USER MOD reduce.3.24.130724 H: found=0, std=0, add=521, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 521 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 109 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 110 HIS : no HD1:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 168:sc= 0.446 (180deg=0.389) USER MOD Single : A 85 ASN :FLIP amide:sc= -0.0496 F(o=-1.2!,f=-0.05) USER MOD Single : A 88 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot -53:sc= 1.03 USER MOD Single : A 96 SER OG : rot 180:sc= -0.469 USER MOD Single : A 101 TYR OH : rot 180:sc= -0.412 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot -44:sc= 0.769 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot -100:sc= -0.0902 USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 162:sc= -0.0196 (180deg=-0.468) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 THR OG1 : rot 180:sc= -0.0102 USER MOD Single : A 133 LYS NZ :NH3+ 168:sc= -1.77 (180deg=-1.92) USER MOD Single : A 134 LYS NZ :NH3+ 157:sc= -0.0781 (180deg=-0.554) USER MOD Single : A 138 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 139 SER OG : rot 76:sc= -3.3! USER MOD Single : A 142 LYS NZ :NH3+ -161:sc= -0.0314 (180deg=-0.384) USER MOD Single : A 146 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 147 SER OG : rot 76:sc= 0.391 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 16 N ALA A 82 35.606 -0.941 -6.638 1.00 0.00 N ATOM 17 CA ALA A 82 35.353 -2.222 -6.009 1.00 0.00 C ATOM 18 C ALA A 82 33.879 -2.344 -5.645 1.00 0.00 C ATOM 19 O ALA A 82 33.449 -1.895 -4.589 1.00 0.00 O ATOM 20 CB ALA A 82 36.206 -2.359 -4.750 1.00 0.00 C ATOM 0 HA ALA A 82 35.614 -3.016 -6.709 1.00 0.00 H new ATOM 0 HB1 ALA A 82 36.011 -3.324 -4.282 1.00 0.00 H new ATOM 0 HB2 ALA A 82 37.261 -2.291 -5.016 1.00 0.00 H new ATOM 0 HB3 ALA A 82 35.956 -1.560 -4.052 1.00 0.00 H new ATOM 26 N TYR A 83 33.118 -2.972 -6.516 1.00 0.00 N ATOM 27 CA TYR A 83 31.689 -3.167 -6.285 1.00 0.00 C ATOM 28 C TYR A 83 31.454 -3.671 -4.868 1.00 0.00 C ATOM 29 O TYR A 83 30.341 -3.620 -4.352 1.00 0.00 O ATOM 30 CB TYR A 83 31.120 -4.180 -7.293 1.00 0.00 C ATOM 31 CG TYR A 83 31.793 -3.991 -8.632 1.00 0.00 C ATOM 32 CD1 TYR A 83 31.890 -2.711 -9.197 1.00 0.00 C ATOM 33 CD2 TYR A 83 32.325 -5.096 -9.310 1.00 0.00 C ATOM 34 CE1 TYR A 83 32.515 -2.539 -10.436 1.00 0.00 C ATOM 35 CE2 TYR A 83 32.950 -4.923 -10.550 1.00 0.00 C ATOM 36 CZ TYR A 83 33.045 -3.645 -11.112 1.00 0.00 C ATOM 37 OH TYR A 83 33.662 -3.474 -12.335 1.00 0.00 O ATOM 0 H TYR A 83 33.460 -3.360 -7.395 1.00 0.00 H new ATOM 0 HA TYR A 83 31.182 -2.211 -6.416 1.00 0.00 H new ATOM 0 HB2 TYR A 83 31.281 -5.196 -6.933 1.00 0.00 H new ATOM 0 HB3 TYR A 83 30.043 -4.044 -7.393 1.00 0.00 H new ATOM 0 HD1 TYR A 83 31.482 -1.858 -8.675 1.00 0.00 H new ATOM 0 HD2 TYR A 83 32.253 -6.082 -8.875 1.00 0.00 H new ATOM 0 HE1 TYR A 83 32.589 -1.553 -10.871 1.00 0.00 H new ATOM 0 HE2 TYR A 83 33.359 -5.775 -11.073 1.00 0.00 H new ATOM 0 HH TYR A 83 33.975 -4.341 -12.668 1.00 0.00 H new ATOM 47 N LYS A 84 32.517 -4.148 -4.242 1.00 0.00 N ATOM 48 CA LYS A 84 32.419 -4.656 -2.872 1.00 0.00 C ATOM 49 C LYS A 84 32.048 -3.526 -1.919 1.00 0.00 C ATOM 50 O LYS A 84 31.242 -3.704 -1.005 1.00 0.00 O ATOM 51 CB LYS A 84 33.750 -5.279 -2.446 1.00 0.00 C ATOM 52 CG LYS A 84 34.035 -6.504 -3.318 1.00 0.00 C ATOM 53 CD LYS A 84 35.349 -7.149 -2.878 1.00 0.00 C ATOM 54 CE LYS A 84 35.645 -8.362 -3.760 1.00 0.00 C ATOM 55 NZ LYS A 84 36.928 -8.987 -3.330 1.00 0.00 N1+ ATOM 0 H LYS A 84 33.451 -4.197 -4.650 1.00 0.00 H new ATOM 0 HA LYS A 84 31.642 -5.419 -2.836 1.00 0.00 H new ATOM 0 HB2 LYS A 84 34.555 -4.551 -2.547 1.00 0.00 H new ATOM 0 HB3 LYS A 84 33.711 -5.567 -1.395 1.00 0.00 H new ATOM 0 HG2 LYS A 84 33.219 -7.222 -3.233 1.00 0.00 H new ATOM 0 HG3 LYS A 84 34.094 -6.211 -4.366 1.00 0.00 H new ATOM 0 HD2 LYS A 84 36.162 -6.427 -2.950 1.00 0.00 H new ATOM 0 HD3 LYS A 84 35.285 -7.453 -1.833 1.00 0.00 H new ATOM 0 HE2 LYS A 84 34.833 -9.085 -3.687 1.00 0.00 H new ATOM 0 HE3 LYS A 84 35.708 -8.059 -4.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 37.031 -9.917 -3.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 37.722 -8.376 -3.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 36.928 -9.105 -2.297 1.00 0.00 H new ATOM 69 N ASN A 85 32.652 -2.364 -2.136 1.00 0.00 N ATOM 70 CA ASN A 85 32.376 -1.207 -1.280 1.00 0.00 C ATOM 71 C ASN A 85 30.939 -0.734 -1.461 1.00 0.00 C ATOM 72 O ASN A 85 30.228 -0.481 -0.487 1.00 0.00 O ATOM 73 CB ASN A 85 33.340 -0.065 -1.608 1.00 0.00 C ATOM 74 CG ASN A 85 34.747 -0.421 -1.140 1.00 0.00 C ATOM 75 OD1 ASN A 85 34.910 -1.101 -0.038 1.00 0.00 O flip ATOM 76 ND2 ASN A 85 35.727 -0.063 -1.794 1.00 0.00 N flip ATOM 0 H ASN A 85 33.326 -2.194 -2.883 1.00 0.00 H new ATOM 0 HA ASN A 85 32.517 -1.509 -0.242 1.00 0.00 H new ATOM 0 HB2 ASN A 85 33.342 0.124 -2.682 1.00 0.00 H new ATOM 0 HB3 ASN A 85 33.008 0.853 -1.123 1.00 0.00 H new ATOM 0 HD21 ASN A 85 35.599 0.468 -2.655 1.00 0.00 H new ATOM 0 HD22 ASN A 85 36.667 -0.298 -1.475 1.00 0.00 H new ATOM 83 N LEU A 86 30.522 -0.606 -2.713 1.00 0.00 N ATOM 84 CA LEU A 86 29.175 -0.150 -3.010 1.00 0.00 C ATOM 85 C LEU A 86 28.142 -1.105 -2.427 1.00 0.00 C ATOM 86 O LEU A 86 27.138 -0.678 -1.861 1.00 0.00 O ATOM 87 CB LEU A 86 28.989 -0.054 -4.520 1.00 0.00 C ATOM 88 CG LEU A 86 27.566 0.469 -4.847 1.00 0.00 C ATOM 89 CD1 LEU A 86 27.637 1.501 -5.974 1.00 0.00 C ATOM 90 CD2 LEU A 86 26.674 -0.700 -5.287 1.00 0.00 C ATOM 0 H LEU A 86 31.094 -0.810 -3.533 1.00 0.00 H new ATOM 0 HA LEU A 86 29.033 0.832 -2.559 1.00 0.00 H new ATOM 0 HB2 LEU A 86 29.738 0.614 -4.945 1.00 0.00 H new ATOM 0 HB3 LEU A 86 29.140 -1.032 -4.976 1.00 0.00 H new ATOM 0 HG LEU A 86 27.146 0.935 -3.955 1.00 0.00 H new ATOM 0 HD11 LEU A 86 26.634 1.864 -6.199 1.00 0.00 H new ATOM 0 HD12 LEU A 86 28.264 2.336 -5.663 1.00 0.00 H new ATOM 0 HD13 LEU A 86 28.063 1.039 -6.864 1.00 0.00 H new ATOM 0 HD21 LEU A 86 25.675 -0.329 -5.516 1.00 0.00 H new ATOM 0 HD22 LEU A 86 27.100 -1.168 -6.175 1.00 0.00 H new ATOM 0 HD23 LEU A 86 26.613 -1.434 -4.483 1.00 0.00 H new ATOM 102 N LEU A 87 28.393 -2.394 -2.576 1.00 0.00 N ATOM 103 CA LEU A 87 27.472 -3.402 -2.068 1.00 0.00 C ATOM 104 C LEU A 87 27.233 -3.195 -0.579 1.00 0.00 C ATOM 105 O LEU A 87 26.132 -3.420 -0.080 1.00 0.00 O ATOM 106 CB LEU A 87 28.061 -4.797 -2.306 1.00 0.00 C ATOM 107 CG LEU A 87 27.890 -5.181 -3.781 1.00 0.00 C ATOM 108 CD1 LEU A 87 28.828 -6.346 -4.119 1.00 0.00 C ATOM 109 CD2 LEU A 87 26.434 -5.602 -4.054 1.00 0.00 C ATOM 0 H LEU A 87 29.220 -2.768 -3.041 1.00 0.00 H new ATOM 0 HA LEU A 87 26.521 -3.311 -2.593 1.00 0.00 H new ATOM 0 HB2 LEU A 87 29.117 -4.808 -2.037 1.00 0.00 H new ATOM 0 HB3 LEU A 87 27.562 -5.527 -1.669 1.00 0.00 H new ATOM 0 HG LEU A 87 28.135 -4.319 -4.402 1.00 0.00 H new ATOM 0 HD11 LEU A 87 28.706 -6.619 -5.167 1.00 0.00 H new ATOM 0 HD12 LEU A 87 29.860 -6.046 -3.940 1.00 0.00 H new ATOM 0 HD13 LEU A 87 28.585 -7.203 -3.491 1.00 0.00 H new ATOM 0 HD21 LEU A 87 26.324 -5.872 -5.104 1.00 0.00 H new ATOM 0 HD22 LEU A 87 26.180 -6.459 -3.430 1.00 0.00 H new ATOM 0 HD23 LEU A 87 25.766 -4.773 -3.821 1.00 0.00 H new ATOM 121 N GLN A 88 28.268 -2.763 0.124 1.00 0.00 N ATOM 122 CA GLN A 88 28.153 -2.518 1.556 1.00 0.00 C ATOM 123 C GLN A 88 27.292 -1.283 1.815 1.00 0.00 C ATOM 124 O GLN A 88 26.584 -1.212 2.823 1.00 0.00 O ATOM 125 CB GLN A 88 29.542 -2.309 2.163 1.00 0.00 C ATOM 126 CG GLN A 88 30.326 -3.619 2.104 1.00 0.00 C ATOM 127 CD GLN A 88 31.771 -3.386 2.527 