USER MOD reduce.3.24.130724 H: found=0, std=0, add=740, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 738 hydrogens (10 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 36 GLN : amide:sc= 0.159 K(o=-0.96,f=-8.8!) USER MOD Set 1.2: A 48 ASN : amide:sc= -1.12 K(o=-0.96,f=-8!) USER MOD Set 2.1: A 14 SER OG : rot 180:sc= 0.148 USER MOD Set 2.2: A 113 ASN : amide:sc= 0.0303 X(o=0.18,f=0.43) USER MOD Single : A 1 ALA N :NH3+ -127:sc= 0.0845 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot -170:sc= -0.744 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 106:sc= 1.33 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 GLN : amide:sc= -0.116 K(o=-0.12,f=-1.2!) USER MOD Single : A 30 THR OG1 : rot -160:sc= -0.0495 USER MOD Single : A 32 TYR OH : rot -40:sc= -0.67! USER MOD Single : A 42 THR OG1 : rot 180:sc= 0.0172 USER MOD Single : A 53 SER OG : rot 180:sc= -0.0721 USER MOD Single : A 54 SER OG : rot 180:sc= 0.0399 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 62 SER OG : rot 44:sc= 0.315 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 166:sc= 0.748 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 82:sc= 1.25 USER MOD Single : A 72 SER OG : rot -95:sc= 1.29 USER MOD Single : A 81 THR OG1 : rot 121:sc= 1.34 USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot 62:sc= 1.25 USER MOD Single : A 90 THR OG1 : rot -40:sc= 0.0877 USER MOD Single : A 94 GLN : amide:sc= -0.447 X(o=-0.45,f=-0.058) USER MOD Single : A 98 SER OG : rot -1:sc= 0.347 USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 SER OG : rot 180:sc=-0.00303 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -15.556 5.730 15.724 1.00 0.00 N ATOM 2 CA ALA A 1 -16.217 4.420 15.544 1.00 0.00 C ATOM 3 C ALA A 1 -15.201 3.364 15.135 1.00 0.00 C ATOM 4 O ALA A 1 -14.078 3.690 14.752 1.00 0.00 O ATOM 5 CB ALA A 1 -17.323 4.523 14.510 1.00 0.00 C ATOM 0 H1 ALA A 1 -15.791 6.111 16.663 1.00 0.00 H new ATOM 0 H2 ALA A 1 -14.526 5.613 15.646 1.00 0.00 H new ATOM 0 H3 ALA A 1 -15.886 6.389 14.990 1.00 0.00 H new ATOM 0 HA ALA A 1 -16.660 4.122 16.494 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -17.800 3.550 14.389 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -18.063 5.251 14.841 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -16.901 4.841 13.557 1.00 0.00 H new ATOM 11 N ALA A 2 -15.598 2.105 15.211 1.00 0.00 N ATOM 12 CA ALA A 2 -14.713 1.007 14.865 1.00 0.00 C ATOM 13 C ALA A 2 -14.889 0.582 13.410 1.00 0.00 C ATOM 14 O ALA A 2 -15.934 0.043 13.033 1.00 0.00 O ATOM 15 CB ALA A 2 -14.968 -0.163 15.794 1.00 0.00 C ATOM 0 H ALA A 2 -16.530 1.818 15.510 1.00 0.00 H new ATOM 0 HA ALA A 2 -13.684 1.346 14.983 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -14.303 -0.986 15.533 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -14.781 0.142 16.823 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -16.004 -0.488 15.694 1.00 0.00 H new ATOM 21 N PRO A 3 -13.861 0.810 12.576 1.00 0.00 N ATOM 22 CA PRO A 3 -13.895 0.451 11.155 1.00 0.00 C ATOM 23 C PRO A 3 -13.687 -1.045 10.939 1.00 0.00 C ATOM 24 O PRO A 3 -13.357 -1.776 11.874 1.00 0.00 O ATOM 25 CB PRO A 3 -12.733 1.249 10.572 1.00 0.00 C ATOM 26 CG PRO A 3 -11.759 1.362 11.692 1.00 0.00 C ATOM 27 CD PRO A 3 -12.576 1.432 12.957 1.00 0.00 C ATOM 0 HA PRO A 3 -14.856 0.673 10.690 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -12.294 0.741 9.714 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -13.059 2.231 10.229 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -11.086 0.505 11.710 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -11.139 2.251 11.580 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -12.097 0.893 13.774 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -12.712 2.461 13.290 1.00 0.00 H new ATOM 35 N THR A 4 -13.872 -1.504 9.714 1.00 0.00 N ATOM 36 CA THR A 4 -13.706 -2.912 9.406 1.00 0.00 C ATOM 37 C THR A 4 -12.711 -3.115 8.268 1.00 0.00 C ATOM 38 O THR A 4 -13.092 -3.279 7.106 1.00 0.00 O ATOM 39 CB THR A 4 -15.054 -3.561 9.047 1.00 0.00 C ATOM 40 OG1 THR A 4 -16.001 -2.546 8.681 1.00 0.00 O ATOM 41 CG2 THR A 4 -15.591 -4.361 10.221 1.00 0.00 C ATOM 0 H THR A 4 -14.137 -0.923 8.918 1.00 0.00 H new ATOM 0 HA THR A 4 -13.312 -3.396 10.300 1.00 0.00 H new ATOM 0 HB THR A 4 -14.900 -4.236 8.205 1.00 0.00 H new ATOM 0 HG1 THR A 4 -16.857 -2.965 8.452 1.00 0.00 H new ATOM 0 HG21 THR A 4 -16.545 -4.812 9.948 1.00 0.00 H new ATOM 0 HG22 THR A 4 -14.880 -5.145 10.483 1.00 0.00 H new ATOM 0 HG23 THR A 4 -15.734 -3.701 11.076 1.00 0.00 H new ATOM 49 N ALA A 5 -11.430 -3.083 8.606 1.00 0.00 N ATOM 50 CA ALA A 5 -10.381 -3.272 7.619 1.00 0.00 C ATOM 51 C ALA A 5 -10.009 -4.743 7.529 1.00 0.00 C ATOM 52 O ALA A 5 -9.365 -5.287 8.424 1.00 0.00 O ATOM 53 CB ALA A 5 -9.163 -2.429 7.960 1.00 0.00 C ATOM 0 H ALA A 5 -11.094 -2.928 9.556 1.00 0.00 H new ATOM 0 HA ALA A 5 -10.754 -2.946 6.648 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -8.390 -2.586 7.208 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -9.443 -1.376 7.978 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -8.782 -2.720 8.939 1.00 0.00 H new ATOM 59 N THR A 6 -10.431 -5.385 6.454 1.00 0.00 N ATOM 60 CA THR A 6 -10.154 -6.791 6.244 1.00 0.00 C ATOM 61 C THR A 6 -9.254 -6.985 5.027 1.00 0.00 C ATOM 62 O THR A 6 -9.713 -6.950 3.884 1.00 0.00 O ATOM 63 CB THR A 6 -11.470 -7.572 6.061 1.00 0.00 C ATOM 64 OG1 THR A 6 -12.415 -6.773 5.333 1.00 0.00 O ATOM 65 CG2 THR A 6 -12.064 -7.954 7.408 1.00 0.00 C ATOM 0 H THR A 6 -10.972 -4.948 5.708 1.00 0.00 H new ATOM 0 HA THR A 6 -9.635 -7.175 7.123 1.00 0.00 H new ATOM 0 HB THR A 6 -11.251 -8.483 5.503 1.00 0.00 H new ATOM 0 HG1 THR A 6 -13.249 -7.275 5.218 1.00 0.00 H new ATOM 0 HG21 THR A 6 -12.992 -8.504 7.253 1.00 0.00 H new ATOM 0 HG22 THR A 6 -11.357 -8.580 7.953 1.00 0.00 H new ATOM 0 HG23 THR A 6 -12.269 -7.052 7.984 1.00 0.00 H new ATOM 73 N VAL A 7 -7.962 -7.166 5.269 1.00 0.00 N ATOM 74 CA VAL A 7 -7.009 -7.353 4.184 1.00 0.00 C ATOM 75 C VAL A 7 -6.370 -8.737 4.235 1.00 0.00 C ATOM 76 O VAL A 7 -6.384 -9.404 5.269 1.00 0.00 O ATOM 77 CB VAL A 7 -5.898 -6.279 4.205 1.00 0.00 C ATOM 78 CG1 VAL A 7 -6.496 -4.886 4.087 1.00 0.00 C ATOM 79 CG2 VAL A 7 -5.052 -6.392 5.467 1.00 0.00 C ATOM 0 H VAL A 7 -7.552 -7.187 6.203 1.00 0.00 H new ATOM 0 HA VAL A 7 -7.574 -7.255 3.257 1.00 0.00 H new ATOM 0 HB VAL A 7 -5.249 -6.450 3.346 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -5.697 -4.145 4.104 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -7.047 -4.805 3.150 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -7.173 -4.709 4.923 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -4.278 -5.625 5.456 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -5.686 -6.256 6.343 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -4.586 -7.377 5.506 1.00 0.00 H new ATOM 89 N THR A 8 -5.816 -9.158 3.110 1.00 0.00 N ATOM 90 CA THR A 8 -5.164 -10.453 3.015 1.00 0.00 C ATOM 91 C THR A 8 -3.702 -10.287 2.606 1.00 0.00 C ATOM 92 O THR A 8 -3.393 -10.164 1.418 1.00 0.00 O ATOM 93 CB THR A 8 -5.874 -11.356 1.992 1.00 0.00 C ATOM 94 OG1 THR A 8 -7.297 -11.198 2.096 1.00 0.00 O ATOM 95 CG2 THR A 8 -5.509 -12.812 2.213 1.00 0.00 C ATOM 0 H THR A 8 -5.805 -8.618 2.245 1.00 0.00 H new ATOM 0 HA THR A 8 -5.217 -10.921 3.998 1.00 0.00 H new ATOM 0 HB THR A 8 -5.548 -11.060 0.995 1.00 0.00 H new ATOM 0 HG1 THR A 8 -7.739 -11.776 1.439 1.00 0.00 H new ATOM 0 HG21 THR A 8 -6.023 -13.432 1.478 1.00 0.00 H new ATOM 0 HG22 THR A 8 -4.432 -12.938 2.104 1.00 0.00 H new ATOM 0 HG23 THR A 8 -5.810 -13.114 3.216 1.00 0.00 H new ATOM 103 N PRO A 9 -2.785 -10.264 3.585 1.00 0.00 N ATOM 104 CA PRO A 9 -1.352 -10.103 3.322 1.00 0.00 C ATOM 105 C PRO A 9 -0.724 -11.363 2.735 1.00 0.00 C ATOM 106 O PRO A 9 -1.150 -12.479 3.035 1.00 0.00 O ATOM 107 CB PRO A 9 -0.774 -9.811 4.706 1.00 0.00 C ATOM 108 CG PRO A 9 -1.704 -10.483 5.653 1.00 0.00 C ATOM 109 CD PRO A 9 -3.068 -10.401 5.028 1.00 0.00 C ATOM 0 HA PRO A 9 -1.155 -9.322 2.588 1.00 0.00 H new ATOM 0 HB2 PRO A 9 0.239 -10.201 4.802 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -0.722 -8.739 4.895 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -1.412 -11.520 5.816 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -1.691 -9.992 6.626 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -3.658 -11.293 5.237 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -3.632 -9.549 5.408 1.00 0.00 H new ATOM 117 N SER A 10 0.280 -11.183 1.886 1.00 0.00 N ATOM 118 CA SER A 10 0.962 -12.305 1.261 1.00 0.00 C ATOM 119 C SER A 10 2.011 -12.899 2.202 1.00 0.00 C ATOM 120 O SER A 10 3.173 -12.483 2.205 1.00 0.00 O ATOM 121 CB SER A 10 1.609 -11.845 -0.046 1.00 0.00 C ATOM 122 OG SER A 10 0.719 -11.025 -0.788 1.00 0.00 O ATOM 0 H SER A 10 0.639 -10.268 1.615 1.00 0.00 H new ATOM 0 HA SER A 10 0.232 -13.085 1.044 1.00 0.00 H new ATOM 0 HB2 SER A 10 2.524 -11.293 0.170 1.00 0.00 H new ATOM 0 HB3 SER A 10 1.893 -12.713 -0.641 1.00 0.00 H new ATOM 0 HG SER A 10 1.086 -10.871 -1.684 1.00 0.00 H new ATOM 128 N SER A 11 1.594 -13.864 3.004 1.00 0.00 N ATOM 129 CA SER A 11 2.487 -14.510 3.945 1.00 0.00 C ATOM 130 C SER A 11 2.880 -15.899 3.449 1.00 0.00 C ATOM 131 O SER A 11 2.041 -16.798 3.345 1.00 0.00 O ATOM 132 CB SER A 11 1.814 -14.600 5.313 1.00 0.00 C ATOM 133 OG SER A 11 1.347 -13.323 5.724 1.00 0.00 O ATOM 0 H SER A 11 0.637 -14.217 3.020 1.00 0.00 H new ATOM 0 HA SER A 11 3.396 -13.915 4.034 1.00 0.00 H new ATOM 0 HB2 SER A 11 0.981 -15.301 5.269 1.00 0.00 H new ATOM 0 HB3 SER A 11 2.520 -14.989 6.047 1.00 0.00 H new ATOM 0 HG SER A 11 0.917 -13.399 6.601 1.00 0.00 H new ATOM 139 N GLY A 12 4.158 -16.058 3.117 1.00 0.00 N ATOM 140 CA GLY A 12 4.651 -17.333 2.638 1.00 0.00 C ATOM 141 C GLY A 12 4.445 -17.506 1.150 1.00 0.00 C ATOM 142 O GLY A 12 4.365 -18.628 0.649 1.00 0.00 O ATOM 0 H GLY A 12 4.862 -15.322 3.172 1.00 0.00 H new ATOM 0 HA2 GLY A 12 5.713 -17.419 2.868 1.00 0.00 H new ATOM 0 HA3 GLY A 12 4.144 -18.139 3.169 1.00 0.00 H new ATOM 146 N LEU A 13 4.369 -16.395 0.437 1.00 0.00 N ATOM 147 CA LEU A 13 4.169 -16.426 -1.001 1.00 0.00 C ATOM 148 C LEU A 13 5.340 -15.750 -1.694 1.00 0.00 C ATOM 149 O LEU A 13 6.101 -15.026 -1.058 1.00 0.00 O ATOM 150 CB LEU A 13 2.852 -15.737 -1.370 1.00 0.00 C ATOM 151 CG LEU A 13 1.612 -16.294 -0.663 1.00 0.00 C ATOM 152 CD1 LEU A 13 0.397 -15.425 -0.940 1.00 0.00 C ATOM 153 CD2 LEU A 13 1.344 -17.723 -1.101 1.00 0.00 C ATOM 0 H LEU A 13 4.443 -15.458 0.833 1.00 0.00 H new ATOM 0 HA LEU A 13 4.114 -17.463 -1.333 1.00 0.00 H new ATOM 0 HB2 LEU A 13 2.937 -14.675 -1.139 1.00 0.00 H new ATOM 0 HB3 LEU A 13 2.706 -15.819 -2.447 1.00 0.00 H new ATOM 0 HG LEU A 13 1.804 -16.288 0.410 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -0.471 -15.840 -0.428 1.00 0.00 H new ATOM 0 HD12 LEU A 13 0.583 -14.414 -0.578 1.00 0.00 H new ATOM 0 HD13 LEU A 13 0.207 -15.397 -2.013 1.00 0.00 H new ATOM 0 HD21 LEU A 13 0.460 -18.101 -0.588 1.00 0.00 H new ATOM 0 HD22 LEU A 13 1.177 -17.748 -2.178 1.00 0.00 H new ATOM 0 HD23 LEU A 13 2.202 -18.347 -0.852 1.00 0.00 H new ATOM 165 N SER A 14 