USER MOD reduce.3.24.130724 H: found=0, std=0, add=800, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 799 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 49 THR OG1 : rot 100:sc= 0.0993 USER MOD Set 1.2: A 52 HIS : no HD1:sc= -7.31! C(o=-7.2!,f=-7.5!) USER MOD Set 2.1: A 24 MET CE :methyl -179:sc= -0.272 (180deg=0) USER MOD Set 2.2: A 26 ASN : amide:sc= -6.24! C(o=-6.5!,f=-7.9!) USER MOD Single : A 4 LYS NZ :NH3+ -139:sc= 0.0323 (180deg=-2.21!) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 GLN : amide:sc= -0.0988 K(o=-0.099,f=-0.73) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 GLN : amide:sc= -0.536 K(o=-0.54,f=-3.6!) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl -168:sc= -1.58 (180deg=-2.39!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 94:sc= 0.00809 USER MOD Single : A 68 THR OG1 : rot 180:sc= -1.08! USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 30:sc= 0.504 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 107:sc= 0.803 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 154:sc= 0.0517 (180deg=0) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= -0.0475 K(o=-0.047,f=-2.3!) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 96 HIS : no HD1:sc= -0.962 K(o=-0.96,f=-0.35) USER MOD Single : A 100 LYS NZ :NH3+ -171:sc= -1.77 (180deg=-1.93) USER MOD ----------------------------------------------------------------- ATOM 34 N VAL A 3 -24.253 -9.972 6.356 1.00 0.00 N ATOM 35 CA VAL A 3 -23.892 -10.963 5.302 1.00 0.00 C ATOM 36 C VAL A 3 -22.589 -10.548 4.613 1.00 0.00 C ATOM 37 O VAL A 3 -22.236 -9.386 4.579 1.00 0.00 O ATOM 38 CB VAL A 3 -25.057 -10.928 4.312 1.00 0.00 C ATOM 39 CG1 VAL A 3 -25.294 -9.489 3.849 1.00 0.00 C ATOM 40 CG2 VAL A 3 -24.723 -11.803 3.101 1.00 0.00 C ATOM 0 HA VAL A 3 -23.733 -11.962 5.709 1.00 0.00 H new ATOM 0 HB VAL A 3 -25.957 -11.305 4.798 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -26.125 -9.466 3.144 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -25.532 -8.864 4.710 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -24.395 -9.110 3.363 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -25.553 -11.779 2.395 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -23.823 -11.425 2.616 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -24.555 -12.829 3.429 1.00 0.00 H new ATOM 50 N LYS A 4 -21.870 -11.491 4.066 1.00 0.00 N ATOM 51 CA LYS A 4 -20.589 -11.150 3.384 1.00 0.00 C ATOM 52 C LYS A 4 -20.467 -11.922 2.067 1.00 0.00 C ATOM 53 O LYS A 4 -21.253 -12.803 1.777 1.00 0.00 O ATOM 54 CB LYS A 4 -19.494 -11.579 4.360 1.00 0.00 C ATOM 55 CG LYS A 4 -18.566 -10.395 4.640 1.00 0.00 C ATOM 56 CD LYS A 4 -18.578 -10.082 6.138 1.00 0.00 C ATOM 57 CE LYS A 4 -19.891 -9.385 6.504 1.00 0.00 C ATOM 58 NZ LYS A 4 -19.910 -8.145 5.678 1.00 0.00 N ATOM 0 H LYS A 4 -22.114 -12.481 4.062 1.00 0.00 H new ATOM 0 HA LYS A 4 -20.523 -10.090 3.137 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -19.939 -11.933 5.290 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -18.925 -12.410 3.942 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -17.552 -10.628 4.314 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -18.890 -9.523 4.073 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -18.470 -11.001 6.713 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -17.732 -9.444 6.394 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -20.750 -10.019 6.284 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -19.931 -9.152 7.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -20.268 -7.353 6.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -18.946 -7.929 5.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -20.529 -8.286 4.855 1.00 0.00 H new ATOM 72 N CYS A 5 -19.487 -11.598 1.267 1.00 0.00 N ATOM 73 CA CYS A 5 -19.315 -12.315 -0.030 1.00 0.00 C ATOM 74 C CYS A 5 -17.929 -12.971 -0.090 1.00 0.00 C ATOM 75 O CYS A 5 -17.013 -12.534 0.580 1.00 0.00 O ATOM 76 CB CYS A 5 -19.438 -11.233 -1.105 1.00 0.00 C ATOM 77 SG CYS A 5 -20.872 -10.185 -0.758 1.00 0.00 S ATOM 0 H CYS A 5 -18.799 -10.869 1.455 1.00 0.00 H new ATOM 0 HA CYS A 5 -20.052 -13.107 -0.163 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -18.532 -10.628 -1.131 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -19.542 -11.694 -2.087 1.00 0.00 H new ATOM 82 N PRO A 6 -17.812 -13.999 -0.896 1.00 0.00 N ATOM 83 CA PRO A 6 -18.962 -14.495 -1.695 1.00 0.00 C ATOM 84 C PRO A 6 -19.928 -15.285 -0.807 1.00 0.00 C ATOM 85 O PRO A 6 -19.561 -15.779 0.240 1.00 0.00 O ATOM 86 CB PRO A 6 -18.311 -15.407 -2.729 1.00 0.00 C ATOM 87 CG PRO A 6 -17.026 -15.855 -2.106 1.00 0.00 C ATOM 88 CD PRO A 6 -16.597 -14.784 -1.134 1.00 0.00 C ATOM 0 HA PRO A 6 -19.548 -13.694 -2.146 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -18.952 -16.257 -2.963 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -18.131 -14.876 -3.664 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -17.160 -16.807 -1.593 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -16.263 -16.009 -2.869 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -16.216 -15.217 -0.209 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -15.800 -14.167 -1.549 1.00 0.00 H new ATOM 96 N GLY A 7 -21.160 -15.408 -1.217 1.00 0.00 N ATOM 97 CA GLY A 7 -22.147 -16.166 -0.396 1.00 0.00 C ATOM 98 C GLY A 7 -23.438 -16.356 -1.195 1.00 0.00 C ATOM 99 O GLY A 7 -23.779 -15.554 -2.041 1.00 0.00 O ATOM 0 H GLY A 7 -21.526 -15.017 -2.085 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -21.735 -17.135 -0.116 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -22.355 -15.629 0.529 1.00 0.00 H new ATOM 103 N GLU A 8 -24.158 -17.412 -0.933 1.00 0.00 N ATOM 104 CA GLU A 8 -25.428 -17.651 -1.679 1.00 0.00 C ATOM 105 C GLU A 8 -26.631 -17.282 -0.806 1.00 0.00 C ATOM 106 O GLU A 8 -26.628 -17.488 0.392 1.00 0.00 O ATOM 107 CB GLU A 8 -25.428 -19.150 -1.989 1.00 0.00 C ATOM 108 CG GLU A 8 -24.476 -19.428 -3.154 1.00 0.00 C ATOM 109 CD GLU A 8 -24.365 -20.939 -3.373 1.00 0.00 C ATOM 110 OE1 GLU A 8 -23.586 -21.563 -2.672 1.00 0.00 O ATOM 111 OE2 GLU A 8 -25.060 -21.445 -4.239 1.00 0.00 O ATOM 0 H GLU A 8 -23.923 -18.119 -0.236 1.00 0.00 H new ATOM 0 HA GLU A 8 -25.496 -17.048 -2.584 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -25.119 -19.714 -1.109 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -26.436 -19.480 -2.241 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -24.842 -18.944 -4.060 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -23.493 -19.007 -2.943 1.00 0.00 H new ATOM 118 N TYR A 9 -27.659 -16.735 -1.396 1.00 0.00 N ATOM 119 CA TYR A 9 -28.859 -16.352 -0.598 1.00 0.00 C ATOM 120 C TYR A 9 -30.118 -16.431 -1.465 1.00 0.00 C ATOM 121 O TYR A 9 -30.054 -16.380 -2.677 1.00 0.00 O ATOM 122 CB TYR A 9 -28.600 -14.910 -0.160 1.00 0.00 C ATOM 123 CG TYR A 9 -28.144 -14.893 1.279 1.00 0.00 C ATOM 124 CD1 TYR A 9 -29.087 -14.960 2.313 1.00 0.00 C ATOM 125 CD2 TYR A 9 -26.779 -14.809 1.580 1.00 0.00 C ATOM 126 CE1 TYR A 9 -28.664 -14.945 3.650 1.00 0.00 C ATOM 127 CE2 TYR A 9 -26.355 -14.793 2.915 1.00 0.00 C ATOM 128 CZ TYR A 9 -27.297 -14.861 3.950 1.00 0.00 C ATOM 129 OH TYR A 9 -26.881 -14.844 5.266 1.00 0.00 O ATOM 0 H TYR A 9 -27.720 -16.537 -2.395 1.00 0.00 H new ATOM 0 HA TYR A 9 -29.017 -17.014 0.253 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -27.842 -14.456 -0.798 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -29.507 -14.317 -0.272 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -30.140 -15.023 2.080 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -26.053 -14.757 0.782 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -29.390 -14.998 4.448 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -25.302 -14.728 3.146 1.00 0.00 H new ATOM 0 HH TYR A 9 -25.903 -14.784 5.299 1.00 0.00 H new ATOM 139 N GLN A 10 -31.264 -16.554 -0.854 1.00 0.00 N ATOM 140 CA GLN A 10 -32.527 -16.634 -1.643 1.00 0.00 C ATOM 141 C GLN A 10 -33.474 -15.502 -1.236 1.00 0.00 C ATOM 142 O GLN A 10 -33.702 -15.261 -0.067 1.00 0.00 O ATOM 143 CB GLN A 10 -33.130 -17.994 -1.290 1.00 0.00 C ATOM 144 CG GLN A 10 -32.483 -19.079 -2.155 1.00 0.00 C ATOM 145 CD GLN A 10 -33.358 -20.333 -2.138 1.00 0.00 C ATOM 146 OE1 GLN A 10 -34.561 -20.251 -2.277 1.00 0.00 O ATOM 147 NE2 GLN A 10 -32.798 -21.501 -1.974 1.00 0.00 N ATOM 0 H GLN A 10 -31.381 -16.603 0.158 1.00 0.00 H new ATOM 0 HA GLN A 10 -32.354 -16.533 -2.714 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -32.970 -18.212 -0.234 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -34.208 -17.979 -1.452 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -32.362 -18.720 -3.177 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -31.487 -19.313 -1.780 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -31.787 -21.570 -1.857 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -33.371 -22.344 -1.963 1.00 0.00 H new ATOM 156 N VAL A 11 -34.027 -14.805 -2.191 1.00 0.00 N ATOM 157 CA VAL A 11 -34.958 -13.689 -1.855 1.00 0.00 C ATOM 158 C VAL A 11 -36.362 -13.991 -2.385 1.00 0.00 C ATOM 159 O VAL A 11 -36.624 -13.896 -3.568 1.00 0.00 O ATOM 160 CB VAL A 11 -34.372 -12.463 -2.555 1.00 0.00 C ATOM 161 CG1 VAL A 11 -35.277 -11.255 -2.308 1.00 0.00 C ATOM 162 CG2 VAL A 11 -32.976 -12.175 -1.997 1.00 0.00 C ATOM 0 H VAL A 11 -33.875 -14.959 -3.188 1.00 0.00 H new ATOM 0 HA VAL A 11 -35.052 -13.539 -0.779 1.00 0.00 H new ATOM 0 HB VAL A 11 -34.303 -12.654 -3.626 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -34.860 -10.380 -2.807 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -36.272 -11.459 -2.704 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -35.345 -11.064 -1.237 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -32.558 -11.301 -2.496 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -33.045 -11.983 -0.926 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -32.330 -13.036 -2.171 1.00 0.00 H new ATOM 172 N ASP A 12 -37.267 -14.353 -1.518 1.00 0.00 N ATOM 173 CA ASP A 12 -38.653 -14.661 -1.972 1.00 0.00 C ATOM 174 C ASP A 12 -38.628 -15.734 -3.064 1.00 0.00 C ATOM 175 O ASP A 12 -38.685 -16.915 -2.786 1.00 0.00 O ATOM 176 CB ASP A 12 -39.189 -13.341 -2.529 1.00 0.00 C ATOM 177 CG ASP A 12 -40.550 -13.578 -3.187 1.00 0.00 C ATOM 178 OD1 ASP A 12 -41.169 -14.581 -2.876 1.00 0.00 O ATOM 179 OD2 ASP A 12 -40.949 -12.751 -3.989 1.00 0.00 O ATOM 0 H ASP A 12 -37.107 -14.449 -0.515 1.00 0.00 H new ATOM 0 HA ASP A 12 -39.276 -15.046 -1.164 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -39.284 -12.608 -1.728 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -38.489 -12.930 -3.256 1.00 0.00 H new ATOM 184 N GLY A 13 -38.541 -15.334 -4.304 1.00 0.00 N ATOM 185 CA GLY A 13 -38.511 -16.333 -5.409 1.00 0.00 C ATOM 186 C GLY A 13 -37.378 -15.992 -6.376 1.00 0.00 C ATOM 187 O GLY A 13 -37.579 -15.882 -7.569 1.00 0.00 O ATOM 0 H GLY A 13 -38.489 -14.359 -4.599 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -38.368 -17.335 -5.004 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -39.465 -16.336 -5.937 1.00 0.00 H new ATOM 191 N LYS A 14 -36.186 -15.825 -5.872 1.00 0.00 N ATOM 192 CA LYS A 14 -35.038 -15.491 -6.766 1.00 0.00 C ATOM 193 C LYS A 14 -33.726 -15.981 -6.148 1.00 0.00 C ATOM 194 O LYS A 14 -33.599 -16.092 -4.944 1.00 0.00 O ATOM 195 CB LYS A 14 -35.047 -13.965 -6.868 1.00 0.00 C ATOM 196 CG LYS A 14 -35.134 -13.552 -8.339 1.00 0.00 C ATOM 197 CD LYS A 14 -36.409 -12.739 -8.569 1.00 0.00 C ATOM 198 CE LYS A 14 -37.391 -13.556 -9.412 1.00 0.00 C ATOM 199 NZ LYS A 14 -38.139 -12.549 -10.215 1.00 0.00 N ATOM 0 H LYS A 14 -35.956 -15.905 -4.881 1.00 0.00 H new ATOM 0 HA LYS A 14 -35.124 -15.965 -7.744 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -35.893 -13.558 -6.314 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -34.144 -13.554 -6.417 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -34.260 -12.962 -8.614 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -35.135 -14.436 -8.976 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -36.864 -12.478 -7.613 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -36.170 -11.803 -9.075 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -36.866 -14.263 -10.055 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -38.064 -14.137 -8.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -38.833 -13.033 -10.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -38.634 -11.894 -9.