 0.00 N ATOM 0 HA LYS A 75 14.917 1.752 -5.337 1.00 0.00 H new ATOM 0 HB2 LYS A 75 14.075 4.088 -3.756 1.00 0.00 H new ATOM 0 HB3 LYS A 75 14.744 2.544 -3.265 1.00 0.00 H new ATOM 0 HG2 LYS A 75 16.991 3.261 -4.046 1.00 0.00 H new ATOM 0 HG3 LYS A 75 16.327 4.799 -4.560 1.00 0.00 H new ATOM 0 HD2 LYS A 75 16.358 3.801 -1.685 1.00 0.00 H new ATOM 0 HD3 LYS A 75 17.550 4.884 -2.376 1.00 0.00 H new ATOM 0 HE2 LYS A 75 14.588 5.543 -2.111 1.00 0.00 H new ATOM 0 HE3 LYS A 75 15.813 6.013 -0.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 15.302 7.795 -2.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 16.911 7.297 -2.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 15.725 6.842 -3.793 1.00 0.00 H new ATOM 1155 N VAL A 76 12.350 1.514 -5.551 1.00 0.00 N ATOM 1156 CA VAL A 76 10.991 1.245 -6.002 1.00 0.00 C ATOM 1157 C VAL A 76 10.175 0.843 -4.721 1.00 0.00 C ATOM 1158 O VAL A 76 10.452 -0.199 -4.121 1.00 0.00 O ATOM 1159 CB VAL A 76 11.278 0.167 -7.094 1.00 0.00 C ATOM 1160 CG1 VAL A 76 10.319 -0.989 -7.096 1.00 0.00 C ATOM 1161 CG2 VAL A 76 11.465 0.768 -8.497 1.00 0.00 C ATOM 0 H VAL A 76 12.810 0.693 -5.157 1.00 0.00 H new ATOM 0 HA VAL A 76 10.375 2.030 -6.441 1.00 0.00 H new ATOM 0 HB VAL A 76 12.237 -0.260 -6.801 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.594 -1.688 -7.886 1.00 0.00 H new ATOM 0 HG12 VAL A 76 10.359 -1.496 -6.132 1.00 0.00 H new ATOM 0 HG13 VAL A 76 9.308 -0.622 -7.271 1.00 0.00 H new ATOM 0 HG21 VAL A 76 11.661 -0.031 -9.212 1.00 0.00 H new ATOM 0 HG22 VAL A 76 10.560 1.301 -8.788 1.00 0.00 H new ATOM 0 HG23 VAL A 76 12.306 1.461 -8.487 1.00 0.00 H new ATOM 1171 N PRO A 77 9.147 1.610 -4.299 1.00 0.00 N ATOM 1172 CA PRO A 77 8.396 1.352 -3.054 1.00 0.00 C ATOM 1173 C PRO A 77 7.293 0.286 -3.199 1.00 0.00 C ATOM 1174 O PRO A 77 6.511 0.235 -4.154 1.00 0.00 O ATOM 1175 CB PRO A 77 7.838 2.750 -2.748 1.00 0.00 C ATOM 1176 CG PRO A 77 7.611 3.383 -4.125 1.00 0.00 C ATOM 1177 CD PRO A 77 8.739 2.823 -4.997 1.00 0.00 C ATOM 0 HA PRO A 77 9.010 0.929 -2.259 1.00 0.00 H new ATOM 0 HB2 PRO A 77 6.909 2.691 -2.180 1.00 0.00 H new ATOM 0 HB3 PRO A 77 8.539 3.335 -2.153 1.00 0.00 H new ATOM 0 HG2 PRO A 77 6.632 3.120 -4.526 1.00 0.00 H new ATOM 0 HG3 PRO A 77 7.653 4.471 -4.073 1.00 0.00 H new ATOM 0 HD2 PRO A 77 8.393 2.606 -6.008 1.00 0.00 H new ATOM 0 HD3 PRO A 77 9.564 3.530 -5.087 1.00 0.00 H new ATOM 1185 N ALA A 78 7.293 -0.544 -2.163 1.00 0.00 N ATOM 1186 CA ALA A 78 6.415 -1.712 -2.039 1.00 0.00 C ATOM 1187 C ALA A 78 5.711 -1.709 -0.655 1.00 0.00 C ATOM 1188 O ALA A 78 6.060 -0.965 0.264 1.00 0.00 O ATOM 1189 CB ALA A 78 7.370 -2.899 -2.263 1.00 0.00 C ATOM 0 H ALA A 78 7.916 -0.425 -1.364 1.00 0.00 H new ATOM 0 HA ALA A 78 5.590 -1.742 -2.751 1.00 0.00 H new ATOM 0 HB1 ALA A 78 6.813 -3.833 -2.191 1.00 0.00 H new ATOM 0 HB2 ALA A 78 7.822 -2.821 -3.252 1.00 0.00 H new ATOM 0 HB3 ALA A 78 8.153 -2.884 -1.505 1.00 0.00 H new ATOM 1195 N PHE A 79 4.687 -2.557 -0.560 1.00 0.00 N ATOM 1196 CA PHE A 79 3.846 -2.749 0.655 1.00 0.00 C ATOM 1197 C PHE A 79 3.516 -4.277 0.648 1.00 0.00 C ATOM 1198 O PHE A 79 2.910 -4.832 -0.276 1.00 0.00 O ATOM 1199 CB PHE A 79 2.585 -1.859 0.637 1.00 0.00 C ATOM 1200 CG PHE A 79 1.411 -2.265 1.563 1.00 0.00 C ATOM 1201 CD1 PHE A 79 1.407 -1.919 2.917 1.00 0.00 C ATOM 1202 CD2 PHE A 79 0.390 -3.089 1.065 1.00 0.00 C ATOM 1203 CE1 PHE A 79 0.410 -2.401 3.762 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -0.592 -3.588 1.915 1.00 0.00 C ATOM 1205 CZ PHE A 79 -0.574 -3.253 3.264 1.00 0.00 C ATOM 0 H PHE A 79 4.400 -3.152 -1.337 1.00 0.00 H new ATOM 0 HA PHE A 79 4.356 -2.450 1.570 1.00 0.00 H new ATOM 0 HB2 PHE A 79 2.885 -0.845 0.899 1.00 0.00 H new ATOM 0 HB3 PHE A 79 2.211 -1.826 -0.386 1.00 0.00 H new ATOM 0 HD1 PHE A 79 2.180 -1.275 3.310 1.00 0.00 H new ATOM 0 HD2 PHE A 79 0.366 -3.338 0.014 1.00 0.00 H new ATOM 0 HE1 PHE A 79 0.400 -2.114 4.803 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -1.366 -4.234 1.528 1.00 0.00 H new ATOM 0 HZ PHE A 79 -1.325 -3.654 3.928 1.00 0.00 H new ATOM 1215 N LYS A 80 3.894 -4.902 1.752 1.00 0.00 N ATOM 1216 CA LYS A 80 3.495 -6.302 2.107 1.00 0.00 C ATOM 1217 C LYS A 80 2.113 -6.252 2.807 1.00 0.00 C ATOM 1218 O LYS A 80 1.854 -5.277 3.518 1.00 0.00 O ATOM 1219 CB LYS A 80 4.532 -6.955 3.058 1.00 0.00 C ATOM 1220 CG LYS A 80 5.897 -7.320 2.426 1.00 0.00 C ATOM 1221 CD LYS A 80 5.865 -8.532 1.472 1.00 0.00 C ATOM 1222 CE LYS A 80 7.256 -8.864 0.902 1.00 0.00 C ATOM 1223 NZ LYS A 80 7.208 -10.034 0.007 1.00 0.00 N ATOM 0 H LYS A 80 4.495 -4.466 2.452 1.00 0.00 H new ATOM 0 HA LYS A 80 3.448 -6.901 1.198 1.00 0.00 H new ATOM 0 HB2 LYS A 80 4.710 -6.275 3.891 1.00 0.00 H new ATOM 0 HB3 LYS A 80 4.093 -7.862 3.475 1.00 0.00 H new ATOM 0 HG2 LYS A 80 6.271 -6.455 1.879 1.00 0.00 H new ATOM 0 HG3 LYS A 80 6.609 -7.524 3.226 1.00 0.00 H new ATOM 0 HD2 LYS A 80 5.476 -9.400 2.004 1.00 0.00 H new ATOM 0 HD3 LYS A 80 5.178 -8.327 0.651 1.00 0.00 H new ATOM 0 HE2 LYS A 80 7.642 -8.003 0.356 1.00 0.00 H new ATOM 0 HE3 LYS A 80 7.949 -9.059 1.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 8.161 -10.230 -0.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 6.863 -10.861 0.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 6.566 -9.838 -0.787 1.00 0.00 H new ATOM 1236 N PRO A 81 1.193 -7.248 2.670 1.00 0.00 N ATOM 1237 CA PRO A 81 -0.027 -7.299 3.517 1.00 0.00 C ATOM 1238 C PRO A 81 0.226 -7.921 4.934 1.00 0.00 C ATOM 1239 O PRO A 81 -0.676 -8.526 5.514 1.00 0.00 O ATOM 1240 CB PRO A 81 -0.926 -8.152 2.603 1.00 0.00 C ATOM 1241 CG PRO A 81 0.008 -9.150 1.914 1.00 0.00 C ATOM 1242 CD PRO A 81 1.288 -8.348 1.688 1.00 0.00 C ATOM 0 HA PRO A 81 -0.448 -6.332 3.791 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -1.693 -8.668 3.180 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -1.442 -7.530 1.872 1.00 0.00 H new ATOM 0 HG2 PRO A 81 0.189 -10.026 2.537 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -0.412 -9.509 0.974 1.00 0.00 H new ATOM 0 HD2 PRO A 81 2.176 -8.957 1.855 1.00 0.00 H new ATOM 0 HD3 PRO A 81 1.348 -7.969 0.668 1.00 0.00 H new ATOM 1250 N GLY A 82 1.447 -7.769 5.497 1.00 0.00 N ATOM 1251 CA GLY A 82 1.886 -8.403 6.760 1.00 0.00 C ATOM 1252 C GLY A 82 1.592 -9.906 6.969 1.00 0.00 C ATOM 1253 O GLY A 82 1.651 -10.334 8.124 1.00 0.00 O ATOM 0 H GLY A 82 2.171 -7.188 5.075 1.00 0.00 H new ATOM 0 HA2 GLY A 82 2.963 -8.260 6.846 1.00 0.00 H new ATOM 0 HA3 GLY A 82 1.425 -7.857 7.583 1.00 0.00 H new ATOM 1257 N LYS A 83 1.262 -10.665 5.884 1.00 0.00 N ATOM 1258 CA LYS A 83 0.686 -12.059 5.961 1.00 0.00 C ATOM 1259 C LYS A 83 -0.800 -12.133 6.467 1.00 0.00 C ATOM 1260 O LYS A 83 -1.670 -12.801 5.907 1.00 0.00 O ATOM 1261 CB LYS A 83 1.567 -13.076 6.748 1.00 0.00 C ATOM 1262 CG LYS A 83 2.413 -14.034 5.882 1.00 0.00 C ATOM 1263 CD LYS A 83 3.548 -13.348 5.087 1.00 0.00 C ATOM 1264 CE LYS A 83 4.408 -14.299 4.230 1.00 0.00 C ATOM 1265 NZ LYS A 83 5.289 -15.170 5.031 1.00 0.00 N ATOM 0 H LYS A 83 1.385 -10.335 4.927 1.00 0.00 H new ATOM 0 HA LYS A 83 0.685 -12.361 4.914 1.00 0.00 H new ATOM 0 HB2 LYS A 83 2.237 -12.519 7.403 1.00 0.00 H new ATOM 0 HB3 LYS A 83 0.918 -13.672 7.389 1.00 0.00 H new ATOM 0 HG2 LYS A 83 2.849 -14.797 6.527 1.00 0.00 H new ATOM 0 HG3 LYS A 83 1.754 -14.547 5.181 1.00 0.00 H new ATOM 0 HD2 LYS A 83 3.110 -12.592 4.436 1.00 0.00 H new ATOM 0 HD3 LYS A 83 4.199 -12.826 5.788 1.00 0.00 H new ATOM 0 HE2 LYS A 83 3.752 -14.920 3.620 1.00 0.00 H new ATOM 0 HE3 LYS A 83 5.017 -13.709 3.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 5.839 -15.784 4.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 5.937 -14.584 5.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 4.712 -15.757 5.667 1.00 0.00 H new ATOM 1278 N ALA A 84 -0.995 -11.471 7.600 1.00 0.00 N ATOM 1279 CA ALA A 84 -2.243 -11.262 8.346 1.00 0.00 C ATOM 1280 C ALA A 84 -3.419 -10.645 7.563 1.00 0.00 C ATOM 1281 O ALA A 84 -4.526 -11.185 7.644 1.00 0.00 O ATOM 1282 CB ALA A 84 -1.770 -10.299 9.435 1.00 0.00 C ATOM 0 H ALA A 84 -0.210 -11.020 8.071 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.667 -12.212 8.671 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.607 -10.045 10.085 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -0.984 -10.773 10.024 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -1.381 -9.391 8.974 1.00 0.00 H new ATOM 1288 N LEU A 85 -3.199 -9.530 6.821 1.00 0.00 N ATOM 1289 CA LEU A 85 -4.190 -9.020 5.858 1.00 0.00 C ATOM 1290 C LEU A 85 -4.462 -10.075 4.735 1.00 0.00 C ATOM 1291 O LEU A 85 -5.625 -10.235 4.374 1.00 0.00 O ATOM 1292 CB LEU A 85 -3.750 -7.630 5.331 1.00 0.00 C ATOM 1293 CG LEU A 85 -4.717 -7.047 4.290 1.00 0.00 C ATOM 1294 CD1 LEU A 85 -6.025 -6.505 4.879 1.00 0.00 C ATOM 1295 CD2 LEU A 85 -4.027 -5.980 3.423 1.00 0.00 C ATOM 0 H LEU A 85 -2.346 -8.974 6.876 1.00 0.00 H new ATOM 0 HA LEU A 85 -5.149 -8.868 6.353 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -3.669 -6.939 6.170 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -2.757 -7.713 4.889 1.00 0.00 H new ATOM 0 HG LEU A 85 -5.002 -7.890 3.661 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -6.650 -6.112 4.077 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -6.554 -7.309 5.391 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -5.802 -5.708 5.588 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -4.738 -5.587 2.696 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -3.672 -5.169 4.059 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -3.182 -6.427 2.899 1.00 0.00 H new ATOM 1307 N LYS A 86 -3.440 -10.778 4.201 1.00 0.00 N ATOM 1308 CA LYS A 86 -3.646 -11.921 3.262 1.00 0.00 C ATOM 1309 C LYS A 86 -4.627 -13.045 3.775 1.00 0.00 C ATOM 1310 O LYS A 86 -5.209 -13.754 2.953 1.00 0.00 O ATOM 1311 CB LYS A 86 -2.282 -12.451 2.744 1.00 0.00 C ATOM 1312 CG LYS A 86 -2.345 -13.083 1.337 1.00 0.00 C ATOM 1313 CD LYS A 86 -0.958 -13.469 0.790 1.00 0.00 C ATOM 1314 CE LYS A 86 -1.026 -14.067 -0.626 1.00 0.00 C ATOM 1315 NZ LYS A 86 0.316 -14.410 -1.129 1.00 0.00 N ATOM 0 H LYS A 86 -2.459 -10.580 4.400 1.00 0.00 H new ATOM 0 HA LYS A 86 -4.191 -11.523 2.406 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -1.567 -11.629 2.730 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -1.902 -13.192 3.447 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -2.976 -13.971 1.371 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -2.818 -12.381 0.650 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -0.318 -12.587 0.777 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -0.494 -14.190 1.463 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -1.652 -14.959 -0.616 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -1.498 -13.354 -1.