USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 688 hydrogens (22 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: T 60 MET CE :methyl -120:sc= -0.0702 (180deg=-1.47!) USER MOD Set 1.2: T 80 MET CE :methyl -170:sc= -0.0748 (180deg=-0.0748) USER MOD Set 2.1: T 69 SER OG : rot 109:sc= 0.866 USER MOD Set 2.2: T 71 THR OG1 : rot 32:sc= 0.952 USER MOD Single : T 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 1 MET N :NH3+ -169:sc= -0.225 (180deg=-0.481) USER MOD Single : T 5 TYR OH : rot 180:sc= 0 USER MOD Single : T 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 11 GLN : amide:sc= -0.0365 X(o=-0.036,f=0) USER MOD Single : T 13 THR OG1 : rot 180:sc= 0 USER MOD Single : T 16 GLN : amide:sc= -5.77! C(o=-5.8!,f=-13!) USER MOD Single : T 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 18 ASN :FLIP amide:sc= -0.736 F(o=-4.1!,f=-0.74) USER MOD Single : T 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 35 SER OG : rot 30:sc= 0.361 USER MOD Single : T 37 SER OG : rot 180:sc=-0.00128 USER MOD Single : T 38 THR OG1 : rot -160:sc= 0 USER MOD Single : T 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 43 LYS NZ :NH3+ -123:sc= -0.561 (180deg=-1.73!) USER MOD Single : T 45 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 47 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 50 GLN : amide:sc= -4.24! C(o=-4.2!,f=-4!) USER MOD Single : T 51 ASN :FLIP amide:sc= -0.212! F(o=-1.2,f=-0.21!) USER MOD Single : T 53 THR OG1 : rot 180:sc= 0.081 USER MOD Single : T 58 GLN : amide:sc= -2.21! C(o=-2.2!,f=-2.5!) USER MOD Single : T 81 MET CE :methyl -166:sc= -3.3 (180deg=-3.84) USER MOD Single : T 84 SER OG : rot 92:sc= 1.2 USER MOD Single : T 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 89 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET T 1 76.462 -17.957 7.639 1.00 0.00 N ATOM 2 CA MET T 1 76.303 -18.389 6.222 1.00 0.00 C ATOM 3 C MET T 1 75.779 -17.221 5.393 1.00 0.00 C ATOM 4 O MET T 1 75.763 -17.279 4.163 1.00 0.00 O ATOM 5 CB MET T 1 75.320 -19.559 6.156 1.00 0.00 C ATOM 6 CG MET T 1 75.903 -20.760 6.902 1.00 0.00 C ATOM 7 SD MET T 1 74.893 -22.225 6.571 1.00 0.00 S ATOM 8 CE MET T 1 75.780 -22.784 5.097 1.00 0.00 C ATOM 0 H1 MET T 1 76.989 -18.682 8.166 1.00 0.00 H new ATOM 0 H2 MET T 1 76.984 -17.058 7.671 1.00 0.00 H new ATOM 0 H3 MET T 1 75.524 -17.829 8.070 1.00 0.00 H new ATOM 0 HA MET T 1 77.266 -18.707 5.823 1.00 0.00 H new ATOM 0 HB2 MET T 1 74.366 -19.271 6.598 1.00 0.00 H new ATOM 0 HB3 MET T 1 75.123 -19.824 5.117 1.00 0.00 H new ATOM 0 HG2 MET T 1 76.931 -20.935 6.584 1.00 0.00 H new ATOM 0 HG3 MET T 1 75.930 -20.558 7.973 1.00 0.00 H new ATOM 0 HE1 MET T 1 75.317 -23.695 4.717 1.00 0.00 H new ATOM 0 HE2 MET T 1 75.738 -22.009 4.332 1.00 0.00 H new ATOM 0 HE3 MET T 1 76.820 -22.986 5.353 1.00 0.00 H new ATOM 20 N ASP T 2 75.351 -16.164 6.075 1.00 0.00 N ATOM 21 CA ASP T 2 74.828 -14.987 5.390 1.00 0.00 C ATOM 22 C ASP T 2 73.637 -15.364 4.514 1.00 0.00 C ATOM 23 O ASP T 2 73.710 -15.296 3.288 1.00 0.00 O ATOM 24 CB ASP T 2 75.923 -14.357 4.527 1.00 0.00 C ATOM 25 CG ASP T 2 77.234 -14.306 5.303 1.00 0.00 C ATOM 26 OD1 ASP T 2 77.248 -13.710 6.366 1.00 0.00 O ATOM 27 OD2 ASP T 2 78.206 -14.867 4.822 1.00 0.00 O ATOM 0 H ASP T 2 75.355 -16.098 7.093 1.00 0.00 H new ATOM 0 HA ASP T 2 74.499 -14.267 6.139 1.00 0.00 H new ATOM 0 HB2 ASP T 2 76.055 -14.935 3.613 1.00 0.00 H new ATOM 0 HB3 ASP T 2 75.628 -13.351 4.228 1.00 0.00 H new ATOM 32 N ASP T 3 72.540 -15.762 5.154 1.00 0.00 N ATOM 33 CA ASP T 3 71.337 -16.152 4.425 1.00 0.00 C ATOM 34 C ASP T 3 70.517 -14.923 4.039 1.00 0.00 C ATOM 35 O ASP T 3 70.468 -14.543 2.869 1.00 0.00 O ATOM 36 CB ASP T 3 70.485 -17.083 5.289 1.00 0.00 C ATOM 37 CG ASP T 3 71.236 -18.384 5.550 1.00 0.00 C ATOM 38 OD1 ASP T 3 71.555 -19.063 4.588 1.00 0.00 O ATOM 39 OD2 ASP T 3 71.480 -18.683 6.707 1.00 0.00 O ATOM 0 H ASP T 3 72.460 -15.823 6.169 1.00 0.00 H new ATOM 0 HA ASP T 3 71.639 -16.671 3.516 1.00 0.00 H new ATOM 0 HB2 ASP T 3 70.244 -16.596 6.234 1.00 0.00 H new ATOM 0 HB3 ASP T 3 69.540 -17.293 4.789 1.00 0.00 H new ATOM 44 N ILE T 4 69.869 -14.314 5.028 1.00 0.00 N ATOM 45 CA ILE T 4 69.047 -13.134 4.778 1.00 0.00 C ATOM 46 C ILE T 4 69.750 -12.159 3.835 1.00 0.00 C ATOM 47 O ILE T 4 69.117 -11.267 3.269 1.00 0.00 O ATOM 48 CB ILE T 4 68.700 -12.431 6.099 1.00 0.00 C ATOM 49 CG1 ILE T 4 69.946 -11.758 6.707 1.00 0.00 C ATOM 50 CG2 ILE T 4 68.134 -13.452 7.089 1.00 0.00 C ATOM 51 CD1 ILE T 4 71.087 -12.770 6.877 1.00 0.00 C ATOM 0 H ILE T 4 69.896 -14.615 6.002 1.00 0.00 H new ATOM 0 HA ILE T 4 68.126 -13.466 4.300 1.00 0.00 H new ATOM 0 HB ILE T 4 67.956 -11.661 5.896 1.00 0.00 H new ATOM 0 HG12 ILE T 4 70.273 -10.940 6.065 1.00 0.00 H new ATOM 0 HG13 ILE T 4 69.694 -11.322 7.674 1.00 0.00 H new ATOM 0 HG21 ILE T 4 67.888 -12.952 8.026 1.00 0.00 H new ATOM 0 HG22 ILE T 4 67.234 -13.904 6.671 1.00 0.00 H new ATOM 0 HG23 ILE T 4 68.876 -14.228 7.276 1.00 0.00 H new ATOM 0 HD11 ILE T 4 71.955 -12.271 7.308 1.00 0.00 H new ATOM 0 HD12 ILE T 4 70.765 -13.574 7.539 1.00 0.00 H new ATOM 0 HD13 ILE T 4 71.353 -13.185 5.905 1.00 0.00 H new ATOM 63 N TYR T 5 71.059 -12.333 3.665 1.00 0.00 N ATOM 64 CA TYR T 5 71.834 -11.463 2.783 1.00 0.00 C ATOM 65 C TYR T 5 71.849 -12.024 1.364 1.00 0.00 C ATOM 66 O TYR T 5 71.571 -11.309 0.400 1.00 0.00 O ATOM 67 CB TYR T 5 73.272 -11.342 3.300 1.00 0.00 C ATOM 68 CG TYR T 5 73.299 -10.454 4.526 1.00 0.00 C ATOM 69 CD1 TYR T 5 73.051 -9.082 4.398 1.00 0.00 C ATOM 70 CD2 TYR T 5 73.572 -11.002 5.786 1.00 0.00 C ATOM 71 CE1 TYR T 5 73.077 -8.258 5.531 1.00 0.00 C ATOM 72 CE2 TYR T 5 73.596 -10.178 6.917 1.00 0.00 C ATOM 73 CZ TYR T 5 73.348 -8.805 6.790 1.00 0.00 C ATOM 74 OH TYR T 5 73.373 -7.993 7.904 1.00 0.00 O ATOM 0 H TYR T 5 71.603 -13.064 4.123 1.00 0.00 H new ATOM 0 HA TYR T 5 71.368 -10.477 2.771 1.00 0.00 H new ATOM 0 HB2 TYR T 5 73.665 -12.329 3.545 1.00 0.00 H new ATOM 0 HB3 TYR T 5 73.914 -10.926 2.524 1.00 0.00 H new ATOM 0 HD1 TYR T 5 72.840 -8.659 3.427 1.00 0.00 H new ATOM 0 HD2 TYR T 5 73.764 -12.060 5.885 1.00 0.00 H new ATOM 0 HE1 TYR T 5 72.888 -7.199 5.432 1.00 0.00 H new ATOM 0 HE2 TYR T 5 73.806 -10.601 7.888 1.00 0.00 H new ATOM 0 HH TYR T 5 73.575 -8.532 8.697 1.00 0.00 H new ATOM 84 N LYS T 6 72.174 -13.307 1.244 1.00 0.00 N ATOM 85 CA LYS T 6 72.220 -13.954 -0.062 1.00 0.00 C ATOM 86 C LYS T 6 70.878 -13.817 -0.776 1.00 0.00 C ATOM 87 O LYS T 6 70.828 -13.587 -1.984 1.00 0.00 O ATOM 88 CB LYS T 6 72.567 -15.440 0.103 1.00 0.00 C ATOM 89 CG LYS T 6 74.058 -15.600 0.470 1.00 0.00 C ATOM 90 CD LYS T 6 74.927 -15.648 -0.803 1.00 0.00 C ATOM 91 CE LYS T 6 74.988 -17.080 -1.350 1.00 0.00 C ATOM 92 NZ LYS T 6 75.895 -17.121 -2.532 1.00 0.00 N ATOM 0 H LYS T 6 72.408 -13.915 2.029 1.00 0.00 H new ATOM 0 HA LYS T 6 72.988 -13.466 -0.662 1.00 0.00 H new ATOM 0 HB2 LYS T 6 71.944 -15.883 0.880 1.00 0.00 H new ATOM 0 HB3 LYS T 6 72.353 -15.976 -0.821 1.00 0.00 H new ATOM 0 HG2 LYS T 6 74.374 -14.770 1.102 1.00 0.00 H new ATOM 0 HG3 LYS T 6 74.200 -16.513 1.049 1.00 0.00 H new ATOM 0 HD2 LYS T 6 74.515 -14.980 -1.559 1.00 0.00 H new ATOM 0 HD3 LYS T 6 75.933 -15.294 -0.579 1.00 0.00 H new ATOM 0 HE2 LYS T 6 75.348 -17.761 -0.578 1.00 0.00 H new ATOM 0 HE3 LYS T 6 73.990 -17.416 -1.632 1.00 0.00 H new ATOM 0 HZ1 LYS T 6 75.937 -18.091 -2.904 1.00 0.00 H new ATOM 0 HZ2 LYS T 6 75.533 -16.483 -3.269 1.00 0.00 H new ATOM 0 HZ3 LYS T 6 76.848 -16.817 -2.249 1.00 0.00 H new ATOM 106 N ALA T 7 69.795 -13.961 -0.020 1.00 0.00 N ATOM 107 CA ALA T 7 68.457 -13.852 -0.589 1.00 0.00 C ATOM 108 C ALA T 7 68.335 -12.589 -1.434 1.00 0.00 C ATOM 109 O ALA T 7 67.717 -12.600 -2.499 1.00 0.00 O ATOM 110 CB ALA T 7 67.416 -13.823 0.531 1.00 0.00 C ATOM 0 H ALA T 7 69.817 -14.152 0.982 1.00 0.00 H new ATOM 0 HA ALA T 7 68.281 -14.719 -1.226 1.00 0.00 H new ATOM 0 HB1 ALA T 7 66.419 -13.741 0.099 1.00 0.00 H new ATOM 0 HB2 ALA T 7 67.484 -14.741 1.115 1.00 0.00 H new ATOM 0 HB3 ALA T 7 67.602 -12.966 1.178 1.00 0.00 H new ATOM 116 N ALA T 8 68.925 -11.500 -0.952 1.00 0.00 N ATOM 117 CA ALA T 8 68.874 -10.233 -1.673 1.00 0.00 C ATOM 118 C ALA T 8 69.855 -10.240 -2.841 1.00 0.00 C ATOM 119 O ALA T 8 69.535 -9.773 -3.935 1.00 0.00 O ATOM 120 CB ALA T 8 69.212 -9.080 -0.727 1.00 0.00 C ATOM 0 H ALA T 8 69.440 -11.469 -0.072 1.00 0.00 H new ATOM 0 HA ALA T 8 67.865 -10.099 -2.063 1.00 0.00 H new ATOM 0 HB1 ALA T 8 69.172 -8.138 -1.273 1.00 0.00 H new ATOM 0 HB2 ALA T 8 68.491 -9.057 0.090 1.00 0.00 H new ATOM 0 HB3 ALA T 8 70.214 -9.223 -0.323 1.00 0.00 H new ATOM 126 N VAL T 9 71.049 -10.771 -2.602 1.00 0.00 N ATOM 127 CA VAL T 9 72.069 -10.832 -3.643 1.00 0.00 C ATOM 128 C VAL T 9 71.541 -11.575 -4.867 1.00 0.00 C ATOM 129 O VAL T 9 72.006 -11.355 -5.985 1.00 0.00 O ATOM 130 CB VAL T 9 73.315 -11.541 -3.112 1.00 0.00 C ATOM 131 CG1 VAL T 9 74.377 -11.600 -4.212 1.00 0.00 C ATOM 132 CG2 VAL T 9 73.868 -10.769 -1.911 1.00 0.00 C ATOM 0 H VAL T 9 71.333 -11.163 -1.704 1.00 0.00 H new ATOM 0 HA VAL T 9 72.327 -9.814 -3.933 1.00 0.00 H new ATOM 0 HB VAL T 9 73.053 -12.554 -2.805 1.00 0.00 H new ATOM 0 HG11 VAL T 9 75.265 -12.105 -3.833 1.00 0.00 H new ATOM 0 HG12 VAL T 9 73.984 -12.149 -5.068 1.00 0.00 H new ATOM 0 HG13 VAL T 9 74.639 -10.588 -4.519 1.00 0.00 H new ATOM 0 HG21 VAL T 9 74.756 -11.274 -1.532 1.00 0.00 H new ATOM 0 HG22 VAL T 9 74.129 -9.756 -2.218 1.00 0.00 H new ATOM 0 HG23 VAL T 9 73.112 -10.726 -1.127 1.00 0.00 H new ATOM 142 N GLU T 10 70.570 -12.455 -4.645 1.00 0.00 N ATOM 143 CA GLU T 10 69.988 -13.225 -5.738 1.00 0.00 C ATOM 144 C GLU T 10 69.076 -12.346 -6.589 1.00 0.00 C ATOM 145 O GLU T 10 68.901 -12.590 -7.783 1.00 0.00 O ATOM 146 CB GLU T 10 69.187 -14.402 -5.178 1.00 0.00 C ATOM 147 CG GLU T 10 70.147 -15.455 -4.622 1.00 0.00 C ATOM 148 CD GLU T 10 70.861 -16.166 -5.767 1.00 0.00 C ATOM 149 OE1 GLU T 10 70.419 -16.021 -6.895 1.00 0.00 O ATOM 150 OE2 GLU T 10 71.839 -16.844 -5.498 1.00 0.00 O ATOM 0 H GLU T 10 70.172 -12.652 -3.726 1.00 0.00 H new ATOM 0 HA GLU T 10 70.798 -13.600 -6.364 1.00 0.00 H new ATOM 0 HB2 GLU T 10 68.515 -14.057 -4.393 1.00 0.00 H new ATOM 0 HB3 GLU T 10 68.566 -14.838 -5.961 1.00 0.00 H new ATOM 0 HG2 GLU T 10 70.877 -14.983 -3.965 1.00 0.00 H new ATOM 0 HG3 GLU T 10 69.597 -16.179 -4.020 1.00 0.00 H new ATOM 157 N GLN T 11 68.498 -11.325 -5.966 1.00 0.00 N ATOM 158 CA GLN T 11 67.605 -10.416 -6.678 1.00 0.00 C ATOM 159 C GLN T 11 68.398 -9.509 -7.613 1.00 0.00 C ATOM 160 O GLN T 11 67.852 -8.959 -8.570 1.00 0.00 O ATOM 161 CB GLN T 11 66.823 -9.562 -5.678 1.00 0.00 C ATOM 162 CG GLN T 11 65.801 -10.436 -4.949 1.00 0.00 C ATOM 163 CD GLN T 11 64.956 -9.579 -4.013 1.00 0.00 C ATOM 164 OE1 GLN T 11 63.727 -9.639 -4.056 1.00 0.00 O ATOM 165 NE2 GLN T 11 65.543 -8.780 -3.165 1.00 0.00 N ATOM 0 H GLN T 11 68.629 -11.106 -4.978 1.00 0.00 H new ATOM 0 HA GLN T 11 66.909 -11.010 -7.270 1.00 0.00 H new ATOM 0 HB2 GLN T 11 67.506 -9.107 -4.960 1.00 0.00 H new ATOM 0 HB3 GLN T 11 66.317 -8.748 -6.197 1.00 0.00 H new ATOM 0 HG2 GLN T 11 65.160 -10.940 -5.672 1.00 0.00 H new ATOM 0 HG3 GLN T 11 66.313 -11.213 -4.381 1.00 0.00 H new ATOM 0 HE21 GLN T 11 66.561 -8.732 -3.131 1.00 0.00 H new ATOM 0 HE22 GLN T 11 64.984 -8.204 -2.536 1.00 0.00 H new ATOM 174 N LEU T 12 69.687 -9.356 -7.330 1.00 0.00 N ATOM 175 CA LEU T 12 70.546 -8.512 -8.152 1.00 0.00 C ATOM 176 C LEU T 12 70.950 -9.240 -9.431 1.00 0.00 C ATOM 177 O LEU T 12 71.686 -10.226 -9.389 1.00 0.00 O ATOM 178 CB LEU T 12 71.800 -8.118 -7.365 1.00 0.00 C ATOM 179 CG LEU T 12 71.413 -7.758 -5.929 1.00 0.00 C ATOM 180 CD1 LEU T 12 72.656 -7.293 -5.168 1.00 0.00 C ATOM 181 CD2 LEU T 12 70.374 -6.632 -5.945 1.00 0.00 C ATOM 0 H LEU T 12 70.158 -9.802 -6.543 1.00 0.00 H new ATOM 0 HA LEU T 12 69.990 -7.614 -8.421 1.00 0.00 H new ATOM 0 HB2 LEU T 12 72.515 -8.941 -7.364 1.00 0.00 H new ATOM 0 HB3 LEU T 12 72.291 -7.270 -7.844 1.00 0.00 H new ATOM 0 HG LEU T 12 70.991 -8.634 -5.437 1.00 0.00 H new ATOM 0 HD11 LEU T 12 72.381 -7.036 -4.145 1.00 0.00 H new ATOM 0 HD12 LEU T 12 73.395 -8.094 -5.155 1.00 0.00 H new ATOM 0 HD13 LEU T 12 73.078 -6.417 -5.661 1.00 0.00 H new ATOM 0 HD21 LEU T 12 70.099 -6.376 -4.922 1.00 0.00 H new ATOM 0 HD22 LEU T 12 70.795 -5.755 -6.437 1.00 0.00 H new ATOM 0 HD23 LEU T 12 69.488 -6.962 -6.487 1.00 0.00 H new ATOM 193 N THR T 13 70.464 -8.745 -10.565 1.00 0.00 N ATOM 194 CA THR T 13 70.780 -9.355 -11.853 1.00 0.00 C ATOM 195 C THR T 13 72.152 -8.895 -12.338 1.00 0.00 C ATOM 196 O THR T 13 72.671 -7.874 -11.884 1.00 0.00 O ATOM 197 CB THR T 13 69.714 -8.970 -12.885 1.00 0.00 C ATOM 198 OG1 THR T 13 68.426 -9.097 -12.298 1.00 0.00 O ATOM 199 CG2 THR T 13 69.813 -9.890 -14.104 1.00 0.00 C ATOM 0 H THR T 13 69.854 -7.929 -10.619 1.00 0.00 H new ATOM 0 HA THR T 13 70.794 -10.438 -11.732 1.00 0.00 H new ATOM 0 HB THR T 13 69.874 -7.939 -13.202 1.00 0.00 H new ATOM 0 HG1 THR T 13 67.742 -8.850 -12.954 1.00 0.00 H new ATOM 0 HG21 THR T 13 69.053 -9.611 -14.833 1.00 0.00 H new ATOM 0 HG22 THR T 13 70.801 -9.792 -14.554 1.00 0.00 H new ATOM 0 HG23 THR T 13 69.656 -10.923 -13.794 1.00 0.00 H new ATOM 207 N GLU T 14 72.736 -9.651 -13.261 1.00 0.00 N ATOM 208 CA GLU T 14 74.048 -9.308 -13.798 1.00 0.00 C ATOM 209 C GLU T 14 73.993 -7.973 -14.536 1.00 0.00 C ATOM 210 O GLU T 14 74.990 -7.523 -15.099 1.00 0.00 O ATOM 211 CB GLU T 14 74.523 -10.403 -14.755 1.00 0.00 C ATOM 212 CG GLU T 14 74.800 -11.685 -13.967 1.00 0.00 C ATOM 213 CD GLU T 14 75.117 -12.827 -14.924 1.00 0.00 C ATOM 214 OE1 GLU T 14 74.208 -13.276 -15.604 1.00 0.00 O ATOM 215 OE2 GLU T 14 76.266 -13.238 -14.966 1.00 0.00 O ATOM 0 H GLU T 14 72.325 -10.499 -13.651 1.00 0.00 H new ATOM 0 HA GLU T 14 74.749 -9.222 -12.967 1.00 0.00 H new ATOM 0 HB2 GLU T 14 73.766 -10.588 -15.517 1.00 0.00 H new ATOM 0 HB3 GLU T 14 75.426 -10.081 -15.274 1.00 0.00 H new ATOM 0 HG2 GLU T 14 75.636 -11.529 -13.285 1.00 0.00 H new ATOM 0 HG3 GLU T 14 73.934 -11.941 -13.357 1.00 0.00 H new ATOM 222 N GLU T 15 72.819 -7.346 -14.532 1.00 0.00 N ATOM 223 CA GLU T 15 72.640 -6.063 -15.206 1.00 0.00 C ATOM 224 C GLU T 15 73.051 -4.909 -14.296 1.00 0.00 C ATOM 225 O GLU T 15 73.837 -4.047 -14.690 1.00 0.00 O ATOM 226 CB GLU T 15 71.175 -5.891 -15.614 1.00 0.00 C ATOM 227 CG GLU T 15 70.785 -6.998 -16.596 1.00 0.00 C ATOM 228 CD GLU T 15 69.268 -7.050 -16.748 1.00 0.00 C ATOM 229 OE1 GLU T 15 68.598 -7.217 -15.743 1.00 0.00 O ATOM 230 OE2 GLU T 15 68.801 -6.922 -17.867 1.00 0.00 O ATOM 0 H GLU T 15 71.982 -7.703 -14.072 1.00 0.00 H new ATOM 0 HA GLU T 15 73.274 -6.052 -16.093 1.00 0.00 H new ATOM 0 HB2 GLU T 15 70.534 -5.929 -14.733 1.00 0.00 H new ATOM 0 HB3 GLU T 15 71.027 -4.914 -16.074 1.00 0.00 H new ATOM 0 HG2 GLU T 15 71.250 -6.816 -17.565 1.00 0.00 H new ATOM 0 HG3 GLU T 15 71.156 -7.959 -16.240 1.00 0.00 H new ATOM 237 N GLN T 16 72.510 -4.891 -13.082 1.00 0.00 N ATOM 238 CA GLN T 16 72.824 -3.831 -12.130 1.00 0.00 C ATOM 239 C GLN T 16 74.192 -4.056 -11.494 1.00 0.00 C ATOM 240 O GLN T 16 74.591 -3.322 -10.591 1.00 0.00 O ATOM 241 CB GLN T 16 71.746 -3.766 -11.042 1.00 0.00 C ATOM 242 CG GLN T 16 71.784 -5.040 -10.183 1.00 0.00 C ATOM 243 CD GLN T 16 72.861 -4.924 -9.106 1.00 0.00 C ATOM 244 OE1 GLN T 16 73.962 -5.447 -9.271 1.00 0.00 O ATOM 245 NE2 GLN T 16 72.605 -4.265 -8.010 1.00 0.00 N ATOM 0 H GLN T 16 71.856 -5.593 -12.736 1.00 0.00 H new ATOM 0 HA GLN T 16 72.849 -2.884 -12.670 1.00 0.00 H new ATOM 0 HB2 GLN T 16 71.905 -2.890 -10.414 1.00 0.00 H new ATOM 0 HB3 GLN T 16 70.763 -3.656 -11.500 1.00 0.00 H new ATOM 0 HG2 GLN T 16 70.812 -5.202 -9.718 1.00 0.00 H new ATOM 0 HG3 GLN T 16 71.984 -5.906 -10.814 1.00 0.00 H new ATOM 0 HE21 GLN T 16 71.691 -3.833 -7.877 1.00 0.00 H new ATOM 0 HE22 GLN T 16 73.319 -4.182 -7.286 1.00 0.00 H new ATOM 254 N LYS T 17 74.910 -5.072 -11.972 1.00 0.00 N ATOM 255 CA LYS T 17 76.240 -5.385 -11.444 1.00 0.00 C ATOM 256 C LYS T 17 77.323 -4.776 -12.329 1.00 0.00 C ATOM 257 O LYS T 17 78.442 -4.534 -11.879 1.00 0.00 O ATOM 258 CB LYS T 17 76.431 -6.904 -11.378 1.00 0.00 C ATOM 259 CG LYS T 17 75.587 -7.485 -10.240 1.00 0.00 C ATOM 260 CD LYS T 17 75.944 -8.960 -10.044 1.00 0.00 C ATOM 261 CE LYS T 17 74.881 -9.630 -9.170 1.00 0.00 C ATOM 262 NZ LYS T 17 75.364 -10.974 -8.745 1.00 0.00 N ATOM 0 H LYS T 17 74.596 -5.690 -12.720 1.00 0.00 H new ATOM 0 HA LYS T 17 76.322 -4.963 -10.442 1.00 0.00 H new ATOM 0 HB2 LYS T 17 76.141 -7.357 -12.326 1.00 0.00 H new ATOM 0 HB3 LYS T 17 77.483 -7.141 -11.220 1.00 0.00 H new ATOM 0 HG2 LYS T 17 75.767 -6.930 -9.319 1.00 0.00 H new ATOM 0 HG3 LYS T 17 74.527 -7.384 -10.471 1.00 0.00 H new ATOM 0 HD2 LYS T 17 76.005 -9.462 -11.010 1.00 0.00 H new ATOM 0 HD3 LYS T 17 76.924 -9.049 -9.576 1.00 0.00 H new ATOM 0 HE2 LYS T 17 74.672 -9.013 -8.296 1.00 0.00 H new ATOM 0 HE3 LYS T 17 73.947 -9.725 -9.723 1.00 0.00 H new ATOM 0 HZ1 LYS T 17 74.643 -11.430 -8.151 1.00 0.00 H new ATOM 0 HZ2 LYS T 17 75.542 -11.560 -9.585 1.00 0.00 H new ATOM 0 HZ3 LYS T 17 76.245 -10.871 -8.202 1.00 0.00 H new ATOM 276 N ASN T 18 76.983 -4.535 -13.591 1.00 0.00 N ATOM 277 CA ASN T 18 77.936 -3.958 -14.533 1.00 0.00 C ATOM 278 C ASN T 18 78.448 -2.613 -14.029 1.00 0.00 C ATOM 279 O ASN T 18 79.554 -2.192 -14.369 1.00 0.00 O ATOM 280 CB ASN T 18 77.273 -3.773 -15.898 1.00 0.00 C ATOM 281 CG ASN T 18 77.023 -5.131 -16.545 1.00 0.00 C ATOM 282 OD1 ASN T 18 77.060 -6.210 -15.812 1.00 0.00 O flip ATOM 283 ND2 ASN T 18 76.788 -5.211 -17.751 1.00 0.00 N flip ATOM 0 H ASN T 18 76.062 -4.729 -13.983 1.00 0.00 H new ATOM 0 HA ASN T 18 78.780 -4.641 -14.627 1.00 0.00 H new ATOM 0 HB2 ASN T 18 76.331 -3.236 -15.784 1.00 0.00 H new ATOM 0 HB3 ASN T 18 77.910 -3.166 -16.542 1.00 0.00 H new ATOM 0 HD21 ASN T 18 76.760 -4.366 -18.322 1.00 0.00 H new ATOM 0 HD22 ASN T 18 76.622 -6.122 -18.179 1.00 0.00 H new ATOM 290 N GLU T 19 77.638 -1.939 -13.217 1.00 0.00 N ATOM 291 CA GLU T 19 78.021 -0.639 -12.674 1.00 0.00 C ATOM 292 C GLU T 19 78.946 -0.818 -11.468 1.00 0.00 C ATOM 293 O GLU T 19 79.997 -0.182 -11.383 1.00 0.00 O ATOM 294 CB GLU T 19 76.761 0.155 -12.268 1.00 0.00 C ATOM 295 CG GLU T 19 75.653 -0.812 -11.829 1.00 0.00 C ATOM 296 CD GLU T 19 74.923 -1.371 -13.049 1.00 0.00 C ATOM 297 OE1 GLU T 19 74.137 -0.640 -13.628 1.00 0.00 O ATOM 298 OE2 GLU T 19 75.161 -2.519 -13.385 1.00 0.00 O ATOM 0 H GLU T 19 76.719 -2.268 -12.922 1.00 0.00 H new ATOM 0 HA GLU T 19 78.557 -0.081 -13.442 1.00 0.00 H new ATOM 0 HB2 GLU T 19 76.999 0.842 -11.456 1.00 0.00 H new ATOM 0 HB3 GLU T 19 76.416 0.760 -13.106 1.00 0.00 H new ATOM 0 HG2 GLU T 19 76.082 -1.628 -11.248 1.00 0.00 H new ATOM 0 HG3 GLU T 19 74.947 -0.296 -11.179 1.00 0.00 H new ATOM 305 N PHE T 20 78.550 -1.684 -10.541 1.00 0.00 N ATOM 306 CA PHE T 20 79.359 -1.929 -9.351 1.00 0.00 C ATOM 307 C PHE T 20 80.735 -2.461 -9.742 1.00 0.00 C ATOM 308 O PHE T 20 81.759 -1.873 -9.393 1.00 0.00 O ATOM 309 CB PHE T 20 78.658 -2.936 -8.433 1.00 0.00 C ATOM 310 CG PHE T 20 77.501 -2.262 -7.726 1.00 0.00 C ATOM 311 CD1 PHE T 20 77.746 -1.238 -6.802 1.00 0.00 C ATOM 312 CD2 PHE T 20 76.183 -2.660 -7.993 1.00 0.00 C ATOM 313 CE1 PHE T 20 76.679 -0.613 -6.147 1.00 0.00 C ATOM 314 CE2 PHE T 20 75.115 -2.034 -7.338 1.00 0.00 C ATOM 315 CZ PHE T 20 75.363 -1.011 -6.415 1.00 0.00 C ATOM 0 H PHE T 20 77.685 -2.222 -10.588 1.00 0.00 H new ATOM 0 HA PHE T 20 79.483 -0.986 -8.819 1.00 0.00 H new ATOM 0 HB2 PHE T 20 78.297 -3.784 -9.015 1.00 0.00 H new ATOM 0 HB3 PHE T 20 79.364 -3.329 -7.702 1.00 0.00 H new ATOM 0 HD1 PHE T 20 78.760 -0.930 -6.595 1.00 0.00 H new ATOM 0 HD2 PHE T 20 75.991 -3.450 -8.704 1.00 0.00 H new ATOM 0 HE1 PHE T 20 76.870 0.176 -5.435 1.00 0.00 H new ATOM 0 HE2 PHE T 20 74.100 -2.340 -7.545 1.00 0.00 H new ATOM 0 HZ PHE T 20 74.539 -0.529 -5.910 1.00 