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -37.473 -12.016 -10.810 1.00 0.00 H new ATOM 213 N LYS A 15 -32.750 -16.277 -6.962 1.00 0.00 N ATOM 214 CA LYS A 15 -31.447 -16.760 -6.420 1.00 0.00 C ATOM 215 C LYS A 15 -30.373 -15.679 -6.578 1.00 0.00 C ATOM 216 O LYS A 15 -30.232 -15.081 -7.626 1.00 0.00 O ATOM 217 CB LYS A 15 -31.100 -17.988 -7.262 1.00 0.00 C ATOM 218 CG LYS A 15 -31.654 -19.245 -6.588 1.00 0.00 C ATOM 219 CD LYS A 15 -33.109 -19.455 -7.013 1.00 0.00 C ATOM 220 CE LYS A 15 -33.945 -19.853 -5.796 1.00 0.00 C ATOM 221 NZ LYS A 15 -34.213 -21.307 -5.971 1.00 0.00 N ATOM 0 H LYS A 15 -32.798 -16.206 -7.978 1.00 0.00 H new ATOM 0 HA LYS A 15 -31.504 -16.996 -5.357 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -31.519 -17.885 -8.263 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -30.019 -18.070 -7.375 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -31.055 -20.113 -6.864 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -31.591 -19.147 -5.504 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -33.505 -18.541 -7.456 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -33.167 -20.231 -7.777 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -33.407 -19.660 -4.868 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -34.873 -19.283 -5.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -34.783 -21.653 -5.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -34.732 -21.460 -6.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -33.312 -21.825 -6.003 1.00 0.00 H new ATOM 235 N VAL A 16 -29.617 -15.426 -5.545 1.00 0.00 N ATOM 236 CA VAL A 16 -28.553 -14.384 -5.636 1.00 0.00 C ATOM 237 C VAL A 16 -27.235 -14.925 -5.074 1.00 0.00 C ATOM 238 O VAL A 16 -27.102 -15.152 -3.888 1.00 0.00 O ATOM 239 CB VAL A 16 -29.063 -13.223 -4.783 1.00 0.00 C ATOM 240 CG1 VAL A 16 -27.962 -12.171 -4.639 1.00 0.00 C ATOM 241 CG2 VAL A 16 -30.284 -12.593 -5.459 1.00 0.00 C ATOM 0 H VAL A 16 -29.689 -15.895 -4.642 1.00 0.00 H new ATOM 0 HA VAL A 16 -28.359 -14.080 -6.664 1.00 0.00 H new ATOM 0 HB VAL A 16 -29.342 -13.593 -3.796 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -28.327 -11.343 -4.031 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -27.092 -12.618 -4.159 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -27.682 -11.800 -5.625 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -30.649 -11.765 -4.852 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -30.004 -12.224 -6.446 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -31.070 -13.341 -5.562 1.00 0.00 H new ATOM 251 N ILE A 17 -26.260 -15.134 -5.916 1.00 0.00 N ATOM 252 CA ILE A 17 -24.952 -15.662 -5.428 1.00 0.00 C ATOM 253 C ILE A 17 -23.889 -14.561 -5.463 1.00 0.00 C ATOM 254 O ILE A 17 -23.280 -14.304 -6.483 1.00 0.00 O ATOM 255 CB ILE A 17 -24.593 -16.788 -6.396 1.00 0.00 C ATOM 256 CG1 ILE A 17 -23.298 -17.462 -5.933 1.00 0.00 C ATOM 257 CG2 ILE A 17 -24.394 -16.214 -7.800 1.00 0.00 C ATOM 258 CD1 ILE A 17 -22.941 -18.596 -6.896 1.00 0.00 C ATOM 0 H ILE A 17 -26.311 -14.962 -6.920 1.00 0.00 H new ATOM 0 HA ILE A 17 -25.008 -16.014 -4.398 1.00 0.00 H new ATOM 0 HB ILE A 17 -25.400 -17.520 -6.416 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -22.489 -16.733 -5.897 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -23.420 -17.853 -4.923 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -24.138 -17.019 -8.489 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -25.315 -15.733 -8.130 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -23.587 -15.481 -7.782 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -22.019 -19.076 -6.567 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -23.747 -19.329 -6.909 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -22.802 -18.192 -7.899 1.00 0.00 H new ATOM 270 N LEU A 18 -23.658 -13.911 -4.355 1.00 0.00 N ATOM 271 CA LEU A 18 -22.632 -12.830 -4.323 1.00 0.00 C ATOM 272 C LEU A 18 -21.252 -13.400 -4.659 1.00 0.00 C ATOM 273 O LEU A 18 -20.771 -14.308 -4.010 1.00 0.00 O ATOM 274 CB LEU A 18 -22.660 -12.302 -2.889 1.00 0.00 C ATOM 275 CG LEU A 18 -24.009 -11.634 -2.616 1.00 0.00 C ATOM 276 CD1 LEU A 18 -24.025 -11.077 -1.192 1.00 0.00 C ATOM 277 CD2 LEU A 18 -24.223 -10.493 -3.612 1.00 0.00 C ATOM 0 H LEU A 18 -24.136 -14.082 -3.470 1.00 0.00 H new ATOM 0 HA LEU A 18 -22.836 -12.045 -5.051 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -22.498 -13.119 -2.186 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -21.851 -11.587 -2.738 1.00 0.00 H new ATOM 0 HG LEU A 18 -24.807 -12.369 -2.727 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -24.986 -10.601 -0.998 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -23.873 -11.890 -0.482 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -23.227 -10.343 -1.080 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -25.184 -10.016 -3.418 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -23.425 -9.759 -3.501 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -24.213 -10.890 -4.627 1.00 0.00 H new ATOM 289 N ASP A 19 -20.612 -12.876 -5.668 1.00 0.00 N ATOM 290 CA ASP A 19 -19.263 -13.392 -6.044 1.00 0.00 C ATOM 291 C ASP A 19 -18.213 -12.911 -5.038 1.00 0.00 C ATOM 292 O ASP A 19 -18.511 -12.655 -3.888 1.00 0.00 O ATOM 293 CB ASP A 19 -18.986 -12.807 -7.428 1.00 0.00 C ATOM 294 CG ASP A 19 -18.342 -13.876 -8.313 1.00 0.00 C ATOM 295 OD1 ASP A 19 -17.276 -14.350 -7.956 1.00 0.00 O ATOM 296 OD2 ASP A 19 -18.926 -14.202 -9.334 1.00 0.00 O ATOM 0 H ASP A 19 -20.963 -12.114 -6.248 1.00 0.00 H new ATOM 0 HA ASP A 19 -19.224 -14.481 -6.047 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -19.914 -12.457 -7.879 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -18.327 -11.943 -7.344 1.00 0.00 H new ATOM 301 N GLU A 20 -16.985 -12.787 -5.463 1.00 0.00 N ATOM 302 CA GLU A 20 -15.916 -12.324 -4.532 1.00 0.00 C ATOM 303 C GLU A 20 -16.183 -10.881 -4.093 1.00 0.00 C ATOM 304 O GLU A 20 -15.945 -10.513 -2.960 1.00 0.00 O ATOM 305 CB GLU A 20 -14.623 -12.407 -5.344 1.00 0.00 C ATOM 306 CG GLU A 20 -13.639 -13.347 -4.644 1.00 0.00 C ATOM 307 CD GLU A 20 -12.921 -12.591 -3.525 1.00 0.00 C ATOM 308 OE1 GLU A 20 -12.909 -11.372 -3.572 1.00 0.00 O ATOM 309 OE2 GLU A 20 -12.396 -13.245 -2.639 1.00 0.00 O ATOM 0 H GLU A 20 -16.676 -12.986 -6.414 1.00 0.00 H new ATOM 0 HA GLU A 20 -15.868 -12.927 -3.625 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -14.836 -12.769 -6.350 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -14.183 -11.415 -5.449 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -14.169 -14.207 -4.235 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -12.914 -13.732 -5.361 1.00 0.00 H new ATOM 316 N ASP A 21 -16.676 -10.062 -4.982 1.00 0.00 N ATOM 317 CA ASP A 21 -16.958 -8.644 -4.615 1.00 0.00 C ATOM 318 C ASP A 21 -18.469 -8.412 -4.527 1.00 0.00 C ATOM 319 O ASP A 21 -19.003 -7.498 -5.124 1.00 0.00 O ATOM 320 CB ASP A 21 -16.354 -7.813 -5.747 1.00 0.00 C ATOM 321 CG ASP A 21 -15.754 -6.528 -5.174 1.00 0.00 C ATOM 322 OD1 ASP A 21 -15.238 -6.580 -4.069 1.00 0.00 O ATOM 323 OD2 ASP A 21 -15.821 -5.514 -5.848 1.00 0.00 O ATOM 0 H ASP A 21 -16.896 -10.313 -5.946 1.00 0.00 H new ATOM 0 HA ASP A 21 -16.538 -8.377 -3.645 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -15.585 -8.387 -6.263 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -17.120 -7.572 -6.484 1.00 0.00 H new ATOM 328 N CYS A 22 -19.163 -9.236 -3.790 1.00 0.00 N ATOM 329 CA CYS A 22 -20.638 -9.062 -3.667 1.00 0.00 C ATOM 330 C CYS A 22 -21.250 -8.754 -5.037 1.00 0.00 C ATOM 331 O CYS A 22 -22.279 -8.116 -5.138 1.00 0.00 O ATOM 332 CB CYS A 22 -20.823 -7.877 -2.719 1.00 0.00 C ATOM 333 SG CYS A 22 -20.195 -8.308 -1.076 1.00 0.00 S ATOM 0 H CYS A 22 -18.773 -10.021 -3.269 1.00 0.00 H new ATOM 0 HA CYS A 22 -21.129 -9.961 -3.294 1.00 0.00 H new ATOM 0 HB2 CYS A 22 -20.295 -7.005 -3.104 1.00 0.00 H new ATOM 0 HB3 CYS A 22 -21.878 -7.609 -2.657 1.00 0.00 H new ATOM 338 N PHE A 23 -20.625 -9.200 -6.091 1.00 0.00 N ATOM 339 CA PHE A 23 -21.173 -8.931 -7.451 1.00 0.00 C ATOM 340 C PHE A 23 -22.413 -9.793 -7.701 1.00 0.00 C ATOM 341 O PHE A 23 -22.455 -10.954 -7.348 1.00 0.00 O ATOM 342 CB PHE A 23 -20.050 -9.315 -8.416 1.00 0.00 C ATOM 343 CG PHE A 23 -19.844 -8.202 -9.415 1.00 0.00 C ATOM 344 CD1 PHE A 23 -19.401 -6.945 -8.983 1.00 0.00 C ATOM 345 CD2 PHE A 23 -20.097 -8.427 -10.775 1.00 0.00 C ATOM 346 CE1 PHE A 23 -19.210 -5.912 -9.911 1.00 0.00 C ATOM 347 CE2 PHE A 23 -19.907 -7.394 -11.702 1.00 0.00 C ATOM 348 CZ PHE A 23 -19.463 -6.137 -11.270 1.00 0.00 C ATOM 0 H PHE A 23 -19.759 -9.739 -6.070 1.00 0.00 H new ATOM 0 HA PHE A 23 -21.478 -7.892 -7.574 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -19.128 -9.498 -7.864 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -20.301 -10.241 -8.933 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -19.207 -6.772 -7.935 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -20.438 -9.396 -11.108 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -18.868 -4.943 -9.578 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -20.103 -7.566 -12.750 1.00 0.00 H new ATOM 0 HZ PHE A 23 -19.316 -5.341 -11.985 1.00 0.00 H new ATOM 358 N MET A 24 -23.424 -9.232 -8.306 1.00 0.00 N ATOM 359 CA MET A 24 -24.661 -10.019 -8.577 1.00 0.00 C ATOM 360 C MET A 24 -24.467 -10.900 -9.813 1.00 0.00 C ATOM 361 O MET A 24 -24.374 -10.417 -10.924 1.00 0.00 O ATOM 362 CB MET A 24 -25.747 -8.973 -8.827 1.00 0.00 C ATOM 363 CG MET A 24 -26.715 -8.949 -7.643 1.00 0.00 C ATOM 364 SD MET A 24 -28.222 -8.061 -8.113 1.00 0.00 S ATOM 365 CE MET A 24 -29.187 -9.507 -8.616 1.00 0.00 C ATOM 0 H MET A 24 -23.447 -8.263 -8.624 1.00 0.00 H new ATOM 0 HA MET A 24 -24.918 -10.684 -7.752 1.00 0.00 H new ATOM 0 HB2 MET A 24 -25.296 -7.990 -8.961 1.00 0.00 H new ATOM 0 HB3 MET A 24 -26.285 -9.205 -9.746 1.00 0.00 H new ATOM 0 HG2 MET A 24 -26.960 -9.967 -7.339 1.00 0.00 H new ATOM 0 HG3 MET A 24 -26.247 -8.464 -6.786 1.00 0.00 H new ATOM 0 HE1 MET A 24 -30.168 -9.186 -8.967 1.00 0.00 H new ATOM 0 HE2 MET A 24 -28.667 -10.030 -9.419 1.00 0.00 H new ATOM 0 HE3 MET A 24 -29.308 -10.178 -7.765 1.00 0.00 H new ATOM 375 N GLN A 25 -24.406 -12.191 -9.630 1.00 0.00 N ATOM 376 CA GLN A 25 -24.218 -13.103 -10.796 1.00 0.00 C ATOM 377 C GLN A 25 -25.574 -13.617 -11.288 1.00 0.00 C ATOM 378 O GLN A 25 -25.655 -14.610 -11.983 1.00 0.00 O ATOM 379 CB GLN A 25 -23.369 -14.256 -10.263 1.00 0.00 C ATOM 380 CG GLN A 25 -22.379 -14.704 -11.340 1.00 0.00 C ATOM 381 CD GLN A 25 -22.078 -16.193 -11.171 1.00 0.00 C ATOM 382 OE1 GLN A 25 -22.339 -16.983 -12.057 1.00 0.00 O ATOM 383 NE2 GLN A 25 -21.536 -16.616 -10.061 1.00 0.00 N ATOM 0 H GLN A 25 -24.478 -12.654 -8.724 1.00 0.00 H new ATOM 0 HA GLN A 25 -23.743 -12.603 -11.640 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -22.831 -13.942 -9.368 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -24.009 -15.089 -9.974 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -22.794 -14.516 -12.330 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -21.458 -14.126 -11.265 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -21.316 -15.955 -9.316 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -21.332 -17.608 -9.939 1.00 0.00 H new ATOM 392 N ASN A 26 -26.637 -12.950 -10.932 1.00 0.00 N ATOM 393 CA ASN A 26 -27.985 -13.403 -11.379 1.00 0.00 C ATOM 394 C ASN A 26 -28.808 -12.209 -11.872 1.00 0.00 C ATOM 395 O ASN A 26 -29.922 -12.000 -11.434 1.00 0.00 O ATOM 396 CB ASN A 26 -28.627 -14.021 -10.137 1.00 0.00 C ATOM 397 CG ASN A 26 -28.815 -12.941 -9.070 1.00 0.00 C ATOM 398 OD1 ASN A 26 -27.862 -12.324 -8.639 1.00 0.00 O ATOM 399 ND2 ASN A 26 -30.014 -12.686 -8.622 1.00 0.00 N ATOM 0 H ASN A 26 -26.631 -12.111 -10.351 1.00 0.00 H new ATOM 0 HA ASN A 26 -27.930 -14.112 -12.205 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -29.589 -14.465 -10.394 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -27.999 -14.824 -9.751 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -30.150 -11.969 -7.910 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -30.815 -13.204 -8.984 1.00 0.00 H new ATOM 406 N PRO A 27 -28.226 -11.464 -12.770 1.00 0.00 N ATOM 407 CA PRO A 27 -28.909 -10.274 -13.334 1.00 0.00 C ATOM 408 C PRO A 27 -30.027 -10.702 -14.289 1.00 0.00 C ATOM 409 O PRO A 27 -30.956 -9.961 -14.544 1.00 0.00 O ATOM 410 CB PRO A 27 -27.798 -9.548 -14.087 1.00 0.00 C ATOM 411 CG PRO A 27 -26.796 -10.608 -14.418 1.00 0.00 C ATOM 412 CD PRO A 27 -26.889 -11.657 -13.341 1.00 0.00 C ATOM 0 HA PRO A 27 -29.381 -9.650 -12.575 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -28.180 -9.071 -14.989 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -27.354 -8.763 -13.475 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -27.003 -11.041 -15.397 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -25.791 -10.188 -14.461 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -26.771 -12.660 -13.750 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -26.111 -11.526 -12.589 1.00 0.00 H new ATOM 420 N