USER MOD reduce.3.24.130724 H: found=0, std=0, add=996, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 993 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 82 CYS SG : rot 180:sc= 0.0568 USER MOD Set 1.2: A 100 HIS : no HD1:sc= 0 X(o=0.057,f=0.057) USER MOD Set 2.1: A 18 GLN : amide:sc= 2.53 K(o=4.5,f=-1.1) USER MOD Set 2.2: A 62 GLN : amide:sc= 0.267 K(o=4.5,f=3.1) USER MOD Set 2.3: A 64 SER OG : rot -129:sc= 1.7 USER MOD Set 3.1: A 10 CYS SG : rot 22:sc= -2.86 USER MOD Set 3.2: A 13 ASN : amide:sc= 0.394 K(o=-0.38,f=-5.4!) USER MOD Set 3.3: A 17 SER OG : rot -86:sc= 0.475 USER MOD Set 3.4: A 36 SER OG : rot -103:sc= 1.6 USER MOD Single : A 3 ASN : amide:sc= 0.0213 X(o=0.021,f=-0.069) USER MOD Single : A 4 LYS NZ :NH3+ -165:sc= 1.21 (180deg=1.06) USER MOD Single : A 7 TYR OH : rot 30:sc= 0.0854 USER MOD Single : A 11 THR OG1 : rot 180:sc= 1.25 USER MOD Single : A 14 SER OG : rot -63:sc= 1.27 USER MOD Single : A 15 CYS SG : rot 154:sc= -0.227 USER MOD Single : A 19 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 168:sc= 1.25 (180deg=1.13) USER MOD Single : A 26 GLN : amide:sc= 0.822 K(o=0.82,f=-0.032) USER MOD Single : A 27 TYR OH : rot 129:sc= 0.215 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HE2:sc= 0.866 K(o=0.87,f=-2.6!) USER MOD Single : A 45 ASN : amide:sc= 0.659 K(o=0.66,f=-7.5!) USER MOD Single : A 47 ASN : amide:sc=-0.00123 K(o=-0.0012,f=-0.86) USER MOD Single : A 50 LYS NZ :NH3+ 165:sc= 1.24 (180deg=1.16) USER MOD Single : A 52 MET CE :methyl -125:sc= -1.79 (180deg=-2.07) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 103:sc= 1.26 USER MOD Single : A 61 ASN : amide:sc= 1.24 K(o=1.2,f=-0.064) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0.0098 USER MOD Single : A 69 SER OG : rot 180:sc= 0.0138 USER MOD Single : A 73 ASN : amide:sc= 1.05 K(o=1,f=0) USER MOD Single : A 74 ASN : amide:sc= 0.376 K(o=0.38,f=-0.15) USER MOD Single : A 80 THR OG1 : rot 45:sc= 0.874 USER MOD Single : A 91 MET CE :methyl -167:sc= -0.0288 (180deg=-0.258) USER MOD Single : A 92 THR OG1 : rot 110:sc= 0.285 USER MOD Single : A 95 HIS : no HE2:sc= -0.283 X(o=-0.28,f=-0.56) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 GLN : amide:sc= 0.668 K(o=0.67,f=0) USER MOD Single : A 112 THR OG1 : rot 180:sc=-0.00452 USER MOD Single : A 116 LYS NZ :NH3+ -166:sc= 0.861 (180deg=0.701) USER MOD Single : A 121 GLN : amide:sc= -0.0712 X(o=-0.071,f=-0.19) USER MOD Single : A 129 ASN : amide:sc= 1.05 K(o=1.1,f=0) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot -23:sc= 1.27 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 35 N ASN A 3 5.822 4.080 -3.119 1.00 0.00 N ATOM 36 CA ASN A 3 6.100 4.180 -4.548 1.00 0.00 C ATOM 37 C ASN A 3 7.594 3.918 -4.711 1.00 0.00 C ATOM 38 O ASN A 3 8.393 4.436 -3.926 1.00 0.00 O ATOM 39 CB ASN A 3 5.732 5.579 -5.064 1.00 0.00 C ATOM 40 CG ASN A 3 5.589 5.613 -6.575 1.00 0.00 C ATOM 41 OD1 ASN A 3 4.482 5.569 -7.099 1.00 0.00 O ATOM 42 ND2 ASN A 3 6.682 5.706 -7.310 1.00 0.00 N ATOM 0 HA ASN A 3 5.513 3.463 -5.122 1.00 0.00 H new ATOM 0 HB2 ASN A 3 4.797 5.899 -4.605 1.00 0.00 H new ATOM 0 HB3 ASN A 3 6.498 6.291 -4.757 1.00 0.00 H new ATOM 0 HD21 ASN A 3 6.611 5.742 -8.327 1.00 0.00 H new ATOM 0 HD22 ASN A 3 7.597 5.742 -6.861 1.00 0.00 H new ATOM 49 N LYS A 4 7.977 3.097 -5.687 1.00 0.00 N ATOM 50 CA LYS A 4 9.371 2.705 -5.900 1.00 0.00 C ATOM 51 C LYS A 4 10.103 3.773 -6.708 1.00 0.00 C ATOM 52 O LYS A 4 9.518 4.817 -6.995 1.00 0.00 O ATOM 53 CB LYS A 4 9.404 1.306 -6.536 1.00 0.00 C ATOM 54 CG LYS A 4 8.860 0.254 -5.549 1.00 0.00 C ATOM 55 CD LYS A 4 9.107 -1.200 -5.972 1.00 0.00 C ATOM 56 CE LYS A 4 10.613 -1.450 -6.120 1.00 0.00 C ATOM 57 NZ LYS A 4 10.975 -2.881 -6.225 1.00 0.00 N ATOM 0 H LYS A 4 7.327 2.683 -6.356 1.00 0.00 H new ATOM 0 HA LYS A 4 9.907 2.637 -4.953 1.00 0.00 H new ATOM 0 HB2 LYS A 4 8.808 1.300 -7.449 1.00 0.00 H new ATOM 0 HB3 LYS A 4 10.425 1.053 -6.821 1.00 0.00 H new ATOM 0 HG2 LYS A 4 9.317 0.418 -4.573 1.00 0.00 H new ATOM 0 HG3 LYS A 4 7.788 0.407 -5.428 1.00 0.00 H new ATOM 0 HD2 LYS A 4 8.687 -1.880 -5.231 1.00 0.00 H new ATOM 0 HD3 LYS A 4 8.601 -1.405 -6.915 1.00 0.00 H new ATOM 0 HE2 LYS A 4 10.973 -0.928 -7.007 1.00 0.00 H new ATOM 0 HE3 LYS A 4 11.129 -1.016 -5.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 11.997 -2.993 -6.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 10.452 -3.425 -5.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 10.730 -3.232 -7.173 1.00 0.00 H new ATOM 71 N ILE A 5 11.362 3.536 -7.077 1.00 0.00 N ATOM 72 CA ILE A 5 12.223 4.447 -7.829 1.00 0.00 C ATOM 73 C ILE A 5 13.116 3.560 -8.708 1.00 0.00 C ATOM 74 O ILE A 5 13.531 2.496 -8.245 1.00 0.00 O ATOM 75 CB ILE A 5 13.098 5.292 -6.865 1.00 0.00 C ATOM 76 CG1 ILE A 5 12.362 5.974 -5.688 1.00 0.00 C ATOM 77 CG2 ILE A 5 13.882 6.371 -7.638 1.00 0.00 C ATOM 78 CD1 ILE A 5 12.323 5.095 -4.428 1.00 0.00 C ATOM 0 H ILE A 5 11.831 2.660 -6.848 1.00 0.00 H new ATOM 0 HA ILE A 5 11.633 5.143 -8.426 1.00 0.00 H new ATOM 0 HB ILE A 5 13.758 4.550 -6.415 1.00 0.00 H new ATOM 0 HG12 ILE A 5 12.855 6.917 -5.453 1.00 0.00 H new ATOM 0 HG13 ILE A 5 11.343 6.214 -5.991 1.00 0.00 H new ATOM 0 HG21 ILE A 5 14.488 6.950 -6.941 1.00 0.00 H new ATOM 0 HG22 ILE A 5 14.531 5.893 -8.372 1.00 0.00 H new ATOM 0 HG23 ILE A 5 13.183 7.034 -8.148 1.00 0.00 H new ATOM 0 HD11 ILE A 5 11.795 5.622 -3.633 1.00 0.00 H new ATOM 0 HD12 ILE A 5 11.805 4.162 -4.651 1.00 0.00 H new ATOM 0 HD13 ILE A 5 13.341 4.877 -4.105 1.00 0.00 H new ATOM 90 N ILE A 6 13.463 3.988 -9.924 1.00 0.00 N ATOM 91 CA ILE A 6 14.382 3.265 -10.810 1.00 0.00 C ATOM 92 C ILE A 6 15.139 4.273 -11.681 1.00 0.00 C ATOM 93 O ILE A 6 14.617 5.357 -11.957 1.00 0.00 O ATOM 94 CB ILE A 6 13.609 2.203 -11.632 1.00 0.00 C ATOM 95 CG1 ILE A 6 14.554 1.375 -12.534 1.00 0.00 C ATOM 96 CG2 ILE A 6 12.459 2.819 -12.452 1.00 0.00 C ATOM 97 CD1 ILE A 6 13.903 0.117 -13.114 1.00 0.00 C ATOM 0 H ILE A 6 13.110 4.856 -10.327 1.00 0.00 H new ATOM 0 HA ILE A 6 15.124 2.718 -10.228 1.00 0.00 H new ATOM 0 HB ILE A 6 13.159 1.523 -10.909 1.00 0.00 H new ATOM 0 HG12 ILE A 6 14.903 2.003 -13.353 1.00 0.00 H new ATOM 0 HG13 ILE A 6 15.432 1.086 -11.957 1.00 0.00 H new ATOM 0 HG21 ILE A 6 11.949 2.034 -13.010 1.00 0.00 H new ATOM 0 HG22 ILE A 6 11.752 3.304 -11.779 1.00 0.00 H new ATOM 0 HG23 ILE A 6 12.862 3.555 -13.148 1.00 0.00 H new ATOM 0 HD11 ILE A 6 14.625 -0.413 -13.736 1.00 0.00 H new ATOM 0 HD12 ILE A 6 13.578 -0.533 -12.301 1.00 0.00 H new ATOM 0 HD13 ILE A 6 13.041 0.399 -13.719 1.00 0.00 H new ATOM 109 N TYR A 7 16.351 3.922 -12.124 1.00 0.00 N ATOM 110 CA TYR A 7 17.236 4.813 -12.865 1.00 0.00 C ATOM 111 C TYR A 7 17.866 4.042 -14.028 1.00 0.00 C ATOM 112 O TYR A 7 18.308 2.905 -13.844 1.00 0.00 O ATOM 113 CB TYR A 7 18.305 5.333 -11.883 1.00 0.00 C ATOM 114 CG TYR A 7 18.955 6.690 -12.109 1.00 0.00 C ATOM 115 CD1 TYR A 7 18.447 7.642 -13.019 1.00 0.00 C ATOM 116 CD2 TYR A 7 20.022 7.051 -11.262 1.00 0.00 C ATOM 117 CE1 TYR A 7 18.953 8.953 -13.033 1.00 0.00 C ATOM 118 CE2 TYR A 7 20.550 8.354 -11.289 1.00 0.00 C ATOM 119 CZ TYR A 7 19.999 9.319 -12.156 1.00 0.00 C ATOM 120 OH TYR A 7 20.458 10.600 -12.106 1.00 0.00 O ATOM 0 H TYR A 7 16.747 2.994 -11.973 1.00 0.00 H new ATOM 0 HA TYR A 7 16.694 5.660 -13.285 1.00 0.00 H new ATOM 0 HB2 TYR A 7 17.852 5.353 -10.892 1.00 0.00 H new ATOM 0 HB3 TYR A 7 19.104 4.592 -11.853 1.00 0.00 H new ATOM 0 HD1 TYR A 7 17.665 7.361 -13.709 1.00 0.00 H new ATOM 0 HD2 TYR A 7 20.438 6.319 -10.585 1.00 0.00 H new ATOM 0 HE1 TYR A 7 18.542 9.682 -13.715 1.00 0.00 H new ATOM 0 HE2 TYR A 7 21.377 8.615 -10.646 1.00 0.00 H new ATOM 0 HH TYR A 7 19.730 11.217 -12.328 1.00 0.00 H new ATOM 130 N PHE A 8 17.944 4.665 -15.204 1.00 0.00 N ATOM 131 CA PHE A 8 18.535 4.092 -16.417 1.00 0.00 C ATOM 132 C PHE A 8 19.666 5.014 -16.862 1.00 0.00 C ATOM 133 O PHE A 8 19.435 6.206 -17.060 1.00 0.00 O ATOM 134 CB PHE A 8 17.473 3.957 -17.522 1.00 0.00 C ATOM 135 CG PHE A 8 16.311 3.039 -17.182 1.00 0.00 C ATOM 136 CD1 PHE A 8 16.463 1.641 -17.262 1.00 0.00 C ATOM 137 CD2 PHE A 8 15.070 3.577 -16.794 1.00 0.00 C ATOM 138 CE1 PHE A 8 15.400 0.787 -16.928 1.00 0.00 C ATOM 139 CE2 PHE A 8 14.005 2.721 -16.470 1.00 0.00 C ATOM 140 CZ PHE A 8 14.173 1.328 -16.516 1.00 0.00 C ATOM 0 H PHE A 8 17.588 5.610 -15.345 1.00 0.00 H new ATOM 0 HA PHE A 8 18.922 3.093 -16.216 1.00 0.00 H new ATOM 0 HB2 PHE A 8 17.080 4.947 -17.751 1.00 0.00 H new ATOM 0 HB3 PHE A 8 17.956 3.588 -18.427 1.00 0.00 H new ATOM 0 HD1 PHE A 8 17.405 1.222 -17.583 1.00 0.00 H new ATOM 0 HD2 PHE A 8 14.937 4.648 -16.745 1.00 0.00 H new ATOM 0 HE1 PHE A 8 15.527 -0.284 -16.988 1.00 0.00 H new ATOM 0 HE2 PHE A 8 13.050 3.137 -16.184 1.00 0.00 H new ATOM 0 HZ PHE A 8 13.360 0.675 -16.235 1.00 0.00 H new ATOM 150 N LEU A 9 20.876 4.484 -17.030 1.00 0.00 N ATOM 151 CA LEU A 9 22.104 5.250 -17.235 1.00 0.00 C ATOM 152 C LEU A 9 22.745 4.850 -18.560 1.00 0.00 C ATOM 153 O LEU A 9 22.773 3.664 -18.900 1.00 0.00 O ATOM 154 CB LEU A 9 23.079 4.971 -16.073 1.00 0.00 C ATOM 155 CG LEU A 9 22.999 5.955 -14.889 1.00 0.00 C ATOM 156 CD1 LEU A 9 21.589 6.168 -14.335 1.00 0.00 C ATOM 157 CD2 LEU A 9 23.895 5.454 -13.753 1.00 0.00 C ATOM 0 H LEU A 9 21.034 3.476 -17.027 1.00 0.00 H new ATOM 0 HA LEU A 9 21.870 6.314 -17.262 1.00 0.00 H new ATOM 0 HB2 LEU A 9 22.893 3.964 -15.699 1.00 0.00 H new ATOM 0 HB3 LEU A 9 24.096 4.983 -16.464 1.00 0.00 H new ATOM 0 HG LEU A 9 23.330 6.917 -15.280 1.00 0.00 H new ATOM 0 HD11 LEU A 9 21.627 6.874 -13.506 1.00 0.00 H new ATOM 0 HD12 LEU A 9 20.946 6.565 -15.120 1.00 0.00 H new ATOM 0 HD13 LEU A 9 21.189 5.217 -13.984 1.00 0.00 H new ATOM 0 HD21 LEU A 9 23.841 6.148 -12.914 1.00 0.00 H new ATOM 0 HD22 LEU A 9 23.558 4.469 -13.431 1.00 0.00 H new ATOM 0 HD23 LEU A 9 24.925 5.389 -14.104 1.00 0.00 H new ATOM 169 N CYS A 10 23.296 5.821 -19.293 1.00 0.00 N ATOM 170 CA CYS A 10 23.976 5.600 -20.570 1.00 0.00 C ATOM 171 C CYS A 10 25.211 6.473 -20.717 1.00 0.00 C ATOM 172 O CYS A 10 25.418 7.447 -19.994 1.00 0.00 O ATOM 173 CB CYS A 10 23.024 5.924 -21.729 1.00 0.00 C ATOM 174 SG CYS A 10 21.808 4.608 -21.869 1.00 0.00 S ATOM 0 H CYS A 10 23.281 6.801 -19.009 1.00 0.00 H new ATOM 0 HA CYS A 10 24.280 4.554 -20.593 1.00 0.00 H new ATOM 0 HB2 CYS A 10 22.528 6.879 -21.554 1.00 0.00 H new ATOM 0 HB3 CYS A 10 23.583 6.021 -22.660 1.00 0.00 H new ATOM 0 HG CYS A 10 21.725 3.972 -20.738 1.00 0.00 H new ATOM 180 N THR A 11 25.982 6.183 -21.756 1.00 0.00 N ATOM 181 CA THR A 11 27.099 6.968 -22.255 1.00 0.00 C ATOM 182 C THR A 11 26.590 8.205 -23.037 1.00 0.00 C ATOM 183 O THR A 11 27.145 8.578 -24.073 1.00 0.00 O ATOM 184 CB THR A 11 27.972 6.003 -23.077 1.00 0.00 C ATOM 185 OG1 THR A 11 27.171 5.300 -24.012 1.00 0.00 O ATOM 186 CG2 THR A 11 28.605 4.931 -22.188 1.00 0.00 C ATOM 0 H THR A 11 25.833 5.338 -22.307 1.00 0.00 H new ATOM 0 HA THR A 11 27.708 7.392 -21.456 1.00 0.00 H new ATOM 0 HB THR A 11 28.737 6.609 -23.562 1.00 0.00 H new ATOM 0 HG1 THR A 11 27.735 4.690 -24.532 1.00 0.00 H new ATOM 0 HG21 THR A 11 29.215 4.266 -22.799 1.00 0.00 H new ATOM 0 HG22 THR A 11 29.231 5.407 -21.434 1.00 0.00 H new ATOM 0 HG23 THR A 11 27.820 4.355 -21.697 1.00 0.00 H new ATOM 194 N GLY A 12 25.472 8.790 -22.592 1.00 0.00 N ATOM 195 CA GLY A 12 24.735 9.867 -23.240 1.00 0.00 C ATOM 196 C GLY A 12 23.243 9.643 -23.010 1.00 0.00 C ATOM 197 O GLY A 12 22.684 8.677 -23.531 1.00 0.00 O ATOM 0 H GLY A 12 25.036 8.502 -21.716 1.00 0.00 H new ATOM 0 HA2 GLY A 12 25.040 10.832 -22.834 1.00 0.00 H new ATOM 0 HA3 GLY A 12 24.954 9.887 -24.307 1.00 0.00 H new ATOM 201 N ASN A 13 22.598 10.491 -22.202 1.00 0.00 N ATOM 202 CA ASN A 13 21.176 10.386 -21.847 1.00 0.00 C ATOM 203 C ASN A 13 20.269 10.842 -22.998 1.00 0.00 C ATOM 204 O ASN A 13 19.474 11.766 -22.832 1.00 0.00 O ATOM 205 CB ASN A 13 20.887 11.202 -20.575 1.00 0.00 C ATOM 206 CG ASN A 13 19.466 11.013 -20.019 1.00 0.00 C ATOM 207 OD1 ASN A 13 18.901 11.950 -19.468 1.00 0.00 O ATOM 208 ND2 ASN A 13 18.849 9.840 -20.098 1.00 0.00 N ATOM 0 H ASN A 13 23.060 11.289 -21.766 1.00 0.00 H new ATOM 0 HA ASN A 13 20.955 9.336 -21.654 1.00 0.00 H new ATOM 0 HB2 ASN A 13 21.607 10.923 -19.806 1.00 0.00 H new ATOM 0 HB3 ASN A 13 21.044 12.259 -20.790 1.00 0.00 H new ATOM 0 HD21 ASN A 13 17.916 9.727 -19.703 1.00 0.00 H new ATOM 0 HD22 ASN A 13 19.308 9.052 -20.554 1.00 0.00 H new ATOM 215 N SER A 14 20.402 10.244 -24.179 1.00 0.00 N ATOM 216 CA SER A 14 19.745 10.755 -25.381 1.00 0.00 C ATOM 217 C SER A 14 18.969 9.693 -26.151 1.00 0.00 C ATOM 218 O SER A 14 18.092 10.063 -26.934 1.00 0.00 O ATOM 219 CB SER A 14 20.790 11.440 -26.272 1.00 0.00 C ATOM 220 OG SER A 14 21.385 12.529 -25.588 1.00 0.00 O ATOM 0 H SER A 14 20.960 9.403 -24.330 1.00 0.00 H new ATOM 0 HA SER A 14 18.995 11.479 -25.063 1.00 0.00 H new ATOM 0 HB2 SER A 14 21.557 10.722 -26.562 1.00 0.00 H new ATOM 0 HB3 SER A 14 20.320 11.792 -27.190 1.00 0.00 H new ATOM 0 HG SER A 14 20.702 13.203 -25.389 1.00 0.00 H new ATOM 226 N CYS A 15 19.233 8.402 -25.920 1.00 0.00 N ATOM 227 CA CYS A 15 18.679 7.337 -26.747 1.00 0.00 C ATOM 228 C CYS A 15 18.205 6.196 -25.846 1.00 0.00 C ATOM 229 O CYS A 15 17.053 6.190 -25.423 1.00 0.00 O ATOM 230 CB CYS A 15 19.722 6.881 -27.788 1.00 0.00 C ATOM 231 SG CYS A 15 20.440 8.256 -28.727 1.00 0.00 S ATOM 0 H CYS A 15 19.831 8.074 -25.162 1.00 0.00 H new ATOM 0 HA CYS A 15 17.815 7.697 -27.305 1.00 0.00 H new ATOM 0 HB2 CYS A 15 20.520 6.340 -27.280 1.00 0.00 H new ATOM 0 HB3 CYS A 15 19.253 6.182 -28.481 1.00 0.00 H new ATOM 0 HG CYS A 15 21.626 7.924 -29.144 1.00 0.00 H new ATOM 237 N ARG A 16 19.092 5.253 -25.512 1.00 0.00 N ATOM 238 CA ARG A 16 18.738 4.007 -24.829 1.00 0.00 C ATOM 239 C ARG A 16 18.030 4.287 -23.503 1.00 0.00 C ATOM 240 O ARG A 16 16.928 3.786 -23.294 1.00 0.00 O ATOM 241 CB ARG A 16 20.016 3.187 -24.595 1.00 0.00 C ATOM 242 CG ARG A 16 20.622 2.526 -25.841 1.00 0.00 C ATOM 243 CD ARG A 16 22.101 2.190 -25.591 1.00 0.00 C ATOM 244 NE ARG A 16 22.895 3.428 -25.542 1.00 0.00 N ATOM 245 CZ ARG A 16 24.125 3.607 -25.061 1.00 0.00 C ATOM 246 NH1 ARG A 16 24.812 2.624 -24.495 1.00 0.00 N ATOM 247 NH2 ARG A 16 24.655 4.812 -25.195 1.00 0.00 N ATOM 0 H ARG A 16 20.089 5.336 -25.712 1.00 0.00 H new ATOM 0 HA ARG A 16 18.048 3.441 -25.455 1.00 0.00 H new ATOM 0 HB2 ARG A 16 20.768 3.839 -24.151 1.00 0.00 H new ATOM 0 HB3 ARG A 16 19.797 2.409 -23.864 1.00 0.00 H new ATOM 0 HG2 ARG A 16 20.071 1.618 -26.086 1.00 0.00 H new ATOM 0 HG3 ARG A 16 20.532 3.194 -26.697 1.00 0.00 H new ATOM 0 HD2 ARG A 16 22.205 1.644 -24.654 1.00 0.00 H new ATOM 0 HD3 ARG A 16 22.474 1.540 -26.382 1.00 0.00 H new ATOM 0 HE ARG A 16 22.445 4.258 -25.927 1.00 0.00 H new ATOM 0 HH11 ARG A 16 24.401 1.694 -24.417 1.00 0.00 H new ATOM 0 HH12 ARG A 16 25.751 2.798 -24.138 1.00 0.00 H new ATOM 0 HH21 ARG A 16 24.125 5.555 -25.650 1.00 0.00 H new ATOM 0 HH22 ARG A 16 25.594 4.998 -24.843 1.00 0.00 H new ATOM 261 N SER A 17 18.628 5.090 -22.620 1.00 0.00 N ATOM 262 CA SER A 17 18.067 5.332 -21.292 1.00 0.00 C ATOM 263 C SER A 17 16.752 6.113 -21.371 1.00 0.00 C ATOM 264 O SER A 17 15.832 5.839 -20.602 1.00 0.00 O ATOM 265 CB SER A 17 19.111 6.032 -20.419 1.00 0.00 C ATOM 266 OG SER A 17 19.719 7.128 -21.095 1.00 0.00 O ATOM 0 H SER A 17 19.502 5.584 -22.803 1.00 0.00 H new ATOM 0 HA SER A 17 17.820 4.377 -20.828 1.00 0.00 H new ATOM 0 HB2 SER A 17 18.639 6.387 -19.503 1.00 0.00 H new ATOM 0 HB3 SER A 17 19.878 5.316 -20.125 1.00 0.00 H new ATOM 0 HG SER A 17 20.471 6.804 -21.634 1.00 0.00 H new ATOM 272 N GLN A 18 16.647 7.040 -22.329 1.00 0.00 N ATOM 273 CA GLN A 18 15.440 7.811 -22.592 1.00 0.00 C ATOM 274 C GLN A 18 14.283 6.878 -22.969 1.00 0.00 C ATOM 275 O GLN A 18 13.240 6.869 -22.311 1.00 0.00 O ATOM 276 CB GLN A 18 15.749 8.842 -23.702 1.00 0.00 C ATOM 277 CG GLN A 18 16.272 10.174 -23.142 1.00 0.00 C ATOM 278 CD GLN A 18 15.177 10.980 -22.437 1.00 0.00 C ATOM 279 OE1 GLN A 18 14.003 10.620 -22.449 1.00 0.00 O ATOM 280 NE2 GLN A 18 15.512 12.088 -21.809 1.00 0.00 N ATOM 0 H GLN A 18 17.418 7.276 -22.953 1.00 0.00 H new ATOM 0 HA GLN A 18 15.127 8.349 -21.697 1.00 0.00 H new ATOM 0 HB2 GLN A 18 16.488 8.424 -24.385 1.00 0.00 H new ATOM 0 HB3 GLN A 18 14.846 9.026 -24.283 1.00 0.00 H new ATOM 0 HG2 GLN A 18 17.083 9.977 -22.441 1.00 0.00 H new ATOM 0 HG3 GLN A 18 16.690 10.768 -23.955 1.00 0.00 H new ATOM 0 HE21 GLN A 18 16.485 12.392 -21.796 1.00 0.00 H new ATOM 0 HE22 GLN A 18 14.798 12.642 -21.336 1.00 0.00 H new ATOM 289 N MET A 19 14.492 6.056 -23.997 1.00 0.00 N ATOM 290 CA MET A 19 13.522 5.056 -24.441 1.00 0.00 C ATOM 291 C MET A 19 13.166 4.084 -23.307 1.00 0.00 C ATOM 292 O MET A 19 11.985 3.794 -23.110 1.00 0.00 O ATOM 293 CB MET A 19 14.046 4.292 -25.673 1.00 0.00 C ATOM 294 CG MET A 19 14.233 5.197 -26.902 1.00 0.00 C ATOM 295 SD MET A 19 14.306 4.347 -28.500 1.00 0.00 S ATOM 296 CE MET A 19 15.780 3.312 -28.296 1.00 0.00 C ATOM 0 H MET A 19 15.349 6.066 -24.551 1.00 0.00 H new ATOM 0 HA MET A 19 12.611 5.581 -24.728 1.00 0.00 H new ATOM 0 HB2 MET A 19 14.998 3.822 -25.425 1.00 0.00 H new ATOM 0 HB3 MET A 19 13.350 3.490 -25.921 1.00 0.00 H new ATOM 0 HG2 MET A 19 13.413 5.914 -26.930 1.00 0.00 H new ATOM 0 HG3 MET A 19 15.152 5.768 -26.773 1.00 0.00 H new ATOM 0 HE1 MET A 19 15.946 2.733 -29.204 1.00 0.00 H new ATOM 0 HE2 MET A 19 16.646 3.946 -28.106 1.00 0.00 H new ATOM 0 HE3 MET A 19 15.635 2.634 -27.455 1.00 0.00 H new ATOM 306 N ALA A 20 14.155 3.600 -22.544 1.00 0.00 N ATOM 307 CA ALA A 20 13.925 2.656 -21.453 1.00 0.00 C ATOM 308 C ALA A 20 13.025 3.253 -20.381 1.00 0.00 C ATOM 309 O ALA A 20 12.079 2.594 -19.959 1.00 0.00 O ATOM 310 CB ALA A 20 15.257 2.203 -20.849 1.00 0.00 C ATOM 0 H ALA A 20 15.135 3.854 -22.669 1.00 0.00 H new ATOM 0 HA ALA A 20 13.414 1.786 -21.866 1.00 0.00 H new ATOM 0 HB1 ALA A 20 15.068 1.500 -20.038 1.00 0.00 H new ATOM 0 HB2 ALA A 20 15.858 1.717 -21.617 1.00 0.00 H new ATOM 0 HB3 ALA A 20 15.794 3.069 -20.461 1.00 0.00 H new ATOM 316 N GLU A 21 13.275 4.501 -19.983 1.00 0.00 N ATOM 317 CA GLU A 21 12.407 5.218 -19.057 1.00 0.00 C ATOM 318 C GLU A 21 10.968 5.288 -19.604 1.00 0.00 C ATOM 319 O GLU A 21 10.020 5.067 -18.849 1.00 0.00 O ATOM 320 CB GLU A 21 12.999 6.608 -18.775 1.00 0.00 C ATOM 321 CG GLU A 21 12.287 7.349 -17.632 1.00 0.00 C ATOM 322 CD GLU A 21 12.654 8.840 -17.501 1.00 0.00 C ATOM 323 OE1 GLU A 21 13.742 9.256 -17.954 1.00 0.00 O ATOM 324 OE2 GLU A 21 11.873 9.590 -16.872 1.00 0.00 O ATOM 0 H GLU A 21 14.083 5.039 -20.294 1.00 0.00 H new ATOM 0 HA GLU A 21 12.352 4.681 -18.110 1.00 0.00 H new ATOM 0 HB2 GLU A 21 14.055 6.503 -18.528 1.00 0.00 H new ATOM 0 HB3 GLU A 21 12.942 7.211 -19.681 1.00 0.00 H new ATOM 0 HG2 GLU A 21 11.210 7.266 -17.779 1.00 0.00 H new ATOM 0 HG3 GLU A 21 12.520 6.848 -16.692 1.00 0.00 H new ATOM 331 N GLY A 22 10.791 5.520 -20.911 1.00 0.00 N ATOM 332 CA GLY A 22 9.485 5.571 -21.554 1.00 0.00 C ATOM 333 C GLY A 22 8.737 4.253 -21.434 1.00 0.00 C ATOM 334 O GLY A 22 7.583 4.245 -20.998 1.00 0.00 O ATOM 0 H GLY A 22 11.566 5.679 -21.555 1.00 0.00 H new ATOM 0 HA2 GLY A 22 8.891 6.367 -21.105 1.00 0.00 H new ATOM 0 HA3 GLY A 22 9.609 5.822 -22.607 1.00 0.00 H new ATOM 338 N TRP A 23 9.388 3.140 -21.784 1.00 0.00 N ATOM 339 CA TRP A 23 8.795 1.812 -21.652 1.00 0.00 C ATOM 340 C TRP A 23 8.491 1.504 -20.191 1.00 0.00 C ATOM 341 O TRP A 23 7.406 1.017 -19.871 1.00 0.00 O ATOM 342 CB TRP A 23 9.740 0.750 -22.225 1.00 0.00 C ATOM 343 CG TRP A 23 9.774 0.676 -23.717 1.00 0.00 C ATOM 344 CD1 TRP A 23 10.783 1.092 -24.513 1.00 0.00 C ATOM 345 CD2 TRP A 23 8.759 0.135 -24.616 1.00 0.00 C ATOM 346 NE1 TRP A 23 10.465 0.849 -25.832 1.00 0.00 N ATOM 347 CE2 TRP A 23 9.233 0.241 -25.957 1.00 0.00 C ATOM 348 CE3 TRP A 23 7.481 -0.433 -24.428 1.00 0.00 C ATOM 349 CZ2 TRP A 23 8.478 -0.209 -27.053 1.00 0.00 C ATOM 350 CZ3 TRP A 23 6.734 -0.922 -25.514 1.00 0.00 C ATOM 351 CH2 TRP A 23 7.235 -0.823 -26.823 1.00 0.00 C ATOM 0 H TRP A 23 10.335 3.137 -22.164 1.00 0.00 H new ATOM 0 HA TRP A 23 7.861 1.796 -22.213 1.00 0.00 H new ATOM 0 HB2 TRP A 23 10.749 0.949 -21.863 1.00 0.00 H new ATOM 0 HB3 TRP A 23 9.447 -0.225 -21.834 1.00 0.00 H new ATOM 0 HD1 TRP A 23 11.700 1.546 -24.168 1.00 0.00 H new ATOM 0 HE1 TRP A 23 11.067 1.089 -26.619 1.00 0.00 H new ATOM 0 HE3 TRP A 23 7.069 -0.493 -23.431 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 8.848 -0.085 -28.060 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 5.770 -1.376 -25.341 1.00 0.00 H new ATOM 0 HH2 TRP A 23 6.666 -1.218 -27.651 1.00 0.00 H new ATOM 362 N ALA A 24 9.439 1.800 -19.302 1.00 0.00 N ATOM 363 CA ALA A 24 9.329 1.504 -17.888 1.00 0.00 C ATOM 364 C ALA A 24 8.132 2.222 -17.286 1.00 0.00 C ATOM 365 O ALA A 24 7.362 1.591 -16.572 1.00 0.00 O ATOM 366 CB ALA A 24 10.633 1.884 -17.189 1.00 0.00 C ATOM 0 H ALA A 24 10.314 2.259 -19.555 1.00 0.00 H new ATOM 0 HA ALA A 24 9.165 0.436 -17.747 1.00 0.00 H new ATOM 0 HB1 ALA A 24 10.553 1.662 -16.125 1.00 0.00 H new ATOM 0 HB2 ALA A 24 11.456 1.312 -17.618 1.00 0.00 H new ATOM 0 HB3 ALA A 24 10.822 2.949 -17.325 1.00 0.00 H new ATOM 372 N LYS A 25 7.912 3.497 -17.619 1.00 0.00 N ATOM 373 CA LYS A 25 6.755 4.240 -17.126 1.00 0.00 C ATOM 374 C LYS A 25 5.449 3.514 -17.442 1.00 0.00 C ATOM 375 O LYS A 25 4.546 3.520 -16.604 1.00 0.00 O ATOM 376 CB LYS A 25 6.800 5.672 -17.686 1.00 0.00 C ATOM 377 CG LYS A 25 5.841 6.625 -16.956 1.00 0.00 C ATOM 378 CD LYS A 25 5.972 8.045 -17.526 1.00 0.00 C ATOM 379 CE LYS A 25 5.053 9.060 -16.828 1.00 0.00 C ATOM 380 NZ LYS A 25 5.486 9.389 -15.446 1.00 0.00 N ATOM 0 H LYS A 25 8.525 4.036 -18.231 1.00 0.00 H new ATOM 0 HA LYS A 25 6.795 4.304 -16.039 1.00 0.00 H new ATOM 0 HB2 LYS A 25 7.817 6.056 -17.608 1.00 0.00 H new ATOM 0 HB3 LYS A 25 6.548 5.651 -18.746 1.00 0.00 H new ATOM 0 HG2 LYS A 25 4.815 6.274 -17.065 1.00 0.00 H new ATOM 0 HG3 LYS A 25 6.064 6.631 -15.889 1.00 0.00 H new ATOM 0 HD2 LYS A 25 7.007 8.375 -17.431 1.00 0.00 H new ATOM 0 HD3 LYS A 25 5.740 8.026 -18.591 1.00 0.00 H new ATOM 0 HE2 LYS A 25 5.019 9.975 -17.419 1.00 0.00 H new ATOM 0 HE3 LYS A 25 4.039 8.662 -16.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 4.957 10.217 -15.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 5.301 8.578 -14.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 6.504 9.603 -15.443 1.00 0.00 H new ATOM 394 N GLN A 26 5.361 2.854 -18.602 1.00 0.00 N ATOM 395 CA GLN A 26 4.178 2.081 -18.957 1.00 0.00 C ATOM 396 C GLN A 26 4.076 0.819 -18.098 1.00 0.00 C ATOM 397 O GLN A 26 3.115 0.658 -17.345 1.00 0.00 O ATOM 398 CB GLN A 26 4.116 1.713 -20.454 1.00 0.00 C ATOM 399 CG GLN A 26 4.507 2.810 -21.451 1.00 0.00 C ATOM 400 CD GLN A 26 3.965 4.202 -21.121 1.00 0.00 C ATOM 401 OE1 GLN A 26 2.761 4.413 -21.005 1.00 0.00 O ATOM 402 NE2 GLN A 26 4.845 5.178 -20.964 1.00 0.00 N ATOM 0 H GLN A 26 6.098 2.843 -19.307 1.00 0.00 H new ATOM 0 HA GLN A 26 3.323 2.727 -18.757 1.00 0.00 H new ATOM 0 HB2 GLN A 26 4.767 0.855 -20.620 1.00 0.00 H new ATOM 0 HB3 GLN A 26 3.100 1.392 -20.683 1.00 0.00 H new ATOM 0 HG2 GLN A 26 5.594 2.862 -21.504 1.00 0.00 H new ATOM 0 HG3 GLN A 26 4.153 2.524 -22.441 1.00 0.00 H new ATOM 0 HE21 GLN A 26 5.842 4.987 -21.064 1.00 0.00 H new ATOM 0 HE22 GLN A 26 4.526 6.121 -20.743 1.00 0.00 H new ATOM 411 N TYR A 27 5.061 -0.077 -18.203 1.00 0.00 N ATOM 412 CA TYR A 27 4.971 -1.412 -17.608 1.00 0.00 C ATOM 413 C TYR A 27 4.965 -1.361 -16.080 1.00 0.00 C ATOM 414 O TYR A 27 4.229 -2.109 -15.438 1.00 0.00 O ATOM 415 CB TYR A 27 6.125 -2.299 -18.084 1.00 0.00 C ATOM 416 CG TYR A 27 6.114 -2.638 -19.561 1.00 0.00 C ATOM 417 CD1 TYR A 27 5.085 -3.434 -20.101 1.00 0.00 C ATOM 418 CD2 TYR A 27 7.169 -2.208 -20.383 1.00 0.00 C ATOM 419 CE1 TYR A 27 5.112 -3.795 -21.460 1.00 0.00 C ATOM 420 CE2 TYR A 27 7.234 -2.612 -21.726 1.00 0.00 C ATOM 421 CZ TYR A 27 6.193 -3.394 -22.278 1.00 0.00 C ATOM 422 OH TYR A 27 6.224 -3.784 -23.584 1.00 0.00 O ATOM 0 H TYR A 27 5.935 0.100 -18.698 1.00 0.00 H new ATOM 0 HA TYR A 27 4.024 -1.839 -17.938 1.00 0.00 H new ATOM 0 HB2 TYR A 27 7.065 -1.800 -17.849 1.00 0.00 H new ATOM 0 HB3 TYR A 27 6.106 -3.228 -17.515 1.00 0.00 H new ATOM 0 HD1 TYR A 27 4.274 -3.768 -19.470 1.00 0.00 H new ATOM 0 HD2 TYR A 27 7.935 -1.563 -19.979 1.00 0.00 H new ATOM 0 HE1 TYR A 27 4.306 -4.379 -21.879 1.00 0.00 H new ATOM 0 HE2 TYR A 27 8.078 -2.326 -22.337 1.00 0.00 H new ATOM 0 HH TYR A 27 6.365 -3.001 -24.156 1.00 0.00 H new ATOM 432 N LEU A 28 5.765 -0.464 -15.498 1.00 0.00 N ATOM 433 CA LEU A 28 5.837 -0.245 -14.053 1.00 0.00 C ATOM 434 C LEU A 28 4.625 0.542 -13.522 1.00 0.00 C ATOM 435 O LEU A 28 4.557 0.828 -12.327 1.00 0.00 O ATOM 436 CB LEU A 28 7.158 0.458 -13.691 1.00 0.00 C ATOM 437 CG LEU A 28 8.446 -0.258 -14.153 1.00 0.00 C ATOM 438 CD1 LEU A 28 9.668 0.541 -13.694 1.00 0.00 C ATOM 439 CD2 LEU A 28 8.562 -1.697 -13.635 1.00 0.00 C ATOM 0 H LEU A 28 6.392 0.141 -16.028 1.00 0.00 H new ATOM 0 HA LEU A 28 5.811 -1.220 -13.567 1.00 0.00 H new ATOM 0 HB2 LEU A 28 7.146 1.459 -14.123 1.00 0.00 H new ATOM 0 HB3 LEU A 28 7.199 0.578 -12.608 1.00 0.00 H new ATOM 0 HG LEU A 28 8.399 -0.313 -15.241 1.00 0.00 H new ATOM 0 HD11 LEU A 28 10.577 0.035 -14.020 1.00 0.00 H new ATOM 0 HD12 LEU A 28 9.633 1.540 -14.128 1.00 0.00 H new ATOM 0 HD13 LEU A 28 9.666 0.617 -12.607 1.00 0.00 H new ATOM 0 HD21 LEU A 28 9.490 -2.140 -13.997 1.00 0.00 H new ATOM 0 HD22 LEU A 28 8.563 -1.692 -12.545 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.716 -2.282 -13.994 1.00 0.00 H new ATOM 451 N GLY A 29 3.673 0.908 -14.389 1.00 0.00 N ATOM 452 CA GLY A 29 2.388 1.498 -14.029 1.00 0.00 C ATOM 453 C GLY A 29 2.511 2.855 -13.339 1.00 0.00 C ATOM 454 O GLY A 29 1.604 3.253 -12.608 1.00 0.00 O ATOM 0 H GLY A 29 3.786 0.795 -15.396 1.00 0.00 H new ATOM 0 HA2 GLY A 29 1.784 1.611 -14.929 1.00 0.00 H new ATOM 0 HA3 GLY A 29 1.854 0.812 -13.371 1.00 0.00 H new ATOM 458 N ASP A 30 3.641 3.541 -13.541 1.00 0.00 N ATOM 459 CA ASP A 30 4.071 4.750 -12.834 1.00 0.00 C ATOM 460 C ASP A 30 4.122 4.578 -11.302 1.00 0.00 C ATOM 461 O ASP A 30 4.271 5.551 -10.566 1.00 0.00 O ATOM 462 CB ASP A 30 3.231 5.947 -13.303 1.00 0.00 C ATOM 463 CG ASP A 30 3.854 7.296 -12.912 1.00 0.00 C ATOM 464 OD1 ASP A 30 4.964 7.603 -13.402 1.00 0.00 O ATOM 465 OD2 ASP A 30 3.197 8.093 -12.204 1.00 0.00 O ATOM 0 H ASP A 30 4.319 3.249 -14.244 1.00 0.00 H new ATOM 0 HA ASP A 30 5.109 4.952 -13.098 1.00 0.00 H new ATOM 0 HB2 ASP A 30 3.117 5.904 -14.386 1.00 0.00 H new ATOM 0 HB3 ASP A 30 2.231 5.875 -12.874 1.00 0.00 H new ATOM 470 N GLU A 31 4.059 3.335 -10.803 1.00 0.00 N ATOM 471 CA GLU A 31 4.216 2.982 -9.388 1.00 0.00 C ATOM 472 C GLU A 31 5.693 3.027 -8.962 1.00 0.00 C ATOM 473 O GLU A 31 6.038 2.711 -7.820 1.00 0.00 O ATOM 474 CB GLU A 31 3.632 1.587 -9.096 1.00 0.00 C ATOM 475 CG GLU A 31 2.164 1.429 -9.513 1.00 0.00 C ATOM 476 CD GLU A 31 1.565 0.114 -8.986 1.00 0.00 C ATOM 477 OE1 GLU A 31 1.649 -0.927 -9.678 1.00 0.00 O ATOM 478 OE2 GLU A 31 0.979 0.107 -7.878 1.00 0.00 O ATOM 0 H GLU A 31 3.892 2.521 -11.395 1.00 0.00 H new ATOM 0 HA GLU A 31 3.664 3.722 -8.808 1.00 0.00 H new ATOM 0 HB2 GLU A 31 4.230 0.838 -9.615 1.00 0.00 H new ATOM 0 HB3 GLU A 31 3.721 1.383 -8.029 1.00 0.00 H new ATOM 0 HG2 GLU A 31 1.585 2.271 -9.134 1.00 0.00 H new ATOM 0 HG3 GLU A 31 2.089 1.454 -10.600 1.00 0.00 H new ATOM 485 N TRP A 32 6.573 3.405 -9.891 1.00 0.00 N ATOM 486 CA TRP A 32 7.996 3.574 -9.708 1.00 0.00 C ATOM 487 C TRP A 32 8.313 4.959 -10.271 1.00 0.00 C ATOM 488 O TRP A 32 7.903 5.280 -11.387 1.00 0.00 O ATOM 489 CB TRP A 32 8.774 2.480 -10.460 1.00 0.00 C ATOM 490 CG TRP A 32 8.517 1.036 -10.108 1.00 0.00 C ATOM 491 CD1 TRP A 32 7.317 0.407 -10.138 1.00 0.00 C ATOM 492 CD2 TRP A 32 9.492 -0.021 -9.827 1.00 0.00 C ATOM 493 NE1 TRP A 32 7.477 -0.937 -9.887 1.00 0.00 N ATOM 494 CE2 TRP A 32 8.804 -1.268 -9.763 1.00 0.00 C ATOM 495 CE3 TRP A 32 10.894 -0.065 -9.675 1.00 0.00 C ATOM 496 CZ2 TRP A 32 9.466 -2.494 -9.635 1.00 0.00 C ATOM 497 CZ3 TRP A 32 11.577 -1.292 -9.545 1.00 0.00 C ATOM 498 CH2 TRP A 32 10.867 -2.508 -9.556 1.00 0.00 C ATOM 0 H TRP A 32 6.282 3.611 -10.847 1.00 0.00 H new ATOM 0 HA TRP A 32 8.286 3.491 -8.660 1.00 0.00 H new ATOM 0 HB2 TRP A 32 8.571 2.602 -11.524 1.00 0.00 H new ATOM 0 HB3 TRP A 32 9.837 2.671 -10.315 1.00 0.00 H new ATOM 0 HD1 TRP A 32 6.371 0.891 -10.331 1.00 0.00 H new ATOM 0 HE1 TRP A 32 6.708 -1.602 -9.804 1.00 0.00 H new ATOM 0 HE3 TRP A 32 11.455 0.858 -9.658 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 8.906 -3.417 -9.598 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 12.651 -1.299 -9.436 1.00 0.00 H new ATOM 0 HH2 TRP A 32 11.398 -3.447 -9.504 1.00 0.00 H new ATOM 509 N LYS A 33 9.006 5.794 -9.497 1.00 0.00 N ATOM 510 CA LYS A 33 9.577 7.061 -9.925 1.00 0.00 C ATOM 511 C LYS A 33 10.692 6.736 -10.914 1.00 0.00 C ATOM 512 O LYS A 33 11.827 6.465 -10.517 1.00 0.00 O ATOM 513 CB LYS A 33 10.105 7.869 -8.720 1.00 0.00 C ATOM 514 CG LYS A 33 9.058 8.311 -7.682 1.00 0.00 C ATOM 515 CD LYS A 33 7.861 9.103 -8.232 1.00 0.00 C ATOM 516 CE LYS A 33 8.295 10.420 -8.895 1.00 0.00 C ATOM 517 NZ LYS A 33 7.137 11.230 -9.349 1.00 0.00 N ATOM 0 H LYS A 33 9.190 5.593 -8.514 1.00 0.00 H new ATOM 0 HA LYS A 33 8.820 7.685 -10.400 1.00 0.00 H new ATOM 0 HB2 LYS A 33 10.859 7.269 -8.211 1.00 0.00 H new ATOM 0 HB3 LYS A 33 10.608 8.759 -9.099 1.00 0.00 H new ATOM 0 HG2 LYS A 33 8.680 7.423 -7.175 1.00 0.00 H new ATOM 0 HG3 LYS A 33 9.557 8.920 -6.928 1.00 0.00 H new ATOM 0 HD2 LYS A 33 7.325 8.492 -8.958 1.00 0.00 H new ATOM 0 HD3 LYS A 33 7.165 9.318 -7.421 1.00 0.00 H new ATOM 0 HE2 LYS A 33 8.888 11.002 -8.189 1.00 0.00 H new ATOM 0 HE3 LYS A 33 8.939 10.201 -9.