5.500 -16.002 -2.983 1.00 0.00 N ATOM 166 CA SER A 14 6.591 -15.407 -3.745 1.00 0.00 C ATOM 167 C SER A 14 6.199 -14.030 -4.280 1.00 0.00 C ATOM 168 O SER A 14 5.105 -13.535 -4.003 1.00 0.00 O ATOM 169 CB SER A 14 6.968 -16.327 -4.904 1.00 0.00 C ATOM 170 OG SER A 14 6.990 -17.684 -4.488 1.00 0.00 O ATOM 0 H SER A 14 4.890 -16.614 -3.525 1.00 0.00 H new ATOM 0 HA SER A 14 7.448 -15.283 -3.082 1.00 0.00 H new ATOM 0 HB2 SER A 14 6.254 -16.204 -5.718 1.00 0.00 H new ATOM 0 HB3 SER A 14 7.947 -16.046 -5.293 1.00 0.00 H new ATOM 0 HG SER A 14 7.232 -18.255 -5.247 1.00 0.00 H new ATOM 176 N ASP A 15 7.092 -13.409 -5.039 1.00 0.00 N ATOM 177 CA ASP A 15 6.813 -12.101 -5.613 1.00 0.00 C ATOM 178 C ASP A 15 5.877 -12.254 -6.805 1.00 0.00 C ATOM 179 O ASP A 15 5.808 -13.320 -7.415 1.00 0.00 O ATOM 180 CB ASP A 15 8.107 -11.385 -6.023 1.00 0.00 C ATOM 181 CG ASP A 15 8.983 -12.217 -6.937 1.00 0.00 C ATOM 182 OD1 ASP A 15 9.468 -13.277 -6.493 1.00 0.00 O ATOM 183 OD2 ASP A 15 9.216 -11.805 -8.088 1.00 0.00 O ATOM 0 H ASP A 15 8.010 -13.788 -5.270 1.00 0.00 H new ATOM 0 HA ASP A 15 6.327 -11.486 -4.856 1.00 0.00 H new ATOM 0 HB2 ASP A 15 7.855 -10.450 -6.523 1.00 0.00 H new ATOM 0 HB3 ASP A 15 8.671 -11.125 -5.127 1.00 0.00 H new ATOM 188 N GLY A 16 5.148 -11.196 -7.124 1.00 0.00 N ATOM 189 CA GLY A 16 4.202 -11.252 -8.221 1.00 0.00 C ATOM 190 C GLY A 16 2.816 -11.629 -7.730 1.00 0.00 C ATOM 191 O GLY A 16 1.863 -11.711 -8.510 1.00 0.00 O ATOM 0 H GLY A 16 5.194 -10.298 -6.643 1.00 0.00 H new ATOM 0 HA2 GLY A 16 4.163 -10.284 -8.721 1.00 0.00 H new ATOM 0 HA3 GLY A 16 4.540 -11.979 -8.959 1.00 0.00 H new ATOM 195 N THR A 17 2.714 -11.854 -6.426 1.00 0.00 N ATOM 196 CA THR A 17 1.460 -12.224 -5.790 1.00 0.00 C ATOM 197 C THR A 17 0.519 -11.021 -5.706 1.00 0.00 C ATOM 198 O THR A 17 0.965 -9.878 -5.568 1.00 0.00 O ATOM 199 CB THR A 17 1.728 -12.791 -4.381 1.00 0.00 C ATOM 200 OG1 THR A 17 2.575 -13.944 -4.482 1.00 0.00 O ATOM 201 CG2 THR A 17 0.435 -13.164 -3.674 1.00 0.00 C ATOM 0 H THR A 17 3.501 -11.784 -5.780 1.00 0.00 H new ATOM 0 HA THR A 17 0.980 -12.992 -6.396 1.00 0.00 H new ATOM 0 HB THR A 17 2.220 -12.017 -3.792 1.00 0.00 H new ATOM 0 HG1 THR A 17 3.478 -13.714 -4.180 1.00 0.00 H new ATOM 0 HG21 THR A 17 0.663 -13.560 -2.684 1.00 0.00 H new ATOM 0 HG22 THR A 17 -0.194 -12.279 -3.575 1.00 0.00 H new ATOM 0 HG23 THR A 17 -0.092 -13.921 -4.255 1.00 0.00 H new ATOM 209 N VAL A 18 -0.776 -11.280 -5.807 1.00 0.00 N ATOM 210 CA VAL A 18 -1.772 -10.229 -5.743 1.00 0.00 C ATOM 211 C VAL A 18 -2.307 -10.087 -4.322 1.00 0.00 C ATOM 212 O VAL A 18 -2.978 -10.983 -3.804 1.00 0.00 O ATOM 213 CB VAL A 18 -2.946 -10.502 -6.704 1.00 0.00 C ATOM 214 CG1 VAL A 18 -3.934 -9.348 -6.687 1.00 0.00 C ATOM 215 CG2 VAL A 18 -2.437 -10.754 -8.115 1.00 0.00 C ATOM 0 H VAL A 18 -1.160 -12.216 -5.934 1.00 0.00 H new ATOM 0 HA VAL A 18 -1.285 -9.302 -6.046 1.00 0.00 H new ATOM 0 HB VAL A 18 -3.464 -11.398 -6.363 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -4.754 -9.561 -7.372 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -4.327 -9.221 -5.678 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -3.430 -8.433 -6.998 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -3.281 -10.945 -8.778 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -1.890 -9.879 -8.466 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -1.774 -11.619 -8.114 1.00 0.00 H new ATOM 225 N VAL A 19 -1.990 -8.967 -3.697 1.00 0.00 N ATOM 226 CA VAL A 19 -2.434 -8.680 -2.344 1.00 0.00 C ATOM 227 C VAL A 19 -3.872 -8.175 -2.364 1.00 0.00 C ATOM 228 O VAL A 19 -4.199 -7.233 -3.089 1.00 0.00 O ATOM 229 CB VAL A 19 -1.537 -7.623 -1.664 1.00 0.00 C ATOM 230 CG1 VAL A 19 -1.857 -7.521 -0.181 1.00 0.00 C ATOM 231 CG2 VAL A 19 -0.061 -7.938 -1.876 1.00 0.00 C ATOM 0 H VAL A 19 -1.418 -8.231 -4.112 1.00 0.00 H new ATOM 0 HA VAL A 19 -2.370 -9.606 -1.773 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.744 -6.658 -2.127 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -1.214 -6.771 0.279 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -2.900 -7.233 -0.053 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -1.686 -8.487 0.295 1.00 0.00 H new ATOM 0 HG21 VAL A 19 0.547 -7.177 -1.387 1.00 0.00 H new ATOM 0 HG22 VAL A 19 0.167 -8.915 -1.450 1.00 0.00 H new ATOM 0 HG23 VAL A 19 0.159 -7.947 -2.943 1.00 0.00 H new ATOM 241 N LYS A 20 -4.718 -8.805 -1.564 1.00 0.00 N ATOM 242 CA LYS A 20 -6.126 -8.442 -1.486 1.00 0.00 C ATOM 243 C LYS A 20 -6.358 -7.437 -0.366 1.00 0.00 C ATOM 244 O LYS A 20 -6.023 -7.695 0.793 1.00 0.00 O ATOM 245 CB LYS A 20 -6.968 -9.697 -1.258 1.00 0.00 C ATOM 246 CG LYS A 20 -8.468 -9.458 -1.302 1.00 0.00 C ATOM 247 CD LYS A 20 -9.224 -10.774 -1.363 1.00 0.00 C ATOM 248 CE LYS A 20 -9.187 -11.370 -2.760 1.00 0.00 C ATOM 249 NZ LYS A 20 -9.640 -12.783 -2.778 1.00 0.00 N ATOM 0 H LYS A 20 -4.451 -9.578 -0.954 1.00 0.00 H new ATOM 0 HA LYS A 20 -6.424 -7.978 -2.426 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -6.707 -10.438 -2.014 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.708 -10.124 -0.290 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -8.777 -8.897 -0.420 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -8.718 -8.849 -2.171 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -8.789 -11.478 -0.654 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -10.259 -10.615 -1.061 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -9.819 -10.779 -3.422 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -8.172 -11.311 -3.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -9.598 -13.149 -3.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -9.022 -13.354 -2.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -10.618 -12.838 -2.429 1.00 0.00 H new ATOM 263 N VAL A 21 -6.923 -6.292 -0.713 1.00 0.00 N ATOM 264 CA VAL A 21 -7.195 -5.248 0.265 1.00 0.00 C ATOM 265 C VAL A 21 -8.661 -4.821 0.226 1.00 0.00 C ATOM 266 O VAL A 21 -9.174 -4.431 -0.823 1.00 0.00 O ATOM 267 CB VAL A 21 -6.292 -4.017 0.019 1.00 0.00 C ATOM 268 CG1 VAL A 21 -6.701 -2.849 0.904 1.00 0.00 C ATOM 269 CG2 VAL A 21 -4.829 -4.372 0.239 1.00 0.00 C ATOM 0 H VAL A 21 -7.203 -6.060 -1.666 1.00 0.00 H new ATOM 0 HA VAL A 21 -6.977 -5.661 1.250 1.00 0.00 H new ATOM 0 HB VAL A 21 -6.420 -3.710 -1.019 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -6.048 -1.998 0.709 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -7.733 -2.572 0.687 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -6.616 -3.139 1.951 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -4.210 -3.492 0.061 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -4.688 -4.713 1.264 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -4.539 -5.165 -0.451 1.00 0.00 H new ATOM 279 N ALA A 22 -9.327 -4.900 1.372 1.00 0.00 N ATOM 280 CA ALA A 22 -10.726 -4.511 1.478 1.00 0.00 C ATOM 281 C ALA A 22 -10.975 -3.728 2.761 1.00 0.00 C ATOM 282 O ALA A 22 -10.994 -4.291 3.857 1.00 0.00 O ATOM 283 CB ALA A 22 -11.624 -5.737 1.420 1.00 0.00 C ATOM 0 H ALA A 22 -8.917 -5.232 2.245 1.00 0.00 H new ATOM 0 HA ALA A 22 -10.965 -3.865 0.633 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -12.666 -5.429 1.501 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -11.471 -6.256 0.474 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -11.379 -6.407 2.244 1.00 0.00 H new ATOM 289 N GLY A 23 -11.151 -2.427 2.625 1.00 0.00 N ATOM 290 CA GLY A 23 -11.390 -1.593 3.782 1.00 0.00 C ATOM 291 C GLY A 23 -12.817 -1.095 3.840 1.00 0.00 C ATOM 292 O GLY A 23 -13.294 -0.463 2.902 1.00 0.00 O ATOM 0 H GLY A 23 -11.133 -1.931 1.734 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -11.166 -2.157 4.687 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -10.710 -0.741 3.761 1.00 0.00 H new ATOM 296 N ALA A 24 -13.504 -1.392 4.931 1.00 0.00 N ATOM 297 CA ALA A 24 -14.883 -0.962 5.101 1.00 0.00 C ATOM 298 C ALA A 24 -15.015 -0.036 6.303 1.00 0.00 C ATOM 299 O ALA A 24 -14.252 -0.140 7.266 1.00 0.00 O ATOM 300 CB ALA A 24 -15.802 -2.163 5.247 1.00 0.00 C ATOM 0 H ALA A 24 -13.129 -1.929 5.713 1.00 0.00 H new ATOM 0 HA ALA A 24 -15.180 -0.408 4.211 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -16.829 -1.822 5.373 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -15.733 -2.784 4.354 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -15.504 -2.746 6.119 1.00 0.00 H new ATOM 306 N GLY A 25 -15.982 0.867 6.243 1.00 0.00 N ATOM 307 CA GLY A 25 -16.191 1.807 7.325 1.00 0.00 C ATOM 308 C GLY A 25 -15.274 3.001 7.200 1.00 0.00 C ATOM 309 O GLY A 25 -14.806 3.554 8.194 1.00 0.00 O ATOM 0 H GLY A 25 -16.629 0.966 5.460 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -17.229 2.141 7.324 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -16.017 1.310 8.280 1.00 0.00 H new ATOM 313 N LEU A 26 -15.009 3.381 5.962 1.00 0.00 N ATOM 314 CA LEU A 26 -14.137 4.502 5.671 1.00 0.00 C ATOM 315 C LEU A 26 -14.956 5.723 5.264 1.00 0.00 C ATOM 316 O LEU A 26 -16.180 5.739 5.406 1.00 0.00 O ATOM 317 CB LEU A 26 -13.154 4.119 4.559 1.00 0.00 C ATOM 318 CG LEU A 26 -12.173 2.997 4.909 1.00 0.00 C ATOM 319 CD1 LEU A 26 -11.457 2.506 3.661 1.00 0.00 C ATOM 320 CD2 LEU A 26 -11.167 3.469 5.948 1.00 0.00 C ATOM 0 H LEU A 26 -15.391 2.923 5.135 1.00 0.00 H new ATOM 0 HA LEU A 26 -13.573 4.755 6.569 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -13.725 3.819 3.680 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -12.583 5.005 4.281 1.00 0.00 H new ATOM 0 HG LEU A 26 -12.739 2.167 5.331 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -10.764 1.709 3.929 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -12.188 2.126 2.948 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -10.905 3.331 3.210 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -10.479 2.657 6.183 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -10.607 4.317 5.553 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -11.694 3.772 6.853 1.00 0.00 H new ATOM 332 N GLN A 27 -14.281 6.744 4.762 1.00 0.00 N ATOM 333 CA GLN A 27 -14.945 7.968 4.340 1.00 0.00 C ATOM 334 C GLN A 27 -15.369 7.862 2.880 1.00 0.00 C ATOM 335 O GLN A 27 -14.529 7.891 1.976 1.00 0.00 O ATOM 336 CB GLN A 27 -14.017 9.167 4.533 1.00 0.00 C ATOM 337 CG GLN A 27 -14.671 10.502 4.215 1.00 0.00 C ATOM 338 CD GLN A 27 -15.425 11.081 5.396 1.00 0.00 C ATOM 339 OE1 GLN A 27 -15.040 10.897 6.551 1.00 0.00 O ATOM 340 NE2 GLN A 27 -16.501 11.792 5.113 1.00 0.00 N ATOM 0 H GLN A 27 -13.269 6.750 4.636 1.00 0.00 H new ATOM 0 HA GLN A 27 -15.834 8.111 4.954 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -13.665 9.181 5.565 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -13.139 9.042 3.899 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -13.906 11.210 3.896 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -15.357 10.375 3.378 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -16.786 11.921 4.142 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -17.047 12.213 5.865 1.00 0.00 H new ATOM 349 N ALA A 28 -16.669 7.719 2.659 1.00 0.00 N ATOM 350 CA ALA A 28 -17.211 7.609 1.312 1.00 0.00 C ATOM 