GLU A 28 -29.945 -11.892 -14.820 1.00 0.00 N ATOM 421 CA GLU A 28 -31.003 -12.365 -15.757 1.00 0.00 C ATOM 422 C GLU A 28 -32.364 -12.382 -15.054 1.00 0.00 C ATOM 423 O GLU A 28 -33.400 -12.415 -15.687 1.00 0.00 O ATOM 424 CB GLU A 28 -30.583 -13.781 -16.148 1.00 0.00 C ATOM 425 CG GLU A 28 -30.762 -14.717 -14.951 1.00 0.00 C ATOM 426 CD GLU A 28 -31.897 -15.701 -15.236 1.00 0.00 C ATOM 427 OE1 GLU A 28 -32.114 -16.004 -16.398 1.00 0.00 O ATOM 428 OE2 GLU A 28 -32.530 -16.136 -14.288 1.00 0.00 O ATOM 0 H GLU A 28 -29.191 -12.557 -14.645 1.00 0.00 H new ATOM 0 HA GLU A 28 -31.104 -11.716 -16.627 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -31.183 -14.130 -16.989 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -29.543 -13.786 -16.474 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -29.836 -15.259 -14.759 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -30.985 -14.139 -14.054 1.00 0.00 H new ATOM 435 N ASP A 29 -32.368 -12.358 -13.750 1.00 0.00 N ATOM 436 CA ASP A 29 -33.662 -12.372 -13.007 1.00 0.00 C ATOM 437 C ASP A 29 -33.711 -11.209 -12.012 1.00 0.00 C ATOM 438 O ASP A 29 -34.235 -11.334 -10.923 1.00 0.00 O ATOM 439 CB ASP A 29 -33.681 -13.711 -12.269 1.00 0.00 C ATOM 440 CG ASP A 29 -34.825 -14.574 -12.804 1.00 0.00 C ATOM 441 OD1 ASP A 29 -34.788 -14.912 -13.976 1.00 0.00 O ATOM 442 OD2 ASP A 29 -35.720 -14.880 -12.034 1.00 0.00 O ATOM 0 H ASP A 29 -31.532 -12.329 -13.166 1.00 0.00 H new ATOM 0 HA ASP A 29 -34.521 -12.260 -13.669 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -32.730 -14.226 -12.404 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -33.806 -13.546 -11.199 1.00 0.00 H new ATOM 447 N TRP A 30 -33.171 -10.079 -12.379 1.00 0.00 N ATOM 448 CA TRP A 30 -33.189 -8.909 -11.453 1.00 0.00 C ATOM 449 C TRP A 30 -34.599 -8.316 -11.378 1.00 0.00 C ATOM 450 O TRP A 30 -35.290 -8.207 -12.371 1.00 0.00 O ATOM 451 CB TRP A 30 -32.217 -7.902 -12.067 1.00 0.00 C ATOM 452 CG TRP A 30 -32.060 -6.735 -11.145 1.00 0.00 C ATOM 453 CD1 TRP A 30 -30.988 -6.511 -10.351 1.00 0.00 C ATOM 454 CD2 TRP A 30 -32.983 -5.633 -10.909 1.00 0.00 C ATOM 455 NE1 TRP A 30 -31.193 -5.341 -9.642 1.00 0.00 N ATOM 456 CE2 TRP A 30 -32.408 -4.763 -9.951 1.00 0.00 C ATOM 457 CE3 TRP A 30 -34.251 -5.306 -11.428 1.00 0.00 C ATOM 458 CZ2 TRP A 30 -33.069 -3.610 -9.523 1.00 0.00 C ATOM 459 CZ3 TRP A 30 -34.918 -4.145 -10.999 1.00 0.00 C ATOM 460 CH2 TRP A 30 -34.327 -3.300 -10.049 1.00 0.00 C ATOM 0 H TRP A 30 -32.719 -9.915 -13.278 1.00 0.00 H new ATOM 0 HA TRP A 30 -32.904 -9.183 -10.437 1.00 0.00 H new ATOM 0 HB2 TRP A 30 -31.250 -8.374 -12.242 1.00 0.00 H new ATOM 0 HB3 TRP A 30 -32.588 -7.567 -13.036 1.00 0.00 H new ATOM 0 HD1 TRP A 30 -30.115 -7.143 -10.282 1.00 0.00 H new ATOM 0 HE1 TRP A 30 -30.528 -4.953 -8.973 1.00 0.00 H new ATOM 0 HE3 TRP A 30 -34.714 -5.951 -12.160 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 -32.612 -2.962 -8.790 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 -35.890 -3.903 -11.403 1.00 0.00 H new ATOM 0 HH2 TRP A 30 -34.844 -2.409 -9.723 1.00 0.00 H new ATOM 471 N ASP A 31 -35.028 -7.931 -10.208 1.00 0.00 N ATOM 472 CA ASP A 31 -36.392 -7.345 -10.071 1.00 0.00 C ATOM 473 C ASP A 31 -36.403 -6.284 -8.967 1.00 0.00 C ATOM 474 O ASP A 31 -35.424 -6.084 -8.275 1.00 0.00 O ATOM 475 CB ASP A 31 -37.292 -8.522 -9.692 1.00 0.00 C ATOM 476 CG ASP A 31 -38.375 -8.699 -10.756 1.00 0.00 C ATOM 477 OD1 ASP A 31 -38.023 -8.956 -11.895 1.00 0.00 O ATOM 478 OD2 ASP A 31 -39.540 -8.576 -10.415 1.00 0.00 O ATOM 0 H ASP A 31 -34.494 -7.996 -9.341 1.00 0.00 H new ATOM 0 HA ASP A 31 -36.725 -6.855 -10.986 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -36.700 -9.433 -9.605 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -37.749 -8.345 -8.718 1.00 0.00 H new ATOM 483 N GLU A 32 -37.503 -5.602 -8.797 1.00 0.00 N ATOM 484 CA GLU A 32 -37.574 -4.555 -7.738 1.00 0.00 C ATOM 485 C GLU A 32 -37.481 -5.199 -6.352 1.00 0.00 C ATOM 486 O GLU A 32 -36.804 -4.705 -5.472 1.00 0.00 O ATOM 487 CB GLU A 32 -38.937 -3.888 -7.930 1.00 0.00 C ATOM 488 CG GLU A 32 -40.048 -4.875 -7.564 1.00 0.00 C ATOM 489 CD GLU A 32 -41.410 -4.237 -7.838 1.00 0.00 C ATOM 490 OE1 GLU A 32 -41.463 -3.325 -8.647 1.00 0.00 O ATOM 491 OE2 GLU A 32 -42.378 -4.670 -7.234 1.00 0.00 O ATOM 0 H GLU A 32 -38.355 -5.724 -9.345 1.00 0.00 H new ATOM 0 HA GLU A 32 -36.756 -3.838 -7.810 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -39.008 -2.997 -7.306 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -39.052 -3.563 -8.964 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -39.941 -5.791 -8.145 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -39.970 -5.153 -6.513 1.00 0.00 H new ATOM 498 N LYS A 33 -38.154 -6.299 -6.151 1.00 0.00 N ATOM 499 CA LYS A 33 -38.103 -6.973 -4.823 1.00 0.00 C ATOM 500 C LYS A 33 -36.704 -7.542 -4.570 1.00 0.00 C ATOM 501 O LYS A 33 -36.129 -7.357 -3.517 1.00 0.00 O ATOM 502 CB LYS A 33 -39.134 -8.100 -4.909 1.00 0.00 C ATOM 503 CG LYS A 33 -39.595 -8.479 -3.500 1.00 0.00 C ATOM 504 CD LYS A 33 -40.885 -9.299 -3.587 1.00 0.00 C ATOM 505 CE LYS A 33 -42.037 -8.507 -2.964 1.00 0.00 C ATOM 506 NZ LYS A 33 -42.094 -8.962 -1.547 1.00 0.00 N ATOM 0 H LYS A 33 -38.737 -6.760 -6.849 1.00 0.00 H new ATOM 0 HA LYS A 33 -38.318 -6.286 -4.004 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -39.987 -7.782 -5.509 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -38.700 -8.967 -5.407 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -38.819 -9.054 -2.995 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -39.762 -7.580 -2.907 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -41.111 -9.532 -4.628 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -40.760 -10.249 -3.068 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -41.858 -7.434 -3.027 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -42.977 -8.704 -3.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -42.861 -8.463 -1.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -42.272 -9.986 -1.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -41.189 -8.755 -1.079 1.00 0.00 H new ATOM 520 N VAL A 34 -36.152 -8.232 -5.531 1.00 0.00 N ATOM 521 CA VAL A 34 -34.790 -8.811 -5.344 1.00 0.00 C ATOM 522 C VAL A 34 -33.794 -7.708 -4.975 1.00 0.00 C ATOM 523 O VAL A 34 -33.107 -7.787 -3.975 1.00 0.00 O ATOM 524 CB VAL A 34 -34.432 -9.427 -6.696 1.00 0.00 C ATOM 525 CG1 VAL A 34 -32.942 -9.774 -6.724 1.00 0.00 C ATOM 526 CG2 VAL A 34 -35.256 -10.699 -6.909 1.00 0.00 C ATOM 0 H VAL A 34 -36.584 -8.420 -6.436 1.00 0.00 H new ATOM 0 HA VAL A 34 -34.760 -9.548 -4.541 1.00 0.00 H new ATOM 0 HB VAL A 34 -34.651 -8.713 -7.489 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -32.689 -10.213 -7.689 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -32.355 -8.868 -6.572 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -32.720 -10.488 -5.931 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -35.002 -11.140 -7.873 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -35.036 -11.412 -6.115 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -36.318 -10.452 -6.891 1.00 0.00 H new ATOM 536 N ALA A 35 -33.712 -6.678 -5.773 1.00 0.00 N ATOM 537 CA ALA A 35 -32.762 -5.572 -5.465 1.00 0.00 C ATOM 538 C ALA A 35 -33.052 -5.004 -4.074 1.00 0.00 C ATOM 539 O ALA A 35 -32.155 -4.631 -3.344 1.00 0.00 O ATOM 540 CB ALA A 35 -33.020 -4.518 -6.541 1.00 0.00 C ATOM 0 H ALA A 35 -34.261 -6.555 -6.624 1.00 0.00 H new ATOM 0 HA ALA A 35 -31.724 -5.904 -5.463 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -32.357 -3.667 -6.384 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -32.831 -4.948 -7.525 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -34.056 -4.186 -6.484 1.00 0.00 H new ATOM 546 N GLU A 36 -34.301 -4.936 -3.700 1.00 0.00 N ATOM 547 CA GLU A 36 -34.647 -4.393 -2.355 1.00 0.00 C ATOM 548 C GLU A 36 -33.984 -5.234 -1.259 1.00 0.00 C ATOM 549 O GLU A 36 -33.422 -4.712 -0.318 1.00 0.00 O ATOM 550 CB GLU A 36 -36.171 -4.499 -2.265 1.00 0.00 C ATOM 551 CG GLU A 36 -36.621 -4.188 -0.836 1.00 0.00 C ATOM 552 CD GLU A 36 -37.563 -5.289 -0.346 1.00 0.00 C ATOM 553 OE1 GLU A 36 -38.055 -6.034 -1.178 1.00 0.00 O ATOM 554 OE2 GLU A 36 -37.775 -5.370 0.853 1.00 0.00 O ATOM 0 H GLU A 36 -35.096 -5.232 -4.267 1.00 0.00 H new ATOM 0 HA GLU A 36 -34.301 -3.368 -2.221 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -36.636 -3.804 -2.964 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -36.494 -5.500 -2.549 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -35.755 -4.117 -0.178 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -37.126 -3.222 -0.804 1.00 0.00 H new ATOM 561 N TRP A 37 -34.045 -6.532 -1.376 1.00 0.00 N ATOM 562 CA TRP A 37 -33.416 -7.403 -0.342 1.00 0.00 C ATOM 563 C TRP A 37 -31.898 -7.204 -0.336 1.00 0.00 C ATOM 564 O TRP A 37 -31.267 -7.195 0.702 1.00 0.00 O ATOM 565 CB TRP A 37 -33.768 -8.832 -0.758 1.00 0.00 C ATOM 566 CG TRP A 37 -32.930 -9.799 0.016 1.00 0.00 C ATOM 567 CD1 TRP A 37 -33.289 -10.376 1.186 1.00 0.00 C ATOM 568 CD2 TRP A 37 -31.603 -10.311 -0.303 1.00 0.00 C ATOM 569 NE1 TRP A 37 -32.268 -11.209 1.606 1.00 0.00 N ATOM 570 CE2 TRP A 37 -31.207 -11.203 0.723 1.00 0.00 C ATOM 571 CE3 TRP A 37 -30.713 -10.089 -1.372 1.00 0.00 C ATOM 572 CZ2 TRP A 37 -29.971 -11.853 0.688 1.00 0.00 C ATOM 573 CZ3 TRP A 37 -29.469 -10.742 -1.409 1.00 0.00 C ATOM 574 CH2 TRP A 37 -29.099 -11.621 -0.381 1.00 0.00 C ATOM 0 H TRP A 37 -34.502 -7.027 -2.142 1.00 0.00 H new ATOM 0 HA TRP A 37 -33.771 -7.173 0.663 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -34.825 -9.025 -0.576 1.00 0.00 H new ATOM 0 HB3 TRP A 37 -33.599 -8.963 -1.827 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -34.221 -10.213 1.707 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -32.296 -11.761 2.464 1.00 0.00 H new ATOM 0 HE3 TRP A 37 -30.988 -9.413 -2.168 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -29.690 -12.530 1.481 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -28.794 -10.566 -2.234 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -28.141 -12.119 -0.415 1.00 0.00 H new ATOM 585 N LEU A 38 -31.308 -7.044 -1.489 1.00 0.00 N ATOM 586 CA LEU A 38 -29.831 -6.845 -1.549 1.00 0.00 C ATOM 587 C LEU A 38 -29.426 -5.616 -0.729 1.00 0.00 C ATOM 588 O LEU A 38 -28.552 -5.679 0.111 1.00 0.00 O ATOM 589 CB LEU A 38 -29.521 -6.629 -3.030 1.00 0.00 C ATOM 590 CG LEU A 38 -28.328 -7.496 -3.435 1.00 0.00 C ATOM 591 CD1 LEU A 38 -28.149 -7.441 -4.953 1.00 0.00 C ATOM 592 CD2 LEU A 38 -27.062 -6.973 -2.753 1.00 0.00 C ATOM 0 H LEU A 38 -31.784 -7.042 -2.391 1.00 0.00 H new ATOM 0 HA LEU A 38 -29.284 -7.693 -1.137 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -30.391 -6.884 -3.635 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -29.300 -5.578 -3.216 1.00 0.00 H new ATOM 0 HG LEU A 38 -28.507 -8.526 -3.127 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -27.299 -8.059 -5.242 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -29.050 -7.814 -5.439 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -27.970 -6.411 -5.261 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -26.212 -7.591 -3.041 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -26.883 -5.943 -3.060 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -27.189 -7.013 -1.671 1.00 0.00 H new ATOM 604 N ALA A 39 -30.056 -4.498 -0.970 1.00 0.00 N ATOM 605 CA ALA A 39 -29.705 -3.266 -0.206 1.00 0.00 C ATOM 606 C ALA A 39 -30.123 -3.415 1.260 1.00 0.00 C ATOM 607 O ALA A 39 -29.545 -2.815 2.144 1.00 0.00 O ATOM 608 CB ALA A 39 -30.499 -2.144 -0.877 1.00 0.00 C ATOM 0 H ALA A 39 -30.797 -4.384 -1.661 1.00 0.00 H new ATOM 0 HA ALA A 39 -28.633 -3.068 -0.212 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -30.295 -1.201 -0.371 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -30.205 -2.066 -1.924 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -31.565 -2.365 -0.815 1.00 0.00 H new ATOM 614 N ARG A 40 -31.123 -4.210 1.522 1.00 0.00 N ATOM 615 CA ARG A 40 -31.578 -4.396 2.930 1.00 0.00 C ATOM 616 C ARG A 40 -30.478 -5.062 3.763 1.00 0.00 C ATOM 617 O ARG A 40 -30.145 -4.613 4.840 1.00 0.00 O ATOM 618 CB ARG A 40 -32.802 -5.308 2.831 1.00 0.00 C ATOM 619 CG ARG A 40 -33.245 -5.722 4.235 1.00 0.00 C ATOM 620 CD ARG A 40 -32.811 -7.164 4.503 1.00 0.00 C ATOM 621 NE ARG A 40 -33.525 -7.555 5.749 1.00 0.00 N ATOM 622 CZ ARG A 40 -33.100 -7.126 6.906 1.00 0.00 C ATOM 623 NH1 ARG A 40 -33.342 -5.898 7.275 1.00 0.00 N ATOM 624 NH2 ARG A 40 -32.433 -7.925 7.693 1.00 0.00 N ATOM 0 H ARG A 40 -31.645 -4.739 0.823 1.00 0.00 H new ATOM 0 HA ARG A 40 -31.811 -3.449 3.416 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -33.614 -4.791 2.320 