0.00 H new ATOM 325 N LYS T 21 80.754 -3.574 -10.468 1.00 0.00 N ATOM 326 CA LYS T 21 82.013 -4.171 -10.898 1.00 0.00 C ATOM 327 C LYS T 21 82.923 -3.112 -11.511 1.00 0.00 C ATOM 328 O LYS T 21 84.146 -3.254 -11.510 1.00 0.00 O ATOM 329 CB LYS T 21 81.747 -5.276 -11.923 1.00 0.00 C ATOM 330 CG LYS T 21 80.993 -6.429 -11.253 1.00 0.00 C ATOM 331 CD LYS T 21 81.012 -7.656 -12.169 1.00 0.00 C ATOM 332 CE LYS T 21 80.245 -7.352 -13.459 1.00 0.00 C ATOM 333 NZ LYS T 21 79.902 -8.631 -14.143 1.00 0.00 N ATOM 0 H LYS T 21 79.919 -4.077 -10.769 1.00 0.00 H new ATOM 0 HA LYS T 21 82.507 -4.600 -10.026 1.00 0.00 H new ATOM 0 HB2 LYS T 21 81.163 -4.881 -12.755 1.00 0.00 H new ATOM 0 HB3 LYS T 21 82.689 -5.636 -12.337 1.00 0.00 H new ATOM 0 HG2 LYS T 21 81.454 -6.670 -10.295 1.00 0.00 H new ATOM 0 HG3 LYS T 21 79.965 -6.133 -11.046 1.00 0.00 H new ATOM 0 HD2 LYS T 21 82.041 -7.931 -12.403 1.00 0.00 H new ATOM 0 HD3 LYS T 21 80.562 -8.508 -11.660 1.00 0.00 H new ATOM 0 HE2 LYS T 21 79.337 -6.793 -13.232 1.00 0.00 H new ATOM 0 HE3 LYS T 21 80.849 -6.726 -14.116 1.00 0.00 H new ATOM 0 HZ1 LYS T 21 79.381 -8.427 -15.020 1.00 0.00 H new ATOM 0 HZ2 LYS T 21 80.775 -9.148 -14.372 1.00 0.00 H new ATOM 0 HZ3 LYS T 21 79.310 -9.212 -13.516 1.00 0.00 H new ATOM 347 N ALA T 22 82.319 -2.049 -12.032 1.00 0.00 N ATOM 348 CA ALA T 22 83.086 -0.970 -12.645 1.00 0.00 C ATOM 349 C ALA T 22 83.664 -0.051 -11.572 1.00 0.00 C ATOM 350 O ALA T 22 84.822 0.358 -11.651 1.00 0.00 O ATOM 351 CB ALA T 22 82.190 -0.162 -13.588 1.00 0.00 C ATOM 0 H ALA T 22 81.308 -1.912 -12.042 1.00 0.00 H new ATOM 0 HA ALA T 22 83.907 -1.407 -13.214 1.00 0.00 H new ATOM 0 HB1 ALA T 22 82.770 0.642 -14.042 1.00 0.00 H new ATOM 0 HB2 ALA T 22 81.802 -0.815 -14.370 1.00 0.00 H new ATOM 0 HB3 ALA T 22 81.359 0.263 -13.025 1.00 0.00 H new ATOM 357 N ALA T 23 82.850 0.268 -10.571 1.00 0.00 N ATOM 358 CA ALA T 23 83.294 1.139 -9.488 1.00 0.00 C ATOM 359 C ALA T 23 84.656 0.693 -8.967 1.00 0.00 C ATOM 360 O ALA T 23 85.597 1.484 -8.908 1.00 0.00 O ATOM 361 CB ALA T 23 82.276 1.115 -8.346 1.00 0.00 C ATOM 0 H ALA T 23 81.888 -0.060 -10.487 1.00 0.00 H new ATOM 0 HA ALA T 23 83.380 2.154 -9.876 1.00 0.00 H new ATOM 0 HB1 ALA T 23 82.616 1.768 -7.542 1.00 0.00 H new ATOM 0 HB2 ALA T 23 81.310 1.463 -8.712 1.00 0.00 H new ATOM 0 HB3 ALA T 23 82.176 0.097 -7.969 1.00 0.00 H new ATOM 367 N PHE T 24 84.756 -0.580 -8.592 1.00 0.00 N ATOM 368 CA PHE T 24 86.011 -1.123 -8.077 1.00 0.00 C ATOM 369 C PHE T 24 87.192 -0.628 -8.908 1.00 0.00 C ATOM 370 O PHE T 24 88.120 -0.014 -8.381 1.00 0.00 O ATOM 371 CB PHE T 24 85.970 -2.654 -8.110 1.00 0.00 C ATOM 372 CG PHE T 24 85.071 -3.164 -7.009 1.00 0.00 C ATOM 373 CD1 PHE T 24 85.594 -3.393 -5.731 1.00 0.00 C ATOM 374 CD2 PHE T 24 83.717 -3.410 -7.267 1.00 0.00 C ATOM 375 CE1 PHE T 24 84.762 -3.867 -4.710 1.00 0.00 C ATOM 376 CE2 PHE T 24 82.886 -3.885 -6.245 1.00 0.00 C ATOM 377 CZ PHE T 24 83.409 -4.114 -4.967 1.00 0.00 C ATOM 0 H PHE T 24 83.989 -1.251 -8.634 1.00 0.00 H new ATOM 0 HA PHE T 24 86.136 -0.783 -7.049 1.00 0.00 H new ATOM 0 HB2 PHE T 24 85.605 -2.997 -9.078 1.00 0.00 H new ATOM 0 HB3 PHE T 24 86.975 -3.057 -7.987 1.00 0.00 H new ATOM 0 HD1 PHE T 24 86.639 -3.204 -5.533 1.00 0.00 H new ATOM 0 HD2 PHE T 24 83.314 -3.234 -8.253 1.00 0.00 H new ATOM 0 HE1 PHE T 24 85.165 -4.042 -3.723 1.00 0.00 H new ATOM 0 HE2 PHE T 24 81.841 -4.075 -6.443 1.00 0.00 H new ATOM 0 HZ PHE T 24 82.768 -4.481 -4.179 1.00 0.00 H new ATOM 387 N ASP T 25 87.151 -0.904 -10.207 1.00 0.00 N ATOM 388 CA ASP T 25 88.224 -0.486 -11.103 1.00 0.00 C ATOM 389 C ASP T 25 88.643 0.953 -10.814 1.00 0.00 C ATOM 390 O ASP T 25 89.817 1.303 -10.941 1.00 0.00 O ATOM 391 CB ASP T 25 87.764 -0.605 -12.557 1.00 0.00 C ATOM 392 CG ASP T 25 87.099 -1.958 -12.784 1.00 0.00 C ATOM 393 OD1 ASP T 25 87.194 -2.797 -11.904 1.00 0.00 O ATOM 394 OD2 ASP T 25 86.503 -2.133 -13.834 1.00 0.00 O ATOM 0 H ASP T 25 86.392 -1.412 -10.661 1.00 0.00 H new ATOM 0 HA ASP T 25 89.082 -1.138 -10.937 1.00 0.00 H new ATOM 0 HB2 ASP T 25 87.065 0.197 -12.793 1.00 0.00 H new ATOM 0 HB3 ASP T 25 88.616 -0.492 -13.227 1.00 0.00 H new ATOM 399 N ILE T 26 87.680 1.782 -10.427 1.00 0.00 N ATOM 400 CA ILE T 26 87.966 3.181 -10.127 1.00 0.00 C ATOM 401 C ILE T 26 88.743 3.302 -8.818 1.00 0.00 C ATOM 402 O ILE T 26 89.847 3.846 -8.790 1.00 0.00 O ATOM 403 CB ILE T 26 86.660 3.974 -10.020 1.00 0.00 C ATOM 404 CG1 ILE T 26 85.717 3.573 -11.163 1.00 0.00 C ATOM 405 CG2 ILE T 26 86.957 5.472 -10.104 1.00 0.00 C ATOM 406 CD1 ILE T 26 86.448 3.666 -12.506 1.00 0.00 C ATOM 0 H ILE T 26 86.702 1.513 -10.314 1.00 0.00 H new ATOM 0 HA ILE T 26 88.572 3.587 -10.937 1.00 0.00 H new ATOM 0 HB ILE T 26 86.184 3.754 -9.064 1.00 0.00 H new ATOM 0 HG12 ILE T 26 85.355 2.557 -11.007 1.00 0.00 H new ATOM 0 HG13 ILE T 26 84.843 4.225 -11.170 1.00 0.00 H new ATOM 0 HG21 ILE T 26 86.025 6.033 -10.028 1.00 0.00 H new ATOM 0 HG22 ILE T 26 87.620 5.758 -9.288 1.00 0.00 H new ATOM 0 HG23 ILE T 26 87.437 5.695 -11.057 1.00 0.00 H new ATOM 0 HD11 ILE T 26 85.770 3.379 -13.310 1.00 0.00 H new ATOM 0 HD12 ILE T 26 86.788 4.689 -12.665 1.00 0.00 H new ATOM 0 HD13 ILE T 26 87.307 2.995 -12.500 1.00 0.00 H new ATOM 418 N PHE T 27 88.159 2.797 -7.737 1.00 0.00 N ATOM 419 CA PHE T 27 88.808 2.859 -6.432 1.00 0.00 C ATOM 420 C PHE T 27 90.190 2.214 -6.486 1.00 0.00 C ATOM 421 O PHE T 27 91.019 2.429 -5.603 1.00 0.00 O ATOM 422 CB PHE T 27 87.953 2.142 -5.385 1.00 0.00 C ATOM 423 CG PHE T 27 86.718 2.960 -5.090 1.00 0.00 C ATOM 424 CD1 PHE T 27 86.742 3.924 -4.074 1.00 0.00 C ATOM 425 CD2 PHE T 27 85.548 2.754 -5.831 1.00 0.00 C ATOM 426 CE1 PHE T 27 85.597 4.681 -3.799 1.00 0.00 C ATOM 427 CE2 PHE T 27 84.403 3.511 -5.556 1.00 0.00 C ATOM 428 CZ PHE T 27 84.427 4.475 -4.541 1.00 0.00 C ATOM 0 H PHE T 27 87.245 2.344 -7.737 1.00 0.00 H new ATOM 0 HA PHE T 27 88.918 3.908 -6.156 1.00 0.00 H new ATOM 0 HB2 PHE T 27 87.669 1.154 -5.748 1.00 0.00 H new ATOM 0 HB3 PHE T 27 88.529 1.992 -4.472 1.00 0.00 H new ATOM 0 HD1 PHE T 27 87.644 4.083 -3.502 1.00 0.00 H new ATOM 0 HD2 PHE T 27 85.529 2.011 -6.615 1.00 0.00 H new ATOM 0 HE1 PHE T 27 85.616 5.424 -3.015 1.00 0.00 H new ATOM 0 HE2 PHE T 27 83.500 3.351 -6.127 1.00 0.00 H new ATOM 0 HZ PHE T 27 83.544 5.060 -4.330 1.00 0.00 H new ATOM 438 N VAL T 28 90.432 1.422 -7.529 1.00 0.00 N ATOM 439 CA VAL T 28 91.719 0.745 -7.690 1.00 0.00 C ATOM 440 C VAL T 28 92.034 0.542 -9.171 1.00 0.00 C ATOM 441 O VAL T 28 91.948 -0.571 -9.686 1.00 0.00 O ATOM 442 CB VAL T 28 91.685 -0.614 -6.979 1.00 0.00 C ATOM 443 CG1 VAL T 28 91.818 -0.413 -5.468 1.00 0.00 C ATOM 444 CG2 VAL T 28 90.356 -1.311 -7.281 1.00 0.00 C ATOM 0 H VAL T 28 89.759 1.233 -8.272 1.00 0.00 H new ATOM 0 HA VAL T 28 92.497 1.367 -7.247 1.00 0.00 H new ATOM 0 HB VAL T 28 92.513 -1.227 -7.335 1.00 0.00 H new ATOM 0 HG11 VAL T 28 91.793 -1.382 -4.969 1.00 0.00 H new ATOM 0 HG12 VAL T 28 92.763 0.084 -5.249 1.00 0.00 H new ATOM 0 HG13 VAL T 28 90.993 0.202 -5.109 1.00 0.00 H new ATOM 0 HG21 VAL T 28 90.329 -2.277 -6.777 1.00 0.00 H new ATOM 0 HG22 VAL T 28 89.532 -0.693 -6.925 1.00 0.00 H new ATOM 0 HG23 VAL T 28 90.259 -1.460 -8.356 1.00 0.00 H new ATOM 454 N LEU T 29 92.402 1.629 -9.849 1.00 0.00 N ATOM 455 CA LEU T 29 92.734 1.566 -11.274 1.00 0.00 C ATOM 456 C LEU T 29 94.243 1.424 -11.469 1.00 0.00 C ATOM 457 O LEU T 29 94.780 1.787 -12.516 1.00 0.00 O ATOM 458 CB LEU T 29 92.227 2.836 -11.984 1.00 0.00 C ATOM 459 CG LEU T 29 92.374 4.047 -11.056 1.00 0.00 C ATOM 460 CD1 LEU T 29 93.828 4.176 -10.596 1.00 0.00 C ATOM 461 CD2 LEU T 29 91.964 5.312 -11.813 1.00 0.00 C ATOM 0 H LEU T 29 92.478 2.559 -9.438 1.00 0.00 H new ATOM 0 HA LEU T 29 92.247 0.693 -11.708 1.00 0.00 H new ATOM 0 HB2 LEU T 29 92.792 3.000 -12.902 1.00 0.00 H new ATOM 0 HB3 LEU T 29 91.183 2.711 -12.270 1.00 0.00 H new ATOM 0 HG LEU T 29 91.734 3.915 -10.183 1.00 0.00 H new ATOM 0 HD11 LEU T 29 93.926 5.039 -9.937 1.00 0.00 H new ATOM 0 HD12 LEU T 29 94.121 3.274 -10.059 1.00 0.00 H new ATOM 0 HD13 LEU T 29 94.474 4.308 -11.464 1.00 0.00 H new ATOM 0 HD21 LEU T 29 92.066 6.177 -11.158 1.00 0.00 H new ATOM 0 HD22 LEU T 29 92.606 5.439 -12.685 1.00 0.00 H new ATOM 0 HD23 LEU T 29 90.927 5.222 -12.136 1.00 0.00 H new ATOM 473 N GLY T 30 94.923 0.892 -10.458 1.00 0.00 N ATOM 474 CA GLY T 30 96.368 0.712 -10.539 1.00 0.00 C ATOM 475 C GLY T 30 96.869 -0.246 -9.461 1.00 0.00 C ATOM 476 O GLY T 30 98.074 -0.447 -9.309 1.00 0.00 O ATOM 0 H GLY T 30 94.502 0.581 -9.582 1.00 0.00 H new ATOM 0 HA2 GLY T 30 96.634 0.326 -11.523 1.00 0.00 H new ATOM 0 HA3 GLY T 30 96.863 1.677 -10.430 1.00 0.00 H new ATOM 480 N ALA T 31 95.940 -0.836 -8.717 1.00 0.00 N ATOM 481 CA ALA T 31 96.306 -1.771 -7.658 1.00 0.00 C ATOM 482 C ALA T 31 96.653 -3.135 -8.245 1.00 0.00 C ATOM 483 O ALA T 31 96.388 -3.403 -9.417 1.00 0.00 O ATOM 484 CB ALA T 31 95.150 -1.916 -6.665 1.00 0.00 C ATOM 0 H ALA T 31 94.937 -0.686 -8.825 1.00 0.00 H new ATOM 0 HA ALA T 31 97.181 -1.379 -7.139 1.00 0.00 H new ATOM 0 HB1 ALA T 31 95.432 -2.616 -5.878 1.00 0.00 H new ATOM 0 HB2 ALA T 31 94.925 -0.945 -6.224 1.00 0.00 H new ATOM 0 HB3 ALA T 31 94.268 -2.291 -7.185 1.00 0.00 H new ATOM 490 N GLU T 32 97.243 -3.996 -7.422 1.00 0.00 N ATOM 491 CA GLU T 32 97.619 -5.332 -7.871 1.00 0.00 C ATOM 492 C GLU T 32 96.381 -6.211 -8.020 1.00 0.00 C ATOM 493 O GLU T 32 95.966 -6.532 -9.133 1.00 0.00 O ATOM 494 CB GLU T 32 98.583 -5.970 -6.867 1.00 0.00 C ATOM 495 CG GLU T 32 99.958 -5.310 -6.986 1.00 0.00 C ATOM 496 CD GLU T 32 100.891 -5.852 -5.908 1.00 0.00 C ATOM 497 OE1 GLU T 32 100.615 -6.925 -5.398 1.00 0.00 O ATOM 498 OE2 GLU T 32 101.868 -5.185 -5.608 1.00 0.00 O ATOM 0 H GLU T 32 97.470 -3.795 -6.448 1.00 0.00 H new ATOM 0 HA GLU T 32 98.111 -5.246 -8.840 1.00 0.00 H new ATOM 0 HB2 GLU T 32 98.199 -5.853 -5.854 1.00 0.00 H new ATOM 0 HB3 GLU T 32 98.665 -7.040 -7.055 1.00 0.00 H new ATOM 0 HG2 GLU T 32 100.379 -5.502 -7.973 1.00 0.00 H new ATOM 0 HG3 GLU T 32 99.862 -4.229 -6.885 1.00 0.00 H new ATOM 505 N ASP T 33 95.793 -6.593 -6.891 1.00 0.00 N ATOM 506 CA ASP T 33 94.601 -7.434 -6.906 1.00 0.00 C ATOM 507 C ASP T 33 93.358 -6.593 -7.183 1.00 0.00 C ATOM 508 O ASP T 33 92.777 -6.665 -8.266 1.00 0.00 O ATOM 509 CB ASP T 33 94.451 -8.151 -5.562 1.00 0.00 C ATOM 510 CG ASP T 33 94.676 -7.168 -4.418 1.00 0.00 C ATOM 511 OD1 ASP T 33 95.779 -6.657 -4.312 1.00 0.00 O ATOM 512 OD2 ASP T 33 93.744 -6.942 -3.664 1.00 0.00 O ATOM 0 H ASP T 33 96.120 -6.336 -5.960 1.00 0.00 H new ATOM 0 HA ASP T 33 94.708 -8.174 -7.699 1.00 0.00 H new ATOM 0 HB2 ASP T 33 93.457 -8.591 -5.484 1.00 0.00 H new ATOM 0 HB3 ASP T 33 95.168 -8.970 -5.495 1.00 0.00 H new ATOM 517 N GLY T 34 92.956 -5.795 -6.198 1.00 0.00 N ATOM 518 CA GLY T 34 91.779 -4.943 -6.346 1.00 0.00 C ATOM 519 C GLY T 34 91.206 -4.563 -4.985 1.00 0.00 C ATOM 520 O GLY T 34 90.024 -4.237 -4.869 1.00 0.00 O ATOM 0 H GLY T 34 93.424 -5.720 -5.295 1.00 0.00 H new ATOM 0 HA2 GLY T 34 92.045 -4.041 -6.897 1.00 0.00 H new ATOM 0 HA3 GLY T 34 91.021 -5.463 -6.932 1.00 0.00 H new ATOM 524 N SER T 35 92.049 -4.606 -3.957 1.00 0.00 N ATOM 525 CA SER T 35 91.615 -4.264 -2.605 1.00 0.00 C ATOM 526 C SER T 35 91.644 -2.754 -2.398 1.00 0.00 C ATOM 527 O SER T 35 92.660 -2.103 -2.642 1.00 0.00 O ATOM 528 CB SER T 35 92.526 -4.937 -1.578 1.00 0.00 C ATOM 529 OG SER T 35 93.875 -4.572 -1.836 1.00 0.00 O ATOM 0 H SER T 35 93.031 -4.872 -4.033 1.00 0.00 H new ATOM 0 HA SER T 35 90.593 -4.618 -2.473 1.00 0.00 H new ATOM 0 HB2 SER T 35 92.242 -4.635 -0.570 1.00 0.00 H new ATOM 0 HB3 SER T 35 92.414 -6.020 -1.630 1.00 0.00 H new ATOM 0 HG SER T 35 93.901 -3.680 -2.240 1.00 0.00 H new ATOM 535 N ILE T 36 90.522 -2.202 -1.945 1.00 0.00 N ATOM 536 CA ILE T 36 90.422 -0.764 -1.707 1.00 0.00 C ATOM 537 C ILE T 36 90.920 -0.421 -0.305 1.00 0.00 C ATOM 538 O ILE T 36 90.951 -1.278 0.578 1.00 0.00 O ATOM 539 CB ILE T 36 88.968 -0.309 -1.858 1.00 0.00 C ATOM 540 CG1 ILE T 36 88.426 -0.777 -3.214 1.00 0.00 C ATOM 541 CG2 ILE T 36 88.901 1.219 -1.778 1.00 0.00 C ATOM 542 CD1 ILE T 36 86.921 -0.511 -3.286 1.00 0.00 C ATOM 0 H ILE T 36 89.672 -2.726 -1.736 1.00 0.00 H new ATOM 0 HA ILE T 36 91.042 -0.248 -2.440 1.00 0.00 H new ATOM 0 HB ILE T 36 88.366 -0.740 -1.058 1.00 0.00 H new ATOM 0 HG12 ILE T 36 88.937 -0.253 -4.022 1.00 0.00 H new ATOM 0 HG13 ILE T 36 88.624 -1.840 -3.349 1.00 0.00 H new ATOM 0 HG21 ILE T 36 87.866 1.544 -1.885 1.00 0.00 H new ATOM 0 HG22 ILE T 36 89.287 1.550 -0.814 1.00 0.00 H new ATOM 0 HG23 ILE T 36 89.502 1.652 -2.578 1.00 0.00 H new ATOM 0 HD11 ILE T 36 86.538 -0.844 -4.251 1.00 0.00 H new ATOM 0 HD12 ILE T 36 86.417 -1.055 -2.488 1.00 0.00 H new ATOM 0 HD13 ILE T 36 86.734 0.557 -3.171 1.00 0.00 H new ATOM 554 N SER T 37 91.310 0.835 -0.109 1.00 0.00 N ATOM 555 CA SER T 37 91.805 1.279 1.191 1.00 0.00 C ATOM 556 C SER T 37 91.656 2.791 1.335 1.00 0.00 C ATOM 557 O SER T 37 91.428 3.499 0.354 1.00 0.00 O ATOM 558 CB SER T 37 93.275 0.892 1.349 1.00 0.00 C ATOM 559 OG SER T 37 93.643 0.997 2.718 1.00 0.00 O ATOM 0 H SER T 37 91.294 1.559 -0.827 1.00 0.00 H new ATOM 0 HA SER T 37 91.216 0.793 1.968 1.00 0.00 H new ATOM 0 HB2 SER T 37 93.435 -0.126 0.994 1.00 0.00 H new ATOM 0 HB3 SER T 37 93.902 1.544 0.741 1.00 0.00 H new ATOM 0 HG SER T 37 94.585 0.748 2.824 1.00 0.00 H new ATOM 565 N THR T 38 91.787 3.277 2.565 1.00 0.00 N ATOM 566 CA THR T 38 91.664 4.707 2.832 1.00 0.00 C ATOM 567 C THR T 38 92.616 5.505 1.948 1.00 0.00 C ATOM 568 O THR T 38 92.581 6.736 1.935 1.00 0.00 O ATOM 569 CB THR T 38 91.973 4.991 4.304 1.00 0.00 C ATOM 570 OG1 THR T 38 93.380 5.027 4.492 1.00 0.00 O ATOM 571 CG2 THR T 38 91.368 3.892 5.178 1.00 0.00 C ATOM 0 H THR T 38 91.977 2.706 3.389 1.00 0.00 H new ATOM 0 HA THR T 38 90.641 5.011 2.609 1.00 0.00 H new ATOM 0 HB THR T 38 91.543 5.952 4.586 1.00 0.00 H new ATOM 0 HG1 THR T 38 93.587 4.890 5.440 1.00 0.00 H new ATOM 0 HG21 THR T 38 91.590 4.097 6.225 1.00 0.00 H new ATOM 0 HG22 THR T 38 90.288 3.866 5.034 1.00 0.00 H new ATOM 0 HG23 THR T 38 91.795 2.929 4.899 1.00 0.00 H new ATOM 579 N LYS T 39 93.472 4.799 1.214 1.00 0.00 N ATOM 580 CA LYS T 39 94.435 5.455 0.335 1.00 0.00 C ATOM 581 C LYS T 39 93.782 5.856 -0.985 1.00 0.00 C ATOM 582 O LYS T 39 93.791 7.028 -1.362 1.00 0.00 O ATOM 583 CB LYS T 39 95.611 4.517 0.060 1.00 0.00 C ATOM 584 CG LYS T 39 96.396 4.288 1.353 1.00 0.00 C ATOM 585 CD LYS T 39 97.687 3.529 1.043 1.00 0.00 C ATOM 586 CE LYS T 39 98.587 3.521 2.280 1.00 0.00 C ATOM 587 NZ LYS T 39 99.883 2.865 1.947 1.00 0.00 N ATOM 0 H LYS T 39 93.519 3.780 1.210 1.00 0.00 H new ATOM 0 HA LYS T 39 94.794 6.356 0.833 1.00 0.00 H new ATOM 0 HB2 LYS T 39 95.248 3.566 -0.330 1.00 0.00 H new ATOM 0 HB3 LYS T 39 96.262 4.947 -0.702 1.00 0.00 H new ATOM 0 HG2 LYS T 39 96.628 5.244 1.823 1.00 0.00 H new ATOM 0 HG3 LYS T 39 95.791 3.723 2.062 1.00 0.00 H new ATOM 0 HD2 LYS T 39 97.457 2.507 0.742 1.00 0.00 H new ATOM 0 HD3 LYS T 39 98.205 3.999 0.207 1.00 0.00 H new ATOM 0 HE2 LYS T 39 98.761 4.541 2.623 1.00 0.00 H new ATOM 0 HE3 LYS T 39 98.097 2.990 3.096 1.00 0.00 H new ATOM 0 HZ1 LYS T 39 100.495 2.859 2.788 1.00 0.00 H new ATOM 0 HZ2 LYS T 39 99.708 1.887 1.639 1.00 0.00 H new ATOM 0 HZ3 LYS T 39 100.351 3.390 1.181 1.00 0.00 H new ATOM 601 N GLU T 40 93.225 4.874 -1.690 1.00 0.00 N ATOM 602 CA GLU T 40 92.577 5.134 -2.975 1.00 0.00 C ATOM 603 C GLU T 40 91.124 5.557 -2.779 1.00 0.00 C ATOM 604 O GLU T 40 90.381 5.719 -3.747 1.00 0.00 O ATOM 605 CB GLU T 40 92.631 3.877 -3.848 1.00 0.00 C ATOM 606 CG GLU T 40 94.011 3.227 -3.722 1.00 0.00 C ATOM 607 CD GLU T 40 95.100 4.245 -4.040 1.00 0.00 C ATOM 608 OE1 GLU T 40 95.377 5.072 -3.186 1.00 0.00 O ATOM 609 OE2 GLU T 40 95.639 4.185 -5.132 1.00 0.00 O ATOM 0 H GLU T 40 93.209 3.897 -1.397 1.00 0.00 H new ATOM 0 HA GLU T 40 93.111 5.947 -3.467 1.00 0.00 H new ATOM 0 HB2 GLU T 40 91.857 3.174 -3.540 1.00 0.00 H new ATOM 0 HB3 GLU T 40 92.432 4.135 -4.888 1.00 0.00 H new ATOM 0 HG2 GLU T 40 94.148 2.839 -2.713 1.00 0.00 H new ATOM 0 HG3 GLU T 40 94.086 2.379 -4.402 1.00 0.00 H new ATOM 616 N LEU T 41 90.724 5.734 -1.524 1.00 0.00 N ATOM 617 CA LEU T 41 89.355 6.137 -1.221 1.00 0.00 C ATOM 618 C LEU T 41 89.165 7.626 -1.509 1.00 0.00 C ATOM 619 O LEU T 41 88.480 8.002 -2.460 1.00 0.00 O ATOM 620 CB LEU T 41 89.043 5.835 0.256 1.00 0.00 C ATOM 621 CG LEU T 41 87.530 5.622 0.472 1.00 0.00 C ATOM 622 CD1 LEU T 41 86.745 6.796 -0.122 1.00 0.00 C ATOM 623 CD2 LEU T 41 87.065 4.301 -0.179 1.00 0.00 C ATOM 0 H LEU T 41 91.322 5.606 -0.707 1.00 0.00 H new ATOM 0 HA LEU T 41 88.669 5.574 -1.853 1.00 0.00 H new ATOM 0 HB2 LEU T 41 89.587 4.945 0.571 1.00 0.00 H new ATOM 0 HB3 LEU T 41 89.390 6.659 0.880 1.00 0.00 H new ATOM 0 HG LEU T 41 87.341 5.567 1.544 1.00 0.00 H new ATOM 0 HD11 LEU T 41 85.678 6.637 0.035 1.00 0.00 H new ATOM 0 HD12 LEU T 41 87.050 7.722 0.366 1.00 0.00 H new ATOM 0 HD13 LEU T 41 86.948 6.866 -1.191 1.00 0.00 H new ATOM 0 HD21 LEU T 41 85.995 4.171 -0.014 1.00 0.00 H new ATOM 0 HD22 LEU T 41 87.266 4.332 -1.250 1.00 0.00 H new ATOM 0 HD23 LEU T 41 87.605 3.466 0.267 1.00 0.00 H new ATOM 635 N GLY T 42 89.775 8.468 -0.680 1.00 0.00 N ATOM 636 CA GLY T 42 89.665 9.912 -0.854 1.00 0.00 C ATOM 637 C GLY T 42 89.912 10.309 -2.306 1.00 0.00 C ATOM 638 O GLY T 42 89.643 11.444 -2.702 1.00 0.00 O ATOM 0 H GLY T 42 90.347 8.178 0.113 1.00 0.00 H new ATOM 0 HA2 GLY T 42 88.674 10.244 -0.546 1.00 0.00 H new ATOM 0 HA3 GLY T 42 90.385 10.415 -0.208 1.00 0.00 H new ATOM 642 N LYS T 43 90.427 9.371 -3.093 1.00 0.00 N ATOM 643 CA LYS T 43 90.706 9.637 -4.500 1.00 0.00 C ATOM 644 C LYS T 43 89.410 9.692 -5.303 1.00 0.00 C ATOM 645 O LYS T 43 89.250 10.539 -6.183 1.00 0.00 O ATOM 646 CB LYS T 43 91.613 8.543 -5.066 1.00 0.00 C ATOM 647 CG LYS T 43 92.167 8.988 -6.421 1.00 0.00 C ATOM 648 CD LYS T 43 93.097 7.905 -6.973 1.00 0.00 C ATOM 649 CE LYS T 43 93.754 8.403 -8.261 1.00 0.00 C ATOM 650 NZ LYS T 43 94.409 7.260 -8.959 1.00 0.00 N ATOM 0 H LYS T 43 90.658 8.427 -2.784 1.00 0.00 H new ATOM 0 HA LYS T 43 91.207 10.602 -4.576 1.00 0.00 H new ATOM 0 HB2 LYS T 43 92.432 8.341 -4.375 1.00 0.00 H new ATOM 0 HB3 LYS T 43 91.054 7.614 -5.177 1.00 0.00 H new ATOM 0 HG2 LYS T 43 91.349 9.170 -7.118 1.00 0.00 H new ATOM 0 HG3 LYS T 43 92.709 9.928 -6.313 1.00 0.00 H new ATOM 0 HD2 LYS T 43 93.860 7.656 -6.236 1.00 0.00 H new ATOM 0 HD3 LYS T 43 92.534 6.993 -7.169 1.00 0.00 H new ATOM 0 HE2 LYS T 43 93.007 8.859 -8.910 1.00 0.00 H new ATOM 0 HE3 LYS T 43 94.490 9.173 -8.032 1.00 0.00 H new ATOM 0 HZ1 LYS T 43 95.418 7.470 -9.098 1.00 0.00 H new ATOM 0 HZ2 LYS T 43 94.311 6.399 -8.383 1.00 0.00 H new ATOM 0 HZ3 LYS T 43 93.956 7.112 -9.883 1.00 0.00 H new ATOM 664 N VAL T 44 88.490 8.784 -4.997 1.00 0.00 N ATOM 665 CA VAL T 44 87.211 8.739 -5.699 1.00 0.00 C ATOM 666 C VAL T 44 86.263 9.806 -5.161 1.00 0.00 C ATOM 667 O VAL T 44 85.597 10.501 -5.929 1.00 0.00 O ATOM 668 CB VAL T 44 86.572 7.359 -5.532 1.00 0.00 C ATOM 669 CG1 VAL T 44 85.215 7.335 -6.238 1.00 0.00 C ATOM 670 CG2 VAL T 44 87.485 6.299 -6.152 1.00 0.00 C ATOM 0 H VAL T 44 88.603 8.074 -4.274 1.00 0.00 H new ATOM 0 HA VAL T 44 87.394 8.931 -6.756 1.00 0.00 H new ATOM 0 HB VAL T 44 86.434 7.149 -4.471 1.00 0.00 H new ATOM 0 HG11 VAL T 44 84.760 6.352 -6.119 1.00 0.00 H new ATOM 0 HG12 VAL T 44 84.564 8.092 -5.800 1.00 0.00 H new ATOM 0 HG13 VAL T 44 85.353 7.545 -7.299 1.00 0.00 H new ATOM 0 HG21 VAL T 44 87.032 5.315 -6.034 1.00 0.00 H new ATOM 0 HG22 VAL T 44 87.621 6.511 -7.212 1.00 0.00 H new ATOM 0 HG23 VAL T 44 88.453 6.315 -5.652 1.00 0.00 H new ATOM 680 N MET T 45 86.207 9.931 -3.839 1.00 0.00 N ATOM 681 CA MET T 45 85.336 10.918 -3.212 1.00 0.00 C ATOM 682 C MET T 45 85.751 12.331 -3.608 1.00 0.00 C ATOM 683 O MET T 45 85.021 