351 C ALA A 28 -16.876 8.844 0.479 1.00 0.00 C ATOM 352 O ALA A 28 -17.255 9.966 0.824 1.00 0.00 O ATOM 353 CB ALA A 28 -18.714 7.391 1.364 1.00 0.00 C ATOM 0 H ALA A 28 -17.370 7.676 3.399 1.00 0.00 H new ATOM 0 HA ALA A 28 -16.749 6.747 0.831 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -19.105 7.311 0.350 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -18.930 6.473 1.910 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -19.187 8.233 1.870 1.00 0.00 H new ATOM 359 N GLY A 29 -16.145 8.632 -0.608 1.00 0.00 N ATOM 360 CA GLY A 29 -15.760 9.730 -1.472 1.00 0.00 C ATOM 361 C GLY A 29 -14.265 9.976 -1.454 1.00 0.00 C ATOM 362 O GLY A 29 -13.716 10.598 -2.366 1.00 0.00 O ATOM 0 H GLY A 29 -15.811 7.716 -0.907 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -16.079 9.516 -2.492 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -16.279 10.636 -1.159 1.00 0.00 H new ATOM 366 N THR A 30 -13.602 9.491 -0.415 1.00 0.00 N ATOM 367 CA THR A 30 -12.166 9.660 -0.285 1.00 0.00 C ATOM 368 C THR A 30 -11.419 8.615 -1.112 1.00 0.00 C ATOM 369 O THR A 30 -11.839 7.458 -1.196 1.00 0.00 O ATOM 370 CB THR A 30 -11.733 9.555 1.194 1.00 0.00 C ATOM 371 OG1 THR A 30 -12.436 10.528 1.978 1.00 0.00 O ATOM 372 CG2 THR A 30 -10.234 9.765 1.348 1.00 0.00 C ATOM 0 H THR A 30 -14.038 8.977 0.350 1.00 0.00 H new ATOM 0 HA THR A 30 -11.915 10.653 -0.658 1.00 0.00 H new ATOM 0 HB THR A 30 -11.976 8.552 1.545 1.00 0.00 H new ATOM 0 HG1 THR A 30 -11.954 10.682 2.817 1.00 0.00 H new ATOM 0 HG21 THR A 30 -9.962 9.685 2.400 1.00 0.00 H new ATOM 0 HG22 THR A 30 -9.700 9.006 0.776 1.00 0.00 H new ATOM 0 HG23 THR A 30 -9.965 10.754 0.978 1.00 0.00 H new ATOM 380 N ALA A 31 -10.332 9.039 -1.744 1.00 0.00 N ATOM 381 CA ALA A 31 -9.511 8.148 -2.543 1.00 0.00 C ATOM 382 C ALA A 31 -8.388 7.582 -1.686 1.00 0.00 C ATOM 383 O ALA A 31 -7.603 8.333 -1.104 1.00 0.00 O ATOM 384 CB ALA A 31 -8.948 8.886 -3.746 1.00 0.00 C ATOM 0 H ALA A 31 -9.999 10.003 -1.716 1.00 0.00 H new ATOM 0 HA ALA A 31 -10.125 7.325 -2.907 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -8.334 8.205 -4.336 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -9.768 9.260 -4.360 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -8.338 9.723 -3.407 1.00 0.00 H new ATOM 390 N TYR A 32 -8.319 6.265 -1.596 1.00 0.00 N ATOM 391 CA TYR A 32 -7.298 5.614 -0.794 1.00 0.00 C ATOM 392 C TYR A 32 -6.252 4.964 -1.681 1.00 0.00 C ATOM 393 O TYR A 32 -6.570 4.116 -2.518 1.00 0.00 O ATOM 394 CB TYR A 32 -7.934 4.574 0.130 1.00 0.00 C ATOM 395 CG TYR A 32 -8.893 5.177 1.131 1.00 0.00 C ATOM 396 CD1 TYR A 32 -8.441 5.654 2.354 1.00 0.00 C ATOM 397 CD2 TYR A 32 -10.251 5.270 0.852 1.00 0.00 C ATOM 398 CE1 TYR A 32 -9.315 6.208 3.272 1.00 0.00 C ATOM 399 CE2 TYR A 32 -11.130 5.822 1.764 1.00 0.00 C ATOM 400 CZ TYR A 32 -10.657 6.290 2.971 1.00 0.00 C ATOM 401 OH TYR A 32 -11.533 6.840 3.881 1.00 0.00 O ATOM 0 H TYR A 32 -8.958 5.626 -2.068 1.00 0.00 H new ATOM 0 HA TYR A 32 -6.805 6.371 -0.183 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -8.464 3.837 -0.473 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -7.147 4.042 0.665 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -7.390 5.591 2.593 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -10.625 4.905 -0.093 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -8.948 6.574 4.219 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -12.183 5.886 1.532 1.00 0.00 H new ATOM 0 HH TYR A 32 -11.292 6.548 4.785 1.00 0.00 H new ATOM 411 N ASP A 33 -5.005 5.370 -1.497 1.00 0.00 N ATOM 412 CA ASP A 33 -3.902 4.831 -2.274 1.00 0.00 C ATOM 413 C ASP A 33 -3.341 3.611 -1.566 1.00 0.00 C ATOM 414 O ASP A 33 -3.068 3.649 -0.363 1.00 0.00 O ATOM 415 CB ASP A 33 -2.807 5.881 -2.464 1.00 0.00 C ATOM 416 CG ASP A 33 -1.990 5.644 -3.721 1.00 0.00 C ATOM 417 OD1 ASP A 33 -1.784 4.472 -4.094 1.00 0.00 O ATOM 418 OD2 ASP A 33 -1.561 6.637 -4.346 1.00 0.00 O ATOM 0 H ASP A 33 -4.732 6.075 -0.812 1.00 0.00 H new ATOM 0 HA ASP A 33 -4.269 4.545 -3.260 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -3.261 6.871 -2.510 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -2.146 5.873 -1.597 1.00 0.00 H new ATOM 423 N VAL A 34 -3.195 2.524 -2.302 1.00 0.00 N ATOM 424 CA VAL A 34 -2.684 1.291 -1.734 1.00 0.00 C ATOM 425 C VAL A 34 -1.603 0.698 -2.625 1.00 0.00 C ATOM 426 O VAL A 34 -1.784 0.566 -3.836 1.00 0.00 O ATOM 427 CB VAL A 34 -3.805 0.246 -1.532 1.00 0.00 C ATOM 428 CG1 VAL A 34 -3.336 -0.874 -0.617 1.00 0.00 C ATOM 429 CG2 VAL A 34 -5.065 0.891 -0.972 1.00 0.00 C ATOM 0 H VAL A 34 -3.423 2.471 -3.295 1.00 0.00 H new ATOM 0 HA VAL A 34 -2.262 1.539 -0.760 1.00 0.00 H new ATOM 0 HB VAL A 34 -4.045 -0.176 -2.508 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -4.140 -1.599 -0.488 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -2.470 -1.367 -1.060 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -3.061 -0.460 0.353 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -5.835 0.131 -0.841 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -4.841 1.351 -0.009 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -5.422 1.654 -1.664 1.00 0.00 H new ATOM 439 N GLY A 35 -0.478 0.359 -2.018 1.00 0.00 N ATOM 440 CA GLY A 35 0.623 -0.229 -2.743 1.00 0.00 C ATOM 441 C GLY A 35 1.502 -1.033 -1.814 1.00 0.00 C ATOM 442 O GLY A 35 1.185 -1.171 -0.630 1.00 0.00 O ATOM 0 H GLY A 35 -0.308 0.484 -1.020 1.00 0.00 H new ATOM 0 HA2 GLY A 35 0.241 -0.871 -3.537 1.00 0.00 H new ATOM 0 HA3 GLY A 35 1.211 0.555 -3.221 1.00 0.00 H new ATOM 446 N GLN A 36 2.605 -1.558 -2.326 1.00 0.00 N ATOM 447 CA GLN A 36 3.524 -2.335 -1.501 1.00 0.00 C ATOM 448 C GLN A 36 4.481 -1.390 -0.781 1.00 0.00 C ATOM 449 O GLN A 36 5.699 -1.540 -0.849 1.00 0.00 O ATOM 450 CB GLN A 36 4.297 -3.359 -2.345 1.00 0.00 C ATOM 451 CG GLN A 36 4.937 -2.777 -3.593 1.00 0.00 C ATOM 452 CD GLN A 36 5.787 -3.784 -4.345 1.00 0.00 C ATOM 453 OE1 GLN A 36 5.795 -3.803 -5.575 1.00 0.00 O ATOM 454 NE2 GLN A 36 6.519 -4.616 -3.619 1.00 0.00 N ATOM 0 H GLN A 36 2.886 -1.463 -3.302 1.00 0.00 H new ATOM 0 HA GLN A 36 2.948 -2.893 -0.762 1.00 0.00 H new ATOM 0 HB2 GLN A 36 5.074 -3.810 -1.728 1.00 0.00 H new ATOM 0 HB3 GLN A 36 3.618 -4.160 -2.638 1.00 0.00 H new ATOM 0 HG2 GLN A 36 4.156 -2.402 -4.255 1.00 0.00 H new ATOM 0 HG3 GLN A 36 5.555 -1.924 -3.314 1.00 0.00 H new ATOM 0 HE21 GLN A 36 6.485 -4.569 -2.601 1.00 0.00 H new ATOM 0 HE22 GLN A 36 7.116 -5.303 -4.078 1.00 0.00 H new ATOM 463 N CYS A 37 3.905 -0.409 -0.102 1.00 0.00 N ATOM 464 CA CYS A 37 4.674 0.586 0.630 1.00 0.00 C ATOM 465 C CYS A 37 5.479 -0.048 1.754 1.00 0.00 C ATOM 466 O CYS A 37 4.931 -0.416 2.793 1.00 0.00 O ATOM 467 CB CYS A 37 3.742 1.652 1.198 1.00 0.00 C ATOM 468 SG CYS A 37 2.279 1.984 0.160 1.00 0.00 S ATOM 0 H CYS A 37 2.895 -0.281 -0.043 1.00 0.00 H new ATOM 0 HA CYS A 37 5.374 1.047 -0.067 1.00 0.00 H new ATOM 0 HB2 CYS A 37 3.410 1.340 2.188 1.00 0.00 H new ATOM 0 HB3 CYS A 37 4.302 2.578 1.327 1.00 0.00 H new ATOM 473 N ALA A 38 6.780 -0.167 1.536 1.00 0.00 N ATOM 474 CA ALA A 38 7.672 -0.750 2.520 1.00 0.00 C ATOM 475 C ALA A 38 8.625 0.299 3.067 1.00 0.00 C ATOM 476 O ALA A 38 8.589 1.461 2.650 1.00 0.00 O ATOM 477 CB ALA A 38 8.443 -1.910 1.907 1.00 0.00 C ATOM 0 H ALA A 38 7.242 0.136 0.678 1.00 0.00 H new ATOM 0 HA ALA A 38 7.075 -1.130 3.349 1.00 0.00 H new ATOM 0 HB1 ALA A 38 9.109 -2.340 2.655 1.00 0.00 H new ATOM 0 HB2 ALA A 38 7.743 -2.672 1.564 1.00 0.00 H new ATOM 0 HB3 ALA A 38 9.030 -1.551 1.062 1.00 0.00 H new ATOM 483 N TRP A 39 9.468 -0.111 4.000 1.00 0.00 N ATOM 484 CA TRP A 39 10.437 0.781 4.612 1.00 0.00 C ATOM 485 C TRP A 39 11.480 1.208 3.585 1.00 0.00 C ATOM 486 O TRP A 39 12.093 0.363 2.935 1.00 0.00 O ATOM 487 CB TRP A 39 11.113 0.058 5.773 1.00 0.00 C ATOM 488 CG TRP A 39 11.352 0.914 6.972 1.00 0.00 C ATOM 489 CD1 TRP A 39 10.410 1.561 7.717 1.00 0.00 C ATOM 490 CD2 TRP A 39 12.615 1.204 7.575 1.00 0.00 C ATOM 491 NE1 TRP A 39 11.010 2.233 8.753 1.00 0.00 N ATOM 492 CE2 TRP A 39 12.366 2.029 8.686 1.00 0.00 C ATOM 493 CE3 TRP A 39 13.933 0.845 7.283 1.00 0.00 C ATOM 494 CZ2 TRP A 39 13.387 2.498 9.507 1.00 0.00 C ATOM 495 CZ3 TRP A 39 14.946 1.312 8.097 1.00 0.00 C ATOM 496 CH2 TRP A 39 14.668 2.131 9.197 1.00 0.00 C ATOM 0 H TRP A 39 9.500 -1.067 4.353 1.00 0.00 H new ATOM 0 HA TRP A 39 9.930 1.673 4.980 1.00 0.00 H new ATOM 0 HB2 TRP A 39 10.497 -0.792 6.065 1.00 0.00 H new ATOM 0 HB3 TRP A 39 12.067 -0.342 5.431 1.00 0.00 H new ATOM 0 HD1 TRP A 39 9.348 1.547 7.521 1.00 0.00 H new ATOM 0 HE1 TRP A 39 10.528 2.792 9.457 1.00 0.00 H new ATOM 0 HE3 TRP A 39 14.156 0.213 6.436 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 13.176 3.129 10.358 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 15.969 1.041 7.881 1.00 0.00 H new ATOM 0 HH2 TRP A 39 15.482 2.481 9.814 1.00 0.00 H new ATOM 507 N VAL A 40 11.677 2.508 3.435 1.00 0.00 N ATOM 508 CA VAL A 40 12.651 3.012 2.475 1.00 0.00 C ATOM 509 C VAL A 40 13.786 3.755 3.184 1.00 0.00 C ATOM 510 O VAL A 40 14.921 3.770 2.709 1.00 0.00 O ATOM 511 CB VAL A 40 11.980 3.918 1.410 1.00 0.00 C ATOM 512 CG1 VAL A 40 11.557 5.258 1.999 1.00 0.00 C ATOM 513 CG2 VAL A 40 12.900 4.111 0.210 1.00 0.00 C ATOM 0 H VAL A 40 11.182 3.229 3.959 1.00 0.00 H new ATOM 0 HA VAL A 40 13.078 2.152 1.958 1.00 0.00 H new ATOM 0 HB VAL A 40 11.075 3.415 1.069 1.00 0.00 H new ATOM 0 HG11 VAL A 40 11.091 5.866 1.223 1.00 0.00 H new ATOM 0 HG12 VAL A 40 10.844 5.092 2.807 1.00 0.00 H new ATOM 0 HG13 VAL A 40 12.433 5.777 2.389 1.00 0.00 H new ATOM 0 HG21 VAL A 40 12.410 4.750 -0.525 1.00 0.00 H new ATOM 0 HG22 VAL A 40 13.829 4.579 0.535 1.00 0.00 H new ATOM 0 HG23 VAL A 40 13.120 3.143 -0.240 1.00 0.00 H new ATOM 523 N ASP A 41 13.479 4.334 4.342 1.00 0.00 N ATOM 524 CA ASP A 41 14.465 5.067 5.131 1.00 0.00 C ATOM 525 C ASP A 41 14.071 5.011 6.598 1.00 0.00 C ATOM 526 O ASP A 41 13.017 4.476 6.932 1.00 0.00 O ATOM 527 CB ASP A 41 14.558 6.525 4.668 1.00 0.00 C ATOM 528 CG ASP A 41 15.947 7.108 4.837 1.00 0.00 C ATOM 529 OD1 ASP A 41 16.343 7.401 5.983 1.00 0.00 O ATOM 530 OD2 ASP A 41 16.650 7.284 3.822 1.00 0.00 O ATOM 0 H ASP A 41 12.548 4.309 4.757 1.00 0.00 H new ATOM 0 HA ASP A 41 15.443 4.605 4.994 1.00 0.00 H new ATOM 0 HB2 ASP A 41 14.268 6.587 3.619 1.00 0.00 H new ATOM 0 HB3 ASP A 41 13.845 7.127 5.232 1.00 0.00 H new ATOM 535 N THR A 42 14.894 5.580 7.466 1.00 0.00 N ATOM 536 CA THR A 42 14.629 5.574 8.897 1.00 0.00 C ATOM 537 C THR A 42 13.346 6.336 9.231 1.00 0.00 C ATOM 538 O THR A 42 13.343 7.562 9.337 1.00 0.00 O ATOM 539 CB THR A 42 15.810 6.178 9.673 1.00 0.00 C ATOM 540 OG1 THR A 42 17.043 5.793 9.047 1.00 0.00 O ATOM 541 CG2 THR A 42 15.807 5.707 11.119 1.00 0.00 C ATOM 0 H THR A 42 15.757 6.055 7.202 1.00 0.00 H new ATOM 0 HA THR A 42 14.500 4.535 9.199 1.00 0.00 H new ATOM 0 HB THR A 42 15.711 7.263 9.662 1.00 0.00 H new ATOM 0 HG1 THR A 42 17.796 6.180 9.541 1.00 0.00 H new ATOM 0 HG21 THR A 42 16.652 6.148 11.647 1.00 0.00 H new ATOM 0 HG22 THR A 42 14.878 6.014 11.600 1.00 0.00 H new ATOM 0 HG23 THR A 42 15.888 4.620 11.148 1.00 0.00 H new ATOM 549 N