1.00 0.00 C ATOM 128 OE1 GLN A 88 32.145 -2.263 2.863 1.00 0.00 O ATOM 129 NE2 GLN A 88 32.609 -4.386 2.534 1.00 0.00 N ATOM 0 H GLN A 88 29.191 -2.576 -0.268 1.00 0.00 H new ATOM 0 HA GLN A 88 27.681 -3.384 2.020 1.00 0.00 H new ATOM 0 HB2 GLN A 88 30.075 -1.529 1.619 1.00 0.00 H new ATOM 0 HB3 GLN A 88 29.452 -1.973 3.196 1.00 0.00 H new ATOM 0 HG2 GLN A 88 29.863 -4.358 2.757 1.00 0.00 H new ATOM 0 HG3 GLN A 88 30.296 -4.024 1.093 1.00 0.00 H new ATOM 0 HE21 GLN A 88 32.296 -5.316 2.255 1.00 0.00 H new ATOM 0 HE22 GLN A 88 33.577 -4.238 2.819 1.00 0.00 H new ATOM 138 N GLU A 89 27.381 -0.298 0.915 1.00 0.00 N ATOM 139 CA GLU A 89 26.618 0.936 1.085 1.00 0.00 C ATOM 140 C GLU A 89 25.118 0.669 1.026 1.00 0.00 C ATOM 141 O GLU A 89 24.369 1.099 1.903 1.00 0.00 O ATOM 142 CB GLU A 89 27.003 1.927 -0.017 1.00 0.00 C ATOM 143 CG GLU A 89 28.472 2.329 0.139 1.00 0.00 C ATOM 144 CD GLU A 89 28.659 3.137 1.417 1.00 0.00 C ATOM 145 OE1 GLU A 89 27.677 3.673 1.904 1.00 0.00 O ATOM 146 OE2 GLU A 89 29.780 3.207 1.892 1.00 0.00 O1- ATOM 0 H GLU A 89 27.963 -0.331 0.078 1.00 0.00 H new ATOM 0 HA GLU A 89 26.853 1.353 2.064 1.00 0.00 H new ATOM 0 HB2 GLU A 89 26.841 1.477 -0.997 1.00 0.00 H new ATOM 0 HB3 GLU A 89 26.367 2.810 0.037 1.00 0.00 H new ATOM 0 HG2 GLU A 89 29.100 1.439 0.167 1.00 0.00 H new ATOM 0 HG3 GLU A 89 28.790 2.917 -0.722 1.00 0.00 H new ATOM 153 N ILE A 90 24.688 -0.046 -0.003 1.00 0.00 N ATOM 154 CA ILE A 90 23.274 -0.364 -0.163 1.00 0.00 C ATOM 155 C ILE A 90 22.788 -1.231 0.991 1.00 0.00 C ATOM 156 O ILE A 90 21.645 -1.123 1.422 1.00 0.00 O ATOM 157 CB ILE A 90 23.049 -1.084 -1.493 1.00 0.00 C ATOM 158 CG1 ILE A 90 23.943 -2.321 -1.562 1.00 0.00 C ATOM 159 CG2 ILE A 90 23.396 -0.145 -2.651 1.00 0.00 C ATOM 160 CD1 ILE A 90 23.666 -3.088 -2.855 1.00 0.00 C ATOM 0 H ILE A 90 25.293 -0.416 -0.737 1.00 0.00 H new ATOM 0 HA ILE A 90 22.705 0.566 -0.160 1.00 0.00 H new ATOM 0 HB ILE A 90 22.004 -1.383 -1.567 1.00 0.00 H new ATOM 0 HG12 ILE A 90 24.992 -2.026 -1.521 1.00 0.00 H new ATOM 0 HG13 ILE A 90 23.758 -2.963 -0.701 1.00 0.00 H new ATOM 0 HG21 ILE A 90 23.235 -0.660 -3.598 1.00 0.00 H new ATOM 0 HG22 ILE A 90 22.760 0.739 -2.606 1.00 0.00 H new ATOM 0 HG23 ILE A 90 24.441 0.156 -2.575 1.00 0.00 H new ATOM 0 HD11 ILE A 90 24.306 -3.969 -2.900 1.00 0.00 H new ATOM 0 HD12 ILE A 90 22.621 -3.397 -2.878 1.00 0.00 H new ATOM 0 HD13 ILE A 90 23.873 -2.445 -3.711 1.00 0.00 H new ATOM 172 N ALA A 91 23.657 -2.110 1.467 1.00 0.00 N ATOM 173 CA ALA A 91 23.301 -3.008 2.560 1.00 0.00 C ATOM 174 C ALA A 91 22.881 -2.215 3.793 1.00 0.00 C ATOM 175 O ALA A 91 21.846 -2.492 4.398 1.00 0.00 O ATOM 176 CB ALA A 91 24.485 -3.907 2.911 1.00 0.00 C ATOM 0 H ALA A 91 24.609 -2.222 1.118 1.00 0.00 H new ATOM 0 HA ALA A 91 22.463 -3.624 2.234 1.00 0.00 H new ATOM 0 HB1 ALA A 91 24.207 -4.573 3.728 1.00 0.00 H new ATOM 0 HB2 ALA A 91 24.763 -4.499 2.039 1.00 0.00 H new ATOM 0 HB3 ALA A 91 25.331 -3.292 3.217 1.00 0.00 H new ATOM 182 N GLN A 92 23.694 -1.232 4.163 1.00 0.00 N ATOM 183 CA GLN A 92 23.392 -0.407 5.326 1.00 0.00 C ATOM 184 C GLN A 92 22.139 0.426 5.087 1.00 0.00 C ATOM 185 O GLN A 92 21.279 0.534 5.961 1.00 0.00 O ATOM 186 CB GLN A 92 24.571 0.519 5.633 1.00 0.00 C ATOM 187 CG GLN A 92 25.747 -0.307 6.157 1.00 0.00 C ATOM 188 CD GLN A 92 26.951 0.597 6.402 1.00 0.00 C ATOM 189 OE1 GLN A 92 27.444 1.239 5.474 1.00 0.00 O ATOM 190 NE2 GLN A 92 27.455 0.686 7.602 1.00 0.00 N ATOM 0 H GLN A 92 24.559 -0.989 3.680 1.00 0.00 H new ATOM 0 HA GLN A 92 23.217 -1.067 6.176 1.00 0.00 H new ATOM 0 HB2 GLN A 92 24.865 1.060 4.734 1.00 0.00 H new ATOM 0 HB3 GLN A 92 24.278 1.264 6.373 1.00 0.00 H new ATOM 0 HG2 GLN A 92 25.465 -0.810 7.082 1.00 0.00 H new ATOM 0 HG3 GLN A 92 26.006 -1.084 5.438 1.00 0.00 H new ATOM 0 HE21 GLN A 92 27.044 0.153 8.368 1.00 0.00 H new ATOM 0 HE22 GLN A 92 28.260 1.289 7.774 1.00 0.00 H new ATOM 199 N LYS A 93 22.044 1.014 3.900 1.00 0.00 N ATOM 200 CA LYS A 93 20.890 1.838 3.563 1.00 0.00 C ATOM 201 C LYS A 93 19.617 0.996 3.554 1.00 0.00 C ATOM 202 O LYS A 93 18.607 1.374 4.144 1.00 0.00 O ATOM 203 CB LYS A 93 21.095 2.480 2.188 1.00 0.00 C ATOM 204 CG LYS A 93 19.940 3.441 1.896 1.00 0.00 C ATOM 205 CD LYS A 93 20.174 4.131 0.551 1.00 0.00 C ATOM 206 CE LYS A 93 19.027 5.104 0.269 1.00 0.00 C ATOM 207 NZ LYS A 93 19.285 5.816 -1.015 1.00 0.00 N1+ ATOM 0 H LYS A 93 22.744 0.937 3.162 1.00 0.00 H new ATOM 0 HA LYS A 93 20.787 2.619 4.316 1.00 0.00 H new ATOM 0 HB2 LYS A 93 22.044 3.016 2.163 1.00 0.00 H new ATOM 0 HB3 LYS A 93 21.144 1.709 1.419 1.00 0.00 H new ATOM 0 HG2 LYS A 93 18.996 2.896 1.877 1.00 0.00 H new ATOM 0 HG3 LYS A 93 19.863 4.185 2.689 1.00 0.00 H new ATOM 0 HD2 LYS A 93 21.123 4.666 0.565 1.00 0.00 H new ATOM 0 HD3 LYS A 93 20.239 3.388 -0.244 1.00 0.00 H new ATOM 0 HE2 LYS A 93 18.082 4.563 0.214 1.00 0.00 H new ATOM 0 HE3 LYS A 93 18.936 5.822 1.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 18.506 6.478 -1.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 20.178 6.344 -0.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 19.351 5.124 -1.789 1.00 0.00 H new ATOM 221 N GLU A 94 19.676 -0.146 2.882 1.00 0.00 N ATOM 222 CA GLU A 94 18.526 -1.037 2.798 1.00 0.00 C ATOM 223 C GLU A 94 18.300 -1.737 4.134 1.00 0.00 C ATOM 224 O GLU A 94 17.277 -2.392 4.333 1.00 0.00 O ATOM 225 CB GLU A 94 18.744 -2.082 1.700 1.00 0.00 C ATOM 226 CG GLU A 94 18.764 -1.391 0.335 1.00 0.00 C ATOM 227 CD GLU A 94 19.044 -2.414 -0.760 1.00 0.00 C ATOM 228 OE1 GLU A 94 19.241 -3.571 -0.426 1.00 0.00 O ATOM 229 OE2 GLU A 94 19.055 -2.027 -1.917 1.00 0.00 O1- ATOM 0 H GLU A 94 20.505 -0.477 2.388 1.00 0.00 H new ATOM 0 HA GLU A 94 17.646 -0.442 2.555 1.00 0.00 H new ATOM 0 HB2 GLU A 94 19.683 -2.609 1.866 1.00 0.00 H new ATOM 0 HB3 GLU A 94 17.950 -2.828 1.730 1.00 0.00 H new ATOM 0 HG2 GLU A 94 17.808 -0.901 0.151 1.00 0.00 H new ATOM 0 HG3 GLU A 94 19.528 -0.613 0.322 1.00 0.00 H new ATOM 236 N SER A 95 19.261 -1.598 5.042 1.00 0.00 N ATOM 237 CA SER A 95 19.151 -2.226 6.352 1.00 0.00 C ATOM 238 C SER A 95 19.385 -3.729 6.244 1.00 0.00 C ATOM 239 O SER A 95 19.182 -4.467 7.208 1.00 0.00 O ATOM 240 CB SER A 95 17.759 -1.965 6.941 1.00 0.00 C ATOM 241 OG SER A 95 16.891 -3.035 6.584 1.00 0.00 O ATOM 0 H SER A 95 20.116 -1.061 4.896 1.00 0.00 H new ATOM 0 HA SER A 95 19.909 -1.796 7.007 1.00 0.00 H new ATOM 0 HB2 SER A 95 17.821 -1.878 8.026 1.00 0.00 H new ATOM 0 HB3 SER A 95 17.364 -1.020 6.567 1.00 0.00 H new ATOM 0 HG SER A 95 16.916 -3.167 5.613 1.00 0.00 H new ATOM 247 N SER A 96 19.810 -4.173 5.068 1.00 0.00 N ATOM 248 CA SER A 96 20.068 -5.592 4.852 1.00 0.00 C ATOM 249 C SER A 96 21.403 -5.988 5.473 1.00 0.00 C ATOM 250 O SER A 96 22.221 -5.130 5.803 1.00 0.00 O ATOM 251 CB SER A 96 20.089 -5.899 3.353 1.00 0.00 C ATOM 252 OG SER A 96 21.381 -5.612 2.835 1.00 0.00 O ATOM 0 H SER A 96 19.982 -3.579 4.257 1.00 0.00 H new ATOM 0 HA SER A 96 19.271 -6.165 5.326 1.00 0.00 H new ATOM 0 HB2 SER A 96 19.839 -6.946 3.181 1.00 0.00 H new ATOM 0 HB3 SER A 96 19.337 -5.303 2.837 1.00 0.00 H new ATOM 0 HG SER A 96 21.400 -5.809 1.875 1.00 0.00 H new ATOM 258 N LEU A 97 21.615 -7.289 5.640 1.00 0.00 N ATOM 259 CA LEU A 97 22.855 -7.775 6.234 1.00 0.00 C ATOM 260 C LEU A 97 24.029 -7.520 5.297 1.00 0.00 C ATOM 261 O LEU A 97 23.991 -7.881 4.121 1.00 0.00 O ATOM 262 CB LEU A 97 22.740 -9.280 6.514 1.00 0.00 C ATOM 263 CG LEU A 97 21.922 -9.507 7.789 1.00 0.00 C ATOM 264 CD1 LEU A 97 20.530 -8.893 7.622 1.00 0.00 C ATOM 265 CD2 LEU A 97 21.788 -11.009 