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 0.236 -14.811 -2.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 0.904 -13.553 -1.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 0.756 -15.109 -0.496 1.00 0.00 H new ATOM 1328 N ASP A 87 -4.834 -13.168 5.106 1.00 0.00 N ATOM 1329 CA ASP A 87 -5.881 -14.005 5.734 1.00 0.00 C ATOM 1330 C ASP A 87 -7.265 -13.282 5.848 1.00 0.00 C ATOM 1331 O ASP A 87 -8.289 -13.930 5.625 1.00 0.00 O ATOM 1332 CB ASP A 87 -5.318 -14.429 7.116 1.00 0.00 C ATOM 1333 CG ASP A 87 -5.429 -15.934 7.380 1.00 0.00 C ATOM 1334 OD1 ASP A 87 -4.491 -16.718 7.243 1.00 0.00 O ATOM 1335 OD2 ASP A 87 -6.690 -16.296 7.780 1.00 0.00 O ATOM 0 H ASP A 87 -4.262 -12.674 5.791 1.00 0.00 H new ATOM 0 HA ASP A 87 -6.096 -14.874 5.112 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -4.271 -14.132 7.181 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -5.851 -13.890 7.899 1.00 0.00 H new ATOM 1341 N ALA A 88 -7.321 -11.975 6.206 1.00 0.00 N ATOM 1342 CA ALA A 88 -8.573 -11.156 6.135 1.00 0.00 C ATOM 1343 C ALA A 88 -9.315 -11.169 4.764 1.00 0.00 C ATOM 1344 O ALA A 88 -10.544 -11.222 4.700 1.00 0.00 O ATOM 1345 CB ALA A 88 -8.228 -9.654 6.350 1.00 0.00 C ATOM 0 H ALA A 88 -6.513 -11.457 6.550 1.00 0.00 H new ATOM 0 HA ALA A 88 -9.211 -11.606 6.896 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -9.140 -9.060 6.298 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -7.765 -9.523 7.328 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -7.536 -9.325 5.575 1.00 0.00 H new ATOM 1351 N VAL A 89 -8.515 -11.104 3.693 1.00 0.00 N ATOM 1352 CA VAL A 89 -8.934 -10.845 2.317 1.00 0.00 C ATOM 1353 C VAL A 89 -9.161 -12.091 1.398 1.00 0.00 C ATOM 1354 O VAL A 89 -9.658 -11.915 0.282 1.00 0.00 O ATOM 1355 CB VAL A 89 -7.724 -9.910 1.949 1.00 0.00 C ATOM 1356 CG1 VAL A 89 -6.484 -10.668 1.477 1.00 0.00 C ATOM 1357 CG2 VAL A 89 -8.064 -8.867 0.926 1.00 0.00 C ATOM 0 H VAL A 89 -7.507 -11.238 3.770 1.00 0.00 H new ATOM 0 HA VAL A 89 -9.933 -10.429 2.185 1.00 0.00 H new ATOM 0 HB VAL A 89 -7.494 -9.417 2.893 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -5.691 -9.958 1.241 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -6.146 -11.340 2.266 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -6.729 -11.247 0.587 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -7.183 -8.258 0.720 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -8.393 -9.352 0.007 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -8.864 -8.231 1.306 1.00 0.00 H new ATOM 1367 N LYS A 90 -8.792 -13.316 1.847 1.00 0.00 N ATOM 1368 CA LYS A 90 -8.839 -14.539 1.016 1.00 0.00 C ATOM 1369 C LYS A 90 -10.263 -14.999 0.624 1.00 0.00 C ATOM 1370 O LYS A 90 -11.164 -15.109 1.457 1.00 0.00 O ATOM 1371 CB LYS A 90 -7.901 -15.630 1.615 1.00 0.00 C ATOM 1372 CG LYS A 90 -8.485 -16.809 2.434 1.00 0.00 C ATOM 1373 CD LYS A 90 -8.931 -16.427 3.855 1.00 0.00 C ATOM 1374 CE LYS A 90 -9.588 -17.586 4.622 1.00 0.00 C ATOM 1375 NZ LYS A 90 -9.968 -17.173 5.985 1.00 0.00 N ATOM 0 H LYS A 90 -8.454 -13.481 2.795 1.00 0.00 H new ATOM 0 HA LYS A 90 -8.432 -14.297 0.034 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -7.340 -16.061 0.786 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -7.182 -15.119 2.255 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -9.338 -17.223 1.896 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -7.736 -17.598 2.500 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -8.066 -16.074 4.416 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -9.634 -15.596 3.796 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -10.471 -17.928 4.083 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -8.899 -18.429 4.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -10.409 -17.974 6.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -9.120 -16.869 6.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -10.643 -16.384 5.933 1.00 0.00 H new ATOM 1389 N MET B 1 10.351 0.588 11.287 1.00 0.00 N ATOM 1390 CA MET B 1 9.341 0.908 12.305 1.00 0.00 C ATOM 1391 C MET B 1 8.834 -0.419 12.968 1.00 0.00 C ATOM 1392 O MET B 1 9.666 -1.209 13.424 1.00 0.00 O ATOM 1393 CB MET B 1 8.309 1.944 11.744 1.00 0.00 C ATOM 1394 CG MET B 1 8.894 3.339 11.422 1.00 0.00 C ATOM 1395 SD MET B 1 7.611 4.615 11.341 1.00 0.00 S ATOM 1396 CE MET B 1 7.039 4.504 9.633 1.00 0.00 C ATOM 0 H1 MET B 1 10.702 1.468 10.857 1.00 0.00 H new ATOM 0 H2 MET B 1 11.143 0.080 11.731 1.00 0.00 H new ATOM 0 H3 MET B 1 9.925 -0.011 10.551 1.00 0.00 H new ATOM 0 HA MET B 1 9.742 1.455 13.158 1.00 0.00 H new ATOM 0 HB2 MET B 1 7.863 1.535 10.837 1.00 0.00 H new ATOM 0 HB3 MET B 1 7.504 2.062 12.470 1.00 0.00 H new ATOM 0 HG2 MET B 1 9.626 3.609 12.184 1.00 0.00 H new ATOM 0 HG3 MET B 1 9.424 3.298 10.471 1.00 0.00 H new ATOM 0 HE1 MET B 1 6.645 5.470 9.318 1.00 0.00 H new ATOM 0 HE2 MET B 1 7.872 4.223 8.988 1.00 0.00 H new ATOM 0 HE3 MET B 1 6.254 3.751 9.560 1.00 0.00 H new ATOM 1407 N ASN B 2 7.508 -0.643 13.064 1.00 0.00 N ATOM 1408 CA ASN B 2 6.848 -1.858 13.666 1.00 0.00 C ATOM 1409 C ASN B 2 5.302 -1.727 13.800 1.00 0.00 C ATOM 1410 O ASN B 2 4.601 -2.721 13.617 1.00 0.00 O ATOM 1411 CB ASN B 2 7.407 -2.517 14.966 1.00 0.00 C ATOM 1412 CG ASN B 2 7.290 -1.745 16.296 1.00 0.00 C ATOM 1413 OD1 ASN B 2 6.230 -1.727 16.918 1.00 0.00 O ATOM 1414 ND2 ASN B 2 8.367 -1.154 16.786 1.00 0.00 N ATOM 0 H ASN B 2 6.827 0.032 12.716 1.00 0.00 H new ATOM 0 HA ASN B 2 7.144 -2.560 12.886 1.00 0.00 H new ATOM 0 HB2 ASN B 2 6.903 -3.475 15.094 1.00 0.00 H new ATOM 0 HB3 ASN B 2 8.463 -2.732 14.800 1.00 0.00 H new ATOM 0 HD21 ASN B 2 8.322 -0.678 17.687 1.00 0.00 H new ATOM 0 HD22 ASN B 2 9.242 -1.174 16.263 1.00 0.00 H new ATOM 1421 N LYS B 3 4.847 -0.512 14.141 1.00 0.00 N ATOM 1422 CA LYS B 3 3.445 -0.077 14.426 1.00 0.00 C ATOM 1423 C LYS B 3 3.457 0.955 15.595 1.00 0.00 C ATOM 1424 O LYS B 3 2.616 1.851 15.592 1.00 0.00 O ATOM 1425 CB LYS B 3 2.329 -1.140 14.662 1.00 0.00 C ATOM 1426 CG LYS B 3 0.881 -0.597 14.557 1.00 0.00 C ATOM 1427 CD LYS B 3 -0.210 -1.683 14.594 1.00 0.00 C ATOM 1428 CE LYS B 3 -1.621 -1.114 14.355 1.00 0.00 C ATOM 1429 NZ LYS B 3 -2.647 -2.169 14.408 1.00 0.00 N ATOM 0 H LYS B 3 5.496 0.269 14.236 1.00 0.00 H new ATOM 0 HA LYS B 3 3.136 0.342 13.468 1.00 0.00 H new ATOM 0 HB2 LYS B 3 2.454 -1.944 13.937 1.00 0.00 H new ATOM 0 HB3 LYS B 3 2.467 -1.578 15.651 1.00 0.00 H new ATOM 0 HG2 LYS B 3 0.708 0.102 15.375 1.00 0.00 H new ATOM 0 HG3 LYS B 3 0.784 -0.033 13.629 1.00 0.00 H new ATOM 0 HD2 LYS B 3 0.007 -2.436 13.837 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -0.184 -2.186 15.561 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -1.840 -0.355 15.106 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -1.655 -0.621 13.384 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -3.584 -1.750 14.243 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -2.452 -2.880 13.675 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -2.630 -2.623 15.344 1.00 0.00 H new ATOM 1442 N THR B 4 4.362 0.818 16.581 1.00 0.00 N ATOM 1443 CA THR B 4 4.568 1.698 17.713 1.00 0.00 C ATOM 1444 C THR B 4 5.532 2.876 17.406 1.00 0.00 C ATOM 1445 O THR B 4 5.285 3.982 17.900 1.00 0.00 O ATOM 1446 CB THR B 4 5.085 0.742 18.806 1.00 0.00 C ATOM 1447 OG1 THR B 4 4.146 -0.289 19.124 1.00 0.00 O ATOM 1448 CG2 THR B 4 5.317 1.542 20.053 1.00 0.00 C ATOM 0 H THR B 4 5.008 0.028 16.595 1.00 0.00 H new ATOM 0 HA THR B 4 3.660 2.221 18.014 1.00 0.00 H new ATOM 0 HB THR B 4 5.994 0.272 18.432 1.00 0.00 H new ATOM 0 HG1 THR B 4 4.520 -0.869 19.820 1.00 0.00 H new ATOM 0 HG21 THR B 4 5.684 0.886 20.843 1.00 0.00 H new ATOM 0 HG22 THR B 4 6.055 2.319 19.855 1.00 0.00 H new ATOM 0 HG23 THR B 4 4.381 2.002 20.369 1.00 0.00 H new ATOM 1456 N GLU B 5 6.633 2.650 16.649 1.00 0.00 N ATOM 1457 CA GLU B 5 7.434 3.783 16.095 1.00 0.00 C ATOM 1458 C GLU B 5 6.558 4.721 15.186 1.00 0.00 C ATOM 1459 O GLU B 5 6.889 5.897 15.013 1.00 0.00 O ATOM 1460 CB GLU B 5 8.684 3.309 15.308 1.00 0.00 C ATOM 1461 CG GLU B 5 9.610 2.253 15.946 1.00 0.00 C ATOM 1462 CD GLU B 5 10.236 2.660 