GLY A 43 12.251 5.598 9.369 1.00 0.00 N ATOM 550 CA GLY A 43 10.976 6.209 9.687 1.00 0.00 C ATOM 551 C GLY A 43 10.226 6.642 8.445 1.00 0.00 C ATOM 552 O GLY A 43 9.139 7.214 8.530 1.00 0.00 O ATOM 0 H GLY A 43 12.224 4.584 9.266 1.00 0.00 H new ATOM 0 HA2 GLY A 43 10.366 5.502 10.250 1.00 0.00 H new ATOM 0 HA3 GLY A 43 11.139 7.073 10.331 1.00 0.00 H new ATOM 556 N VAL A 44 10.808 6.368 7.287 1.00 0.00 N ATOM 557 CA VAL A 44 10.199 6.739 6.022 1.00 0.00 C ATOM 558 C VAL A 44 9.845 5.498 5.217 1.00 0.00 C ATOM 559 O VAL A 44 10.645 4.566 5.101 1.00 0.00 O ATOM 560 CB VAL A 44 11.132 7.634 5.174 1.00 0.00 C ATOM 561 CG1 VAL A 44 10.361 8.288 4.040 1.00 0.00 C ATOM 562 CG2 VAL A 44 11.808 8.693 6.032 1.00 0.00 C ATOM 0 H VAL A 44 11.704 5.889 7.199 1.00 0.00 H new ATOM 0 HA VAL A 44 9.296 7.302 6.258 1.00 0.00 H new ATOM 0 HB VAL A 44 11.907 6.997 4.748 1.00 0.00 H new ATOM 0 HG11 VAL A 44 11.035 8.914 3.455 1.00 0.00 H new ATOM 0 HG12 VAL A 44 9.933 7.517 3.399 1.00 0.00 H new ATOM 0 HG13 VAL A 44 9.561 8.903 4.451 1.00 0.00 H new ATOM 0 HG21 VAL A 44 12.458 9.307 5.408 1.00 0.00 H new ATOM 0 HG22 VAL A 44 11.050 9.323 6.496 1.00 0.00 H new ATOM 0 HG23 VAL A 44 12.402 8.209 6.807 1.00 0.00 H new ATOM 572 N LEU A 45 8.645 5.489 4.669 1.00 0.00 N ATOM 573 CA LEU A 45 8.176 4.378 3.863 1.00 0.00 C ATOM 574 C LEU A 45 7.877 4.887 2.463 1.00 0.00 C ATOM 575 O LEU A 45 7.827 6.098 2.251 1.00 0.00 O ATOM 576 CB LEU A 45 6.936 3.740 4.500 1.00 0.00 C ATOM 577 CG LEU A 45 7.115 3.309 5.956 1.00 0.00 C ATOM 578 CD1 LEU A 45 6.200 4.114 6.867 1.00 0.00 C ATOM 579 CD2 LEU A 45 6.859 1.815 6.101 1.00 0.00 C ATOM 0 H LEU A 45 7.971 6.248 4.769 1.00 0.00 H new ATOM 0 HA LEU A 45 8.944 3.607 3.807 1.00 0.00 H new ATOM 0 HB2 LEU A 45 6.110 4.449 4.444 1.00 0.00 H new ATOM 0 HB3 LEU A 45 6.649 2.869 3.910 1.00 0.00 H new ATOM 0 HG LEU A 45 8.144 3.507 6.256 1.00 0.00 H new ATOM 0 HD11 LEU A 45 6.341 3.794 7.899 1.00 0.00 H new ATOM 0 HD12 LEU A 45 6.440 5.174 6.780 1.00 0.00 H new ATOM 0 HD13 LEU A 45 5.162 3.952 6.575 1.00 0.00 H new ATOM 0 HD21 LEU A 45 6.990 1.523 7.143 1.00 0.00 H new ATOM 0 HD22 LEU A 45 5.840 1.588 5.786 1.00 0.00 H new ATOM 0 HD23 LEU A 45 7.563 1.263 5.478 1.00 0.00 H new ATOM 591 N ALA A 46 7.686 3.987 1.511 1.00 0.00 N ATOM 592 CA ALA A 46 7.414 4.400 0.142 1.00 0.00 C ATOM 593 C ALA A 46 6.587 3.366 -0.611 1.00 0.00 C ATOM 594 O ALA A 46 6.823 2.166 -0.495 1.00 0.00 O ATOM 595 CB ALA A 46 8.724 4.661 -0.578 1.00 0.00 C ATOM 0 H ALA A 46 7.714 2.978 1.657 1.00 0.00 H new ATOM 0 HA ALA A 46 6.826 5.317 0.175 1.00 0.00 H new ATOM 0 HB1 ALA A 46 8.520 4.970 -1.603 1.00 0.00 H new ATOM 0 HB2 ALA A 46 9.271 5.450 -0.063 1.00 0.00 H new ATOM 0 HB3 ALA A 46 9.323 3.750 -0.586 1.00 0.00 H new ATOM 601 N CYS A 47 5.620 3.851 -1.385 1.00 0.00 N ATOM 602 CA CYS A 47 4.738 2.992 -2.172 1.00 0.00 C ATOM 603 C CYS A 47 5.253 2.852 -3.602 1.00 0.00 C ATOM 604 O CYS A 47 6.173 3.563 -4.003 1.00 0.00 O ATOM 605 CB CYS A 47 3.322 3.570 -2.197 1.00 0.00 C ATOM 606 SG CYS A 47 2.602 3.856 -0.553 1.00 0.00 S ATOM 0 H CYS A 47 5.425 4.847 -1.485 1.00 0.00 H new ATOM 0 HA CYS A 47 4.721 2.007 -1.705 1.00 0.00 H new ATOM 0 HB2 CYS A 47 3.337 4.513 -2.743 1.00 0.00 H new ATOM 0 HB3 CYS A 47 2.674 2.891 -2.751 1.00 0.00 H new ATOM 611 N ASN A 48 4.651 1.948 -4.369 1.00 0.00 N ATOM 612 CA ASN A 48 5.055 1.725 -5.754 1.00 0.00 C ATOM 613 C ASN A 48 4.037 2.336 -6.716 1.00 0.00 C ATOM 614 O ASN A 48 2.860 1.992 -6.687 1.00 0.00 O ATOM 615 CB ASN A 48 5.226 0.225 -6.046 1.00 0.00 C ATOM 616 CG ASN A 48 3.939 -0.579 -5.904 1.00 0.00 C ATOM 617 OD1 ASN A 48 3.138 -0.350 -4.994 1.00 0.00 O ATOM 618 ND2 ASN A 48 3.742 -1.542 -6.792 1.00 0.00 N ATOM 0 H ASN A 48 3.881 1.357 -4.055 1.00 0.00 H new ATOM 0 HA ASN A 48 6.017 2.214 -5.904 1.00 0.00 H new ATOM 0 HB2 ASN A 48 5.610 0.103 -7.059 1.00 0.00 H new ATOM 0 HB3 ASN A 48 5.976 -0.184 -5.369 1.00 0.00 H new ATOM 0 HD21 ASN A 48 2.906 -2.123 -6.737 1.00 0.00 H new ATOM 0 HD22 ASN A 48 4.427 -1.702 -7.531 1.00 0.00 H new ATOM 625 N PRO A 49 4.479 3.260 -7.580 1.00 0.00 N ATOM 626 CA PRO A 49 3.600 3.915 -8.548 1.00 0.00 C ATOM 627 C PRO A 49 3.399 3.081 -9.810 1.00 0.00 C ATOM 628 O PRO A 49 2.596 3.428 -10.678 1.00 0.00 O ATOM 629 CB PRO A 49 4.363 5.194 -8.876 1.00 0.00 C ATOM 630 CG PRO A 49 5.796 4.806 -8.757 1.00 0.00 C ATOM 631 CD PRO A 49 5.864 3.764 -7.668 1.00 0.00 C ATOM 0 HA PRO A 49 2.596 4.076 -8.155 1.00 0.00 H new ATOM 0 HB2 PRO A 49 4.129 5.551 -9.879 1.00 0.00 H new ATOM 0 HB3 PRO A 49 4.109 5.997 -8.184 1.00 0.00 H new ATOM 0 HG2 PRO A 49 6.170 4.408 -9.700 1.00 0.00 H new ATOM 0 HG3 PRO A 49 6.413 5.669 -8.508 1.00 0.00 H new ATOM 0 HD2 PRO A 49 6.565 2.968 -7.919 1.00 0.00 H new ATOM 0 HD3 PRO A 49 6.195 4.194 -6.722 1.00 0.00 H new ATOM 639 N ALA A 50 4.142 1.989 -9.912 1.00 0.00 N ATOM 640 CA ALA A 50 4.052 1.108 -11.069 1.00 0.00 C ATOM 641 C ALA A 50 2.796 0.248 -11.000 1.00 0.00 C ATOM 642 O ALA A 50 1.849 0.450 -11.760 1.00 0.00 O ATOM 643 CB ALA A 50 5.288 0.231 -11.169 1.00 0.00 C ATOM 0 H ALA A 50 4.816 1.691 -9.207 1.00 0.00 H new ATOM 0 HA ALA A 50 3.993 1.729 -11.963 1.00 0.00 H new ATOM 0 HB1 ALA A 50 5.203 -0.420 -12.039 1.00 0.00 H new ATOM 0 HB2 ALA A 50 6.173 0.859 -11.271 1.00 0.00 H new ATOM 0 HB3 ALA A 50 5.377 -0.377 -10.268 1.00 0.00 H new ATOM 649 N ASP A 51 2.788 -0.704 -10.079 1.00 0.00 N ATOM 650 CA ASP A 51 1.646 -1.598 -9.916 1.00 0.00 C ATOM 651 C ASP A 51 0.766 -1.136 -8.761 1.00 0.00 C ATOM 652 O ASP A 51 0.565 -1.862 -7.789 1.00 0.00 O ATOM 653 CB ASP A 51 2.122 -3.035 -9.676 1.00 0.00 C ATOM 654 CG ASP A 51 1.377 -4.049 -10.523 1.00 0.00 C ATOM 655 OD1 ASP A 51 0.218 -4.378 -10.193 1.00 0.00 O ATOM 656 OD2 ASP A 51 1.954 -4.528 -11.525 1.00 0.00 O ATOM 0 H ASP A 51 3.557 -0.879 -9.433 1.00 0.00 H new ATOM 0 HA ASP A 51 1.057 -1.573 -10.833 1.00 0.00 H new ATOM 0 HB2 ASP A 51 3.188 -3.101 -9.892 1.00 0.00 H new ATOM 0 HB3 ASP A 51 1.994 -3.284 -8.623 1.00 0.00 H new ATOM 661 N PHE A 52 0.258 0.084 -8.865 1.00 0.00 N ATOM 662 CA PHE A 52 -0.600 0.636 -7.829 1.00 0.00 C ATOM 663 C PHE A 52 -2.025 0.776 -8.346 1.00 0.00 C ATOM 664 O PHE A 52 -2.253 0.934 -9.550 1.00 0.00 O ATOM 665 CB PHE A 52 -0.073 1.992 -7.331 1.00 0.00 C ATOM 666 CG PHE A 52 -0.645 3.194 -8.040 1.00 0.00 C ATOM 667 CD1 PHE A 52 -0.166 3.579 -9.281 1.00 0.00 C ATOM 668 CD2 PHE A 52 -1.665 3.938 -7.462 1.00 0.00 C ATOM 669 CE1 PHE A 52 -0.690 4.680 -9.932 1.00 0.00 C ATOM 670 CE2 PHE A 52 -2.192 5.039 -8.109 1.00 0.00 C ATOM 671 CZ PHE A 52 -1.704 5.410 -9.346 1.00 0.00 C ATOM 0 H PHE A 52 0.425 0.708 -9.654 1.00 0.00 H new ATOM 0 HA PHE A 52 -0.596 -0.053 -6.984 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -0.288 2.080 -6.266 1.00 0.00 H new ATOM 0 HB3 PHE A 52 1.011 2.006 -7.440 1.00 0.00 H new ATOM 0 HD1 PHE A 52 0.627 3.012 -9.746 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -2.051 3.652 -6.495 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -0.306 4.969 -10.899 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -2.985 5.609 -7.648 1.00 0.00 H new ATOM 0 HZ PHE A 52 -2.115 6.270 -9.854 1.00 0.00 H new ATOM 681 N SER A 53 -2.982 0.701 -7.437 1.00 0.00 N ATOM 682 CA SER A 53 -4.382 0.819 -7.792 1.00 0.00 C ATOM 683 C SER A 53 -5.159 1.484 -6.667 1.00 0.00 C ATOM 684 O SER A 53 -5.748 0.807 -5.820 1.00 0.00 O ATOM 685 CB SER A 53 -4.965 -0.561 -8.097 1.00 0.00 C ATOM 686 OG SER A 53 -4.146 -1.258 -9.020 1.00 0.00 O ATOM 0 H SER A 53 -2.811 0.558 -6.442 1.00 0.00 H new ATOM 0 HA SER A 53 -4.466 1.440 -8.684 1.00 0.00 H new ATOM 0 HB2 SER A 53 -5.053 -1.136 -7.175 1.00 0.00 H new ATOM 0 HB3 SER A 53 -5.971 -0.455 -8.504 1.00 0.00 H new ATOM 0 HG SER A 53 -4.534 -2.139 -9.202 1.00 0.00 H new ATOM 692 N SER A 54 -5.124 2.809 -6.638 1.00 0.00 N ATOM 693 CA SER A 54 -5.844 3.563 -5.628 1.00 0.00 C ATOM 694 C SER A 54 -7.340 3.352 -5.813 1.00 0.00 C ATOM 695 O SER A 54 -7.848 3.421 -6.933 1.00 0.00 O ATOM 696 CB SER A 54 -5.493 5.048 -5.723 1.00 0.00 C ATOM 697 OG SER A 54 -5.374 5.460 -7.075 1.00 0.00 O ATOM 0 H SER A 54 -4.604 3.381 -7.303 1.00 0.00 H new ATOM 0 HA SER A 54 -5.554 3.210 -4.638 1.00 0.00 H new ATOM 0 HB2 SER A 54 -6.262 5.639 -5.226 1.00 0.00 H new ATOM 0 HB3 SER A 54 -4.557 5.238 -5.198 1.00 0.00 H new ATOM 0 HG SER A 54 -5.151 6.414 -7.108 1.00 0.00 H new ATOM 703 N VAL A 55 -8.039 3.085 -4.727 1.00 0.00 N ATOM 704 CA VAL A 55 -9.468 2.839 -4.794 1.00 0.00 C ATOM 705 C VAL A 55 -10.245 3.873 -3.987 1.00 0.00 C ATOM 706 O VAL A 55 -9.844 4.253 -2.885 1.00 0.00 O ATOM 707 CB VAL A 55 -9.809 1.410 -4.309 1.00 0.00 C ATOM 708 CG1 VAL A 55 -9.299 1.166 -2.897 1.00 0.00 C ATOM 709 CG2 VAL A 55 -11.303 1.146 -4.397 1.00 0.00 C ATOM 0 H VAL A 55 -7.642 3.033 -3.789 1.00 0.00 H new ATOM 0 HA VAL A 55 -9.767 2.928 -5.838 1.00 0.00 H new ATOM 0 HB VAL A 55 -9.301 0.709 -4.971 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -9.556 0.153 -2.588 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -8.216 1.289 -2.875 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -9.759 1.881 -2.215 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -11.515 0.135 -4.050 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -11.837 1.863 -3.773 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -11.631 1.251 -5.431 1.00 0.00 H new ATOM 719 N THR A 56 -11.338 4.351 -4.556 1.00 0.00 N ATOM 720 CA THR A 56 -12.177 5.325 -3.891 1.00 0.00 C ATOM 721 C THR A 56 -13.278 4.600 -3.117 1.00 0.00 C ATOM 722 O THR A 56 -13.708 3.512 -3.508 1.00 0.00 O ATOM 723 CB THR A 56 -12.781 6.327 -4.909 1.00 0.00 C ATOM 724 OG1 THR A 56 -13.222 7.515 -4.240 1.00 0.00 O ATOM 725 CG2 THR A 56 -13.944 5.716 -5.679 1.00 0.00 C ATOM 0 H THR A 56 -11.664 4.077 -5.483 1.00 0.00 H new ATOM 0 HA THR A 56 -11.569 5.900 -3.192 1.00 0.00 H new ATOM 0 HB THR A 56 -11.995 6.579 -5.621 1.00 0.00 H new ATOM 0 HG1 THR A 56 -13.599 8.139 -4.895 1.00 0.00 H new ATOM 0 HG21 THR A 56 -14.340 6.449 -6.382 1.00 0.00 H new ATOM 0 HG22 THR A 56 -13.598 4.839 -6.226 1.00 0.00 H new ATOM 0 HG23 THR A 56 -14.728 5.422 -4.981 1.00 0.00 H new ATOM 733 N ALA A 57 -13.707 5.178 -2.004 1.00 0.00 N ATOM 734 CA ALA A 57 -14.751 4.566 -1.194 1.00 0.00 C ATOM 735 C ALA A 57 -16.104 4.677 -1.882 1.00 0.00 C ATOM 736 O ALA A 57 -16.443 5.728 -2.433 1.00 0.00 O ATOM 737 CB ALA A 57 -14.803 5.205 0.182 1.00 0.00 C ATOM 0 H ALA A 57 -13.352 6.063 -1.643 1.00 0.00 H new ATOM 0 HA ALA A 57 -14.512 3.509 -1.076 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -15.589 4.734 0.772 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -13.844 5.070 0.682 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -15.013 6.270 0.081 1.00 0.00 H new ATOM 743 N ASP A 58 -16.866 3.593 -1.848 1.00 0.00 N ATOM 744 CA ASP A 58 -18.190 3.549 -2.471 1.00 0.00 C ATOM 745 C ASP A 58 -19.257 4.152 -1.556 1.00 0.00 C ATOM 746 O ASP A 58 -18.947 4.692 -0.495 1.00 0.00 O ATOM 747 CB ASP A 58 -18.565 2.104 -2.848 1.00 0.00 C ATOM 748 CG ASP A 58 -18.429 1.120 -1.698 1.00 0.00 C ATOM 749 OD1 ASP A 58 -18.670 1.507 -0.539 1.00 0.00 O ATOM 750 OD2 ASP A 58 -18.078 -0.052 -1.947 1.00 