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 7.479 12.108 -9.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 6.584 10.687 -10.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 6.535 11.463 -8.533 1.00 0.00 H new ATOM 531 N VAL A 34 10.338 6.647 -12.187 1.00 0.00 N ATOM 532 CA VAL A 34 11.264 6.383 -13.260 1.00 0.00 C ATOM 533 C VAL A 34 12.124 7.634 -13.466 1.00 0.00 C ATOM 534 O VAL A 34 11.614 8.758 -13.392 1.00 0.00 O ATOM 535 CB VAL A 34 10.505 6.007 -14.553 1.00 0.00 C ATOM 536 CG1 VAL A 34 11.277 4.920 -15.296 1.00 0.00 C ATOM 537 CG2 VAL A 34 9.071 5.478 -14.374 1.00 0.00 C ATOM 0 H VAL A 34 9.375 6.760 -12.502 1.00 0.00 H new ATOM 0 HA VAL A 34 11.903 5.537 -13.007 1.00 0.00 H new ATOM 0 HB VAL A 34 10.430 6.950 -15.094 1.00 0.00 H new ATOM 0 HG11 VAL A 34 10.743 4.654 -16.208 1.00 0.00 H new ATOM 0 HG12 VAL A 34 12.270 5.289 -15.551 1.00 0.00 H new ATOM 0 HG13 VAL A 34 11.370 4.040 -14.660 1.00 0.00 H new ATOM 0 HG21 VAL A 34 8.643 5.249 -15.350 1.00 0.00 H new ATOM 0 HG22 VAL A 34 9.090 4.574 -13.765 1.00 0.00 H new ATOM 0 HG23 VAL A 34 8.463 6.236 -13.880 1.00 0.00 H new ATOM 547 N TYR A 35 13.401 7.432 -13.779 1.00 0.00 N ATOM 548 CA TYR A 35 14.341 8.473 -14.175 1.00 0.00 C ATOM 549 C TYR A 35 15.332 7.889 -15.182 1.00 0.00 C ATOM 550 O TYR A 35 15.525 6.670 -15.239 1.00 0.00 O ATOM 551 CB TYR A 35 15.129 8.963 -12.948 1.00 0.00 C ATOM 552 CG TYR A 35 14.336 9.702 -11.888 1.00 0.00 C ATOM 553 CD1 TYR A 35 14.057 11.074 -12.045 1.00 0.00 C ATOM 554 CD2 TYR A 35 13.920 9.032 -10.722 1.00 0.00 C ATOM 555 CE1 TYR A 35 13.365 11.775 -11.041 1.00 0.00 C ATOM 556 CE2 TYR A 35 13.241 9.729 -9.709 1.00 0.00 C ATOM 557 CZ TYR A 35 12.957 11.105 -9.865 1.00 0.00 C ATOM 558 OH TYR A 35 12.297 11.798 -8.893 1.00 0.00 O ATOM 0 H TYR A 35 13.824 6.504 -13.763 1.00 0.00 H new ATOM 0 HA TYR A 35 13.790 9.305 -14.614 1.00 0.00 H new ATOM 0 HB2 TYR A 35 15.604 8.100 -12.480 1.00 0.00 H new ATOM 0 HB3 TYR A 35 15.929 9.618 -13.295 1.00 0.00 H new ATOM 0 HD1 TYR A 35 14.376 11.589 -12.939 1.00 0.00 H new ATOM 0 HD2 TYR A 35 14.124 7.978 -10.606 1.00 0.00 H new ATOM 0 HE1 TYR A 35 13.145 12.825 -11.168 1.00 0.00 H new ATOM 0 HE2 TYR A 35 12.936 9.213 -8.810 1.00 0.00 H new ATOM 0 HH TYR A 35 12.084 11.196 -8.150 1.00 0.00 H new ATOM 568 N SER A 36 16.037 8.752 -15.910 1.00 0.00 N ATOM 569 CA SER A 36 17.165 8.370 -16.740 1.00 0.00 C ATOM 570 C SER A 36 18.245 9.443 -16.637 1.00 0.00 C ATOM 571 O SER A 36 17.949 10.591 -16.283 1.00 0.00 O ATOM 572 CB SER A 36 16.739 8.116 -18.190 1.00 0.00 C ATOM 573 OG SER A 36 16.155 9.238 -18.812 1.00 0.00 O ATOM 0 H SER A 36 15.833 9.751 -15.937 1.00 0.00 H new ATOM 0 HA SER A 36 17.574 7.427 -16.378 1.00 0.00 H new ATOM 0 HB2 SER A 36 17.610 7.804 -18.766 1.00 0.00 H new ATOM 0 HB3 SER A 36 16.029 7.289 -18.212 1.00 0.00 H new ATOM 0 HG SER A 36 15.182 9.124 -18.846 1.00 0.00 H new ATOM 579 N ALA A 37 19.493 9.062 -16.906 1.00 0.00 N ATOM 580 CA ALA A 37 20.642 9.951 -16.892 1.00 0.00 C ATOM 581 C ALA A 37 21.791 9.346 -17.703 1.00 0.00 C ATOM 582 O ALA A 37 21.619 8.356 -18.421 1.00 0.00 O ATOM 583 CB ALA A 37 21.062 10.218 -15.442 1.00 0.00 C ATOM 0 H ALA A 37 19.734 8.100 -17.145 1.00 0.00 H new ATOM 0 HA ALA A 37 20.376 10.901 -17.356 1.00 0.00 H new ATOM 0 HB1 ALA A 37 21.924 10.885 -15.430 1.00 0.00 H new ATOM 0 HB2 ALA A 37 20.236 10.683 -14.904 1.00 0.00 H new ATOM 0 HB3 ALA A 37 21.325 9.276 -14.960 1.00 0.00 H new ATOM 589 N GLY A 38 22.977 9.939 -17.600 1.00 0.00 N ATOM 590 CA GLY A 38 24.185 9.430 -18.215 1.00 0.00 C ATOM 591 C GLY A 38 25.392 10.277 -17.845 1.00 0.00 C ATOM 592 O GLY A 38 25.268 11.251 -17.097 1.00 0.00 O ATOM 0 H GLY A 38 23.121 10.802 -17.076 1.00 0.00 H new ATOM 0 HA2 GLY A 38 24.350 8.400 -17.899 1.00 0.00 H new ATOM 0 HA3 GLY A 38 24.066 9.416 -19.298 1.00 0.00 H new ATOM 596 N ILE A 39 26.553 9.902 -18.393 1.00 0.00 N ATOM 597 CA ILE A 39 27.804 10.660 -18.301 1.00 0.00 C ATOM 598 C ILE A 39 27.627 12.082 -18.863 1.00 0.00 C ATOM 599 O ILE A 39 28.311 13.007 -18.420 1.00 0.00 O ATOM 600 CB ILE A 39 28.920 9.832 -18.999 1.00 0.00 C ATOM 601 CG1 ILE A 39 29.606 8.926 -17.953 1.00 0.00 C ATOM 602 CG2 ILE A 39 29.972 10.674 -19.738 1.00 0.00 C ATOM 603 CD1 ILE A 39 30.410 7.770 -18.565 1.00 0.00 C ATOM 0 H ILE A 39 26.650 9.039 -18.927 1.00 0.00 H new ATOM 0 HA ILE A 39 28.101 10.809 -17.263 1.00 0.00 H new ATOM 0 HB ILE A 39 28.428 9.241 -19.771 1.00 0.00 H new ATOM 0 HG12 ILE A 39 30.271 9.534 -17.340 1.00 0.00 H new ATOM 0 HG13 ILE A 39 28.846 8.515 -17.288 1.00 0.00 H new ATOM 0 HG21 ILE A 39 30.711 10.015 -20.194 1.00 0.00 H new ATOM 0 HG22 ILE A 39 29.485 11.266 -20.513 1.00 0.00 H new ATOM 0 HG23 ILE A 39 30.467 11.340 -19.031 1.00 0.00 H new ATOM 0 HD11 ILE A 39 30.862 7.179 -17.768 1.00 0.00 H new ATOM 0 HD12 ILE A 39 29.746 7.137 -19.154 1.00 0.00 H new ATOM 0 HD13 ILE A 39 31.194 8.172 -19.207 1.00 0.00 H new ATOM 615 N GLU A 40 26.700 12.273 -19.803 1.00 0.00 N ATOM 616 CA GLU A 40 26.317 13.564 -20.336 1.00 0.00 C ATOM 617 C GLU A 40 24.832 13.512 -20.685 1.00 0.00 C ATOM 618 O GLU A 40 24.241 12.430 -20.784 1.00 0.00 O ATOM 619 CB GLU A 40 27.174 13.962 -21.549 1.00 0.00 C ATOM 620 CG GLU A 40 27.044 13.000 -22.743 1.00 0.00 C ATOM 621 CD GLU A 40 27.690 13.568 -24.016 1.00 0.00 C ATOM 622 OE1 GLU A 40 28.932 13.498 -24.165 1.00 0.00 O ATOM 623 OE2 GLU A 40 26.945 14.076 -24.884 1.00 0.00 O ATOM 0 H GLU A 40 26.182 11.501 -20.223 1.00 0.00 H new ATOM 0 HA GLU A 40 26.492 14.335 -19.585 1.00 0.00 H new ATOM 0 HB2 GLU A 40 26.890 14.964 -21.869 1.00 0.00 H new ATOM 0 HB3 GLU A 40 28.219 14.009 -21.244 1.00 0.00 H new ATOM 0 HG2 GLU A 40 27.512 12.048 -22.493 1.00 0.00 H new ATOM 0 HG3 GLU A 40 25.990 12.797 -22.931 1.00 0.00 H new ATOM 630 N ALA A 41 24.255 14.684 -20.931 1.00 0.00 N ATOM 631 CA ALA A 41 22.923 14.858 -21.469 1.00 0.00 C ATOM 632 C ALA A 41 22.974 16.100 -22.350 1.00 0.00 C ATOM 633 O ALA A 41 23.501 17.133 -21.929 1.00 0.00 O ATOM 634 CB ALA A 41 21.931 15.055 -20.322 1.00 0.00 C ATOM 0 H ALA A 41 24.727 15.570 -20.751 1.00 0.00 H new ATOM 0 HA ALA A 41 22.601 13.989 -22.043 1.00 0.00 H new ATOM 0 HB1 ALA A 41 20.928 15.186 -20.727 1.00 0.00 H new ATOM 0 HB2 ALA A 41 21.948 14.180 -19.672 1.00 0.00 H new ATOM 0 HB3 ALA A 41 22.209 15.939 -19.748 1.00 0.00 H new ATOM 640 N HIS A 42 22.398 16.000 -23.546 1.00 0.00 N ATOM 641 CA HIS A 42 22.257 17.108 -24.487 1.00 0.00 C ATOM 642 C HIS A 42 20.829 17.105 -25.060 1.00 0.00 C ATOM 643 O HIS A 42 20.583 17.616 -26.156 1.00 0.00 O ATOM 644 CB HIS A 42 23.376 17.032 -25.545 1.00 0.00 C ATOM 645 CG HIS A 42 24.726 17.440 -24.993 1.00 0.00 C ATOM 646 ND1 HIS A 42 25.813 16.630 -24.732 1.00 0.00 N ATOM 647 CD2 HIS A 42 25.083 18.712 -24.628 1.00 0.00 C ATOM 648 CE1 HIS A 42 26.789 17.398 -24.219 1.00 0.00 C ATOM 649 NE2 HIS A 42 26.395 18.682 -24.138 1.00 0.00 N ATOM 0 H HIS A 42 22.007 15.125 -23.896 1.00 0.00 H new ATOM 0 HA HIS A 42 22.383 18.072 -23.994 1.00 0.00 H new ATOM 0 HB2 HIS A 42 23.438 16.015 -25.931 1.00 0.00 H new ATOM 0 HB3 HIS A 42 23.121 17.677 -26.386 1.00 0.00 H new ATOM 0 HD1 HIS A 42 25.866 15.625 -24.899 1.00 0.00 H new ATOM 0 HD2 HIS A 42 24.458 19.589 -24.705 1.00 0.00 H new ATOM 0 HE1 HIS A 42 27.759 17.034 -23.913 1.00 0.00 H new ATOM 657 N GLY A 43 19.886 16.523 -24.310 1.00 0.00 N ATOM 658 CA GLY A 43 18.505 16.345 -24.727 1.00 0.00 C ATOM 659 C GLY A 43 18.336 14.976 -25.374 1.00 0.00 C ATOM 660 O GLY A 43 19.315 14.278 -25.661 1.00 0.00 O ATOM 0 H GLY A 43 20.074 16.157 -23.377 1.00 0.00 H new ATOM 0 HA2 GLY A 43 17.841 16.436 -23.867 1.00 0.00 H new ATOM 0 HA3 GLY A 43 18.224 17.128 -25.431 1.00 0.00 H new ATOM 664 N LEU A 44 17.082 14.585 -25.583 1.00 0.00 N ATOM 665 CA LEU A 44 16.741 13.318 -26.209 1.00 0.00 C ATOM 666 C LEU A 44 16.779 13.445 -27.731 1.00 0.00 C ATOM 667 O LEU A 44 16.502 14.509 -28.289 1.00 0.00 O ATOM 668 CB LEU A 44 15.402 12.782 -25.681 1.00 0.00 C ATOM 669 CG LEU A 44 14.113 13.467 -26.175 1.00 0.00 C ATOM 670 CD1 LEU A 44 12.949 12.766 -25.476 1.00 0.00 C ATOM 671 CD2 LEU A 44 14.008 14.965 -25.862 1.00 0.00 C ATOM 0 H LEU A 44 16.271 15.145 -25.320 1.00 0.00 H new ATOM 0 HA LEU A 44 17.491 12.576 -25.937 1.00 0.00 H new ATOM 0 HB2 LEU A 44 15.339 11.724 -25.937 1.00 0.00 H new ATOM 0 HB3 LEU A 44 15.420 12.846 -24.593 1.00 0.00 H new ATOM 0 HG LEU A 44 14.106 13.386 -27.262 1.00 0.00 H new ATOM 0 HD11 LEU A 44 12.009 13.217 -25.794 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.951 11.708 -25.738 1.00 0.00 H new ATOM 0 HD13 LEU A 44 13.056 12.872 -24.396 1.00 0.00 H new ATOM 0 HD21 LEU A 44 13.066 15.353 -26.251 1.00 0.00 H new ATOM 0 HD22 LEU A 44 14.044 15.115 -24.783 1.00 0.00 H new ATOM 0 HD23 LEU A 44 14.839 15.494 -26.330 1.00 0.00 H new ATOM 683 N ASN A 45 17.140 12.352 -28.400 1.00 0.00 N ATOM 684 CA ASN A 45 17.309 12.303 -29.846 1.00 0.00 C ATOM 685 C ASN A 45 15.926 12.309 -30.515 1.00 0.00 C ATOM 686 O ASN A 45 15.076 11.523 -30.097 1.00 0.00 O ATOM 687 CB ASN A 45 18.087 11.022 -30.185 1.00 0.00 C ATOM 688 CG ASN A 45 18.515 10.950 -31.644 1.00 0.00 C ATOM 689 OD1 ASN A 45 17.723 11.143 -32.555 1.00 0.00 O ATOM 690 ND2 ASN A 45 19.776 10.652 -31.895 1.00 0.00 N ATOM 0 H ASN A 45 17.326 11.460 -27.941 1.00 0.00 H new ATOM 0 HA ASN A 45 17.863 13.168 -30.212 1.00 0.00 H new ATOM 0 HB2 ASN A 45 18.971 10.963 -29.550 1.00 0.00 H new ATOM 0 HB3 ASN A 45 17.468 10.156 -29.951 1.00 0.00 H new ATOM 0 HD21 ASN A 45 20.101 10.580 -32.859 1.00 0.00 H new ATOM 0 HD22 ASN A 45 20.426 10.494 -31.125 1.00 0.00 H new ATOM 697 N PRO A 46 15.664 13.116 -31.560 1.00 0.00 N ATOM 698 CA PRO A 46 14.408 13.063 -32.309 1.00 0.00 C ATOM 699 C PRO A 46 14.008 11.660 -32.787 1.00 0.00 C ATOM 700 O PRO A 46 12.821 11.335 -32.815 1.00 0.00 O ATOM 701 CB PRO A 46 14.599 14.016 -33.493 1.00 0.00 C ATOM 702 CG PRO A 46 15.614 15.029 -32.971 1.00 0.00 C ATOM 703 CD PRO A 46 16.511 14.186 -32.066 1.00 0.00 C ATOM 0 HA PRO A 46 13.585 13.354 -31.657 1.00 0.00 H new ATOM 0 HB2 PRO A 46 14.970 13.493 -34.374 1.00 0.00 H new ATOM 0 HB3 PRO A 46 13.663 14.496 -33.778 1.00 0.00 H new ATOM 0 HG2 PRO A 46 16.178 15.489 -33.782 1.00 0.00 H new ATOM 0 HG3 PRO A 46 15.131 15.837 -32.421 1.00 0.00 H new ATOM 0 HD2 PRO A 46 17.360 13.785 -32.620 1.00 0.00 H new ATOM 0 HD3 PRO A 46 16.917 14.784 -31.250 1.00 0.00 H new ATOM 711 N ASN A 47 14.972 10.798 -33.130 1.00 0.00 N ATOM 712 CA ASN A 47 14.681 9.428 -33.548 1.00 0.00 C ATOM 713 C ASN A 47 14.243 8.579 -32.359 1.00 0.00 C ATOM 714 O ASN A 47 13.444 7.667 -32.546 1.00 0.00 O ATOM 715 CB ASN A 47 15.885 8.766 -34.231 1.00 0.00 C ATOM 716 CG ASN A 47 16.124 9.235 -35.663 1.00 0.00 C ATOM 717 OD1 ASN A 47 15.195 9.546 -36.401 1.00 0.00 O ATOM 718 ND2 ASN A 47 17.374 9.284 -36.094 1.00 0.00 N ATOM 0 H ASN A 47 15.965 11.030 -33.125 1.00 0.00 H new ATOM 0 HA ASN A 47 13.868 9.487 -34.272 1.00 0.00 H new ATOM 0 HB2 ASN A 47 16.779 8.966 -33.641 1.00 0.00 H new ATOM 0 HB3 ASN A 47 15.739 7.686 -34.233 1.00 0.00 H new ATOM 0 HD21 ASN A 47 17.573 9.583 -37.049 1.00 0.00 H new ATOM 0 HD22 ASN A 47 18.139 9.023 -35.471 1.00 0.00 H new ATOM 725 N ALA A 48 14.705 8.889 -31.141 1.00 0.00 N ATOM 726 CA ALA A 48 14.205 8.262 -29.927 1.00 0.00 C ATOM 727 C ALA A 48 12.728 8.624 -29.758 1.00 0.00 C ATOM 728 O ALA A 48 11.903 7.744 -29.520 1.00 0.00 O ATOM 729 CB ALA A 48 15.027 8.694 -28.699 1.00 0.00 C ATOM 0 H ALA A 48 15.435 9.582 -30.977 1.00 0.00 H new ATOM 0 HA ALA A 48 14.305 7.180 -30.011 1.00 0.00 H new ATOM 0 HB1 ALA A 48 14.630 8.210 -27.807 1.00 0.00 H new ATOM 0 HB2 ALA A 48 16.068 8.403 -28.837 1.00 0.00 H new ATOM 0 HB3 ALA A 48 14.965 9.776 -28.582 1.00 0.00 H new ATOM 735 N VAL A 49 12.381 9.906 -29.929 1.00 0.00 N ATOM 736 CA VAL A 49 10.995 10.359 -29.856 1.00 0.00 C ATOM 737 C VAL A 49 10.162 9.604 -30.899 1.00 0.00 C ATOM 738 O VAL A 49 9.140 9.018 -30.537 1.00 0.00 O ATOM 739 CB VAL A 49 10.887 11.894 -30.009 1.00 0.00 C ATOM 740 CG1 VAL A 49 9.440 12.371 -29.814 1.00 0.00 C ATOM 741 CG2 VAL A 49 11.771 12.628 -28.990 1.00 0.00 C ATOM 0 H VAL A 49 13.052 10.650 -30.120 1.00 0.00 H new ATOM 0 HA VAL A 49 10.594 10.133 -28.868 1.00 0.00 H new ATOM 0 HB VAL A 49 11.224 12.126 -31.019 1.00 0.00 H new ATOM 0 HG11 VAL A 49 9.396 13.454 -29.927 1.00 0.00 H new ATOM 0 HG12 VAL A 49 8.798 11.901 -30.560 1.00 0.00 H new ATOM 0 HG13 VAL A 49 9.098 12.096 -28.816 1.00 0.00 H new ATOM 0 HG21 VAL A 49 11.669 13.704 -29.128 1.00 0.00 H new ATOM 0 HG22 VAL A 49 11.461 12.361 -27.980 1.00 0.00 H new ATOM 0 HG23 VAL A 49 12.812 12.341 -29.138 1.00 0.00 H new ATOM 751 N LYS A 50 10.608 9.536 -32.163 1.00 0.00 N ATOM 752 CA LYS A 50 9.887 8.783 -33.188 1.00 0.00 C ATOM 753 C LYS A 50 9.747 7.319 -32.796 1.00 0.00 C ATOM 754 O LYS A 50 8.664 6.773 -32.971 1.00 0.00 O ATOM 755 CB LYS A 50 10.556 8.886 -34.575 1.00 0.00 C ATOM 756 CG LYS A 50 9.919 9.910 -35.530 1.00 0.00 C ATOM 757 CD LYS A 50 8.398 9.773 -35.764 1.00 0.00 C ATOM 758 CE LYS A 50 7.840 8.340 -35.892 1.00 0.00 C ATOM 759 NZ LYS A 50 8.312 7.605 -37.090 1.00 0.00 N ATOM 0 H LYS A 50 11.459 9.992 -32.493 1.00 0.00 H new ATOM 0 HA LYS A 50 8.897 9.234 -33.259 1.00 0.00 H new ATOM 0 HB2 LYS A 50 11.606 9.145 -34.437 1.00 0.00 H new ATOM 0 HB3 LYS A 50 10.529 7.905 -35.048 1.00 0.00 H new ATOM 0 HG2 LYS A 50 10.117 10.909 -35.142 1.00 0.00 H new ATOM 0 HG3 LYS A 50 10.422 9.837 -36.494 1.00 0.00 H new ATOM 0 HD2 LYS A 50 7.882 10.266 -34.940 1.00 0.00 H new ATOM 0 HD3 LYS A 50 8.143 10.319 -36.672 1.00 0.00 H new ATOM 0 HE2 LYS A 50 8.116 7.775 -35.002 1.00 0.00 H new ATOM 0 HE3 LYS A 50 6.751 8.388 -35.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 8.108 6.591 -36.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 7.823 7.966 -37.