17.283 1.00 0.00 C ATOM 1463 OE1 GLU B 5 9.726 2.405 18.374 1.00 0.00 O ATOM 1464 OE2 GLU B 5 11.416 3.338 17.119 1.00 0.00 O ATOM 0 H GLU B 5 6.984 1.723 16.410 1.00 0.00 H new ATOM 0 HA GLU B 5 7.782 4.349 16.959 1.00 0.00 H new ATOM 0 HB2 GLU B 5 8.341 2.912 14.352 1.00 0.00 H new ATOM 0 HB3 GLU B 5 9.289 4.189 15.089 1.00 0.00 H new ATOM 0 HG2 GLU B 5 9.041 1.335 16.094 1.00 0.00 H new ATOM 0 HG3 GLU B 5 10.410 2.022 15.243 1.00 0.00 H new ATOM 1472 N LEU B 6 5.437 4.185 14.636 1.00 0.00 N ATOM 1473 CA LEU B 6 4.398 4.935 13.958 1.00 0.00 C ATOM 1474 C LEU B 6 3.569 5.846 14.883 1.00 0.00 C ATOM 1475 O LEU B 6 3.264 6.959 14.492 1.00 0.00 O ATOM 1476 CB LEU B 6 3.464 3.846 13.357 1.00 0.00 C ATOM 1477 CG LEU B 6 3.295 3.977 11.813 1.00 0.00 C ATOM 1478 CD1 LEU B 6 3.661 5.282 11.067 1.00 0.00 C ATOM 1479 CD2 LEU B 6 3.863 2.767 11.048 1.00 0.00 C ATOM 0 H LEU B 6 5.245 3.184 14.664 1.00 0.00 H new ATOM 0 HA LEU B 6 4.850 5.606 13.227 1.00 0.00 H new ATOM 0 HB2 LEU B 6 3.866 2.860 13.591 1.00 0.00 H new ATOM 0 HB3 LEU B 6 2.485 3.912 13.832 1.00 0.00 H new ATOM 0 HG LEU B 6 2.206 4.017 11.795 1.00 0.00 H new ATOM 0 HD11 LEU B 6 3.467 5.159 10.001 1.00 0.00 H new ATOM 0 HD12 LEU B 6 3.057 6.103 11.453 1.00 0.00 H new ATOM 0 HD13 LEU B 6 4.717 5.505 11.220 1.00 0.00 H new ATOM 0 HD21 LEU B 6 3.718 2.913 9.978 1.00 0.00 H new ATOM 0 HD22 LEU B 6 4.928 2.670 11.260 1.00 0.00 H new ATOM 0 HD23 LEU B 6 3.346 1.861 11.364 1.00 0.00 H new ATOM 1491 N ILE B 7 3.196 5.378 16.081 1.00 0.00 N ATOM 1492 CA ILE B 7 2.450 6.154 17.112 1.00 0.00 C ATOM 1493 C ILE B 7 3.244 7.425 17.527 1.00 0.00 C ATOM 1494 O ILE B 7 2.680 8.522 17.521 1.00 0.00 O ATOM 1495 CB ILE B 7 2.112 5.246 18.341 1.00 0.00 C ATOM 1496 CG1 ILE B 7 1.516 3.880 17.928 1.00 0.00 C ATOM 1497 CG2 ILE B 7 1.148 5.959 19.301 1.00 0.00 C ATOM 1498 CD1 ILE B 7 1.344 2.835 19.025 1.00 0.00 C ATOM 0 H ILE B 7 3.404 4.425 16.380 1.00 0.00 H new ATOM 0 HA ILE B 7 1.506 6.491 16.684 1.00 0.00 H new ATOM 0 HB ILE B 7 3.058 5.055 18.848 1.00 0.00 H new ATOM 0 HG12 ILE B 7 0.540 4.060 17.476 1.00 0.00 H new ATOM 0 HG13 ILE B 7 2.153 3.454 17.152 1.00 0.00 H new ATOM 0 HG21 ILE B 7 0.929 5.307 20.147 1.00 0.00 H new ATOM 0 HG22 ILE B 7 1.608 6.879 19.662 1.00 0.00 H new ATOM 0 HG23 ILE B 7 0.222 6.197 18.777 1.00 0.00 H new ATOM 0 HD11 ILE B 7 0.917 1.927 18.599 1.00 0.00 H new ATOM 0 HD12 ILE B 7 2.314 2.608 19.466 1.00 0.00 H new ATOM 0 HD13 ILE B 7 0.677 3.222 19.795 1.00 0.00 H new ATOM 1510 N ASN B 8 4.546 7.262 17.844 1.00 0.00 N ATOM 1511 CA ASN B 8 5.457 8.425 18.052 1.00 0.00 C ATOM 1512 C ASN B 8 5.701 9.307 16.778 1.00 0.00 C ATOM 1513 O ASN B 8 6.125 10.452 16.940 1.00 0.00 O ATOM 1514 CB ASN B 8 6.815 7.969 18.654 1.00 0.00 C ATOM 1515 CG ASN B 8 6.752 7.271 20.030 1.00 0.00 C ATOM 1516 OD1 ASN B 8 6.379 7.871 21.038 1.00 0.00 O ATOM 1517 ND2 ASN B 8 7.112 5.997 20.093 1.00 0.00 N ATOM 0 H ASN B 8 4.992 6.352 17.962 1.00 0.00 H new ATOM 0 HA ASN B 8 4.931 9.066 18.760 1.00 0.00 H new ATOM 0 HB2 ASN B 8 7.292 7.290 17.947 1.00 0.00 H new ATOM 0 HB3 ASN B 8 7.461 8.843 18.742 1.00 0.00 H new ATOM 0 HD21 ASN B 8 7.082 5.502 20.984 1.00 0.00 H new ATOM 0 HD22 ASN B 8 7.419 5.512 19.250 1.00 0.00 H new ATOM 1524 N ALA B 9 5.439 8.815 15.544 1.00 0.00 N ATOM 1525 CA ALA B 9 5.429 9.658 14.317 1.00 0.00 C ATOM 1526 C ALA B 9 4.280 10.676 14.273 1.00 0.00 C ATOM 1527 O ALA B 9 4.489 11.845 13.954 1.00 0.00 O ATOM 1528 CB ALA B 9 5.201 8.787 13.046 1.00 0.00 C ATOM 0 H ALA B 9 5.230 7.832 15.368 1.00 0.00 H new ATOM 0 HA ALA B 9 6.395 10.162 14.339 1.00 0.00 H new ATOM 0 HB1 ALA B 9 5.198 9.426 12.163 1.00 0.00 H new ATOM 0 HB2 ALA B 9 6.002 8.053 12.960 1.00 0.00 H new ATOM 0 HB3 ALA B 9 4.244 8.272 13.125 1.00 0.00 H new ATOM 1534 N VAL B 10 3.071 10.184 14.566 1.00 0.00 N ATOM 1535 CA VAL B 10 1.808 10.916 14.501 1.00 0.00 C ATOM 1536 C VAL B 10 1.729 11.954 15.581 1.00 0.00 C ATOM 1537 O VAL B 10 1.551 13.136 15.301 1.00 0.00 O ATOM 1538 CB VAL B 10 0.543 10.010 14.486 1.00 0.00 C ATOM 1539 CG1 VAL B 10 -0.597 10.626 13.704 1.00 0.00 C ATOM 1540 CG2 VAL B 10 0.830 8.626 13.936 1.00 0.00 C ATOM 0 H VAL B 10 2.944 9.218 14.869 1.00 0.00 H new ATOM 0 HA VAL B 10 1.810 11.418 13.533 1.00 0.00 H new ATOM 0 HB VAL B 10 0.244 9.918 15.530 1.00 0.00 H new ATOM 0 HG11 VAL B 10 -1.456 9.955 13.724 1.00 0.00 H new ATOM 0 HG12 VAL B 10 -0.872 11.581 14.152 1.00 0.00 H new ATOM 0 HG13 VAL B 10 -0.285 10.786 12.672 1.00 0.00 H new ATOM 0 HG21 VAL B 10 -0.085 8.033 13.947 1.00 0.00 H new ATOM 0 HG22 VAL B 10 1.196 8.710 12.913 1.00 0.00 H new ATOM 0 HG23 VAL B 10 1.585 8.139 14.553 1.00 0.00 H new ATOM 1550 N ALA B 11 1.910 11.472 16.809 1.00 0.00 N ATOM 1551 CA ALA B 11 1.955 12.346 17.962 1.00 0.00 C ATOM 1552 C ALA B 11 3.122 13.366 17.989 1.00 0.00 C ATOM 1553 O ALA B 11 2.945 14.416 18.614 1.00 0.00 O ATOM 1554 CB ALA B 11 1.885 11.459 19.205 1.00 0.00 C ATOM 0 H ALA B 11 2.027 10.482 17.023 1.00 0.00 H new ATOM 0 HA ALA B 11 1.095 13.015 17.919 1.00 0.00 H new ATOM 0 HB1 ALA B 11 1.916 12.082 20.099 1.00 0.00 H new ATOM 0 HB2 ALA B 11 0.956 10.888 19.193 1.00 0.00 H new ATOM 0 HB3 ALA B 11 2.732 10.773 19.211 1.00 0.00 H new ATOM 1560 N GLU B 12 4.272 13.099 17.310 1.00 0.00 N ATOM 1561 CA GLU B 12 5.315 14.136 17.131 1.00 0.00 C ATOM 1562 C GLU B 12 4.939 15.128 15.995 1.00 0.00 C ATOM 1563 O GLU B 12 5.021 16.335 16.246 1.00 0.00 O ATOM 1564 CB GLU B 12 6.724 13.502 16.979 1.00 0.00 C ATOM 1565 CG GLU B 12 7.929 14.470 16.942 1.00 0.00 C ATOM 1566 CD GLU B 12 8.149 15.264 18.235 1.00 0.00 C ATOM 1567 OE1 GLU B 12 7.731 16.409 18.404 1.00 0.00 O ATOM 1568 OE2 GLU B 12 8.854 14.550 19.170 1.00 0.00 O ATOM 0 H GLU B 12 4.493 12.197 16.889 1.00 0.00 H new ATOM 0 HA GLU B 12 5.364 14.738 18.038 1.00 0.00 H new ATOM 0 HB2 GLU B 12 6.873 12.807 17.805 1.00 0.00 H new ATOM 0 HB3 GLU B 12 6.734 12.914 16.061 1.00 0.00 H new ATOM 0 HG2 GLU B 12 8.831 13.898 16.724 1.00 0.00 H new ATOM 0 HG3 GLU B 12 7.790 15.172 16.119 1.00 0.00 H new ATOM 1576 N THR B 13 4.519 14.666 14.791 1.00 0.00 N ATOM 1577 CA THR B 13 4.151 15.600 13.668 1.00 0.00 C ATOM 1578 C THR B 13 2.664 16.057 13.519 1.00 0.00 C ATOM 1579 O THR B 13 2.250 16.584 12.481 1.00 0.00 O ATOM 1580 CB THR B 13 4.871 15.122 12.386 1.00 0.00 C ATOM 1581 OG1 THR B 13 5.286 16.238 11.605 1.00 0.00 O ATOM 1582 CG2 THR B 13 4.153 14.139 11.471 1.00 0.00 C ATOM 0 H THR B 13 4.424 13.676 14.563 1.00 0.00 H new ATOM 0 HA THR B 13 4.525 16.586 13.945 1.00 0.00 H new ATOM 0 HB THR B 13 5.701 14.547 12.797 1.00 0.00 H new ATOM 0 HG1 THR B 13 5.742 15.921 10.797 1.00 0.00 H new ATOM 0 HG21 THR B 13 4.790 13.904 10.618 1.00 0.00 H new ATOM 0 HG22 THR B 13 3.931 13.225 12.022 1.00 0.00 H new ATOM 0 HG23 THR B 13 3.223 14.584 11.117 1.00 0.00 H new ATOM 1590 N SER B 14 1.913 15.902 14.609 1.00 0.00 N ATOM 1591 CA SER B 14 0.489 16.332 14.729 1.00 0.00 C ATOM 1592 C SER B 14 0.127 16.890 16.140 1.00 0.00 C ATOM 1593 O SER B 14 -0.669 17.833 16.200 1.00 0.00 O ATOM 1594 CB SER B 14 -0.504 15.216 14.312 1.00 0.00 C ATOM 1595 OG SER B 14 -1.836 15.713 14.222 1.00 0.00 O ATOM 0 H SER B 14 2.270 15.467 15.460 1.00 0.00 H new ATOM 0 HA SER B 14 0.385 17.157 14.024 1.00 0.00 H new ATOM 0 HB2 SER B 14 -0.203 14.800 13.350 1.00 0.00 H new ATOM 0 HB3 SER B 14 -0.466 14.403 15.037 1.00 0.00 H new ATOM 0 HG SER B 14 -2.439 14.987 13.956 1.00 0.00 H new ATOM 1601 N GLY B 15 0.643 16.322 17.257 1.00 0.00 N ATOM 1602 CA GLY B 15 0.273 16.767 18.625 1.00 0.00 C ATOM 1603 C GLY B 15 -1.155 16.405 19.073 1.00 0.00 C ATOM 1604 O GLY B 15 -2.026 17.262 19.239 1.00 0.00 O ATOM 0 H GLY B 15 1.316 15.556 17.239 1.00 0.00 H new ATOM 0 HA2 GLY B 15 0.979 16.333 19.333 1.00 0.00 H new ATOM 0 HA3 GLY B 15 0.390 17.849 18.681 1.00 0.00 H new ATOM 1608 N LEU B 16 -1.325 15.103 19.283 1.00 0.00 N ATOM 1609 CA LEU B 16 -2.590 14.463 19.708 1.00 0.00 C ATOM 1610 C LEU B 16 -2.281 13.759 21.069 1.00 0.00 C ATOM 1611 O LEU B 16 -1.846 14.382 22.044 1.00 0.00 O ATOM 1612 CB LEU B 16 -3.327 13.823 18.469 1.00 0.00 C ATOM 1613 CG LEU B 16 -2.429 12.965 17.563 1.00 0.00 C ATOM 1614 CD1 LEU B 16 -1.484 12.033 18.236 1.00 0.00 C ATOM 1615 CD2 LEU B 16 -2.770 12.459 16.156 1.00 0.00 C ATOM 0 H LEU B 16 -0.567 14.432 19.161 1.00 0.00 H new ATOM 0 HA LEU B 16 -3.440 15.079 20.002 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -4.150 13.207 18.831 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -3.766 14.622 17.872 1.00 0.00 H new ATOM 0 HG LEU B 16 -2.015 13.927 17.263 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -0.912 11.489 17.484 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -0.803 12.601 18.870 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -2.044 11.325 18.847 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -1.935 11.876 15.767 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -3.660 11.832 16.201 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -2.957 13.309 15.499 1.00 0.00 H new ATOM 1627 N SER B 17 -2.544 12.466 21.097 1.00 0.00 N ATOM 1628 CA SER B 17 -2.212 11.533 22.206 1.00 0.00 C ATOM 1629 C SER B 17 -1.493 10.261 21.665 1.00 0.00 C ATOM 1630 O SER B 17 -1.589 9.904 20.494 1.00 0.00 O ATOM 1631 CB SER B 17 -3.470 11.162 23.017 1.00 0.00 C ATOM 1632 OG SER B 17 -4.131 12.311 23.536 1.00 0.00 O ATOM 0 H SER B 17 -3.015 11.997 20.323 1.00 0.00 H new ATOM 0 HA SER B 17 -1.525 12.044 22.881 1.00 0.00 H new ATOM 