0.00 O ATOM 0 H ASP A 58 -16.591 2.723 -1.392 1.00 0.00 H new ATOM 0 HA ASP A 58 -18.147 4.149 -3.380 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -19.593 2.087 -3.210 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -17.931 1.776 -3.672 1.00 0.00 H new ATOM 755 N ALA A 59 -20.518 4.044 -1.970 1.00 0.00 N ATOM 756 CA ALA A 59 -21.637 4.585 -1.200 1.00 0.00 C ATOM 757 C ALA A 59 -21.826 3.843 0.123 1.00 0.00 C ATOM 758 O ALA A 59 -22.549 4.304 1.009 1.00 0.00 O ATOM 759 CB ALA A 59 -22.912 4.529 -2.023 1.00 0.00 C ATOM 0 H ALA A 59 -20.791 3.585 -2.839 1.00 0.00 H new ATOM 0 HA ALA A 59 -21.407 5.624 -0.964 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -23.739 4.934 -1.440 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -22.785 5.118 -2.931 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -23.128 3.494 -2.289 1.00 0.00 H new ATOM 765 N ASN A 60 -21.176 2.699 0.256 1.00 0.00 N ATOM 766 CA ASN A 60 -21.267 1.910 1.474 1.00 0.00 C ATOM 767 C ASN A 60 -20.100 2.246 2.390 1.00 0.00 C ATOM 768 O ASN A 60 -20.017 1.764 3.520 1.00 0.00 O ATOM 769 CB ASN A 60 -21.252 0.413 1.150 1.00 0.00 C ATOM 770 CG ASN A 60 -22.566 -0.095 0.593 1.00 0.00 C ATOM 771 OD1 ASN A 60 -23.318 0.645 -0.046 1.00 0.00 O ATOM 772 ND2 ASN A 60 -22.846 -1.368 0.812 1.00 0.00 N ATOM 0 H ASN A 60 -20.579 2.295 -0.465 1.00 0.00 H new ATOM 0 HA ASN A 60 -22.206 2.149 1.974 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -20.459 0.213 0.430 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -21.009 -0.145 2.055 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -23.710 -1.770 0.448 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -22.198 -1.948 1.345 1.00 0.00 H new ATOM 779 N GLY A 61 -19.197 3.082 1.891 1.00 0.00 N ATOM 780 CA GLY A 61 -18.033 3.474 2.659 1.00 0.00 C ATOM 781 C GLY A 61 -16.981 2.387 2.671 1.00 0.00 C ATOM 782 O GLY A 61 -16.215 2.258 3.630 1.00 0.00 O ATOM 0 H GLY A 61 -19.252 3.497 0.961 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -17.610 4.386 2.239 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -18.332 3.703 3.682 1.00 0.00 H new ATOM 786 N SER A 62 -16.947 1.599 1.605 1.00 0.00 N ATOM 787 CA SER A 62 -15.991 0.508 1.486 1.00 0.00 C ATOM 788 C SER A 62 -15.090 0.695 0.266 1.00 0.00 C ATOM 789 O SER A 62 -15.467 1.350 -0.708 1.00 0.00 O ATOM 790 CB SER A 62 -16.734 -0.829 1.406 1.00 0.00 C ATOM 791 OG SER A 62 -18.112 -0.633 1.118 1.00 0.00 O ATOM 0 H SER A 62 -17.574 1.696 0.807 1.00 0.00 H new ATOM 0 HA SER A 62 -15.355 0.509 2.371 1.00 0.00 H new ATOM 0 HB2 SER A 62 -16.283 -1.453 0.634 1.00 0.00 H new ATOM 0 HB3 SER A 62 -16.629 -1.364 2.350 1.00 0.00 H new ATOM 0 HG SER A 62 -18.206 0.037 0.409 1.00 0.00 H new ATOM 797 N ALA A 63 -13.893 0.129 0.334 1.00 0.00 N ATOM 798 CA ALA A 63 -12.932 0.224 -0.754 1.00 0.00 C ATOM 799 C ALA A 63 -12.169 -1.089 -0.921 1.00 0.00 C ATOM 800 O ALA A 63 -11.407 -1.488 -0.039 1.00 0.00 O ATOM 801 CB ALA A 63 -11.970 1.378 -0.500 1.00 0.00 C ATOM 0 H ALA A 63 -13.563 -0.405 1.138 1.00 0.00 H new ATOM 0 HA ALA A 63 -13.473 0.417 -1.680 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -11.254 1.442 -1.319 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -12.530 2.311 -0.434 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -11.437 1.208 0.435 1.00 0.00 H new ATOM 807 N SER A 64 -12.404 -1.767 -2.035 1.00 0.00 N ATOM 808 CA SER A 64 -11.736 -3.029 -2.321 1.00 0.00 C ATOM 809 C SER A 64 -10.768 -2.870 -3.495 1.00 0.00 C ATOM 810 O SER A 64 -11.131 -2.325 -4.541 1.00 0.00 O ATOM 811 CB SER A 64 -12.776 -4.107 -2.632 1.00 0.00 C ATOM 812 OG SER A 64 -13.743 -4.195 -1.597 1.00 0.00 O ATOM 0 H SER A 64 -13.055 -1.463 -2.759 1.00 0.00 H new ATOM 0 HA SER A 64 -11.163 -3.330 -1.444 1.00 0.00 H new ATOM 0 HB2 SER A 64 -13.269 -3.879 -3.577 1.00 0.00 H new ATOM 0 HB3 SER A 64 -12.281 -5.070 -2.755 1.00 0.00 H new ATOM 0 HG SER A 64 -14.398 -4.889 -1.819 1.00 0.00 H new ATOM 818 N THR A 65 -9.543 -3.352 -3.322 1.00 0.00 N ATOM 819 CA THR A 65 -8.528 -3.254 -4.362 1.00 0.00 C ATOM 820 C THR A 65 -7.562 -4.444 -4.295 1.00 0.00 C ATOM 821 O THR A 65 -7.624 -5.261 -3.371 1.00 0.00 O ATOM 822 CB THR A 65 -7.745 -1.926 -4.241 1.00 0.00 C ATOM 823 OG1 THR A 65 -6.874 -1.751 -5.365 1.00 0.00 O ATOM 824 CG2 THR A 65 -6.930 -1.883 -2.957 1.00 0.00 C ATOM 0 H THR A 65 -9.229 -3.815 -2.469 1.00 0.00 H new ATOM 0 HA THR A 65 -9.035 -3.272 -5.327 1.00 0.00 H new ATOM 0 HB THR A 65 -8.474 -1.116 -4.219 1.00 0.00 H new ATOM 0 HG1 THR A 65 -6.564 -0.822 -5.397 1.00 0.00 H new ATOM 0 HG21 THR A 65 -6.391 -0.938 -2.900 1.00 0.00 H new ATOM 0 HG22 THR A 65 -7.597 -1.972 -2.100 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.218 -2.708 -2.950 1.00 0.00 H new ATOM 832 N SER A 66 -6.689 -4.549 -5.288 1.00 0.00 N ATOM 833 CA SER A 66 -5.711 -5.624 -5.355 1.00 0.00 C ATOM 834 C SER A 66 -4.403 -5.093 -5.931 1.00 0.00 C ATOM 835 O SER A 66 -4.401 -4.418 -6.962 1.00 0.00 O ATOM 836 CB SER A 66 -6.250 -6.765 -6.217 1.00 0.00 C ATOM 837 OG SER A 66 -7.521 -7.198 -5.749 1.00 0.00 O ATOM 0 H SER A 66 -6.640 -3.893 -6.067 1.00 0.00 H new ATOM 0 HA SER A 66 -5.524 -6.006 -4.351 1.00 0.00 H new ATOM 0 HB2 SER A 66 -6.332 -6.436 -7.253 1.00 0.00 H new ATOM 0 HB3 SER A 66 -5.549 -7.600 -6.202 1.00 0.00 H new ATOM 0 HG SER A 66 -7.847 -7.927 -6.316 1.00 0.00 H new ATOM 843 N LEU A 67 -3.294 -5.392 -5.264 1.00 0.00 N ATOM 844 CA LEU A 67 -1.982 -4.913 -5.710 1.00 0.00 C ATOM 845 C LEU A 67 -1.027 -6.073 -5.960 1.00 0.00 C ATOM 846 O LEU A 67 -1.125 -7.109 -5.314 1.00 0.00 O ATOM 847 CB LEU A 67 -1.359 -3.977 -4.666 1.00 0.00 C ATOM 848 CG LEU A 67 -2.103 -2.666 -4.396 1.00 0.00 C ATOM 849 CD1 LEU A 67 -2.537 -2.015 -5.699 1.00 0.00 C ATOM 850 CD2 LEU A 67 -3.298 -2.899 -3.481 1.00 0.00 C ATOM 0 H LEU A 67 -3.272 -5.960 -4.417 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.139 -4.370 -6.642 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.275 -4.522 -3.726 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.345 -3.735 -4.986 1.00 0.00 H new ATOM 0 HG LEU A 67 -1.419 -1.986 -3.889 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -3.064 -1.085 -5.484 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -1.659 -1.802 -6.309 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -3.200 -2.690 -6.240 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -3.810 -1.953 -3.304 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -3.985 -3.602 -3.952 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -2.955 -3.309 -2.531 1.00 0.00 H new ATOM 862 N THR A 68 -0.097 -5.886 -6.882 1.00 0.00 N ATOM 863 CA THR A 68 0.884 -6.913 -7.193 1.00 0.00 C ATOM 864 C THR A 68 2.224 -6.575 -6.550 1.00 0.00 C ATOM 865 O THR A 68 2.865 -5.587 -6.914 1.00 0.00 O ATOM 866 CB THR A 68 1.064 -7.062 -8.711 1.00 0.00 C ATOM 867 OG1 THR A 68 -0.191 -6.845 -9.371 1.00 0.00 O ATOM 868 CG2 THR A 68 1.594 -8.445 -9.050 1.00 0.00 C ATOM 0 H THR A 68 -0.001 -5.031 -7.429 1.00 0.00 H new ATOM 0 HA THR A 68 0.518 -7.858 -6.792 1.00 0.00 H new ATOM 0 HB THR A 68 1.785 -6.320 -9.053 1.00 0.00 H new ATOM 0 HG1 THR A 68 -0.342 -5.883 -9.479 1.00 0.00 H new ATOM 0 HG21 THR A 68 1.716 -8.533 -10.130 1.00 0.00 H new ATOM 0 HG22 THR A 68 2.557 -8.595 -8.563 1.00 0.00 H new ATOM 0 HG23 THR A 68 0.890 -9.200 -8.701 1.00 0.00 H new ATOM 876 N VAL A 69 2.634 -7.389 -5.585 1.00 0.00 N ATOM 877 CA VAL A 69 3.891 -7.167 -4.882 1.00 0.00 C ATOM 878 C VAL A 69 5.088 -7.561 -5.748 1.00 0.00 C ATOM 879 O VAL A 69 5.265 -8.729 -6.100 1.00 0.00 O ATOM 880 CB VAL A 69 3.941 -7.929 -3.529 1.00 0.00 C ATOM 881 CG1 VAL A 69 3.562 -9.395 -3.702 1.00 0.00 C ATOM 882 CG2 VAL A 69 5.318 -7.807 -2.889 1.00 0.00 C ATOM 0 H VAL A 69 2.114 -8.209 -5.272 1.00 0.00 H new ATOM 0 HA VAL A 69 3.947 -6.099 -4.671 1.00 0.00 H new ATOM 0 HB VAL A 69 3.209 -7.469 -2.866 1.00 0.00 H new ATOM 0 HG11 VAL A 69 3.607 -9.899 -2.737 1.00 0.00 H new ATOM 0 HG12 VAL A 69 2.550 -9.465 -4.101 1.00 0.00 H new ATOM 0 HG13 VAL A 69 4.258 -9.872 -4.393 1.00 0.00 H new ATOM 0 HG21 VAL A 69 5.329 -8.348 -1.943 1.00 0.00 H new ATOM 0 HG22 VAL A 69 6.069 -8.229 -3.557 1.00 0.00 H new ATOM 0 HG23 VAL A 69 5.543 -6.756 -2.708 1.00 0.00 H new ATOM 892 N ARG A 70 5.895 -6.573 -6.103 1.00 0.00 N ATOM 893 CA ARG A 70 7.085 -6.800 -6.905 1.00 0.00 C ATOM 894 C ARG A 70 8.290 -6.972 -5.990 1.00 0.00 C ATOM 895 O ARG A 70 8.231 -6.628 -4.806 1.00 0.00 O ATOM 896 CB ARG A 70 7.317 -5.626 -7.861 1.00 0.00 C ATOM 897 CG ARG A 70 6.137 -5.335 -8.776 1.00 0.00 C ATOM 898 CD ARG A 70 5.918 -6.462 -9.769 1.00 0.00 C ATOM 899 NE ARG A 70 4.701 -6.279 -10.556 1.00 0.00 N ATOM 900 CZ ARG A 70 4.147 -7.239 -11.299 1.00 0.00 C ATOM 901 NH1 ARG A 70 4.713 -8.438 -11.380 1.00 0.00 N ATOM 902 NH2 ARG A 70 3.023 -6.999 -11.962 1.00 0.00 N ATOM 0 H ARG A 70 5.744 -5.598 -5.845 1.00 0.00 H new ATOM 0 HA ARG A 70 6.947 -7.705 -7.496 1.00 0.00 H new ATOM 0 HB2 ARG A 70 7.540 -4.733 -7.277 1.00 0.00 H new ATOM 0 HB3 ARG A 70 8.195 -5.835 -8.472 1.00 0.00 H new ATOM 0 HG2 ARG A 70 5.237 -5.194 -8.178 1.00 0.00 H new ATOM 0 HG3 ARG A 70 6.312 -4.403 -9.313 1.00 0.00 H new ATOM 0 HD2 ARG A 70 6.775 -6.524 -10.439 1.00 0.00 H new ATOM 0 HD3 ARG A 70 5.862 -7.410 -9.233 1.00 0.00 H new ATOM 0 HE ARG A 70 4.249 -5.365 -10.536 1.00 0.00 H new ATOM 0 HH11 ARG A 70 5.577 -8.630 -10.872 1.00 0.00 H new ATOM 0 HH12 ARG A 70 4.284 -9.167 -11.950 1.00 0.00 H new ATOM 0 HH21 ARG A 70 2.583 -6.081 -11.904 1.00 0.00 H new ATOM 0 HH22 ARG A 70 2.599 -7.733 -12.530 1.00 0.00 H new ATOM 916 N ARG A 71 9.375 -7.501 -6.534 1.00 0.00 N ATOM 917 CA ARG A 71 10.589 -7.709 -5.757 1.00 0.00 C ATOM 918 C ARG A 71 11.322 -6.388 -5.572 1.00 0.00 C ATOM 919 O ARG A 71 11.844 -6.097 -4.494 1.00 0.00 O ATOM 920 CB ARG A 71 11.495 -8.730 -6.450 1.00 0.00 C ATOM 921 CG ARG A 71 12.696 -9.146 -5.615 1.00 0.00 C ATOM 922 CD ARG A 71 12.275 -9.941 -4.388 1.00 0.00 C ATOM 923 NE ARG A 71 11.619 -11.200 -4.747 1.00 0.00 N ATOM 924 CZ ARG A 71 11.651 -12.293 -3.989 1.00 0.00 C ATOM 925 NH1 ARG A 71 12.288 -12.277 -2.824 1.00 0.00 N ATOM 926 NH2 ARG A 71 11.036 -13.400 -4.394 1.00 0.00 N ATOM 0 H ARG A 71 9.441 -7.794 -7.509 1.00 0.00 H new ATOM 0 HA ARG A 71 10.317 -8.099 -4.776 1.00 0.00 H new ATOM 0 HB2 ARG A 71 10.909 -9.616 -6.694 1.00 0.00 H new ATOM 0 HB3 ARG A 71 11.847 -8.310 -7.393 1.00 0.00 H new ATOM 0 HG2 ARG A 71 13.373 -9.746 -6.223 1.00 0.00 H new ATOM 0 HG3 ARG A 71 13.248 -8.259 -5.303 1.00 0.00 H new ATOM 0 HD2 ARG A 71 13.151 -10.151 -3.774 1.00 0.00 H new ATOM 0 HD3 ARG A 71 11.598 -9.340 -3.782 1.00 0.00 H new ATOM 0 HE ARG A 71 11.108 -11.241 -5.629 1.00 0.00 H new ATOM 0 HH11 ARG A 71 12.754 -11.426 -2.509 1.00 0.00 H new ATOM 0 HH12 ARG A 71 12.312 -13.116 -2.244 1.00 0.00 H new ATOM 0 HH21 ARG A 71 10.540 -13.411 -5.285 1.00 0.00 H new ATOM 0 HH22 ARG A 71 11.060 -14.238 -3.813 1.00 0.00 H new ATOM 940 N SER A 72 11.370 -5.609 -6.643 1.00 0.00 N ATOM 941 CA SER A 72 12.005 -4.300 -6.629 1.00 0.00 C ATOM 942 C SER A 72 11.034 -3.273 -7.209 1.00 0.00 C ATOM 943 O SER A 72 10.472 -3.476 -8.290 1.00 0.00 O ATOM 944 CB SER A 72 13.297 -4.327 -7.446 