13.292 -3.373 1.00 0.00 O ATOM 684 CB MET T 45 85.393 10.774 -1.690 1.00 0.00 C ATOM 685 CG MET T 45 84.782 9.432 -1.281 1.00 0.00 C ATOM 686 SD MET T 45 84.609 9.372 0.520 1.00 0.00 S ATOM 687 CE MET T 45 82.918 10.012 0.611 1.00 0.00 C ATOM 0 H MET T 45 86.750 9.366 -3.186 1.00 0.00 H new ATOM 0 HA MET T 45 84.316 10.743 -3.555 1.00 0.00 H new ATOM 0 HB2 MET T 45 86.426 10.835 -1.347 1.00 0.00 H new ATOM 0 HB3 MET T 45 84.851 11.592 -1.216 1.00 0.00 H new ATOM 0 HG2 MET T 45 83.809 9.304 -1.755 1.00 0.00 H new ATOM 0 HG3 MET T 45 85.414 8.613 -1.624 1.00 0.00 H new ATOM 0 HE1 MET T 45 82.603 10.060 1.653 1.00 0.00 H new ATOM 0 HE2 MET T 45 82.883 11.011 0.175 1.00 0.00 H new ATOM 0 HE3 MET T 45 82.249 9.352 0.059 1.00 0.00 H new ATOM 697 N ARG T 46 86.930 12.449 -4.211 1.00 0.00 N ATOM 698 CA ARG T 46 87.433 13.750 -4.635 1.00 0.00 C ATOM 699 C ARG T 46 86.619 14.280 -5.812 1.00 0.00 C ATOM 700 O ARG T 46 86.375 15.482 -5.918 1.00 0.00 O ATOM 701 CB ARG T 46 88.903 13.636 -5.039 1.00 0.00 C ATOM 702 CG ARG T 46 89.433 15.015 -5.438 1.00 0.00 C ATOM 703 CD ARG T 46 90.961 14.982 -5.487 1.00 0.00 C ATOM 704 NE ARG T 46 91.479 16.274 -5.925 1.00 0.00 N ATOM 705 CZ ARG T 46 92.774 16.563 -5.830 1.00 0.00 C ATOM 706 NH1 ARG T 46 93.605 15.685 -5.340 1.00 0.00 N ATOM 707 NH2 ARG T 46 93.212 17.726 -6.228 1.00 0.00 N ATOM 0 H ARG T 46 87.550 11.666 -4.416 1.00 0.00 H new ATOM 0 HA ARG T 46 87.340 14.445 -3.800 1.00 0.00 H new ATOM 0 HB2 ARG T 46 89.488 13.236 -4.211 1.00 0.00 H new ATOM 0 HB3 ARG T 46 89.009 12.940 -5.871 1.00 0.00 H new ATOM 0 HG2 ARG T 46 89.034 15.302 -6.411 1.00 0.00 H new ATOM 0 HG3 ARG T 46 89.098 15.766 -4.722 1.00 0.00 H new ATOM 0 HD2 ARG T 46 91.359 14.738 -4.502 1.00 0.00 H new ATOM 0 HD3 ARG T 46 91.293 14.199 -6.168 1.00 0.00 H new ATOM 0 HE ARG T 46 90.837 16.967 -6.310 1.00 0.00 H new ATOM 0 HH11 ARG T 46 93.262 14.776 -5.029 1.00 0.00 H new ATOM 0 HH12 ARG T 46 94.598 15.907 -5.268 1.00 0.00 H new ATOM 0 HH21 ARG T 46 92.562 18.412 -6.611 1.00 0.00 H new ATOM 0 HH22 ARG T 46 94.205 17.949 -6.156 1.00 0.00 H new ATOM 721 N MET T 47 86.205 13.376 -6.693 1.00 0.00 N ATOM 722 CA MET T 47 85.420 13.764 -7.859 1.00 0.00 C ATOM 723 C MET T 47 84.142 14.481 -7.432 1.00 0.00 C ATOM 724 O MET T 47 83.682 15.402 -8.106 1.00 0.00 O ATOM 725 CB MET T 47 85.061 12.526 -8.683 1.00 0.00 C ATOM 726 CG MET T 47 86.330 11.944 -9.308 1.00 0.00 C ATOM 727 SD MET T 47 85.892 10.540 -10.365 1.00 0.00 S ATOM 728 CE MET T 47 87.471 9.665 -10.241 1.00 0.00 C ATOM 0 H MET T 47 86.398 12.377 -6.623 1.00 0.00 H new ATOM 0 HA MET T 47 86.019 14.443 -8.466 1.00 0.00 H new ATOM 0 HB2 MET T 47 84.580 11.781 -8.049 1.00 0.00 H new ATOM 0 HB3 MET T 47 84.347 12.790 -9.463 1.00 0.00 H new ATOM 0 HG2 MET T 47 86.843 12.707 -9.893 1.00 0.00 H new ATOM 0 HG3 MET T 47 87.019 11.624 -8.527 1.00 0.00 H new ATOM 0 HE1 MET T 47 87.426 8.748 -10.829 1.00 0.00 H new ATOM 0 HE2 MET T 47 88.270 10.301 -10.621 1.00 0.00 H new ATOM 0 HE3 MET T 47 87.669 9.418 -9.198 1.00 0.00 H new ATOM 738 N LEU T 48 83.576 14.052 -6.308 1.00 0.00 N ATOM 739 CA LEU T 48 82.351 14.661 -5.802 1.00 0.00 C ATOM 740 C LEU T 48 82.631 16.073 -5.292 1.00 0.00 C ATOM 741 O LEU T 48 82.364 17.057 -5.983 1.00 0.00 O ATOM 742 CB LEU T 48 81.773 13.807 -4.668 1.00 0.00 C ATOM 743 CG LEU T 48 81.072 12.573 -5.249 1.00 0.00 C ATOM 744 CD1 LEU T 48 82.027 11.829 -6.189 1.00 0.00 C ATOM 745 CD2 LEU T 48 80.651 11.645 -4.107 1.00 0.00 C ATOM 0 H LEU T 48 83.942 13.292 -5.735 1.00 0.00 H new ATOM 0 HA LEU T 48 81.628 14.717 -6.616 1.00 0.00 H new ATOM 0 HB2 LEU T 48 82.570 13.498 -3.991 1.00 0.00 H new ATOM 0 HB3 LEU T 48 81.067 14.395 -4.082 1.00 0.00 H new ATOM 0 HG LEU T 48 80.191 12.887 -5.809 1.00 0.00 H new ATOM 0 HD11 LEU T 48 81.525 10.953 -6.599 1.00 0.00 H new ATOM 0 HD12 LEU T 48 82.326 12.490 -7.002 1.00 0.00 H new ATOM 0 HD13 LEU T 48 82.911 11.514 -5.635 1.00 0.00 H new ATOM 0 HD21 LEU T 48 80.152 10.767 -4.517 1.00 0.00 H new ATOM 0 HD22 LEU T 48 81.533 11.333 -3.547 1.00 0.00 H new ATOM 0 HD23 LEU T 48 79.967 12.173 -3.442 1.00 0.00 H new ATOM 757 N GLY T 49 83.171 16.164 -4.081 1.00 0.00 N ATOM 758 CA GLY T 49 83.483 17.461 -3.490 1.00 0.00 C ATOM 759 C GLY T 49 83.864 17.314 -2.022 1.00 0.00 C ATOM 760 O GLY T 49 83.459 18.117 -1.182 1.00 0.00 O ATOM 0 H GLY T 49 83.400 15.362 -3.493 1.00 0.00 H new ATOM 0 HA2 GLY T 49 84.303 17.926 -4.037 1.00 0.00 H new ATOM 0 HA3 GLY T 49 82.622 18.123 -3.582 1.00 0.00 H new ATOM 764 N GLN T 50 84.648 16.279 -1.719 1.00 0.00 N ATOM 765 CA GLN T 50 85.087 16.024 -0.344 1.00 0.00 C ATOM 766 C GLN T 50 86.536 15.550 -0.330 1.00 0.00 C ATOM 767 O GLN T 50 87.079 15.151 -1.361 1.00 0.00 O ATOM 768 CB GLN T 50 84.199 14.956 0.300 1.00 0.00 C ATOM 769 CG GLN T 50 82.727 15.341 0.136 1.00 0.00 C ATOM 770 CD GLN T 50 82.467 16.697 0.786 1.00 0.00 C ATOM 771 OE1 GLN T 50 81.629 17.462 0.312 1.00 0.00 O ATOM 772 NE2 GLN T 50 83.140 17.039 1.851 1.00 0.00 N ATOM 0 H GLN T 50 84.992 15.605 -2.403 1.00 0.00 H new ATOM 0 HA GLN T 50 85.008 16.952 0.222 1.00 0.00 H new ATOM 0 HB2 GLN T 50 84.385 13.987 -0.163 1.00 0.00 H new ATOM 0 HB3 GLN T 50 84.443 14.856 1.358 1.00 0.00 H new ATOM 0 HG2 GLN T 50 82.468 15.380 -0.922 1.00 0.00 H new ATOM 0 HG3 GLN T 50 82.091 14.582 0.592 1.00 0.00 H new ATOM 0 HE21 GLN T 50 83.834 16.402 2.242 1.00 0.00 H new ATOM 0 HE22 GLN T 50 82.971 17.943 2.292 1.00 0.00 H new ATOM 781 N ASN T 51 87.160 15.596 0.843 1.00 0.00 N ATOM 782 CA ASN T 51 88.547 15.168 0.977 1.00 0.00 C ATOM 783 C ASN T 51 88.962 15.134 2.445 1.00 0.00 C ATOM 784 O ASN T 51 89.889 15.831 2.855 1.00 0.00 O ATOM 785 CB ASN T 51 89.464 16.123 0.209 1.00 0.00 C ATOM 786 CG ASN T 51 90.857 15.515 0.078 1.00 0.00 C ATOM 787 OD1 ASN T 51 91.342 15.270 -1.108 1.00 0.00 O flip ATOM 788 ND2 ASN T 51 91.519 15.257 1.083 1.00 0.00 N flip ATOM 0 H ASN T 51 86.730 15.923 1.708 1.00 0.00 H new ATOM 0 HA ASN T 51 88.637 14.163 0.564 1.00 0.00 H new ATOM 0 HB2 ASN T 51 89.050 16.321 -0.780 1.00 0.00 H new ATOM 0 HB3 ASN T 51 89.523 17.080 0.728 1.00 0.00 H new ATOM 0 HD21 ASN T 51 91.137 15.450 2.009 1.00 0.00 H new ATOM 0 HD22 ASN T 51 92.450 14.850 0.990 1.00 0.00 H new ATOM 795 N PRO T 52 88.295 14.336 3.239 1.00 0.00 N ATOM 796 CA PRO T 52 88.597 14.205 4.694 1.00 0.00 C ATOM 797 C PRO T 52 89.843 13.356 4.945 1.00 0.00 C ATOM 798 O PRO T 52 90.485 12.884 4.006 1.00 0.00 O ATOM 799 CB PRO T 52 87.339 13.529 5.249 1.00 0.00 C ATOM 800 CG PRO T 52 86.826 12.699 4.115 1.00 0.00 C ATOM 801 CD PRO T 52 87.173 13.468 2.834 1.00 0.00 C ATOM 0 HA PRO T 52 88.816 15.162 5.167 1.00 0.00 H new ATOM 0 HB2 PRO T 52 87.570 12.913 6.118 1.00 0.00 H new ATOM 0 HB3 PRO T 52 86.601 14.265 5.567 1.00 0.00 H new ATOM 0 HG2 PRO T 52 87.288 11.712 4.114 1.00 0.00 H new ATOM 0 HG3 PRO T 52 85.750 12.547 4.199 1.00 0.00 H new ATOM 0 HD2 PRO T 52 87.460 12.793 2.027 1.00 0.00 H new ATOM 0 HD3 PRO T 52 86.325 14.051 2.475 1.00 0.00 H new ATOM 809 N THR T 53 90.175 13.165 6.218 1.00 0.00 N ATOM 810 CA THR T 53 91.343 12.369 6.586 1.00 0.00 C ATOM 811 C THR T 53 91.019 10.878 6.478 1.00 0.00 C ATOM 812 O THR T 53 89.861 10.481 6.613 1.00 0.00 O ATOM 813 CB THR T 53 91.774 12.703 8.026 1.00 0.00 C ATOM 814 OG1 THR T 53 92.332 11.547 8.635 1.00 0.00 O ATOM 815 CG2 THR T 53 90.561 13.164 8.837 1.00 0.00 C ATOM 0 H THR T 53 89.656 13.547 7.008 1.00 0.00 H new ATOM 0 HA THR T 53 92.159 12.606 5.903 1.00 0.00 H new ATOM 0 HB THR T 53 92.517 13.500 8.000 1.00 0.00 H new ATOM 0 HG1 THR T 53 92.608 11.760 9.551 1.00 0.00 H new ATOM 0 HG21 THR T 53 90.872 13.399 9.855 1.00 0.00 H new ATOM 0 HG22 THR T 53 90.131 14.052 8.375 1.00 0.00 H new ATOM 0 HG23 THR T 53 89.815 12.369 8.860 1.00 0.00 H new ATOM 823 N PRO T 54 92.006 10.045 6.241 1.00 0.00 N ATOM 824 CA PRO T 54 91.793 8.570 6.120 1.00 0.00 C ATOM 825 C PRO T 54 91.361 7.949 7.450 1.00 0.00 C ATOM 826 O PRO T 54 91.070 6.756 7.523 1.00 0.00 O ATOM 827 CB PRO T 54 93.165 8.038 5.667 1.00 0.00 C ATOM 828 CG PRO T 54 94.148 9.060 6.140 1.00 0.00 C ATOM 829 CD PRO T 54 93.425 10.404 6.062 1.00 0.00 C ATOM 0 HA PRO T 54 90.994 8.320 5.422 1.00 0.00 H new ATOM 0 HB2 PRO T 54 93.372 7.060 6.101 1.00 0.00 H new ATOM 0 HB3 PRO T 54 93.206 7.922 4.584 1.00 0.00 H new ATOM 0 HG2 PRO T 54 94.471 8.849 7.159 1.00 0.00 H new ATOM 0 HG3 PRO T 54 95.042 9.060 5.516 1.00 0.00 H new ATOM 0 HD2 PRO T 54 93.766 11.089 6.838 1.00 0.00 H new ATOM 0 HD3 PRO T 54 93.596 10.897 5.105 1.00 0.00 H new ATOM 837 N GLU T 55 91.318 8.771 8.494 1.00 0.00 N ATOM 838 CA GLU T 55 90.916 8.297 9.814 1.00 0.00 C ATOM 839 C GLU T 55 89.396 8.232 9.919 1.00 0.00 C ATOM 840 O GLU T 55 88.846 7.353 10.580 1.00 0.00 O ATOM 841 CB GLU T 55 91.466 9.232 10.893 1.00 0.00 C ATOM 842 CG GLU T 55 91.323 8.571 12.265 1.00 0.00 C ATOM 843 CD GLU T 55 91.545 9.601 13.367 1.00 0.00 C ATOM 844 OE1 GLU T 55 92.689 9.802 13.742 1.00 0.00 O ATOM 845 OE2 GLU T 55 90.569 10.176 13.819 1.00 0.00 O ATOM 0 H GLU T 55 91.555 9.762 8.453 1.00 0.00 H new ATOM 0 HA GLU T 55 91.321 7.296 9.960 1.00 0.00 H new ATOM 0 HB2 GLU T 55 92.514 9.457 10.694 1.00 0.00 H new ATOM 0 HB3 GLU T 55 90.928 10.180 10.877 1.00 0.00 H new ATOM 0 HG2 GLU T 55 90.331 8.129 12.363 1.00 0.00 H new ATOM 0 HG3 GLU T 55 92.044 7.760 12.364 1.00 0.00 H new ATOM 852 N GLU T 56 88.724 9.173 9.260 1.00 0.00 N ATOM 853 CA GLU T 56 87.265 9.220 9.284 1.00 0.00 C ATOM 854 C GLU T 56 86.677 8.241 8.272 1.00 0.00 C ATOM 855 O GLU T 56 85.676 7.578 8.544 1.00 0.00 O ATOM 856 CB GLU T 56 86.782 10.635 8.962 1.00 0.00 C ATOM 857 CG GLU T 56 87.114 11.566 10.128 1.00 0.00 C ATOM 858 CD GLU T 56 86.727 12.999 9.778 1.00 0.00 C ATOM 859 OE1 GLU T 56 86.351 13.228 8.639 1.00 0.00 O ATOM 860 OE2 GLU T 56 86.810 13.847 10.651 1.00 0.00 O ATOM 0 H GLU T 56 89.163 9.909 8.706 1.00 0.00 H new ATOM 0 HA GLU T 56 86.931 8.938 10.282 1.00 0.00 H new ATOM 0 HB2 GLU