8.046 1.00 0.00 C ATOM 0 H LEU A 97 20.953 -8.019 5.376 1.00 0.00 H new ATOM 0 HA LEU A 97 23.027 -7.241 7.169 1.00 0.00 H new ATOM 0 HB2 LEU A 97 22.264 -9.781 5.671 1.00 0.00 H new ATOM 0 HB3 LEU A 97 23.733 -9.716 6.625 1.00 0.00 H new ATOM 0 HG LEU A 97 22.427 -9.035 8.632 1.00 0.00 H new ATOM 0 HD11 LEU A 97 19.949 -9.055 8.530 1.00 0.00 H new ATOM 0 HD12 LEU A 97 20.624 -7.823 7.438 1.00 0.00 H new ATOM 0 HD13 LEU A 97 20.024 -9.363 6.779 1.00 0.00 H new ATOM 0 HD21 LEU A 97 21.206 -11.172 8.953 1.00 0.00 H new ATOM 0 HD22 LEU A 97 21.284 -11.479 7.202 1.00 0.00 H new ATOM 0 HD23 LEU A 97 22.779 -11.447 8.167 1.00 0.00 H new ATOM 277 N LEU A 98 25.071 -6.894 5.831 1.00 0.00 N ATOM 278 CA LEU A 98 26.247 -6.591 5.042 1.00 0.00 C ATOM 279 C LEU A 98 26.680 -7.807 4.223 1.00 0.00 C ATOM 280 O LEU A 98 26.496 -8.947 4.650 1.00 0.00 O ATOM 281 CB LEU A 98 27.401 -6.147 5.952 1.00 0.00 C ATOM 282 CG LEU A 98 27.225 -4.674 6.321 1.00 0.00 C ATOM 283 CD1 LEU A 98 25.905 -4.493 7.073 1.00 0.00 C ATOM 284 CD2 LEU A 98 28.385 -4.232 7.208 1.00 0.00 C ATOM 0 H LEU A 98 25.121 -6.590 6.803 1.00 0.00 H new ATOM 0 HA LEU A 98 25.994 -5.780 4.359 1.00 0.00 H new ATOM 0 HB2 LEU A 98 27.422 -6.758 6.854 1.00 0.00 H new ATOM 0 HB3 LEU A 98 28.355 -6.294 5.445 1.00 0.00 H new ATOM 0 HG LEU A 98 27.211 -4.069 5.415 1.00 0.00 H new ATOM 0 HD11 LEU A 98 25.778 -3.443 7.337 1.00 0.00 H new ATOM 0 HD12 LEU A 98 25.078 -4.810 6.438 1.00 0.00 H new ATOM 0 HD13 LEU A 98 25.918 -5.096 7.981 1.00 0.00 H new ATOM 0 HD21 LEU A 98 28.261 -3.182 7.472 1.00 0.00 H new ATOM 0 HD22 LEU A 98 28.399 -4.835 8.116 1.00 0.00 H new ATOM 0 HD23 LEU A 98 29.324 -4.363 6.671 1.00 0.00 H new ATOM 296 N PRO A 99 27.252 -7.582 3.065 1.00 0.00 N ATOM 297 CA PRO A 99 27.723 -8.681 2.173 1.00 0.00 C ATOM 298 C PRO A 99 28.925 -9.417 2.756 1.00 0.00 C ATOM 299 O PRO A 99 29.818 -8.791 3.325 1.00 0.00 O ATOM 300 CB PRO A 99 28.097 -7.954 0.872 1.00 0.00 C ATOM 301 CG PRO A 99 28.418 -6.554 1.294 1.00 0.00 C ATOM 302 CD PRO A 99 27.517 -6.258 2.482 1.00 0.00 C ATOM 0 HA PRO A 99 26.965 -9.451 2.032 1.00 0.00 H new ATOM 0 HB2 PRO A 99 28.951 -8.426 0.387 1.00 0.00 H new ATOM 0 HB3 PRO A 99 27.274 -7.973 0.158 1.00 0.00 H new ATOM 0 HG2 PRO A 99 29.469 -6.460 1.568 1.00 0.00 H new ATOM 0 HG3 PRO A 99 28.237 -5.850 0.482 1.00 0.00 H new ATOM 0 HD2 PRO A 99 28.005 -5.597 3.198 1.00 0.00 H new ATOM 0 HD3 PRO A 99 26.595 -5.767 2.171 1.00 0.00 H new ATOM 310 N PHE A 100 28.953 -10.747 2.605 1.00 0.00 N ATOM 311 CA PHE A 100 30.057 -11.543 3.121 1.00 0.00 C ATOM 312 C PHE A 100 30.538 -12.506 2.050 1.00 0.00 C ATOM 313 O PHE A 100 29.736 -13.195 1.411 1.00 0.00 O ATOM 314 CB PHE A 100 29.604 -12.317 4.360 1.00 0.00 C ATOM 315 CG PHE A 100 30.812 -12.905 5.049 1.00 0.00 C ATOM 316 CD1 PHE A 100 31.633 -12.088 5.838 1.00 0.00 C ATOM 317 CD2 PHE A 100 31.113 -14.263 4.900 1.00 0.00 C ATOM 318 CE1 PHE A 100 32.755 -12.631 6.475 1.00 0.00 C ATOM 319 CE2 PHE A 100 32.235 -14.806 5.537 1.00 0.00 C ATOM 320 CZ PHE A 100 33.056 -13.991 6.325 1.00 0.00 C ATOM 0 H PHE A 100 28.227 -11.285 2.132 1.00 0.00 H new ATOM 0 HA PHE A 100 30.878 -10.883 3.399 1.00 0.00 H new ATOM 0 HB2 PHE A 100 29.069 -11.655 5.041 1.00 0.00 H new ATOM 0 HB3 PHE A 100 28.912 -13.109 4.075 1.00 0.00 H new ATOM 0 HD1 PHE A 100 31.400 -11.040 5.955 1.00 0.00 H new ATOM 0 HD2 PHE A 100 30.479 -14.893 4.293 1.00 0.00 H new ATOM 0 HE1 PHE A 100 33.389 -12.001 7.082 1.00 0.00 H new ATOM 0 HE2 PHE A 100 32.467 -15.854 5.420 1.00 0.00 H new ATOM 0 HZ PHE A 100 33.921 -14.410 6.817 1.00 0.00 H new ATOM 330 N TYR A 101 31.852 -12.558 1.853 1.00 0.00 N ATOM 331 CA TYR A 101 32.428 -13.440 0.844 1.00 0.00 C ATOM 332 C TYR A 101 33.014 -14.692 1.491 1.00 0.00 C ATOM 333 O TYR A 101 33.488 -14.650 2.631 1.00 0.00 O ATOM 334 CB TYR A 101 33.526 -12.708 0.067 1.00 0.00 C ATOM 335 CG TYR A 101 33.015 -11.356 -0.368 1.00 0.00 C ATOM 336 CD1 TYR A 101 32.210 -11.244 -1.509 1.00 0.00 C ATOM 337 CD2 TYR A 101 33.345 -10.213 0.371 1.00 0.00 C ATOM 338 CE1 TYR A 101 31.737 -9.988 -1.909 1.00 0.00 C ATOM 339 CE2 TYR A 101 32.871 -8.958 -0.032 1.00 0.00 C ATOM 340 CZ TYR A 101 32.067 -8.846 -1.170 1.00 0.00 C ATOM 341 OH TYR A 101 31.602 -7.609 -1.566 1.00 0.00 O ATOM 0 H TYR A 101 32.533 -12.005 2.374 1.00 0.00 H new ATOM 0 HA TYR A 101 31.633 -13.735 0.159 1.00 0.00 H new ATOM 0 HB2 TYR A 101 34.412 -12.591 0.691 1.00 0.00 H new ATOM 0 HB3 TYR A 101 33.824 -13.294 -0.803 1.00 0.00 H new ATOM 0 HD1 TYR A 101 31.955 -12.125 -2.079 1.00 0.00 H new ATOM 0 HD2 TYR A 101 33.965 -10.299 1.251 1.00 0.00 H new ATOM 0 HE1 TYR A 101 31.117 -9.900 -2.789 1.00 0.00 H new ATOM 0 HE2 TYR A 101 33.127 -8.076 0.537 1.00 0.00 H new ATOM 0 HH TYR A 101 31.923 -6.924 -0.943 1.00 0.00 H new ATOM 351 N ALA A 102 32.987 -15.810 0.763 1.00 0.00 N ATOM 352 CA ALA A 102 33.525 -17.066 1.289 1.00 0.00 C ATOM 353 C ALA A 102 34.234 -17.865 0.201 1.00 0.00 C ATOM 354 O ALA A 102 33.614 -18.660 -0.509 1.00 0.00 O ATOM 355 CB ALA A 102 32.382 -17.907 1.865 1.00 0.00 C ATOM 0 H ALA A 102 32.604 -15.872 -0.180 1.00 0.00 H new ATOM 0 HA ALA A 102 34.250 -16.826 2.067 1.00 0.00 H new ATOM 0 HB1 ALA A 102 32.781 -18.843 2.257 1.00 0.00 H new ATOM 0 HB2 ALA A 102 31.894 -17.356 2.668 1.00 0.00 H new ATOM 0 HB3 ALA A 102 31.657 -18.122 1.080 1.00 0.00 H new ATOM 361 N THR A 103 35.540 -17.638 0.071 1.00 0.00 N ATOM 362 CA THR A 103 36.332 -18.342 -0.925 1.00 0.00 C ATOM 363 C THR A 103 36.507 -19.801 -0.519 1.00 0.00 C ATOM 364 O THR A 103 36.832 -20.092 0.633 1.00 0.00 O ATOM 365 CB THR A 103 37.703 -17.685 -1.076 1.00 0.00 C ATOM 366 OG1 THR A 103 37.534 -16.305 -1.363 1.00 0.00 O ATOM 367 CG2 THR A 103 38.472 -18.356 -2.217 1.00 0.00 C ATOM 0 H THR A 103 36.066 -16.975 0.641 1.00 0.00 H new ATOM 0 HA THR A 103 35.808 -18.294 -1.880 1.00 0.00 H new ATOM 0 HB THR A 103 38.265 -17.798 -0.149 1.00 0.00 H new ATOM 0 HG1 THR A 103 38.412 -15.881 -1.459 1.00 0.00 H new ATOM 0 HG21 THR A 103 39.450 -17.886 -2.323 1.00 0.00 H new ATOM 0 HG22 THR A 103 38.601 -19.415 -1.995 1.00 0.00 H new ATOM 0 HG23 THR A 103 37.914 -18.245 -3.147 1.00 0.00 H new ATOM 375 N ALA A 104 36.290 -20.717 -1.460 1.00 0.00 N ATOM 376 CA ALA A 104 36.429 -22.144 -1.178 1.00 0.00 C ATOM 377 C ALA A 104 37.133 -22.841 -2.335 1.00 0.00 C ATOM 378 O ALA A 104 37.187 -22.313 -3.445 1.00 0.00 O ATOM 379 CB ALA A 104 35.051 -22.766 -0.957 1.00 0.00 C ATOM 0 H ALA A 104 36.019 -20.499 -2.419 1.00 0.00 H new ATOM 0 HA ALA A 104 37.027 -22.269 -0.275 1.00 0.00 H new ATOM 0 HB1 ALA A 104 35.161 -23.830 -0.747 1.00 0.00 H new ATOM 0 HB2 ALA A 104 34.563 -22.279 -0.113 1.00 0.00 H new ATOM 0 HB3 ALA A 104 34.444 -22.634 -1.853 1.00 0.00 H new ATOM 385 N THR A 105 37.670 -24.034 -2.076 1.00 0.00 N ATOM 386 CA THR A 105 38.362 -24.795 -3.104 1.00 0.00 C ATOM 387 C THR A 105 37.456 -25.889 -3.660 1.00 0.00 C ATOM 388 O THR A 105 36.785 -26.598 -2.908 1.00 0.00 O ATOM 389 CB THR A 105 39.617 -25.420 -2.508 1.00 0.00 C ATOM 390 OG1 THR A 105 39.260 -26.424 -1.570 1.00 0.00 O ATOM 391 CG2 THR A 105 40.457 -24.346 -1.817 1.00 0.00 C ATOM 0 H THR A 105 37.637 -24.489 -1.164 1.00 0.00 H new ATOM 0 HA THR A 105 38.635 -24.124 -3.919 1.00 0.00 H new ATOM 0 HB THR A 105 40.201 -25.871 -3.310 1.00 0.00 H new ATOM 0 HG1 THR A 105 40.072 -26.822 -1.192 1.00 0.00 H new ATOM 0 HG21 THR A 105 41.352 -24.801 -1.394 1.00 0.00 H new ATOM 0 HG22 THR A 105 40.745 -23.586 -2.543 1.00 0.00 H new ATOM 0 HG23 THR A 105 39.873 -23.884 -1.021 1.00 0.00 H new ATOM 399 N SER A 106 