1.00 0.00 C ATOM 945 OG SER A 72 13.982 -5.559 -7.285 1.00 0.00 O ATOM 0 H SER A 72 10.970 -5.867 -7.545 1.00 0.00 H new ATOM 0 HA SER A 72 12.257 -4.028 -5.604 1.00 0.00 H new ATOM 0 HB2 SER A 72 13.067 -4.171 -8.500 1.00 0.00 H new ATOM 0 HB3 SER A 72 13.943 -3.506 -7.136 1.00 0.00 H new ATOM 0 HG SER A 72 14.662 -5.466 -6.585 1.00 0.00 H new ATOM 951 N PHE A 73 10.830 -2.178 -6.499 1.00 0.00 N ATOM 952 CA PHE A 73 9.899 -1.153 -6.950 1.00 0.00 C ATOM 953 C PHE A 73 10.406 0.241 -6.629 1.00 0.00 C ATOM 954 O PHE A 73 11.257 0.423 -5.760 1.00 0.00 O ATOM 955 CB PHE A 73 8.525 -1.369 -6.299 1.00 0.00 C ATOM 956 CG PHE A 73 8.532 -1.234 -4.798 1.00 0.00 C ATOM 957 CD1 PHE A 73 8.908 -2.297 -3.992 1.00 0.00 C ATOM 958 CD2 PHE A 73 8.160 -0.043 -4.194 1.00 0.00 C ATOM 959 CE1 PHE A 73 8.913 -2.173 -2.617 1.00 0.00 C ATOM 960 CE2 PHE A 73 8.164 0.087 -2.819 1.00 0.00 C ATOM 961 CZ PHE A 73 8.541 -0.982 -2.029 1.00 0.00 C ATOM 0 H PHE A 73 11.292 -1.974 -5.613 1.00 0.00 H new ATOM 0 HA PHE A 73 9.809 -1.238 -8.033 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.820 -0.650 -6.715 1.00 0.00 H new ATOM 0 HB3 PHE A 73 8.161 -2.362 -6.563 1.00 0.00 H new ATOM 0 HD1 PHE A 73 9.200 -3.233 -4.445 1.00 0.00 H new ATOM 0 HD2 PHE A 73 7.863 0.795 -4.807 1.00 0.00 H new ATOM 0 HE1 PHE A 73 9.209 -3.009 -2.001 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.873 1.022 -2.363 1.00 0.00 H new ATOM 0 HZ PHE A 73 8.544 -0.885 -0.953 1.00 0.00 H new ATOM 971 N GLU A 74 9.880 1.219 -7.350 1.00 0.00 N ATOM 972 CA GLU A 74 10.243 2.609 -7.138 1.00 0.00 C ATOM 973 C GLU A 74 9.488 3.145 -5.931 1.00 0.00 C ATOM 974 O GLU A 74 8.262 3.184 -5.935 1.00 0.00 O ATOM 975 CB GLU A 74 9.913 3.455 -8.376 1.00 0.00 C ATOM 976 CG GLU A 74 10.205 2.762 -9.698 1.00 0.00 C ATOM 977 CD GLU A 74 9.009 2.004 -10.241 1.00 0.00 C ATOM 978 OE1 GLU A 74 8.744 0.881 -9.763 1.00 0.00 O ATOM 979 OE2 GLU A 74 8.339 2.521 -11.159 1.00 0.00 O ATOM 0 H GLU A 74 9.196 1.073 -8.092 1.00 0.00 H new ATOM 0 HA GLU A 74 11.317 2.669 -6.961 1.00 0.00 H new ATOM 0 HB2 GLU A 74 8.858 3.727 -8.346 1.00 0.00 H new ATOM 0 HB3 GLU A 74 10.483 4.383 -8.331 1.00 0.00 H new ATOM 0 HG2 GLU A 74 10.522 3.505 -10.430 1.00 0.00 H new ATOM 0 HG3 GLU A 74 11.037 2.071 -9.565 1.00 0.00 H new ATOM 986 N GLY A 75 10.213 3.536 -4.895 1.00 0.00 N ATOM 987 CA GLY A 75 9.574 4.054 -3.701 1.00 0.00 C ATOM 988 C GLY A 75 9.152 5.499 -3.847 1.00 0.00 C ATOM 989 O GLY A 75 9.980 6.370 -4.134 1.00 0.00 O ATOM 0 H GLY A 75 11.232 3.505 -4.858 1.00 0.00 H new ATOM 0 HA2 GLY A 75 8.700 3.446 -3.468 1.00 0.00 H new ATOM 0 HA3 GLY A 75 10.259 3.963 -2.858 1.00 0.00 H new ATOM 993 N PHE A 76 7.872 5.763 -3.615 1.00 0.00 N ATOM 994 CA PHE A 76 7.333 7.106 -3.737 1.00 0.00 C ATOM 995 C PHE A 76 6.543 7.480 -2.495 1.00 0.00 C ATOM 996 O PHE A 76 5.894 6.632 -1.882 1.00 0.00 O ATOM 997 CB PHE A 76 6.431 7.212 -4.973 1.00 0.00 C ATOM 998 CG PHE A 76 7.163 7.539 -6.243 1.00 0.00 C ATOM 999 CD1 PHE A 76 7.978 6.600 -6.853 1.00 0.00 C ATOM 1000 CD2 PHE A 76 7.029 8.785 -6.832 1.00 0.00 C ATOM 1001 CE1 PHE A 76 8.647 6.898 -8.024 1.00 0.00 C ATOM 1002 CE2 PHE A 76 7.695 9.086 -8.004 1.00 0.00 C ATOM 1003 CZ PHE A 76 8.505 8.139 -8.602 1.00 0.00 C ATOM 0 H PHE A 76 7.187 5.059 -3.340 1.00 0.00 H new ATOM 0 HA PHE A 76 8.169 7.797 -3.846 1.00 0.00 H new ATOM 0 HB2 PHE A 76 5.902 6.268 -5.105 1.00 0.00 H new ATOM 0 HB3 PHE A 76 5.677 7.978 -4.794 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.092 5.623 -6.408 1.00 0.00 H new ATOM 0 HD2 PHE A 76 6.397 9.529 -6.370 1.00 0.00 H new ATOM 0 HE1 PHE A 76 9.282 6.157 -8.486 1.00 0.00 H new ATOM 0 HE2 PHE A 76 7.583 10.062 -8.453 1.00 0.00 H new ATOM 0 HZ PHE A 76 9.025 8.372 -9.520 1.00 0.00 H new ATOM 1013 N LEU A 77 6.607 8.746 -2.121 1.00 0.00 N ATOM 1014 CA LEU A 77 5.887 9.236 -0.956 1.00 0.00 C ATOM 1015 C LEU A 77 4.449 9.568 -1.349 1.00 0.00 C ATOM 1016 O LEU A 77 4.063 9.397 -2.509 1.00 0.00 O ATOM 1017 CB LEU A 77 6.585 10.467 -0.368 1.00 0.00 C ATOM 1018 CG LEU A 77 8.108 10.364 -0.237 1.00 0.00 C ATOM 1019 CD1 LEU A 77 8.678 11.656 0.330 1.00 0.00 C ATOM 1020 CD2 LEU A 77 8.494 9.181 0.639 1.00 0.00 C ATOM 0 H LEU A 77 7.152 9.457 -2.609 1.00 0.00 H new ATOM 0 HA LEU A 77 5.877 8.460 -0.191 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.349 11.329 -0.992 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.166 10.664 0.619 1.00 0.00 H new ATOM 0 HG LEU A 77 8.529 10.204 -1.230 1.00 0.00 H new ATOM 0 HD11 LEU A 77 9.761 11.568 0.418 1.00 0.00 H new ATOM 0 HD12 LEU A 77 8.434 12.484 -0.335 1.00 0.00 H new ATOM 0 HD13 LEU A 77 8.248 11.842 1.314 1.00 0.00 H new ATOM 0 HD21 LEU A 77 9.580 9.126 0.719 1.00 0.00 H new ATOM 0 HD22 LEU A 77 8.063 9.308 1.632 1.00 0.00 H new ATOM 0 HD23 LEU A 77 8.116 8.260 0.194 1.00 0.00 H new ATOM 1032 N PHE A 78 3.658 10.052 -0.403 1.00 0.00 N ATOM 1033 CA PHE A 78 2.266 10.381 -0.689 1.00 0.00 C ATOM 1034 C PHE A 78 2.146 11.761 -1.320 1.00 0.00 C ATOM 1035 O PHE A 78 1.118 12.096 -1.911 1.00 0.00 O ATOM 1036 CB PHE A 78 1.417 10.312 0.579 1.00 0.00 C ATOM 1037 CG PHE A 78 0.974 8.921 0.929 1.00 0.00 C ATOM 1038 CD1 PHE A 78 0.346 8.122 -0.014 1.00 0.00 C ATOM 1039 CD2 PHE A 78 1.183 8.410 2.197 1.00 0.00 C ATOM 1040 CE1 PHE A 78 -0.064 6.841 0.301 1.00 0.00 C ATOM 1041 CE2 PHE A 78 0.775 7.131 2.522 1.00 0.00 C ATOM 1042 CZ PHE A 78 0.151 6.346 1.571 1.00 0.00 C ATOM 0 H PHE A 78 3.950 10.225 0.559 1.00 0.00 H new ATOM 0 HA PHE A 78 1.895 9.642 -1.399 1.00 0.00 H new ATOM 0 HB2 PHE A 78 1.988 10.723 1.412 1.00 0.00 H new ATOM 0 HB3 PHE A 78 0.538 10.944 0.453 1.00 0.00 H new ATOM 0 HD1 PHE A 78 0.175 8.506 -1.009 1.00 0.00 H new ATOM 0 HD2 PHE A 78 1.672 9.019 2.943 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -0.551 6.229 -0.444 1.00 0.00 H new ATOM 0 HE2 PHE A 78 0.943 6.745 3.517 1.00 0.00 H new ATOM 0 HZ PHE A 78 -0.168 5.345 1.822 1.00 0.00 H new ATOM 1052 N ASP A 79 3.197 12.555 -1.189 1.00 0.00 N ATOM 1053 CA ASP A 79 3.215 13.901 -1.751 1.00 0.00 C ATOM 1054 C ASP A 79 3.488 13.843 -3.256 1.00 0.00 C ATOM 1055 O ASP A 79 2.930 14.620 -4.033 1.00 0.00 O ATOM 1056 CB ASP A 79 4.265 14.777 -1.042 1.00 0.00 C ATOM 1057 CG ASP A 79 5.694 14.444 -1.429 1.00 0.00 C ATOM 1058 OD1 ASP A 79 6.012 13.249 -1.595 1.00 0.00 O ATOM 1059 OD2 ASP A 79 6.506 15.378 -1.570 1.00 0.00 O ATOM 0 H ASP A 79 4.051 12.292 -0.698 1.00 0.00 H new ATOM 0 HA ASP A 79 2.236 14.354 -1.592 1.00 0.00 H new ATOM 0 HB2 ASP A 79 4.069 15.824 -1.274 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.153 14.663 0.036 1.00 0.00 H new ATOM 1064 N GLY A 80 4.324 12.895 -3.660 1.00 0.00 N ATOM 1065 CA GLY A 80 4.657 12.738 -5.062 1.00 0.00 C ATOM 1066 C GLY A 80 6.152 12.640 -5.283 1.00 0.00 C ATOM 1067 O GLY A 80 6.607 12.383 -6.399 1.00 0.00 O ATOM 0 H GLY A 80 4.780 12.228 -3.037 1.00 0.00 H new ATOM 0 HA2 GLY A 80 4.174 11.842 -5.451 1.00 0.00 H new ATOM 0 HA3 GLY A 80 4.262 13.583 -5.625 1.00 0.00 H new ATOM 1071 N THR A 81 6.921 12.850 -4.225 1.00 0.00 N ATOM 1072 CA THR A 81 8.370 12.782 -4.310 1.00 0.00 C ATOM 1073 C THR A 81 8.852 11.344 -4.129 1.00 0.00 C ATOM 1074 O THR A 81 8.280 10.584 -3.349 1.00 0.00 O ATOM 1075 CB THR A 81 9.024 13.693 -3.250 1.00 0.00 C ATOM 1076 OG1 THR A 81 8.400 14.985 -3.277 1.00 0.00 O ATOM 1077 CG2 THR A 81 10.517 13.850 -3.504 1.00 0.00 C ATOM 0 H THR A 81 6.563 13.069 -3.295 1.00 0.00 H new ATOM 0 HA THR A 81 8.665 13.131 -5.300 1.00 0.00 H new ATOM 0 HB THR A 81 8.887 13.230 -2.273 1.00 0.00 H new ATOM 0 HG1 THR A 81 8.011 15.179 -2.398 1.00 0.00 H new ATOM 0 HG21 THR A 81 10.950 14.497 -2.741 1.00 0.00 H new ATOM 0 HG22 THR A 81 10.997 12.872 -3.466 1.00 0.00 H new ATOM 0 HG23 THR A 81 10.674 14.293 -4.487 1.00 0.00 H new ATOM 1085 N ARG A 82 9.882 10.965 -4.872 1.00 0.00 N ATOM 1086 CA ARG A 82 10.432 9.620 -4.782 1.00 0.00 C ATOM 1087 C ARG A 82 11.565 9.579 -3.763 1.00 0.00 C ATOM 1088 O ARG A 82 12.149 10.613 -3.437 1.00 0.00 O ATOM 1089 CB ARG A 82 10.945 9.146 -6.146 1.00 0.00 C ATOM 1090 CG ARG A 82 12.293 9.726 -6.543 1.00 0.00 C ATOM 1091 CD ARG A 82 12.153 10.907 -7.487 1.00 0.00 C ATOM 1092 NE ARG A 82 11.316 10.591 -8.644 1.00 0.00 N ATOM 1093 CZ ARG A 82 11.729 9.889 -9.697 1.00 0.00 C ATOM 1094 NH1 ARG A 82 12.973 9.419 -9.751 1.00 0.00 N ATOM 1095 NH2 ARG A 82 10.895 9.656 -10.698 1.00 0.00 N ATOM 0 H ARG A 82 10.354 11.570 -5.544 1.00 0.00 H new ATOM 0 HA ARG A 82 9.634 8.951 -4.459 1.00 0.00 H new ATOM 0 HB2 ARG A 82 11.019 8.059 -6.135 1.00 0.00 H new ATOM 0 HB3 ARG A 82 10.211 9.408 -6.908 1.00 0.00 H new ATOM 0 HG2 ARG A 82 12.829 10.040 -5.648 1.00 0.00 H new ATOM 0 HG3 ARG A 82 12.894 8.951 -7.019 1.00 0.00 H new ATOM 0 HD2 ARG A 82 11.723 11.752 -6.949 1.00 0.00 H new ATOM 0 HD3 ARG A 82 13.141 11.217 -7.829 1.00 0.00 H new ATOM 0 HE ARG A 82 10.354 10.930 -8.644 1.00 0.00 H new ATOM 0 HH11 ARG A 82 13.619 9.596 -8.981 1.00 0.00 H new ATOM 0 HH12 ARG A 82 13.281 8.882 -10.562 1.00 0.00 H new ATOM 0 HH21 ARG A 82 9.941 10.014 -10.660 1.00 0.00 H new ATOM 0 HH22 ARG A 82 11.207 9.119 -11.507 1.00 0.00 H new ATOM 1109 N TRP A 83 11.871 8.389 -3.262 1.00 0.00 N ATOM 1110 CA TRP A 83 12.949 8.229 -2.291 1.00 0.00 C ATOM 1111 C TRP A 83 14.030 7.295 -2.834 1.00 0.00 C ATOM 1112 O TRP A 83 15.186 7.355 -2.413 1.00 0.00 O ATOM 1113 CB TRP A 83 12.404 7.696 -0.963 1.00 0.00 C ATOM 1114 CG TRP A 83 13.265 8.046 0.218 1.00 0.00 C ATOM 1115 CD1 TRP A 83 14.389 7.390 0.641 1.00 0.00 C ATOM 1116 CD2 TRP A 83 13.072 9.136 1.129 1.00 0.00 C ATOM 1117 NE1 TRP A 83 14.903 8.006 1.755 1.00 0.00 N ATOM 1118 CE2 TRP A 83 14.112 9.076 2.077 1.00 0.00 C ATOM 1119 CE3 TRP A 83 12.122 10.152 1.242 1.00 0.00 C ATOM 1120 CZ2 TRP A 83 14.226 9.995 3.118 1.00 0.00 C ATOM 1121 CZ3 TRP A 83 12.239 11.067 2.272 1.00 0.00 C ATOM 1122 CH2 TRP A 83 13.283 10.980 3.201 1.00 0.00 C ATOM 0 H TRP A 83 11.391 7.524 -3.510 1.00 0.00 H new ATOM 0 HA TRP A 83 13.395 9.208 -2.114 1.00 0.00 H new ATOM 0 HB2 TRP A 83 11.402 8.094 -0.804 1.00 0.00 H new ATOM 0 HB3 TRP A 83 12.310 6.612 -1.026 1.00 0.00 H new ATOM 0 HD1 TRP A 83 14.810 6.515 0.168 1.00 0.00 H new ATOM 0 HE1 TRP A 83 15.739 7.714 2.261 1.00 0.00 H new ATOM 0 HE3 TRP A 83 11.308 10.222 0.536 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 15.032 9.931 3.834 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 11.513 11.862 2.361 1.00 0.00 H new ATOM 0 HH2 TRP A 83 13.344 11.706 3.999 1.00 0.00 H new ATOM 1133 N GLY A 84 13.659 6.440 -3.775 1.00 0.00 N ATOM 1134 CA GLY A 84 14.617 5.516 -4.352 1.00 0.00 C ATOM 1135 C GLY A 84 14.004 4.162 -4.642 1.00 0.00 C ATOM 1136 O GLY A 84 12.854 3.909 -4.283 1.00 0.00 O ATOM 0 H GLY A 84 12.713 6.368 -4.150 1.00 0.00 H new ATOM 0 HA2 GLY A 84 15.015 5.938 -5.275 1.00 0.00 H new ATOM 0 HA3 GLY A 84 15.458 5.393 -3.669 1.00 0.00 H new ATOM 1140 N THR A 85 14.763 3.297 -5.290 1.00 0.00 N ATOM 1141 CA THR A 85 14.290 1.963 -5.632 1.00 0.00 C ATOM 1142 C THR A 85 14.428 1.007 -4.447 1.00 0.00 C ATOM 1143 O THR A 85 15.538 0.727 -3.985 1.00 0.00 O ATOM 1144 CB THR A 85 15.063 1.399 -6.838 1.00 0.00 C ATOM 1145 OG1 THR A 85 15.253 2.430 -7.818 1.00 