T 56 87.258 10.994 8.049 1.00 0.00 H new ATOM 0 HB3 GLU T 56 85.707 10.631 8.781 1.00 0.00 H new ATOM 0 HG2 GLU T 56 86.581 11.245 11.023 1.00 0.00 H new ATOM 0 HG3 GLU T 56 88.179 11.513 10.354 1.00 0.00 H new ATOM 867 N LEU T 57 87.304 8.154 7.104 1.00 0.00 N ATOM 868 CA LEU T 57 86.829 7.251 6.062 1.00 0.00 C ATOM 869 C LEU T 57 86.879 5.806 6.545 1.00 0.00 C ATOM 870 O LEU T 57 85.966 5.024 6.279 1.00 0.00 O ATOM 871 CB LEU T 57 87.688 7.401 4.803 1.00 0.00 C ATOM 872 CG LEU T 57 87.606 8.841 4.278 1.00 0.00 C ATOM 873 CD1 LEU T 57 88.666 9.040 3.190 1.00 0.00 C ATOM 874 CD2 LEU T 57 86.210 9.121 3.691 1.00 0.00 C ATOM 0 H LEU T 57 88.134 8.692 6.856 1.00 0.00 H new ATOM 0 HA LEU T 57 85.797 7.510 5.827 1.00 0.00 H new ATOM 0 HB2 LEU T 57 88.724 7.146 5.027 1.00 0.00 H new ATOM 0 HB3 LEU T 57 87.347 6.706 4.036 1.00 0.00 H new ATOM 0 HG LEU T 57 87.783 9.531 5.103 1.00 0.00 H new ATOM 0 HD11 LEU T 57 88.613 10.061 2.813 1.00 0.00 H new ATOM 0 HD12 LEU T 57 89.656 8.859 3.609 1.00 0.00 H new ATOM 0 HD13 LEU T 57 88.484 8.342 2.373 1.00 0.00 H new ATOM 0 HD21 LEU T 57 86.169 10.146 3.323 1.00 0.00 H new ATOM 0 HD22 LEU T 57 86.016 8.432 2.868 1.00 0.00 H new ATOM 0 HD23 LEU T 57 85.455 8.983 4.465 1.00 0.00 H new ATOM 886 N GLN T 58 87.947 5.455 7.254 1.00 0.00 N ATOM 887 CA GLN T 58 88.099 4.097 7.766 1.00 0.00 C ATOM 888 C GLN T 58 86.806 3.637 8.435 1.00 0.00 C ATOM 889 O GLN T 58 86.484 2.449 8.434 1.00 0.00 O ATOM 890 CB GLN T 58 89.260 4.045 8.769 1.00 0.00 C ATOM 891 CG GLN T 58 89.301 2.680 9.472 1.00 0.00 C ATOM 892 CD GLN T 58 89.239 1.548 8.450 1.00 0.00 C ATOM 893 OE1 GLN T 58 88.228 0.854 8.350 1.00 0.00 O ATOM 894 NE2 GLN T 58 90.269 1.316 7.682 1.00 0.00 N ATOM 0 H GLN T 58 88.714 6.086 7.486 1.00 0.00 H new ATOM 0 HA GLN T 58 88.318 3.428 6.934 1.00 0.00 H new ATOM 0 HB2 GLN T 58 90.203 4.223 8.253 1.00 0.00 H new ATOM 0 HB3 GLN T 58 89.146 4.838 9.508 1.00 0.00 H new ATOM 0 HG2 GLN T 58 90.214 2.596 10.061 1.00 0.00 H new ATOM 0 HG3 GLN T 58 88.465 2.597 10.166 1.00 0.00 H new ATOM 0 HE21 GLN T 58 91.107 1.892 7.765 1.00 0.00 H new ATOM 0 HE22 GLN T 58 90.236 0.559 6.999 1.00 0.00 H new ATOM 903 N GLU T 59 86.070 4.587 9.003 1.00 0.00 N ATOM 904 CA GLU T 59 84.813 4.266 9.669 1.00 0.00 C ATOM 905 C GLU T 59 83.865 3.556 8.708 1.00 0.00 C ATOM 906 O GLU T 59 83.073 2.707 9.115 1.00 0.00 O ATOM 907 CB GLU T 59 84.154 5.546 10.188 1.00 0.00 C ATOM 908 CG GLU T 59 85.127 6.286 11.106 1.00 0.00 C ATOM 909 CD GLU T 59 84.528 7.622 11.532 1.00 0.00 C ATOM 910 OE1 GLU T 59 83.624 8.086 10.856 1.00 0.00 O ATOM 911 OE2 GLU T 59 84.979 8.162 12.529 1.00 0.00 O ATOM 0 H GLU T 59 86.319 5.576 9.016 1.00 0.00 H new ATOM 0 HA GLU T 59 85.026 3.603 10.508 1.00 0.00 H new ATOM 0 HB2 GLU T 59 83.869 6.185 9.352 1.00 0.00 H new ATOM 0 HB3 GLU T 59 83.240 5.303 10.730 1.00 0.00 H new ATOM 0 HG2 GLU T 59 85.344 5.679 11.985 1.00 0.00 H new ATOM 0 HG3 GLU T 59 86.073 6.450 10.590 1.00 0.00 H new ATOM 918 N MET T 60 83.954 3.912 7.430 1.00 0.00 N ATOM 919 CA MET T 60 83.102 3.304 6.413 1.00 0.00 C ATOM 920 C MET T 60 83.627 1.923 6.032 1.00 0.00 C ATOM 921 O MET T 60 82.854 0.986 5.836 1.00 0.00 O ATOM 922 CB MET T 60 83.056 4.198 5.169 1.00 0.00 C ATOM 923 CG MET T 60 82.182 5.424 5.446 1.00 0.00 C ATOM 924 SD MET T 60 80.436 4.957 5.342 1.00 0.00 S ATOM 925 CE MET T 60 80.236 5.224 3.562 1.00 0.00 C ATOM 0 H MET T 60 84.603 4.614 7.075 1.00 0.00 H new ATOM 0 HA MET T 60 82.097 3.198 6.821 1.00 0.00 H new ATOM 0 HB2 MET T 60 84.064 4.512 4.898 1.00 0.00 H new ATOM 0 HB3 MET T 60 82.657 3.639 4.322 1.00 0.00 H new ATOM 0 HG2 MET T 60 82.404 5.826 6.435 1.00 0.00 H new ATOM 0 HG3 MET T 60 82.402 6.211 4.725 1.00 0.00 H new ATOM 0 HE1 MET T 60 79.469 5.979 3.391 1.00 0.00 H new ATOM 0 HE2 MET T 60 81.180 5.564 3.137 1.00 0.00 H new ATOM 0 HE3 MET T 60 79.938 4.290 3.085 1.00 0.00 H new ATOM 935 N ILE T 61 84.947 1.806 5.929 1.00 0.00 N ATOM 936 CA ILE T 61 85.567 0.537 5.571 1.00 0.00 C ATOM 937 C ILE T 61 85.588 -0.401 6.777 1.00 0.00 C ATOM 938 O ILE T 61 85.918 -1.580 6.654 1.00 0.00 O ATOM 939 CB ILE T 61 86.996 0.780 5.066 1.00 0.00 C ATOM 940 CG1 ILE T 61 86.943 1.484 3.702 1.00 0.00 C ATOM 941 CG2 ILE T 61 87.735 -0.556 4.916 1.00 0.00 C ATOM 942 CD1 ILE T 61 86.323 2.880 3.842 1.00 0.00 C ATOM 0 H ILE T 61 85.604 2.570 6.087 1.00 0.00 H new ATOM 0 HA ILE T 61 84.983 0.070 4.778 1.00 0.00 H new ATOM 0 HB ILE T 61 87.526 1.405 5.785 1.00 0.00 H new ATOM 0 HG12 ILE T 61 87.948 1.566 3.289 1.00 0.00 H new ATOM 0 HG13 ILE T 61 86.358 0.888 3.001 1.00 0.00 H new ATOM 0 HG21 ILE T 61 88.748 -0.373 4.557 1.00 0.00 H new ATOM 0 HG22 ILE T 61 87.777 -1.059 5.882 1.00 0.00 H new ATOM 0 HG23 ILE T 61 87.205 -1.187 4.202 1.00 0.00 H new ATOM 0 HD11 ILE T 61 86.293 3.364 2.866 1.00 0.00 H new ATOM 0 HD12 ILE T 61 85.310 2.790 4.234 1.00 0.00 H new ATOM 0 HD13 ILE T 61 86.925 3.478 4.526 1.00 0.00 H new ATOM 954 N ASP T 62 85.231 0.134 7.941 1.00 0.00 N ATOM 955 CA ASP T 62 85.213 -0.660 9.166 1.00 0.00 C ATOM 956 C ASP T 62 83.926 -1.475 9.264 1.00 0.00 C ATOM 957 O ASP T 62 83.961 -2.704 9.330 1.00 0.00 O ATOM 958 CB ASP T 62 85.328 0.260 10.382 1.00 0.00 C ATOM 959 CG ASP T 62 85.295 -0.564 11.664 1.00 0.00 C ATOM 960 OD1 ASP T 62 86.091 -1.481 11.777 1.00 0.00 O ATOM 961 OD2 ASP T 62 84.473 -0.265 12.515 1.00 0.00 O ATOM 0 H ASP T 62 84.952 1.108 8.062 1.00 0.00 H new ATOM 0 HA ASP T 62 86.060 -1.346 9.143 1.00 0.00 H new ATOM 0 HB2 ASP T 62 86.255 0.830 10.330 1.00 0.00 H new ATOM 0 HB3 ASP T 62 84.510 0.981 10.382 1.00 0.00 H new ATOM 966 N GLU T 63 82.792 -0.783 9.280 1.00 0.00 N ATOM 967 CA GLU T 63 81.499 -1.452 9.379 1.00 0.00 C ATOM 968 C GLU T 63 81.430 -2.645 8.424 1.00 0.00 C ATOM 969 O GLU T 63 80.933 -3.710 8.788 1.00 0.00 O ATOM 970 CB GLU T 63 80.370 -0.459 9.066 1.00 0.00 C ATOM 971 CG GLU T 63 80.789 0.448 7.907 1.00 0.00 C ATOM 972 CD GLU T 63 79.570 1.164 7.337 1.00 0.00 C ATOM 973 OE1 GLU T 63 78.551 1.181 8.008 1.00 0.00 O ATOM 974 OE2 GLU T 63 79.673 1.685 6.238 1.00 0.00 O ATOM 0 H GLU T 63 82.741 0.234 9.226 1.00 0.00 H new ATOM 0 HA GLU T 63 81.379 -1.822 10.397 1.00 0.00 H new ATOM 0 HB2 GLU T 63 79.459 -0.999 8.807 1.00 0.00 H new ATOM 0 HB3 GLU T 63 80.145 0.141 9.948 1.00 0.00 H new ATOM 0 HG2 GLU T 63 81.521 1.178 8.252 1.00 0.00 H new ATOM 0 HG3 GLU T 63 81.271 -0.143 7.128 1.00 0.00 H new ATOM 981 N VAL T 64 81.930 -2.462 7.205 1.00 0.00 N ATOM 982 CA VAL T 64 81.911 -3.539 6.219 1.00 0.00 C ATOM 983 C VAL T 64 82.959 -4.596 6.554 1.00 0.00 C ATOM 984 O VAL T 64 82.687 -5.795 6.490 1.00 0.00 O ATOM 985 CB VAL T 64 82.175 -2.986 4.815 1.00 0.00 C ATOM 986 CG1 VAL T 64 81.028 -2.062 4.404 1.00 0.00 C ATOM 987 CG2 VAL T 64 83.490 -2.202 4.805 1.00 0.00 C ATOM 0 H VAL T 64 82.348 -1.591 6.879 1.00 0.00 H new ATOM 0 HA VAL T 64 80.923 -3.999 6.244 1.00 0.00 H new ATOM 0 HB VAL T 64 82.245 -3.815 4.111 1.00 0.00 H new ATOM 0 HG11 VAL T 64 81.217 -1.669 3.405 1.00 0.00 H new ATOM 0 HG12 VAL T 64 80.093 -2.622 4.403 1.00 0.00 H new ATOM 0 HG13 VAL T 64 80.955 -1.236 5.111 1.00 0.00 H new ATOM 0 HG21 VAL T 64 83.673 -1.811 3.804 1.00 0.00 H new ATOM 0 HG22 VAL T 64 83.426 -1.375 5.512 1.00 0.00 H new ATOM 0 HG23 VAL T 64 84.309 -2.862 5.092 1.00 0.00 H new ATOM 997 N ASP T 65 84.158 -4.146 6.911 1.00 0.00 N ATOM 998 CA ASP T 65 85.237 -5.067 7.252 1.00 0.00 C ATOM 999 C ASP T 65 84.898 -5.841 8.523 1.00 0.00 C ATOM 1000 O ASP T 65 85.332 -5.476 9.616 1.00 0.00 O ATOM 1001 CB ASP T 65 86.543 -4.293 7.453 1.00 0.00 C ATOM 1002 CG ASP T 65 87.105 -3.855 6.104 1.00 0.00 C ATOM 1003 OD1 ASP T 65 86.394 -3.978 5.120 1.00 0.00 O ATOM 1004 OD2 ASP T 65 88.238 -3.404 6.074 1.00 0.00 O ATOM 0 H ASP T 65 84.406 -3.158 6.971 1.00 0.00 H new ATOM 0 HA ASP T 65 85.359 -5.774 6.432 1.00 0.00 H new ATOM 0 HB2 ASP T 65 86.365 -3.421 8.082 1.00 0.00 H new ATOM 0 HB3 ASP T 65 87.269 -4.918 7.973 1.00 0.00 H new ATOM 1009 N GLU T 66 84.126 -6.910 8.370 1.00 0.00 N ATOM 1010 CA GLU T 66 83.739 -7.730 9.513 1.00 0.00 C ATOM 1011 C GLU T 66 84.966 -8.394 10.131 1.00 0.00 C ATOM 1012 O GLU T 66 85.043 -8.568 11.347 1.00 0.00 O ATOM 1013 CB GLU T 66 82.742 -8.804 9.072 1.00 0.00 C ATOM 1014 CG GLU T 66 81.390 -8.155 8.773 1.00 0.00 C ATOM 1015 CD GLU T 66 80.725 -7.710 10.070 1.00 0.00 C ATOM 1016 OE1 GLU T 66 80.902 -8.389 11.068 1.00 0.00 O ATOM 1017 OE2 GLU T 66 80.049 -6.694 10.047 1.00 0.00 O ATOM 0 H GLU T 66 83.758 -7.228 7.474 1.00 0.00 H new ATOM 0 HA GLU T 66 83.272 -7.087 10.259 1.00 0.00 H new ATOM 0 HB2 GLU T 66 83.114 -9.318 8.186 1.00 0.00 H new ATOM 0 HB3 GLU T 66 82.631 -9.555 9.854 1.00 0.00 H new ATOM 0 HG2 GLU T 66 81.527 -7.299 8.113 1.00 0.00 H new ATOM 0 HG3 GLU T 66 80.746 -8.862 8.249 1.00 0.00 H new ATOM 1024 N ASP T 67 85.924 -8.760 9.284 1.00 0.00 N ATOM 1025 CA ASP T 67 87.147 -9.403 9.755 1.00 0.00 C ATOM 1026 C ASP T 67 88.131 -8.362 10.279 1.00 0.00 C ATOM 1027 O ASP T 67 88.963 -8.657 11.136 1.00 0.00 O ATOM 1028 CB ASP T 67 87.794 -10.191 8.615 1.00 0.00 C ATOM 1029 CG ASP T 67 87.861 -9.330 7.358 1.00 0.00 C ATOM 1030 OD1 ASP T 67 87.515 -8.164 7.444 1.00 0.00 O ATOM 1031 OD2 ASP T 67 88.258 -9.851 6.327 1.00 0.00 O ATOM 0 H ASP T 67 85.878 -8.624 8.274 1.00 0.00 H new ATOM 0 HA ASP T 67 86.889 -10.084 10.566 1.00 0.00 H new ATOM 0 HB2 ASP T 67 88.797 -10.507 8.903 1.00 0.00 H new ATOM 0 HB3 ASP T 67 87.220 -11.096 8.416 1.00 0.00 H new ATOM 1036 N GLY T 68 88.030 -7.144 9.756 1.00 0.00 N ATOM 1037 CA GLY T 68 88.918 -6.063 10.175 1.00 0.00 C ATOM 1038 C GLY T 68 90.245 -6.126 9.428 1.00 0.00 C ATOM 1039 O GLY T 68 91.292 -5.782 9.974 1.00 0.00 O ATOM 0 H GLY T 68 87.347 -6.881 9.046 1.00 0.00 H new ATOM 0 HA2 GLY T 68 88.438 -5.102 9.991 1.00 0.00 H new ATOM 0 HA3 GLY T 68 89.097 -6.130 11.248 1.00 0.00 H new ATOM 1043 N SER T 69 90.192 -6.568 8.175 1.00 0.00 N ATOM 1044 CA SER T 69 91.397 -6.673 7.358 1.00 0.00 C