37.438 -26.020 -4.982 1.00 0.00 N ATOM 400 CA SER A 106 36.608 -27.030 -5.625 1.00 0.00 C ATOM 401 C SER A 106 37.098 -27.300 -7.037 1.00 0.00 C ATOM 402 O SER A 106 37.854 -26.509 -7.604 1.00 0.00 O ATOM 403 CB SER A 106 35.155 -26.565 -5.670 1.00 0.00 C ATOM 404 OG SER A 106 35.092 -25.272 -6.261 1.00 0.00 O ATOM 0 H SER A 106 37.984 -25.445 -5.624 1.00 0.00 H new ATOM 0 HA SER A 106 36.675 -27.950 -5.044 1.00 0.00 H new ATOM 0 HB2 SER A 106 34.554 -27.269 -6.244 1.00 0.00 H new ATOM 0 HB3 SER A 106 34.739 -26.538 -4.663 1.00 0.00 H new ATOM 0 HG SER A 106 34.160 -24.972 -6.293 1.00 0.00 H new ATOM 410 N GLY A 107 36.654 -28.421 -7.609 1.00 0.00 N ATOM 411 CA GLY A 107 37.044 -28.789 -8.965 1.00 0.00 C ATOM 412 C GLY A 107 37.773 -30.129 -8.983 1.00 0.00 C ATOM 413 O GLY A 107 37.724 -30.888 -8.014 1.00 0.00 O ATOM 0 H GLY A 107 36.027 -29.085 -7.154 1.00 0.00 H new ATOM 0 HA2 GLY A 107 36.159 -28.845 -9.599 1.00 0.00 H new ATOM 0 HA3 GLY A 107 37.688 -28.016 -9.384 1.00 0.00 H new ATOM 417 N PRO A 108 38.433 -30.435 -10.068 1.00 0.00 N ATOM 418 CA PRO A 108 39.178 -31.719 -10.221 1.00 0.00 C ATOM 419 C PRO A 108 40.422 -31.779 -9.341 1.00 0.00 C ATOM 420 O PRO A 108 41.045 -30.756 -9.059 1.00 0.00 O ATOM 421 CB PRO A 108 39.555 -31.742 -11.715 1.00 0.00 C ATOM 422 CG PRO A 108 39.573 -30.316 -12.134 1.00 0.00 C ATOM 423 CD PRO A 108 38.553 -29.586 -11.267 1.00 0.00 C ATOM 0 HA PRO A 108 38.581 -32.577 -9.912 1.00 0.00 H new ATOM 0 HB2 PRO A 108 40.527 -32.210 -11.869 1.00 0.00 H new ATOM 0 HB3 PRO A 108 38.831 -32.314 -12.295 1.00 0.00 H new ATOM 0 HG2 PRO A 108 40.567 -29.888 -12.004 1.00 0.00 H new ATOM 0 HG3 PRO A 108 39.321 -30.221 -13.190 1.00 0.00 H new ATOM 0 HD2 PRO A 108 38.891 -28.581 -11.013 1.00 0.00 H new ATOM 0 HD3 PRO A 108 37.596 -29.480 -11.779 1.00 0.00 H new ATOM 431 N SER A 109 40.792 -32.988 -8.938 1.00 0.00 N ATOM 432 CA SER A 109 41.979 -33.174 -8.117 1.00 0.00 C ATOM 433 C SER A 109 43.234 -32.864 -8.926 1.00 0.00 C ATOM 434 O SER A 109 44.294 -32.589 -8.363 1.00 0.00 O ATOM 435 CB SER A 109 42.042 -34.617 -7.612 1.00 0.00 C ATOM 436 OG SER A 109 42.068 -35.505 -8.722 1.00 0.00 O ATOM 0 H SER A 109 40.291 -33.847 -9.165 1.00 0.00 H new ATOM 0 HA SER A 109 41.925 -32.494 -7.267 1.00 0.00 H new ATOM 0 HB2 SER A 109 42.930 -34.760 -6.997 1.00 0.00 H new ATOM 0 HB3 SER A 109 41.179 -34.831 -6.981 1.00 0.00 H new ATOM 0 HG SER A 109 42.110 -36.430 -8.400 1.00 0.00 H new ATOM 442 N HIS A 110 43.105 -32.898 -10.255 1.00 0.00 N ATOM 443 CA HIS A 110 44.237 -32.612 -11.133 1.00 0.00 C ATOM 444 C HIS A 110 44.368 -31.116 -11.358 1.00 0.00 C ATOM 445 O HIS A 110 45.476 -30.584 -11.399 1.00 0.00 O ATOM 446 CB HIS A 110 44.051 -33.313 -12.474 1.00 0.00 C ATOM 447 CG HIS A 110 44.242 -34.794 -12.296 1.00 0.00 C ATOM 448 ND1 HIS A 110 43.256 -35.606 -11.758 1.00 0.00 N ATOM 449 CD2 HIS A 110 45.298 -35.622 -12.580 1.00 0.00 C ATOM 450 CE1 HIS A 110 43.735 -36.863 -11.734 1.00 0.00 C ATOM 451 NE2 HIS A 110 44.975 -36.928 -12.225 1.00 0.00 N ATOM 0 H HIS A 110 42.236 -33.119 -10.741 1.00 0.00 H new ATOM 0 HA HIS A 110 45.145 -32.981 -10.655 1.00 0.00 H new ATOM 0 HB2 HIS A 110 43.056 -33.109 -12.868 1.00 0.00 H new ATOM 0 HB3 HIS A 110 44.767 -32.928 -13.200 1.00 0.00 H new ATOM 0 HD2 HIS A 110 46.236 -35.308 -13.013 1.00 0.00 H new ATOM 0 HE1 HIS A 110 43.184 -37.715 -11.363 1.00 0.00 H new ATOM 0 HE2 HIS A 110 45.560 -37.758 -12.320 1.00 0.00 H new ATOM 459 N ALA A 111 43.226 -30.435 -11.477 1.00 0.00 N ATOM 460 CA ALA A 111 43.214 -28.983 -11.670 1.00 0.00 C ATOM 461 C ALA A 111 42.321 -28.314 -10.625 1.00 0.00 C ATOM 462 O ALA A 111 41.190 -27.932 -10.907 1.00 0.00 O ATOM 463 CB ALA A 111 42.732 -28.647 -13.090 1.00 0.00 C ATOM 0 H ALA A 111 42.301 -30.864 -11.443 1.00 0.00 H new ATOM 0 HA ALA A 111 44.227 -28.601 -11.546 1.00 0.00 H new ATOM 0 HB1 ALA A 111 42.726 -27.566 -13.226 1.00 0.00 H new ATOM 0 HB2 ALA A 111 43.404 -29.100 -13.819 1.00 0.00 H new ATOM 0 HB3 ALA A 111 41.724 -29.036 -13.234 1.00 0.00 H new ATOM 469 N PRO A 112 42.809 -28.162 -9.429 1.00 0.00 N ATOM 470 CA PRO A 112 42.031 -27.530 -8.325 1.00 0.00 C ATOM 471 C PRO A 112 41.676 -26.078 -8.623 1.00 0.00 C ATOM 472 O PRO A 112 42.555 -25.251 -8.847 1.00 0.00 O ATOM 473 CB PRO A 112 42.971 -27.632 -7.108 1.00 0.00 C ATOM 474 CG PRO A 112 43.999 -28.653 -7.482 1.00 0.00 C ATOM 475 CD PRO A 112 44.144 -28.568 -8.989 1.00 0.00 C ATOM 0 HA PRO A 112 41.072 -28.024 -8.169 1.00 0.00 H new ATOM 0 HB2 PRO A 112 43.435 -26.670 -6.888 1.00 0.00 H new ATOM 0 HB3 PRO A 112 42.425 -27.934 -6.214 1.00 0.00 H new ATOM 0 HG2 PRO A 112 44.949 -28.450 -6.987 1.00 0.00 H new ATOM 0 HG3 PRO A 112 43.687 -29.651 -7.176 1.00 0.00 H new ATOM 0 HD2 PRO A 112 44.903 -27.842 -9.281 1.00 0.00 H new ATOM 0 HD3 PRO A 112 44.437 -29.525 -9.420 1.00 0.00 H new ATOM 483 N THR A 113 40.384 -25.772 -8.608 1.00 0.00 N ATOM 484 CA THR A 113 39.910 -24.412 -8.870 1.00 0.00 C ATOM 485 C THR A 113 39.325 -23.810 -7.609 1.00 0.00 C ATOM 486 O THR A 113 39.206 -24.484 -6.586 1.00 0.00 O ATOM 487 CB THR A 113 38.855 -24.434 -9.978 1.00 0.00 C ATOM 488 OG1 THR A 113 37.687 -25.090 -9.507 1.00 0.00 O ATOM 489 CG2 THR A 113 39.405 -25.181 -11.196 1.00 0.00 C ATOM 0 H THR A 113 39.643 -26.446 -8.417 1.00 0.00 H new ATOM 0 HA THR A 113 40.753 -23.800 -9.192 1.00 0.00 H new ATOM 0 HB THR A 113 38.608 -23.411 -10.263 1.00 0.00 H new ATOM 0 HG1 THR A 113 37.941 -25.902 -9.021 1.00 0.00 H new ATOM 0 HG21 THR A 113 38.652 -25.196 -11.984 1.00 0.00 H new ATOM 0 HG22 THR A 113 40.300 -24.676 -11.559 1.00 0.00 H new ATOM 0 HG23 THR A 113 39.654 -26.204 -10.913 1.00 0.00 H new ATOM 497 N PHE A 114 38.972 -22.531 -7.683 1.00 0.00 N ATOM 498 CA PHE A 114 38.403 -21.834 -6.527 1.00 0.00 C ATOM 499 C PHE A 114 37.128 -21.103 -6.920 1.00 0.00 C ATOM 500 O PHE A 114 37.019 -20.572 -8.025 1.00 0.00 O ATOM 501 CB PHE A 114 39.427 -20.829 -5.980 1.00 0.00 C ATOM 502 CG PHE A 114 40.823 -21.355 -6.225 1.00 0.00 C ATOM 503 CD1 PHE A 114 41.320 -22.409 -5.458 1.00 0.00 C ATOM 504 CD2 PHE A 114 41.613 -20.791 -7.230 1.00 0.00 C ATOM 505 CE1 PHE A 114 42.611 -22.897 -5.684 1.00 0.00 C ATOM 506 CE2 PHE A 114 42.900 -21.278 -7.457 1.00 0.00 C ATOM 507 CZ PHE A 114 43.405 -22.327 -6.685 1.00 0.00 C ATOM 0 H PHE A 114 39.067 -21.957 -8.521 1.00 0.00 H new ATOM 0 HA PHE A 114 38.161 -22.568 -5.758 1.00 0.00 H new ATOM 0 HB2 PHE A 114 39.300 -19.862 -6.466 1.00 0.00 H new ATOM 0 HB3 PHE A 114 39.267 -20.673 -4.913 1.00 0.00 H new ATOM 0 HD1 PHE A 114 40.706 -22.850 -4.687 1.00 0.00 H new ATOM 0 HD2 PHE A 114 41.228 -19.980 -7.830 1.00 0.00 H new ATOM 0 HE1 PHE A 114 42.994 -23.712 -5.087 1.00 0.00 H new ATOM 0 HE2 PHE A 114 43.510 -20.842 -8.234 1.00 0.00 H new ATOM 0 HZ PHE A 114 44.405 -22.697 -6.860 1.00 0.00 H new ATOM 517 N THR A 115 36.166 -21.068 -6.004 1.00 0.00 N ATOM 518 CA THR A 115 34.896 -20.386 -6.258 1.00 0.00 C ATOM 519 C THR A 115 34.543 -19.467 -5.096 1.00 0.00 C ATOM 520 O THR A 115 34.528 -19.888 -3.940 1.00 0.00 O ATOM 521 CB THR A 115 33.786 -21.415 -6.455 1.00 0.00 C ATOM 522 OG1 THR A 115 34.126 -22.268 -7.539 1.00 0.00 O ATOM 523 CG2 THR A 115 32.474 -20.692 -6.761 1.00 0.00 C ATOM 0 H THR A 115 36.238 -21.500 -5.083 1.00 0.00 H new ATOM 0 HA THR A 115 34.998 -19.785 -7.162 1.00 0.00 H new ATOM 0 HB THR A 115 33.668 -22.009 -5.549 1.00 0.00 H new ATOM 0 HG1 THR A 115 33.416 -22.932 -7.668 1.00 0.00 H new ATOM 0 HG21 THR A 115 31.679 -21.425 -6.902 1.00 0.00 H new ATOM 0 HG22 THR A 115 32.218 -20.035 -5.930 1.00 0.00 H new ATOM 0 