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -32.564 -6.191 2.238 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -32.807 -5.055 4.977 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -34.328 -5.634 4.327 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -33.079 -7.818 3.673 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -31.731 -7.234 4.628 1.00 0.00 H new ATOM 0 HE ARG A 40 -34.346 -8.158 5.699 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -33.863 -5.274 6.659 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -33.010 -5.562 8.179 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -32.244 -8.885 7.404 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -32.101 -7.590 8.597 1.00 0.00 H new ATOM 638 N GLU A 41 -29.915 -6.132 3.273 1.00 0.00 N ATOM 639 CA GLU A 41 -28.839 -6.827 4.039 1.00 0.00 C ATOM 640 C GLU A 41 -27.517 -6.064 3.915 1.00 0.00 C ATOM 641 O GLU A 41 -26.678 -6.112 4.793 1.00 0.00 O ATOM 642 CB GLU A 41 -28.724 -8.208 3.392 1.00 0.00 C ATOM 643 CG GLU A 41 -29.396 -9.249 4.289 1.00 0.00 C ATOM 644 CD GLU A 41 -28.388 -10.341 4.649 1.00 0.00 C ATOM 645 OE1 GLU A 41 -27.772 -10.874 3.741 1.00 0.00 O ATOM 646 OE2 GLU A 41 -28.248 -10.625 5.828 1.00 0.00 O ATOM 0 H GLU A 41 -30.152 -6.556 2.376 1.00 0.00 H new ATOM 0 HA GLU A 41 -29.067 -6.891 5.103 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -29.195 -8.201 2.409 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -27.675 -8.465 3.241 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -29.773 -8.775 5.195 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -30.254 -9.686 3.777 1.00 0.00 H new ATOM 653 N LEU A 42 -27.325 -5.360 2.834 1.00 0.00 N ATOM 654 CA LEU A 42 -26.056 -4.597 2.655 1.00 0.00 C ATOM 655 C LEU A 42 -26.150 -3.235 3.351 1.00 0.00 C ATOM 656 O LEU A 42 -25.201 -2.478 3.385 1.00 0.00 O ATOM 657 CB LEU A 42 -25.911 -4.418 1.144 1.00 0.00 C ATOM 658 CG LEU A 42 -24.969 -5.488 0.590 1.00 0.00 C ATOM 659 CD1 LEU A 42 -23.617 -5.395 1.299 1.00 0.00 C ATOM 660 CD2 LEU A 42 -25.575 -6.872 0.831 1.00 0.00 C ATOM 0 H LEU A 42 -27.992 -5.279 2.066 1.00 0.00 H new ATOM 0 HA LEU A 42 -25.200 -5.115 3.089 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -26.886 -4.493 0.663 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -25.521 -3.425 0.921 1.00 0.00 H new ATOM 0 HG LEU A 42 -24.830 -5.331 -0.480 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -22.946 -6.158 0.904 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -23.185 -4.409 1.130 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -23.756 -5.552 2.369 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -24.905 -7.636 0.437 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -25.713 -7.027 1.901 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -26.539 -6.940 0.327 1.00 0.00 H new ATOM 672 N GLU A 43 -27.288 -2.918 3.904 1.00 0.00 N ATOM 673 CA GLU A 43 -27.439 -1.605 4.595 1.00 0.00 C ATOM 674 C GLU A 43 -28.550 -1.684 5.646 1.00 0.00 C ATOM 675 O GLU A 43 -28.389 -1.242 6.767 1.00 0.00 O ATOM 676 CB GLU A 43 -27.815 -0.617 3.490 1.00 0.00 C ATOM 677 CG GLU A 43 -26.889 0.599 3.556 1.00 0.00 C ATOM 678 CD GLU A 43 -27.143 1.500 2.345 1.00 0.00 C ATOM 679 OE1 GLU A 43 -26.811 1.090 1.246 1.00 0.00 O ATOM 680 OE2 GLU A 43 -27.665 2.586 2.539 1.00 0.00 O ATOM 0 H GLU A 43 -28.119 -3.510 3.908 1.00 0.00 H new ATOM 0 HA GLU A 43 -26.530 -1.306 5.117 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -27.733 -1.097 2.515 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -28.853 -0.304 3.605 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -27.064 1.153 4.478 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -25.848 0.276 3.571 1.00 0.00 H new ATOM 687 N GLY A 44 -29.674 -2.243 5.295 1.00 0.00 N ATOM 688 CA GLY A 44 -30.791 -2.349 6.275 1.00 0.00 C ATOM 689 C GLY A 44 -32.035 -1.658 5.713 1.00 0.00 C ATOM 690 O GLY A 44 -32.993 -1.417 6.420 1.00 0.00 O ATOM 0 H GLY A 44 -29.868 -2.631 4.372 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -31.007 -3.397 6.483 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -30.503 -1.889 7.221 1.00 0.00 H new ATOM 694 N ILE A 45 -32.029 -1.337 4.448 1.00 0.00 N ATOM 695 CA ILE A 45 -33.214 -0.662 3.845 1.00 0.00 C ATOM 696 C ILE A 45 -34.339 -1.675 3.618 1.00 0.00 C ATOM 697 O ILE A 45 -34.545 -2.152 2.520 1.00 0.00 O ATOM 698 CB ILE A 45 -32.715 -0.105 2.512 1.00 0.00 C ATOM 699 CG1 ILE A 45 -31.662 0.976 2.771 1.00 0.00 C ATOM 700 CG2 ILE A 45 -33.889 0.504 1.742 1.00 0.00 C ATOM 701 CD1 ILE A 45 -30.574 0.894 1.700 1.00 0.00 C ATOM 0 H ILE A 45 -31.256 -1.513 3.806 1.00 0.00 H new ATOM 0 HA ILE A 45 -33.617 0.121 4.488 1.00 0.00 H new ATOM 0 HB ILE A 45 -32.273 -0.911 1.926 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -32.127 1.962 2.758 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -31.224 0.843 3.760 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -33.534 0.901 0.791 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -34.640 -0.264 1.556 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -34.331 1.309 2.329 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -29.824 1.663 1.884 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -30.103 -0.088 1.735 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -31.019 1.048 0.717 1.00 0.00 H new ATOM 713 N GLN A 46 -35.068 -2.006 4.648 1.00 0.00 N ATOM 714 CA GLN A 46 -36.178 -2.988 4.492 1.00 0.00 C ATOM 715 C GLN A 46 -37.093 -2.575 3.335 1.00 0.00 C ATOM 716 O GLN A 46 -37.403 -3.364 2.465 1.00 0.00 O ATOM 717 CB GLN A 46 -36.936 -2.940 5.819 1.00 0.00 C ATOM 718 CG GLN A 46 -36.280 -3.896 6.817 1.00 0.00 C ATOM 719 CD GLN A 46 -35.597 -3.088 7.923 1.00 0.00 C ATOM 720 OE1 GLN A 46 -34.482 -3.382 8.305 1.00 0.00 O ATOM 721 NE2 GLN A 46 -36.222 -2.075 8.457 1.00 0.00 N ATOM 0 H GLN A 46 -34.943 -1.639 5.591 1.00 0.00 H new ATOM 0 HA GLN A 46 -35.814 -3.990 4.265 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -36.932 -1.925 6.216 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -37.979 -3.218 5.665 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -37.029 -4.560 7.247 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -35.550 -4.526 6.308 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -37.158 -1.827 8.137 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -35.774 -1.531 9.194 1.00 0.00 H new ATOM 730 N LYS A 47 -37.527 -1.345 3.319 1.00 0.00 N ATOM 731 CA LYS A 47 -38.421 -0.884 2.218 1.00 0.00 C ATOM 732 C LYS A 47 -37.692 0.132 1.336 1.00 0.00 C ATOM 733 O LYS A 47 -37.093 1.072 1.819 1.00 0.00 O ATOM 734 CB LYS A 47 -39.610 -0.229 2.922 1.00 0.00 C ATOM 735 CG LYS A 47 -40.258 -1.236 3.875 1.00 0.00 C ATOM 736 CD LYS A 47 -39.942 -0.847 5.321 1.00 0.00 C ATOM 737 CE LYS A 47 -40.791 0.362 5.722 1.00 0.00 C ATOM 738 NZ LYS A 47 -39.889 1.203 6.558 1.00 0.00 N ATOM 0 H LYS A 47 -37.302 -0.639 4.020 1.00 0.00 H new ATOM 0 HA LYS A 47 -38.733 -1.702 1.568 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -39.279 0.650 3.475 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -40.339 0.112 2.187 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -41.337 -1.257 3.720 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -39.887 -2.240 3.668 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -40.146 -1.685 5.987 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -38.883 -0.610 5.422 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -41.140 0.908 4.845 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -41.676 0.056 6.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -40.399 2.053 6.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -39.578 0.659 7.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -39.059 1.485 5.998 1.00 0.00 H new ATOM 752 N MET A 48 -37.738 -0.049 0.044 1.00 0.00 N ATOM 753 CA MET A 48 -37.047 0.908 -0.868 1.00 0.00 C ATOM 754 C MET A 48 -37.832 2.220 -0.953 1.00 0.00 C ATOM 755 O MET A 48 -38.984 2.242 -1.338 1.00 0.00 O ATOM 756 CB MET A 48 -37.022 0.210 -2.229 1.00 0.00 C ATOM 757 CG MET A 48 -35.878 -0.805 -2.263 1.00 0.00 C ATOM 758 SD MET A 48 -34.294 0.070 -2.184 1.00 0.00 S ATOM 759 CE MET A 48 -34.222 0.566 -3.923 1.00 0.00 C ATOM 0 H MET A 48 -38.223 -0.817 -0.419 1.00 0.00 H new ATOM 0 HA MET A 48 -36.045 1.160 -0.520 1.00 0.00 H new ATOM 0 HB2 MET A 48 -37.973 -0.292 -2.409 1.00 0.00 H new ATOM 0 HB3 MET A 48 -36.894 0.945 -3.024 1.00 0.00 H new ATOM 0 HG2 MET A 48 -35.966 -1.497 -1.425 1.00 0.00 H new ATOM 0 HG3 MET A 48 -35.932 -1.400 -3.175 1.00 0.00 H new ATOM 0 HE1 MET A 48 -33.224 0.939 -4.154 1.00 0.00 H new ATOM 0 HE2 MET A 48 -34.444 -0.293 -4.556 1.00 0.00 H new ATOM 0 HE3 MET A 48 -34.955 1.352 -4.108 1.00 0.00 H new ATOM 769 N THR A 49 -37.216 3.314 -0.595 1.00 0.00 N ATOM 770 CA THR A 49 -37.928 4.623 -0.657 1.00 0.00 C ATOM 771 C THR A 49 -38.012 5.110 -2.106 1.00 0.00 C ATOM 772 O THR A 49 -37.931 4.334 -3.038 1.00 0.00 O ATOM 773 CB THR A 49 -37.076 5.577 0.181 1.00 0.00 C ATOM 774 OG1 THR A 49 -36.447 4.852 1.229 1.00 0.00 O ATOM 775 CG2 THR A 49 -37.965 6.670 0.776 1.00 0.00 C ATOM 0 H THR A 49 -36.253 3.358 -0.263 1.00 0.00 H new ATOM 0 HA THR A 49 -38.950 4.556 -0.285 1.00 0.00 H new ATOM 0 HB THR A 49 -36.316 6.035 -0.451 1.00 0.00 H new ATOM 0 HG1 THR A 49 -35.517 4.662 0.983 1.00 0.00 H new ATOM 0 HG21 THR A 49 -37.356 7.349 1.373 1.00 0.00 H new ATOM 0 HG22 THR A 49 -38.446 7.226 -0.029 1.00 0.00 H new ATOM 0 HG23 THR A 49 -38.727 6.215 1.408 1.00 0.00 H new ATOM 783 N GLU A 50 -38.175 6.389 -2.303 1.00 0.00 N ATOM 784 CA GLU A 50 -38.264 6.924 -3.693 1.00 0.00 C ATOM 785 C GLU A 50 -36.879 7.358 -4.182 1.00 0.00 C ATOM 786 O GLU A 50 -36.597 7.345 -5.364 1.00 0.00 O ATOM 787 CB GLU A 50 -39.201 8.128 -3.593 1.00 0.00 C ATOM 788 CG GLU A 50 -40.645 7.641 -3.462 1.00 0.00 C ATOM 789 CD GLU A 50 -41.113 7.812 -2.015 1.00 0.00 C ATOM 790 OE1 GLU A 50 -40.303 7.614 -1.125 1.00 0.00 O ATOM 791 OE2 GLU A 50 -42.272 8.137 -1.823 1.00 0.00 O ATOM 0 H GLU A 50 -38.250 7.087 -1.563 1.00 0.00 H new ATOM 0 HA GLU A 50 -38.631 6.180 -4.401 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -38.933 8.740 -2.732 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -39.097 8.758 -4.477 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -41.292 8.205 -4.134 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -40.715 6.594 -3.757 1.00 0.00 H new ATOM 798 N GLU A 51 -36.014 7.741 -3.285 1.00 0.00 N ATOM 799 CA GLU A 51 -34.649 8.174 -3.700 1.00 0.00 C ATOM 800 C GLU A 51 -33.815 6.961 -4.121 1.00 0.00 C ATOM 801 O GLU A 51 -33.185 6.958 -5.159 1.00 0.00 O ATOM 802 CB GLU A 51 -34.049 8.835 -2.459 1.00 0.00 C ATOM 803 CG GLU A 51 -34.118 10.356 -2.606 1.00 0.00 C ATOM 804 CD GLU A 51 -35.259 10.902 -1.746 1.00 0.00 C ATOM 805 OE1 GLU A 51 -35.902 10.109 -1.078 1.00 0.00 O ATOM 806 OE2 GLU A 51 -35.469 12.103 -1.770 1.00 0.00 O ATOM 0 H GLU A 51 -36.193 7.773 -2.281 1.00 0.00 H new ATOM 0 HA GLU A 51 -34.672 8.854 -4.552 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -34.592 8.520 -1.568 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -33.014 8.518 -2.330 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -33.172 10.804 -2.301 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -34.276 10.624 -3.651 1.00 0.00 H new ATOM 813 N HIS A 52 -33.806 5.929 -3.321 1.00 0.00 N ATOM 814 CA HIS A 52 -33.013 4.717 -3.675 1.00 0.00 C ATOM 815 C HIS A 52 -33.349 4.260 -5.098 1.00 0.00 C ATOM 816 O HIS A 52 -32.474 3.967 -5.888 1.00 0.00 O ATOM 817 CB HIS A 52 -33.437 3.657 -2.657 1.00 0.00 C ATOM 818 CG HIS A 52 -32.735 3.906 -1.351 1.00 0.00 C ATOM 819 ND1 HIS A 52 -33.425 4.278 -0.192 1.00 0.00 N ATOM 820 CD2 HIS A 52 -31.405 3.842 -0.995 1.00 0.00 C ATOM 821 CE1 HIS A 52 -32.517 4.421 0.796 1.00 0.00 C ATOM 822 NE2 HIS A 52 -31.299 4.166 0.342 1.00 0.00 N ATOM 0 H HIS A 52 -34.313 5.873 -2.438 1.00 0.00 H new ATOM 0 HA HIS A 52 -31.939 4.903 -3.648 1.00 0.00 H new ATOM 0 HB2 HIS A 52 -34.517 3.687 -2.513 1.00 0.00 H new ATOM 0 HB3 HIS A 52 -33.193 2.662 -3.029 1.00 0.00 H new ATOM 0 HD2 HIS A 52 -30.586 3.583 -1.650 1.00 0.00 H new ATOM 0 HE1 HIS A 52 -32.750 4.703 1.812 1.00 0.00 H new ATOM 0 HE2 HIS A 52 -30.436 4.203 0.884 1.00 0.00 H new ATOM 830 N TRP A 53 -34.610 4.194 -5.428 1.00 0.00 N ATOM 831 CA TRP A 53 -35.001 3.753 -6.798 1.00 0.00 C ATOM 832 C TRP A 53 -34.671 4.843 -7.821 1.00 0.00 C ATOM 833 O TRP A 53 -34.366 4.564 -8.963 1.00 0.00 O ATOM 834 CB TRP A 53 -36.511 3.527 -6.725 1.00 0.00 C ATOM 835 CG TRP A 53 -36.784 2.108 -6.343 1.00 0.00 C ATOM 836 CD1 TRP A 53 -37.675 1.715 -5.404 1.00 0.00 C ATOM 837 CD2 TRP A 53 -36.181 0.892 -6.870 1.00 0.00 C ATOM 838 NE1 TRP A 53 -37.658 0.334 -5.322 1.00 0.00 N ATOM 839 CE2 TRP A 53 -36.752 -0.219 -6.206 1.00 