0 HB2 SER B 17 -4.158 10.604 22.382 1.00 0.00 H new ATOM 0 HB3 SER B 17 -3.190 10.503 23.839 1.00 0.00 H new ATOM 0 HG SER B 17 -4.923 12.032 24.041 1.00 0.00 H new ATOM 1638 N LYS B 18 -0.766 9.539 22.533 1.00 0.00 N ATOM 1639 CA LYS B 18 -0.194 8.188 22.208 1.00 0.00 C ATOM 1640 C LYS B 18 -1.327 7.160 21.893 1.00 0.00 C ATOM 1641 O LYS B 18 -1.260 6.459 20.883 1.00 0.00 O ATOM 1642 CB LYS B 18 0.743 7.758 23.374 1.00 0.00 C ATOM 1643 CG LYS B 18 1.618 6.504 23.145 1.00 0.00 C ATOM 1644 CD LYS B 18 2.917 6.765 22.349 1.00 0.00 C ATOM 1645 CE LYS B 18 3.687 5.489 21.950 1.00 0.00 C ATOM 1646 NZ LYS B 18 4.388 4.851 23.080 1.00 0.00 N ATOM 0 H LYS B 18 -0.550 9.857 23.478 1.00 0.00 H new ATOM 0 HA LYS B 18 0.406 8.230 21.299 1.00 0.00 H new ATOM 0 HB2 LYS B 18 1.403 8.594 23.604 1.00 0.00 H new ATOM 0 HB3 LYS B 18 0.128 7.585 24.257 1.00 0.00 H new ATOM 0 HG2 LYS B 18 1.880 6.078 24.113 1.00 0.00 H new ATOM 0 HG3 LYS B 18 1.027 5.756 22.616 1.00 0.00 H new ATOM 0 HD2 LYS B 18 2.669 7.323 21.446 1.00 0.00 H new ATOM 0 HD3 LYS B 18 3.573 7.399 22.945 1.00 0.00 H new ATOM 0 HE2 LYS B 18 2.989 4.774 21.514 1.00 0.00 H new ATOM 0 HE3 LYS B 18 4.413 5.738 21.176 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 4.885 4.001 22.745 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 5.077 5.518 23.483 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 3.698 4.583 23.810 1.00 0.00 H new ATOM 1659 N LYS B 19 -2.398 7.123 22.708 1.00 0.00 N ATOM 1660 CA LYS B 19 -3.625 6.362 22.379 1.00 0.00 C ATOM 1661 C LYS B 19 -4.330 6.936 21.111 1.00 0.00 C ATOM 1662 O LYS B 19 -4.700 6.105 20.283 1.00 0.00 O ATOM 1663 CB LYS B 19 -4.608 6.250 23.578 1.00 0.00 C ATOM 1664 CG LYS B 19 -4.162 5.327 24.740 1.00 0.00 C ATOM 1665 CD LYS B 19 -3.153 5.938 25.741 1.00 0.00 C ATOM 1666 CE LYS B 19 -2.803 5.034 26.940 1.00 0.00 C ATOM 1667 NZ LYS B 19 -1.962 3.878 26.569 1.00 0.00 N ATOM 0 H LYS B 19 -2.441 7.612 23.602 1.00 0.00 H new ATOM 0 HA LYS B 19 -3.304 5.345 22.152 1.00 0.00 H new ATOM 0 HB2 LYS B 19 -4.776 7.250 23.979 1.00 0.00 H new ATOM 0 HB3 LYS B 19 -5.567 5.892 23.203 1.00 0.00 H new ATOM 0 HG2 LYS B 19 -5.049 5.017 25.292 1.00 0.00 H new ATOM 0 HG3 LYS B 19 -3.721 4.426 24.314 1.00 0.00 H new ATOM 0 HD2 LYS B 19 -2.234 6.181 25.207 1.00 0.00 H new ATOM 0 HD3 LYS B 19 -3.560 6.876 26.118 1.00 0.00 H new ATOM 0 HE2 LYS B 19 -2.284 5.626 27.694 1.00 0.00 H new ATOM 0 HE3 LYS B 19 -3.725 4.673 27.397 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 -1.761 3.309 27.416 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 -2.464 3.293 25.870 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 -1.068 4.216 26.159 1.00 0.00 H new ATOM 1680 N ASP B 20 -4.477 8.275 20.898 1.00 0.00 N ATOM 1681 CA ASP B 20 -5.086 8.812 19.634 1.00 0.00 C ATOM 1682 C ASP B 20 -4.282 8.569 18.326 1.00 0.00 C ATOM 1683 O ASP B 20 -4.903 8.406 17.277 1.00 0.00 O ATOM 1684 CB ASP B 20 -5.415 10.328 19.759 1.00 0.00 C ATOM 1685 CG ASP B 20 -6.713 10.619 20.524 1.00 0.00 C ATOM 1686 OD1 ASP B 20 -6.755 10.801 21.741 1.00 0.00 O ATOM 1687 OD2 ASP B 20 -7.808 10.654 19.699 1.00 0.00 O ATOM 0 H ASP B 20 -4.191 8.992 21.565 1.00 0.00 H new ATOM 0 HA ASP B 20 -5.997 8.222 19.531 1.00 0.00 H new ATOM 0 HB2 ASP B 20 -4.588 10.830 20.261 1.00 0.00 H new ATOM 0 HB3 ASP B 20 -5.489 10.758 18.760 1.00 0.00 H new ATOM 1693 N ALA B 21 -2.946 8.551 18.381 1.00 0.00 N ATOM 1694 CA ALA B 21 -2.069 8.212 17.238 1.00 0.00 C ATOM 1695 C ALA B 21 -2.116 6.729 16.807 1.00 0.00 C ATOM 1696 O ALA B 21 -2.095 6.474 15.600 1.00 0.00 O ATOM 1697 CB ALA B 21 -0.649 8.629 17.636 1.00 0.00 C ATOM 0 H ALA B 21 -2.428 8.774 19.231 1.00 0.00 H new ATOM 0 HA ALA B 21 -2.424 8.748 16.358 1.00 0.00 H new ATOM 0 HB1 ALA B 21 0.039 8.399 16.823 1.00 0.00 H new ATOM 0 HB2 ALA B 21 -0.627 9.700 17.838 1.00 0.00 H new ATOM 0 HB3 ALA B 21 -0.348 8.085 18.531 1.00 0.00 H new ATOM 1703 N THR B 22 -2.186 5.767 17.751 1.00 0.00 N ATOM 1704 CA THR B 22 -2.302 4.310 17.387 1.00 0.00 C ATOM 1705 C THR B 22 -3.656 3.856 16.839 1.00 0.00 C ATOM 1706 O THR B 22 -3.750 3.078 15.890 1.00 0.00 O ATOM 1707 CB THR B 22 -1.742 3.365 18.445 1.00 0.00 C ATOM 1708 OG1 THR B 22 -1.251 2.197 17.790 1.00 0.00 O ATOM 1709 CG2 THR B 22 -2.292 2.933 19.789 1.00 0.00 C ATOM 0 H THR B 22 -2.166 5.951 18.754 1.00 0.00 H new ATOM 0 HA THR B 22 -1.642 4.234 16.523 1.00 0.00 H new ATOM 0 HB THR B 22 -1.118 4.148 18.875 1.00 0.00 H new ATOM 0 HG1 THR B 22 -1.478 1.405 18.320 1.00 0.00 H new ATOM 0 HG21 THR B 22 -1.596 2.240 20.261 1.00 0.00 H new ATOM 0 HG22 THR B 22 -2.422 3.807 20.427 1.00 0.00 H new ATOM 0 HG23 THR B 22 -3.254 2.441 19.647 1.00 0.00 H new ATOM 1717 N LYS B 23 -4.682 4.376 17.491 1.00 0.00 N ATOM 1718 CA LYS B 23 -6.062 4.414 16.992 1.00 0.00 C ATOM 1719 C LYS B 23 -6.279 5.022 15.589 1.00 0.00 C ATOM 1720 O LYS B 23 -7.183 4.570 14.901 1.00 0.00 O ATOM 1721 CB LYS B 23 -6.696 5.441 17.976 1.00 0.00 C ATOM 1722 CG LYS B 23 -7.285 4.803 19.256 1.00 0.00 C ATOM 1723 CD LYS B 23 -8.020 5.816 20.163 1.00 0.00 C ATOM 1724 CE LYS B 23 -8.567 5.229 21.478 1.00 0.00 C ATOM 1725 NZ LYS B 23 -9.718 4.326 21.281 1.00 0.00 N ATOM 0 H LYS B 23 -4.583 4.799 18.414 1.00 0.00 H new ATOM 0 HA LYS B 23 -6.450 3.397 16.929 1.00 0.00 H new ATOM 0 HB2 LYS B 23 -5.938 6.171 18.261 1.00 0.00 H new ATOM 0 HB3 LYS B 23 -7.485 5.986 17.458 1.00 0.00 H new ATOM 0 HG2 LYS B 23 -7.978 4.011 18.973 1.00 0.00 H new ATOM 0 HG3 LYS B 23 -6.480 4.335 19.823 1.00 0.00 H new ATOM 0 HD2 LYS B 23 -7.336 6.631 20.402 1.00 0.00 H new ATOM 0 HD3 LYS B 23 -8.849 6.249 19.603 1.00 0.00 H new ATOM 0 HE2 LYS B 23 -7.770 4.685 21.984 1.00 0.00 H new ATOM 0 HE3 LYS B 23 -8.863 6.045 22.137 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 -10.038 3.965 22.202 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 -10.494 4.847 20.825 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 -9.434 3.528 20.677 1.00 0.00 H new ATOM 1738 N ALA B 24 -5.523 6.078 15.263 1.00 0.00 N ATOM 1739 CA ALA B 24 -5.544 6.781 13.971 1.00 0.00 C ATOM 1740 C ALA B 24 -4.794 6.058 12.820 1.00 0.00 C ATOM 1741 O ALA B 24 -5.257 6.096 11.684 1.00 0.00 O ATOM 1742 CB ALA B 24 -5.015 8.164 14.270 1.00 0.00 C ATOM 0 H ALA B 24 -4.853 6.483 15.917 1.00 0.00 H new ATOM 0 HA ALA B 24 -6.557 6.815 13.571 1.00 0.00 H new ATOM 0 HB1 ALA B 24 -4.999 8.754 13.353 1.00 0.00 H new ATOM 0 HB2 ALA B 24 -5.660 8.650 15.003 1.00 0.00 H new ATOM 0 HB3 ALA B 24 -4.004 8.088 14.670 1.00 0.00 H new ATOM 1748 N VAL B 25 -3.651 5.402 13.099 1.00 0.00 N ATOM 1749 CA VAL B 25 -3.023 4.369 12.219 1.00 0.00 C ATOM 1750 C VAL B 25 -4.068 3.223 11.999 1.00 0.00 C ATOM 1751 O VAL B 25 -4.452 2.983 10.854 1.00 0.00 O ATOM 1752 CB VAL B 25 -1.769 3.903 13.070 1.00 0.00 C ATOM 1753 CG1 VAL B 25 -1.303 2.454 12.793 1.00 0.00 C ATOM 1754 CG2 VAL B 25 -0.562 4.846 12.946 1.00 0.00 C ATOM 0 H VAL B 25 -3.121 5.570 13.954 1.00 0.00 H new ATOM 0 HA VAL B 25 -2.724 4.706 11.226 1.00 0.00 H new ATOM 0 HB VAL B 25 -2.148 3.940 14.091 1.00 0.00 H new ATOM 0 HG11 VAL B 25 -0.441 2.223 13.419 1.00 0.00 H new ATOM 0 HG12 VAL B 25 -2.113 1.761 13.021 1.00 0.00 H new ATOM 0 HG13 VAL B 25 -1.026 2.355 11.743 1.00 0.00 H new ATOM 0 HG21 VAL B 25 0.260 4.467 13.554 1.00 0.00 H new ATOM 0 HG22 VAL B 25 -0.248 4.900 11.904 1.00 0.00 H new ATOM 0 HG23 VAL B 25 -0.841 5.841 13.293 1.00 0.00 H new ATOM 1764 N ASP B 26 -4.551 2.563 13.085 1.00 0.00 N ATOM 1765 CA ASP B 26 -5.657 1.569 12.998 1.00 0.00 C ATOM 1766 C ASP B 26 -6.986 2.143 12.393 1.00 0.00 C ATOM 1767 O ASP B 26 -7.799 1.368 11.909 1.00 0.00 O ATOM 1768 CB ASP B 26 -5.849 0.924 14.397 1.00 0.00 C ATOM 1769 CG ASP B 26 -6.708 -0.349 14.407 1.00 0.00 C ATOM 1770 OD1 ASP B 26 -6.263 -1.468 14.156 1.00 0.00 O ATOM 1771 OD2 ASP B 26 -8.019 -0.088 14.716 1.00 0.00 O ATOM 0 H ASP B 26 -4.193 2.701 14.030 1.00 0.00 H new ATOM 0 HA ASP B 26 -5.372 0.798 12.282 1.00 0.00 H new ATOM 0 HB2 ASP B 26 -4.868 0.687 14.810 1.00 0.00 H new ATOM 0 HB3 ASP B 26 -6.305 1.659 15.061 1.00 0.00 H new ATOM 1777 N ALA B 27 -7.196 3.469 12.390 1.00 0.00 N ATOM 1778 CA ALA B 27 -8.317 4.144 11.705 1.00 0.00 C ATOM 1779 C ALA B 27 -8.232 4.112 10.169 1.00 0.00 C ATOM 1780 O ALA B 27 -9.231 3.825 9.501 1.00 0.00 O ATOM 1781 CB ALA B 27 -8.422 5.576 12.180 1.00 0.00 C ATOM 0 H ALA B 27 -6.578 4.120 12.875 1.00 0.00 H new ATOM 0 HA ALA B 27 -9.212 3.581 11.970 1.00 0.00 H new ATOM 0 HB1 ALA B 27 -9.251 6.068 11.671 1.00 0.00 H new ATOM 0 HB2 ALA B 27 -8.597 5.591 13.256 1.00 0.00 H new ATOM 0 HB3 ALA B 27 -7.494 6.103 11.956 1.00 0.00 H new ATOM 1787 N VAL B 28 -7.027 4.401 9.635 1.00 0.00 N ATOM 1788 CA VAL B 28 -6.696 4.210 8.208 1.00 0.00 C ATOM 1789 C VAL B 28 -6.940 2.706 7.835 1.00 0.00 C ATOM 1790 O VAL B 28 -7.922 2.378 7.172 1.00 0.00 O ATOM 1791 CB VAL B 28 -5.199 4.591 7.865 1.00 0.00 C ATOM 1792 CG1 VAL B 28 -5.047 4.842 6.377 1.00 0.00 C ATOM 1793 CG2 VAL B 28 -4.536 5.760 8.565 1.00 0.00 C ATOM 0 H VAL B 28 -6.253 4.775 10.184 1.00 0.00 H new ATOM 0 HA VAL B 28 -7.337 4.876 7.630 1.00 0.00 H new ATOM 0 HB VAL B 28 -4.683 3.711 8.247 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -4.012 5.103 6.156 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -5.320 3.942 5.826 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -5.700 5.662 6.078 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -3.514 5.869 8.202 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -5.094 