HG23 THR A 115 32.588 -20.100 -7.669 1.00 0.00 H new ATOM 531 N SER A 116 34.261 -18.206 -5.409 1.00 0.00 N ATOM 532 CA SER A 116 33.909 -17.229 -4.379 1.00 0.00 C ATOM 533 C SER A 116 32.398 -17.080 -4.283 1.00 0.00 C ATOM 534 O SER A 116 31.734 -16.745 -5.264 1.00 0.00 O ATOM 535 CB SER A 116 34.532 -15.879 -4.714 1.00 0.00 C ATOM 536 OG SER A 116 33.908 -14.868 -3.934 1.00 0.00 O ATOM 0 H SER A 116 34.269 -17.837 -6.360 1.00 0.00 H new ATOM 0 HA SER A 116 34.292 -17.580 -3.421 1.00 0.00 H new ATOM 0 HB2 SER A 116 35.603 -15.900 -4.514 1.00 0.00 H new ATOM 0 HB3 SER A 116 34.410 -15.663 -5.775 1.00 0.00 H new ATOM 0 HG SER A 116 33.240 -14.400 -4.478 1.00 0.00 H new ATOM 542 N THR A 117 31.855 -17.334 -3.092 1.00 0.00 N ATOM 543 CA THR A 117 30.411 -17.225 -2.879 1.00 0.00 C ATOM 544 C THR A 117 30.096 -15.998 -2.040 1.00 0.00 C ATOM 545 O THR A 117 30.661 -15.809 -0.963 1.00 0.00 O ATOM 546 CB THR A 117 29.891 -18.474 -2.171 1.00 0.00 C ATOM 547 OG1 THR A 117 30.129 -19.612 -2.990 1.00 0.00 O ATOM 548 CG2 THR A 117 28.389 -18.329 -1.923 1.00 0.00 C ATOM 0 H THR A 117 32.386 -17.614 -2.268 1.00 0.00 H new ATOM 0 HA THR A 117 29.922 -17.130 -3.849 1.00 0.00 H new ATOM 0 HB THR A 117 30.406 -18.596 -1.218 1.00 0.00 H new ATOM 0 HG1 THR A 117 29.798 -20.416 -2.537 1.00 0.00 H new ATOM 0 HG21 THR A 117 28.016 -19.220 -1.418 1.00 0.00 H new ATOM 0 HG22 THR A 117 28.206 -17.454 -1.299 1.00 0.00 H new ATOM 0 HG23 THR A 117 27.873 -18.209 -2.876 1.00 0.00 H new ATOM 556 N VAL A 118 29.185 -15.164 -2.537 1.00 0.00 N ATOM 557 CA VAL A 118 28.795 -13.945 -1.824 1.00 0.00 C ATOM 558 C VAL A 118 27.361 -14.059 -1.333 1.00 0.00 C ATOM 559 O VAL A 118 26.493 -14.558 -2.044 1.00 0.00 O ATOM 560 CB VAL A 118 28.923 -12.736 -2.751 1.00 0.00 C ATOM 561 CG1 VAL A 118 27.853 -12.805 -3.841 1.00 0.00 C ATOM 562 CG2 VAL A 118 28.742 -11.453 -1.935 1.00 0.00 C ATOM 0 H VAL A 118 28.704 -15.307 -3.425 1.00 0.00 H new ATOM 0 HA VAL A 118 29.456 -13.816 -0.967 1.00 0.00 H new ATOM 0 HB VAL A 118 29.908 -12.738 -3.217 1.00 0.00 H new ATOM 0 HG11 VAL A 118 27.948 -11.941 -4.499 1.00 0.00 H new ATOM 0 HG12 VAL A 118 27.982 -13.719 -4.421 1.00 0.00 H new ATOM 0 HG13 VAL A 118 26.865 -12.804 -3.381 1.00 0.00 H new ATOM 0 HG21 VAL A 118 28.833 -10.588 -2.592 1.00 0.00 H new ATOM 0 HG22 VAL A 118 27.756 -11.454 -1.470 1.00 0.00 H new ATOM 0 HG23 VAL A 118 29.508 -11.403 -1.161 1.00 0.00 H new ATOM 572 N GLU A 119 27.121 -13.585 -0.112 1.00 0.00 N ATOM 573 CA GLU A 119 25.785 -13.627 0.479 1.00 0.00 C ATOM 574 C GLU A 119 25.344 -12.232 0.902 1.00 0.00 C ATOM 575 O GLU A 119 26.080 -11.517 1.576 1.00 0.00 O ATOM 576 CB GLU A 119 25.781 -14.557 1.691 1.00 0.00 C ATOM 577 CG GLU A 119 24.354 -14.696 2.225 1.00 0.00 C ATOM 578 CD GLU A 119 24.332 -15.664 3.402 1.00 0.00 C ATOM 579 OE1 GLU A 119 25.400 -16.010 3.880 1.00 0.00 O ATOM 580 OE2 GLU A 119 23.247 -16.044 3.810 1.00 0.00 O1- ATOM 0 H GLU A 119 27.834 -13.168 0.487 1.00 0.00 H new ATOM 0 HA GLU A 119 25.087 -14.004 -0.269 1.00 0.00 H new ATOM 0 HB2 GLU A 119 26.173 -15.535 1.413 1.00 0.00 H new ATOM 0 HB3 GLU A 119 26.434 -14.161 2.468 1.00 0.00 H new ATOM 0 HG2 GLU A 119 23.977 -13.722 2.537 1.00 0.00 H new ATOM 0 HG3 GLU A 119 23.694 -15.055 1.435 1.00 0.00 H new ATOM 587 N PHE A 120 24.132 -11.858 0.513 1.00 0.00 N ATOM 588 CA PHE A 120 23.602 -10.547 0.877 1.00 0.00 C ATOM 589 C PHE A 120 22.109 -10.481 0.575 1.00 0.00 C ATOM 590 O PHE A 120 21.606 -11.256 -0.236 1.00 0.00 O ATOM 591 CB PHE A 120 24.333 -9.450 0.102 1.00 0.00 C ATOM 592 CG PHE A 120 23.976 -9.547 -1.362 1.00 0.00 C ATOM 593 CD1 PHE A 120 22.842 -8.887 -1.841 1.00 0.00 C ATOM 594 CD2 PHE A 120 24.770 -10.302 -2.232 1.00 0.00 C ATOM 595 CE1 PHE A 120 22.498 -8.976 -3.195 1.00 0.00 C ATOM 596 CE2 PHE A 120 24.427 -10.389 -3.589 1.00 0.00 C ATOM 597 CZ PHE A 120 23.291 -9.728 -4.068 1.00 0.00 C ATOM 0 H PHE A 120 23.503 -12.434 -0.047 1.00 0.00 H new ATOM 0 HA PHE A 120 23.757 -10.393 1.945 1.00 0.00 H new ATOM 0 HB2 PHE A 120 24.057 -8.470 0.491 1.00 0.00 H new ATOM 0 HB3 PHE A 120 25.410 -9.553 0.233 1.00 0.00 H new ATOM 0 HD1 PHE A 120 22.230 -8.307 -1.166 1.00 0.00 H new ATOM 0 HD2 PHE A 120 25.644 -10.816 -1.860 1.00 0.00 H new ATOM 0 HE1 PHE A 120 21.622 -8.465 -3.565 1.00 0.00 H new ATOM 0 HE2 PHE A 120 25.040 -10.967 -4.265 1.00 0.00 H new ATOM 0 HZ PHE A 120 23.026 -9.798 -5.113 1.00 0.00 H new ATOM 607 N ALA A 121 21.403 -9.558 1.217 1.00 0.00 N ATOM 608 CA ALA A 121 19.972 -9.428 0.989 1.00 0.00 C ATOM 609 C ALA A 121 19.288 -10.769 1.228 1.00 0.00 C ATOM 610 O ALA A 121 18.183 -11.015 0.745 1.00 0.00 O ATOM 611 CB ALA A 121 19.710 -8.961 -0.445 1.00 0.00 C ATOM 0 H ALA A 121 21.792 -8.898 1.890 1.00 0.00 H new ATOM 0 HA ALA A 121 19.568 -8.690 1.682 1.00 0.00 H new ATOM 0 HB1 ALA A 121 18.636 -8.867 -0.606 1.00 0.00 H new ATOM 0 HB2 ALA A 121 20.188 -7.994 -0.606 1.00 0.00 H new ATOM 0 HB3 ALA A 121 20.119 -9.689 -1.145 1.00 0.00 H new ATOM 617 N GLY A 122 19.967 -11.632 1.979 1.00 0.00 N ATOM 618 CA GLY A 122 19.435 -12.953 2.284 1.00 0.00 C ATOM 619 C GLY A 122 19.488 -13.856 1.061 1.00 0.00 C ATOM 620 O GLY A 122 18.736 -14.822 0.955 1.00 0.00 O ATOM 0 H GLY A 122 20.883 -11.440 2.385 1.00 0.00 H new ATOM 0 HA2 GLY A 122 20.007 -13.401 3.097 1.00 0.00 H new ATOM 0 HA3 GLY A 122 18.405 -12.864 2.630 1.00 0.00 H new ATOM 624 N LYS A 123 20.385 -13.536 0.138 1.00 0.00 N ATOM 625 CA LYS A 123 20.541 -14.319 -1.091 1.00 0.00 C ATOM 626 C LYS A 123 22.004 -14.616 -1.345 1.00 0.00 C ATOM 627 O LYS A 123 22.876 -13.859 -0.930 1.00 0.00 O ATOM 628 CB LYS A 123 19.953 -13.555 -2.274 1.00 0.00 C ATOM 629 CG LYS A 123 18.429 -13.516 -2.155 1.00 0.00 C ATOM 630 CD LYS A 123 17.845 -12.733 -3.332 1.00 0.00 C ATOM 631 CE LYS A 123 16.317 -12.766 -3.258 1.00 0.00 C ATOM 632 NZ LYS A 123 15.866 -12.089 -2.010 1.00 0.00 N1+ ATOM 0 H LYS A 123 21.018 -12.740 0.213 1.00 0.00 H new ATOM 0 HA LYS A 123 20.008 -15.262 -0.974 1.00 0.00 H new ATOM 0 HB2 LYS A 123 20.352 -12.541 -2.299 1.00 0.00 H new ATOM 0 HB3 LYS A 123 20.242 -14.034 -3.209 1.00 0.00 H new ATOM 0 HG2 LYS A 123 18.028 -14.530 -2.144 1.00 0.00 H new ATOM 0 HG3 LYS A 123 18.139 -13.049 -1.214 1.00 0.00 H new ATOM 0 HD2 LYS A 123 18.199 -11.702 -3.308 1.00 0.00 H new ATOM 0 HD3 LYS A 123 18.184 -13.165 -4.274 1.00 0.00 H new ATOM 0 HE2 LYS A 123 15.889 -12.269 -4.129 1.00 0.00 H new ATOM 0 HE3 LYS A 123 15.964 -13.797 -3.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 14.860 -11.838 -2.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 15.996 -12.730 -1.