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 9.337 7.742 -37.199 1.00 0.00 H new ATOM 773 N ALA A 51 10.797 6.685 -32.277 1.00 0.00 N ATOM 774 CA ALA A 51 10.771 5.275 -31.927 1.00 0.00 C ATOM 775 C ALA A 51 9.683 5.014 -30.884 1.00 0.00 C ATOM 776 O ALA A 51 8.906 4.073 -31.033 1.00 0.00 O ATOM 777 CB ALA A 51 12.155 4.845 -31.429 1.00 0.00 C ATOM 0 H ALA A 51 11.690 7.140 -32.089 1.00 0.00 H new ATOM 0 HA ALA A 51 10.530 4.679 -32.807 1.00 0.00 H new ATOM 0 HB1 ALA A 51 12.135 3.787 -31.167 1.00 0.00 H new ATOM 0 HB2 ALA A 51 12.892 5.010 -32.215 1.00 0.00 H new ATOM 0 HB3 ALA A 51 12.424 5.432 -30.551 1.00 0.00 H new ATOM 783 N MET A 52 9.582 5.869 -29.866 1.00 0.00 N ATOM 784 CA MET A 52 8.558 5.725 -28.838 1.00 0.00 C ATOM 785 C MET A 52 7.169 6.056 -29.382 1.00 0.00 C ATOM 786 O MET A 52 6.201 5.355 -29.085 1.00 0.00 O ATOM 787 CB MET A 52 8.905 6.589 -27.622 1.00 0.00 C ATOM 788 CG MET A 52 10.232 6.173 -26.968 1.00 0.00 C ATOM 789 SD MET A 52 10.533 4.402 -26.697 1.00 0.00 S ATOM 790 CE MET A 52 9.060 4.000 -25.736 1.00 0.00 C ATOM 0 H MET A 52 10.200 6.670 -29.734 1.00 0.00 H new ATOM 0 HA MET A 52 8.534 4.682 -28.521 1.00 0.00 H new ATOM 0 HB2 MET A 52 8.965 7.634 -27.927 1.00 0.00 H new ATOM 0 HB3 MET A 52 8.103 6.517 -26.888 1.00 0.00 H new ATOM 0 HG2 MET A 52 11.043 6.559 -27.585 1.00 0.00 H new ATOM 0 HG3 MET A 52 10.300 6.674 -26.003 1.00 0.00 H new ATOM 0 HE1 MET A 52 9.355 3.537 -24.794 1.00 0.00 H new ATOM 0 HE2 MET A 52 8.498 4.912 -25.532 1.00 0.00 H new ATOM 0 HE3 MET A 52 8.435 3.308 -26.300 1.00 0.00 H new ATOM 800 N LYS A 53 7.043 7.062 -30.246 1.00 0.00 N ATOM 801 CA LYS A 53 5.769 7.354 -30.896 1.00 0.00 C ATOM 802 C LYS A 53 5.326 6.203 -31.795 1.00 0.00 C ATOM 803 O LYS A 53 4.125 6.030 -31.991 1.00 0.00 O ATOM 804 CB LYS A 53 5.874 8.658 -31.691 1.00 0.00 C ATOM 805 CG LYS A 53 6.027 9.903 -30.794 1.00 0.00 C ATOM 806 CD LYS A 53 4.715 10.658 -30.520 1.00 0.00 C ATOM 807 CE LYS A 53 3.709 9.841 -29.698 1.00 0.00 C ATOM 808 NZ LYS A 53 2.464 10.602 -29.419 1.00 0.00 N ATOM 0 H LYS A 53 7.805 7.686 -30.511 1.00 0.00 H new ATOM 0 HA LYS A 53 5.010 7.473 -30.123 1.00 0.00 H new ATOM 0 HB2 LYS A 53 6.727 8.597 -32.366 1.00 0.00 H new ATOM 0 HB3 LYS A 53 4.985 8.771 -32.311 1.00 0.00 H new ATOM 0 HG2 LYS A 53 6.461 9.598 -29.842 1.00 0.00 H new ATOM 0 HG3 LYS A 53 6.734 10.588 -31.262 1.00 0.00 H new ATOM 0 HD2 LYS A 53 4.940 11.584 -29.991 1.00 0.00 H new ATOM 0 HD3 LYS A 53 4.258 10.936 -31.470 1.00 0.00 H new ATOM 0 HE2 LYS A 53 3.461 8.926 -30.236 1.00 0.00 H new ATOM 0 HE3 LYS A 53 4.169 9.542 -28.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 1.814 10.012 -28.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 2.696 11.463 -28.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 2.009 10.865 -30.317 1.00 0.00 H new ATOM 822 N GLU A 54 6.256 5.383 -32.290 1.00 0.00 N ATOM 823 CA GLU A 54 5.958 4.244 -33.144 1.00 0.00 C ATOM 824 C GLU A 54 5.242 3.137 -32.351 1.00 0.00 C ATOM 825 O GLU A 54 4.647 2.247 -32.957 1.00 0.00 O ATOM 826 CB GLU A 54 7.257 3.745 -33.809 1.00 0.00 C ATOM 827 CG GLU A 54 7.056 3.128 -35.200 1.00 0.00 C ATOM 828 CD GLU A 54 6.552 4.157 -36.233 1.00 0.00 C ATOM 829 OE1 GLU A 54 7.331 5.049 -36.641 1.00 0.00 O ATOM 830 OE2 GLU A 54 5.375 4.070 -36.648 1.00 0.00 O ATOM 0 H GLU A 54 7.252 5.499 -32.102 1.00 0.00 H new ATOM 0 HA GLU A 54 5.273 4.550 -33.935 1.00 0.00 H new ATOM 0 HB2 GLU A 54 7.953 4.580 -33.891 1.00 0.00 H new ATOM 0 HB3 GLU A 54 7.723 3.004 -33.159 1.00 0.00 H new ATOM 0 HG2 GLU A 54 7.998 2.702 -35.545 1.00 0.00 H new ATOM 0 HG3 GLU A 54 6.342 2.307 -35.131 1.00 0.00 H new ATOM 837 N VAL A 55 5.257 3.203 -31.010 1.00 0.00 N ATOM 838 CA VAL A 55 4.576 2.248 -30.129 1.00 0.00 C ATOM 839 C VAL A 55 3.483 2.921 -29.281 1.00 0.00 C ATOM 840 O VAL A 55 2.769 2.235 -28.547 1.00 0.00 O ATOM 841 CB VAL A 55 5.612 1.481 -29.283 1.00 0.00 C ATOM 842 CG1 VAL A 55 6.475 0.607 -30.207 1.00 0.00 C ATOM 843 CG2 VAL A 55 6.505 2.426 -28.461 1.00 0.00 C ATOM 0 H VAL A 55 5.752 3.935 -30.501 1.00 0.00 H new ATOM 0 HA VAL A 55 4.051 1.519 -30.745 1.00 0.00 H new ATOM 0 HB VAL A 55 5.070 0.855 -28.574 1.00 0.00 H new ATOM 0 HG11 VAL A 55 7.209 0.063 -29.612 1.00 0.00 H new ATOM 0 HG12 VAL A 55 5.838 -0.103 -30.736 1.00 0.00 H new ATOM 0 HG13 VAL A 55 6.991 1.240 -30.929 1.00 0.00 H new ATOM 0 HG21 VAL A 55 7.219 1.840 -27.882 1.00 0.00 H new ATOM 0 HG22 VAL A 55 7.044 3.093 -29.133 1.00 0.00 H new ATOM 0 HG23 VAL A 55 5.886 3.015 -27.785 1.00 0.00 H new ATOM 853 N GLY A 56 3.313 4.241 -29.401 1.00 0.00 N ATOM 854 CA GLY A 56 2.245 4.977 -28.736 1.00 0.00 C ATOM 855 C GLY A 56 2.690 5.462 -27.360 1.00 0.00 C ATOM 856 O GLY A 56 1.875 5.529 -26.440 1.00 0.00 O ATOM 0 H GLY A 56 3.921 4.830 -29.969 1.00 0.00 H new ATOM 0 HA2 GLY A 56 1.950 5.829 -29.348 1.00 0.00 H new ATOM 0 HA3 GLY A 56 1.367 4.339 -28.634 1.00 0.00 H new ATOM 860 N ILE A 57 3.979 5.777 -27.210 1.00 0.00 N ATOM 861 CA ILE A 57 4.571 6.334 -26.005 1.00 0.00 C ATOM 862 C ILE A 57 5.130 7.697 -26.424 1.00 0.00 C ATOM 863 O ILE A 57 5.362 7.962 -27.606 1.00 0.00 O ATOM 864 CB ILE A 57 5.633 5.345 -25.450 1.00 0.00 C ATOM 865 CG1 ILE A 57 4.954 4.037 -24.974 1.00 0.00 C ATOM 866 CG2 ILE A 57 6.477 5.966 -24.313 1.00 0.00 C ATOM 867 CD1 ILE A 57 5.918 2.887 -24.648 1.00 0.00 C ATOM 0 H ILE A 57 4.660 5.643 -27.958 1.00 0.00 H new ATOM 0 HA ILE A 57 3.866 6.477 -25.186 1.00 0.00 H new ATOM 0 HB ILE A 57 6.318 5.115 -26.266 1.00 0.00 H new ATOM 0 HG12 ILE A 57 4.360 4.256 -24.087 1.00 0.00 H new ATOM 0 HG13 ILE A 57 4.262 3.703 -25.747 1.00 0.00 H new ATOM 0 HG21 ILE A 57 7.204 5.235 -23.959 1.00 0.00 H new ATOM 0 HG22 ILE A 57 6.999 6.846 -24.687 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.823 6.255 -23.490 1.00 0.00 H new ATOM 0 HD11 ILE A 57 5.349 2.016 -24.324 1.00 0.00 H new ATOM 0 HD12 ILE A 57 6.495 2.633 -25.537 1.00 0.00 H new ATOM 0 HD13 ILE A 57 6.595 3.195 -23.851 1.00 0.00 H new ATOM 879 N ASP A 58 5.371 8.560 -25.448 1.00 0.00 N ATOM 880 CA ASP A 58 6.092 9.806 -25.629 1.00 0.00 C ATOM 881 C ASP A 58 7.169 9.867 -24.554 1.00 0.00 C ATOM 882 O ASP A 58 6.961 9.409 -23.428 1.00 0.00 O ATOM 883 CB ASP A 58 5.164 11.023 -25.521 1.00 0.00 C ATOM 884 CG ASP A 58 6.015 12.294 -25.473 1.00 0.00 C ATOM 885 OD1 ASP A 58 6.769 12.530 -26.443 1.00 0.00 O ATOM 886 OD2 ASP A 58 6.063 12.957 -24.413 1.00 0.00 O ATOM 0 H ASP A 58 5.063 8.408 -24.488 1.00 0.00 H new ATOM 0 HA ASP A 58 6.529 9.834 -26.627 1.00 0.00 H new ATOM 0 HB2 ASP A 58 4.485 11.056 -26.373 1.00 0.00 H new ATOM 0 HB3 ASP A 58 4.547 10.948 -24.625 1.00 0.00 H new ATOM 891 N ILE A 59 8.302 10.465 -24.907 1.00 0.00 N ATOM 892 CA ILE A 59 9.421 10.734 -24.014 1.00 0.00 C ATOM 893 C ILE A 59 9.815 12.222 -24.078 1.00 0.00 C ATOM 894 O ILE A 59 10.673 12.663 -23.321 1.00 0.00 O ATOM 895 CB ILE A 59 10.579 9.740 -24.288 1.00 0.00 C ATOM 896 CG1 ILE A 59 10.954 9.667 -25.785 1.00 0.00 C ATOM 897 CG2 ILE A 59 10.184 8.345 -23.763 1.00 0.00 C ATOM 898 CD1 ILE A 59 12.286 8.951 -26.033 1.00 0.00 C ATOM 0 H ILE A 59 8.471 10.788 -25.860 1.00 0.00 H new ATOM 0 HA ILE A 59 9.129 10.559 -22.978 1.00 0.00 H new ATOM 0 HB ILE A 59 11.463 10.101 -23.763 1.00 0.00 H new ATOM 0 HG12 ILE A 59 10.163 9.149 -26.328 1.00 0.00 H new ATOM 0 HG13 ILE A 59 11.010 10.677 -26.190 1.00 0.00 H new ATOM 0 HG21 ILE A 59 10.995 7.642 -23.953 1.00 0.00 H new ATOM 0 HG22 ILE A 59 9.995 8.400 -22.691 1.00 0.00 H new ATOM 0 HG23 ILE A 59 9.283 8.006 -24.273 1.00 0.00 H new ATOM 0 HD11 ILE A 59 12.495 8.931 -27.103 1.00 0.00 H new ATOM 0 HD12 ILE A 59 13.086 9.482 -25.517 1.00 0.00 H new ATOM 0 HD13 ILE A 59 12.226 7.930 -25.656 1.00 0.00 H new ATOM 910 N SER A 60 9.148 13.043 -24.896 1.00 0.00 N ATOM 911 CA SER A 60 9.347 14.495 -24.909 1.00 0.00 C ATOM 912 C SER A 60 9.072 15.108 -23.526 1.00 0.00 C ATOM 913 O SER A 60 9.706 16.086 -23.131 1.00 0.00 O ATOM 914 CB SER A 60 8.446 15.149 -25.966 1.00 0.00 C ATOM 915 OG SER A 60 8.402 14.394 -27.161 1.00 0.00 O ATOM 0 H SER A 60 8.454 12.718 -25.569 1.00 0.00 H new ATOM 0 HA SER A 60 10.389 14.687 -25.163 1.00 0.00 H new ATOM 0 HB2 SER A 60 7.437 15.256 -25.567 1.00 0.00 H new ATOM 0 HB3 SER A 60 8.811 16.153 -26.184 1.00 0.00 H new ATOM 0 HG SER A 60 7.559 13.897 -27.203 1.00 0.00 H new ATOM 921 N ASN A 61 8.152 14.500 -22.770 1.00 0.00 N ATOM 922 CA ASN A 61 7.782 14.868 -21.404 1.00 0.00 C ATOM 923 C ASN A 61 8.881 14.626 -20.351 1.00 0.00 C ATOM 924 O ASN A 61 8.661 14.975 -19.190 1.00 0.00 O ATOM 925 CB ASN A 61 6.504 14.114 -20.994 1.00 0.00 C ATOM 926 CG ASN A 61 6.735 12.611 -20.840 1.00 0.00 C ATOM 927 OD1 ASN A 61 7.085 12.118 -19.773 1.00 0.00 O ATOM 928 ND2 ASN A 61 6.560 11.863 -21.916 1.00 0.00 N ATOM 0 H ASN A 61 7.621 13.700 -23.113 1.00 0.00 H new ATOM 0 HA ASN A 61 7.619 15.946 -21.423 1.00 0.00 H new ATOM 0 HB2 ASN A 61 6.133 14.520 -20.053 1.00 0.00 H new ATOM 0 HB3 ASN A 61 5.730 14.285 -21.742 1.00 0.00 H new ATOM 0 HD21 ASN A 61 6.716 10.856 -21.868 1.00 0.00 H new ATOM 0 HD22 ASN A 61 6.269 12.293 -22.794 1.00 0.00 H new ATOM 935 N GLN A 62 10.033 14.037 -20.699 1.00 0.00 N ATOM 936 CA GLN A 62 11.049 13.605 -19.732 1.00 0.00 C ATOM 937 C GLN A 62 12.445 13.982 -20.246 1.00 0.00 C ATOM 938 O GLN A 62 13.325 13.134 -20.390 1.00 0.00 O ATOM 939 CB GLN A 62 10.884 12.103 -19.392 1.00 0.00 C ATOM 940 CG GLN A 62 10.779 11.230 -20.648 1.00 0.00 C ATOM 941 CD GLN A 62 11.008 9.740 -20.424 1.00 0.00 C ATOM 942 OE1 GLN A 62 10.224 9.043 -19.786 1.00 0.00 O ATOM 943 NE2 GLN A 62 12.061 9.218 -21.026 1.00 0.00 N ATOM 0 H GLN A 62 10.287 13.846 -21.668 1.00 0.00 H new ATOM 0 HA GLN A 62 10.914 14.130 -18.786 1.00 0.00 H new ATOM 0 HB2 GLN A 62 11.733 11.773 -18.793 1.00 0.00 H new ATOM 0 HB3 GLN A 62 9.991 11.967 -18.782 1.00 0.00 H new ATOM 0 HG2 GLN A 62 9.790 11.368 -21.085 1.00 0.00 H new ATOM 0 HG3 GLN A 62 11.503 11.587 -21.380 1.00 0.00 H new ATOM 0 HE21 GLN A 62 12.698 9.818 -21.550 1.00 0.00 H new ATOM 0 HE22 GLN A 62 12.237 8.215 -20.967 1.00 0.00 H new ATOM 952 N THR A 63 12.634 15.260 -20.577 1.00 0.00 N ATOM 953 CA THR A 63 13.894 15.802 -21.079 1.00 0.00 C ATOM 954 C THR A 63 15.095 15.410 -20.194 1.00 0.00 C ATOM 955 O THR A 63 14.990 15.295 -18.967 1.00 0.00 O ATOM 956 CB THR A 63 13.754 17.327 -21.255 1.00 0.00 C ATOM 957 OG1 THR A 63 13.086 17.909 -20.146 1.00 0.00 O ATOM 958 CG2 THR A 63 12.927 17.645 -22.506 1.00 0.00 C ATOM 0 H THR A 63 11.898 15.962 -20.501 1.00 0.00 H new ATOM 0 HA THR A 63 14.106 15.361 -22.053 1.00 0.00 H new ATOM 0 HB THR A 63 14.761 17.734 -21.342 1.00 0.00 H new ATOM 0 HG1 THR A 63 13.011 18.877 -20.280 1.00 0.00 H new ATOM 0 HG21 THR A 63 12.837 18.726 -22.617 1.00 0.00 H new ATOM 0 HG22 THR A 63 13.421 17.230 -23.384 1.00 0.00 H new ATOM 0 HG23 THR A 63 11.934 17.206 -22.407 1.00 0.00 H new ATOM 966 N SER A 64 16.237 15.177 -20.845 1.00 0.00 N ATOM 967 CA SER A 64 17.437 14.596 -20.282 1.00 0.00 C ATOM 968 C SER A 64 18.098 15.438 -19.189 1.00 0.00 C ATOM 969 O SER A 64 17.905 16.655 -19.113 1.00 0.00 O ATOM 970 CB SER A 64 18.415 14.399 -21.443 1.00 0.00 C ATOM 971 OG SER A 64 17.776 13.756 -22.531 1.00 0.00 O ATOM 0 H SER A 64 16.345 15.405 -21.833 1.00 0.00 H new ATOM 0 HA SER A 64 17.163 13.662 -19.791 1.00 0.00 H new ATOM 0 HB2 SER A 64 18.806 15.365 -21.763 1.00 0.00 H new ATOM 0 HB3 SER A 64 19.266 13.804 -21.111 1.00 0.00 H new ATOM 0 HG SER A 64 18.314 12.990 -22.820 1.00 0.00 H new ATOM 977 N ASP A 65 18.948 14.784 -18.398 1.00 0.00 N ATOM 978 CA ASP A 65 19.851 15.403 -17.424 1.00 0.00 C ATOM 979 C ASP A 65 21.029 14.461 -17.139 1.00 0.00 C ATOM 980 O ASP A 65 20.934 13.253 -17.366 1.00 0.00 O ATOM 981 CB ASP A 65 19.094 15.719 -16.121 1.00 0.00 C ATOM 982 CG ASP A 65 19.915 16.565 -15.130 1.00 0.00 C ATOM 983 OD1 ASP A 65 20.851 17.281 -15.555 1.00 0.00 O ATOM 984 OD2 ASP A 65 19.575 16.570 -13.926 1.00 0.00 O ATOM 0 H ASP A 65 19.031 13.768 -18.418 1.00 0.00 H new ATOM 0 HA ASP A 65 20.234 16.337 -17.837 1.00 0.00 H new ATOM 0 HB2 ASP A 65 18.172 16.248 -16.363 1.00 0.00 H new ATOM 0 HB3 ASP A 65 18.807 14.784 -15.639 1.00 0.00 H new ATOM 989 N ILE A 66 22.151 15.000 -16.660 1.00 0.00 N ATOM 990 CA ILE A 66 23.271 14.219 -16.149 1.00 0.00 C ATOM 991 C ILE A 66 22.881 13.581 -14.806 1.00 0.00 C ATOM 992 O ILE A 66 21.876 13.943 -14.187 1.00 0.00 O ATOM 993 CB ILE A 66 24.568 15.068 -16.042 1.00 0.00 C ATOM 994 CG1 ILE A 66 24.400 16.574 -15.720 1.00 0.00 C ATOM 995 CG2 ILE A 66 25.394 14.865 -17.315 1.00 0.00 C ATOM 996 CD1 ILE A 66 24.161 17.508 -16.924 1.00 0.00 C ATOM 0 H ILE A 66 22.306 16.007 -16.617 1.00 0.00 H new ATOM 0 HA ILE A 66 23.495 13.421 -16.857 1.00 0.00 H new ATOM 0 HB ILE A 66 25.084 14.694 -15.158 1.00 0.00 H new ATOM 0 HG12 ILE A 66 23.564 16.685 -15.030 1.00 0.00 H new ATOM 0 HG13 ILE A 66 25.293 16.913 -15.196 1.00 0.00 H new ATOM 0 HG21 ILE A 66 26.308 15.456 -17.254 1.00 0.00 H new ATOM 0 HG22 ILE A 66 25.650 13.810 -17.419 1.00 0.00 H new ATOM 0 HG23 ILE A 66 24.813 15.184 -18.180 1.00 0.00 H new ATOM 0 HD11 ILE A 66 24.059 18.535 -16.573 1.00 0.00 H new ATOM 0 HD12 ILE A 66 25.006 17.441 -17.610 1.00 0.00 H new ATOM 0 HD13 ILE A 66 23.249 17.209 -17.441 1.00 0.00 H new ATOM 1008 N ILE A 67 23.684 12.604 -14.374 1.00 0.00 N ATOM 1009 CA ILE A 67 23.483 11.843 -13.146 1.00 0.00 C ATOM 1010 C ILE A 67 23.415 12.791 -11.943 1.00 0.00 C ATOM 1011 O ILE A 67 24.132 13.795 -11.884 1.00 0.00 O ATOM 1012 CB ILE A 67 24.596 10.774 -13.024 1.00 0.00 C ATOM 1013 CG1 ILE A 67 24.367 9.675 -14.086 1.00 0.00 C ATOM 1014 CG2 ILE A 67 24.645 10.122 -11.634 1.00 0.00 C ATOM 1015 CD1 ILE A 67 25.568 8.753 -14.299 1.00 0.00 C ATOM 0 H ILE A 67 24.516 12.315 -14.888 1.00 0.00 H new ATOM 0 HA ILE A 67 22.530 11.315 -13.171 1.00 0.00 H new ATOM 0 HB ILE A 67 25.548 11.281 -13.182 1.00 0.00 H new ATOM 0 HG12 ILE A 67 23.508 9.073 -13.791 1.00 0.00 H new ATOM 0 HG13 ILE A 67 24.113 10.148 -15.034 1.00 0.00 H new ATOM 0 HG21 ILE A 67 25.444 9.381 -11.608 1.00 0.00 H new ATOM 0 HG22 ILE A 67 24.834 10.886 -10.880 1.00 0.00 H new ATOM 0 HG23 ILE A 67 23.692 9.635 -11.427 1.00 0.00 H new ATOM 0 HD11 ILE A 67 25.326 8.010 -15.059 1.00 0.00 H new ATOM 0 HD12 ILE A 67 26.425 9.342 -14.626 1.00 0.00 H new ATOM 0 HD13 ILE A 67 25.810 8.249 -13.363 1.00 0.00 H new ATOM 1027 N ASP A 68 22.594 12.420 -10.961 1.00 0.00 N ATOM 1028 CA ASP A 68 22.461 13.113 -9.685 1.00 0.00 C ATOM 1029 C ASP A 68 22.340 12.095 -8.548 1.00 0.00 C ATOM 1030 O ASP A 68 21.597 11.108 -8.640 1.00 0.00 O ATOM 1031 CB ASP A 68 21.243 14.045 -9.711 1.00 0.00 C ATOM 1032 CG ASP A 68 21.267 15.007 -8.514 1.00 0.00 C ATOM 1033 OD1 ASP A 68 21.068 14.556 -7.368 1.00 0.00 O ATOM 1034 OD2 ASP A 68 21.497 16.221 -8.720 1.00 0.00 O ATOM 0 H ASP A 68 21.986 11.604 -11.036 1.00 0.00 H new ATOM 0 HA ASP A 68 23.351 13.719 -9.515 1.00 0.00 H new ATOM 0 HB2 ASP A 68 21.235 14.614 -10.641 1.00 0.00 H new ATOM 0 HB3 ASP A 68 20.327 13.455 -9.691 1.00 0.00 H new ATOM 1039 N SER A 69 23.085 12.334 -7.468 1.00 0.00 N ATOM 1040 CA SER A 69 23.151 11.488 -6.285 1.00 0.00 C ATOM 1041 C SER