6.673 8.357 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -4.522 5.580 9.640 1.00 0.00 H new ATOM 1803 N PHE B 29 -6.068 1.869 8.422 1.00 0.00 N ATOM 1804 CA PHE B 29 -5.892 0.416 8.234 1.00 0.00 C ATOM 1805 C PHE B 29 -7.084 -0.487 8.626 1.00 0.00 C ATOM 1806 O PHE B 29 -7.057 -1.652 8.228 1.00 0.00 O ATOM 1807 CB PHE B 29 -4.502 0.041 8.861 1.00 0.00 C ATOM 1808 CG PHE B 29 -3.269 0.818 8.314 1.00 0.00 C ATOM 1809 CD1 PHE B 29 -3.088 1.006 6.937 1.00 0.00 C ATOM 1810 CD2 PHE B 29 -2.409 1.473 9.200 1.00 0.00 C ATOM 1811 CE1 PHE B 29 -2.126 1.887 6.460 1.00 0.00 C ATOM 1812 CE2 PHE B 29 -1.456 2.371 8.726 1.00 0.00 C ATOM 1813 CZ PHE B 29 -1.328 2.584 7.357 1.00 0.00 C ATOM 0 H PHE B 29 -5.403 2.227 9.108 1.00 0.00 H new ATOM 0 HA PHE B 29 -5.885 0.195 7.167 1.00 0.00 H new ATOM 0 HB2 PHE B 29 -4.558 0.201 9.938 1.00 0.00 H new ATOM 0 HB3 PHE B 29 -4.332 -1.024 8.705 1.00 0.00 H new ATOM 0 HD1 PHE B 29 -3.704 0.459 6.238 1.00 0.00 H new ATOM 0 HD2 PHE B 29 -2.484 1.281 10.260 1.00 0.00 H new ATOM 0 HE1 PHE B 29 -1.999 2.029 5.397 1.00 0.00 H new ATOM 0 HE2 PHE B 29 -0.818 2.900 9.419 1.00 0.00 H new ATOM 0 HZ PHE B 29 -0.603 3.296 6.990 1.00 0.00 H new ATOM 1823 N ASP B 30 -8.113 0.017 9.347 1.00 0.00 N ATOM 1824 CA ASP B 30 -9.399 -0.728 9.530 1.00 0.00 C ATOM 1825 C ASP B 30 -10.365 -0.539 8.326 1.00 0.00 C ATOM 1826 O ASP B 30 -10.971 -1.501 7.849 1.00 0.00 O ATOM 1827 CB ASP B 30 -10.121 -0.326 10.838 1.00 0.00 C ATOM 1828 CG ASP B 30 -11.257 -1.259 11.282 1.00 0.00 C ATOM 1829 OD1 ASP B 30 -12.444 -0.934 11.265 1.00 0.00 O ATOM 1830 OD2 ASP B 30 -10.795 -2.482 11.697 1.00 0.00 O ATOM 0 H ASP B 30 -8.087 0.925 9.810 1.00 0.00 H new ATOM 0 HA ASP B 30 -9.125 -1.781 9.591 1.00 0.00 H new ATOM 0 HB2 ASP B 30 -9.383 -0.275 11.638 1.00 0.00 H new ATOM 0 HB3 ASP B 30 -10.527 0.678 10.714 1.00 0.00 H new ATOM 1836 N SER B 31 -10.515 0.714 7.879 1.00 0.00 N ATOM 1837 CA SER B 31 -11.320 1.056 6.677 1.00 0.00 C ATOM 1838 C SER B 31 -10.752 0.467 5.336 1.00 0.00 C ATOM 1839 O SER B 31 -11.545 0.141 4.451 1.00 0.00 O ATOM 1840 CB SER B 31 -11.556 2.580 6.633 1.00 0.00 C ATOM 1841 OG SER B 31 -12.183 3.051 7.822 1.00 0.00 O ATOM 0 H SER B 31 -10.088 1.523 8.331 1.00 0.00 H new ATOM 0 HA SER B 31 -12.287 0.562 6.772 1.00 0.00 H new ATOM 0 HB2 SER B 31 -10.603 3.092 6.497 1.00 0.00 H new ATOM 0 HB3 SER B 31 -12.177 2.827 5.772 1.00 0.00 H new ATOM 0 HG SER B 31 -12.315 4.020 7.760 1.00 0.00 H new ATOM 1847 N ILE B 32 -9.417 0.275 5.200 1.00 0.00 N ATOM 1848 CA ILE B 32 -8.737 -0.380 4.053 1.00 0.00 C ATOM 1849 C ILE B 32 -9.039 -1.882 4.046 1.00 0.00 C ATOM 1850 O ILE B 32 -9.417 -2.381 2.998 1.00 0.00 O ATOM 1851 CB ILE B 32 -7.189 -0.206 4.066 1.00 0.00 C ATOM 1852 CG1 ILE B 32 -6.843 1.202 4.567 1.00 0.00 C ATOM 1853 CG2 ILE B 32 -6.605 -0.675 2.711 1.00 0.00 C ATOM 1854 CD1 ILE B 32 -5.520 1.864 4.383 1.00 0.00 C ATOM 0 H ILE B 32 -8.757 0.584 5.914 1.00 0.00 H new ATOM 0 HA ILE B 32 -9.126 0.112 3.161 1.00 0.00 H new ATOM 0 HB ILE B 32 -6.685 -0.854 4.783 1.00 0.00 H new ATOM 0 HG12 ILE B 32 -7.579 1.870 4.120 1.00 0.00 H new ATOM 0 HG13 ILE B 32 -7.030 1.194 5.641 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -5.522 -0.553 2.720 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -6.851 -1.725 2.553 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -7.031 -0.077 1.905 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -5.544 2.856 4.833 1.00 0.00 H new ATOM 0 HD12 ILE B 32 -4.744 1.267 4.863 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -5.303 1.953 3.319 1.00 0.00 H new ATOM 1866 N THR B 33 -8.803 -2.613 5.147 1.00 0.00 N ATOM 1867 CA THR B 33 -9.176 -4.059 5.207 1.00 0.00 C ATOM 1868 C THR B 33 -10.680 -4.335 4.921 1.00 0.00 C ATOM 1869 O THR B 33 -10.962 -5.367 4.329 1.00 0.00 O ATOM 1870 CB THR B 33 -8.673 -4.739 6.499 1.00 0.00 C ATOM 1871 OG1 THR B 33 -9.001 -6.125 6.525 1.00 0.00 O ATOM 1872 CG2 THR B 33 -9.169 -4.074 7.786 1.00 0.00 C ATOM 0 H THR B 33 -8.367 -2.250 5.995 1.00 0.00 H new ATOM 0 HA THR B 33 -8.647 -4.532 4.379 1.00 0.00 H new ATOM 0 HB THR B 33 -7.590 -4.618 6.472 1.00 0.00 H new ATOM 0 HG1 THR B 33 -8.667 -6.525 7.355 1.00 0.00 H new ATOM 0 HG21 THR B 33 -8.773 -4.610 8.648 1.00 0.00 H new ATOM 0 HG22 THR B 33 -8.830 -3.039 7.815 1.00 0.00 H new ATOM 0 HG23 THR B 33 -10.258 -4.100 7.812 1.00 0.00 H new ATOM 1880 N GLU B 34 -11.615 -3.439 5.297 1.00 0.00 N ATOM 1881 CA GLU B 34 -13.022 -3.503 4.816 1.00 0.00 C ATOM 1882 C GLU B 34 -13.155 -3.152 3.297 1.00 0.00 C ATOM 1883 O GLU B 34 -14.034 -3.720 2.649 1.00 0.00 O ATOM 1884 CB GLU B 34 -13.935 -2.618 5.713 1.00 0.00 C ATOM 1885 CG GLU B 34 -14.531 -3.313 6.959 1.00 0.00 C ATOM 1886 CD GLU B 34 -13.528 -3.657 8.066 1.00 0.00 C ATOM 1887 OE1 GLU B 34 -12.906 -4.718 8.110 1.00 0.00 O ATOM 1888 OE2 GLU B 34 -13.412 -2.653 8.992 1.00 0.00 O ATOM 0 H GLU B 34 -11.428 -2.662 5.931 1.00 0.00 H new ATOM 0 HA GLU B 34 -13.360 -4.536 4.904 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -13.360 -1.753 6.043 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -14.756 -2.241 5.103 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -15.302 -2.668 7.379 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -15.023 -4.232 6.640 1.00 0.00 H new ATOM 1896 N ALA B 35 -12.310 -2.262 2.721 1.00 0.00 N ATOM 1897 CA ALA B 35 -12.221 -2.049 1.253 1.00 0.00 C ATOM 1898 C ALA B 35 -11.713 -3.319 0.514 1.00 0.00 C ATOM 1899 O ALA B 35 -12.436 -3.896 -0.290 1.00 0.00 O ATOM 1900 CB ALA B 35 -11.317 -0.819 0.910 1.00 0.00 C ATOM 0 H ALA B 35 -11.673 -1.673 3.258 1.00 0.00 H new ATOM 0 HA ALA B 35 -13.232 -1.841 0.902 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -11.273 -0.690 -0.171 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -11.736 0.079 1.365 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -10.312 -0.987 1.297 1.00 0.00 H new ATOM 1906 N LEU B 36 -10.511 -3.791 0.859 1.00 0.00 N ATOM 1907 CA LEU B 36 -9.815 -4.970 0.290 1.00 0.00 C ATOM 1908 C LEU B 36 -10.640 -6.250 0.449 1.00 0.00 C ATOM 1909 O LEU B 36 -10.950 -6.893 -0.556 1.00 0.00 O ATOM 1910 CB LEU B 36 -8.401 -5.018 0.921 1.00 0.00 C ATOM 1911 CG LEU B 36 -7.633 -3.628 0.838 1.00 0.00 C ATOM 1912 CD1 LEU B 36 -6.167 -3.758 1.195 1.00 0.00 C ATOM 1913 CD2 LEU B 36 -7.832 -2.475 -0.204 1.00 0.00 C ATOM 0 H LEU B 36 -9.957 -3.339 1.586 1.00 0.00 H new ATOM 0 HA LEU B 36 -9.700 -4.883 -0.790 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -8.486 -5.318 1.966 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -7.811 -5.783 0.417 1.00 0.00 H new ATOM 0 HG LEU B 36 -8.322 -3.197 1.564 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -5.687 -2.782 1.123 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -6.073 -4.135 2.213 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -5.685 -4.451 0.506 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -7.146 -1.659 0.021 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -7.631 -2.852 -1.207 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -8.858 -2.111 -0.152 1.00 0.00 H new ATOM 1925 N ARG B 37 -11.084 -6.565 1.684 1.00 0.00 N ATOM 1926 CA ARG B 37 -11.983 -7.705 1.912 1.00 0.00 C ATOM 1927 C ARG B 37 -13.331 -7.634 1.120 1.00 0.00 C ATOM 1928 O ARG B 37 -13.826 -8.693 0.723 1.00 0.00 O ATOM 1929 CB ARG B 37 -12.247 -7.821 3.430 1.00 0.00 C ATOM 1930 CG ARG B 37 -13.061 -9.021 3.946 1.00 0.00 C ATOM 1931 CD ARG B 37 -13.404 -8.803 5.430 1.00 0.00 C ATOM 1932 NE ARG B 37 -14.029 -10.006 6.035 1.00 0.00 N ATOM 1933 CZ ARG B 37 -13.451 -10.808 6.952 1.00 0.00 C ATOM 1934 NH1 ARG B 37 -12.231 -10.618 7.452 1.00 0.00 N ATOM 1935 NH2 ARG B 37 -14.138 -11.850 7.383 1.00 0.00 N ATOM 0 H ARG B 37 -10.835 -6.049 2.528 1.00 0.00 H new ATOM 0 HA ARG B 37 -11.482 -8.594 1.529 1.00 0.00 H new ATOM 0 HB2 ARG B 37 -11.281 -7.835 3.934 1.00 0.00 H new ATOM 0 HB3 ARG B 37 -12.759 -6.913 3.747 1.00 0.00 H new ATOM 0 HG2 ARG B 37 -13.975 -9.133 3.362 1.00 0.00 H new ATOM 0 HG3 ARG B 37 -12.490 -9.942 3.824 1.00 0.00 H new ATOM 0 HD2 ARG B 37 -12.497 -8.550 5.979 1.00 0.00 H new ATOM 0 HD3 ARG B 37 -14.082 -7.955 5.525 1.00 0.00 H new ATOM 0 HE ARG B 37 -14.973 -10.246 5.732 1.00 0.00 H new ATOM 0 HH11 ARG B 37 -11.671 -9.824 7.142 1.00 0.00 H new ATOM 0 HH12 ARG B 37 -11.857 -11.267 8.144 1.00 0.00 H new ATOM 0 HH21 ARG B 37 -15.076 -12.027 7.022 1.00 0.00 H new ATOM 0 HH22 ARG B 37 -13.731 -12.478 8.077 1.00 0.00 H new ATOM 1948 N LYS B 38 -13.903 -6.421 0.900 1.00 0.00 N ATOM 1949 CA LYS B 38 -15.199 -6.277 0.176 1.00 0.00 C ATOM 1950 C LYS B 38 -15.072 -5.869 -1.338 1.00 0.00 C ATOM 1951 O LYS B 38 -16.065 -5.440 -1.933 1.00 0.00 O ATOM 1952 CB LYS B 38 -16.081 -5.299 1.008 1.00 0.00 C ATOM 1953 CG LYS B 38 -17.611 -5.414 0.812 1.00 0.00 C ATOM 1954 CD LYS B 38 -18.439 -4.365 1.593 1.00 0.00 C ATOM 1955 CE LYS B 38 -18.384 -4.425 3.136 1.00 0.00 C ATOM 1956 NZ LYS B 38 -18.981 -5.653 3.696 1.00 0.00 N ATOM 0 H LYS B 38 -13.495 -5.538 1.208 1.00 0.00 H new ATOM 0 HA LYS B 38 -15.674 -7.256 0.105 1.00 0.00 H new ATOM 0 HB2 LYS B 38 -15.860 -5.454 2.064 1.00 0.00 H new ATOM 0 HB3 LYS B 38 -15.782 -4.279 0.766 1.00 0.00 H new ATOM 0 HG2 LYS B 38 -17.837 -5.319 -0.250 1.00 0.00 H new ATOM 0 HG3 LYS B 38 -17.930 -6.411 1.117 1.00 0.00 H new ATOM 0 HD2 LYS B 38 -18.108 -3.374 1.282 1.00 0.00 H new ATOM 0 HD3 LYS B 38 -19.481 -4.463 1.289 1.00 0.00 H new ATOM 0 HE2 LYS B 38 -17.345 -4.355 