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 16.427 -11.226 -1.861 1.00 0.00 H new ATOM 646 N VAL A 124 22.274 -15.727 -2.030 1.00 0.00 N ATOM 647 CA VAL A 124 23.650 -16.120 -2.331 1.00 0.00 C ATOM 648 C VAL A 124 23.873 -16.211 -3.834 1.00 0.00 C ATOM 649 O VAL A 124 23.136 -16.895 -4.539 1.00 0.00 O ATOM 650 CB VAL A 124 23.946 -17.480 -1.695 1.00 0.00 C ATOM 651 CG1 VAL A 124 23.025 -18.545 -2.303 1.00 0.00 C ATOM 652 CG2 VAL A 124 25.404 -17.857 -1.959 1.00 0.00 C ATOM 0 H VAL A 124 21.563 -16.367 -2.385 1.00 0.00 H new ATOM 0 HA VAL A 124 24.320 -15.363 -1.923 1.00 0.00 H new ATOM 0 HB VAL A 124 23.772 -17.423 -0.621 1.00 0.00 H new ATOM 0 HG11 VAL A 124 23.238 -19.513 -1.848 1.00 0.00 H new ATOM 0 HG12 VAL A 124 21.985 -18.277 -2.116 1.00 0.00 H new ATOM 0 HG13 VAL A 124 23.196 -18.604 -3.378 1.00 0.00 H new ATOM 0 HG21 VAL A 124 25.617 -18.826 -1.507 1.00 0.00 H new ATOM 0 HG22 VAL A 124 25.577 -17.913 -3.034 1.00 0.00 H new ATOM 0 HG23 VAL A 124 26.059 -17.102 -1.525 1.00 0.00 H new ATOM 662 N PHE A 125 24.906 -15.522 -4.320 1.00 0.00 N ATOM 663 CA PHE A 125 25.231 -15.543 -5.749 1.00 0.00 C ATOM 664 C PHE A 125 26.562 -16.254 -5.973 1.00 0.00 C ATOM 665 O PHE A 125 27.598 -15.834 -5.451 1.00 0.00 O ATOM 666 CB PHE A 125 25.311 -14.119 -6.288 1.00 0.00 C ATOM 667 CG PHE A 125 23.974 -13.438 -6.118 1.00 0.00 C ATOM 668 CD1 PHE A 125 23.567 -13.009 -4.851 1.00 0.00 C ATOM 669 CD2 PHE A 125 23.145 -13.226 -7.227 1.00 0.00 C ATOM 670 CE1 PHE A 125 22.332 -12.374 -4.692 1.00 0.00 C ATOM 671 CE2 PHE A 125 21.911 -12.591 -7.065 1.00 0.00 C ATOM 672 CZ PHE A 125 21.503 -12.165 -5.798 1.00 0.00 C ATOM 0 H PHE A 125 25.528 -14.947 -3.752 1.00 0.00 H new ATOM 0 HA PHE A 125 24.446 -16.082 -6.279 1.00 0.00 H new ATOM 0 HB2 PHE A 125 26.084 -13.562 -5.759 1.00 0.00 H new ATOM 0 HB3 PHE A 125 25.592 -14.133 -7.341 1.00 0.00 H new ATOM 0 HD1 PHE A 125 24.207 -13.168 -3.995 1.00 0.00 H new ATOM 0 HD2 PHE A 125 23.460 -13.553 -8.207 1.00 0.00 H new ATOM 0 HE1 PHE A 125 22.018 -12.044 -3.713 1.00 0.00 H new ATOM 0 HE2 PHE A 125 21.272 -12.429 -7.920 1.00 0.00 H new ATOM 0 HZ PHE A 125 20.549 -11.675 -5.674 1.00 0.00 H new ATOM 682 N SER A 126 26.525 -17.337 -6.745 1.00 0.00 N ATOM 683 CA SER A 126 27.735 -18.103 -7.033 1.00 0.00 C ATOM 684 C SER A 126 28.521 -17.459 -8.171 1.00 0.00 C ATOM 685 O SER A 126 27.942 -17.018 -9.164 1.00 0.00 O ATOM 686 CB SER A 126 27.364 -19.535 -7.415 1.00 0.00 C ATOM 687 OG SER A 126 26.420 -20.040 -6.481 1.00 0.00 O ATOM 0 H SER A 126 25.678 -17.702 -7.180 1.00 0.00 H new ATOM 0 HA SER A 126 28.358 -18.113 -6.138 1.00 0.00 H new ATOM 0 HB2 SER A 126 26.946 -19.558 -8.421 1.00 0.00 H new ATOM 0 HB3 SER A 126 28.255 -20.163 -7.425 1.00 0.00 H new ATOM 0 HG SER A 126 26.178 -20.958 -6.724 1.00 0.00 H new ATOM 693 N GLY A 127 29.841 -17.415 -8.025 1.00 0.00 N ATOM 694 CA GLY A 127 30.697 -16.828 -9.051 1.00 0.00 C ATOM 695 C GLY A 127 31.057 -17.864 -10.107 1.00 0.00 C ATOM 696 O GLY A 127 30.469 -18.944 -10.156 1.00 0.00 O ATOM 0 H GLY A 127 30.340 -17.776 -7.212 1.00 0.00 H new ATOM 0 HA2 GLY A 127 30.187 -15.986 -9.519 1.00 0.00 H new ATOM 0 HA3 GLY A 127 31.606 -16.436 -8.594 1.00 0.00 H new ATOM 700 N GLU A 128 32.022 -17.527 -10.960 1.00 0.00 N ATOM 701 CA GLU A 128 32.449 -18.436 -12.014 1.00 0.00 C ATOM 702 C GLU A 128 33.719 -19.179 -11.599 1.00 0.00 C ATOM 703 O GLU A 128 34.675 -18.573 -11.120 1.00 0.00 O ATOM 704 CB GLU A 128 32.694 -17.658 -13.319 1.00 0.00 C ATOM 705 CG GLU A 128 34.126 -17.116 -13.349 1.00 0.00 C ATOM 706 CD GLU A 128 34.277 -16.086 -14.451 1.00 0.00 C ATOM 707 OE1 GLU A 128 33.364 -15.961 -15.246 1.00 0.00 O ATOM 708 OE2 GLU A 128 35.306 -15.434 -14.482 1.00 0.00 O1- ATOM 0 H GLU A 128 32.519 -16.636 -10.940 1.00 0.00 H new ATOM 0 HA GLU A 128 31.658 -19.167 -12.181 1.00 0.00 H new ATOM 0 HB2 GLU A 128 32.526 -18.309 -14.177 1.00 0.00 H new ATOM 0 HB3 GLU A 128 31.984 -16.835 -13.399 1.00 0.00 H new ATOM 0 HG2 GLU A 128 34.372 -16.667 -12.387 1.00 0.00 H new ATOM 0 HG3 GLU A 128 34.828 -17.934 -13.508 1.00 0.00 H new ATOM 715 N GLU A 129 33.734 -20.486 -11.801 1.00 0.00 N ATOM 716 CA GLU A 129 34.905 -21.280 -11.458 1.00 0.00 C ATOM 717 C GLU A 129 36.140 -20.759 -12.192 1.00 0.00 C ATOM 718 O GLU A 129 36.048 -20.253 -13.310 1.00 0.00 O ATOM 719 CB GLU A 129 34.668 -22.743 -11.831 1.00 0.00 C ATOM 720 CG GLU A 129 33.575 -23.325 -10.936 1.00 0.00 C ATOM 721 CD GLU A 129 33.283 -24.767 -11.337 1.00 0.00 C ATOM 722 OE1 GLU A 129 33.951 -25.259 -12.232 1.00 0.00 O ATOM 723 OE2 GLU A 129 32.395 -25.358 -10.746 1.00 0.00 O1- ATOM 0 H GLU A 129 32.958 -21.017 -12.197 1.00 0.00 H new ATOM 0 HA GLU A 129 35.074 -21.201 -10.384 1.00 0.00 H new ATOM 0 HB2 GLU A 129 34.375 -22.820 -12.878 1.00 0.00 H new ATOM 0 HB3 GLU A 129 35.590 -23.313 -11.715 1.00 0.00 H new ATOM 0 HG2 GLU A 129 33.889 -23.286 -9.893 1.00 0.00 H new ATOM 0 HG3 GLU A 129 32.668 -22.725 -11.019 1.00 0.00 H new ATOM 730 N ALA A 130 37.296 -20.891 -11.554 1.00 0.00 N ATOM 731 CA ALA A 130 38.545 -20.436 -12.152 1.00 0.00 C ATOM 732 C ALA A 130 39.741 -20.902 -11.329 1.00 0.00 C ATOM 733 O ALA A 130 39.597 -21.271 -10.166 1.00 0.00 O ATOM 734 CB ALA A 130 38.550 -18.910 -12.249 1.00 0.00 C ATOM 0 H ALA A 130 37.395 -21.307 -10.628 1.00 0.00 H new ATOM 0 HA ALA A 130 38.623 -20.865 -13.151 1.00 0.00 H new ATOM 0 HB1 ALA A 130 39.486 -18.577 -12.697 1.00 0.00 H new ATOM 0 HB2 ALA A 130 37.715 -18.582 -12.868 1.00 0.00 H new ATOM 0 HB3 ALA A 130 38.452 -18.482 -11.251 1.00 0.00 H new ATOM 740 N LYS A 131 40.921 -20.866 -11.936 1.00 0.00 N ATOM 741 CA LYS A 131 42.146 -21.270 -11.251 1.00 0.00 C ATOM 742 C LYS A 131 42.759 -20.085 -10.519 1.00 0.00 C ATOM 743 O LYS A 131 43.980 -19.984 -10.396 1.00 0.00 O ATOM 744 CB LYS A 131 43.152 -21.831 -12.253 1.00 0.00 C ATOM 745 CG LYS A 131 42.692 -23.212 -12.716 1.00 0.00 C ATOM 746 CD LYS A 131 43.671 -23.752 -13.760 1.00 0.00 C ATOM 747 CE LYS A 131 43.219 -25.139 -14.219 1.00 0.00 C ATOM 748 NZ LYS A 131 44.172 -25.663 -15.237 1.00 0.00 N1+ ATOM 0 H LYS A 131 41.057 -20.562 -12.900 1.00 0.00 H new ATOM 0 HA LYS A 131 41.895 -22.044 -10.526 1.00 0.00 H new ATOM 0 HB2 LYS A 131 43.243 -21.161 -13.108 1.00 0.00 H new ATOM 0 HB3 LYS A 131 44.139 -21.899 -11.795 1.00 0.00 H new ATOM 0 HG2 LYS A 131 42.638 -23.893 -11.866 1.00 0.00 H new ATOM 0 HG3 LYS A 131 41.690 -23.150 -13.140 1.00 0.00 H new ATOM 0 HD2 LYS A 131 43.720 -23.074 -14.612 1.00 0.00 H new ATOM 0 HD3 LYS A 131 44.675 -23.807 -13.338 1.00 0.00 H new ATOM 0 HE2 LYS A 131 43.171 -25.818 -13.367 1.00 0.00 H new ATOM 0 HE3 LYS A 131 42.215 -25.085 -14.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 43.864 -26.606 -15.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 44.196 -25.020 -16.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 45.123 -25.730 -14.821 1.00 0.00 H new ATOM 762 N THR A 132 41.912 -19.190 -10.032 1.00 0.00 N ATOM 763 CA THR A 132 42.386 -18.012 -9.308 1.00 0.00 C ATOM 764 C THR A 132 41.286 -17.446 -8.420 1.00 0.00 C ATOM 765 O THR A 132 40.102 -17.581 -8.722 1.00 0.00 O ATOM 766 CB THR A 132 42.850 -16.946 -10.301 1.00 0.00 C ATOM 767 OG1 THR A 132 43.147 -15.745 -9.604 1.00 0.00 O ATOM 768 CG2 THR A 132 41.745 -16.687 -11.324 1.00 0.00 C ATOM 0 H THR A 132 40.898 -19.253 -10.122 1.00 0.00 H new ATOM 0 HA THR A 132 43.223 -18.308 -8.676 1.00 0.00 H new ATOM 0 HB THR A 132 43.745 -17.294 -10.816 1.00 0.00 H new ATOM 0 HG1 THR A 132 43.446 -15.063 -10.241 1.00 0.00 H new ATOM 0 HG21 THR A 132 42.076 -15.927 -12.032 1.00 0.00 H new ATOM 0 HG22 THR A 132 41.522 -17.610 -11.860 1.00 0.00 H new ATOM 0 HG23 THR A 132 40.848 -16.339 -10.811 1.00 0.00 H new ATOM 776 N LYS A 133 41.684 -16.807 -7.326 1.00 0.00 N ATOM 777 CA LYS A 133 40.721 -16.214 -6.406 1.00 0.00 C ATOM 778 C LYS A 133 40.264 -14.853 -6.918 1.00 0.00 C ATOM 779 O LYS A 133 39.109 -14.464 -6.745 1.00 0.00 O ATOM 780 CB LYS A 133 41.345 -16.067 -5.017 1.00 0.00 C ATOM 781 CG LYS A 133 41.579 -17.452 -4.417 1.00 0.00 C ATOM 782 CD LYS A 133 42.230 -17.309 -3.037 1.00 0.00 C ATOM 783 CE LYS A 133 42.572 -18.695 -2.484 1.00 0.00 C ATOM 784 NZ LYS A 133 41.315 -19.451 -2.228 1.00 0.00 N1+ ATOM 0 H LYS A 133 42.660 -16.687 -7.056 1.00 0.00 H new ATOM 0 HA LYS A 133 39.854 -16.871 -6.339 1.00 0.00 H new ATOM 0 HB2 LYS A 133 42.288 -15.524 -5.085 1.00 0.00 H new ATOM 0 HB3 LYS A 133 40.688 -15.485 -4.371 1.00 0.00 H new ATOM 0 HG2 LYS A 133 40.633 -17.987 -4.331 1.00 0.00 H new ATOM 0 HG3 LYS A 133 42.220 -18.041 -5.074 1.00 0.00 H new ATOM 0 HD2 LYS A 133 43.133 -16.703 -3.111 1.00 0.00 H new ATOM 0 HD3 LYS A 133 41.554 -16.792 -2.357 1.00 0.00 H new ATOM 0 HE2 LYS A 133 43.197 -19.237 -3.193 1.00 0.00 H new ATOM 0 HE3 LYS A 133 43.146 -18.599 -1.