A 69 21.782 11.223 -5.652 1.00 0.00 C ATOM 1042 O SER A 69 21.579 10.161 -5.058 1.00 0.00 O ATOM 1043 CB SER A 69 24.100 12.137 -5.268 1.00 0.00 C ATOM 1044 OG SER A 69 25.309 12.543 -5.898 1.00 0.00 O ATOM 0 H SER A 69 23.682 13.158 -7.395 1.00 0.00 H new ATOM 0 HA SER A 69 23.528 10.513 -6.594 1.00 0.00 H new ATOM 0 HB2 SER A 69 23.616 12.999 -4.809 1.00 0.00 H new ATOM 0 HB3 SER A 69 24.320 11.432 -4.467 1.00 0.00 H new ATOM 0 HG SER A 69 25.901 12.956 -5.235 1.00 0.00 H new ATOM 1050 N ASP A 70 20.831 12.150 -5.804 1.00 0.00 N ATOM 1051 CA ASP A 70 19.506 12.097 -5.183 1.00 0.00 C ATOM 1052 C ASP A 70 18.628 10.997 -5.786 1.00 0.00 C ATOM 1053 O ASP A 70 17.580 10.657 -5.236 1.00 0.00 O ATOM 1054 CB ASP A 70 18.809 13.458 -5.317 1.00 0.00 C ATOM 1055 CG ASP A 70 17.473 13.508 -4.555 1.00 0.00 C ATOM 1056 OD1 ASP A 70 17.478 13.400 -3.307 1.00 0.00 O ATOM 1057 OD2 ASP A 70 16.417 13.731 -5.189 1.00 0.00 O ATOM 0 H ASP A 70 20.967 12.981 -6.379 1.00 0.00 H new ATOM 0 HA ASP A 70 19.649 11.859 -4.129 1.00 0.00 H new ATOM 0 HB2 ASP A 70 19.469 14.240 -4.941 1.00 0.00 H new ATOM 0 HB3 ASP A 70 18.632 13.670 -6.371 1.00 0.00 H new ATOM 1062 N ILE A 71 19.067 10.418 -6.907 1.00 0.00 N ATOM 1063 CA ILE A 71 18.415 9.306 -7.563 1.00 0.00 C ATOM 1064 C ILE A 71 19.353 8.102 -7.455 1.00 0.00 C ATOM 1065 O ILE A 71 18.880 7.033 -7.093 1.00 0.00 O ATOM 1066 CB ILE A 71 18.050 9.686 -9.013 1.00 0.00 C ATOM 1067 CG1 ILE A 71 17.184 10.968 -9.116 1.00 0.00 C ATOM 1068 CG2 ILE A 71 17.294 8.519 -9.663 1.00 0.00 C ATOM 1069 CD1 ILE A 71 17.424 11.703 -10.436 1.00 0.00 C ATOM 0 H ILE A 71 19.911 10.727 -7.389 1.00 0.00 H new ATOM 0 HA ILE A 71 17.469 9.045 -7.088 1.00 0.00 H new ATOM 0 HB ILE A 71 18.987 9.893 -9.531 1.00 0.00 H new ATOM 0 HG12 ILE A 71 16.130 10.704 -9.032 1.00 0.00 H new ATOM 0 HG13 ILE A 71 17.414 11.631 -8.282 1.00 0.00 H new ATOM 0 HG21 ILE A 71 17.033 8.781 -10.688 1.00 0.00 H new ATOM 0 HG22 ILE A 71 17.927 7.632 -9.665 1.00 0.00 H new ATOM 0 HG23 ILE A 71 16.385 8.315 -9.098 1.00 0.00 H new ATOM 0 HD11 ILE A 71 16.801 12.596 -10.474 1.00 0.00 H new ATOM 0 HD12 ILE A 71 18.473 11.989 -10.507 1.00 0.00 H new ATOM 0 HD13 ILE A 71 17.169 11.048 -11.269 1.00 0.00 H new ATOM 1081 N LEU A 72 20.671 8.266 -7.650 1.00 0.00 N ATOM 1082 CA LEU A 72 21.650 7.173 -7.515 1.00 0.00 C ATOM 1083 C LEU A 72 21.444 6.389 -6.221 1.00 0.00 C ATOM 1084 O LEU A 72 21.216 5.183 -6.252 1.00 0.00 O ATOM 1085 CB LEU A 72 23.100 7.693 -7.472 1.00 0.00 C ATOM 1086 CG LEU A 72 23.742 8.166 -8.779 1.00 0.00 C ATOM 1087 CD1 LEU A 72 25.158 8.651 -8.447 1.00 0.00 C ATOM 1088 CD2 LEU A 72 23.806 7.043 -9.823 1.00 0.00 C ATOM 0 H LEU A 72 21.089 9.160 -7.906 1.00 0.00 H new ATOM 0 HA LEU A 72 21.492 6.542 -8.389 1.00 0.00 H new ATOM 0 HB2 LEU A 72 23.135 8.522 -6.766 1.00 0.00 H new ATOM 0 HB3 LEU A 72 23.725 6.900 -7.063 1.00 0.00 H new ATOM 0 HG LEU A 72 23.139 8.966 -9.209 1.00 0.00 H new ATOM 0 HD11 LEU A 72 25.647 8.997 -9.358 1.00 0.00 H new ATOM 0 HD12 LEU A 72 25.103 9.471 -7.731 1.00 0.00 H new ATOM 0 HD13 LEU A 72 25.732 7.831 -8.016 1.00 0.00 H new ATOM 0 HD21 LEU A 72 24.268 7.420 -10.735 1.00 0.00 H new ATOM 0 HD22 LEU A 72 24.398 6.216 -9.432 1.00 0.00 H new ATOM 0 HD23 LEU A 72 22.797 6.694 -10.045 1.00 0.00 H new ATOM 1100 N ASN A 73 21.534 7.086 -5.083 1.00 0.00 N ATOM 1101 CA ASN A 73 21.486 6.468 -3.755 1.00 0.00 C ATOM 1102 C ASN A 73 20.059 6.120 -3.303 1.00 0.00 C ATOM 1103 O ASN A 73 19.869 5.594 -2.207 1.00 0.00 O ATOM 1104 CB ASN A 73 22.200 7.355 -2.708 1.00 0.00 C ATOM 1105 CG ASN A 73 21.261 8.263 -1.908 1.00 0.00 C ATOM 1106 OD1 ASN A 73 21.026 8.045 -0.721 1.00 0.00 O ATOM 1107 ND2 ASN A 73 20.705 9.296 -2.518 1.00 0.00 N ATOM 0 H ASN A 73 21.643 8.100 -5.058 1.00 0.00 H new ATOM 0 HA ASN A 73 22.021 5.522 -3.835 1.00 0.00 H new ATOM 0 HB2 ASN A 73 22.744 6.713 -2.015 1.00 0.00 H new ATOM 0 HB3 ASN A 73 22.939 7.974 -3.216 1.00 0.00 H new ATOM 0 HD21 ASN A 73 20.079 9.915 -2.004 1.00 0.00 H new ATOM 0 HD22 ASN A 73 20.902 9.474 -3.503 1.00 0.00 H new ATOM 1114 N ASN A 74 19.058 6.413 -4.136 1.00 0.00 N ATOM 1115 CA ASN A 74 17.641 6.371 -3.791 1.00 0.00 C ATOM 1116 C ASN A 74 16.875 5.343 -4.629 1.00 0.00 C ATOM 1117 O ASN A 74 15.918 4.738 -4.154 1.00 0.00 O ATOM 1118 CB ASN A 74 17.134 7.800 -4.036 1.00 0.00 C ATOM 1119 CG ASN A 74 15.666 8.068 -3.733 1.00 0.00 C ATOM 1120 OD1 ASN A 74 14.985 7.334 -3.025 1.00 0.00 O ATOM 1121 ND2 ASN A 74 15.169 9.178 -4.254 1.00 0.00 N ATOM 0 H ASN A 74 19.221 6.696 -5.102 1.00 0.00 H new ATOM 0 HA ASN A 74 17.487 6.056 -2.759 1.00 0.00 H new ATOM 0 HB2 ASN A 74 17.735 8.482 -3.434 1.00 0.00 H new ATOM 0 HB3 ASN A 74 17.317 8.051 -5.081 1.00 0.00 H new ATOM 0 HD21 ASN A 74 14.200 9.439 -4.070 1.00 0.00 H new ATOM 0 HD22 ASN A 74 15.755 9.773 -4.840 1.00 0.00 H new ATOM 1128 N ALA A 75 17.317 5.113 -5.865 1.00 0.00 N ATOM 1129 CA ALA A 75 16.734 4.174 -6.801 1.00 0.00 C ATOM 1130 C ALA A 75 16.791 2.763 -6.223 1.00 0.00 C ATOM 1131 O ALA A 75 17.837 2.321 -5.752 1.00 0.00 O ATOM 1132 CB ALA A 75 17.427 4.313 -8.155 1.00 0.00 C ATOM 0 H ALA A 75 18.126 5.601 -6.250 1.00 0.00 H new ATOM 0 HA ALA A 75 15.679 4.393 -6.965 1.00 0.00 H new ATOM 0 HB1 ALA A 75 16.990 3.607 -8.862 1.00 0.00 H new ATOM 0 HB2 ALA A 75 17.296 5.329 -8.528 1.00 0.00 H new ATOM 0 HB3 ALA A 75 18.491 4.102 -8.043 1.00 0.00 H new ATOM 1138 N ASP A 76 15.661 2.054 -6.275 1.00 0.00 N ATOM 1139 CA ASP A 76 15.587 0.650 -5.868 1.00 0.00 C ATOM 1140 C ASP A 76 16.427 -0.230 -6.797 1.00 0.00 C ATOM 1141 O ASP A 76 16.927 -1.277 -6.388 1.00 0.00 O ATOM 1142 CB ASP A 76 14.138 0.149 -5.864 1.00 0.00 C ATOM 1143 CG ASP A 76 14.063 -1.313 -5.388 1.00 0.00 C ATOM 1144 OD1 ASP A 76 14.329 -1.574 -4.193 1.00 0.00 O ATOM 1145 OD2 ASP A 76 13.673 -2.193 -6.189 1.00 0.00 O ATOM 0 H ASP A 76 14.773 2.437 -6.600 1.00 0.00 H new ATOM 0 HA ASP A 76 15.984 0.584 -4.855 1.00 0.00 H new ATOM 0 HB2 ASP A 76 13.533 0.779 -5.212 1.00 0.00 H new ATOM 0 HB3 ASP A 76 13.718 0.231 -6.866 1.00 0.00 H new ATOM 1150 N LEU A 77 16.618 0.229 -8.039 1.00 0.00 N ATOM 1151 CA LEU A 77 17.475 -0.405 -9.030 1.00 0.00 C ATOM 1152 C LEU A 77 18.058 0.679 -9.927 1.00 0.00 C ATOM 1153 O LEU A 77 17.357 1.618 -10.307 1.00 0.00 O ATOM 1154 CB LEU A 77 16.653 -1.406 -9.867 1.00 0.00 C ATOM 1155 CG LEU A 77 17.444 -2.080 -11.011 1.00 0.00 C ATOM 1156 CD1 LEU A 77 18.603 -2.941 -10.494 1.00 0.00 C ATOM 1157 CD2 LEU A 77 16.513 -2.966 -11.836 1.00 0.00 C ATOM 0 H LEU A 77 16.166 1.075 -8.385 1.00 0.00 H new ATOM 0 HA LEU A 77 18.281 -0.949 -8.538 1.00 0.00 H new ATOM 0 HB2 LEU A 77 16.263 -2.180 -9.206 1.00 0.00 H new ATOM 0 HB3 LEU A 77 15.794 -0.887 -10.292 1.00 0.00 H new ATOM 0 HG LEU A 77 17.860 -1.278 -11.621 1.00 0.00 H new ATOM 0 HD11 LEU A 77 19.126 -3.392 -11.338 1.00 0.00 H new ATOM 0 HD12 LEU A 77 19.296 -2.317 -9.929 1.00 0.00 H new ATOM 0 HD13 LEU A 77 18.212 -3.727 -9.848 1.00 0.00 H new ATOM 0 HD21 LEU A 77 17.078 -3.438 -12.640 1.00 0.00 H new ATOM 0 HD22 LEU A 77 16.081 -3.736 -11.196 1.00 0.00 H new ATOM 0 HD23 LEU A 77 15.715 -2.358 -12.261 1.00 0.00 H new ATOM 1169 N VAL A 78 19.318 0.508 -10.309 1.00 0.00 N ATOM 1170 CA VAL A 78 19.978 1.306 -11.327 1.00 0.00 C ATOM 1171 C VAL A 78 20.321 0.328 -12.454 1.00 0.00 C ATOM 1172 O VAL A 78 20.652 -0.829 -12.194 1.00 0.00 O ATOM 1173 CB VAL A 78 21.208 2.013 -10.717 1.00 0.00 C ATOM 1174 CG1 VAL A 78 21.924 2.893 -11.750 1.00 0.00 C ATOM 1175 CG2 VAL A 78 20.813 2.905 -9.526 1.00 0.00 C ATOM 0 H VAL A 78 19.922 -0.209 -9.907 1.00 0.00 H new ATOM 0 HA VAL A 78 19.356 2.109 -11.723 1.00 0.00 H new ATOM 0 HB VAL A 78 21.877 1.220 -10.381 1.00 0.00 H new ATOM 0 HG11 VAL A 78 22.784 3.374 -11.284 1.00 0.00 H new ATOM 0 HG12 VAL A 78 22.260 2.276 -12.583 1.00 0.00 H new ATOM 0 HG13 VAL A 78 21.237 3.655 -12.118 1.00 0.00 H new ATOM 0 HG21 VAL A 78 21.703 3.387 -9.121 1.00 0.00 H new ATOM 0 HG22 VAL A 78 20.108 3.666 -9.860 1.00 0.00 H new ATOM 0 HG23 VAL A 78 20.348 2.294 -8.752 1.00 0.00 H new ATOM 1185 N VAL A 79 20.244 0.761 -13.705 1.00 0.00 N ATOM 1186 CA VAL A 79 20.516 -0.080 -14.859 1.00 0.00 C ATOM 1187 C VAL A 79 21.466 0.723 -15.735 1.00 0.00 C ATOM 1188 O VAL A 79 21.153 1.864 -16.072 1.00 0.00 O ATOM 1189 CB VAL A 79 19.201 -0.424 -15.596 1.00 0.00 C ATOM 1190 CG1 VAL A 79 19.440 -1.500 -16.666 1.00 0.00 C ATOM 1191 CG2 VAL A 79 18.075 -0.904 -14.662 1.00 0.00 C ATOM 0 H VAL A 79 19.988 1.718 -13.948 1.00 0.00 H new ATOM 0 HA VAL A 79 20.962 -1.034 -14.580 1.00 0.00 H new ATOM 0 HB VAL A 79 18.876 0.510 -16.054 1.00 0.00 H new ATOM 0 HG11 VAL A 79 18.501 -1.726 -17.171 1.00 0.00 H new ATOM 0 HG12 VAL A 79 20.165 -1.135 -17.394 1.00 0.00 H new ATOM 0 HG13 VAL A 79 19.824 -2.404 -16.193 1.00 0.00 H new ATOM 0 HG21 VAL A 79 17.185 -1.126 -15.250 1.00 0.00 H new ATOM 0 HG22 VAL A 79 18.397 -1.803 -14.136 1.00 0.00 H new ATOM 0 HG23 VAL A 79 17.846 -0.123 -13.937 1.00 0.00 H new ATOM 1201 N THR A 80 22.608 0.155 -16.109 1.00 0.00 N ATOM 1202 CA THR A 80 23.481 0.751 -17.115 1.00 0.00 C ATOM 1203 C THR A 80 23.239 0.033 -18.434 1.00 0.00 C ATOM 1204 O THR A 80 23.174 -1.196 -18.466 1.00 0.00 O ATOM 1205 CB THR A 80 24.953 0.687 -16.684 1.00 0.00 C ATOM 1206 OG1 THR A 80 25.275 -0.522 -16.015 1.00 0.00 O ATOM 1207 CG2 THR A 80 25.272 1.858 -15.758 1.00 0.00 C ATOM 0 H THR A 80 22.953 -0.725 -15.727 1.00 0.00 H new ATOM 0 HA THR A 80 23.250 1.810 -17.233 1.00 0.00 H new ATOM 0 HB THR A 80 25.550 0.737 -17.595 1.00 0.00 H new ATOM 0 HG1 THR A 80 24.888 -1.279 -16.503 1.00 0.00 H new ATOM 0 HG21 THR A 80 26.318 1.808 -15.455 1.00 0.00 H new ATOM 0 HG22 THR A 80 25.091 2.796 -16.282 1.00 0.00 H new ATOM 0 HG23 THR A 80 24.636 1.807 -14.875 1.00 0.00 H new ATOM 1215 N LEU A 81 23.118 0.790 -19.523 1.00 0.00 N ATOM 1216 CA LEU A 81 22.772 0.256 -20.846 1.00 0.00 C ATOM 1217 C LEU A 81 23.997 0.355 -21.779 1.00 0.00 C ATOM 1218 O LEU A 81 23.869 0.381 -23.007 1.00 0.00 O ATOM 1219 CB LEU A 81 21.509 0.945 -21.417 1.00 0.00 C ATOM 1220 CG LEU A 81 20.160 0.737 -20.681 1.00 0.00 C ATOM 1221 CD1 LEU A 81 20.105 1.355 -19.276 1.00 0.00 C ATOM 1222 CD2 LEU A 81 18.998 1.383 -21.448 1.00 0.00 C ATOM 0 H LEU A 81 23.258 1.800 -19.516 1.00 0.00 H new ATOM 0 HA LEU A 81 22.514 -0.799 -20.759 1.00 0.00 H new ATOM 0 HB2 LEU A 81 21.704 2.017 -21.456 1.00 0.00 H new ATOM 0 HB3 LEU A 81 21.382 0.606 -22.445 1.00 0.00 H new ATOM 0 HG LEU A 81 20.073 -0.347 -20.614 1.00 0.00 H new ATOM 0 HD11 LEU A 81 19.128 1.164 -18.832 1.00 0.00 H new ATOM 0 HD12 LEU A 81 20.880 0.910 -18.652 1.00 0.00 H new ATOM 0 HD13 LEU A 81 20.268 2.431 -19.345 1.00 0.00 H new ATOM 0 HD21 LEU A 81 18.067 1.219 -20.905 1.00 0.00 H new ATOM 0 HD22 LEU A 81 19.177 2.454 -21.545 1.00 0.00 H new ATOM 0 HD23 LEU A 81 18.923 0.936 -22.439 1.00 0.00 H new ATOM 1234 N CYS A 82 25.202 0.467 -21.206 1.00 0.00 N ATOM 1235 CA CYS A 82 26.460 0.572 -21.927 1.00 0.00 C ATOM 1236 C CYS A 82 26.772 -0.747 -22.644 1.00 0.00 C ATOM 1237 O CYS A 82 27.021 -1.761 -21.998 1.00 0.00 O ATOM 1238 CB CYS A 82 27.591 0.975 -20.963 1.00 0.00 C ATOM 1239 SG CYS A 82 27.750 -0.004 -19.436 1.00 0.00 S ATOM 0 H CYS A 82 25.323 0.487 -20.193 1.00 0.00 H new ATOM 0 HA CYS A 82 26.376 1.350 -22.686 1.00 0.00 H new ATOM 0 HB2 CYS A 82 28.536 0.918 -21.504 1.00 0.00 H new ATOM 0 HB3 CYS A 82 27.445 2.019 -20.685 1.00 0.00 H new ATOM 0 HG CYS A 82 28.743 0.451 -18.730 1.00 0.00 H new ATOM 1244 N GLY A 83 26.754 -0.746 -23.977 1.00 0.00 N ATOM 1245 CA GLY A 83 27.229 -1.845 -24.815 1.00 0.00 C ATOM 1246 C GLY A 83 27.506 -1.323 -26.229 1.00 0.00 C ATOM 1247 O GLY A 83 27.381 -2.053 -27.211 1.00 0.00 O ATOM 0 H GLY A 83 26.398 0.042 -24.518 1.00 0.00 H new ATOM 0 HA2 GLY A 83 28.136 -2.275 -24.390 1.00 0.00 H new ATOM 0 HA3 GLY A 83 26.484 -2.640 -24.848 1.00 0.00 H new ATOM 1327 N PRO A 90 28.734 4.612 -17.007 1.00 0.00 N ATOM 1328 CA PRO A 90 28.644 5.607 -15.941 1.00 0.00 C ATOM 1329 C PRO A 90 28.762 5.035 -14.518 1.00 0.00 C ATOM 1330 O PRO A 90 28.329 3.913 -14.242 1.00 0.00 O ATOM 1331 CB PRO A 90 27.302 6.307 -16.140 1.00 0.00 C ATOM 1332 CG PRO A 90 26.974 6.102 -17.614 1.00 0.00 C ATOM 1333 CD PRO A 90 27.628 4.769 -17.943 1.00 0.00 C ATOM 0 HA PRO A 90 29.492 6.288 -16.016 1.00 0.00 H new ATOM 0 HB2 PRO A 90 26.532 5.877 -15.499 1.00 0.00 H new ATOM 0 HB3 PRO A 90 27.367 7.366 -15.892 1.00 0.00 H new ATOM 0 HG2 PRO A 90 25.898 6.074 -17.785 1.00 0.00 H new ATOM 0 HG3 PRO A 90 27.374 6.908 -18.230 1.00 0.00 H new ATOM 0 HD2 PRO A 90 26.915 3.951 -17.842 1.00 0.00 H new ATOM 0 HD3 PRO A 90 27.985 4.755 -18.973 1.00 0.00 H new ATOM 1341 N MET A 91 29.327 5.841 -13.614 1.00 0.00 N ATOM 1342 CA MET A 91 29.536 5.522 -12.208 1.00 0.00 C ATOM 1343 C MET A 91 28.192 5.319 -11.503 1.00 0.00 C ATOM 1344 O MET A 91 27.256 6.100 -11.686 1.00 0.00 O ATOM 1345 CB MET A 91 30.350 6.669 -11.575 1.00 0.00 C ATOM 1346 CG MET A 91 30.710 6.491 -10.089 1.00 0.00 C ATOM 1347 SD MET A 91 29.409 6.791 -8.848 1.00 0.00 S ATOM 1348 CE MET A 91 29.015 8.539 -9.143 1.00 0.00 C ATOM 0 H MET A 91 29.664 6.772 -13.858 1.00 0.00 H new ATOM 0 HA MET A 91 30.090 4.589 -12.102 1.00 0.00 H new ATOM 0 HB2 MET A 91 31.273 6.790 -12.142 1.00 0.00 H new ATOM 0 HB3 MET A 91 29.785 7.595 -11.685 1.00 0.00 H new ATOM 0 HG2 MET A 91 31.071 5.472 -9.953 1.00 0.00 H new ATOM 0 HG3 MET A 91 31.544 7.157 -9.866 1.00 0.00 H new ATOM 0 HE1 MET A 91 28.412 8.920 -8.319 1.00 0.00 H new ATOM 0 HE2 MET A 91 29.939 9.113 -9.213 1.00 0.00 H new ATOM 0 HE3 MET A 91 28.457 8.634 -10.075 1.00 0.00 H new ATOM 1358 N THR A 92 28.139 4.302 -10.646 1.00 0.00 N ATOM 1359 CA THR A 92 27.036 3.989 -9.756 1.00 0.00 C ATOM 1360 C THR A 92 27.578 3.743 -8.334 1.00 0.00 C ATOM 1361 O THR A 92 28.732 3.319 -8.189 1.00 0.00 O ATOM 1362 CB THR A 92 26.348 2.733 -10.306 1.00 0.00 C ATOM 1363 OG1 THR A 92 27.288 1.679 -10.471 1.00 0.00 O ATOM 1364 CG2 THR A 92 25.705 2.998 -11.671 1.00 0.00 C ATOM 0 H THR A 92 28.910 3.641 -10.553 1.00 0.00 H new ATOM 0 HA THR A 92 26.322 4.811 -9.703 1.00 0.00 H new ATOM 0 HB THR A 92 25.580 2.454 -9.584 1.00 0.00 H new ATOM 0 HG1 THR A 92 27.117 0.981 -9.805 1.00 0.00 H new ATOM 0 HG21 THR A 92 25.227 2.087 -12.031 1.00 0.00 H new ATOM 0 HG22 THR A 92 24.958 3.786 -11.575 1.00 0.00 H new ATOM 0 HG23 THR A 92 26.472 3.310 -12.380 1.00 0.00 H new ATOM 1372 N PRO A 93 26.774 3.946 -7.274 1.00 0.00 N ATOM 1373 CA PRO A 93 27.173 3.592 -5.917 1.00 0.00 C ATOM 1374 C PRO A 93 27.224 2.059 -5.764 1.00 0.00 C ATOM 1375 O PRO A 93 26.378 1.361 -6.331 1.00 0.00 O ATOM 1376 CB PRO A 93 26.116 4.221 -5.004 1.00 0.00 C ATOM 1377 CG PRO A 93 24.870 4.258 -5.884 1.00 0.00 C ATOM 