3.458 1.00 0.00 H new ATOM 0 HE3 LYS B 38 -18.903 -3.558 3.545 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 -18.912 -5.631 4.733 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 -19.981 -5.711 3.417 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 -18.471 -6.484 3.333 1.00 0.00 H new ATOM 1969 N GLY B 39 -13.891 -6.011 -1.984 1.00 0.00 N ATOM 1970 CA GLY B 39 -13.680 -5.574 -3.393 1.00 0.00 C ATOM 1971 C GLY B 39 -13.852 -4.059 -3.696 1.00 0.00 C ATOM 1972 O GLY B 39 -14.520 -3.704 -4.670 1.00 0.00 O ATOM 0 H GLY B 39 -13.064 -6.426 -1.554 1.00 0.00 H new ATOM 0 HA2 GLY B 39 -12.673 -5.867 -3.691 1.00 0.00 H new ATOM 0 HA3 GLY B 39 -14.374 -6.127 -4.027 1.00 0.00 H new ATOM 1976 N ASP B 40 -13.237 -3.198 -2.866 1.00 0.00 N ATOM 1977 CA ASP B 40 -13.359 -1.714 -2.957 1.00 0.00 C ATOM 1978 C ASP B 40 -11.981 -1.014 -3.090 1.00 0.00 C ATOM 1979 O ASP B 40 -10.969 -1.450 -2.527 1.00 0.00 O ATOM 1980 CB ASP B 40 -14.198 -1.076 -1.814 1.00 0.00 C ATOM 1981 CG ASP B 40 -15.570 -1.700 -1.492 1.00 0.00 C ATOM 1982 OD1 ASP B 40 -16.379 -2.050 -2.352 1.00 0.00 O ATOM 1983 OD2 ASP B 40 -15.784 -1.812 -0.143 1.00 0.00 O ATOM 0 H ASP B 40 -12.634 -3.505 -2.103 1.00 0.00 H new ATOM 0 HA ASP B 40 -13.917 -1.541 -3.877 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -13.598 -1.101 -0.905 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -14.358 -0.027 -2.062 1.00 0.00 H new ATOM 1989 N LYS B 41 -11.985 0.108 -3.839 1.00 0.00 N ATOM 1990 CA LYS B 41 -10.800 0.985 -3.994 1.00 0.00 C ATOM 1991 C LYS B 41 -10.811 2.027 -2.842 1.00 0.00 C ATOM 1992 O LYS B 41 -11.847 2.588 -2.462 1.00 0.00 O ATOM 1993 CB LYS B 41 -10.756 1.764 -5.335 1.00 0.00 C ATOM 1994 CG LYS B 41 -10.828 0.925 -6.628 1.00 0.00 C ATOM 1995 CD LYS B 41 -10.644 1.792 -7.890 1.00 0.00 C ATOM 1996 CE LYS B 41 -10.801 0.991 -9.194 1.00 0.00 C ATOM 1997 NZ LYS B 41 -10.583 1.842 -10.377 1.00 0.00 N ATOM 0 H LYS B 41 -12.804 0.433 -4.352 1.00 0.00 H new ATOM 0 HA LYS B 41 -9.927 0.333 -3.974 1.00 0.00 H new ATOM 0 HB2 LYS B 41 -11.584 2.473 -5.343 1.00 0.00 H new ATOM 0 HB3 LYS B 41 -9.836 2.348 -5.359 1.00 0.00 H new ATOM 0 HG2 LYS B 41 -10.059 0.153 -6.603 1.00 0.00 H new ATOM 0 HG3 LYS B 41 -11.790 0.414 -6.676 1.00 0.00 H new ATOM 0 HD2 LYS B 41 -11.373 2.603 -7.877 1.00 0.00 H new ATOM 0 HD3 LYS B 41 -9.656 2.251 -7.868 1.00 0.00 H new ATOM 0 HE2 LYS B 41 -10.091 0.164 -9.203 1.00 0.00 H new ATOM 0 HE3 LYS B 41 -11.799 0.554 -9.237 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 -10.696 1.273 -11.240 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 -11.277 2.617 -10.380 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 -9.622 2.238 -10.347 1.00 0.00 H new ATOM 2010 N VAL B 42 -9.607 2.336 -2.358 1.00 0.00 N ATOM 2011 CA VAL B 42 -9.359 3.261 -1.246 1.00 0.00 C ATOM 2012 C VAL B 42 -9.085 4.612 -1.962 1.00 0.00 C ATOM 2013 O VAL B 42 -9.933 5.074 -2.735 1.00 0.00 O ATOM 2014 CB VAL B 42 -8.302 2.429 -0.420 1.00 0.00 C ATOM 2015 CG1 VAL B 42 -7.850 3.054 0.879 1.00 0.00 C ATOM 2016 CG2 VAL B 42 -8.841 1.075 0.103 1.00 0.00 C ATOM 0 H VAL B 42 -8.749 1.938 -2.740 1.00 0.00 H new ATOM 0 HA VAL B 42 -10.088 3.571 -0.497 1.00 0.00 H new ATOM 0 HB VAL B 42 -7.509 2.356 -1.164 1.00 0.00 H new ATOM 0 HG11 VAL B 42 -7.126 2.400 1.365 1.00 0.00 H new ATOM 0 HG12 VAL B 42 -7.388 4.020 0.677 1.00 0.00 H new ATOM 0 HG13 VAL B 42 -8.710 3.193 1.534 1.00 0.00 H new ATOM 0 HG21 VAL B 42 -8.057 0.562 0.660 1.00 0.00 H new ATOM 0 HG22 VAL B 42 -9.695 1.251 0.757 1.00 0.00 H new ATOM 0 HG23 VAL B 42 -9.151 0.457 -0.740 1.00 0.00 H new ATOM 2026 N GLN B 43 -8.042 5.314 -1.540 1.00 0.00 N ATOM 2027 CA GLN B 43 -7.422 6.475 -2.246 1.00 0.00 C ATOM 2028 C GLN B 43 -6.551 7.371 -1.319 1.00 0.00 C ATOM 2029 O GLN B 43 -6.949 7.712 -0.205 1.00 0.00 O ATOM 2030 CB GLN B 43 -8.151 7.218 -3.410 1.00 0.00 C ATOM 2031 CG GLN B 43 -8.090 6.417 -4.728 1.00 0.00 C ATOM 2032 CD GLN B 43 -8.883 7.029 -5.891 1.00 0.00 C ATOM 2033 OE1 GLN B 43 -8.634 8.158 -6.315 1.00 0.00 O ATOM 2034 NE2 GLN B 43 -9.840 6.295 -6.441 1.00 0.00 N ATOM 0 H GLN B 43 -7.570 5.097 -0.662 1.00 0.00 H new ATOM 0 HA GLN B 43 -6.762 5.913 -2.907 1.00 0.00 H new ATOM 0 HB2 GLN B 43 -9.192 7.389 -3.136 1.00 0.00 H new ATOM 0 HB3 GLN B 43 -7.695 8.197 -3.558 1.00 0.00 H new ATOM 0 HG2 GLN B 43 -7.047 6.320 -5.029 1.00 0.00 H new ATOM 0 HG3 GLN B 43 -8.464 5.410 -4.542 1.00 0.00 H new ATOM 0 HE21 GLN B 43 -10.037 5.361 -6.081 1.00 0.00 H new ATOM 0 HE22 GLN B 43 -10.379 6.664 -7.224 1.00 0.00 H new ATOM 2043 N LEU B 44 -5.369 7.779 -1.806 1.00 0.00 N ATOM 2044 CA LEU B 44 -4.443 8.713 -1.118 1.00 0.00 C ATOM 2045 C LEU B 44 -3.854 9.543 -2.298 1.00 0.00 C ATOM 2046 O LEU B 44 -3.044 9.033 -3.075 1.00 0.00 O ATOM 2047 CB LEU B 44 -3.347 8.020 -0.254 1.00 0.00 C ATOM 2048 CG LEU B 44 -3.827 6.931 0.750 1.00 0.00 C ATOM 2049 CD1 LEU B 44 -3.755 5.500 0.175 1.00 0.00 C ATOM 2050 CD2 LEU B 44 -3.068 6.989 2.086 1.00 0.00 C ATOM 0 H LEU B 44 -5.015 7.465 -2.710 1.00 0.00 H new ATOM 0 HA LEU B 44 -4.956 9.320 -0.371 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -2.621 7.564 -0.928 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -2.820 8.791 0.308 1.00 0.00 H new ATOM 0 HG LEU B 44 -4.876 7.165 0.933 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -4.103 4.789 0.924 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -4.386 5.432 -0.711 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -2.725 5.268 -0.095 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -3.441 6.209 2.750 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -2.004 6.835 1.907 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -3.221 7.964 2.549 1.00 0.00 H new ATOM 2062 N ILE B 45 -4.267 10.812 -2.479 1.00 0.00 N ATOM 2063 CA ILE B 45 -3.926 11.615 -3.704 1.00 0.00 C ATOM 2064 C ILE B 45 -2.465 11.937 -4.114 1.00 0.00 C ATOM 2065 O ILE B 45 -2.099 11.900 -5.295 1.00 0.00 O ATOM 2066 CB ILE B 45 -4.976 12.757 -3.903 1.00 0.00 C ATOM 2067 CG1 ILE B 45 -5.040 13.366 -5.331 1.00 0.00 C ATOM 2068 CG2 ILE B 45 -4.799 13.882 -2.862 1.00 0.00 C ATOM 2069 CD1 ILE B 45 -5.518 12.403 -6.429 1.00 0.00 C ATOM 0 H ILE B 45 -4.838 11.317 -1.801 1.00 0.00 H new ATOM 0 HA ILE B 45 -4.007 10.864 -4.490 1.00 0.00 H new ATOM 0 HB ILE B 45 -5.932 12.255 -3.753 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -5.705 14.229 -5.312 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -4.049 13.733 -5.597 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -5.546 14.657 -3.033 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -4.923 13.473 -1.859 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -3.802 14.312 -2.957 1.00 0.00 H new ATOM 0 HD11 ILE B 45 -5.528 12.921 -7.388 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -4.842 11.550 -6.485 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -6.524 12.054 -6.194 1.00 0.00 H new ATOM 2081 N GLY B 46 -1.681 12.233 -3.107 1.00 0.00 N ATOM 2082 CA GLY B 46 -0.211 12.391 -3.257 1.00 0.00 C ATOM 2083 C GLY B 46 0.623 11.201 -2.724 1.00 0.00 C ATOM 2084 O GLY B 46 1.742 11.434 -2.256 1.00 0.00 O ATOM 0 H GLY B 46 -2.018 12.376 -2.155 1.00 0.00 H new ATOM 0 HA2 GLY B 46 0.020 12.535 -4.312 1.00 0.00 H new ATOM 0 HA3 GLY B 46 0.099 13.297 -2.736 1.00 0.00 H new ATOM 2088 N PHE B 47 0.117 9.943 -2.808 1.00 0.00 N ATOM 2089 CA PHE B 47 0.758 8.779 -2.148 1.00 0.00 C ATOM 2090 C PHE B 47 0.354 7.355 -2.645 1.00 0.00 C ATOM 2091 O PHE B 47 1.236 6.494 -2.703 1.00 0.00 O ATOM 2092 CB PHE B 47 0.402 8.896 -0.632 1.00 0.00 C ATOM 2093 CG PHE B 47 1.245 7.991 0.278 1.00 0.00 C ATOM 2094 CD1 PHE B 47 2.592 8.281 0.518 1.00 0.00 C ATOM 2095 CD2 PHE B 47 0.721 6.759 0.691 1.00 0.00 C ATOM 2096 CE1 PHE B 47 3.410 7.326 1.111 1.00 0.00 C ATOM 2097 CE2 PHE B 47 1.549 5.814 1.287 1.00 0.00 C ATOM 2098 CZ PHE B 47 2.897 6.089 1.462 1.00 0.00 C ATOM 0 H PHE B 47 -0.731 9.711 -3.325 1.00 0.00 H new ATOM 0 HA PHE B 47 1.820 8.840 -2.388 1.00 0.00 H new ATOM 0 HB2 PHE B 47 0.531 9.932 -0.318 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -0.651 8.651 -0.496 1.00 0.00 H new ATOM 0 HD1 PHE B 47 2.996 9.244 0.243 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -0.327 6.543 0.546 1.00 0.00 H new ATOM 0 HE1 PHE B 47 4.450 7.550 1.299 1.00 0.00 H new ATOM 0 HE2 PHE B 47 1.143 4.868 1.613 1.00 0.00 H new ATOM 0 HZ PHE B 47 3.550 5.334 1.874 1.00 0.00 H new ATOM 2108 N GLY B 48 -0.942 7.072 -2.883 1.00 0.00 N ATOM 2109 CA GLY B 48 -1.409 5.708 -3.170 1.00 0.00 C ATOM 2110 C GLY B 48 -2.879 5.488 -3.542 1.00 0.00 C ATOM 2111 O GLY B 48 -3.672 6.408 -3.744 1.00 0.00 O ATOM 0 H GLY B 48 -1.682 7.774 -2.881 1.00 0.00 H new ATOM 0 HA2 GLY B 48 -0.801 5.317 -3.986 1.00 0.00 H new ATOM 0 HA3 GLY B 48 -1.197 5.096 -2.293 1.00 0.00 H new ATOM 2115 N ASN B 49 -3.189 4.193 -3.677 1.00 0.00 N ATOM 2116 CA ASN B 49 -4.551 3.690 -3.974 1.00 0.00 C ATOM 2117 C ASN B 49 -4.482 2.169 -3.698 1.00 0.00 C ATOM 2118 O ASN B 49 -3.972 1.403 -4.524 1.00 0.00 O ATOM 2119 CB ASN B 49 -5.043 4.003 -5.422 1.00 0.00 C ATOM 2120 CG ASN B 49 -6.462 3.511 -5.803 1.00 0.00 C ATOM 2121 OD1 ASN B 49 -7.224 2.970 -4.999 1.00 0.00 O ATOM 2122 ND2 ASN B 49 -6.846 3.704 -7.054 1.00 0.00 N ATOM 0 H ASN B 49 -2.497 3.449 -3.583 1.00 0.00 H new ATOM 0 HA ASN B 49 -5.289 4.194 -3.350 1.00 0.00 H new ATOM 0 HB2 ASN B 49 -5.009 5.083 -5.566 1.00 0.00 H new ATOM 0 HB3 ASN B 49 -4.333 3.565 -6.123 1.00 0.00 H new ATOM 