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 41.541 -20.450 -2.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 40.832 -19.051 -1.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 40.692 -19.380 -3.058 1.00 0.00 H new ATOM 798 N LYS A 134 41.192 -14.124 -7.528 1.00 0.00 N ATOM 799 CA LYS A 134 40.887 -12.795 -8.043 1.00 0.00 C ATOM 800 C LYS A 134 39.678 -12.836 -8.961 1.00 0.00 C ATOM 801 O LYS A 134 38.715 -12.097 -8.759 1.00 0.00 O ATOM 802 CB LYS A 134 42.096 -12.255 -8.817 1.00 0.00 C ATOM 803 CG LYS A 134 43.326 -12.202 -7.896 1.00 0.00 C ATOM 804 CD LYS A 134 43.266 -10.950 -7.015 1.00 0.00 C ATOM 805 CE LYS A 134 44.553 -10.835 -6.204 1.00 0.00 C ATOM 806 NZ LYS A 134 45.693 -10.558 -7.122 1.00 0.00 N1+ ATOM 0 H LYS A 134 42.154 -14.428 -7.677 1.00 0.00 H new ATOM 0 HA LYS A 134 40.663 -12.141 -7.200 1.00 0.00 H new ATOM 0 HB2 LYS A 134 42.302 -12.892 -9.677 1.00 0.00 H new ATOM 0 HB3 LYS A 134 41.877 -11.259 -9.203 1.00 0.00 H new ATOM 0 HG2 LYS A 134 43.362 -13.095 -7.272 1.00 0.00 H new ATOM 0 HG3 LYS A 134 44.238 -12.193 -8.493 1.00 0.00 H new ATOM 0 HD2 LYS A 134 43.134 -10.063 -7.634 1.00 0.00 H new ATOM 0 HD3 LYS A 134 42.406 -11.004 -6.347 1.00 0.00 H new ATOM 0 HE2 LYS A 134 44.462 -10.036 -5.468 1.00 0.00 H new ATOM 0 HE3 LYS A 134 44.732 -11.758 -5.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 46.464 -10.104 -6.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 46.034 -11.451 -7.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 45.378 -9.925 -7.885 1.00 0.00 H new ATOM 820 N LEU A 135 39.730 -13.695 -9.971 1.00 0.00 N ATOM 821 CA LEU A 135 38.633 -13.813 -10.906 1.00 0.00 C ATOM 822 C LEU A 135 37.379 -14.337 -10.216 1.00 0.00 C ATOM 823 O LEU A 135 36.270 -13.884 -10.501 1.00 0.00 O ATOM 824 CB LEU A 135 39.026 -14.773 -12.043 1.00 0.00 C ATOM 825 CG LEU A 135 38.226 -14.426 -13.310 1.00 0.00 C ATOM 826 CD1 LEU A 135 38.934 -13.286 -14.067 1.00 0.00 C ATOM 827 CD2 LEU A 135 38.129 -15.660 -14.211 1.00 0.00 C ATOM 0 H LEU A 135 40.518 -14.315 -10.158 1.00 0.00 H new ATOM 0 HA LEU A 135 38.419 -12.823 -11.309 1.00 0.00 H new ATOM 0 HB2 LEU A 135 40.095 -14.698 -12.243 1.00 0.00 H new ATOM 0 HB3 LEU A 135 38.829 -15.803 -11.747 1.00 0.00 H new ATOM 0 HG LEU A 135 37.222 -14.106 -13.030 1.00 0.00 H new ATOM 0 HD11 LEU A 135 38.368 -13.039 -14.965 1.00 0.00 H new ATOM 0 HD12 LEU A 135 38.997 -12.407 -13.425 1.00 0.00 H new ATOM 0 HD13 LEU A 135 39.938 -13.604 -14.347 1.00 0.00 H new ATOM 0 HD21 LEU A 135 37.562 -15.412 -15.108 1.00 0.00 H new ATOM 0 HD22 LEU A 135 39.131 -15.984 -14.493 1.00 0.00 H new ATOM 0 HD23 LEU A 135 37.625 -16.464 -13.674 1.00 0.00 H new ATOM 839 N ALA A 136 37.563 -15.306 -9.325 1.00 0.00 N ATOM 840 CA ALA A 136 36.436 -15.897 -8.616 1.00 0.00 C ATOM 841 C ALA A 136 35.629 -14.821 -7.896 1.00 0.00 C ATOM 842 O ALA A 136 34.417 -14.718 -8.084 1.00 0.00 O ATOM 843 CB ALA A 136 36.947 -16.922 -7.600 1.00 0.00 C ATOM 0 H ALA A 136 38.473 -15.695 -9.079 1.00 0.00 H new ATOM 0 HA ALA A 136 35.789 -16.391 -9.341 1.00 0.00 H new ATOM 0 HB1 ALA A 136 36.102 -17.363 -7.071 1.00 0.00 H new ATOM 0 HB2 ALA A 136 37.498 -17.706 -8.120 1.00 0.00 H new ATOM 0 HB3 ALA A 136 37.605 -16.429 -6.885 1.00 0.00 H new ATOM 849 N GLU A 137 36.299 -14.030 -7.062 1.00 0.00 N ATOM 850 CA GLU A 137 35.619 -12.978 -6.316 1.00 0.00 C ATOM 851 C GLU A 137 34.985 -11.973 -7.272 1.00 0.00 C ATOM 852 O GLU A 137 33.878 -11.492 -7.035 1.00 0.00 O ATOM 853 CB GLU A 137 36.616 -12.264 -5.400 1.00 0.00 C ATOM 854 CG GLU A 137 37.135 -13.244 -4.340 1.00 0.00 C ATOM 855 CD GLU A 137 38.138 -12.544 -3.428 1.00 0.00 C ATOM 856 OE1 GLU A 137 38.400 -11.375 -3.655 1.00 0.00 O ATOM 857 OE2 GLU A 137 38.627 -13.189 -2.516 1.00 0.00 O1- ATOM 0 H GLU A 137 37.302 -14.097 -6.888 1.00 0.00 H new ATOM 0 HA GLU A 137 34.833 -13.430 -5.711 1.00 0.00 H new ATOM 0 HB2 GLU A 137 37.448 -11.873 -5.986 1.00 0.00 H new ATOM 0 HB3 GLU A 137 36.137 -11.412 -4.918 1.00 0.00 H new ATOM 0 HG2 GLU A 137 36.303 -13.629 -3.751 1.00 0.00 H new ATOM 0 HG3 GLU A 137 37.606 -14.100 -4.824 1.00 0.00 H new ATOM 864 N MET A 138 35.700 -11.652 -8.346 1.00 0.00 N ATOM 865 CA MET A 138 35.199 -10.695 -9.325 1.00 0.00 C ATOM 866 C MET A 138 33.917 -11.210 -9.978 1.00 0.00 C ATOM 867 O MET A 138 32.944 -10.469 -10.115 1.00 0.00 O ATOM 868 CB MET A 138 36.255 -10.451 -10.404 1.00 0.00 C ATOM 869 CG MET A 138 35.749 -9.391 -11.388 1.00 0.00 C ATOM 870 SD MET A 138 37.037 -9.030 -12.607 1.00 0.00 S ATOM 871 CE MET A 138 36.598 -10.326 -13.793 1.00 0.00 C ATOM 0 H MET A 138 36.620 -12.037 -8.559 1.00 0.00 H new ATOM 0 HA MET A 138 34.980 -9.761 -8.808 1.00 0.00 H new ATOM 0 HB2 MET A 138 37.188 -10.121 -9.946 1.00 0.00 H new ATOM 0 HB3 MET A 138 36.470 -11.379 -10.933 1.00 0.00 H new ATOM 0 HG2 MET A 138 34.849 -9.746 -11.890 1.00 0.00 H new ATOM 0 HG3 MET A 138 35.477 -8.482 -10.851 1.00 0.00 H new ATOM 0 HE1 MET A 138 37.279 -10.287 -14.644 1.00 0.00 H new ATOM 0 HE2 MET A 138 36.675 -11.301 -13.312 1.00 0.00 H new ATOM 0 HE3 MET A 138 35.576 -10.172 -14.139 1.00 0.00 H new ATOM 881 N SER A 139 33.928 -12.473 -10.395 1.00 0.00 N ATOM 882 CA SER A 139 32.765 -13.063 -11.044 1.00 0.00 C ATOM 883 C SER A 139 31.570 -13.078 -10.108 1.00 0.00 C ATOM 884 O SER A 139 30.446 -12.834 -10.536 1.00 0.00 O ATOM 885 CB SER A 139 33.083 -14.492 -11.495 1.00 0.00 C ATOM 886 OG SER A 139 34.136 -14.430 -12.444 1.00 0.00 O ATOM 0 H SER A 139 34.724 -13.103 -10.295 1.00 0.00 H new ATOM 0 HA SER A 139 32.517 -12.454 -11.913 1.00 0.00 H new ATOM 0 HB2 SER A 139 33.375 -15.104 -10.642 1.00 0.00 H new ATOM 0 HB3 SER A 139 32.201 -14.958 -11.935 1.00 0.00 H new ATOM 0 HG SER A 139 34.984 -14.262 -11.982 1.00 0.00 H new ATOM 892 N ALA A 140 31.821 -13.364 -8.834 1.00 0.00 N ATOM 893 CA ALA A 140 30.748 -13.409 -7.847 1.00 0.00 C ATOM 894 C ALA A 140 30.107 -12.035 -7.690 1.00 0.00 C ATOM 895 O ALA A 140 28.884 -11.906 -7.665 1.00 0.00 O ATOM 896 CB ALA A 140 31.302 -13.879 -6.500 1.00 0.00 C ATOM 0 H ALA A 140 32.749 -13.566 -8.463 1.00 0.00 H new ATOM 0 HA ALA A 140 29.988 -14.111 -8.191 1.00 0.00 H new ATOM 0 HB1 ALA A 140 30.496 -13.911 -5.766 1.00 0.00 H new ATOM 0 HB2 ALA A 140 31.732 -14.875 -6.611 1.00 0.00 H new ATOM 0 HB3 ALA A 140 32.073 -13.187 -6.162 1.00 0.00 H new ATOM 902 N ALA A 141 30.941 -11.010 -7.576 1.00 0.00 N ATOM 903 CA ALA A 141 30.449 -9.647 -7.420 1.00 0.00 C ATOM 904 C ALA A 141 29.857 -9.138 -8.730 1.00 0.00 C ATOM 905 O ALA A 141 29.022 -8.233 -8.735 1.00 0.00 O ATOM 906 CB ALA A 141 31.585 -8.723 -6.983 1.00 0.00 C ATOM 0 H ALA A 141 31.957 -11.095 -7.588 1.00 0.00 H new ATOM 0 HA ALA A 141 29.671 -9.651 -6.656 1.00 0.00 H new ATOM 0 HB1 ALA A 141 31.205 -7.708 -6.870 1.00 0.00 H new ATOM 0 HB2 ALA A 141 31.989 -9.068 -6.031 1.00 0.00 H new ATOM 0 HB3 ALA A 141 32.373 -8.734 -7.736 1.00 0.00 H new ATOM 912 N LYS A 142 30.290 -9.729 -9.841 1.00 0.00 N ATOM 913 CA LYS A 142 29.791 -9.331 -11.151 1.00 0.00 C ATOM 914 C LYS A 142 28.339 -9.756 -11.347 1.00 0.00 C ATOM 915 O LYS A 142 27.497 -8.964 -11.773 1.00 0.00 O ATOM 916 CB LYS A 142 30.658 -9.949 -12.247 1.00 0.00 C ATOM 917 CG LYS A 142 30.204 -9.430 -13.613 1.00 0.00 C ATOM 918 CD LYS A 142 31.134 -9.971 -14.701 1.00 0.00 C ATOM 919 CE LYS A 142 30.691 -9.438 -16.065 1.00 0.00 C ATOM 920 NZ LYS A 142 29.357 -10.007 -16.410 1.00 0.00 N1+ ATOM 0 H LYS A 142 30.980 -10.480 -9.859 1.00 0.00 H new ATOM 0 HA LYS A 142 29.839 -8.244 -11.212 1.00 0.00 H new ATOM 0 HB2 LYS A 142 31.706 -9.698 -12.081 1.00 0.00 H new ATOM 0 HB3 LYS A 142 30.582 -11.036 -12.216 1.00 0.00 H new ATOM 0 HG2 LYS A 142 29.178 -9.741 -13.809 1.00 0.00 H new ATOM 0 HG3 LYS A 142 30.213 -8.340 -13.621 1.00 0.00 H new ATOM 0 HD2 LYS A 142 32.162 -9.670 -14.498 1.00 0.00 H new ATOM 0 HD3 LYS A 142 31.115 -11.061 -14.701 1.00 0.00 H new ATOM 0 HE2 LYS A 142 30.640 -8.349 -16.043 1.00 0.00 H new ATOM 0 HE3 LYS A 142 31.422 -9.707 -16.