1378 CD PRO A 93 25.431 4.503 -7.283 1.00 0.00 C ATOM 0 HA PRO A 93 28.169 3.957 -5.665 1.00 0.00 H new ATOM 0 HB2 PRO A 93 25.956 3.626 -4.105 1.00 0.00 H new ATOM 0 HB3 PRO A 93 26.408 5.219 -4.678 1.00 0.00 H new ATOM 0 HG2 PRO A 93 24.314 3.322 -5.832 1.00 0.00 H new ATOM 0 HG3 PRO A 93 24.187 5.052 -5.580 1.00 0.00 H new ATOM 0 HD2 PRO A 93 24.813 4.022 -8.042 1.00 0.00 H new ATOM 0 HD3 PRO A 93 25.451 5.568 -7.516 1.00 0.00 H new ATOM 1386 N PRO A 94 28.159 1.512 -4.966 1.00 0.00 N ATOM 1387 CA PRO A 94 28.290 0.073 -4.762 1.00 0.00 C ATOM 1388 C PRO A 94 27.203 -0.479 -3.826 1.00 0.00 C ATOM 1389 O PRO A 94 26.911 -1.675 -3.864 1.00 0.00 O ATOM 1390 CB PRO A 94 29.688 -0.113 -4.165 1.00 0.00 C ATOM 1391 CG PRO A 94 29.904 1.177 -3.374 1.00 0.00 C ATOM 1392 CD PRO A 94 29.171 2.229 -4.208 1.00 0.00 C ATOM 0 HA PRO A 94 28.164 -0.476 -5.695 1.00 0.00 H new ATOM 0 HB2 PRO A 94 29.738 -0.992 -3.523 1.00 0.00 H new ATOM 0 HB3 PRO A 94 30.443 -0.241 -4.940 1.00 0.00 H new ATOM 0 HG2 PRO A 94 29.493 1.105 -2.367 1.00 0.00 H new ATOM 0 HG3 PRO A 94 30.963 1.413 -3.270 1.00 0.00 H new ATOM 0 HD2 PRO A 94 28.715 2.985 -3.568 1.00 0.00 H new ATOM 0 HD3 PRO A 94 29.861 2.748 -4.873 1.00 0.00 H new ATOM 1400 N HIS A 95 26.601 0.378 -2.992 1.00 0.00 N ATOM 1401 CA HIS A 95 25.608 -0.002 -1.990 1.00 0.00 C ATOM 1402 C HIS A 95 24.184 -0.056 -2.568 1.00 0.00 C ATOM 1403 O HIS A 95 23.230 -0.227 -1.806 1.00 0.00 O ATOM 1404 CB HIS A 95 25.724 0.937 -0.774 1.00 0.00 C ATOM 1405 CG HIS A 95 25.495 2.402 -1.063 1.00 0.00 C ATOM 1406 ND1 HIS A 95 26.465 3.374 -1.185 1.00 0.00 N ATOM 1407 CD2 HIS A 95 24.283 3.028 -1.187 1.00 0.00 C ATOM 1408 CE1 HIS A 95 25.850 4.552 -1.387 1.00 0.00 C ATOM 1409 NE2 HIS A 95 24.514 4.393 -1.404 1.00 0.00 N ATOM 0 H HIS A 95 26.799 1.379 -2.999 1.00 0.00 H new ATOM 0 HA HIS A 95 25.816 -1.019 -1.658 1.00 0.00 H new ATOM 0 HB2 HIS A 95 25.006 0.616 -0.019 1.00 0.00 H new ATOM 0 HB3 HIS A 95 26.717 0.821 -0.340 1.00 0.00 H new ATOM 0 HD1 HIS A 95 27.473 3.225 -1.131 1.00 0.00 H new ATOM 0 HD2 HIS A 95 23.316 2.551 -1.128 1.00 0.00 H new ATOM 0 HE1 HIS A 95 26.358 5.496 -1.518 1.00 0.00 H new ATOM 1417 N VAL A 96 24.017 0.080 -3.890 1.00 0.00 N ATOM 1418 CA VAL A 96 22.716 -0.008 -4.560 1.00 0.00 C ATOM 1419 C VAL A 96 22.769 -1.147 -5.585 1.00 0.00 C ATOM 1420 O VAL A 96 23.809 -1.388 -6.206 1.00 0.00 O ATOM 1421 CB VAL A 96 22.330 1.351 -5.182 1.00 0.00 C ATOM 1422 CG1 VAL A 96 20.923 1.341 -5.794 1.00 0.00 C ATOM 1423 CG2 VAL A 96 22.363 2.469 -4.126 1.00 0.00 C ATOM 0 H VAL A 96 24.791 0.256 -4.530 1.00 0.00 H new ATOM 0 HA VAL A 96 21.930 -0.239 -3.841 1.00 0.00 H new ATOM 0 HB VAL A 96 23.064 1.533 -5.967 1.00 0.00 H new ATOM 0 HG11 VAL A 96 20.703 2.321 -6.217 1.00 0.00 H new ATOM 0 HG12 VAL A 96 20.873 0.587 -6.580 1.00 0.00 H new ATOM 0 HG13 VAL A 96 20.191 1.107 -5.020 1.00 0.00 H new ATOM 0 HG21 VAL A 96 22.087 3.416 -4.590 1.00 0.00 H new ATOM 0 HG22 VAL A 96 21.658 2.237 -3.328 1.00 0.00 H new ATOM 0 HG23 VAL A 96 23.368 2.548 -3.711 1.00 0.00 H new ATOM 1433 N LYS A 97 21.649 -1.863 -5.749 1.00 0.00 N ATOM 1434 CA LYS A 97 21.505 -2.921 -6.739 1.00 0.00 C ATOM 1435 C LYS A 97 21.669 -2.310 -8.128 1.00 0.00 C ATOM 1436 O LYS A 97 21.116 -1.243 -8.414 1.00 0.00 O ATOM 1437 CB LYS A 97 20.133 -3.598 -6.570 1.00 0.00 C ATOM 1438 CG LYS A 97 19.997 -4.867 -7.427 1.00 0.00 C ATOM 1439 CD LYS A 97 18.639 -5.545 -7.195 1.00 0.00 C ATOM 1440 CE LYS A 97 18.525 -6.810 -8.058 1.00 0.00 C ATOM 1441 NZ LYS A 97 17.245 -7.528 -7.834 1.00 0.00 N ATOM 0 H LYS A 97 20.811 -1.716 -5.187 1.00 0.00 H new ATOM 0 HA LYS A 97 22.269 -3.687 -6.605 1.00 0.00 H new ATOM 0 HB2 LYS A 97 19.984 -3.853 -5.521 1.00 0.00 H new ATOM 0 HB3 LYS A 97 19.347 -2.893 -6.842 1.00 0.00 H new ATOM 0 HG2 LYS A 97 20.104 -4.611 -8.481 1.00 0.00 H new ATOM 0 HG3 LYS A 97 20.801 -5.562 -7.184 1.00 0.00 H new ATOM 0 HD2 LYS A 97 18.528 -5.803 -6.142 1.00 0.00 H new ATOM 0 HD3 LYS A 97 17.832 -4.854 -7.441 1.00 0.00 H new ATOM 0 HE2 LYS A 97 18.608 -6.539 -9.110 1.00 0.00 H new ATOM 0 HE3 LYS A 97 19.358 -7.477 -7.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 17.212 -8.375 -8.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 17.176 -7.811 -6.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 16.449 -6.902 -8.072 1.00 0.00 H new ATOM 1455 N ARG A 98 22.385 -3.013 -9.001 1.00 0.00 N ATOM 1456 CA ARG A 98 22.639 -2.584 -10.369 1.00 0.00 C ATOM 1457 C ARG A 98 22.381 -3.740 -11.328 1.00 0.00 C ATOM 1458 O ARG A 98 22.594 -4.902 -10.979 1.00 0.00 O ATOM 1459 CB ARG A 98 24.069 -2.020 -10.479 1.00 0.00 C ATOM 1460 CG ARG A 98 24.422 -1.533 -11.895 1.00 0.00 C ATOM 1461 CD ARG A 98 25.769 -0.814 -11.895 1.00 0.00 C ATOM 1462 NE ARG A 98 26.244 -0.545 -13.262 1.00 0.00 N ATOM 1463 CZ ARG A 98 27.499 -0.212 -13.586 1.00 0.00 C ATOM 1464 NH1 ARG A 98 28.349 0.233 -12.666 1.00 0.00 N ATOM 1465 NH2 ARG A 98 27.892 -0.346 -14.846 1.00 0.00 N ATOM 0 H ARG A 98 22.811 -3.911 -8.772 1.00 0.00 H new ATOM 0 HA ARG A 98 21.957 -1.781 -10.648 1.00 0.00 H new ATOM 0 HB2 ARG A 98 24.181 -1.192 -9.779 1.00 0.00 H new ATOM 0 HB3 ARG A 98 24.780 -2.790 -10.179 1.00 0.00 H new ATOM 0 HG2 ARG A 98 24.456 -2.381 -12.579 1.00 0.00 H new ATOM 0 HG3 ARG A 98 23.645 -0.861 -12.259 1.00 0.00 H new ATOM 0 HD2 ARG A 98 25.680 0.125 -11.350 1.00 0.00 H new ATOM 0 HD3 ARG A 98 26.505 -1.420 -11.367 1.00 0.00 H new ATOM 0 HE ARG A 98 25.565 -0.618 -14.020 1.00 0.00 H new ATOM 0 HH11 ARG A 98 28.048 0.325 -11.696 1.00 0.00 H new ATOM 0 HH12 ARG A 98 29.302 0.482 -12.930 1.00 0.00 H new ATOM 0 HH21 ARG A 98 27.241 -0.698 -15.548 1.00 0.00 H new ATOM 0 HH22 ARG A 98 28.845 -0.097 -15.112 1.00 0.00 H new ATOM 1479 N GLU A 99 21.977 -3.402 -12.547 1.00 0.00 N ATOM 1480 CA GLU A 99 21.840 -4.289 -13.691 1.00 0.00 C ATOM 1481 C GLU A 99 22.659 -3.700 -14.845 1.00 0.00 C ATOM 1482 O GLU A 99 22.937 -2.497 -14.871 1.00 0.00 O ATOM 1483 CB GLU A 99 20.353 -4.385 -14.075 1.00 0.00 C ATOM 1484 CG GLU A 99 19.613 -5.537 -13.388 1.00 0.00 C ATOM 1485 CD GLU A 99 19.899 -6.879 -14.083 1.00 0.00 C ATOM 1486 OE1 GLU A 99 19.326 -7.115 -15.172 1.00 0.00 O ATOM 1487 OE2 GLU A 99 20.693 -7.689 -13.553 1.00 0.00 O ATOM 0 H GLU A 99 21.721 -2.441 -12.775 1.00 0.00 H new ATOM 0 HA GLU A 99 22.203 -5.290 -13.459 1.00 0.00 H new ATOM 0 HB2 GLU A 99 19.860 -3.446 -13.822 1.00 0.00 H new ATOM 0 HB3 GLU A 99 20.273 -4.506 -15.155 1.00 0.00 H new ATOM 0 HG2 GLU A 99 19.916 -5.595 -12.343 1.00 0.00 H new ATOM 0 HG3 GLU A 99 18.541 -5.341 -13.399 1.00 0.00 H new ATOM 1494 N HIS A 100 23.012 -4.541 -15.818 1.00 0.00 N ATOM 1495 CA HIS A 100 23.800 -4.170 -16.985 1.00 0.00 C ATOM 1496 C HIS A 100 23.112 -4.771 -18.207 1.00 0.00 C ATOM 1497 O HIS A 100 23.044 -5.994 -18.350 1.00 0.00 O ATOM 1498 CB HIS A 100 25.245 -4.659 -16.815 1.00 0.00 C ATOM 1499 CG HIS A 100 26.075 -4.554 -18.071 1.00 0.00 C ATOM 1500 ND1 HIS A 100 26.747 -3.442 -18.527 1.00 0.00 N ATOM 1501 CD2 HIS A 100 26.304 -5.562 -18.971 1.00 0.00 C ATOM 1502 CE1 HIS A 100 27.371 -3.776 -19.670 1.00 0.00 C ATOM 1503 NE2 HIS A 100 27.127 -5.061 -19.988 1.00 0.00 N ATOM 0 H HIS A 100 22.748 -5.526 -15.812 1.00 0.00 H new ATOM 0 HA HIS A 100 23.857 -3.089 -17.109 1.00 0.00 H new ATOM 0 HB2 HIS A 100 25.724 -4.081 -16.025 1.00 0.00 H new ATOM 0 HB3 HIS A 100 25.231 -5.698 -16.486 1.00 0.00 H new ATOM 0 HD2 HIS A 100 25.917 -6.568 -18.907 1.00 0.00 H new ATOM 0 HE1 HIS A 100 27.984 -3.105 -20.253 1.00 0.00 H new ATOM 0 HE2 HIS A 100 27.471 -5.567 -20.804 1.00 0.00 H new ATOM 1511 N TRP A 101 22.558 -3.907 -19.055 1.00 0.00 N ATOM 1512 CA TRP A 101 21.761 -4.245 -20.231 1.00 0.00 C ATOM 1513 C TRP A 101 22.479 -3.631 -21.444 1.00 0.00 C ATOM 1514 O TRP A 101 21.941 -2.754 -22.114 1.00 0.00 O ATOM 1515 CB TRP A 101 20.313 -3.717 -20.085 1.00 0.00 C ATOM 1516 CG TRP A 101 19.388 -4.256 -19.024 1.00 0.00 C ATOM 1517 CD1 TRP A 101 19.710 -4.998 -17.941 1.00 0.00 C ATOM 1518 CD2 TRP A 101 17.935 -4.083 -18.941 1.00 0.00 C ATOM 1519 NE1 TRP A 101 18.593 -5.243 -17.176 1.00 0.00 N ATOM 1520 CE2 TRP A 101 17.464 -4.683 -17.733 1.00 0.00 C ATOM 1521 CE3 TRP A 101 16.962 -3.496 -19.781 1.00 0.00 C ATOM 1522 CZ2 TRP A 101 16.114 -4.654 -17.353 1.00 0.00 C ATOM 1523 CZ3 TRP A 101 15.596 -3.503 -19.435 1.00 0.00 C ATOM 1524 CH2 TRP A 101 15.175 -4.055 -18.210 1.00 0.00 C ATOM 0 H TRP A 101 22.659 -2.899 -18.933 1.00 0.00 H new ATOM 0 HA TRP A 101 21.675 -5.325 -20.354 1.00 0.00 H new ATOM 0 HB2 TRP A 101 20.381 -2.640 -19.931 1.00 0.00 H new ATOM 0 HB3 TRP A 101 19.820 -3.871 -21.045 1.00 0.00 H new ATOM 0 HD1 TRP A 101 20.705 -5.349 -17.709 1.00 0.00 H new ATOM 0 HE1 TRP A 101 18.600 -5.773 -16.305 1.00 0.00 H new ATOM 0 HE3 TRP A 101 17.271 -3.033 -20.706 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 15.800 -5.086 -16.414 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 14.868 -3.083 -20.113 1.00 0.00 H new ATOM 0 HH2 TRP A 101 14.133 -4.018 -17.930 1.00 0.00 H new ATOM 1535 N GLY A 102 23.748 -3.987 -21.670 1.00 0.00 N ATOM 1536 CA GLY A 102 24.534 -3.395 -22.737 1.00 0.00 C ATOM 1537 C GLY A 102 24.014 -3.789 -24.116 1.00 0.00 C ATOM 1538 O GLY A 102 23.791 -4.973 -24.389 1.00 0.00 O ATOM 0 H GLY A 102 24.247 -4.687 -21.121 1.00 0.00 H new ATOM 0 HA2 GLY A 102 24.518 -2.309 -22.640 1.00 0.00 H new ATOM 0 HA3 GLY A 102 25.573 -3.708 -22.638 1.00 0.00 H new ATOM 1542 N PHE A 103 23.870 -2.795 -24.989 1.00 0.00 N ATOM 1543 CA PHE A 103 23.601 -2.923 -26.415 1.00 0.00 C ATOM 1544 C PHE A 103 24.042 -1.601 -27.051 1.00 0.00 C ATOM 1545 O PHE A 103 24.217 -0.593 -26.354 1.00 0.00 O ATOM 1546 CB PHE A 103 22.123 -3.263 -26.716 1.00 0.00 C ATOM 1547 CG PHE A 103 21.096 -2.779 -25.706 1.00 0.00 C ATOM 1548 CD1 PHE A 103 20.921 -1.402 -25.480 1.00 0.00 C ATOM 1549 CD2 PHE A 103 20.343 -3.709 -24.961 1.00 0.00 C ATOM 1550 CE1 PHE A 103 20.050 -0.963 -24.470 1.00 0.00 C ATOM 1551 CE2 PHE A 103 19.458 -3.267 -23.963 1.00 0.00 C ATOM 1552 CZ PHE A 103 19.338 -1.893 -23.692 1.00 0.00 C ATOM 0 H PHE A 103 23.943 -1.820 -24.700 1.00 0.00 H new ATOM 0 HA PHE A 103 24.155 -3.761 -26.838 1.00 0.00 H new ATOM 0 HB2 PHE A 103 21.868 -2.844 -27.689 1.00 0.00 H new ATOM 0 HB3 PHE A 103 22.033 -4.346 -26.802 1.00 0.00 H new ATOM 0 HD1 PHE A 103 21.456 -0.683 -26.083 1.00 0.00 H new ATOM 0 HD2 PHE A 103 20.447 -4.766 -25.158 1.00 0.00 H new ATOM 0 HE1 PHE A 103 19.926 0.095 -24.290 1.00 0.00 H new ATOM 0 HE2 PHE A 103 18.871 -3.982 -23.405 1.00 0.00 H new ATOM 0 HZ PHE A 103 18.701 -1.553 -22.889 1.00 0.00 H new ATOM 1562 N ASP A 104 24.276 -1.617 -28.362 1.00 0.00 N ATOM 1563 CA ASP A 104 24.804 -0.465 -29.072 1.00 0.00 C ATOM 1564 C ASP A 104 23.783 0.662 -29.107 1.00 0.00 C ATOM 1565 O ASP A 104 22.579 0.433 -29.232 1.00 0.00 O ATOM 1566 CB ASP A 104 25.279 -0.838 -30.480 1.00 0.00 C ATOM 1567 CG ASP A 104 25.973 0.341 -31.190 1.00 0.00 C ATOM 1568 OD1 ASP A 104 26.684 1.120 -30.514 1.00 0.00 O ATOM 1569 OD2 ASP A 104 25.860 0.433 -32.432 1.00 0.00 O ATOM 0 H ASP A 104 24.104 -2.428 -28.956 1.00 0.00 H new ATOM 0 HA ASP A 104 25.677 -0.109 -28.526 1.00 0.00 H new ATOM 0 HB2 ASP A 104 25.969 -1.680 -30.418 1.00 0.00 H new ATOM 0 HB3 ASP A 104 24.427 -1.167 -31.074 1.00 0.00 H new ATOM 1574 N ASP A 105 24.276 1.887 -28.970 1.00 0.00 N ATOM 1575 CA ASP A 105 23.442 3.079 -29.035 1.00 0.00 C ATOM 1576 C ASP A 105 22.929 3.247 -30.465 1.00 0.00 C ATOM 1577 O ASP A 105 23.740 3.256 -31.395 1.00 0.00 O ATOM 1578 CB ASP A 105 24.207 4.335 -28.618 1.00 0.00 C ATOM 1579 CG ASP A 105 23.201 5.457 -28.354 1.00 0.00 C ATOM 1580 OD1 ASP A 105 22.662 6.015 -29.333 1.00 0.00 O ATOM 1581 OD2 ASP A 105 22.903 5.693 -27.159 1.00 0.00 O ATOM 0 H ASP A 105 25.265 2.081 -28.811 1.00 0.00 H new ATOM 0 HA ASP A 105 22.612 2.952 -28.340 1.00 0.00 H new ATOM 0 HB2 ASP A 105 24.797 4.138 -27.723 1.00 0.00 H new ATOM 0 HB3 ASP A 105 24.905 4.630 -29.402 1.00 0.00 H new ATOM 1586 N PRO A 106 21.617 3.394 -30.693 1.00 0.00 N ATOM 1587 CA PRO A 106 21.096 3.475 -32.045 1.00 0.00 C ATOM 1588 C PRO A 106 21.517 4.753 -32.783 1.00 0.00 C ATOM 1589 O PRO A 106 21.594 4.735 -34.011 1.00 0.00 O ATOM 1590 CB PRO A 106 19.588 3.334 -31.893 1.00 0.00 C ATOM 1591 CG PRO A 106 19.294 3.825 -30.475 1.00 0.00 C ATOM 1592 CD PRO A 106 20.546 3.408 -29.712 1.00 0.00 C ATOM 0 HA PRO A 106 21.507 2.688 -32.678 1.00 0.00 H new ATOM 0 HB2 PRO A 106 19.058 3.929 -32.636 1.00 0.00 H new ATOM 0 HB3 PRO A 106 19.271 2.300 -32.028 1.00 0.00 H new ATOM 0 HG2 PRO A 106 19.141 4.904 -30.443 1.00 0.00 H new ATOM 0 HG3 PRO A 106 18.396 3.363 -30.064 1.00 0.00 H new ATOM 0 HD2 PRO A 106 20.764 4.107 -28.905 1.00 0.00 H new ATOM 0 HD3 PRO A 106 20.419 2.426 -29.257 1.00 0.00 H new ATOM 1600 N ALA A 107 21.879 5.831 -32.079 1.00 0.00 N ATOM 1601 CA ALA A 107 22.463 7.011 -32.701 1.00 0.00 C ATOM 1602 C ALA A 107 23.920 6.782 -33.127 1.00 0.00 C ATOM 1603 O ALA A 107 24.479 7.616 -33.840 1.00 0.00 O ATOM 1604 CB ALA A 107 22.359 8.218 -31.766 1.00 0.00 C ATOM 0 H ALA A 107 21.774 5.904 -31.067 1.00 0.00 H new ATOM 0 HA ALA A 107 21.891 7.214 -33.607 1.00 0.00 H new ATOM 0 HB1 ALA A 107 22.801 9.090 -32.248 1.00 0.00 H new ATOM 0 HB2 ALA A 107 21.311 8.417 -31.545 1.00 0.00 H new ATOM 0 HB3 ALA A 107 22.892 8.007 -30.839 1.00 0.00 H new ATOM 1610 N ARG A 108 24.541 5.667 -32.721 1.00 0.00 N ATOM 1611 CA ARG A 108 25.928 5.312 -33.039 1.00 0.00 C ATOM 1612 C ARG A 108 25.977 4.104 -33.986 1.00 0.00 C ATOM 1613 O ARG A 108 27.072 3.723 -34.408 1.00 0.00 O ATOM 1614 CB ARG A 108 26.733 5.086 -31.738 1.00 0.00 C ATOM 1615 CG ARG A 108 26.731 6.343 -30.845 1.00 0.00 C ATOM 1616 CD ARG A 108 27.514 6.196 -29.530 1.00 0.00 C ATOM 1617 NE ARG A 108 27.453 7.458 -28.765 1.00 0.00 N ATOM 1618 CZ ARG A 108 27.394 7.602 -27.433 1.00 0.00 C ATOM 1619 NH1 ARG A 108 27.500 6.565 -26.613 1.00 0.00 N ATOM 1620 NH2 ARG A 108 27.222 8.807 -26.903 1.00 0.00 N ATOM 0 H ARG A 108 24.076 4.966 -32.144 1.00 0.00 H new ATOM 0 HA ARG A 108 26.400 6.140 -33.568 1.00 0.00 H new ATOM 0 HB2 ARG A 108 26.308 4.247 -31.187 1.00 0.00 H new ATOM 0 HB3 ARG A 108 27.760 4.817 -31.987 1.00 0.00 H new ATOM 0 HG2 ARG A 108 27.150 7.175 -31.411 1.00 0.00 H new ATOM 0 HG3 ARG A 108 25.699 6.604 -30.611 1.00 0.00 H new ATOM 0 HD2 ARG A 108 27.098 5.381 -28.938 1.00 0.00 H new ATOM 0 HD3 ARG A 108 28.552 5.938 -29.741 1.00 0.00 H new ATOM 0 HE ARG A 108 27.456 8.319 -29.313 1.00 0.00 H new ATOM 0 HH11 ARG A 108 27.630 5.627 -26.991 1.00 0.00 H new ATOM 0 HH12 ARG A 108 27.451 6.706 -25.604 1.00 0.00 H new ATOM 0 HH21 ARG A 108 27.135 9.623 -27.509 1.00 0.00 H new ATOM 0 HH22 ARG A 108 27.177 8.917 -25.890 1.00 0.00 H