0.00 O ATOM 1146 CG2 THR A 85 14.316 0.231 -7.467 1.00 0.00 C ATOM 0 H THR A 85 15.717 3.494 -5.593 1.00 0.00 H new ATOM 0 HA THR A 85 13.235 2.050 -5.893 1.00 0.00 H new ATOM 0 HB THR A 85 16.031 1.042 -6.486 1.00 0.00 H new ATOM 0 HG1 THR A 85 15.747 2.067 -8.583 1.00 0.00 H new ATOM 0 HG21 THR A 85 14.884 -0.149 -8.317 1.00 0.00 H new ATOM 0 HG22 THR A 85 14.193 -0.562 -6.729 1.00 0.00 H new ATOM 0 HG23 THR A 85 13.336 0.566 -7.806 1.00 0.00 H new ATOM 1154 N VAL A 86 13.298 0.514 -3.959 1.00 0.00 N ATOM 1155 CA VAL A 86 13.285 -0.412 -2.835 1.00 0.00 C ATOM 1156 C VAL A 86 13.379 -1.842 -3.349 1.00 0.00 C ATOM 1157 O VAL A 86 12.722 -2.199 -4.328 1.00 0.00 O ATOM 1158 CB VAL A 86 12.008 -0.266 -1.980 1.00 0.00 C ATOM 1159 CG1 VAL A 86 12.206 -0.879 -0.603 1.00 0.00 C ATOM 1160 CG2 VAL A 86 11.606 1.196 -1.858 1.00 0.00 C ATOM 0 H VAL A 86 12.374 0.741 -4.326 1.00 0.00 H new ATOM 0 HA VAL A 86 14.143 -0.175 -2.205 1.00 0.00 H new ATOM 0 HB VAL A 86 11.203 -0.804 -2.482 1.00 0.00 H new ATOM 0 HG11 VAL A 86 11.293 -0.764 -0.019 1.00 0.00 H new ATOM 0 HG12 VAL A 86 12.439 -1.939 -0.707 1.00 0.00 H new ATOM 0 HG13 VAL A 86 13.028 -0.374 -0.095 1.00 0.00 H new ATOM 0 HG21 VAL A 86 10.704 1.276 -1.252 1.00 0.00 H new ATOM 0 HG22 VAL A 86 12.412 1.757 -1.385 1.00 0.00 H new ATOM 0 HG23 VAL A 86 11.414 1.604 -2.850 1.00 0.00 H new ATOM 1170 N ASP A 87 14.197 -2.653 -2.700 1.00 0.00 N ATOM 1171 CA ASP A 87 14.382 -4.037 -3.108 1.00 0.00 C ATOM 1172 C ASP A 87 14.160 -4.972 -1.928 1.00 0.00 C ATOM 1173 O ASP A 87 14.853 -4.881 -0.915 1.00 0.00 O ATOM 1174 CB ASP A 87 15.788 -4.224 -3.674 1.00 0.00 C ATOM 1175 CG ASP A 87 15.991 -5.590 -4.288 1.00 0.00 C ATOM 1176 OD1 ASP A 87 16.248 -6.550 -3.538 1.00 0.00 O ATOM 1177 OD2 ASP A 87 15.909 -5.709 -5.526 1.00 0.00 O ATOM 0 H ASP A 87 14.746 -2.377 -1.886 1.00 0.00 H new ATOM 0 HA ASP A 87 13.652 -4.279 -3.880 1.00 0.00 H new ATOM 0 HB2 ASP A 87 15.977 -3.459 -4.428 1.00 0.00 H new ATOM 0 HB3 ASP A 87 16.518 -4.075 -2.879 1.00 0.00 H new ATOM 1182 N CYS A 88 13.204 -5.878 -2.064 1.00 0.00 N ATOM 1183 CA CYS A 88 12.881 -6.811 -0.994 1.00 0.00 C ATOM 1184 C CYS A 88 13.378 -8.223 -1.296 1.00 0.00 C ATOM 1185 O CYS A 88 12.622 -9.192 -1.209 1.00 0.00 O ATOM 1186 CB CYS A 88 11.371 -6.830 -0.748 1.00 0.00 C ATOM 1187 SG CYS A 88 10.733 -5.346 0.099 1.00 0.00 S ATOM 0 H CYS A 88 12.638 -5.988 -2.905 1.00 0.00 H new ATOM 0 HA CYS A 88 13.393 -6.466 -0.095 1.00 0.00 H new ATOM 0 HB2 CYS A 88 10.860 -6.937 -1.705 1.00 0.00 H new ATOM 0 HB3 CYS A 88 11.122 -7.709 -0.154 1.00 0.00 H new ATOM 1192 N THR A 89 14.643 -8.346 -1.667 1.00 0.00 N ATOM 1193 CA THR A 89 15.216 -9.656 -1.939 1.00 0.00 C ATOM 1194 C THR A 89 15.752 -10.257 -0.642 1.00 0.00 C ATOM 1195 O THR A 89 15.401 -11.376 -0.278 1.00 0.00 O ATOM 1196 CB THR A 89 16.327 -9.594 -3.005 1.00 0.00 C ATOM 1197 OG1 THR A 89 15.810 -8.979 -4.190 1.00 0.00 O ATOM 1198 CG2 THR A 89 16.848 -10.983 -3.338 1.00 0.00 C ATOM 0 H THR A 89 15.287 -7.564 -1.786 1.00 0.00 H new ATOM 0 HA THR A 89 14.427 -10.292 -2.340 1.00 0.00 H new ATOM 0 HB THR A 89 17.155 -9.007 -2.608 1.00 0.00 H new ATOM 0 HG1 THR A 89 15.538 -8.059 -3.989 1.00 0.00 H new ATOM 0 HG21 THR A 89 17.631 -10.907 -4.093 1.00 0.00 H new ATOM 0 HG22 THR A 89 17.255 -11.444 -2.438 1.00 0.00 H new ATOM 0 HG23 THR A 89 16.032 -11.595 -3.722 1.00 0.00 H new ATOM 1206 N THR A 90 16.580 -9.492 0.065 1.00 0.00 N ATOM 1207 CA THR A 90 17.134 -9.948 1.331 1.00 0.00 C ATOM 1208 C THR A 90 16.308 -9.399 2.491 1.00 0.00 C ATOM 1209 O THR A 90 16.448 -9.836 3.634 1.00 0.00 O ATOM 1210 CB THR A 90 18.616 -9.539 1.490 1.00 0.00 C ATOM 1211 OG1 THR A 90 19.205 -10.217 2.607 1.00 0.00 O ATOM 1212 CG2 THR A 90 18.765 -8.034 1.677 1.00 0.00 C ATOM 0 H THR A 90 16.879 -8.559 -0.218 1.00 0.00 H new ATOM 0 HA THR A 90 17.091 -11.037 1.339 1.00 0.00 H new ATOM 0 HB THR A 90 19.132 -9.826 0.574 1.00 0.00 H new ATOM 0 HG1 THR A 90 18.565 -10.242 3.349 1.00 0.00 H new ATOM 0 HG21 THR A 90 19.820 -7.784 1.785 1.00 0.00 H new ATOM 0 HG22 THR A 90 18.357 -7.517 0.808 1.00 0.00 H new ATOM 0 HG23 THR A 90 18.225 -7.723 2.571 1.00 0.00 H new ATOM 1220 N ALA A 91 15.442 -8.445 2.178 1.00 0.00 N ATOM 1221 CA ALA A 91 14.578 -7.826 3.169 1.00 0.00 C ATOM 1222 C ALA A 91 13.122 -8.149 2.863 1.00 0.00 C ATOM 1223 O ALA A 91 12.797 -8.575 1.753 1.00 0.00 O ATOM 1224 CB ALA A 91 14.798 -6.323 3.198 1.00 0.00 C ATOM 0 H ALA A 91 15.320 -8.081 1.233 1.00 0.00 H new ATOM 0 HA ALA A 91 14.825 -8.226 4.152 1.00 0.00 H new ATOM 0 HB1 ALA A 91 14.144 -5.874 3.945 1.00 0.00 H new ATOM 0 HB2 ALA A 91 15.837 -6.112 3.452 1.00 0.00 H new ATOM 0 HB3 ALA A 91 14.571 -5.903 2.218 1.00 0.00 H new ATOM 1230 N ALA A 92 12.252 -7.943 3.837 1.00 0.00 N ATOM 1231 CA ALA A 92 10.836 -8.228 3.667 1.00 0.00 C ATOM 1232 C ALA A 92 10.064 -6.968 3.297 1.00 0.00 C ATOM 1233 O ALA A 92 10.397 -5.869 3.741 1.00 0.00 O ATOM 1234 CB ALA A 92 10.264 -8.845 4.934 1.00 0.00 C ATOM 0 H ALA A 92 12.502 -7.578 4.756 1.00 0.00 H new ATOM 0 HA ALA A 92 10.731 -8.942 2.850 1.00 0.00 H new ATOM 0 HB1 ALA A 92 9.204 -9.053 4.791 1.00 0.00 H new ATOM 0 HB2 ALA A 92 10.789 -9.774 5.155 1.00 0.00 H new ATOM 0 HB3 ALA A 92 10.389 -8.151 5.765 1.00 0.00 H new ATOM 1240 N CYS A 93 9.034 -7.136 2.484 1.00 0.00 N ATOM 1241 CA CYS A 93 8.206 -6.023 2.053 1.00 0.00 C ATOM 1242 C CYS A 93 6.945 -5.952 2.913 1.00 0.00 C ATOM 1243 O CYS A 93 6.783 -6.731 3.854 1.00 0.00 O ATOM 1244 CB CYS A 93 7.835 -6.182 0.571 1.00 0.00 C ATOM 1245 SG CYS A 93 8.828 -5.166 -0.577 1.00 0.00 S ATOM 0 H CYS A 93 8.750 -8.040 2.107 1.00 0.00 H new ATOM 0 HA CYS A 93 8.766 -5.095 2.172 1.00 0.00 H new ATOM 0 HB2 CYS A 93 7.944 -7.231 0.294 1.00 0.00 H new ATOM 0 HB3 CYS A 93 6.783 -5.926 0.444 1.00 0.00 H new ATOM 1250 N GLN A 94 6.063 -5.016 2.601 1.00 0.00 N ATOM 1251 CA GLN A 94 4.818 -4.860 3.341 1.00 0.00 C ATOM 1252 C GLN A 94 3.797 -4.112 2.498 1.00 0.00 C ATOM 1253 O GLN A 94 4.106 -3.672 1.391 1.00 0.00 O ATOM 1254 CB GLN A 94 5.056 -4.139 4.672 1.00 0.00 C ATOM 1255 CG GLN A 94 5.779 -2.815 4.538 1.00 0.00 C ATOM 1256 CD GLN A 94 5.643 -1.954 5.776 1.00 0.00 C ATOM 1257 OE1 GLN A 94 6.455 -2.032 6.699 1.00 0.00 O ATOM 1258 NE2 GLN A 94 4.614 -1.123 5.802 1.00 0.00 N ATOM 0 H GLN A 94 6.186 -4.350 1.838 1.00 0.00 H new ATOM 0 HA GLN A 94 4.425 -5.852 3.566 1.00 0.00 H new ATOM 0 HB2 GLN A 94 4.095 -3.968 5.157 1.00 0.00 H new ATOM 0 HB3 GLN A 94 5.633 -4.791 5.328 1.00 0.00 H new ATOM 0 HG2 GLN A 94 6.835 -2.999 4.341 1.00 0.00 H new ATOM 0 HG3 GLN A 94 5.384 -2.274 3.678 1.00 0.00 H new ATOM 0 HE21 GLN A 94 3.965 -1.090 5.016 1.00 0.00 H new ATOM 0 HE22 GLN A 94 4.470 -0.515 6.608 1.00 0.00 H new ATOM 1267 N VAL A 95 2.585 -3.981 3.015 1.00 0.00 N ATOM 1268 CA VAL A 95 1.517 -3.295 2.296 1.00 0.00 C ATOM 1269 C VAL A 95 1.198 -1.952 2.940 1.00 0.00 C ATOM 1270 O VAL A 95 1.174 -1.830 4.166 1.00 0.00 O ATOM 1271 CB VAL A 95 0.225 -4.146 2.248 1.00 0.00 C ATOM 1272 CG1 VAL A 95 -0.754 -3.589 1.221 1.00 0.00 C ATOM 1273 CG2 VAL A 95 0.546 -5.605 1.952 1.00 0.00 C ATOM 0 H VAL A 95 2.314 -4.340 3.930 1.00 0.00 H new ATOM 0 HA VAL A 95 1.876 -3.136 1.279 1.00 0.00 H new ATOM 0 HB VAL A 95 -0.248 -4.096 3.229 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -1.654 -4.204 1.206 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -1.018 -2.566 1.488 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -0.291 -3.599 0.234 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -0.378 -6.182 1.923 1.00 0.00 H new ATOM 0 HG22 VAL A 95 1.050 -5.678 0.988 1.00 0.00 H new ATOM 0 HG23 VAL A 95 1.197 -6.000 2.732 1.00 0.00 H new ATOM 1283 N GLY A 96 0.964 -0.950 2.107 1.00 0.00 N ATOM 1284 CA GLY A 96 0.637 0.366 2.596 1.00 0.00 C ATOM 1285 C GLY A 96 -0.689 0.842 2.056 1.00 0.00 C ATOM 1286 O GLY A 96 -0.915 0.806 0.847 1.00 0.00 O ATOM 0 H GLY A 96 0.996 -1.030 1.091 1.00 0.00 H new ATOM 0 HA2 GLY A 96 0.604 0.353 3.685 1.00 0.00 H new ATOM 0 HA3 GLY A 96 1.421 1.067 2.309 1.00 0.00 H new ATOM 1290 N LEU A 97 -1.565 1.279 2.946 1.00 0.00 N ATOM 1291 CA LEU A 97 -2.888 1.745 2.558 1.00 0.00 C ATOM 1292 C LEU A 97 -3.271 2.996 3.336 1.00 0.00 C ATOM 1293 O LEU A 97 -3.450 2.948 4.553 1.00 0.00 O ATOM 1294 CB LEU A 97 -3.928 0.638 2.793 1.00 0.00 C ATOM 1295 CG LEU A 97 -3.423 -0.572 3.590 1.00 0.00 C ATOM 1296 CD1 LEU A 97 -3.485 -0.307 5.086 1.00 0.00 C ATOM 1297 CD2 LEU A 97 -4.214 -1.818 3.236 1.00 0.00 C ATOM 0 H LEU A 97 -1.383 1.321 3.949 1.00 0.00 H new ATOM 0 HA LEU A 97 -2.866 1.994 1.497 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -4.781 1.068 3.317 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -4.291 0.290 1.826 1.00 0.00 H new ATOM 0 HG LEU A 97 -2.380 -0.738 3.319 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -3.121 -1.181 5.626 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -2.863 0.554 5.329 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -4.516 -0.104 5.377 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -3.839 -2.663 3.813 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -5.267 -1.659 3.469 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -4.105 -2.028 2.172 1.00 0.00 H new ATOM 1309 N SER A 98 -3.381 4.118 2.637 1.00 0.00 N ATOM 1310 CA SER A 98 -3.746 5.381 3.269 1.00 0.00 C ATOM 1311 C SER A 98 -4.349 6.342 2.247 1.00 0.00 C ATOM 1312 O SER A 98 -4.228 6.132 1.041 1.00 0.00 O ATOM 1313 CB SER A 98 -2.523 6.028 3.925 1.00 0.00 C ATOM 1314 OG SER A 98 -1.988 5.202 4.946 1.00 0.00 O ATOM 0 H SER A 98 -3.223 4.180 1.631 1.00 0.00 H new ATOM 0 HA SER A 98 -4.491 5.169 4.036 1.00 0.00 H new ATOM 0 HB2 SER A 98 -1.760 6.217 3.170 1.00 0.00 H new ATOM 0 HB3 SER A 98 -2.802 6.994 4.345 1.00 0.00 H new ATOM 0 HG SER A 98 -2.526 4.387 5.023 1.00 0.00 H new ATOM 1320 N ASP A 99 -5.015 7.383 2.731 1.00 0.00 N ATOM 1321 CA ASP A 99 -5.620 8.377 1.854 1.00 0.00 C ATOM 1322 C ASP A 99 -4.552 9.340 1.334 1.00 0.00 C ATOM 1323 O ASP A 99 -3.363 9.174 1.619 1.00 0.00 O ATOM 1324 CB ASP A 99 -6.727 9.145 2.595 1.00 0.00 C ATOM 1325 CG ASP A 99 -6.201 10.327 3.383 1.00 0.00 C ATOM 1326 OD1 ASP A 99 -5.412 10.119 4.321 1.00 0.00 O ATOM 1327 OD2 ASP A 99 -6.575 11.478 3.064 1.00 0.00 O ATOM 0 H ASP A 99 -5.150 7.561 3.726 1.00 0.00 H new ATOM 0 HA ASP A 99 -6.070 7.866 1.003 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -7.464 9.496 1.873 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -7.243 8.464 3.272 1.00 0.00 H new ATOM 1332 N ALA A 100 -4.979 10.342 0.574 1.00 0.00 N ATOM 1333 CA ALA A 100 -4.064 11.330 0.011 1.00 0.00 C ATOM 1334 C ALA A 100 -3.245 12.033 1.097 1.00 0.00 C ATOM 1335 O ALA A 100 -2.098 12.425 0.868 1.00 0.00 O ATOM 1336 CB ALA A 100 -4.841 12.352 -0.800 1.00 0.00 C ATOM 0 H ALA A 100 -5.958 10.493 0.332 1.00 0.00 H new ATOM 0 HA ALA A 100 -3.365 10.803 -0.638 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -4.151 13.086 -1.217 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -5.369 11.849 -1.610 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -5.561 12.856 -0.156 1.00 0.00 H new ATOM 1342 N ALA A 101 -3.837 12.196 2.276 1.00 0.00 N ATOM 