0.00 C ATOM 840 CE3 TRP A 53 -35.202 0.649 -7.853 1.00 0.00 C ATOM 841 CZ2 TRP A 53 -36.366 -1.526 -6.505 1.00 0.00 C ATOM 842 CZ3 TRP A 53 -34.810 -0.667 -8.156 1.00 0.00 C ATOM 843 CH2 TRP A 53 -35.392 -1.752 -7.484 1.00 0.00 C ATOM 0 H TRP A 53 -35.386 4.426 -4.809 1.00 0.00 H new ATOM 0 HA TRP A 53 -34.468 2.855 -7.109 1.00 0.00 H new ATOM 0 HB2 TRP A 53 -36.956 4.203 -5.995 1.00 0.00 H new ATOM 0 HB3 TRP A 53 -36.970 3.750 -7.688 1.00 0.00 H new ATOM 0 HD1 TRP A 53 -38.298 2.372 -4.815 1.00 0.00 H new ATOM 0 HE1 TRP A 53 -38.243 -0.209 -4.687 1.00 0.00 H new ATOM 0 HE3 TRP A 53 -34.750 1.478 -8.377 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 -36.816 -2.358 -5.984 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 -34.057 -0.843 -8.910 1.00 0.00 H new ATOM 0 HH2 TRP A 53 -35.089 -2.761 -7.722 1.00 0.00 H new ATOM 854 N LYS A 54 -34.731 6.084 -7.421 1.00 0.00 N ATOM 855 CA LYS A 54 -34.422 7.190 -8.373 1.00 0.00 C ATOM 856 C LYS A 54 -32.980 7.071 -8.874 1.00 0.00 C ATOM 857 O LYS A 54 -32.736 6.867 -10.047 1.00 0.00 O ATOM 858 CB LYS A 54 -34.605 8.473 -7.561 1.00 0.00 C ATOM 859 CG LYS A 54 -35.976 9.079 -7.867 1.00 0.00 C ATOM 860 CD LYS A 54 -35.798 10.499 -8.408 1.00 0.00 C ATOM 861 CE LYS A 54 -35.453 10.439 -9.898 1.00 0.00 C ATOM 862 NZ LYS A 54 -36.621 11.055 -10.588 1.00 0.00 N ATOM 0 H LYS A 54 -34.980 6.380 -6.477 1.00 0.00 H new ATOM 0 HA LYS A 54 -35.065 7.169 -9.253 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -34.520 8.257 -6.496 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -33.818 9.186 -7.805 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -36.502 8.464 -8.597 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -36.587 9.096 -6.965 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -36.712 11.074 -8.259 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -35.006 11.011 -7.861 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -34.534 10.985 -10.113 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -35.297 9.411 -10.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -36.459 11.051 -11.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -37.480 10.510 -10.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -36.740 12.035 -10.261 1.00 0.00 H new ATOM 876 N LEU A 55 -32.023 7.200 -7.996 1.00 0.00 N ATOM 877 CA LEU A 55 -30.598 7.096 -8.426 1.00 0.00 C ATOM 878 C LEU A 55 -30.323 5.712 -9.020 1.00 0.00 C ATOM 879 O LEU A 55 -29.669 5.580 -10.035 1.00 0.00 O ATOM 880 CB LEU A 55 -29.782 7.302 -7.149 1.00 0.00 C ATOM 881 CG LEU A 55 -28.294 7.356 -7.498 1.00 0.00 C ATOM 882 CD1 LEU A 55 -27.951 8.736 -8.061 1.00 0.00 C ATOM 883 CD2 LEU A 55 -27.466 7.101 -6.236 1.00 0.00 C ATOM 0 H LEU A 55 -32.165 7.373 -7.001 1.00 0.00 H new ATOM 0 HA LEU A 55 -30.345 7.827 -9.194 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -30.085 8.226 -6.656 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -29.973 6.490 -6.448 1.00 0.00 H new ATOM 0 HG LEU A 55 -28.068 6.593 -8.243 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -26.890 8.774 -8.310 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -28.541 8.920 -8.959 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -28.177 9.499 -7.316 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -26.405 7.139 -6.483 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -27.693 7.864 -5.492 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -27.710 6.118 -5.833 1.00 0.00 H new ATOM 895 N VAL A 56 -30.817 4.679 -8.394 1.00 0.00 N ATOM 896 CA VAL A 56 -30.584 3.304 -8.924 1.00 0.00 C ATOM 897 C VAL A 56 -31.168 3.173 -10.332 1.00 0.00 C ATOM 898 O VAL A 56 -30.713 2.378 -11.131 1.00 0.00 O ATOM 899 CB VAL A 56 -31.315 2.377 -7.952 1.00 0.00 C ATOM 900 CG1 VAL A 56 -31.453 0.987 -8.575 1.00 0.00 C ATOM 901 CG2 VAL A 56 -30.518 2.274 -6.649 1.00 0.00 C ATOM 0 H VAL A 56 -31.371 4.727 -7.539 1.00 0.00 H new ATOM 0 HA VAL A 56 -29.523 3.064 -8.998 1.00 0.00 H new ATOM 0 HB VAL A 56 -32.306 2.780 -7.743 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -31.974 0.327 -7.881 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -32.020 1.059 -9.503 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -30.463 0.583 -8.786 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -31.038 1.613 -5.955 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -29.527 1.871 -6.859 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -30.420 3.264 -6.203 1.00 0.00 H new ATOM 911 N LYS A 57 -32.173 3.945 -10.642 1.00 0.00 N ATOM 912 CA LYS A 57 -32.786 3.863 -12.000 1.00 0.00 C ATOM 913 C LYS A 57 -31.898 4.570 -13.027 1.00 0.00 C ATOM 914 O LYS A 57 -31.524 4.002 -14.033 1.00 0.00 O ATOM 915 CB LYS A 57 -34.131 4.578 -11.872 1.00 0.00 C ATOM 916 CG LYS A 57 -34.960 4.334 -13.134 1.00 0.00 C ATOM 917 CD LYS A 57 -36.400 3.994 -12.743 1.00 0.00 C ATOM 918 CE LYS A 57 -37.361 4.958 -13.441 1.00 0.00 C ATOM 919 NZ LYS A 57 -38.632 4.857 -12.671 1.00 0.00 N ATOM 0 H LYS A 57 -32.597 4.629 -10.015 1.00 0.00 H new ATOM 0 HA LYS A 57 -32.902 2.833 -12.338 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -34.667 4.213 -10.996 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -33.974 5.647 -11.728 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -34.944 5.220 -13.769 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -34.527 3.519 -13.714 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -36.631 2.967 -13.024 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -36.520 4.063 -11.662 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -36.974 5.977 -13.432 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -37.509 4.682 -14.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -39.343 5.491 -13.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -38.980 3.877 -12.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -38.462 5.132 -11.683 1.00 0.00 H new ATOM 933 N TYR A 58 -31.558 5.806 -12.783 1.00 0.00 N ATOM 934 CA TYR A 58 -30.696 6.547 -13.748 1.00 0.00 C ATOM 935 C TYR A 58 -29.397 5.775 -13.996 1.00 0.00 C ATOM 936 O TYR A 58 -28.853 5.789 -15.082 1.00 0.00 O ATOM 937 CB TYR A 58 -30.404 7.888 -13.075 1.00 0.00 C ATOM 938 CG TYR A 58 -30.416 8.985 -14.113 1.00 0.00 C ATOM 939 CD1 TYR A 58 -31.535 9.154 -14.938 1.00 0.00 C ATOM 940 CD2 TYR A 58 -29.309 9.831 -14.250 1.00 0.00 C ATOM 941 CE1 TYR A 58 -31.547 10.172 -15.902 1.00 0.00 C ATOM 942 CE2 TYR A 58 -29.321 10.849 -15.214 1.00 0.00 C ATOM 943 CZ TYR A 58 -30.440 11.019 -16.040 1.00 0.00 C ATOM 944 OH TYR A 58 -30.451 12.021 -16.988 1.00 0.00 O ATOM 0 H TYR A 58 -31.840 6.335 -11.958 1.00 0.00 H new ATOM 0 HA TYR A 58 -31.179 6.677 -14.717 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -31.150 8.091 -12.307 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -29.435 7.854 -12.577 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -32.388 8.500 -14.832 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -28.446 9.700 -13.614 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -32.410 10.303 -16.538 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -28.468 11.502 -15.320 1.00 0.00 H new ATOM 0 HH TYR A 58 -29.606 12.517 -16.950 1.00 0.00 H new ATOM 954 N LEU A 59 -28.896 5.099 -12.998 1.00 0.00 N ATOM 955 CA LEU A 59 -27.634 4.326 -13.181 1.00 0.00 C ATOM 956 C LEU A 59 -27.829 3.246 -14.248 1.00 0.00 C ATOM 957 O LEU A 59 -27.076 3.153 -15.197 1.00 0.00 O ATOM 958 CB LEU A 59 -27.352 3.693 -11.819 1.00 0.00 C ATOM 959 CG LEU A 59 -26.159 4.392 -11.168 1.00 0.00 C ATOM 960 CD1 LEU A 59 -26.450 4.629 -9.685 1.00 0.00 C ATOM 961 CD2 LEU A 59 -24.916 3.510 -11.308 1.00 0.00 C ATOM 0 H LEU A 59 -29.305 5.048 -12.065 1.00 0.00 H new ATOM 0 HA LEU A 59 -26.808 4.955 -13.513 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -28.230 3.777 -11.178 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -27.144 2.630 -11.937 1.00 0.00 H new ATOM 0 HG LEU A 59 -25.986 5.349 -11.660 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -25.598 5.128 -9.222 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -27.336 5.256 -9.584 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -26.623 3.673 -9.191 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -24.064 4.006 -10.844 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -25.091 2.554 -10.815 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -24.707 3.341 -12.364 1.00 0.00 H new ATOM 973 N ARG A 60 -28.836 2.429 -14.099 1.00 0.00 N ATOM 974 CA ARG A 60 -29.078 1.357 -15.106 1.00 0.00 C ATOM 975 C ARG A 60 -29.131 1.960 -16.511 1.00 0.00 C ATOM 976 O ARG A 60 -28.454 1.512 -17.416 1.00 0.00 O ATOM 977 CB ARG A 60 -30.433 0.758 -14.728 1.00 0.00 C ATOM 978 CG ARG A 60 -30.333 -0.768 -14.718 1.00 0.00 C ATOM 979 CD ARG A 60 -31.666 -1.371 -15.165 1.00 0.00 C ATOM 980 NE ARG A 60 -31.394 -2.825 -15.329 1.00 0.00 N ATOM 981 CZ ARG A 60 -31.707 -3.660 -14.376 1.00 0.00 C ATOM 982 NH1 ARG A 60 -31.142 -3.554 -13.205 1.00 0.00 N ATOM 983 NH2 ARG A 60 -32.585 -4.601 -14.596 1.00 0.00 N ATOM 0 H ARG A 60 -29.500 2.457 -13.325 1.00 0.00 H new ATOM 0 HA ARG A 60 -28.288 0.606 -15.111 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -30.741 1.119 -13.747 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -31.195 1.078 -15.439 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -29.533 -1.095 -15.383 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -30.080 -1.120 -13.718 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -32.447 -1.196 -14.424 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -32.008 -0.925 -16.099 1.00 0.00 H new ATOM 0 HE ARG A 60 -30.963 -3.169 -16.187 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -30.456 -2.819 -13.034 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -31.386 -4.206 -12.460 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -33.026 -4.683 -15.512 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -32.830 -5.254 -13.852 1.00 0.00 H new ATOM 997 N GLU A 61 -29.927 2.976 -16.701 1.00 0.00 N ATOM 998 CA GLU A 61 -30.020 3.609 -18.047 1.00 0.00 C ATOM 999 C GLU A 61 -28.619 3.915 -18.581 1.00 0.00 C ATOM 1000 O GLU A 61 -28.326 3.707 -19.741 1.00 0.00 O ATOM 1001 CB GLU A 61 -30.803 4.904 -17.821 1.00 0.00 C ATOM 1002 CG GLU A 61 -31.583 5.259 -19.088 1.00 0.00 C ATOM 1003 CD GLU A 61 -31.434 6.753 -19.378 1.00 0.00 C ATOM 1004 OE1 GLU A 61 -30.407 7.133 -19.916 1.00 0.00 O ATOM 1005 OE2 GLU A 61 -32.350 7.493 -19.058 1.00 0.00 O ATOM 0 H GLU A 61 -30.517 3.395 -15.982 1.00 0.00 H new ATOM 0 HA GLU A 61 -30.505 2.962 -18.778 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -31.488 4.785 -16.981 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -30.120 5.714 -17.563 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -31.213 4.676 -19.931 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -32.636 5.005 -18.963 1.00 0.00 H new ATOM 1012 N TYR A 62 -27.749 4.406 -17.740 1.00 0.00 N ATOM 1013 CA TYR A 62 -26.367 4.724 -18.196 1.00 0.00 C ATOM 1014 C TYR A 62 -25.632 3.440 -18.589 1.00 0.00 C ATOM 1015 O TYR A 62 -24.838 3.424 -19.509 1.00 0.00 O ATOM 1016 CB TYR A 62 -25.693 5.378 -16.989 1.00 0.00 C ATOM 1017 CG TYR A 62 -24.460 6.123 -17.440 1.00 0.00 C ATOM 1018 CD1 TYR A 62 -23.353 5.415 -17.928 1.00 0.00 C ATOM 1019 CD2 TYR A 62 -24.421 7.522 -17.369 1.00 0.00 C ATOM 1020 CE1 TYR A 62 -22.207 6.105 -18.345 1.00 0.00 C ATOM 1021 CE2 TYR A 62 -23.274 8.213 -17.787 1.00 0.00 C ATOM 1022 CZ TYR A 62 -22.168 7.504 -18.275 1.00 0.00 C ATOM 1023 OH TYR A 62 -21.040 8.184 -18.686 1.00 0.00 O ATOM 0 H TYR A 62 -27.937 4.600 -16.756 1.00 0.00 H new ATOM 0 HA TYR A 62 -26.360 5.375 -19.070 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -26.386 6.063 -16.500 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -25.423 4.619 -16.255 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -23.383 4.337 -17.983 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -25.274 8.068 -16.993 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -21.354 5.559 -18.720 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -23.243 9.291 -17.733 1.00 0.00 H new ATOM 0 HH TYR A 62 -21.179 9.147 -18.572 1.00 0.00 H new ATOM 1033 N TRP A 63 -25.890 2.362 -17.900 1.00 0.00 N ATOM 1034 CA TRP A 63 -25.207 1.080 -18.235 1.00 0.00 C ATOM 1035 C TRP A 63 -25.653 0.585 -19.614 1.00 0.00 C ATOM 1036 O TRP A 63 -24.968 -0.184 -20.259 1.00 0.00 O ATOM 1037 CB TRP A 63 -25.648 0.101 -17.148 1.00 0.00 C ATOM 1038 CG TRP A 63 -24.822 -1.143 -17.232 1.00 0.00 C ATOM 1039 CD1 TRP A 63 -23.779 -1.439 -16.423 1.00 0.00 C ATOM 1040 CD2 TRP A 63 -24.950 -2.259 -18.161 1.00 0.00 C ATOM 1041 NE1 TRP A 63 -23.258 -2.665 -16.796 1.00 0.00 N ATOM 1042 CE2 TRP A 63 -23.945 -3.211 -17.861 1.00 0.00 C ATOM 1043 CE3 TRP A 63 -25.832 -2.534 -19.224 1.00 0.00 C ATOM 1044 CZ2 TRP A 63 -23.820 -4.395 -18.591 1.00 0.00 C ATOM 1045 CZ3 TRP A 63 -25.709 -3.726 -19.960 1.00 0.00 C ATOM 1046 CH2 TRP A 63 -24.705 -4.654 -19.644 1.00 0.00 C ATOM 0 H TRP A 63 -26.545 2.314 -17.119 1.00 0.00 H new ATOM 0 HA TRP A 63 -24.123 1.189 -18.272 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -25.537 0.558 -16.165 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -26.704 -0.142 -17.269 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -23.413 -0.819 -15.618 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -22.463 -3.111 -16.339 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -26.607 -1.825 -19.475 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -23.045 -5.106 -18.345 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -26.391 -3.928 -20.773 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -24.615 -5.568 -20.213 1.00 0.00 H new ATOM 1057 N GLU A 64 -26.795 1.021 -20.071 1.00 0.00 N ATOM 1058 CA GLU A 64 -27.283 0.574 -21.408 1.00 0.00 C ATOM 1059 C GLU A 64 -26.497 1.278 -22.518 1.00 0.00 C ATOM 1060 O GLU A 64 -26.592 0.927 -23.677 1.00 0.00 O ATOM 1061 CB GLU A 64 -28.756 0.982 -21.451 1.00 0.00 C ATOM 1062 CG GLU A 64 -29.631 -0.272 -21.505 1.00 0.00 C ATOM 1063 CD GLU A 64 -30.229 -0.538 -20.122 1.00 0.00 C ATOM 1064 OE1 GLU A 64 -30.927 0.329 -19.624 1.00 0.00 O ATOM 1065 OE2 GLU A 64 -29.979 -1.605 -19.586 1.00 0.00 O ATOM 0 H GLU A 64 -27.411 1.667 -19.577 1.00 0.00 H new ATOM 0 HA GLU A 64 -27.155 -0.498 -21.558 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -29.006 1.575 -20.571 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -28.946 1.609 -22.323 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -30.427 -0.141 -22.238 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -29.038 -1.128 -21.827 1.00 0.00 H new ATOM 1072 N THR A 65 -25.721 2.268 -22.172 1.00 0.00 N ATOM 1073 CA THR A 65 -24.931 2.993 -23.207 1.00 0.00 C ATOM 1074 C THR A 65 -23.657 2.213 -23.543 1.00 0.00 C ATOM 1075 O THR A 65 -23.341 1.987 -24.694 1.00 0.00 O ATOM 1076 CB THR A 65 -24.583 4.339 -22.568 1.00 0.00 C ATOM 1077 OG1 THR A 65 -25.772 4.956 -22.093 1.00 0.00 O ATOM 1078 CG2 THR A 65 -23.915 5.242 -23.605 1.00 0.00 C ATOM 0 H THR A 65 -25.600 2.606 -21.217 1.00 0.00 H new ATOM 0 HA THR A 65 -25.484 3.114 -24.139 1.00 0.00 H new ATOM 0 HB THR A 65 -23.898 4.180 -21.735 1.00 0.00 H new ATOM 0 HG1 THR A 65 -25.905 4.727 -21.149 1.00 0.00 H new ATOM 0 HG21 THR A 65 -23.668 6.200 -23.148 1.00 0.00 H new ATOM 0 HG22 THR A 65 -23.003 4.767 -23.968 1.00 0.00 H new ATOM 0 HG23 THR A 65 -24.597 5.403 -24.440 1.00 0.00 H new ATOM 1086 N PHE A 66 -22.922 1.802 -22.546 1.00 0.00 N ATOM 1087 CA PHE A 66 -21.668 1.038 -22.808 1.00 0.00 C ATOM 1088 C PHE A 66 -21.364 0.104 -21.633 1.00 0.00 C ATOM 1089 O PHE A 66 -20.915 -1.010 -21.812 1.00 0.00 O ATOM 1090 CB PHE A 66 -20.579 2.102 -22.943 1.00 0.00 C ATOM 1091 CG PHE A 66 -19.349 1.490 -23.569 1.00 0.00 C ATOM 1092 CD1 PHE A 66 -19.359 1.121 -24.921 1.00 0.00 C ATOM 1093 CD2 PHE A 66 -18.195 1.291 -22.798 1.00 0.00 C ATOM 1094 CE1 PHE A 66 -18.217 0.554 -25.502 1.00 0.00 C ATOM 1095 CE2 PHE A 66 -17.053 0.724 -23.378 1.00 0.00 C ATOM 1096 CZ PHE A 66 -17.064 0.355 -24.730 1.00 0.00 C ATOM 0 H PHE A 66 -23.135 1.962 -21.561 1.00 0.00 H new ATOM 0 HA PHE A 66 -21.741 0.414 -23.699 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -20.938 2.929 -23.556 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -20.335 2.513 -21.964 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -20.248 1.274 -25.515 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -18.187 1.575 -21.756 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -18.225 0.270 -26.544 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -16.164 0.571 -22.784 1.00 0.00 H new ATOM 0 HZ PHE A 66 -16.184 -0.083 -25.177 1.00 0.00 H new ATOM 1106 N GLY A 67 -21.605 0.554 -20.431 1.00 0.00 N ATOM 1107 CA GLY A 67 -21.329 -0.303 -19.244 1.00 0.00 C ATOM 1108 C GLY A 67 -20.343 0.411 -18.318 1.00 0.00 C ATOM 1109 O GLY A 67 -19.144 0.244 -18.423 1.00 0.00 O ATOM 0 H GLY A 67 -21.981 1.478 -20.221 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -22.256 -0.515 -18.712 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -20.918 -1.261 -19.562 1.00 0.00 H new ATOM 1113 N THR A 68 -20.838 1.209 -17.411 1.00 0.00 N ATOM 1114 CA THR A 68 -19.928 1.935 -16.480 1.00 0.00 C ATOM 1115 C THR A 68 -20.695 2.386 -15.234 1.00 0.00 C ATOM 1116 O THR A 68 -21.872 2.124 -15.089 1.00 0.00 O ATOM 1117 CB THR A 68 -19.435 3.147 -17.274 1.00 0.00 C ATOM 1118 OG1 THR A 68 -19.616 2.906 -18.663 1.00 0.00 O ATOM 1119 CG2 THR A 68 -17.952 3.379 -16.983 1.00 0.00 C ATOM 0 H THR A 68 -21.833 1.389 -17.275 1.00 0.00 H new ATOM 0 HA THR A 68 -19.104 1.309 -16.136 1.00 0.00 H new ATOM 0 HB THR A 68 -20.003 4.030 -16.981 1.00 0.00 H new ATOM 0 HG1 THR A 68 -19.302 3.682 -19.173 1.00 0.00 H new ATOM 0 HG21 THR A 68 -17.601 4.242 -17.549 1.00 0.00 H new ATOM 0 HG22 THR A 68 -17.815 3.563 -15.917 1.00 0.00 H new ATOM 0 HG23 THR A 68 -17.382 2.497 -17.275 1.00 0.00 H new ATOM 1127 N CYS A 69 -20.036 3.065 -14.334 1.00 0.00 N ATOM 1128 CA CYS A 69 -20.729 3.532 -13.099 1.00 0.00 C ATOM 1129 C CYS A 69 -20.278 4.952 -12.744 1.00 0.00 C ATOM 1130 O CYS A 69 -19.382 5.137 -11.944 1.00 0.00 O ATOM 1131 CB CYS A 69 -20.304 2.546 -12.011 1.00 0.00 C ATOM 1132 SG CYS A 69 -21.639 1.361 -11.713 1.00 0.00 S ATOM 0 H CYS A 69 -19.050 3.316 -14.400 1.00 0.00 H new ATOM 0 HA CYS A 69 -21.812 3.564 -13.219 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -19.399 2.021 -12.315 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -20.068 3.082 -11.092 1.00 0.00 H new ATOM 1137 N PRO A 70 -20.921 5.910 -13.354 1.00 0.00 N ATOM 1138 CA PRO A 70 -20.587 7.333 -13.103 1.00 0.00 C ATOM 1139 C PRO A 70 -21.074 7.759 -11.713 1.00 0.00 C ATOM 1140 O PRO A 70 -22.234 7.599 -11.387 1.00 0.00 O ATOM 1141 CB PRO A 70 -21.346 8.076 -14.199 1.00 0.00 C ATOM 1142 CG PRO A 70 -22.476 7.171 -14.571 1.00 0.00 C ATOM 1143 CD PRO A 70 -22.009 5.759 -14.326 1.00 0.00 C ATOM 0 HA PRO A 70 -19.516 7.534 -13.123 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -21.713 9.038 -13.842 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -20.704 8.278 -15.056 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -23.361 7.394 -13.974 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -22.753 7.310 -15.616 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -22.812 5.135 -13.933 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -21.661 5.288 -15.245 1.00 0.00 H new ATOM 1151 N PRO A 71 -20.166 8.289 -10.938 1.00 0.00 N ATOM 1152 CA PRO A 71 -20.504 8.742 -9.568 1.00 0.00 C ATOM 1153 C PRO A 71 -21.300 10.049 -9.616 1.00 0.00 C ATOM 1154 O PRO A 71 -20.741 11.129 -9.621 1.00 0.00 O ATOM 1155 CB PRO A 71 -19.142 8.962 -8.916 1.00 0.00 C ATOM 1156 CG PRO A 71 -18.204 9.226 -10.052 1.00 0.00 C ATOM 1157 CD PRO A 71 -18.752 8.512 -11.262 1.00 0.00 C ATOM 0 HA PRO A 71 -21.123 8.029 -9.023 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -19.168 9.803 -8.223 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -18.833 8.087 -8.344 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -18.122 10.296 -10.242 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -17.203 8.867 -9.815 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -18.640 9.114 -12.164 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -18.231 7.571 -11.439 1.00 0.00 H new ATOM 1165 N ILE A 72 -22.601 9.962 -9.648 1.00 0.00 N ATOM 1166 CA ILE A 72 -23.431 11.203 -9.692 1.00 0.00 C ATOM 1167 C ILE A 72 -22.900 12.149 -10.778 1.00 0.00 C ATOM 1168 O ILE A 72 -22.640 11.739 -11.893 1.00 0.00 O ATOM 1169 CB ILE A 72 -23.290 11.832 -8.302 1.00 0.00 C ATOM 1170 CG1 ILE A 72 -23.298 10.738 -7.228 1.00 0.00 C ATOM 1171 CG2 ILE A 72 -24.460 12.786 -8.054 1.00 0.00 C ATOM 1172 CD1 ILE A 72 -24.630 9.989 -7.272 1.00 0.00 C ATOM 0 H ILE A 72 -23.126 9.088 -9.646 1.00 0.00 H new ATOM 0 HA ILE A 72 -24.474 10.997 -9.933 1.00 0.00 H new ATOM 0 HB ILE A 72 -22.348 12.379 -8.253 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -22.473 10.045 -7.394 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -23.150 11.180 -6.243 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -24.361 13.234 -7.065 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -24.456 13.571 -8.810 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -25.398 12.234 -8.109 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -24.635 9.211 -6.508 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -25.446 10.687 -7.085 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -24.759 9.534 -8.254 1.00 0.00 H new ATOM 1184 N LYS A 73 -22.735 13.408 -10.467 1.00 0.00 N ATOM 1185 CA LYS A 73 -22.218 14.369 -11.485 1.00 0.00 C ATOM 1186 C LYS A 73 -23.131 14.383 -12.718 1.00 0.00 C ATOM 1187 O LYS A 73 -24.145 15.051 -12.739 1.00 0.00 O ATOM 1188 CB LYS A 73 -20.822 13.857 -11.843 1.00 0.00 C ATOM 1189 CG LYS A 73 -19.809 14.384 -10.826 1.00 0.00 C ATOM 1190 CD LYS A 73 -18.656 15.071 -11.560 1.00 0.00 C ATOM 1191 CE LYS A 73 -17.388 14.992 -10.706 1.00 0.00 C ATOM 1192 NZ LYS A 73 -16.286 14.739 -11.676 1.00 0.00 N ATOM 0 H LYS A 73 -22.936 13.812 -9.552 1.00 0.00 H new ATOM 0 HA LYS A 73 -22.188 15.392 -11.110 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -20.813 12.767 -11.849 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -20.549 14.184 -12.847 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -20.292 15.087 -10.147 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -19.429 13.564 -10.217 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -18.488 14.592 -12.525 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -18.908 16.112 -11.761 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -17.224 15.918 -10.155 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -17.457 14.191 -9.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -15.383 14.672 -11.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -16.465 13.847 -12.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -16.240 15.521 -12.360 1.00 0.00 H new ATOM 1206 N MET A 74 -22.782 13.656 -13.746 1.00 0.00 N ATOM 1207 CA MET A 74 -23.638 13.640 -14.968 1.00 0.00 C ATOM 1208 C MET A 74 -25.101 13.407 -14.587 1.00 0.00 C ATOM 1209 O MET A 74 -26.006 13.768 -15.313 1.00 0.00 O ATOM 1210 CB MET A 74 -23.110 12.477 -15.807 1.00 0.00 C ATOM 1211 CG MET A 74 -23.689 12.564 -17.220 1.00 0.00 C ATOM 1212 SD MET A 74 -24.859 11.207 -17.479 1.00 0.00 S ATOM 1213 CE MET A 74 -24.753 11.159 -19.284 1.00 0.00 C ATOM 0 H MET A 74 -21.945 13.075 -13.793 1.00 0.00 H new ATOM 0 HA MET A 74 -23.599 14.584 -15.511 1.00 0.00 H new ATOM 0 HB2 MET A 74 -22.021 12.508 -15.846 1.00 0.00 H new ATOM 0 HB3 MET A 74 -23.386 11.528 -15.347 1.00 0.00 H new ATOM 0 HG2 MET A 74 -24.190 13.522 -17.361 1.00 0.00 H new ATOM 0 HG3 MET A 74 -22.887 12.512 -17.957 1.00 0.00 H new ATOM 0 HE1 MET A 74 -25.409 10.377 -19.666 1.00 0.00 H new ATOM 0 HE2 MET A 74 -25.061 12.122 -19.692 1.00 0.00 H new ATOM 0 HE3 MET A 74 -23.726 10.950 -19.583 1.00 0.00 H new ATOM 1223 N VAL A 75 -25.340 12.805 -13.455 1.00 0.00 N ATOM 1224 CA VAL A 75 -26.746 12.548 -13.029 1.00 0.00 C ATOM 1225 C VAL A 75 -27.441 13.864 -12.669 1.00 0.00 C ATOM 1226 O VAL A 75 -28.550 14.127 -13.089 1.00 0.00 O ATOM 1227 CB VAL A 75 -26.627 11.649 -11.799 1.00 0.00 C ATOM 1228 CG1 VAL A 75 -28.017 11.166 -11.382 1.00 0.00 C ATOM 1229 CG2 VAL A 75 -25.749 10.441 -12.135 1.00 0.00 C ATOM 0 H VAL A 75 -24.623 12.480 -12.806 1.00 0.00 H new ATOM 0 HA VAL A 75 -27.338 12.084 -13.818 1.00 0.00 H new ATOM 0 HB VAL A 75 -26.177 12.211 -10.981 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -27.931 10.525 -10.505 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -28.644 12.025 -11.144 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -28.467 10.603 -12.200 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -25.663 9.799 -11.259 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -26.200 9.880 -12.953 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -24.758 10.783 -12.433 1.00 0.00 H new ATOM 1239 N THR A 76 -26.797 14.694 -11.894 1.00 0.00 N ATOM 1240 CA THR A 76 -27.424 15.992 -11.510 1.00 0.00 C ATOM 1241 C THR A 76 -27.632 16.866 -12.749 1.00 0.00 C ATOM 1242 O THR A 76 -28.596 17.600 -12.849 1.00 0.00 O ATOM 1243 CB THR A 76 -26.427 16.646 -10.553 1.00 0.00 C ATOM 1244 OG1 THR A 76 -25.104 16.313 -10.950 1.00 0.00 O ATOM 1245 CG2 THR A 76 -26.677 16.145 -9.129 1.00 0.00 C ATOM 0 H THR A 76 -25.866 14.530 -11.511 1.00 0.00 H new ATOM 0 HA THR A 76 -28.403 15.857 -11.049 1.00 0.00 H new ATOM 0 HB THR A 76 -26.553 17.728 -10.581 1.00 0.00 H new ATOM 0 HG1 THR A 76 -25.078 16.176 -11.920 1.00 0.00 H new ATOM 0 HG21 THR A 76 -25.965 16.612 -8.449 1.00 0.00 H new ATOM 0 HG22 THR A 76 -27.692 16.402 -8.826 1.00 0.00 H new ATOM 0 HG23 THR A 76 -26.552 15.063 -9.097 1.00 0.00 H new ATOM 1253 N LYS A 77 -26.736 16.794 -13.695 1.00 0.00 N ATOM 1254 CA LYS A 77 -26.884 17.622 -14.928 1.00 0.00 C ATOM 1255 C LYS A 77 -28.331 17.575 -15.424 1.00 0.00 C ATOM 1256 O LYS A 77 -28.840 18.532 -15.973 1.00 0.00 O ATOM 1257 CB LYS A 77 -25.945 16.981 -15.950 1.00 0.00 C ATOM 1258 CG LYS A 77 -24.630 17.760 -15.994 1.00 0.00 C ATOM 1259 CD LYS A 77 -24.044 17.695 -17.406 1.00 0.00 C ATOM 1260 CE LYS A 77 -24.454 18.946 -18.187 1.00 0.00 C ATOM 1261 NZ LYS A 77 -23.315 19.218 -19.107 1.00 0.00 N ATOM 0 H LYS A 77 -25.908 16.199 -13.669 1.00 0.00 H new ATOM 0 HA LYS A 77 -26.642 18.670 -14.754 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -25.755 15.941 -15.683 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -26.411 16.977 -16.935 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -24.800 18.798 -15.707 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -23.924 17.343 -15.276 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -22.957 17.624 -17.357 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -24.400 16.801 -17.918 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -25.378 18.780 -18.741 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -24.631 19.788 -17.