new ATOM 1634 N ALA A 109 24.814 3.568 -34.390 1.00 0.00 N ATOM 1635 CA ALA A 109 24.613 2.551 -35.423 1.00 0.00 C ATOM 1636 C ALA A 109 24.880 3.124 -36.827 1.00 0.00 C ATOM 1637 O ALA A 109 24.013 3.121 -37.703 1.00 0.00 O ATOM 1638 CB ALA A 109 23.193 1.980 -35.290 1.00 0.00 C ATOM 0 H ALA A 109 23.930 3.857 -33.971 1.00 0.00 H new ATOM 0 HA ALA A 109 25.328 1.740 -35.284 1.00 0.00 H new ATOM 0 HB1 ALA A 109 23.033 1.221 -36.056 1.00 0.00 H new ATOM 0 HB2 ALA A 109 23.072 1.532 -34.304 1.00 0.00 H new ATOM 0 HB3 ALA A 109 22.465 2.782 -35.416 1.00 0.00 H new ATOM 1644 N GLN A 110 26.062 3.709 -37.002 1.00 0.00 N ATOM 1645 CA GLN A 110 26.490 4.465 -38.162 1.00 0.00 C ATOM 1646 C GLN A 110 26.454 3.623 -39.441 1.00 0.00 C ATOM 1647 O GLN A 110 26.739 2.422 -39.440 1.00 0.00 O ATOM 1648 CB GLN A 110 27.880 5.064 -37.866 1.00 0.00 C ATOM 1649 CG GLN A 110 28.982 4.028 -37.560 1.00 0.00 C ATOM 1650 CD GLN A 110 30.032 4.593 -36.602 1.00 0.00 C ATOM 1651 OE1 GLN A 110 31.090 5.065 -37.014 1.00 0.00 O ATOM 1652 NE2 GLN A 110 29.764 4.565 -35.304 1.00 0.00 N ATOM 0 H GLN A 110 26.789 3.661 -36.288 1.00 0.00 H new ATOM 0 HA GLN A 110 25.793 5.282 -38.350 1.00 0.00 H new ATOM 0 HB2 GLN A 110 28.192 5.662 -38.722 1.00 0.00 H new ATOM 0 HB3 GLN A 110 27.794 5.743 -37.017 1.00 0.00 H new ATOM 0 HG2 GLN A 110 28.533 3.136 -37.124 1.00 0.00 H new ATOM 0 HG3 GLN A 110 29.463 3.722 -38.489 1.00 0.00 H new ATOM 0 HE21 GLN A 110 28.883 4.171 -34.974 1.00 0.00 H new ATOM 0 HE22 GLN A 110 30.439 4.937 -34.636 1.00 0.00 H new ATOM 1661 N GLY A 111 26.110 4.298 -40.534 1.00 0.00 N ATOM 1662 CA GLY A 111 26.006 3.757 -41.881 1.00 0.00 C ATOM 1663 C GLY A 111 25.216 4.748 -42.730 1.00 0.00 C ATOM 1664 O GLY A 111 25.724 5.254 -43.732 1.00 0.00 O ATOM 0 H GLY A 111 25.884 5.292 -40.499 1.00 0.00 H new ATOM 0 HA2 GLY A 111 26.998 3.598 -42.305 1.00 0.00 H new ATOM 0 HA3 GLY A 111 25.507 2.788 -41.864 1.00 0.00 H new ATOM 1668 N THR A 112 24.011 5.094 -42.269 1.00 0.00 N ATOM 1669 CA THR A 112 23.173 6.168 -42.787 1.00 0.00 C ATOM 1670 C THR A 112 22.077 6.435 -41.752 1.00 0.00 C ATOM 1671 O THR A 112 21.879 5.639 -40.829 1.00 0.00 O ATOM 1672 CB THR A 112 22.657 5.827 -44.210 1.00 0.00 C ATOM 1673 OG1 THR A 112 21.824 6.858 -44.702 1.00 0.00 O ATOM 1674 CG2 THR A 112 21.890 4.503 -44.302 1.00 0.00 C ATOM 0 H THR A 112 23.576 4.606 -41.486 1.00 0.00 H new ATOM 0 HA THR A 112 23.733 7.093 -42.922 1.00 0.00 H new ATOM 0 HB THR A 112 23.558 5.726 -44.816 1.00 0.00 H new ATOM 0 HG1 THR A 112 21.511 6.625 -45.601 1.00 0.00 H new ATOM 0 HG21 THR A 112 21.565 4.341 -45.330 1.00 0.00 H new ATOM 0 HG22 THR A 112 22.540 3.684 -43.994 1.00 0.00 H new ATOM 0 HG23 THR A 112 21.019 4.541 -43.648 1.00 0.00 H new ATOM 1682 N GLU A 113 21.357 7.548 -41.890 1.00 0.00 N ATOM 1683 CA GLU A 113 20.274 7.913 -40.985 1.00 0.00 C ATOM 1684 C GLU A 113 19.160 6.862 -41.002 1.00 0.00 C ATOM 1685 O GLU A 113 18.518 6.640 -39.980 1.00 0.00 O ATOM 1686 CB GLU A 113 19.752 9.325 -41.300 1.00 0.00 C ATOM 1687 CG GLU A 113 19.135 9.480 -42.700 1.00 0.00 C ATOM 1688 CD GLU A 113 18.686 10.929 -42.957 1.00 0.00 C ATOM 1689 OE1 GLU A 113 17.522 11.276 -42.654 1.00 0.00 O ATOM 1690 OE2 GLU A 113 19.486 11.737 -43.484 1.00 0.00 O ATOM 0 H GLU A 113 21.512 8.224 -42.638 1.00 0.00 H new ATOM 0 HA GLU A 113 20.667 7.935 -39.969 1.00 0.00 H new ATOM 0 HB2 GLU A 113 19.004 9.596 -40.555 1.00 0.00 H new ATOM 0 HB3 GLU A 113 20.574 10.033 -41.199 1.00 0.00 H new ATOM 0 HG2 GLU A 113 19.863 9.183 -43.455 1.00 0.00 H new ATOM 0 HG3 GLU A 113 18.281 8.810 -42.800 1.00 0.00 H new ATOM 1697 N GLU A 114 18.961 6.175 -42.131 1.00 0.00 N ATOM 1698 CA GLU A 114 17.986 5.098 -42.240 1.00 0.00 C ATOM 1699 C GLU A 114 18.443 3.874 -41.437 1.00 0.00 C ATOM 1700 O GLU A 114 17.628 3.218 -40.790 1.00 0.00 O ATOM 1701 CB GLU A 114 17.749 4.770 -43.723 1.00 0.00 C ATOM 1702 CG GLU A 114 16.643 3.726 -43.921 1.00 0.00 C ATOM 1703 CD GLU A 114 16.325 3.518 -45.413 1.00 0.00 C ATOM 1704 OE1 GLU A 114 16.969 2.665 -46.066 1.00 0.00 O ATOM 1705 OE2 GLU A 114 15.412 4.190 -45.947 1.00 0.00 O ATOM 0 H GLU A 114 19.475 6.354 -42.994 1.00 0.00 H new ATOM 0 HA GLU A 114 17.036 5.416 -41.812 1.00 0.00 H new ATOM 0 HB2 GLU A 114 17.483 5.683 -44.256 1.00 0.00 H new ATOM 0 HB3 GLU A 114 18.676 4.402 -44.164 1.00 0.00 H new ATOM 0 HG2 GLU A 114 16.951 2.779 -43.478 1.00 0.00 H new ATOM 0 HG3 GLU A 114 15.742 4.045 -43.397 1.00 0.00 H new ATOM 1712 N GLU A 115 19.747 3.586 -41.431 1.00 0.00 N ATOM 1713 CA GLU A 115 20.320 2.491 -40.661 1.00 0.00 C ATOM 1714 C GLU A 115 20.181 2.810 -39.171 1.00 0.00 C ATOM 1715 O GLU A 115 19.688 1.984 -38.404 1.00 0.00 O ATOM 1716 CB GLU A 115 21.789 2.275 -41.068 1.00 0.00 C ATOM 1717 CG GLU A 115 22.420 1.014 -40.460 1.00 0.00 C ATOM 1718 CD GLU A 115 21.851 -0.281 -41.069 1.00 0.00 C ATOM 1719 OE1 GLU A 115 22.365 -0.742 -42.113 1.00 0.00 O ATOM 1720 OE2 GLU A 115 20.899 -0.862 -40.502 1.00 0.00 O ATOM 0 H GLU A 115 20.436 4.114 -41.967 1.00 0.00 H new ATOM 0 HA GLU A 115 19.788 1.562 -40.866 1.00 0.00 H new ATOM 0 HB2 GLU A 115 21.850 2.213 -42.155 1.00 0.00 H new ATOM 0 HB3 GLU A 115 22.372 3.145 -40.765 1.00 0.00 H new ATOM 0 HG2 GLU A 115 23.499 1.041 -40.614 1.00 0.00 H new ATOM 0 HG3 GLU A 115 22.252 1.010 -39.383 1.00 0.00 H new ATOM 1727 N LYS A 116 20.530 4.041 -38.773 1.00 0.00 N ATOM 1728 CA LYS A 116 20.341 4.520 -37.410 1.00 0.00 C ATOM 1729 C LYS A 116 18.875 4.401 -37.004 1.00 0.00 C ATOM 1730 O LYS A 116 18.583 3.839 -35.952 1.00 0.00 O ATOM 1731 CB LYS A 116 20.857 5.963 -37.277 1.00 0.00 C ATOM 1732 CG LYS A 116 22.391 6.036 -37.281 1.00 0.00 C ATOM 1733 CD LYS A 116 22.868 7.457 -36.950 1.00 0.00 C ATOM 1734 CE LYS A 116 24.398 7.544 -37.043 1.00 0.00 C ATOM 1735 NZ LYS A 116 24.928 8.768 -36.391 1.00 0.00 N ATOM 0 H LYS A 116 20.953 4.730 -39.395 1.00 0.00 H new ATOM 0 HA LYS A 116 20.921 3.898 -36.728 1.00 0.00 H new ATOM 0 HB2 LYS A 116 20.465 6.564 -38.097 1.00 0.00 H new ATOM 0 HB3 LYS A 116 20.477 6.399 -36.353 1.00 0.00 H new ATOM 0 HG2 LYS A 116 22.795 5.333 -36.553 1.00 0.00 H new ATOM 0 HG3 LYS A 116 22.772 5.738 -38.258 1.00 0.00 H new ATOM 0 HD2 LYS A 116 22.414 8.169 -37.639 1.00 0.00 H new ATOM 0 HD3 LYS A 116 22.542 7.732 -35.947 1.00 0.00 H new ATOM 0 HE2 LYS A 116 24.840 6.664 -36.575 1.00 0.00 H new ATOM 0 HE3 LYS A 116 24.698 7.533 -38.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 25.918 8.912 -36.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 24.361 9.590 -36.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 24.877 8.661 -35.358 1.00 0.00 H new ATOM 1749 N TRP A 117 17.942 4.871 -37.832 1.00 0.00 N ATOM 1750 CA TRP A 117 16.510 4.803 -37.557 1.00 0.00 C ATOM 1751 C TRP A 117 16.019 3.355 -37.419 1.00 0.00 C ATOM 1752 O TRP A 117 15.176 3.067 -36.564 1.00 0.00 O ATOM 1753 CB TRP A 117 15.752 5.561 -38.657 1.00 0.00 C ATOM 1754 CG TRP A 117 14.265 5.375 -38.686 1.00 0.00 C ATOM 1755 CD1 TRP A 117 13.561 4.953 -39.760 1.00 0.00 C ATOM 1756 CD2 TRP A 117 13.289 5.510 -37.605 1.00 0.00 C ATOM 1757 NE1 TRP A 117 12.233 4.814 -39.425 1.00 0.00 N ATOM 1758 CE2 TRP A 117 12.004 5.138 -38.104 1.00 0.00 C ATOM 1759 CE3 TRP A 117 13.365 5.859 -36.239 1.00 0.00 C ATOM 1760 CZ2 TRP A 117 10.866 5.083 -37.284 1.00 0.00 C ATOM 1761 CZ3 TRP A 117 12.234 5.799 -35.407 1.00 0.00 C ATOM 1762 CH2 TRP A 117 10.986 5.401 -35.922 1.00 0.00 C ATOM 0 H TRP A 117 18.164 5.315 -38.723 1.00 0.00 H new ATOM 0 HA TRP A 117 16.312 5.278 -36.596 1.00 0.00 H new ATOM 0 HB2 TRP A 117 15.962 6.625 -38.547 1.00 0.00 H new ATOM 0 HB3 TRP A 117 16.154 5.255 -39.623 1.00 0.00 H new ATOM 0 HD1 TRP A 117 13.978 4.754 -40.736 1.00 0.00 H new ATOM 0 HE1 TRP A 117 11.508 4.509 -40.074 1.00 0.00 H new ATOM 0 HE3 TRP A 117 14.310 6.178 -35.826 1.00 0.00 H new ATOM 0 HZ2 TRP A 117 9.909 4.799 -37.696 1.00 0.00 H new ATOM 0 HZ3 TRP A 117 12.323 6.061 -34.363 1.00 0.00 H new ATOM 0 HH2 TRP A 117 10.125 5.341 -35.273 1.00 0.00 H new ATOM 1773 N ALA A 118 16.537 2.423 -38.222 1.00 0.00 N ATOM 1774 CA ALA A 118 16.164 1.022 -38.113 1.00 0.00 C ATOM 1775 C ALA A 118 16.692 0.443 -36.799 1.00 0.00 C ATOM 1776 O ALA A 118 15.967 -0.250 -36.084 1.00 0.00 O ATOM 1777 CB ALA A 118 16.672 0.247 -39.331 1.00 0.00 C ATOM 0 H ALA A 118 17.218 2.620 -38.955 1.00 0.00 H new ATOM 0 HA ALA A 118 15.078 0.930 -38.099 1.00 0.00 H new ATOM 0 HB1 ALA A 118 16.388 -0.801 -39.240 1.00 0.00 H new ATOM 0 HB2 ALA A 118 16.233 0.665 -40.237 1.00 0.00 H new ATOM 0 HB3 ALA A 118 17.758 0.325 -39.385 1.00 0.00 H new ATOM 1783 N PHE A 119 17.932 0.779 -36.444 1.00 0.00 N ATOM 1784 CA PHE A 119 18.537 0.349 -35.195 1.00 0.00 C ATOM 1785 C PHE A 119 17.806 0.949 -33.992 1.00 0.00 C ATOM 1786 O PHE A 119 17.677 0.283 -32.970 1.00 0.00 O ATOM 1787 CB PHE A 119 20.038 0.662 -35.178 1.00 0.00 C ATOM 1788 CG PHE A 119 20.855 -0.393 -34.456 1.00 0.00 C ATOM 1789 CD1 PHE A 119 21.084 -0.301 -33.070 1.00 0.00 C ATOM 1790 CD2 PHE A 119 21.380 -1.487 -35.173 1.00 0.00 C ATOM 1791 CE1 PHE A 119 21.832 -1.291 -32.407 1.00 0.00 C ATOM 1792 CE2 PHE A 119 22.128 -2.476 -34.511 1.00 0.00 C ATOM 1793 CZ PHE A 119 22.355 -2.379 -33.126 1.00 0.00 C ATOM 0 H PHE A 119 18.542 1.359 -37.020 1.00 0.00 H new ATOM 0 HA PHE A 119 18.434 -0.733 -35.119 1.00 0.00 H new ATOM 0 HB2 PHE A 119 20.396 0.752 -36.203 1.00 0.00 H new ATOM 0 HB3 PHE A 119 20.197 1.628 -34.698 1.00 0.00 H new ATOM 0 HD1 PHE A 119 20.684 0.533 -32.513 1.00 0.00 H new ATOM 0 HD2 PHE A 119 21.207 -1.566 -36.236 1.00 0.00 H new ATOM 0 HE1 PHE A 119 22.005 -1.215 -31.344 1.00 0.00 H new ATOM 0 HE2 PHE A 119 22.529 -3.311 -35.066 1.00 0.00 H new ATOM 0 HZ PHE A 119 22.930 -3.139 -32.617 1.00 0.00 H new ATOM 1803 N PHE A 120 17.274 2.169 -34.112 1.00 0.00 N ATOM 1804 CA PHE A 120 16.440 2.794 -33.089 1.00 0.00 C ATOM 1805 C PHE A 120 15.232 1.924 -32.796 1.00 0.00 C ATOM 1806 O PHE A 120 14.996 1.603 -31.635 1.00 0.00 O ATOM 1807 CB PHE A 120 16.012 4.217 -33.503 1.00 0.00 C ATOM 1808 CG PHE A 120 16.776 5.326 -32.812 1.00 0.00 C ATOM 1809 CD1 PHE A 120 16.481 5.632 -31.472 1.00 0.00 C ATOM 1810 CD2 PHE A 120 17.787 6.040 -33.486 1.00 0.00 C ATOM 1811 CE1 PHE A 120 17.197 6.639 -30.807 1.00 0.00 C ATOM 1812 CE2 PHE A 120 18.503 7.049 -32.819 1.00 0.00 C ATOM 1813 CZ PHE A 120 18.199 7.356 -31.483 1.00 0.00 C ATOM 0 H PHE A 120 17.414 2.756 -34.935 1.00 0.00 H new ATOM 0 HA PHE A 120 17.030 2.887 -32.177 1.00 0.00 H new ATOM 0 HB2 PHE A 120 16.138 4.322 -34.581 1.00 0.00 H new ATOM 0 HB3 PHE A 120 14.949 4.339 -33.293 1.00 0.00 H new ATOM 0 HD1 PHE A 120 15.703 5.092 -30.954 1.00 0.00 H new ATOM 0 HD2 PHE A 120 18.012 5.811 -34.517 1.00 0.00 H new ATOM 0 HE1 PHE A 120 16.978 6.864 -29.774 1.00 0.00 H new ATOM 0 HE2 PHE A 120 19.286 7.587 -33.333 1.00 0.00 H new ATOM 0 HZ PHE A 120 18.735 8.144 -30.975 1.00 0.00 H new ATOM 1823 N GLN A 121 14.499 1.492 -33.821 1.00 0.00 N ATOM 1824 CA GLN A 121 13.325 0.646 -33.631 1.00 0.00 C ATOM 1825 C GLN A 121 13.702 -0.717 -33.046 1.00 0.00 C ATOM 1826 O GLN A 121 12.946 -1.251 -32.229 1.00 0.00 O ATOM 1827 CB GLN A 121 12.593 0.486 -34.966 1.00 0.00 C ATOM 1828 CG GLN A 121 11.862 1.775 -35.361 1.00 0.00 C ATOM 1829 CD GLN A 121 11.606 1.789 -36.865 1.00 0.00 C ATOM 1830 OE1 GLN A 121 10.546 1.396 -37.346 1.00 0.00 O ATOM 1831 NE2 GLN A 121 12.600 2.204 -37.633 1.00 0.00 N ATOM 0 H GLN A 121 14.700 1.716 -34.796 1.00 0.00 H new ATOM 0 HA GLN A 121 12.662 1.127 -32.913 1.00 0.00 H new ATOM 0 HB2 GLN A 121 13.307 0.218 -35.744 1.00 0.00 H new ATOM 0 HB3 GLN A 121 11.877 -0.333 -34.894 1.00 0.00 H new ATOM 0 HG2 GLN A 121 10.917 1.847 -34.822 1.00 0.00 H new ATOM 0 HG3 GLN A 121 12.458 2.642 -35.077 1.00 0.00 H new ATOM 0 HE21 GLN A 121 13.471 2.526 -37.211 1.00 0.00 H new ATOM 0 HE22 GLN A 121 12.496 2.202 -38.648 1.00 0.00 H new ATOM 1840 N ARG A 122 14.862 -1.267 -33.416 1.00 0.00 N ATOM 1841 CA ARG A 122 15.348 -2.525 -32.847 1.00 0.00 C ATOM 1842 C ARG A 122 15.673 -2.356 -31.367 1.00 0.00 C ATOM 1843 O ARG A 122 15.165 -3.124 -30.552 1.00 0.00 O ATOM 1844 CB ARG A 122 16.575 -3.029 -33.627 1.00 0.00 C ATOM 1845 CG ARG A 122 16.211 -3.547 -35.029 1.00 0.00 C ATOM 1846 CD ARG A 122 17.445 -3.757 -35.920 1.00 0.00 C ATOM 1847 NE ARG A 122 18.416 -4.704 -35.338 1.00 0.00 N ATOM 1848 CZ ARG A 122 19.621 -4.995 -35.846 1.00 0.00 C ATOM 1849 NH1 ARG A 122 20.031 -4.443 -36.987 1.00 0.00 N ATOM 1850 NH2 ARG A 122 20.416 -5.847 -35.206 1.00 0.00 N ATOM 0 H ARG A 122 15.485 -0.857 -34.112 1.00 0.00 H new ATOM 0 HA ARG A 122 14.559 -3.272 -32.934 1.00 0.00 H new ATOM 0 HB2 ARG A 122 17.300 -2.220 -33.719 1.00 0.00 H new ATOM 0 HB3 ARG A 122 17.057 -3.827 -33.063 1.00 0.00 H new ATOM 0 HG2 ARG A 122 15.671 -4.489 -34.935 1.00 0.00 H new ATOM 0 HG3 ARG A 122 15.536 -2.839 -35.510 1.00 0.00 H new ATOM 0 HD2 ARG A 122 17.125 -4.125 -36.895 1.00 0.00 H new ATOM 0 HD3 ARG A 122 17.935 -2.798 -36.086 1.00 0.00 H new ATOM 0 HE ARG A 122 18.147 -5.177 -34.476 1.00 0.00 H new ATOM 0 HH11 ARG A 122 19.425 -3.790 -37.484 1.00 0.00 H new ATOM 0 HH12 ARG A 122 20.951 -4.673 -37.363 1.00 0.00 H new ATOM 0 HH21 ARG A 122 20.107 -6.275 -34.333 1.00 0.00 H new ATOM 0 HH22 ARG A 122 21.335 -6.073 -35.588 1.00 0.00 H new ATOM 1864 N VAL A 123 16.461 -1.345 -30.995 1.00 0.00 N ATOM 1865 CA VAL A 123 16.843 -1.133 -29.603 1.00 0.00 C ATOM 1866 C VAL A 123 15.596 -0.784 -28.789 1.00 0.00 C ATOM 1867 O VAL A 123 15.427 -1.315 -27.695 1.00 0.00 O ATOM 1868 CB VAL A 123 17.958 -0.069 -29.530 1.00 0.00 C ATOM 1869 CG1 VAL A 123 18.281 0.370 -28.098 1.00 0.00 C ATOM 1870 CG2 VAL A 123 19.255 -0.621 -30.140 1.00 0.00 C ATOM 0 H VAL A 123 16.847 -0.659 -31.644 1.00 0.00 H new ATOM 0 HA VAL A 123 17.259 -2.040 -29.163 1.00 0.00 H new ATOM 0 HB VAL A 123 17.583 0.792 -30.083 1.00 0.00 H new ATOM 0 HG11 VAL A 123 19.073 1.119 -28.117 1.00 0.00 H new ATOM 0 HG12 VAL A 123 17.389 0.796 -27.638 1.00 0.00 H new ATOM 0 HG13 VAL A 123 18.611 -0.492 -27.519 1.00 0.00 H new ATOM 0 HG21 VAL A 123 20.035 0.138 -30.083 1.00 0.00 H new ATOM 0 HG22 VAL A 123 19.569 -1.506 -29.587 1.00 0.00 H new ATOM 0 HG23 VAL A 123 19.082 -0.887 -31.183 1.00 0.00 H new ATOM 1880 N ARG A 124 14.682 0.027 -29.333 1.00 0.00 N ATOM 1881 CA ARG A 124 13.389 0.332 -28.729 1.00 0.00 C ATOM 1882 C ARG A 124 12.663 -0.968 -28.404 1.00 0.00 C ATOM 1883 O ARG A 124 12.229 -1.146 -27.270 1.00 0.00 O ATOM 1884 CB ARG A 124 12.604 1.207 -29.725 1.00 0.00 C ATOM 1885 CG ARG A 124 11.095 1.374 -29.469 1.00 0.00 C ATOM 1886 CD ARG A 124 10.273 1.347 -30.769 1.00 0.00 C ATOM 1887 NE ARG A 124 10.410 0.077 -31.514 1.00 0.00 N ATOM 1888 CZ ARG A 124 9.690 -0.304 -32.577 1.00 