1343 CA ALA A 101 -3.156 12.847 3.388 1.00 0.00 C ATOM 1344 C ALA A 101 -2.205 11.875 4.079 1.00 0.00 C ATOM 1345 O ALA A 101 -1.023 12.169 4.262 1.00 0.00 O ATOM 1346 CB ALA A 101 -4.166 13.402 4.381 1.00 0.00 C ATOM 0 H ALA A 101 -4.786 11.886 2.485 1.00 0.00 H new ATOM 0 HA ALA A 101 -2.570 13.677 2.992 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -3.639 13.884 5.204 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -4.804 14.131 3.882 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -4.779 12.589 4.769 1.00 0.00 H new ATOM 1352 N GLY A 102 -2.726 10.717 4.455 1.00 0.00 N ATOM 1353 CA GLY A 102 -1.910 9.716 5.113 1.00 0.00 C ATOM 1354 C GLY A 102 -2.616 9.057 6.281 1.00 0.00 C ATOM 1355 O GLY A 102 -1.984 8.702 7.277 1.00 0.00 O ATOM 0 H GLY A 102 -3.701 10.451 4.316 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -1.626 8.953 4.389 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -0.989 10.180 5.466 1.00 0.00 H new ATOM 1359 N ASN A 103 -3.928 8.903 6.172 1.00 0.00 N ATOM 1360 CA ASN A 103 -4.715 8.272 7.223 1.00 0.00 C ATOM 1361 C ASN A 103 -5.368 7.005 6.700 1.00 0.00 C ATOM 1362 O ASN A 103 -5.631 6.879 5.499 1.00 0.00 O ATOM 1363 CB ASN A 103 -5.796 9.220 7.751 1.00 0.00 C ATOM 1364 CG ASN A 103 -5.230 10.498 8.341 1.00 0.00 C ATOM 1365 OD1 ASN A 103 -4.856 10.550 9.514 1.00 0.00 O ATOM 1366 ND2 ASN A 103 -5.178 11.544 7.534 1.00 0.00 N ATOM 0 H ASN A 103 -4.471 9.207 5.364 1.00 0.00 H new ATOM 0 HA ASN A 103 -4.039 8.025 8.042 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -6.478 9.473 6.939 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -6.383 8.705 8.511 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -4.818 12.435 7.876 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -5.497 11.460 6.569 1.00 0.00 H new ATOM 1373 N GLY A 104 -5.632 6.070 7.599 1.00 0.00 N ATOM 1374 CA GLY A 104 -6.255 4.824 7.211 1.00 0.00 C ATOM 1375 C GLY A 104 -5.923 3.702 8.167 1.00 0.00 C ATOM 1376 O GLY A 104 -5.616 3.956 9.334 1.00 0.00 O ATOM 0 H GLY A 104 -5.425 6.153 8.594 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -7.336 4.957 7.170 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -5.929 4.553 6.207 1.00 0.00 H new ATOM 1380 N PRO A 105 -5.983 2.446 7.704 1.00 0.00 N ATOM 1381 CA PRO A 105 -5.672 1.280 8.529 1.00 0.00 C ATOM 1382 C PRO A 105 -4.174 1.162 8.802 1.00 0.00 C ATOM 1383 O PRO A 105 -3.361 1.863 8.192 1.00 0.00 O ATOM 1384 CB PRO A 105 -6.160 0.086 7.688 1.00 0.00 C ATOM 1385 CG PRO A 105 -6.918 0.679 6.544 1.00 0.00 C ATOM 1386 CD PRO A 105 -6.356 2.054 6.342 1.00 0.00 C ATOM 0 HA PRO A 105 -6.146 1.338 9.509 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -5.321 -0.512 7.333 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -6.795 -0.575 8.278 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -6.802 0.074 5.644 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -7.985 0.722 6.764 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -5.496 2.047 5.672 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -7.091 2.734 5.911 1.00 0.00 H new ATOM 1394 N GLU A 106 -3.816 0.281 9.722 1.00 0.00 N ATOM 1395 CA GLU A 106 -2.419 0.068 10.069 1.00 0.00 C ATOM 1396 C GLU A 106 -1.731 -0.786 9.011 1.00 0.00 C ATOM 1397 O GLU A 106 -2.369 -1.629 8.373 1.00 0.00 O ATOM 1398 CB GLU A 106 -2.306 -0.591 11.442 1.00 0.00 C ATOM 1399 CG GLU A 106 -2.319 0.404 12.587 1.00 0.00 C ATOM 1400 CD GLU A 106 -2.406 -0.260 13.945 1.00 0.00 C ATOM 1401 OE1 GLU A 106 -1.512 -1.068 14.281 1.00 0.00 O ATOM 1402 OE2 GLU A 106 -3.367 0.027 14.692 1.00 0.00 O ATOM 0 H GLU A 106 -4.474 -0.299 10.243 1.00 0.00 H new ATOM 0 HA GLU A 106 -1.921 1.037 10.108 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -3.130 -1.292 11.570 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -1.384 -1.171 11.484 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -1.416 1.012 12.543 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -3.165 1.080 12.464 1.00 0.00 H new ATOM 1409 N GLY A 107 -0.436 -0.569 8.832 1.00 0.00 N ATOM 1410 CA GLY A 107 0.313 -1.314 7.839 1.00 0.00 C ATOM 1411 C GLY A 107 0.514 -2.767 8.218 1.00 0.00 C ATOM 1412 O GLY A 107 0.671 -3.098 9.398 1.00 0.00 O ATOM 0 H GLY A 107 0.112 0.112 9.358 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -0.209 -1.262 6.884 1.00 0.00 H new ATOM 0 HA3 GLY A 107 1.286 -0.843 7.697 1.00 0.00 H new ATOM 1416 N VAL A 108 0.503 -3.638 7.221 1.00 0.00 N ATOM 1417 CA VAL A 108 0.688 -5.064 7.441 1.00 0.00 C ATOM 1418 C VAL A 108 1.909 -5.554 6.669 1.00 0.00 C ATOM 1419 O VAL A 108 2.054 -5.277 5.476 1.00 0.00 O ATOM 1420 CB VAL A 108 -0.557 -5.871 7.010 1.00 0.00 C ATOM 1421 CG1 VAL A 108 -0.384 -7.341 7.351 1.00 0.00 C ATOM 1422 CG2 VAL A 108 -1.815 -5.320 7.670 1.00 0.00 C ATOM 0 H VAL A 108 0.367 -3.379 6.244 1.00 0.00 H new ATOM 0 HA VAL A 108 0.839 -5.220 8.509 1.00 0.00 H new ATOM 0 HB VAL A 108 -0.666 -5.774 5.930 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -1.271 -7.893 7.040 1.00 0.00 H new ATOM 0 HG12 VAL A 108 0.490 -7.735 6.831 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -0.247 -7.451 8.427 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -2.679 -5.904 7.352 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -1.714 -5.382 8.754 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -1.953 -4.279 7.378 1.00 0.00 H new ATOM 1432 N ALA A 109 2.788 -6.270 7.355 1.00 0.00 N ATOM 1433 CA ALA A 109 4.002 -6.781 6.737 1.00 0.00 C ATOM 1434 C ALA A 109 3.766 -8.130 6.072 1.00 0.00 C ATOM 1435 O ALA A 109 2.923 -8.915 6.514 1.00 0.00 O ATOM 1436 CB ALA A 109 5.110 -6.901 7.772 1.00 0.00 C ATOM 0 H ALA A 109 2.683 -6.510 8.341 1.00 0.00 H new ATOM 0 HA ALA A 109 4.303 -6.072 5.965 1.00 0.00 H new ATOM 0 HB1 ALA A 109 6.013 -7.284 7.296 1.00 0.00 H new ATOM 0 HB2 ALA A 109 5.315 -5.920 8.201 1.00 0.00 H new ATOM 0 HB3 ALA A 109 4.798 -7.584 8.562 1.00 0.00 H new ATOM 1442 N ILE A 110 4.515 -8.390 5.009 1.00 0.00 N ATOM 1443 CA ILE A 110 4.415 -9.642 4.278 1.00 0.00 C ATOM 1444 C ILE A 110 5.792 -10.289 4.194 1.00 0.00 C ATOM 1445 O ILE A 110 6.803 -9.636 4.457 1.00 0.00 O ATOM 1446 CB ILE A 110 3.849 -9.435 2.852 1.00 0.00 C ATOM 1447 CG1 ILE A 110 4.797 -8.575 2.009 1.00 0.00 C ATOM 1448 CG2 ILE A 110 2.465 -8.800 2.920 1.00 0.00 C ATOM 1449 CD1 ILE A 110 4.310 -8.349 0.596 1.00 0.00 C ATOM 0 H ILE A 110 5.206 -7.741 4.632 1.00 0.00 H new ATOM 0 HA ILE A 110 3.725 -10.291 4.816 1.00 0.00 H new ATOM 0 HB ILE A 110 3.761 -10.410 2.372 1.00 0.00 H new ATOM 0 HG12 ILE A 110 4.931 -7.610 2.498 1.00 0.00 H new ATOM 0 HG13 ILE A 110 5.776 -9.053 1.975 1.00 0.00 H new ATOM 0 HG21 ILE A 110 2.079 -8.660 1.910 1.00 0.00 H new ATOM 0 HG22 ILE A 110 1.793 -9.451 3.479 1.00 0.00 H new ATOM 0 HG23 ILE A 110 2.532 -7.834 3.420 1.00 0.00 H new ATOM 0 HD11 ILE A 110 5.030 -7.733 0.057 1.00 0.00 H new ATOM 0 HD12 ILE A 110 4.203 -9.309 0.090 1.00 0.00 H new ATOM 0 HD13 ILE A 110 3.345 -7.843 0.620 1.00 0.00 H new ATOM 1461 N SER A 111 5.840 -11.562 3.850 1.00 0.00 N ATOM 1462 CA SER A 111 7.108 -12.271 3.749 1.00 0.00 C ATOM 1463 C SER A 111 7.056 -13.324 2.649 1.00 0.00 C ATOM 1464 O SER A 111 6.036 -13.993 2.460 1.00 0.00 O ATOM 1465 CB SER A 111 7.462 -12.922 5.090 1.00 0.00 C ATOM 1466 OG SER A 111 7.547 -11.944 6.112 1.00 0.00 O ATOM 0 H SER A 111 5.019 -12.128 3.636 1.00 0.00 H new ATOM 0 HA SER A 111 7.882 -11.548 3.493 1.00 0.00 H new ATOM 0 HB2 SER A 111 6.707 -13.664 5.351 1.00 0.00 H new ATOM 0 HB3 SER A 111 8.412 -13.450 5.005 1.00 0.00 H new ATOM 0 HG SER A 111 7.772 -12.377 6.962 1.00 0.00 H new ATOM 1472 N PHE A 112 8.159 -13.456 1.922 1.00 0.00 N ATOM 1473 CA PHE A 112 8.257 -14.423 0.841 1.00 0.00 C ATOM 1474 C PHE A 112 8.647 -15.789 1.389 1.00 0.00 C ATOM 1475 O PHE A 112 9.072 -15.905 2.540 1.00 0.00 O ATOM 1476 CB PHE A 112 9.285 -13.964 -0.199 1.00 0.00 C ATOM 1477 CG PHE A 112 9.010 -12.591 -0.747 1.00 0.00 C ATOM 1478 CD1 PHE A 112 7.950 -12.371 -1.612 1.00 0.00 C ATOM 1479 CD2 PHE A 112 9.816 -11.519 -0.399 1.00 0.00 C ATOM 1480 CE1 PHE A 112 7.697 -11.108 -2.114 1.00 0.00 C ATOM 1481 CE2 PHE A 112 9.568 -10.256 -0.898 1.00 0.00 C ATOM 1482 CZ PHE A 112 8.508 -10.050 -1.758 1.00 0.00 C ATOM 0 H PHE A 112 9.002 -12.900 2.065 1.00 0.00 H new ATOM 0 HA PHE A 112 7.282 -14.500 0.359 1.00 0.00 H new ATOM 0 HB2 PHE A 112 10.277 -13.975 0.253 1.00 0.00 H new ATOM 0 HB3 PHE A 112 9.302 -14.679 -1.022 1.00 0.00 H new ATOM 0 HD1 PHE A 112 7.314 -13.196 -1.897 1.00 0.00 H new ATOM 0 HD2 PHE A 112 10.649 -11.673 0.271 1.00 0.00 H new ATOM 0 HE1 PHE A 112 6.865 -10.950 -2.784 1.00 0.00 H new ATOM 0 HE2 PHE A 112 10.203 -9.429 -0.616 1.00 0.00 H new ATOM 0 HZ PHE A 112 8.314 -9.063 -2.151 1.00 0.00 H new ATOM 1492 N ASN A 113 8.513 -16.817 0.568 1.00 0.00 N ATOM 1493 CA ASN A 113 8.851 -18.172 0.984 1.00 0.00 C ATOM 1494 C ASN A 113 10.183 -18.584 0.383 1.00 0.00 C ATOM 1495 O ASN A 113 10.855 -19.461 0.958 1.00 0.00 O ATOM 1496 CB ASN A 113 7.763 -19.164 0.565 1.00 0.00 C ATOM 1497 CG ASN A 113 7.830 -19.532 -0.908 1.00 0.00 C ATOM 1498 OD1 ASN A 113 8.501 -20.487 -1.293 1.00 0.00 O ATOM 1499 ND2 ASN A 113 7.127 -18.779 -1.737 1.00 0.00 N ATOM 1500 OXT ASN A 113 10.558 -18.017 -0.663 1.00 0.00 O ATOM 0 H ASN A 113 8.173 -16.741 -0.391 1.00 0.00 H new ATOM 0 HA ASN A 113 8.925 -18.184 2.071 1.00 0.00 H new ATOM 0 HB2 ASN A 113 7.854 -20.070 1.165 1.00 0.00 H new ATOM 0 HB3 ASN A 113 6.785 -18.735 0.783 1.00 0.00 H new ATOM 0 HD21 ASN A 113 7.129 -18.982 -2.737 1.00 0.00 H new ATOM 0 HD22 ASN A 113 6.583 -17.995 -1.377 1.00 0.00 H new TER 1507 ASN A 113 HETATM 1508 O1 FLN A 114 3.839 5.836 4.638 1.00 20.00 O HETATM 1509 C8A FLN A 114 4.544 6.981 4.304 1.00 20.00 C HETATM 1510 C4A FLN A 114 4.914 7.266 2.980 1.00 20.00 C HETATM 1511 C4 FLN A 114 4.540 6.296 1.907 1.00 20.00 C HETATM 1512 C3 FLN A 114 3.800 5.110 2.334 1.00 20.00 C HETATM 1513 C2 FLN A 114 3.484 4.921 3.648 1.00 20.00 C HETATM 1514 C1' FLN A 114 2.743 3.813 4.346 1.00 20.00 C HETATM 1515 C2' FLN A 114 1.374 3.922 4.598 1.00 20.00 C HETATM 1516 C3' FLN A 114 0.702 2.883 5.251 1.00 20.00 C HETATM 1517 C4' FLN A 114 1.346 1.710 5.677 1.00 20.00 C HETATM 1518 C5' FLN A 114 2.718 1.645 5.402 1.00 20.00 C HETATM 1519 C6' FLN A 114 3.412 2.663 4.755 1.00 20.00 C HETATM 1520 O4 FLN A 114 4.846 6.498 0.724 1.00 20.00 O HETATM 1521 C5 FLN A 114 5.635 8.456 2.709 1.00 20.00 C HETATM 1522 C6 FLN A 114 5.961 9.330 3.762 1.00 20.00 C HETATM 1523 C7 FLN A 114 5.569 9.009 5.080 1.00 20.00 C HETATM 1524 C8 FLN A 114 4.862 7.840 5.354 1.00 20.00 C HETATM 0 H8 FLN A 114 4.562 7.601 6.374 1.00 20.00 H new HETATM 0 H7 FLN A 114 5.823 9.686 5.896 1.00 20.00 H new HETATM 0 H6' FLN A 114 4.481 2.560 4.568 1.00 20.00 H new HETATM 0 H6 FLN A 114 6.512 10.249 3.562 1.00 20.00 H new HETATM 0 H5' FLN A 114 3.268 0.755 5.709 1.00 20.00 H new HETATM 0 H5 FLN A 114 5.936 8.693 1.688 1.00 20.00 H new HETATM 0 H4' FLN A 114 0.815 0.906 6.186 1.00 20.00 H new HETATM 0 H3' FLN A 114 -0.367 2.988 5.437 1.00 20.00 H new HETATM 0 H3 FLN A 114 3.497 4.368 1.595 1.00 20.00 H new HETATM 0 H2' FLN A 114 0.830 4.814 4.287 1.00 20.00 H new