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -23.523 20.063 -19.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -22.451 19.379 -18.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -23.175 18.402 -19.736 1.00 0.00 H new ATOM 1275 N GLU A 78 -28.998 16.470 -15.234 1.00 0.00 N ATOM 1276 CA GLU A 78 -30.413 16.363 -15.695 1.00 0.00 C ATOM 1277 C GLU A 78 -31.264 15.677 -14.623 1.00 0.00 C ATOM 1278 O GLU A 78 -32.020 14.768 -14.906 1.00 0.00 O ATOM 1279 CB GLU A 78 -30.354 15.510 -16.962 1.00 0.00 C ATOM 1280 CG GLU A 78 -30.318 16.423 -18.190 1.00 0.00 C ATOM 1281 CD GLU A 78 -30.660 15.611 -19.440 1.00 0.00 C ATOM 1282 OE1 GLU A 78 -31.726 15.018 -19.464 1.00 0.00 O ATOM 1283 OE2 GLU A 78 -29.851 15.595 -20.353 1.00 0.00 O ATOM 0 H GLU A 78 -28.625 15.636 -14.780 1.00 0.00 H new ATOM 0 HA GLU A 78 -30.863 17.338 -15.883 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -29.470 14.873 -16.943 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -31.221 14.851 -17.011 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -31.028 17.241 -18.069 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -29.330 16.872 -18.294 1.00 0.00 H new ATOM 1290 N THR A 79 -31.148 16.104 -13.396 1.00 0.00 N ATOM 1291 CA THR A 79 -31.951 15.476 -12.308 1.00 0.00 C ATOM 1292 C THR A 79 -32.169 16.473 -11.167 1.00 0.00 C ATOM 1293 O THR A 79 -33.264 16.954 -10.951 1.00 0.00 O ATOM 1294 CB THR A 79 -31.110 14.291 -11.831 1.00 0.00 C ATOM 1295 OG1 THR A 79 -31.065 13.303 -12.852 1.00 0.00 O ATOM 1296 CG2 THR A 79 -31.735 13.695 -10.570 1.00 0.00 C ATOM 0 H THR A 79 -30.532 16.861 -13.099 1.00 0.00 H new ATOM 0 HA THR A 79 -32.938 15.165 -12.650 1.00 0.00 H new ATOM 0 HB THR A 79 -30.098 14.629 -11.607 1.00 0.00 H new ATOM 0 HG1 THR A 79 -30.175 13.298 -13.263 1.00 0.00 H new ATOM 0 HG21 THR A 79 -31.135 12.851 -10.231 1.00 0.00 H new ATOM 0 HG22 THR A 79 -31.769 14.453 -9.788 1.00 0.00 H new ATOM 0 HG23 THR A 79 -32.747 13.356 -10.791 1.00 0.00 H new ATOM 1304 N GLY A 80 -31.135 16.786 -10.436 1.00 0.00 N ATOM 1305 CA GLY A 80 -31.285 17.752 -9.310 1.00 0.00 C ATOM 1306 C GLY A 80 -31.202 17.001 -7.980 1.00 0.00 C ATOM 1307 O GLY A 80 -32.202 16.591 -7.426 1.00 0.00 O ATOM 0 H GLY A 80 -30.194 16.416 -10.569 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -30.504 18.511 -9.361 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -32.240 18.272 -9.387 1.00 0.00 H new ATOM 1311 N PHE A 81 -30.017 16.816 -7.464 1.00 0.00 N ATOM 1312 CA PHE A 81 -29.873 16.090 -6.170 1.00 0.00 C ATOM 1313 C PHE A 81 -28.603 16.543 -5.446 1.00 0.00 C ATOM 1314 O PHE A 81 -27.505 16.169 -5.808 1.00 0.00 O ATOM 1315 CB PHE A 81 -29.773 14.613 -6.555 1.00 0.00 C ATOM 1316 CG PHE A 81 -31.051 13.906 -6.175 1.00 0.00 C ATOM 1317 CD1 PHE A 81 -31.661 14.174 -4.942 1.00 0.00 C ATOM 1318 CD2 PHE A 81 -31.628 12.981 -7.055 1.00 0.00 C ATOM 1319 CE1 PHE A 81 -32.848 13.517 -4.590 1.00 0.00 C ATOM 1320 CE2 PHE A 81 -32.815 12.324 -6.703 1.00 0.00 C ATOM 1321 CZ PHE A 81 -33.425 12.592 -5.470 1.00 0.00 C ATOM 0 H PHE A 81 -29.143 17.136 -7.882 1.00 0.00 H new ATOM 0 HA PHE A 81 -30.707 16.281 -5.495 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -29.596 14.517 -7.626 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -28.925 14.151 -6.049 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -31.216 14.887 -4.263 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -31.158 12.774 -8.005 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -33.318 13.724 -3.640 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -33.260 11.611 -7.382 1.00 0.00 H new ATOM 0 HZ PHE A 81 -34.339 12.086 -5.198 1.00 0.00 H new ATOM 1331 N SER A 82 -28.743 17.344 -4.426 1.00 0.00 N ATOM 1332 CA SER A 82 -27.542 17.819 -3.681 1.00 0.00 C ATOM 1333 C SER A 82 -26.742 16.625 -3.154 1.00 0.00 C ATOM 1334 O SER A 82 -27.297 15.624 -2.747 1.00 0.00 O ATOM 1335 CB SER A 82 -28.095 18.648 -2.524 1.00 0.00 C ATOM 1336 OG SER A 82 -28.028 20.028 -2.861 1.00 0.00 O ATOM 0 H SER A 82 -29.636 17.690 -4.076 1.00 0.00 H new ATOM 0 HA SER A 82 -26.868 18.400 -4.311 1.00 0.00 H new ATOM 0 HB2 SER A 82 -29.126 18.362 -2.317 1.00 0.00 H new ATOM 0 HB3 SER A 82 -27.522 18.455 -1.617 1.00 0.00 H new ATOM 0 HG SER A 82 -28.384 20.563 -2.121 1.00 0.00 H new ATOM 1342 N LEU A 83 -25.440 16.725 -3.156 1.00 0.00 N ATOM 1343 CA LEU A 83 -24.604 15.596 -2.655 1.00 0.00 C ATOM 1344 C LEU A 83 -24.927 15.309 -1.186 1.00 0.00 C ATOM 1345 O LEU A 83 -24.762 14.204 -0.709 1.00 0.00 O ATOM 1346 CB LEU A 83 -23.160 16.078 -2.802 1.00 0.00 C ATOM 1347 CG LEU A 83 -22.254 14.890 -3.125 1.00 0.00 C ATOM 1348 CD1 LEU A 83 -22.631 14.315 -4.492 1.00 0.00 C ATOM 1349 CD2 LEU A 83 -20.797 15.354 -3.154 1.00 0.00 C ATOM 0 H LEU A 83 -24.919 17.539 -3.483 1.00 0.00 H new ATOM 0 HA LEU A 83 -24.784 14.673 -3.205 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -23.094 16.825 -3.593 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -22.831 16.560 -1.881 1.00 0.00 H new ATOM 0 HG LEU A 83 -22.378 14.122 -2.361 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -21.984 13.468 -4.721 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -23.669 13.984 -4.474 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -22.508 15.083 -5.256 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -20.150 14.507 -3.384 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -20.675 16.122 -3.918 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -20.526 15.763 -2.181 1.00 0.00 H new ATOM 1361 N GLU A 84 -25.381 16.297 -0.466 1.00 0.00 N ATOM 1362 CA GLU A 84 -25.712 16.083 0.973 1.00 0.00 C ATOM 1363 C GLU A 84 -26.720 14.940 1.126 1.00 0.00 C ATOM 1364 O GLU A 84 -26.611 14.119 2.014 1.00 0.00 O ATOM 1365 CB GLU A 84 -26.326 17.404 1.438 1.00 0.00 C ATOM 1366 CG GLU A 84 -25.216 18.429 1.674 1.00 0.00 C ATOM 1367 CD GLU A 84 -25.312 19.538 0.625 1.00 0.00 C ATOM 1368 OE1 GLU A 84 -26.172 20.391 0.769 1.00 0.00 O ATOM 1369 OE2 GLU A 84 -24.523 19.515 -0.306 1.00 0.00 O ATOM 0 H GLU A 84 -25.538 17.244 -0.811 1.00 0.00 H new ATOM 0 HA GLU A 84 -24.835 15.810 1.560 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -27.025 17.776 0.689 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -26.894 17.250 2.355 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -25.304 18.852 2.675 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -24.241 17.944 1.618 1.00 0.00 H new ATOM 1376 N LYS A 85 -27.703 14.882 0.267 1.00 0.00 N ATOM 1377 CA LYS A 85 -28.718 13.793 0.369 1.00 0.00 C ATOM 1378 C LYS A 85 -28.071 12.432 0.090 1.00 0.00 C ATOM 1379 O LYS A 85 -28.111 11.537 0.910 1.00 0.00 O ATOM 1380 CB LYS A 85 -29.759 14.122 -0.702 1.00 0.00 C ATOM 1381 CG LYS A 85 -30.833 13.032 -0.721 1.00 0.00 C ATOM 1382 CD LYS A 85 -31.679 13.123 0.550 1.00 0.00 C ATOM 1383 CE LYS A 85 -32.804 14.139 0.343 1.00 0.00 C ATOM 1384 NZ LYS A 85 -34.031 13.464 0.852 1.00 0.00 N ATOM 0 H LYS A 85 -27.847 15.540 -0.499 1.00 0.00 H new ATOM 0 HA LYS A 85 -29.159 13.733 1.364 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -30.213 15.091 -0.497 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -29.281 14.194 -1.679 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -31.466 13.147 -1.601 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -30.367 12.049 -0.790 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -32.097 12.146 0.792 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -31.056 13.421 1.393 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -32.607 15.063 0.887 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -32.907 14.405 -0.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -34.720 14.181 1.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -34.447 12.884 0.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -33.783 12.855 1.658 1.00 0.00 H new ATOM 1398 N ILE A 86 -27.478 12.269 -1.061 1.00 0.00 N ATOM 1399 CA ILE A 86 -26.833 10.964 -1.389 1.00 0.00 C ATOM 1400 C ILE A 86 -25.986 10.481 -0.209 1.00 0.00 C ATOM 1401 O ILE A 86 -26.085 9.347 0.216 1.00 0.00 O ATOM 1402 CB ILE A 86 -25.947 11.251 -2.600 1.00 0.00 C ATOM 1403 CG1 ILE A 86 -26.825 11.639 -3.793 1.00 0.00 C ATOM 1404 CG2 ILE A 86 -25.140 9.999 -2.949 1.00 0.00 C ATOM 1405 CD1 ILE A 86 -25.993 12.437 -4.799 1.00 0.00 C ATOM 0 H ILE A 86 -27.412 12.981 -1.788 1.00 0.00 H new ATOM 0 HA ILE A 86 -27.565 10.184 -1.596 1.00 0.00 H new ATOM 0 HB ILE A 86 -25.266 12.070 -2.367 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -27.229 10.745 -4.267 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -27.675 12.232 -3.455 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -24.508 10.203 -3.813 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -24.516 9.720 -2.100 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -25.821 9.181 -3.183 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -26.617 12.714 -5.649 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -25.610 13.339 -4.321 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -25.158 11.828 -5.145 1.00 0.00 H new ATOM 1417 N TYR A 87 -25.152 11.332 0.322 1.00 0.00 N ATOM 1418 CA TYR A 87 -24.299 10.922 1.473 1.00 0.00 C ATOM 1419 C TYR A 87 -25.172 10.480 2.651 1.00 0.00 C ATOM 1420 O TYR A 87 -24.884 9.508 3.319 1.00 0.00 O ATOM 1421 CB TYR A 87 -23.500 12.174 1.836 1.00 0.00 C ATOM 1422 CG TYR A 87 -22.127 12.093 1.213 1.00 0.00 C ATOM 1423 CD1 TYR A 87 -21.955 11.459 -0.024 1.00 0.00 C ATOM 1424 CD2 TYR A 87 -21.026 12.652 1.873 1.00 0.00 C ATOM 1425 CE1 TYR A 87 -20.680 11.384 -0.602 1.00 0.00 C ATOM 1426 CE2 TYR A 87 -19.751 12.577 1.296 1.00 0.00 C ATOM 1427 CZ TYR A 87 -19.578 11.942 0.058 1.00 0.00 C ATOM 1428 OH TYR A 87 -18.323 11.868 -0.509 1.00 0.00 O ATOM 0 H TYR A 87 -25.024 12.294 0.008 1.00 0.00 H new ATOM 0 HA TYR A 87 -23.651 10.080 1.228 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -24.019 13.065 1.483 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -23.415 12.263 2.919 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -22.805 11.028 -0.533 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -21.159 13.141 2.827 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -20.548 10.896 -1.556 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -18.902 13.008 1.805 1.00 0.00 H new ATOM 0 HH TYR A 87 -17.672 12.305 0.079 1.00 0.00 H new ATOM 1438 N GLN A 88 -26.238 11.187 2.909 1.00 0.00 N ATOM 1439 CA GLN A 88 -27.128 10.806 4.044 1.00 0.00 C ATOM 1440 C GLN A 88 -27.779 9.447 3.774 1.00 0.00 C ATOM 1441 O GLN A 88 -28.165 8.742 4.685 1.00 0.00 O ATOM 1442 CB GLN A 88 -28.187 11.907 4.104 1.00 0.00 C ATOM 1443 CG GLN A 88 -28.758 11.990 5.521 1.00 0.00 C ATOM 1444 CD GLN A 88 -27.884 12.914 6.372 1.00 0.00 C ATOM 1445 OE1 GLN A 88 -26.702 12.680 6.522 1.00 0.00 O ATOM 1446 NE2 GLN A 88 -28.420 13.960 6.938 1.00 0.00 N ATOM 0 H GLN A 88 -26.532 12.011 2.384 1.00 0.00 H new ATOM 0 HA GLN A 88 -26.583 10.714 4.983 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -27.748 12.864 3.821 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -28.985 11.698 3.391 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -29.781 12.366 5.491 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -28.797 10.996 5.967 