0.00 C ATOM 1889 NH1 ARG A 124 8.699 0.456 -33.031 1.00 0.00 N ATOM 1890 NH2 ARG A 124 9.994 -1.443 -33.190 1.00 0.00 N ATOM 0 H ARG A 124 14.828 0.498 -30.226 1.00 0.00 H new ATOM 0 HA ARG A 124 13.499 0.878 -27.792 1.00 0.00 H new ATOM 0 HB2 ARG A 124 13.058 2.198 -29.736 1.00 0.00 H new ATOM 0 HB3 ARG A 124 12.734 0.786 -30.722 1.00 0.00 H new ATOM 0 HG2 ARG A 124 10.751 0.578 -28.808 1.00 0.00 H new ATOM 0 HG3 ARG A 124 10.919 2.317 -28.951 1.00 0.00 H new ATOM 0 HD2 ARG A 124 9.222 1.510 -30.531 1.00 0.00 H new ATOM 0 HD3 ARG A 124 10.587 2.172 -31.408 1.00 0.00 H new ATOM 0 HE ARG A 124 11.124 -0.573 -31.186 1.00 0.00 H new ATOM 0 HH11 ARG A 124 8.481 1.339 -32.569 1.00 0.00 H new ATOM 0 HH12 ARG A 124 8.157 0.157 -33.841 1.00 0.00 H new ATOM 0 HH21 ARG A 124 10.767 -2.015 -32.850 1.00 0.00 H new ATOM 0 HH22 ARG A 124 9.454 -1.746 -34.001 1.00 0.00 H new ATOM 1904 N ASP A 125 12.502 -1.847 -29.394 1.00 0.00 N ATOM 1905 CA ASP A 125 11.715 -3.061 -29.214 1.00 0.00 C ATOM 1906 C ASP A 125 12.360 -3.984 -28.180 1.00 0.00 C ATOM 1907 O ASP A 125 11.672 -4.505 -27.303 1.00 0.00 O ATOM 1908 CB ASP A 125 11.552 -3.799 -30.547 1.00 0.00 C ATOM 1909 CG ASP A 125 10.818 -5.134 -30.351 1.00 0.00 C ATOM 1910 OD1 ASP A 125 9.597 -5.122 -30.085 1.00 0.00 O ATOM 1911 OD2 ASP A 125 11.454 -6.202 -30.496 1.00 0.00 O ATOM 0 H ASP A 125 12.906 -1.739 -30.324 1.00 0.00 H new ATOM 0 HA ASP A 125 10.730 -2.770 -28.849 1.00 0.00 H new ATOM 0 HB2 ASP A 125 10.997 -3.174 -31.247 1.00 0.00 H new ATOM 0 HB3 ASP A 125 12.532 -3.980 -30.989 1.00 0.00 H new ATOM 1916 N GLU A 126 13.679 -4.178 -28.243 1.00 0.00 N ATOM 1917 CA GLU A 126 14.381 -5.064 -27.323 1.00 0.00 C ATOM 1918 C GLU A 126 14.344 -4.518 -25.889 1.00 0.00 C ATOM 1919 O GLU A 126 14.125 -5.287 -24.950 1.00 0.00 O ATOM 1920 CB GLU A 126 15.824 -5.289 -27.789 1.00 0.00 C ATOM 1921 CG GLU A 126 15.897 -6.172 -29.045 1.00 0.00 C ATOM 1922 CD GLU A 126 17.353 -6.442 -29.465 1.00 0.00 C ATOM 1923 OE1 GLU A 126 17.983 -7.377 -28.919 1.00 0.00 O ATOM 1924 OE2 GLU A 126 17.876 -5.744 -30.363 1.00 0.00 O ATOM 0 H GLU A 126 14.284 -3.727 -28.930 1.00 0.00 H new ATOM 0 HA GLU A 126 13.868 -6.026 -27.322 1.00 0.00 H new ATOM 0 HB2 GLU A 126 16.292 -4.326 -27.996 1.00 0.00 H new ATOM 0 HB3 GLU A 126 16.395 -5.755 -26.986 1.00 0.00 H new ATOM 0 HG2 GLU A 126 15.391 -7.119 -28.855 1.00 0.00 H new ATOM 0 HG3 GLU A 126 15.366 -5.686 -29.863 1.00 0.00 H new ATOM 1931 N ILE A 127 14.494 -3.200 -25.715 1.00 0.00 N ATOM 1932 CA ILE A 127 14.335 -2.539 -24.425 1.00 0.00 C ATOM 1933 C ILE A 127 12.921 -2.806 -23.914 1.00 0.00 C ATOM 1934 O ILE A 127 12.777 -3.270 -22.784 1.00 0.00 O ATOM 1935 CB ILE A 127 14.662 -1.031 -24.552 1.00 0.00 C ATOM 1936 CG1 ILE A 127 16.193 -0.840 -24.635 1.00 0.00 C ATOM 1937 CG2 ILE A 127 14.113 -0.197 -23.385 1.00 0.00 C ATOM 1938 CD1 ILE A 127 16.628 0.606 -24.908 1.00 0.00 C ATOM 0 H ILE A 127 14.731 -2.562 -26.474 1.00 0.00 H new ATOM 0 HA ILE A 127 15.036 -2.939 -23.693 1.00 0.00 H new ATOM 0 HB ILE A 127 14.175 -0.677 -25.461 1.00 0.00 H new ATOM 0 HG12 ILE A 127 16.642 -1.173 -23.699 1.00 0.00 H new ATOM 0 HG13 ILE A 127 16.587 -1.482 -25.423 1.00 0.00 H new ATOM 0 HG21 ILE A 127 14.375 0.851 -23.532 1.00 0.00 H new ATOM 0 HG22 ILE A 127 13.028 -0.298 -23.344 1.00 0.00 H new ATOM 0 HG23 ILE A 127 14.546 -0.551 -22.449 1.00 0.00 H new ATOM 0 HD11 ILE A 127 17.716 0.657 -24.952 1.00 0.00 H new ATOM 0 HD12 ILE A 127 16.211 0.938 -25.859 1.00 0.00 H new ATOM 0 HD13 ILE A 127 16.267 1.252 -24.108 1.00 0.00 H new ATOM 1950 N GLY A 128 11.894 -2.558 -24.734 1.00 0.00 N ATOM 1951 CA GLY A 128 10.507 -2.798 -24.371 1.00 0.00 C ATOM 1952 C GLY A 128 10.296 -4.228 -23.883 1.00 0.00 C ATOM 1953 O GLY A 128 9.689 -4.430 -22.832 1.00 0.00 O ATOM 0 H GLY A 128 12.011 -2.182 -25.675 1.00 0.00 H new ATOM 0 HA2 GLY A 128 10.208 -2.098 -23.591 1.00 0.00 H new ATOM 0 HA3 GLY A 128 9.866 -2.608 -25.232 1.00 0.00 H new ATOM 1957 N ASN A 129 10.853 -5.214 -24.593 1.00 0.00 N ATOM 1958 CA ASN A 129 10.725 -6.618 -24.218 1.00 0.00 C ATOM 1959 C ASN A 129 11.322 -6.874 -22.845 1.00 0.00 C ATOM 1960 O ASN A 129 10.665 -7.465 -21.990 1.00 0.00 O ATOM 1961 CB ASN A 129 11.381 -7.561 -25.243 1.00 0.00 C ATOM 1962 CG ASN A 129 10.468 -7.861 -26.423 1.00 0.00 C ATOM 1963 OD1 ASN A 129 9.704 -8.822 -26.407 1.00 0.00 O ATOM 1964 ND2 ASN A 129 10.526 -7.054 -27.464 1.00 0.00 N ATOM 0 H ASN A 129 11.402 -5.059 -25.439 1.00 0.00 H new ATOM 0 HA ASN A 129 9.656 -6.832 -24.196 1.00 0.00 H new ATOM 0 HB2 ASN A 129 12.305 -7.111 -25.607 1.00 0.00 H new ATOM 0 HB3 ASN A 129 11.653 -8.495 -24.751 1.00 0.00 H new ATOM 0 HD21 ASN A 129 9.930 -7.223 -28.274 1.00 0.00 H new ATOM 0 HD22 ASN A 129 11.167 -6.261 -27.459 1.00 0.00 H new ATOM 1971 N ARG A 130 12.556 -6.432 -22.600 1.00 0.00 N ATOM 1972 CA ARG A 130 13.191 -6.729 -21.322 1.00 0.00 C ATOM 1973 C ARG A 130 12.512 -5.941 -20.202 1.00 0.00 C ATOM 1974 O ARG A 130 12.385 -6.471 -19.101 1.00 0.00 O ATOM 1975 CB ARG A 130 14.708 -6.498 -21.408 1.00 0.00 C ATOM 1976 CG ARG A 130 15.453 -6.879 -20.117 1.00 0.00 C ATOM 1977 CD ARG A 130 15.413 -8.364 -19.717 1.00 0.00 C ATOM 1978 NE ARG A 130 15.868 -8.543 -18.327 1.00 0.00 N ATOM 1979 CZ ARG A 130 17.097 -8.338 -17.839 1.00 0.00 C ATOM 1980 NH1 ARG A 130 18.134 -8.114 -18.644 1.00 0.00 N ATOM 1981 NH2 ARG A 130 17.279 -8.355 -16.527 1.00 0.00 N ATOM 0 H ARG A 130 13.119 -5.883 -23.250 1.00 0.00 H new ATOM 0 HA ARG A 130 13.061 -7.784 -21.079 1.00 0.00 H new ATOM 0 HB2 ARG A 130 15.111 -7.079 -22.237 1.00 0.00 H new ATOM 0 HB3 ARG A 130 14.897 -5.448 -21.633 1.00 0.00 H new ATOM 0 HG2 ARG A 130 16.496 -6.582 -20.224 1.00 0.00 H new ATOM 0 HG3 ARG A 130 15.038 -6.293 -19.297 1.00 0.00 H new ATOM 0 HD2 ARG A 130 14.398 -8.747 -19.825 1.00 0.00 H new ATOM 0 HD3 ARG A 130 16.046 -8.944 -20.389 1.00 0.00 H new ATOM 0 HE ARG A 130 15.165 -8.860 -17.660 1.00 0.00 H new ATOM 0 HH11 ARG A 130 18.000 -8.096 -19.655 1.00 0.00 H new ATOM 0 HH12 ARG A 130 19.062 -7.960 -18.250 1.00 0.00 H new ATOM 0 HH21 ARG A 130 16.488 -8.523 -15.905 1.00 0.00 H new ATOM 0 HH22 ARG A 130 18.210 -8.200 -16.139 1.00 0.00 H new ATOM 1995 N LEU A 131 12.017 -4.724 -20.461 1.00 0.00 N ATOM 1996 CA LEU A 131 11.281 -3.965 -19.456 1.00 0.00 C ATOM 1997 C LEU A 131 9.998 -4.704 -19.080 1.00 0.00 C ATOM 1998 O LEU A 131 9.647 -4.760 -17.901 1.00 0.00 O ATOM 1999 CB LEU A 131 10.951 -2.537 -19.927 1.00 0.00 C ATOM 2000 CG LEU A 131 11.343 -1.436 -18.928 1.00 0.00 C ATOM 2001 CD1 LEU A 131 10.862 -1.703 -17.494 1.00 0.00 C ATOM 2002 CD2 LEU A 131 12.849 -1.168 -18.953 1.00 0.00 C ATOM 0 H LEU A 131 12.115 -4.249 -21.358 1.00 0.00 H new ATOM 0 HA LEU A 131 11.924 -3.876 -18.580 1.00 0.00 H new ATOM 0 HB2 LEU A 131 11.461 -2.352 -20.873 1.00 0.00 H new ATOM 0 HB3 LEU A 131 9.881 -2.470 -20.123 1.00 0.00 H new ATOM 0 HG LEU A 131 10.821 -0.540 -19.263 1.00 0.00 H new ATOM 0 HD11 LEU A 131 11.176 -0.884 -16.847 1.00 0.00 H new ATOM 0 HD12 LEU A 131 9.775 -1.778 -17.483 1.00 0.00 H new ATOM 0 HD13 LEU A 131 11.294 -2.636 -17.133 1.00 0.00 H new ATOM 0 HD21 LEU A 131 13.091 -0.384 -18.235 1.00 0.00 H new ATOM 0 HD22 LEU A 131 13.385 -2.080 -18.690 1.00 0.00 H new ATOM 0 HD23 LEU A 131 13.145 -0.849 -19.952 1.00 0.00 H new ATOM 2014 N LYS A 132 9.314 -5.295 -20.068 1.00 0.00 N ATOM 2015 CA LYS A 132 8.122 -6.096 -19.826 1.00 0.00 C ATOM 2016 C LYS A 132 8.459 -7.230 -18.879 1.00 0.00 C ATOM 2017 O LYS A 132 7.793 -7.391 -17.862 1.00 0.00 O ATOM 2018 CB LYS A 132 7.533 -6.606 -21.151 1.00 0.00 C ATOM 2019 CG LYS A 132 6.222 -7.378 -20.946 1.00 0.00 C ATOM 2020 CD LYS A 132 5.631 -7.784 -22.306 1.00 0.00 C ATOM 2021 CE LYS A 132 4.387 -8.677 -22.171 1.00 0.00 C ATOM 2022 NZ LYS A 132 3.209 -7.965 -21.610 1.00 0.00 N ATOM 0 H LYS A 132 9.575 -5.228 -21.052 1.00 0.00 H new ATOM 0 HA LYS A 132 7.356 -5.479 -19.356 1.00 0.00 H new ATOM 0 HB2 LYS A 132 7.354 -5.761 -21.816 1.00 0.00 H new ATOM 0 HB3 LYS A 132 8.259 -7.252 -21.644 1.00 0.00 H new ATOM 0 HG2 LYS A 132 6.404 -8.266 -20.340 1.00 0.00 H new ATOM 0 HG3 LYS A 132 5.509 -6.761 -20.400 1.00 0.00 H new ATOM 0 HD2 LYS A 132 5.369 -6.886 -22.866 1.00 0.00 H new ATOM 0 HD3 LYS A 132 6.390 -8.311 -22.884 1.00 0.00 H new ATOM 0 HE2 LYS A 132 4.128 -9.077 -23.151 1.00 0.00 H new ATOM 0 HE3 LYS A 132 4.627 -9.527 -21.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 2.405 -8.622 -21.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 3.440 -7.605 -20.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 2.957 -7.169 -22.230 1.00 0.00 H new ATOM 2036 N GLU A 133 9.507 -7.993 -19.181 1.00 0.00 N ATOM 2037 CA GLU A 133 9.866 -9.140 -18.356 1.00 0.00 C ATOM 2038 C GLU A 133 10.287 -8.705 -16.958 1.00 0.00 C ATOM 2039 O GLU A 133 9.963 -9.383 -15.984 1.00 0.00 O ATOM 2040 CB GLU A 133 10.973 -9.996 -18.975 1.00 0.00 C ATOM 2041 CG GLU A 133 10.555 -10.578 -20.328 1.00 0.00 C ATOM 2042 CD GLU A 133 11.633 -11.518 -20.898 1.00 0.00 C ATOM 2043 OE1 GLU A 133 12.659 -11.031 -21.425 1.00 0.00 O ATOM 2044 OE2 GLU A 133 11.453 -12.756 -20.847 1.00 0.00 O ATOM 0 H GLU A 133 10.117 -7.839 -19.984 1.00 0.00 H new ATOM 0 HA GLU A 133 8.966 -9.752 -18.293 1.00 0.00 H new ATOM 0 HB2 GLU A 133 11.871 -9.392 -19.102 1.00 0.00 H new ATOM 0 HB3 GLU A 133 11.228 -10.808 -18.294 1.00 0.00 H new ATOM 0 HG2 GLU A 133 9.618 -11.123 -20.216 1.00 0.00 H new ATOM 0 HG3 GLU A 133 10.370 -9.767 -21.032 1.00 0.00 H new ATOM 2051 N PHE A 134 10.959 -7.569 -16.829 1.00 0.00 N ATOM 2052 CA PHE A 134 11.365 -7.045 -15.540 1.00 0.00 C ATOM 2053 C PHE A 134 10.150 -6.702 -14.681 1.00 0.00 C ATOM 2054 O PHE A 134 10.168 -6.931 -13.471 1.00 0.00 O ATOM 2055 CB PHE A 134 12.278 -5.833 -15.758 1.00 0.00 C ATOM 2056 CG PHE A 134 12.559 -5.029 -14.507 1.00 0.00 C ATOM 2057 CD1 PHE A 134 13.408 -5.544 -13.509 1.00 0.00 C ATOM 2058 CD2 PHE A 134 11.941 -3.779 -14.323 1.00 0.00 C ATOM 2059 CE1 PHE A 134 13.637 -4.804 -12.336 1.00 0.00 C ATOM 2060 CE2 PHE A 134 12.192 -3.025 -13.165 1.00 0.00 C ATOM 2061 CZ PHE A 134 13.040 -3.540 -12.169 1.00 0.00 C ATOM 0 H PHE A 134 11.237 -6.987 -17.619 1.00 0.00 H new ATOM 0 HA PHE A 134 11.924 -7.806 -14.994 1.00 0.00 H new ATOM 0 HB2 PHE A 134 13.225 -6.177 -16.175 1.00 0.00 H new ATOM 0 HB3 PHE A 134 11.822 -5.179 -16.501 1.00 0.00 H new ATOM 0 HD1 PHE A 134 13.882 -6.505 -13.644 1.00 0.00 H new ATOM 0 HD2 PHE A 134 11.269 -3.397 -15.077 1.00 0.00 H new ATOM 0 HE1 PHE A 134 14.273 -5.206 -11.561 1.00 0.00 H new ATOM 0 HE2 PHE A 134 11.736 -2.054 -13.040 1.00 0.00 H new ATOM 0 HZ PHE A 134 13.234 -2.966 -11.275 1.00 0.00 H new ATOM 2071 N ALA A 135 9.083 -6.195 -15.299 1.00 0.00 N ATOM 2072 CA ALA A 135 7.886 -5.792 -14.586 1.00 0.00 C ATOM 2073 C ALA A 135 6.988 -6.993 -14.278 1.00 0.00 C ATOM 2074 O ALA A 135 6.368 -7.052 -13.216 1.00 0.00 O ATOM 2075 CB ALA A 135 7.123 -4.770 -15.435 1.00 0.00 C ATOM 0 H ALA A 135 9.031 -6.055 -16.308 1.00 0.00 H new ATOM 0 HA ALA A 135 8.178 -5.347 -13.635 1.00 0.00 H new ATOM 0 HB1 ALA A 135 6.221 -4.460 -14.908 1.00 0.00 H new ATOM 0 HB2 ALA A 135 7.756 -3.900 -15.613 1.00 0.00 H new ATOM 0 HB3 ALA A 135 6.849 -5.221 -16.389 1.00 0.00 H new ATOM 2081 N GLU A 136 6.905 -7.936 -15.216 1.00 0.00 N ATOM 2082 CA GLU A 136 5.948 -9.034 -15.196 1.00 0.00 C ATOM 2083 C GLU A 136 6.528 -10.248 -14.472 1.00 0.00 C ATOM 2084 O GLU A 136 5.876 -10.844 -13.614 1.00 0.00 O ATOM 2085 CB GLU A 136 5.592 -9.398 -16.652 1.00 0.00 C ATOM 2086 CG GLU A 136 4.644 -10.598 -16.796 1.00 0.00 C ATOM 2087 CD GLU A 136 3.215 -10.282 -16.312 1.00 0.00 C ATOM 2088 OE1 GLU A 136 2.414 -9.722 -17.095 1.00 0.00 O ATOM 2089 OE2 GLU A 136 2.867 -10.607 -15.154 1.00 0.00 O ATOM 0 H GLU A 136 7.519 -7.955 -16.030 1.00 0.00 H new ATOM 0 HA GLU A 136 5.052 -8.726 -14.658 1.00 0.00 H new ATOM 0 HB2 GLU A 136 5.135 -8.531 -17.128 1.00 0.00 H new ATOM 0 HB3 GLU A 136 6.513 -9.611 -17.195 1.00 0.00 H new ATOM 0 HG2 GLU A 136 4.610 -10.907 -17.841 1.00 0.00 H new ATOM 0 HG3 GLU A 136 5.039 -11.440 -16.227 1.00 0.00 H new ATOM 2096 N THR A 137 7.766 -10.596 -14.813 1.00 0.00 N ATOM 2097 CA THR A 137 8.408 -11.841 -14.407 1.00 0.00 C ATOM 2098 C THR A 137 9.510 -11.594 -13.362 1.00 0.00 C ATOM 2099 O THR A 137 9.914 -12.521 -12.657 1.00 0.00 O ATOM 2100 CB THR A 137 8.886 -12.620 -15.650 1.00 0.00 C ATOM 2101 OG1 THR A 137 10.015 -12.033 -16.258 1.00 0.00 O ATOM 2102 CG2 THR A 137 7.814 -12.745 -16.740 1.00 0.00 C ATOM 0 H THR A 137 8.363 -10.006 -15.392 1.00 0.00 H new ATOM 0 HA THR A 137 7.679 -12.475 -13.903 1.00 0.00 H new ATOM 0 HB THR A 137 9.130 -13.606 -15.255 1.00 0.00 H new ATOM 0 HG1 THR A 137 10.062 -11.085 -16.014 1.00 0.00 H new ATOM 0 HG21 THR A 137 8.217 -13.304 -17.585 1.00 0.00 H new ATOM 0 HG22 THR A 137 6.947 -13.269 -16.339 1.00 0.00 H new ATOM 0 HG23 THR A 137 7.515 -11.751 -17.072 1.00 0.00 H new ATOM 2110 N GLY A 138 9.975 -10.343 -13.233 1.00 0.00 N ATOM 2111 CA GLY A 138 11.019 -9.949 -12.296 1.00 0.00 C ATOM 2112 C GLY A 138 12.423 -10.209 -12.848 1.00 0.00 C ATOM 2113 O GLY A 138 13.385 -10.171 -12.079 1.00 0.00 O ATOM 0 H GLY A 138 9.624 -9.566 -13.792 1.00 0.00 H new ATOM 0 HA2 GLY A 138 10.913 -8.890 -12.062 1.00 0.00 H new ATOM 0 HA3 GLY A 138 10.891 -10.496 -11.362 1.00 0.00 H new ATOM 2117 N LYS A 139 12.552 -10.520 -14.145 1.00 0.00 N ATOM 2118 CA LYS A 139 13.809 -10.897 -14.762 1.00 0.00 C ATOM 2119 C LYS A 139 14.513 -9.638 -15.226 1.00 0.00 C ATOM 2120 O LYS A 139 15.514 -9.245 -14.595 1.00 0.00 O ATOM 2121 CB LYS A 139 13.588 -11.897 -15.907 1.00 0.00 C ATOM 2122 CG LYS A 139 12.960 -13.218 -15.434 1.00 0.00 C ATOM 2123 CD LYS A 139 13.839 -14.033 -14.474 1.00 0.00 C ATOM 2124 CE LYS A 139 13.136 -15.325 -14.032 1.00 0.00 C ATOM 2125 NZ LYS A 139 13.026 -16.334 -15.117 1.00 0.00 N ATOM 2126 OXT LYS A 139 14.095 -9.048 -16.241 1.00 0.00 O ATOM 0 H LYS A 139 11.767 -10.513 -14.796 1.00 0.00 H new ATOM 0 HA LYS A 139 14.442 -11.407 -14.036 1.00 0.00 H new ATOM 0 HB2 LYS A 139 12.944 -11.443 -16.660 1.00 0.00 H new ATOM 0 HB3 LYS A 139 14.543 -12.106 -16.389 1.00 0.00 H new ATOM 0 HG2 LYS A 139 12.012 -12.999 -14.942 1.00 0.00 H new ATOM 0 HG3 LYS A 139 12.732 -13.830 -16.307 1.00 0.00 H new ATOM 0 HD2 LYS A 139 14.782 -14.279 -14.962 1.00 0.00 H new ATOM 0 HD3 LYS A 139 14.080 -13.430 -13.598 1.00 0.00 H new ATOM 0 HE2 LYS A 139 13.682 -15.760 -13.195 1.00 0.00 H new ATOM 0 HE3 LYS A 139 12.137 -15.081 -13.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 12.543 -17.181 -14.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 12.481 -15.935 -15.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 13.977 -16.593 -15.448 1.00 0.00 H new