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 29.197 -9.920 -17.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 29.327 -11.011 -16.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 28.615 -9.488 -15.898 1.00 0.00 H new ATOM 934 N VAL A 143 28.057 -11.018 -11.041 1.00 0.00 N ATOM 935 CA VAL A 143 26.709 -11.548 -11.192 1.00 0.00 C ATOM 936 C VAL A 143 25.763 -10.903 -10.186 1.00 0.00 C ATOM 937 O VAL A 143 24.594 -10.663 -10.489 1.00 0.00 O ATOM 938 CB VAL A 143 26.717 -13.067 -11.002 1.00 0.00 C ATOM 939 CG1 VAL A 143 27.330 -13.408 -9.645 1.00 0.00 C ATOM 940 CG2 VAL A 143 25.280 -13.596 -11.052 1.00 0.00 C ATOM 0 H VAL A 143 28.740 -11.689 -10.689 1.00 0.00 H new ATOM 0 HA VAL A 143 26.358 -11.316 -12.197 1.00 0.00 H new ATOM 0 HB VAL A 143 27.305 -13.527 -11.796 1.00 0.00 H new ATOM 0 HG11 VAL A 143 27.336 -14.490 -9.510 1.00 0.00 H new ATOM 0 HG12 VAL A 143 28.352 -13.032 -9.603 1.00 0.00 H new ATOM 0 HG13 VAL A 143 26.740 -12.946 -8.853 1.00 0.00 H new ATOM 0 HG21 VAL A 143 25.286 -14.678 -10.917 1.00 0.00 H new ATOM 0 HG22 VAL A 143 24.694 -13.134 -10.257 1.00 0.00 H new ATOM 0 HG23 VAL A 143 24.836 -13.353 -12.018 1.00 0.00 H new ATOM 950 N ALA A 144 26.272 -10.639 -8.986 1.00 0.00 N ATOM 951 CA ALA A 144 25.459 -10.037 -7.940 1.00 0.00 C ATOM 952 C ALA A 144 25.016 -8.638 -8.344 1.00 0.00 C ATOM 953 O ALA A 144 23.858 -8.270 -8.173 1.00 0.00 O ATOM 954 CB ALA A 144 26.261 -9.969 -6.639 1.00 0.00 C ATOM 0 H ALA A 144 27.237 -10.832 -8.717 1.00 0.00 H new ATOM 0 HA ALA A 144 24.572 -10.653 -7.790 1.00 0.00 H new ATOM 0 HB1 ALA A 144 25.649 -9.518 -5.858 1.00 0.00 H new ATOM 0 HB2 ALA A 144 26.551 -10.976 -6.337 1.00 0.00 H new ATOM 0 HB3 ALA A 144 27.155 -9.365 -6.794 1.00 0.00 H new ATOM 960 N PHE A 145 25.951 -7.861 -8.876 1.00 0.00 N ATOM 961 CA PHE A 145 25.656 -6.498 -9.296 1.00 0.00 C ATOM 962 C PHE A 145 24.580 -6.493 -10.375 1.00 0.00 C ATOM 963 O PHE A 145 23.678 -5.657 -10.360 1.00 0.00 O ATOM 964 CB PHE A 145 26.918 -5.821 -9.825 1.00 0.00 C ATOM 965 CG PHE A 145 26.642 -4.355 -10.064 1.00 0.00 C ATOM 966 CD1 PHE A 145 26.678 -3.452 -8.993 1.00 0.00 C ATOM 967 CD2 PHE A 145 26.349 -3.897 -11.354 1.00 0.00 C ATOM 968 CE1 PHE A 145 26.423 -2.094 -9.215 1.00 0.00 C ATOM 969 CE2 PHE A 145 26.095 -2.538 -11.574 1.00 0.00 C ATOM 970 CZ PHE A 145 26.131 -1.637 -10.504 1.00 0.00 C ATOM 0 H PHE A 145 26.917 -8.151 -9.026 1.00 0.00 H new ATOM 0 HA PHE A 145 25.291 -5.945 -8.430 1.00 0.00 H new ATOM 0 HB2 PHE A 145 27.732 -5.937 -9.110 1.00 0.00 H new ATOM 0 HB3 PHE A 145 27.238 -6.297 -10.752 1.00 0.00 H new ATOM 0 HD1 PHE A 145 26.902 -3.804 -7.997 1.00 0.00 H new ATOM 0 HD2 PHE A 145 26.319 -4.592 -12.180 1.00 0.00 H new ATOM 0 HE1 PHE A 145 26.452 -1.398 -8.390 1.00 0.00 H new ATOM 0 HE2 PHE A 145 25.871 -2.185 -12.570 1.00 0.00 H new ATOM 0 HZ PHE A 145 25.933 -0.589 -10.674 1.00 0.00 H new ATOM 980 N MET A 146 24.685 -7.427 -11.314 1.00 0.00 N ATOM 981 CA MET A 146 23.719 -7.515 -12.400 1.00 0.00 C ATOM 982 C MET A 146 22.331 -7.841 -11.861 1.00 0.00 C ATOM 983 O MET A 146 21.331 -7.309 -12.334 1.00 0.00 O ATOM 984 CB MET A 146 24.149 -8.600 -13.390 1.00 0.00 C ATOM 985 CG MET A 146 23.174 -8.635 -14.569 1.00 0.00 C ATOM 986 SD MET A 146 23.728 -9.861 -15.779 1.00 0.00 S ATOM 987 CE MET A 146 22.884 -11.289 -15.058 1.00 0.00 C ATOM 0 H MET A 146 25.424 -8.129 -11.344 1.00 0.00 H new ATOM 0 HA MET A 146 23.681 -6.550 -12.906 1.00 0.00 H new ATOM 0 HB2 MET A 146 25.160 -8.401 -13.747 1.00 0.00 H new ATOM 0 HB3 MET A 146 24.171 -9.571 -12.894 1.00 0.00 H new ATOM 0 HG2 MET A 146 22.172 -8.883 -14.218 1.00 0.00 H new ATOM 0 HG3 MET A 146 23.115 -7.651 -15.034 1.00 0.00 H new ATOM 0 HE1 MET A 146 23.092 -12.175 -15.657 1.00 0.00 H new ATOM 0 HE2 MET A 146 23.241 -11.447 -14.040 1.00 0.00 H new ATOM 0 HE3 MET A 146 21.810 -11.106 -15.041 1.00 0.00 H new ATOM 997 N SER A 147 22.275 -8.730 -10.875 1.00 0.00 N ATOM 998 CA SER A 147 20.998 -9.117 -10.287 1.00 0.00 C ATOM 999 C SER A 147 20.383 -7.958 -9.510 1.00 0.00 C ATOM 1000 O SER A 147 19.183 -7.701 -9.603 1.00 0.00 O ATOM 1001 CB SER A 147 21.198 -10.306 -9.354 1.00 0.00 C ATOM 1002 OG SER A 147 21.687 -11.411 -10.099 1.00 0.00 O ATOM 0 H SER A 147 23.089 -9.192 -10.470 1.00 0.00 H new ATOM 0 HA SER A 147 20.320 -9.393 -11.094 1.00 0.00 H new ATOM 0 HB2 SER A 147 21.901 -10.047 -8.562 1.00 0.00 H new ATOM 0 HB3 SER A 147 20.256 -10.567 -8.871 1.00 0.00 H new ATOM 0 HG SER A 147 22.635 -11.273 -10.305 1.00 0.00 H new ATOM 1008 N ILE A 148 21.213 -7.268 -8.736 1.00 0.00 N ATOM 1009 CA ILE A 148 20.739 -6.142 -7.940 1.00 0.00 C ATOM 1010 C ILE A 148 20.050 -5.108 -8.825 1.00 0.00 C ATOM 1011 O ILE A 148 19.116 -4.432 -8.391 1.00 0.00 O ATOM 1012 CB ILE A 148 21.912 -5.488 -7.202 1.00 0.00 C ATOM 1013 CG1 ILE A 148 22.397 -6.423 -6.090 1.00 0.00 C ATOM 1014 CG2 ILE A 148 21.465 -4.157 -6.588 1.00 0.00 C ATOM 1015 CD1 ILE A 148 23.738 -5.920 -5.554 1.00 0.00 C ATOM 0 H ILE A 148 22.209 -7.466 -8.643 1.00 0.00 H new ATOM 0 HA ILE A 148 20.018 -6.517 -7.213 1.00 0.00 H new ATOM 0 HB ILE A 148 22.722 -5.303 -7.908 1.00 0.00 H new ATOM 0 HG12 ILE A 148 21.662 -6.461 -5.286 1.00 0.00 H new ATOM 0 HG13 ILE A 148 22.503 -7.438 -6.473 1.00 0.00 H new ATOM 0 HG21 ILE A 148 22.304 -3.698 -6.065 1.00 0.00 H new ATOM 0 HG22 ILE A 148 21.120 -3.489 -7.378 1.00 0.00 H new ATOM 0 HG23 ILE A 148 20.652 -4.336 -5.884 1.00 0.00 H new ATOM 0 HD11 ILE A 148 24.085 -6.584 -4.762 1.00 0.00 H new ATOM 0 HD12 ILE A 148 24.470 -5.904 -6.362 1.00 0.00 H new ATOM 0 HD13 ILE A 148 23.616 -4.913 -5.155 1.00 0.00 H new ATOM 1027 N LYS A 149 20.511 -4.992 -10.063 1.00 0.00 N ATOM 1028 CA LYS A 149 19.927 -4.040 -10.995 1.00 0.00 C ATOM 1029 C LYS A 149 18.466 -4.381 -11.259 1.00 0.00 C ATOM 1030 O LYS A 149 17.621 -3.494 -11.364 1.00 0.00 O ATOM 1031 CB LYS A 149 20.707 -4.051 -12.308 1.00 0.00 C ATOM 1032 CG LYS A 149 22.055 -3.357 -12.111 1.00 0.00 C ATOM 1033 CD LYS A 149 22.893 -3.490 -13.388 1.00 0.00 C ATOM 1034 CE LYS A 149 22.359 -2.537 -14.462 1.00 0.00 C ATOM 1035 NZ LYS A 149 23.368 -2.393 -15.543 1.00 0.00 N1+ ATOM 0 H LYS A 149 21.282 -5.541 -10.442 1.00 0.00 H new ATOM 0 HA LYS A 149 19.980 -3.045 -10.554 1.00 0.00 H new ATOM 0 HB2 LYS A 149 20.860 -5.077 -12.643 1.00 0.00 H new ATOM 0 HB3 LYS A 149 20.136 -3.544 -13.086 1.00 0.00 H new ATOM 0 HG2 LYS A 149 21.902 -2.305 -11.872 1.00 0.00 H new ATOM 0 HG3 LYS A 149 22.585 -3.801 -11.268 1.00 0.00 H new ATOM 0 HD2 LYS A 149 23.937 -3.262 -13.174 1.00 0.00 H new ATOM 0 HD3 LYS A 149 22.859 -4.517 -13.751 1.00 0.00 H new ATOM 0 HE2 LYS A 149 21.424 -2.920 -14.871 1.00 0.00 H new ATOM 0 HE3 LYS A 149 22.139 -1.564 -14.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 23.006 -1.746 -16.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 24.249 -2.009 -15.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 23.556 -3.323 -15.968 1.00 0.00 H new