0 HD21 ASN B 49 -7.774 3.405 -7.355 1.00 0.00 H new ATOM 0 HD22 ASN B 49 -6.214 4.152 -7.718 1.00 0.00 H new ATOM 2129 N PHE B 50 -5.016 1.726 -2.545 1.00 0.00 N ATOM 2130 CA PHE B 50 -5.085 0.278 -2.228 1.00 0.00 C ATOM 2131 C PHE B 50 -6.330 -0.321 -2.915 1.00 0.00 C ATOM 2132 O PHE B 50 -7.437 0.222 -2.825 1.00 0.00 O ATOM 2133 CB PHE B 50 -5.213 -0.096 -0.733 1.00 0.00 C ATOM 2134 CG PHE B 50 -4.132 0.316 0.241 1.00 0.00 C ATOM 2135 CD1 PHE B 50 -4.068 1.644 0.671 1.00 0.00 C ATOM 2136 CD2 PHE B 50 -3.352 -0.660 0.871 1.00 0.00 C ATOM 2137 CE1 PHE B 50 -3.169 2.010 1.663 1.00 0.00 C ATOM 2138 CE2 PHE B 50 -2.462 -0.289 1.870 1.00 0.00 C ATOM 2139 CZ PHE B 50 -2.353 1.045 2.236 1.00 0.00 C ATOM 0 H PHE B 50 -5.402 2.335 -1.824 1.00 0.00 H new ATOM 0 HA PHE B 50 -4.130 -0.114 -2.577 1.00 0.00 H new ATOM 0 HB2 PHE B 50 -6.152 0.323 -0.372 1.00 0.00 H new ATOM 0 HB3 PHE B 50 -5.305 -1.181 -0.676 1.00 0.00 H new ATOM 0 HD1 PHE B 50 -4.718 2.386 0.231 1.00 0.00 H new ATOM 0 HD2 PHE B 50 -3.442 -1.697 0.582 1.00 0.00 H new ATOM 0 HE1 PHE B 50 -3.105 3.038 1.987 1.00 0.00 H new ATOM 0 HE2 PHE B 50 -1.856 -1.036 2.361 1.00 0.00 H new ATOM 0 HZ PHE B 50 -1.623 1.336 2.977 1.00 0.00 H new ATOM 2149 N GLU B 51 -6.136 -1.466 -3.575 1.00 0.00 N ATOM 2150 CA GLU B 51 -7.252 -2.203 -4.207 1.00 0.00 C ATOM 2151 C GLU B 51 -6.868 -3.682 -4.400 1.00 0.00 C ATOM 2152 O GLU B 51 -5.698 -4.047 -4.547 1.00 0.00 O ATOM 2153 CB GLU B 51 -7.779 -1.521 -5.507 1.00 0.00 C ATOM 2154 CG GLU B 51 -6.767 -1.380 -6.669 1.00 0.00 C ATOM 2155 CD GLU B 51 -7.347 -0.631 -7.868 1.00 0.00 C ATOM 2156 OE1 GLU B 51 -7.234 0.583 -8.028 1.00 0.00 O ATOM 2157 OE2 GLU B 51 -8.005 -1.468 -8.732 1.00 0.00 O ATOM 0 H GLU B 51 -5.224 -1.907 -3.690 1.00 0.00 H new ATOM 0 HA GLU B 51 -8.104 -2.171 -3.527 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -8.636 -2.090 -5.868 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -8.142 -0.527 -5.248 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -5.881 -0.855 -6.312 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -6.444 -2.371 -6.987 1.00 0.00 H new ATOM 2165 N VAL B 52 -7.893 -4.542 -4.421 1.00 0.00 N ATOM 2166 CA VAL B 52 -7.727 -5.999 -4.441 1.00 0.00 C ATOM 2167 C VAL B 52 -7.663 -6.579 -5.898 1.00 0.00 C ATOM 2168 O VAL B 52 -8.047 -5.902 -6.861 1.00 0.00 O ATOM 2169 CB VAL B 52 -8.883 -6.447 -3.468 1.00 0.00 C ATOM 2170 CG1 VAL B 52 -10.096 -7.008 -4.210 1.00 0.00 C ATOM 2171 CG2 VAL B 52 -8.346 -7.336 -2.341 1.00 0.00 C ATOM 0 H VAL B 52 -8.868 -4.243 -4.425 1.00 0.00 H new ATOM 0 HA VAL B 52 -6.776 -6.400 -4.090 1.00 0.00 H new ATOM 0 HB VAL B 52 -9.273 -5.557 -2.974 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -10.860 -7.300 -3.490 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -10.499 -6.246 -4.877 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -9.795 -7.878 -4.793 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -9.167 -7.629 -1.686 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -7.887 -8.227 -2.768 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -7.602 -6.785 -1.766 1.00 0.00 H new ATOM 2181 N ARG B 53 -7.212 -7.846 -6.046 1.00 0.00 N ATOM 2182 CA ARG B 53 -7.163 -8.512 -7.381 1.00 0.00 C ATOM 2183 C ARG B 53 -7.691 -9.964 -7.280 1.00 0.00 C ATOM 2184 O ARG B 53 -6.971 -10.861 -6.837 1.00 0.00 O ATOM 2185 CB ARG B 53 -5.732 -8.474 -8.004 1.00 0.00 C ATOM 2186 CG ARG B 53 -5.650 -8.424 -9.545 1.00 0.00 C ATOM 2187 CD ARG B 53 -6.194 -7.151 -10.229 1.00 0.00 C ATOM 2188 NE ARG B 53 -5.447 -5.926 -9.835 1.00 0.00 N ATOM 2189 CZ ARG B 53 -5.989 -4.705 -9.665 1.00 0.00 C ATOM 2190 NH1 ARG B 53 -7.280 -4.430 -9.840 1.00 0.00 N ATOM 2191 NH2 ARG B 53 -5.189 -3.719 -9.304 1.00 0.00 N ATOM 0 H ARG B 53 -6.880 -8.425 -5.275 1.00 0.00 H new ATOM 0 HA ARG B 53 -7.814 -7.952 -8.053 1.00 0.00 H new ATOM 0 HB2 ARG B 53 -5.210 -7.603 -7.607 1.00 0.00 H new ATOM 0 HB3 ARG B 53 -5.188 -9.355 -7.662 1.00 0.00 H new ATOM 0 HG2 ARG B 53 -4.606 -8.546 -9.834 1.00 0.00 H new ATOM 0 HG3 ARG B 53 -6.193 -9.282 -9.942 1.00 0.00 H new ATOM 0 HD2 ARG B 53 -6.140 -7.273 -11.311 1.00 0.00 H new ATOM 0 HD3 ARG B 53 -7.247 -7.028 -9.974 1.00 0.00 H new ATOM 0 HE ARG B 53 -4.443 -6.019 -9.681 1.00 0.00 H new ATOM 0 HH11 ARG B 53 -7.925 -5.169 -10.120 1.00 0.00 H new ATOM 0 HH12 ARG B 53 -7.624 -3.481 -9.694 1.00 0.00 H new ATOM 0 HH21 ARG B 53 -4.194 -3.895 -9.163 1.00 0.00 H new ATOM 0 HH22 ARG B 53 -5.566 -2.781 -9.166 1.00 0.00 H new ATOM 2522 N LYS B 75 -9.278 -12.922 -3.813 1.00 0.00 N ATOM 2523 CA LYS B 75 -8.949 -11.466 -3.810 1.00 0.00 C ATOM 2524 C LYS B 75 -7.588 -11.216 -3.102 1.00 0.00 C ATOM 2525 O LYS B 75 -7.411 -11.562 -1.929 1.00 0.00 O ATOM 2526 CB LYS B 75 -10.051 -10.521 -3.265 1.00 0.00 C ATOM 2527 CG LYS B 75 -11.529 -10.970 -3.375 1.00 0.00 C ATOM 2528 CD LYS B 75 -12.524 -9.818 -3.110 1.00 0.00 C ATOM 2529 CE LYS B 75 -14.005 -10.231 -3.014 1.00 0.00 C ATOM 2530 NZ LYS B 75 -14.323 -10.963 -1.774 1.00 0.00 N ATOM 0 HA LYS B 75 -8.876 -11.197 -4.864 1.00 0.00 H new ATOM 0 HB2 LYS B 75 -9.838 -10.336 -2.212 1.00 0.00 H new ATOM 0 HB3 LYS B 75 -9.955 -9.566 -3.782 1.00 0.00 H new ATOM 0 HG2 LYS B 75 -11.708 -11.377 -4.370 1.00 0.00 H new ATOM 0 HG3 LYS B 75 -11.714 -11.775 -2.664 1.00 0.00 H new ATOM 0 HD2 LYS B 75 -12.242 -9.324 -2.181 1.00 0.00 H new ATOM 0 HD3 LYS B 75 -12.421 -9.081 -3.907 1.00 0.00 H new ATOM 0 HE2 LYS B 75 -14.629 -9.339 -3.072 1.00 0.00 H new ATOM 0 HE3 LYS B 75 -14.258 -10.854 -3.872 1.00 0.00 H new ATOM 0 HZ1 LYS B 75 -15.320 -11.258 -1.791 1.00 0.00 H new ATOM 0 HZ2 LYS B 75 -13.715 -11.804 -1.701 1.00 0.00 H new ATOM 0 HZ3 LYS B 75 -14.158 -10.345 -0.954 1.00 0.00 H new ATOM 2543 N VAL B 76 -6.650 -10.595 -3.833 1.00 0.00 N ATOM 2544 CA VAL B 76 -5.252 -10.427 -3.435 1.00 0.00 C ATOM 2545 C VAL B 76 -5.026 -8.933 -3.039 1.00 0.00 C ATOM 2546 O VAL B 76 -5.346 -8.055 -3.840 1.00 0.00 O ATOM 2547 CB VAL B 76 -4.490 -10.951 -4.701 1.00 0.00 C ATOM 2548 CG1 VAL B 76 -3.756 -9.908 -5.538 1.00 0.00 C ATOM 2549 CG2 VAL B 76 -3.565 -12.099 -4.392 1.00 0.00 C ATOM 0 H VAL B 76 -6.854 -10.185 -4.744 1.00 0.00 H new ATOM 0 HA VAL B 76 -4.906 -10.968 -2.554 1.00 0.00 H new ATOM 0 HB VAL B 76 -5.312 -11.296 -5.327 1.00 0.00 H new ATOM 0 HG11 VAL B 76 -3.270 -10.396 -6.383 1.00 0.00 H new ATOM 0 HG12 VAL B 76 -4.468 -9.170 -5.906 1.00 0.00 H new ATOM 0 HG13 VAL B 76 -3.004 -9.412 -4.924 1.00 0.00 H new ATOM 0 HG21 VAL B 76 -3.065 -12.420 -5.306 1.00 0.00 H new ATOM 0 HG22 VAL B 76 -2.820 -11.780 -3.664 1.00 0.00 H new ATOM 0 HG23 VAL B 76 -4.140 -12.930 -3.982 1.00 0.00 H new ATOM 2559 N PRO B 77 -4.441 -8.575 -1.882 1.00 0.00 N ATOM 2560 CA PRO B 77 -4.277 -7.161 -1.486 1.00 0.00 C ATOM 2561 C PRO B 77 -3.001 -6.503 -2.040 1.00 0.00 C ATOM 2562 O PRO B 77 -1.912 -7.085 -2.093 1.00 0.00 O ATOM 2563 CB PRO B 77 -4.260 -7.288 0.042 1.00 0.00 C ATOM 2564 CG PRO B 77 -3.611 -8.654 0.298 1.00 0.00 C ATOM 2565 CD PRO B 77 -4.007 -9.549 -0.882 1.00 0.00 C ATOM 0 HA PRO B 77 -5.056 -6.507 -1.879 1.00 0.00 H new ATOM 0 HB2 PRO B 77 -3.688 -6.483 0.502 1.00 0.00 H new ATOM 0 HB3 PRO B 77 -5.267 -7.241 0.457 1.00 0.00 H new ATOM 0 HG2 PRO B 77 -2.527 -8.562 0.369 1.00 0.00 H new ATOM 0 HG3 PRO B 77 -3.957 -9.078 1.241 1.00 0.00 H new ATOM 0 HD2 PRO B 77 -3.169 -10.149 -1.236 1.00 0.00 H new ATOM 0 HD3 PRO B 77 -4.805 -10.242 -0.616 1.00 0.00 H new ATOM 2573 N ALA B 78 -3.212 -5.247 -2.439 1.00 0.00 N ATOM 2574 CA ALA B 78 -2.187 -4.436 -3.106 1.00 0.00 C ATOM 2575 C ALA B 78 -2.321 -2.939 -2.727 1.00 0.00 C ATOM 2576 O ALA B 78 -3.339 -2.458 -2.219 1.00 0.00 O ATOM 2577 CB ALA B 78 -2.392 -4.704 -4.607 1.00 0.00 C ATOM 0 H ALA B 78 -4.099 -4.761 -2.309 1.00 0.00 H new ATOM 0 HA ALA B 78 -1.174 -4.699 -2.801 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -1.662 -4.133 -5.181 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -2.261 -5.767 -4.808 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -3.398 -4.402 -4.896 1.00 0.00 H new ATOM 2583 N PHE B 79 -1.222 -2.235 -2.997 1.00 0.00 N ATOM 2584 CA PHE B 79 -1.059 -0.782 -2.743 1.00 0.00 C ATOM 2585 C PHE B 79 -0.302 -0.234 -3.990 1.00 0.00 C ATOM 2586 O PHE B 79 0.805 -0.650 -4.351 1.00 0.00 O ATOM 2587 CB PHE B 79 -0.335 -0.529 -1.403 1.00 0.00 C ATOM 2588 CG PHE B 79 0.356 0.836 -1.201 1.00 0.00 C ATOM 2589 CD1 PHE B 79 -0.376 1.962 -0.816 1.00 0.00 C ATOM 2590 CD2 PHE B 79 1.721 0.973 -1.492 1.00 0.00 C ATOM 2591 CE1 PHE B 79 0.245 3.203 -0.725 1.00 0.00 C ATOM 2592 CE2 PHE B 79 2.336 2.219 -1.420 1.00 0.00 C ATOM 2593 CZ PHE B 79 1.595 3.334 -1.045 1.00 0.00 C ATOM 0 H PHE B 79 -0.392 -2.660 -3.410 1.00 0.00 H new ATOM 0 HA PHE B 79 -2.009 -0.261 -2.627 1.00 0.00 H new ATOM 0 HB2 PHE B 79 -1.062 -0.658 -0.601 1.00 0.00 H new ATOM 0 HB3 PHE B 79 0.418 -1.307 -1.278 1.00 0.00 H new ATOM 0 HD1 PHE B 79 -1.428 1.868 -0.588 1.00 0.00 H new ATOM 0 HD2 PHE B 79 2.299 0.105 -1.774 1.00 0.00 H new ATOM 0 HE1 PHE B 79 -0.320 4.066 -0.406 1.00 0.00 H new ATOM 0 HE2 PHE B 79 3.385 2.320 -1.655 1.00 0.00 H new ATOM 0 HZ PHE B 79 2.067 4.304 -1.002 1.00 0.00 H new ATOM 2603 N LYS B 80 -0.945 0.767 -4.574 1.00 0.00 N ATOM 2604 CA LYS B 80 -0.357 1.642 -5.631 1.00 0.00 C ATOM 2605 C LYS B 80 0.540 2.690 -4.932 1.00 0.00 C ATOM 2606 O LYS B 80 0.110 3.229 -3.909 1.00 0.00 O ATOM 2607 CB LYS B 80 -1.474 2.371 -6.426 1.00 0.00 C ATOM 2608 CG LYS B 80 -2.244 1.510 -7.457 1.00 0.00 C ATOM 2609 CD LYS B 