ATOM 1045 C SER T 69 91.778 -5.311 6.786 1.00 0.00 C ATOM 1046 O SER T 69 92.926 -5.089 6.398 1.00 0.00 O ATOM 1047 CB SER T 69 91.167 -7.663 6.216 1.00 0.00 C ATOM 1048 OG SER T 69 90.130 -7.175 5.375 1.00 0.00 O ATOM 0 H SER T 69 89.334 -6.857 7.706 1.00 0.00 H new ATOM 0 HA SER T 69 92.212 -7.029 7.989 1.00 0.00 H new ATOM 0 HB2 SER T 69 92.085 -7.795 5.643 1.00 0.00 H new ATOM 0 HB3 SER T 69 90.898 -8.641 6.615 1.00 0.00 H new ATOM 0 HG SER T 69 90.511 -6.888 4.519 1.00 0.00 H new ATOM 1054 N GLY T 70 90.809 -4.403 6.735 1.00 0.00 N ATOM 1055 CA GLY T 70 91.055 -3.064 6.206 1.00 0.00 C ATOM 1056 C GLY T 70 91.002 -3.061 4.682 1.00 0.00 C ATOM 1057 O GLY T 70 91.803 -2.397 4.025 1.00 0.00 O ATOM 0 H GLY T 70 89.853 -4.567 7.051 1.00 0.00 H new ATOM 0 HA2 GLY T 70 90.312 -2.371 6.601 1.00 0.00 H new ATOM 0 HA3 GLY T 70 92.030 -2.710 6.540 1.00 0.00 H new ATOM 1061 N THR T 71 90.050 -3.808 4.126 1.00 0.00 N ATOM 1062 CA THR T 71 89.895 -3.888 2.676 1.00 0.00 C ATOM 1063 C THR T 71 88.450 -4.212 2.313 1.00 0.00 C ATOM 1064 O THR T 71 87.864 -5.157 2.841 1.00 0.00 O ATOM 1065 CB THR T 71 90.820 -4.970 2.108 1.00 0.00 C ATOM 1066 OG1 THR T 71 90.565 -6.200 2.771 1.00 0.00 O ATOM 1067 CG2 THR T 71 92.281 -4.568 2.320 1.00 0.00 C ATOM 0 H THR T 71 89.378 -4.364 4.655 1.00 0.00 H new ATOM 0 HA THR T 71 90.161 -2.922 2.246 1.00 0.00 H new ATOM 0 HB THR T 71 90.632 -5.082 1.040 1.00 0.00 H new ATOM 0 HG1 THR T 71 89.618 -6.247 3.020 1.00 0.00 H new ATOM 0 HG21 THR T 71 92.934 -5.341 1.914 1.00 0.00 H new ATOM 0 HG22 THR T 71 92.476 -3.624 1.811 1.00 0.00 H new ATOM 0 HG23 THR T 71 92.475 -4.452 3.386 1.00 0.00 H new ATOM 1075 N VAL T 72 87.880 -3.421 1.408 1.00 0.00 N ATOM 1076 CA VAL T 72 86.499 -3.630 0.980 1.00 0.00 C ATOM 1077 C VAL T 72 86.431 -4.689 -0.112 1.00 0.00 C ATOM 1078 O VAL T 72 86.427 -4.372 -1.301 1.00 0.00 O ATOM 1079 CB VAL T 72 85.914 -2.318 0.455 1.00 0.00 C ATOM 1080 CG1 VAL T 72 84.464 -2.540 0.016 1.00 0.00 C ATOM 1081 CG2 VAL T 72 85.957 -1.266 1.564 1.00 0.00 C ATOM 0 H VAL T 72 88.349 -2.634 0.959 1.00 0.00 H new ATOM 0 HA VAL T 72 85.920 -3.971 1.838 1.00 0.00 H new ATOM 0 HB VAL T 72 86.499 -1.974 -0.398 1.00 0.00 H new ATOM 0 HG11 VAL T 72 84.050 -1.604 -0.358 1.00 0.00 H new ATOM 0 HG12 VAL T 72 84.434 -3.291 -0.774 1.00 0.00 H new ATOM 0 HG13 VAL T 72 83.875 -2.884 0.866 1.00 0.00 H new ATOM 0 HG21 VAL T 72 85.541 -0.329 1.193 1.00 0.00 H new ATOM 0 HG22 VAL T 72 85.371 -1.611 2.416 1.00 0.00 H new ATOM 0 HG23 VAL T 72 86.990 -1.106 1.874 1.00 0.00 H new ATOM 1091 N ASP T 73 86.378 -5.951 0.299 1.00 0.00 N ATOM 1092 CA ASP T 73 86.308 -7.049 -0.654 1.00 0.00 C ATOM 1093 C ASP T 73 84.941 -7.071 -1.338 1.00 0.00 C ATOM 1094 O ASP T 73 83.950 -6.593 -0.784 1.00 0.00 O ATOM 1095 CB ASP T 73 86.564 -8.380 0.066 1.00 0.00 C ATOM 1096 CG ASP T 73 85.929 -8.350 1.453 1.00 0.00 C ATOM 1097 OD1 ASP T 73 86.523 -7.760 2.341 1.00 0.00 O ATOM 1098 OD2 ASP T 73 84.860 -8.917 1.605 1.00 0.00 O ATOM 0 H ASP T 73 86.382 -6.236 1.278 1.00 0.00 H new ATOM 0 HA ASP T 73 87.074 -6.906 -1.416 1.00 0.00 H new ATOM 0 HB2 ASP T 73 86.150 -9.204 -0.515 1.00 0.00 H new ATOM 0 HB3 ASP T 73 87.636 -8.557 0.151 1.00 0.00 H new ATOM 1103 N PHE T 74 84.899 -7.623 -2.546 1.00 0.00 N ATOM 1104 CA PHE T 74 83.654 -7.696 -3.304 1.00 0.00 C ATOM 1105 C PHE T 74 82.600 -8.499 -2.545 1.00 0.00 C ATOM 1106 O PHE T 74 81.420 -8.470 -2.893 1.00 0.00 O ATOM 1107 CB PHE T 74 83.914 -8.348 -4.663 1.00 0.00 C ATOM 1108 CG PHE T 74 82.668 -8.263 -5.512 1.00 0.00 C ATOM 1109 CD1 PHE T 74 81.669 -9.235 -5.391 1.00 0.00 C ATOM 1110 CD2 PHE T 74 82.513 -7.211 -6.422 1.00 0.00 C ATOM 1111 CE1 PHE T 74 80.516 -9.157 -6.180 1.00 0.00 C ATOM 1112 CE2 PHE T 74 81.359 -7.132 -7.211 1.00 0.00 C ATOM 1113 CZ PHE T 74 80.360 -8.104 -7.090 1.00 0.00 C ATOM 0 H PHE T 74 85.708 -8.025 -3.020 1.00 0.00 H new ATOM 0 HA PHE T 74 83.280 -6.682 -3.448 1.00 0.00 H new ATOM 0 HB2 PHE T 74 84.743 -7.849 -5.165 1.00 0.00 H new ATOM 0 HB3 PHE T 74 84.204 -9.390 -4.528 1.00 0.00 H new ATOM 0 HD1 PHE T 74 81.788 -10.046 -4.688 1.00 0.00 H new ATOM 0 HD2 PHE T 74 83.284 -6.460 -6.516 1.00 0.00 H new ATOM 0 HE1 PHE T 74 79.746 -9.909 -6.087 1.00 0.00 H new ATOM 0 HE2 PHE T 74 81.240 -6.320 -7.913 1.00 0.00 H new ATOM 0 HZ PHE T 74 79.469 -8.042 -7.698 1.00 0.00 H new ATOM 1123 N ASP T 75 83.032 -9.217 -1.514 1.00 0.00 N ATOM 1124 CA ASP T 75 82.111 -10.025 -0.720 1.00 0.00 C ATOM 1125 C ASP T 75 81.349 -9.158 0.278 1.00 0.00 C ATOM 1126 O ASP T 75 80.127 -9.030 0.195 1.00 0.00 O ATOM 1127 CB ASP T 75 82.883 -11.113 0.030 1.00 0.00 C ATOM 1128 CG ASP T 75 83.348 -12.190 -0.945 1.00 0.00 C ATOM 1129 OD1 ASP T 75 82.570 -12.551 -1.813 1.00 0.00 O ATOM 1130 OD2 ASP T 75 84.473 -12.640 -0.808 1.00 0.00 O ATOM 0 H ASP T 75 84.005 -9.257 -1.210 1.00 0.00 H new ATOM 0 HA ASP T 75 81.394 -10.488 -1.397 1.00 0.00 H new ATOM 0 HB2 ASP T 75 83.742 -10.676 0.538 1.00 0.00 H new ATOM 0 HB3 ASP T 75 82.249 -11.556 0.798 1.00 0.00 H new ATOM 1135 N GLU T 76 82.074 -8.569 1.222 1.00 0.00 N ATOM 1136 CA GLU T 76 81.451 -7.722 2.234 1.00 0.00 C ATOM 1137 C GLU T 76 80.921 -6.433 1.611 1.00 0.00 C ATOM 1138 O GLU T 76 80.198 -5.674 2.255 1.00 0.00 O ATOM 1139 CB GLU T 76 82.463 -7.389 3.334 1.00 0.00 C ATOM 1140 CG GLU T 76 83.538 -6.449 2.781 1.00 0.00 C ATOM 1141 CD GLU T 76 84.740 -6.418 3.721 1.00 0.00 C ATOM 1142 OE1 GLU T 76 84.754 -7.195 4.661 1.00 0.00 O ATOM 1143 OE2 GLU T 76 85.629 -5.616 3.487 1.00 0.00 O ATOM 0 H GLU T 76 83.086 -8.661 1.308 1.00 0.00 H new ATOM 0 HA GLU T 76 80.613 -8.267 2.668 1.00 0.00 H new ATOM 0 HB2 GLU T 76 81.956 -6.921 4.178 1.00 0.00 H new ATOM 0 HB3 GLU T 76 82.923 -8.304 3.707 1.00 0.00 H new ATOM 0 HG2 GLU T 76 83.849 -6.782 1.791 1.00 0.00 H new ATOM 0 HG3 GLU T 76 83.130 -5.445 2.666 1.00 0.00 H new ATOM 1150 N PHE T 77 81.286 -6.190 0.356 1.00 0.00 N ATOM 1151 CA PHE T 77 80.839 -4.989 -0.341 1.00 0.00 C ATOM 1152 C PHE T 77 79.318 -4.984 -0.481 1.00 0.00 C ATOM 1153 O PHE T 77 78.650 -4.043 -0.055 1.00 0.00 O ATOM 1154 CB PHE T 77 81.483 -4.915 -1.726 1.00 0.00 C ATOM 1155 CG PHE T 77 80.952 -3.708 -2.469 1.00 0.00 C ATOM 1156 CD1 PHE T 77 81.238 -2.421 -1.999 1.00 0.00 C ATOM 1157 CD2 PHE T 77 80.175 -3.874 -3.624 1.00 0.00 C ATOM 1158 CE1 PHE T 77 80.748 -1.300 -2.682 1.00 0.00 C ATOM 1159 CE2 PHE T 77 79.686 -2.754 -4.306 1.00 0.00 C ATOM 1160 CZ PHE T 77 79.973 -1.467 -3.835 1.00 0.00 C ATOM 0 H PHE T 77 81.886 -6.804 -0.196 1.00 0.00 H new ATOM 0 HA PHE T 77 81.141 -4.120 0.244 1.00 0.00 H new ATOM 0 HB2 PHE T 77 82.567 -4.848 -1.631 1.00 0.00 H new ATOM 0 HB3 PHE T 77 81.267 -5.824 -2.287 1.00 0.00 H new ATOM 0 HD1 PHE T 77 81.837 -2.292 -1.109 1.00 0.00 H new ATOM 0 HD2 PHE T 77 79.954 -4.867 -3.988 1.00 0.00 H new ATOM 0 HE1 PHE T 77 80.968 -0.307 -2.319 1.00 0.00 H new ATOM 0 HE2 PHE T 77 79.087 -2.882 -5.196 1.00 0.00 H new ATOM 0 HZ PHE T 77 79.596 -0.603 -4.362 1.00 0.00 H new ATOM 1170 N LEU T 78 78.781 -6.041 -1.082 1.00 0.00 N ATOM 1171 CA LEU T 78 77.339 -6.147 -1.274 1.00 0.00 C ATOM 1172 C LEU T 78 76.604 -5.906 0.041 1.00 0.00 C ATOM 1173 O LEU T 78 75.573 -5.234 0.072 1.00 0.00 O ATOM 1174 CB LEU T 78 76.980 -7.534 -1.814 1.00 0.00 C ATOM 1175 CG LEU T 78 77.810 -7.842 -3.067 1.00 0.00 C ATOM 1176 CD1 LEU T 78 77.571 -9.296 -3.485 1.00 0.00 C ATOM 1177 CD2 LEU T 78 77.399 -6.905 -4.214 1.00 0.00 C ATOM 0 H LEU T 78 79.317 -6.830 -1.442 1.00 0.00 H new ATOM 0 HA LEU T 78 77.033 -5.388 -1.994 1.00 0.00 H new ATOM 0 HB2 LEU T 78 77.166 -8.289 -1.050 1.00 0.00 H new ATOM 0 HB3 LEU T 78 75.917 -7.576 -2.053 1.00 0.00 H new ATOM 0 HG LEU T 78 78.866 -7.690 -2.845 1.00 0.00 H new ATOM 0 HD11 LEU T 78 78.159 -9.520 -4.375 1.00 0.00 H new ATOM 0 HD12 LEU T 78 77.871 -9.961 -2.675 1.00 0.00 H new ATOM 0 HD13 LEU T 78 76.513 -9.443 -3.702 1.00 0.00 H new ATOM 0 HD21 LEU T 78 77.993 -7.131 -5.099 1.00 0.00 H new ATOM 0 HD22 LEU T 78 76.342 -7.048 -4.440 1.00 0.00 H new ATOM 0 HD23 LEU T 78 77.569 -5.870 -3.917 1.00 0.00 H new ATOM 1189 N VAL T 79 77.142 -6.455 1.125 1.00 0.00 N ATOM 1190 CA VAL T 79 76.527 -6.290 2.437 1.00 0.00 C ATOM 1191 C VAL T 79 76.380 -4.809 2.776 1.00 0.00 C ATOM 1192 O VAL T 79 75.436 -4.410 3.458 1.00 0.00 O ATOM 1193 CB VAL T 79 77.382 -6.981 3.503 1.00 0.00 C ATOM 1194 CG1 VAL T 79 76.797 -6.703 4.891 1.00 0.00 C ATOM 1195 CG2 VAL T 79 77.391 -8.489 3.248 1.00 0.00 C ATOM 0 H VAL T 79 77.995 -7.014 1.122 1.00 0.00 H new ATOM 0 HA VAL T 79 75.537 -6.745 2.416 1.00 0.00 H new ATOM 0 HB VAL T 79 78.401 -6.596 3.456 1.00 0.00 H new ATOM 0 HG11 VAL T 79 77.407 -7.196 5.648 1.00 0.00 H new ATOM 0 HG12 VAL T 79 76.789 -5.629 5.074 1.00 0.00 H new ATOM 0 HG13 VAL T 79 75.778 -7.087 4.940 1.00 0.00 H new ATOM 0 HG21 VAL T 79 77.999 -8.983 4.006 1.00 0.00 H new ATOM 0 HG22 VAL T 79 76.372 -8.872 3.295 1.00 0.00 H new ATOM 0 HG23 VAL T 79 77.809 -8.689 2.261 1.00 0.00 H new ATOM 1205 N MET T 80 77.317 -4.002 2.294 1.00 0.00 N ATOM 1206 CA MET T 80 77.283 -2.567 2.550 1.00 0.00 C ATOM 1207 C MET T 80 75.992 -1.955 2.012 1.00 0.00 C ATOM 1208 O MET T 80 75.448 -1.018 2.597 1.00 0.00 O ATOM 1209 CB MET T 80 78.486 -1.890 1.888 1.00 0.00 C ATOM 1210 CG MET T 80 78.634 -0.463 2.420 1.00 0.00 C ATOM 1211 SD MET T 80 79.721 0.477 1.318 1.00 0.00 S ATOM 1212 CE MET T 80 80.506 1.507 2.583 1.00 0.00 C ATOM 0 H MET T 80 78.105 -4.314 1.727 1.00 0.00 H new ATOM 0 HA MET T 80 77.324 -2.409 3.628 1.00 0.00 H new ATOM 0 HB2 MET T 80 79.393 -2.460 2.091 1.00 0.00 H new ATOM 0 HB3 MET T 80 78.356 -1.873 0.806 1.00 0.00 H new ATOM 0 HG2 MET T 80 77.657 0.017 2.483 1.00 0.00 H new ATOM 0 HG3 MET T 80 79.046 -0.480 3.429 1.00 0.00 H new ATOM 0 HE1 MET T 80 81.091 2.291 2.102 1.00 0.00 H new ATOM 0 HE2 MET T 80 79.739 1.960 3.211 1.00 0.00 H new ATOM 0 HE3 MET T 80 81.162 0.891 3.199 1.00 0.00 H new ATOM 1222 N MET T 81 75.509 -2.490 0.895 1.00 0.00 N ATOM 1223 