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -29.413 14.156 6.811 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -27.846 14.582 7.507 1.00 0.00 H new ATOM 1455 N LEU A 89 -27.905 9.073 2.530 1.00 0.00 N ATOM 1456 CA LEU A 89 -28.532 7.760 2.207 1.00 0.00 C ATOM 1457 C LEU A 89 -27.521 6.626 2.406 1.00 0.00 C ATOM 1458 O LEU A 89 -27.709 5.754 3.230 1.00 0.00 O ATOM 1459 CB LEU A 89 -28.939 7.865 0.736 1.00 0.00 C ATOM 1460 CG LEU A 89 -30.430 8.195 0.641 1.00 0.00 C ATOM 1461 CD1 LEU A 89 -30.757 8.681 -0.771 1.00 0.00 C ATOM 1462 CD2 LEU A 89 -31.249 6.941 0.951 1.00 0.00 C ATOM 0 H LEU A 89 -27.601 9.619 1.724 1.00 0.00 H new ATOM 0 HA LEU A 89 -29.384 7.541 2.850 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -28.352 8.638 0.240 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -28.730 6.927 0.222 1.00 0.00 H new ATOM 0 HG LEU A 89 -30.675 8.977 1.359 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -31.819 8.916 -0.838 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -30.173 9.574 -0.993 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -30.512 7.900 -1.491 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -32.312 7.175 0.884 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -31.003 6.159 0.233 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -31.017 6.594 1.958 1.00 0.00 H new ATOM 1474 N PHE A 90 -26.451 6.633 1.660 1.00 0.00 N ATOM 1475 CA PHE A 90 -25.431 5.556 1.810 1.00 0.00 C ATOM 1476 C PHE A 90 -24.456 5.907 2.938 1.00 0.00 C ATOM 1477 O PHE A 90 -24.473 7.007 3.452 1.00 0.00 O ATOM 1478 CB PHE A 90 -24.703 5.507 0.466 1.00 0.00 C ATOM 1479 CG PHE A 90 -25.391 4.518 -0.445 1.00 0.00 C ATOM 1480 CD1 PHE A 90 -26.529 4.904 -1.165 1.00 0.00 C ATOM 1481 CD2 PHE A 90 -24.890 3.215 -0.571 1.00 0.00 C ATOM 1482 CE1 PHE A 90 -27.167 3.988 -2.011 1.00 0.00 C ATOM 1483 CE2 PHE A 90 -25.529 2.298 -1.417 1.00 0.00 C ATOM 1484 CZ PHE A 90 -26.667 2.684 -2.137 1.00 0.00 C ATOM 0 H PHE A 90 -26.238 7.337 0.953 1.00 0.00 H new ATOM 0 HA PHE A 90 -25.879 4.595 2.064 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -24.697 6.496 0.008 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -23.663 5.218 0.614 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -26.914 5.908 -1.068 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -24.012 2.918 -0.017 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -28.044 4.286 -2.566 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -25.144 1.294 -1.514 1.00 0.00 H new ATOM 0 HZ PHE A 90 -27.159 1.977 -2.789 1.00 0.00 H new ATOM 1494 N PRO A 91 -23.637 4.952 3.281 1.00 0.00 N ATOM 1495 CA PRO A 91 -22.641 5.155 4.360 1.00 0.00 C ATOM 1496 C PRO A 91 -21.489 6.038 3.870 1.00 0.00 C ATOM 1497 O PRO A 91 -21.351 7.175 4.277 1.00 0.00 O ATOM 1498 CB PRO A 91 -22.162 3.740 4.674 1.00 0.00 C ATOM 1499 CG PRO A 91 -22.420 2.946 3.430 1.00 0.00 C ATOM 1500 CD PRO A 91 -23.566 3.606 2.703 1.00 0.00 C ATOM 0 HA PRO A 91 -23.050 5.661 5.234 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -21.103 3.732 4.932 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -22.701 3.323 5.525 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -21.531 2.919 2.800 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -22.666 1.914 3.678 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -23.386 3.644 1.629 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -24.498 3.060 2.851 1.00 0.00 H new ATOM 1508 N SER A 92 -20.661 5.530 2.999 1.00 0.00 N ATOM 1509 CA SER A 92 -19.523 6.346 2.486 1.00 0.00 C ATOM 1510 C SER A 92 -19.724 6.650 1.000 1.00 0.00 C ATOM 1511 O SER A 92 -18.888 6.339 0.174 1.00 0.00 O ATOM 1512 CB SER A 92 -18.280 5.479 2.693 1.00 0.00 C ATOM 1513 OG SER A 92 -18.613 4.356 3.498 1.00 0.00 O ATOM 0 H SER A 92 -20.723 4.585 2.620 1.00 0.00 H new ATOM 0 HA SER A 92 -19.437 7.303 3.000 1.00 0.00 H new ATOM 0 HB2 SER A 92 -17.891 5.147 1.730 1.00 0.00 H new ATOM 0 HB3 SER A 92 -17.493 6.062 3.171 1.00 0.00 H new ATOM 0 HG SER A 92 -17.817 3.800 3.629 1.00 0.00 H new ATOM 1519 N GLY A 93 -20.828 7.252 0.652 1.00 0.00 N ATOM 1520 CA GLY A 93 -21.082 7.569 -0.781 1.00 0.00 C ATOM 1521 C GLY A 93 -21.500 6.297 -1.518 1.00 0.00 C ATOM 1522 O GLY A 93 -20.999 5.225 -1.240 1.00 0.00 O ATOM 0 H GLY A 93 -21.564 7.538 1.298 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -21.864 8.324 -0.864 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -20.185 7.988 -1.236 1.00 0.00 H new ATOM 1526 N PRO A 94 -22.411 6.459 -2.438 1.00 0.00 N ATOM 1527 CA PRO A 94 -22.909 5.307 -3.228 1.00 0.00 C ATOM 1528 C PRO A 94 -21.849 4.851 -4.236 1.00 0.00 C ATOM 1529 O PRO A 94 -21.018 4.015 -3.941 1.00 0.00 O ATOM 1530 CB PRO A 94 -24.136 5.868 -3.943 1.00 0.00 C ATOM 1531 CG PRO A 94 -23.901 7.344 -4.015 1.00 0.00 C ATOM 1532 CD PRO A 94 -23.057 7.717 -2.825 1.00 0.00 C ATOM 0 HA PRO A 94 -23.140 4.435 -2.617 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -24.245 5.437 -4.938 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -25.050 5.640 -3.395 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -23.396 7.609 -4.944 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -24.847 7.886 -4.001 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -22.322 8.480 -3.081 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -23.665 8.119 -2.015 1.00 0.00 H new ATOM 1540 N ALA A 95 -21.869 5.396 -5.422 1.00 0.00 N ATOM 1541 CA ALA A 95 -20.861 4.996 -6.446 1.00 0.00 C ATOM 1542 C ALA A 95 -20.865 3.475 -6.634 1.00 0.00 C ATOM 1543 O ALA A 95 -21.630 2.941 -7.411 1.00 0.00 O ATOM 1544 CB ALA A 95 -19.519 5.469 -5.887 1.00 0.00 C ATOM 0 H ALA A 95 -22.540 6.101 -5.727 1.00 0.00 H new ATOM 0 HA ALA A 95 -21.071 5.432 -7.423 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -18.723 5.211 -6.585 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -19.543 6.550 -5.748 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -19.333 4.984 -4.929 1.00 0.00 H new ATOM 1550 N HIS A 96 -20.017 2.772 -5.930 1.00 0.00 N ATOM 1551 CA HIS A 96 -19.977 1.289 -6.078 1.00 0.00 C ATOM 1552 C HIS A 96 -21.244 0.662 -5.490 1.00 0.00 C ATOM 1553 O HIS A 96 -21.972 -0.040 -6.164 1.00 0.00 O ATOM 1554 CB HIS A 96 -18.744 0.846 -5.291 1.00 0.00 C ATOM 1555 CG HIS A 96 -17.572 1.712 -5.665 1.00 0.00 C ATOM 1556 ND1 HIS A 96 -16.505 1.923 -4.805 1.00 0.00 N ATOM 1557 CD2 HIS A 96 -17.286 2.428 -6.801 1.00 0.00 C ATOM 1558 CE1 HIS A 96 -15.635 2.736 -5.432 1.00 0.00 C ATOM 1559 NE2 HIS A 96 -16.062 3.073 -6.652 1.00 0.00 N ATOM 0 H HIS A 96 -19.352 3.160 -5.261 1.00 0.00 H new ATOM 0 HA HIS A 96 -19.927 0.980 -7.122 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -18.937 0.919 -4.221 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -18.520 -0.199 -5.504 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -17.915 2.482 -7.677 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -14.704 3.075 -5.001 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -15.592 3.674 -7.329 1.00 0.00 H new ATOM 1567 N GLY A 97 -21.513 0.907 -4.237 1.00 0.00 N ATOM 1568 CA GLY A 97 -22.731 0.324 -3.607 1.00 0.00 C ATOM 1569 C GLY A 97 -23.920 0.462 -4.560 1.00 0.00 C ATOM 1570 O GLY A 97 -24.530 -0.513 -4.951 1.00 0.00 O ATOM 0 H GLY A 97 -20.941 1.486 -3.622 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -22.562 -0.726 -3.370 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -22.945 0.832 -2.667 1.00 0.00 H new ATOM 1574 N ALA A 98 -24.254 1.666 -4.936 1.00 0.00 N ATOM 1575 CA ALA A 98 -25.406 1.866 -5.863 1.00 0.00 C ATOM 1576 C ALA A 98 -25.312 0.902 -7.049 1.00 0.00 C ATOM 1577 O ALA A 98 -26.267 0.238 -7.398 1.00 0.00 O ATOM 1578 CB ALA A 98 -25.285 3.314 -6.339 1.00 0.00 C ATOM 0 H ALA A 98 -23.780 2.520 -4.642 1.00 0.00 H new ATOM 0 HA ALA A 98 -26.362 1.674 -5.376 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -26.099 3.540 -7.027 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -25.338 3.985 -5.481 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -24.331 3.451 -6.848 1.00 0.00 H new ATOM 1584 N CYS A 99 -24.169 0.823 -7.673 1.00 0.00 N ATOM 1585 CA CYS A 99 -24.017 -0.095 -8.839 1.00 0.00 C ATOM 1586 C CYS A 99 -24.441 -1.517 -8.457 1.00 0.00 C ATOM 1587 O CYS A 99 -25.377 -2.062 -9.007 1.00 0.00 O ATOM 1588 CB CYS A 99 -22.528 -0.051 -9.185 1.00 0.00 C ATOM 1589 SG CYS A 99 -22.094 1.609 -9.760 1.00 0.00 S ATOM 0 H CYS A 99 -23.334 1.354 -7.427 1.00 0.00 H new ATOM 0 HA CYS A 99 -24.640 0.202 -9.682 1.00 0.00 H new ATOM 0 HB2 CYS A 99 -21.932 -0.312 -8.310 1.00 0.00 H new ATOM 0 HB3 CYS A 99 -22.301 -0.786 -9.957 1.00 0.00 H new ATOM 1594 N LYS A 100 -23.760 -2.121 -7.523 1.00 0.00 N ATOM 1595 CA LYS A 100 -24.126 -3.508 -7.112 1.00 0.00 C ATOM 1596 C LYS A 100 -25.645 -3.634 -6.962 1.00 0.00 C ATOM 1597 O LYS A 100 -26.247 -4.580 -7.429 1.00 0.00 O ATOM 1598 CB LYS A 100 -23.434 -3.718 -5.765 1.00 0.00 C ATOM 1599 CG LYS A 100 -21.924 -3.833 -5.978 1.00 0.00 C ATOM 1600 CD LYS A 100 -21.239 -4.114 -4.639 1.00 0.00 C ATOM 1601 CE LYS A 100 -19.956 -3.285 -4.537 1.00 0.00 C ATOM 1602 NZ LYS A 100 -20.411 -1.921 -4.149 1.00 0.00 N ATOM 0 H LYS A 100 -22.967 -1.716 -7.026 1.00 0.00 H new ATOM 0 HA LYS A 100 -23.819 -4.251 -7.848 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -23.655 -2.885 -5.097 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -23.814 -4.620 -5.286 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -21.706 -4.633 -6.685 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -21.536 -2.911 -6.411 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -21.910 -3.867 -3.816 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -21.006 -5.175 -4.553 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -19.275 -3.701 -3.794 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -19.420 -3.268 -5.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -19.611 -1.259 -4.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -21.166 -1.610 -4.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -20.774 -1.940 -3.175 1.00 0.00 H new ATOM 1616 N VAL A 101 -26.267 -2.689 -6.312 1.00 0.00 N ATOM 1617 CA VAL A 101 -27.746 -2.756 -6.130 1.00 0.00 C ATOM 1618 C VAL A 101 -28.441 -2.929 -7.482 1.00 0.00 C ATOM 1619 O VAL A 101 -29.209 -3.849 -7.682 1.00 0.00 O ATOM 1620 CB VAL A 101 -28.126 -1.417 -5.499 1.00 0.00 C ATOM 1621 CG1 VAL A 101 -29.648 -1.268 -5.492 1.00 0.00 C ATOM 1622 CG2 VAL A 101 -27.603 -1.365 -4.062 1.00 0.00 C ATOM 0 H VAL A 101 -25.816 -1.873 -5.899 1.00 0.00 H new ATOM 0 HA VAL A 101 -28.048 -3.601 -5.510 1.00 0.00 H new ATOM 0 HB VAL A 101 -27.685 -0.605 -6.078 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -29.918 -0.313 -5.042 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -30.022 -1.306 -6.515 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -30.090 -2.079 -4.914 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -27.873 -0.410 -3.611 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -28.044 -2.177 -3.485 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -26.518 -1.470 -4.066 1.00 0.00 H new ATOM 1632 N ALA A 102 -28.181 -2.051 -8.411 1.00 0.00 N ATOM 1633 CA ALA A 102 -28.829 -2.165 -9.750 1.00 0.00 C ATOM 1634 C ALA A 102 -28.417 -3.473 -10.430 1.00 0.00 C ATOM 1635 O ALA A 102 -29.099 -3.973 -11.301 1.00 0.00 O ATOM 1636 CB ALA A 102 -28.315 -0.963 -10.542 1.00 0.00 C ATOM 0 H ALA A 102 -27.548 -1.259 -8.302 1.00 0.00 H new ATOM 0 HA ALA A 102 -29.917 -2.174 -9.682 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -28.747 -0.975 -11.543 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -28.602 -0.043 -10.034 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -27.229 -1.013 -10.616 1.00 0.00 H new ATOM 1642 N GLY A 103 -27.304 -4.031 -10.038 1.00 0.00 N ATOM 1643 CA GLY A 103 -26.849 -5.305 -10.663 1.00 0.00 C ATOM 1644 C GLY A 103 -25.555 -5.057 -11.440 1.00 0.00 C ATOM 1645 O GLY A 103 -24.602 -5.803 -11.329 1.00 0.00 O ATOM 0 H GLY A 103 -26.691 -3.660 -9.312 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -26.686 -6.061 -9.895 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -27.619 -5.690 -11.331 1.00 0.00 H new ATOM 1649 N ALA A 104 -25.514 -4.015 -12.225 1.00 0.00 N ATOM 1650 CA ALA A 104 -24.280 -3.718 -13.009 1.00 0.00 C ATOM 1651 C ALA A 104 -23.704 -5.007 -13.600 1.00 0.00 C ATOM 1652 O ALA A 104 -22.684 -5.494 -13.153 1.00 0.00 O ATOM 1653 CB ALA A 104 -23.308 -3.110 -11.999 1.00 0.00 C ATOM 0 H ALA A 104 -26.281 -3.356 -12.358 1.00 0.00 H new ATOM 0 HA ALA A 104 -24.474 -3.046 -13.845 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -22.371 -2.863 -12.499 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -23.743 -2.205 -11.575 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -23.115 -3.828 -11.202 1.00 0.00 H new