80 -1.446 1.026 -8.693 1.00 0.00 C ATOM 2610 CE LYS B 80 -0.820 2.111 -9.598 1.00 0.00 C ATOM 2611 NZ LYS B 80 -1.818 2.964 -10.270 1.00 0.00 N ATOM 0 H LYS B 80 -1.906 1.015 -4.338 1.00 0.00 H new ATOM 0 HA LYS B 80 0.219 1.036 -6.331 1.00 0.00 H new ATOM 0 HB2 LYS B 80 -2.192 2.779 -5.715 1.00 0.00 H new ATOM 0 HB3 LYS B 80 -1.028 3.217 -6.949 1.00 0.00 H new ATOM 0 HG2 LYS B 80 -2.638 0.634 -6.942 1.00 0.00 H new ATOM 0 HG3 LYS B 80 -3.100 2.085 -7.809 1.00 0.00 H new ATOM 0 HD2 LYS B 80 -0.645 0.374 -8.344 1.00 0.00 H new ATOM 0 HD3 LYS B 80 -2.110 0.416 -9.306 1.00 0.00 H new ATOM 0 HE2 LYS B 80 -0.162 2.739 -8.997 1.00 0.00 H new ATOM 0 HE3 LYS B 80 -0.198 1.629 -10.353 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 -1.331 3.669 -10.860 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 -2.431 2.375 -10.869 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 -2.396 3.451 -9.556 1.00 0.00 H new ATOM 2624 N PRO B 81 1.763 3.034 -5.422 1.00 0.00 N ATOM 2625 CA PRO B 81 2.480 4.240 -4.931 1.00 0.00 C ATOM 2626 C PRO B 81 1.929 5.576 -5.561 1.00 0.00 C ATOM 2627 O PRO B 81 2.678 6.539 -5.717 1.00 0.00 O ATOM 2628 CB PRO B 81 3.920 3.869 -5.336 1.00 0.00 C ATOM 2629 CG PRO B 81 3.793 3.047 -6.620 1.00 0.00 C ATOM 2630 CD PRO B 81 2.504 2.259 -6.437 1.00 0.00 C ATOM 0 HA PRO B 81 2.370 4.459 -3.869 1.00 0.00 H new ATOM 0 HB2 PRO B 81 4.522 4.762 -5.502 1.00 0.00 H new ATOM 0 HB3 PRO B 81 4.411 3.294 -4.551 1.00 0.00 H new ATOM 0 HG2 PRO B 81 3.745 3.689 -7.500 1.00 0.00 H new ATOM 0 HG3 PRO B 81 4.648 2.385 -6.754 1.00 0.00 H new ATOM 0 HD2 PRO B 81 1.945 2.183 -7.370 1.00 0.00 H new ATOM 0 HD3 PRO B 81 2.701 1.242 -6.099 1.00 0.00 H new ATOM 2638 N GLY B 82 0.617 5.623 -5.904 1.00 0.00 N ATOM 2639 CA GLY B 82 -0.101 6.743 -6.553 1.00 0.00 C ATOM 2640 C GLY B 82 0.564 7.539 -7.680 1.00 0.00 C ATOM 2641 O GLY B 82 0.106 8.658 -7.925 1.00 0.00 O ATOM 0 H GLY B 82 -0.002 4.833 -5.723 1.00 0.00 H new ATOM 0 HA2 GLY B 82 -1.034 6.342 -6.949 1.00 0.00 H new ATOM 0 HA3 GLY B 82 -0.366 7.453 -5.770 1.00 0.00 H new ATOM 2645 N LYS B 83 1.615 6.975 -8.327 1.00 0.00 N ATOM 2646 CA LYS B 83 2.552 7.743 -9.231 1.00 0.00 C ATOM 2647 C LYS B 83 3.495 8.765 -8.495 1.00 0.00 C ATOM 2648 O LYS B 83 4.703 8.845 -8.718 1.00 0.00 O ATOM 2649 CB LYS B 83 1.853 8.439 -10.436 1.00 0.00 C ATOM 2650 CG LYS B 83 1.991 7.672 -11.767 1.00 0.00 C ATOM 2651 CD LYS B 83 1.264 8.364 -12.937 1.00 0.00 C ATOM 2652 CE LYS B 83 1.406 7.591 -14.261 1.00 0.00 C ATOM 2653 NZ LYS B 83 0.704 8.274 -15.362 1.00 0.00 N ATOM 0 H LYS B 83 1.848 5.985 -8.248 1.00 0.00 H new ATOM 0 HA LYS B 83 3.186 6.949 -9.625 1.00 0.00 H new ATOM 0 HB2 LYS B 83 0.794 8.563 -10.207 1.00 0.00 H new ATOM 0 HB3 LYS B 83 2.271 9.438 -10.559 1.00 0.00 H new ATOM 0 HG2 LYS B 83 3.048 7.569 -12.013 1.00 0.00 H new ATOM 0 HG3 LYS B 83 1.593 6.665 -11.643 1.00 0.00 H new ATOM 0 HD2 LYS B 83 0.207 8.468 -12.693 1.00 0.00 H new ATOM 0 HD3 LYS B 83 1.663 9.371 -13.063 1.00 0.00 H new ATOM 0 HE2 LYS B 83 2.462 7.486 -14.511 1.00 0.00 H new ATOM 0 HE3 LYS B 83 1.005 6.585 -14.141 1.00 0.00 H new ATOM 0 HZ1 LYS B 83 0.819 7.727 -16.239 1.00 0.00 H new ATOM 0 HZ2 LYS B 83 -0.308 8.352 -15.133 1.00 0.00 H new ATOM 0 HZ3 LYS B 83 1.104 9.225 -15.492 1.00 0.00 H new ATOM 2666 N ALA B 84 2.841 9.579 -7.676 1.00 0.00 N ATOM 2667 CA ALA B 84 3.375 10.600 -6.762 1.00 0.00 C ATOM 2668 C ALA B 84 4.482 10.145 -5.788 1.00 0.00 C ATOM 2669 O ALA B 84 5.496 10.839 -5.673 1.00 0.00 O ATOM 2670 CB ALA B 84 2.117 10.991 -5.979 1.00 0.00 C ATOM 0 H ALA B 84 1.823 9.543 -7.625 1.00 0.00 H new ATOM 0 HA ALA B 84 3.877 11.389 -7.322 1.00 0.00 H new ATOM 0 HB1 ALA B 84 2.368 11.759 -5.247 1.00 0.00 H new ATOM 0 HB2 ALA B 84 1.366 11.378 -6.667 1.00 0.00 H new ATOM 0 HB3 ALA B 84 1.722 10.115 -5.465 1.00 0.00 H new ATOM 2676 N LEU B 85 4.295 8.999 -5.090 1.00 0.00 N ATOM 2677 CA LEU B 85 5.366 8.370 -4.306 1.00 0.00 C ATOM 2678 C LEU B 85 6.550 7.921 -5.229 1.00 0.00 C ATOM 2679 O LEU B 85 7.694 8.139 -4.834 1.00 0.00 O ATOM 2680 CB LEU B 85 4.776 7.242 -3.420 1.00 0.00 C ATOM 2681 CG LEU B 85 5.838 6.595 -2.528 1.00 0.00 C ATOM 2682 CD1 LEU B 85 6.321 7.513 -1.407 1.00 0.00 C ATOM 2683 CD2 LEU B 85 5.353 5.249 -1.957 1.00 0.00 C ATOM 0 H LEU B 85 3.408 8.497 -5.059 1.00 0.00 H new ATOM 0 HA LEU B 85 5.805 9.096 -3.622 1.00 0.00 H new ATOM 0 HB2 LEU B 85 3.980 7.650 -2.797 1.00 0.00 H new ATOM 0 HB3 LEU B 85 4.325 6.481 -4.056 1.00 0.00 H new ATOM 0 HG LEU B 85 6.696 6.409 -3.174 1.00 0.00 H new ATOM 0 HD11 LEU B 85 7.073 6.995 -0.811 1.00 0.00 H new ATOM 0 HD12 LEU B 85 6.757 8.414 -1.837 1.00 0.00 H new ATOM 0 HD13 LEU B 85 5.478 7.785 -0.771 1.00 0.00 H new ATOM 0 HD21 LEU B 85 6.133 4.818 -1.329 1.00 0.00 H new ATOM 0 HD22 LEU B 85 4.454 5.409 -1.362 1.00 0.00 H new ATOM 0 HD23 LEU B 85 5.129 4.566 -2.776 1.00 0.00 H new ATOM 2695 N LYS B 86 6.302 7.325 -6.418 1.00 0.00 N ATOM 2696 CA LYS B 86 7.379 7.057 -7.430 1.00 0.00 C ATOM 2697 C LYS B 86 8.242 8.310 -7.825 1.00 0.00 C ATOM 2698 O LYS B 86 9.404 8.139 -8.199 1.00 0.00 O ATOM 2699 CB LYS B 86 6.885 6.314 -8.699 1.00 0.00 C ATOM 2700 CG LYS B 86 6.337 4.895 -8.441 1.00 0.00 C ATOM 2701 CD LYS B 86 5.955 4.091 -9.702 1.00 0.00 C ATOM 2702 CE LYS B 86 4.714 4.616 -10.449 1.00 0.00 C ATOM 2703 NZ LYS B 86 4.374 3.768 -11.604 1.00 0.00 N ATOM 0 H LYS B 86 5.374 7.018 -6.710 1.00 0.00 H new ATOM 0 HA LYS B 86 8.042 6.380 -6.891 1.00 0.00 H new ATOM 0 HB2 LYS B 86 6.105 6.910 -9.172 1.00 0.00 H new ATOM 0 HB3 LYS B 86 7.709 6.247 -9.409 1.00 0.00 H new ATOM 0 HG2 LYS B 86 7.086 4.331 -7.885 1.00 0.00 H new ATOM 0 HG3 LYS B 86 5.458 4.975 -7.802 1.00 0.00 H new ATOM 0 HD2 LYS B 86 6.802 4.092 -10.388 1.00 0.00 H new ATOM 0 HD3 LYS B 86 5.778 3.054 -9.416 1.00 0.00 H new ATOM 0 HE2 LYS B 86 3.867 4.655 -9.764 1.00 0.00 H new ATOM 0 HE3 LYS B 86 4.897 5.636 -10.788 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 3.534 4.153 -12.082 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 5.173 3.751 -12.269 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 4.174 2.801 -11.278 1.00 0.00 H new ATOM 2716 N ASP B 87 7.692 9.537 -7.713 1.00 0.00 N ATOM 2717 CA ASP B 87 8.421 10.815 -7.851 1.00 0.00 C ATOM 2718 C ASP B 87 9.278 11.169 -6.593 1.00 0.00 C ATOM 2719 O ASP B 87 10.428 11.581 -6.768 1.00 0.00 O ATOM 2720 CB ASP B 87 7.327 11.874 -8.152 1.00 0.00 C ATOM 2721 CG ASP B 87 7.609 12.707 -9.406 1.00 0.00 C ATOM 2722 OD1 ASP B 87 8.139 13.817 -9.375 1.00 0.00 O ATOM 2723 OD2 ASP B 87 7.209 12.070 -10.552 1.00 0.00 O ATOM 0 H ASP B 87 6.700 9.670 -7.518 1.00 0.00 H new ATOM 0 HA ASP B 87 9.159 10.765 -8.651 1.00 0.00 H new ATOM 0 HB2 ASP B 87 6.368 11.370 -8.269 1.00 0.00 H new ATOM 0 HB3 ASP B 87 7.234 12.542 -7.296 1.00 0.00 H new ATOM 2729 N ALA B 88 8.738 11.014 -5.352 1.00 0.00 N ATOM 2730 CA ALA B 88 9.526 11.126 -4.083 1.00 0.00 C ATOM 2731 C ALA B 88 10.843 10.293 -4.079 1.00 0.00 C ATOM 2732 O ALA B 88 11.936 10.802 -3.829 1.00 0.00 O ATOM 2733 CB ALA B 88 8.686 10.597 -2.876 1.00 0.00 C ATOM 0 H ALA B 88 7.751 10.809 -5.199 1.00 0.00 H new ATOM 0 HA ALA B 88 9.770 12.185 -4.002 1.00 0.00 H new ATOM 0 HB1 ALA B 88 9.270 10.684 -1.960 1.00 0.00 H new ATOM 0 HB2 ALA B 88 7.774 11.186 -2.782 1.00 0.00 H new ATOM 0 HB3 ALA B 88 8.427 9.551 -3.043 1.00 0.00 H new ATOM 2739 N VAL B 89 10.668 9.012 -4.424 1.00 0.00 N ATOM 2740 CA VAL B 89 11.662 7.939 -4.330 1.00 0.00 C ATOM 2741 C VAL B 89 12.572 7.684 -5.588 1.00 0.00 C ATOM 2742 O VAL B 89 13.381 6.751 -5.559 1.00 0.00 O ATOM 2743 CB VAL B 89 10.635 6.806 -3.950 1.00 0.00 C ATOM 2744 CG1 VAL B 89 9.980 6.154 -5.171 1.00 0.00 C ATOM 2745 CG2 VAL B 89 11.240 5.758 -3.058 1.00 0.00 C ATOM 0 H VAL B 89 9.779 8.679 -4.797 1.00 0.00 H new ATOM 0 HA VAL B 89 12.492 8.104 -3.643 1.00 0.00 H new ATOM 0 HB VAL B 89 9.848 7.313 -3.391 1.00 0.00 H new ATOM 0 HG11 VAL B 89 9.284 5.383 -4.842 1.00 0.00 H new ATOM 0 HG12 VAL B 89 9.441 6.910 -5.742 1.00 0.00 H new ATOM 0 HG13 VAL B 89 10.749 5.705 -5.800 1.00 0.00 H new ATOM 0 HG21 VAL B 89 10.491 5.001 -2.826 1.00 0.00 H new ATOM 0 HG22 VAL B 89 12.083 5.290 -3.566 1.00 0.00 H new ATOM 0 HG23 VAL B 89 11.585 6.222 -2.134 1.00 0.00 H new ATOM 2755 N LYS B 90 12.443 8.495 -6.663 1.00 0.00 N ATOM 2756 CA LYS B 90 13.155 8.312 -7.951 1.00 0.00 C ATOM 2757 C LYS B 90 14.680 8.530 -7.867 1.00 0.00 C ATOM 2758 O LYS B 90 15.166 9.573 -7.427 1.00 0.00 O ATOM 2759 CB LYS B 90 12.482 9.273 -8.974 1.00 0.00 C ATOM 2760 CG LYS B 90 12.522 8.815 -10.448 1.00 0.00 C ATOM 2761 CD LYS B 90 11.510 9.558 -11.352 1.00 0.00 C ATOM 2762 CE LYS B 90 11.840 11.042 -11.605 1.00 0.00 C ATOM 2763 NZ LYS B 90 10.822 11.681 -12.457 1.00 0.00 N ATOM 0 H LYS B 90 11.830 9.310 -6.661 1.00 0.00 H new ATOM 0 HA LYS B 90 13.065 7.272 -8.264 1.00 0.00 H new ATOM 0 HB2 LYS B 90 11.441 9.412 -8.684 1.00 0.00 H new ATOM 0 HB3 LYS B 90 12.965 10.247 -8.902 1.00 0.00 H new ATOM 0 HG2 LYS B 90 13.528 8.967 -10.840 1.00 0.00 H new ATOM 0 HG3 LYS B 90 12.320 7.745 -10.493 1.00 0.00 H new ATOM 0 HD2 LYS B 90 11.455 9.044 -12.311 1.00 0.00 H new ATOM 0 HD3 LYS B 90 10.521 9.492 -10.898 1.00 0.00 H new ATOM 0 HE2 LYS B 90 11.904 11.570 -10.653 1.00 0.00 H new ATOM 0 HE3 LYS B 90 12.818 11.123 -12.080 1.00 0.00 H new ATOM 0 HZ1 LYS B 90 11.073 12.679 -12.609 1.00 0.00 H new ATOM 0 HZ2 LYS B 90 10.780 11.192 -13.374 1.00 0.00 H new ATOM 0 HZ3 LYS B 90 9.894 11.624 -11.991 1.00 0.00 H new