CA MET T 81 74.279 -1.988 0.286 1.00 0.00 C ATOM 1224 C MET T 81 73.054 -2.558 0.993 1.00 0.00 C ATOM 1225 O MET T 81 72.232 -1.814 1.527 1.00 0.00 O ATOM 1226 CB MET T 81 74.234 -2.372 -1.196 1.00 0.00 C ATOM 1227 CG MET T 81 75.275 -1.561 -1.970 1.00 0.00 C ATOM 1228 SD MET T 81 76.938 -2.075 -1.460 1.00 0.00 S ATOM 1229 CE MET T 81 77.659 -0.425 -1.261 1.00 0.00 C ATOM 0 H MET T 81 75.945 -3.265 0.395 1.00 0.00 H new ATOM 0 HA MET T 81 74.269 -0.902 0.384 1.00 0.00 H new ATOM 0 HB2 MET T 81 74.430 -3.438 -1.312 1.00 0.00 H new ATOM 0 HB3 MET T 81 73.239 -2.185 -1.600 1.00 0.00 H new ATOM 0 HG2 MET T 81 75.148 -1.713 -3.042 1.00 0.00 H new ATOM 0 HG3 MET T 81 75.137 -0.496 -1.781 1.00 0.00 H new ATOM 0 HE1 MET T 81 78.744 -0.508 -1.191 1.00 0.00 H new ATOM 0 HE2 MET T 81 77.397 0.193 -2.120 1.00 0.00 H new ATOM 0 HE3 MET T 81 77.271 0.034 -0.352 1.00 0.00 H new ATOM 1239 N VAL T 82 72.936 -3.883 0.988 1.00 0.00 N ATOM 1240 CA VAL T 82 71.804 -4.545 1.628 1.00 0.00 C ATOM 1241 C VAL T 82 71.497 -3.913 2.983 1.00 0.00 C ATOM 1242 O VAL T 82 70.335 -3.684 3.322 1.00 0.00 O ATOM 1243 CB VAL T 82 72.107 -6.034 1.814 1.00 0.00 C ATOM 1244 CG1 VAL T 82 70.868 -6.744 2.363 1.00 0.00 C ATOM 1245 CG2 VAL T 82 72.489 -6.648 0.464 1.00 0.00 C ATOM 0 H VAL T 82 73.606 -4.516 0.551 1.00 0.00 H new ATOM 0 HA VAL T 82 70.932 -4.427 0.984 1.00 0.00 H new ATOM 0 HB VAL T 82 72.933 -6.151 2.516 1.00 0.00 H new ATOM 0 HG11 VAL T 82 71.085 -7.804 2.495 1.00 0.00 H new ATOM 0 HG12 VAL T 82 70.594 -6.307 3.323 1.00 0.00 H new ATOM 0 HG13 VAL T 82 70.041 -6.627 1.662 1.00 0.00 H new ATOM 0 HG21 VAL T 82 72.705 -7.708 0.595 1.00 0.00 H new ATOM 0 HG22 VAL T 82 71.662 -6.530 -0.236 1.00 0.00 H new ATOM 0 HG23 VAL T 82 73.372 -6.143 0.072 1.00 0.00 H new ATOM 1255 N ARG T 83 72.542 -3.631 3.752 1.00 0.00 N ATOM 1256 CA ARG T 83 72.367 -3.022 5.067 1.00 0.00 C ATOM 1257 C ARG T 83 71.753 -1.632 4.934 1.00 0.00 C ATOM 1258 O ARG T 83 70.593 -1.420 5.284 1.00 0.00 O ATOM 1259 CB ARG T 83 73.717 -2.920 5.781 1.00 0.00 C ATOM 1260 CG ARG T 83 74.156 -4.309 6.251 1.00 0.00 C ATOM 1261 CD ARG T 83 75.521 -4.209 6.933 1.00 0.00 C ATOM 1262 NE ARG T 83 75.424 -3.403 8.144 1.00 0.00 N ATOM 1263 CZ ARG T 83 76.504 -2.852 8.690 1.00 0.00 C ATOM 1264 NH1 ARG T 83 77.675 -3.031 8.143 1.00 0.00 N ATOM 1265 NH2 ARG T 83 76.392 -2.132 9.773 1.00 0.00 N ATOM 0 H ARG T 83 73.512 -3.812 3.492 1.00 0.00 H new ATOM 0 HA ARG T 83 71.695 -3.650 5.652 1.00 0.00 H new ATOM 0 HB2 ARG T 83 74.465 -2.500 5.108 1.00 0.00 H new ATOM 0 HB3 ARG T 83 73.639 -2.245 6.633 1.00 0.00 H new ATOM 0 HG2 ARG T 83 73.421 -4.719 6.943 1.00 0.00 H new ATOM 0 HG3 ARG T 83 74.211 -4.991 5.403 1.00 0.00 H new ATOM 0 HD2 ARG T 83 75.886 -5.206 7.180 1.00 0.00 H new ATOM 0 HD3 ARG T 83 76.245 -3.765 6.250 1.00 0.00 H new ATOM 0 HE ARG T 83 74.513 -3.259 8.579 1.00 0.00 H new ATOM 0 HH11 ARG T 83 77.762 -3.594 7.297 1.00 0.00 H new ATOM 0 HH12 ARG T 83 78.503 -2.608 8.562 1.00 0.00 H new ATOM 0 HH21 ARG T 83 75.476 -1.992 10.200 1.00 0.00 H new ATOM 0 HH22 ARG T 83 77.220 -1.709 10.192 1.00 0.00 H new ATOM 1279 N SER T 84 72.540 -0.689 4.425 1.00 0.00 N ATOM 1280 CA SER T 84 72.064 0.678 4.251 1.00 0.00 C ATOM 1281 C SER T 84 70.687 0.687 3.595 1.00 0.00 C ATOM 1282 O SER T 84 69.877 1.580 3.843 1.00 0.00 O ATOM 1283 CB SER T 84 73.048 1.465 3.386 1.00 0.00 C ATOM 1284 OG SER T 84 74.373 1.219 3.837 1.00 0.00 O ATOM 0 H SER T 84 73.503 -0.845 4.128 1.00 0.00 H new ATOM 0 HA SER T 84 71.988 1.145 5.233 1.00 0.00 H new ATOM 0 HB2 SER T 84 72.947 1.171 2.341 1.00 0.00 H new ATOM 0 HB3 SER T 84 72.825 2.531 3.440 1.00 0.00 H new ATOM 0 HG SER T 84 74.752 0.464 3.341 1.00 0.00 H new ATOM 1290 N MET T 85 70.429 -0.312 2.758 1.00 0.00 N ATOM 1291 CA MET T 85 69.146 -0.409 2.071 1.00 0.00 C ATOM 1292 C MET T 85 68.077 -0.967 3.006 1.00 0.00 C ATOM 1293 O MET T 85 67.319 -0.214 3.617 1.00 0.00 O ATOM 1294 CB MET T 85 69.277 -1.315 0.845 1.00 0.00 C ATOM 1295 CG MET T 85 70.156 -0.631 -0.204 1.00 0.00 C ATOM 1296 SD MET T 85 69.221 0.696 -1.003 1.00 0.00 S ATOM 1297 CE MET T 85 70.249 0.837 -2.486 1.00 0.00 C ATOM 0 H MET T 85 71.086 -1.061 2.540 1.00 0.00 H new ATOM 0 HA MET T 85 68.849 0.591 1.754 1.00 0.00 H new ATOM 0 HB2 MET T 85 69.713 -2.272 1.132 1.00 0.00 H new ATOM 0 HB3 MET T 85 68.292 -1.525 0.428 1.00 0.00 H new ATOM 0 HG2 MET T 85 71.053 -0.227 0.265 1.00 0.00 H new ATOM 0 HG3 MET T 85 70.485 -1.357 -0.947 1.00 0.00 H new ATOM 0 HE1 MET T 85 69.847 1.615 -3.135 1.00 0.00 H new ATOM 0 HE2 MET T 85 71.268 1.095 -2.199 1.00 0.00 H new ATOM 0 HE3 MET T 85 70.252 -0.114 -3.018 1.00 0.00 H new ATOM 1307 N LYS T 86 68.024 -2.291 3.110 1.00 0.00 N ATOM 1308 CA LYS T 86 67.044 -2.940 3.973 1.00 0.00 C ATOM 1309 C LYS T 86 67.065 -2.325 5.369 1.00 0.00 C ATOM 1310 O LYS T 86 66.162 -2.557 6.173 1.00 0.00 O ATOM 1311 CB LYS T 86 67.346 -4.438 4.067 1.00 0.00 C ATOM 1312 CG LYS T 86 66.140 -5.171 4.662 1.00 0.00 C ATOM 1313 CD LYS T 86 66.391 -6.680 4.626 1.00 0.00 C ATOM 1314 CE LYS T 86 65.093 -7.421 4.953 1.00 0.00 C ATOM 1315 NZ LYS T 86 65.320 -8.890 4.848 1.00 0.00 N ATOM 0 H LYS T 86 68.643 -2.931 2.612 1.00 0.00 H new ATOM 0 HA LYS T 86 66.054 -2.794 3.542 1.00 0.00 H new ATOM 0 HB2 LYS T 86 67.574 -4.836 3.078 1.00 0.00 H new ATOM 0 HB3 LYS T 86 68.227 -4.603 4.688 1.00 0.00 H new ATOM 0 HG2 LYS T 86 65.972 -4.844 5.688 1.00 0.00 H new ATOM 0 HG3 LYS T 86 65.239 -4.928 4.099 1.00 0.00 H new ATOM 0 HD2 LYS T 86 66.753 -6.976 3.641 1.00 0.00 H new ATOM 0 HD3 LYS T 86 67.166 -6.948 5.344 1.00 0.00 H new ATOM 0 HE2 LYS T 86 64.759 -7.165 5.958 1.00 0.00 H new ATOM 0 HE3 LYS T 86 64.304 -7.114 4.267 1.00 0.00 H new ATOM 0 HZ1 LYS T 86 64.438 -9.394 5.070 1.00 0.00 H new ATOM 0 HZ2 LYS T 86 65.620 -9.127 3.881 1.00 0.00 H new ATOM 0 HZ3 LYS T 86 66.061 -9.176 5.520 1.00 0.00 H new ATOM 1329 N ASP T 87 68.100 -1.539 5.650 1.00 0.00 N ATOM 1330 CA ASP T 87 68.227 -0.895 6.954 1.00 0.00 C ATOM 1331 C ASP T 87 69.146 0.319 6.866 1.00 0.00 C ATOM 1332 O ASP T 87 70.364 0.199 7.001 1.00 0.00 O ATOM 1333 CB ASP T 87 68.787 -1.889 7.973 1.00 0.00 C ATOM 1334 CG ASP T 87 67.830 -3.064 8.137 1.00 0.00 C ATOM 1335 OD1 ASP T 87 66.795 -2.878 8.756 1.00 0.00 O ATOM 1336 OD2 ASP T 87 68.145 -4.133 7.639 1.00 0.00 O ATOM 0 H ASP T 87 68.857 -1.333 4.999 1.00 0.00 H new ATOM 0 HA ASP T 87 67.239 -0.564 7.273 1.00 0.00 H new ATOM 0 HB2 ASP T 87 69.763 -2.247 7.645 1.00 0.00 H new ATOM 0 HB3 ASP T 87 68.935 -1.394 8.933 1.00 0.00 H new ATOM 1341 N ASP T 88 68.555 1.487 6.639 1.00 0.00 N ATOM 1342 CA ASP T 88 69.330 2.719 6.534 1.00 0.00 C ATOM 1343 C ASP T 88 69.706 3.233 7.920 1.00 0.00 C ATOM 1344 O ASP T 88 68.838 3.588 8.718 1.00 0.00 O ATOM 1345 CB ASP T 88 68.518 3.784 5.795 1.00 0.00 C ATOM 1346 CG ASP T 88 67.177 3.994 6.490 1.00 0.00 C ATOM 1347 OD1 ASP T 88 66.712 3.064 7.127 1.00 0.00 O ATOM 1348 OD2 ASP T 88 66.634 5.080 6.372 1.00 0.00 O ATOM 0 H ASP T 88 67.549 1.607 6.525 1.00 0.00 H new ATOM 0 HA ASP T 88 70.243 2.507 5.977 1.00 0.00 H new ATOM 0 HB2 ASP T 88 69.073 4.722 5.767 1.00 0.00 H new ATOM 0 HB3 ASP T 88 68.357 3.478 4.761 1.00 0.00 H new ATOM 1353 N SER T 89 71.005 3.270 8.199 1.00 0.00 N ATOM 1354 CA SER T 89 71.485 3.743 9.492 1.00 0.00 C ATOM 1355 C SER T 89 72.992 3.973 9.453 1.00 0.00 C ATOM 1356 O SER T 89 73.519 4.131 8.365 1.00 0.00 O ATOM 1357 CB SER T 89 71.151 2.721 10.579 1.00 0.00 C ATOM 1358 OG SER T 89 71.708 1.462 10.226 1.00 0.00 O ATOM 1359 OXT SER T 89 73.597 3.988 10.512 1.00 0.00 O ATOM 0 H SER T 89 71.739 2.981 7.553 1.00 0.00 H new ATOM 0 HA SER T 89 70.991 4.688 9.718 1.00 0.00 H new ATOM 0 HB2 SER T 89 71.548 3.051 11.539 1.00 0.00 H new ATOM 0 HB3 SER T 89 70.070 2.634 10.694 1.00 0.00 H new ATOM 0 HG SER T 89 71.497 0.805 10.922 1.00 0.00 H new TER 1365 SER T 89 HETATM 1366 CA CA T 90 87.426 -6.579 5.138 1.00 0.00 CA HETATM 1367 S1 WW7 T 91 80.200 3.550 -5.461 1.00 0.00 S HETATM 1368 O1 WW7 T 91 81.087 3.143 -6.500 1.00 0.00 O HETATM 1369 O2 WW7 T 91 79.499 4.798 -5.657 1.00 0.00 O HETATM 1370 N1 WW7 T 91 79.002 2.299 -5.318 1.00 0.00 N HETATM 1371 C4 WW7 T 91 82.495 3.911 -1.356 1.00 0.00 C HETATM 1372 C3 WW7 T 91 81.554 4.929 -1.793 1.00 0.00 C HETATM 1373 C2 WW7 T 91 80.855 4.806 -3.072 1.00 0.00 C HETATM 1374 C1 WW7 T 91 81.080 3.654 -3.935 1.00 0.00 C HETATM 1375 C9 WW7 T 91 82.022 2.619 -3.530 1.00 0.00 C HETATM 1376 C10 WW7 T 91 82.745 2.751 -2.205 1.00 0.00 C HETATM 1377 CL1 WW7 T 91 84.526 1.762 -0.296 1.00 0.00 CL HETATM 1378 C5 WW7 T 91 83.674 1.705 -1.796 1.00 0.00 C HETATM 1379 C6 WW7 T 91 83.903 0.551 -2.653 1.00 0.00 C HETATM 1380 C7 WW7 T 91 83.201 0.429 -3.933 1.00 0.00 C HETATM 1381 C8 WW7 T 91 82.266 1.454 -4.373 1.00 0.00 C HETATM 1382 C11 WW7 T 91 78.501 2.009 -3.977 1.00 0.00 C HETATM 1383 C12 WW7 T 91 77.350 2.910 -3.535 1.00 0.00 C HETATM 1384 C14 WW7 T 91 77.922 2.812 -1.098 1.00 0.00 C HETATM 1385 C13 WW7 T 91 77.767 3.729 -2.312 1.00 0.00 C HETATM 1386 C15 WW7 T 91 78.607 3.574 0.041 1.00 0.00 C HETATM 1387 C16 WW7 T 91 77.571 3.987 1.091 1.00 0.00 C HETATM 1388 N2 WW7 T 91 76.406 4.635 0.509 1.00 0.00 N HETATM 0 HN22 WW7 T 91 75.647 4.955 1.110 1.00 0.00 H new HETATM 0 HN21 WW7 T 91 76.348 4.769 -0.500 1.00 0.00 H new HETATM 0 H162 WW7 T 91 77.251 3.105 1.646 1.00 0.00 H new HETATM 0 H161 WW7 T 91 78.037 4.663 1.808 1.00 0.00 H new HETATM 0 H152 WW7 T 91 79.373 2.948 0.500 1.00 0.00 H new HETATM 0 H151 WW7 T 91 79.111 4.457 -0.352 1.00 0.00 H new HETATM 0 H142 WW7 T 91 76.945 2.455 -0.773 1.00 0.00 H new HETATM 0 H141 WW7 T 91 78.510 1.934 -1.366 1.00 0.00 H new HETATM 0 H132 WW7 T 91 78.707 4.244 -2.512 1.00 0.00 H new HETATM 0 H131 WW7 T 91 77.021 4.496 -2.106 1.00 0.00 H new HETATM 0 H122 WW7 T 91 77.065 3.576 -4.349 1.00 0.00 H new HETATM 0 H121 WW7 T 91 76.475 2.306 -3.297 1.00 0.00 H new HETATM 0 H112 WW7 T 91 78.171 0.971 -3.940 1.00 0.00 H new HETATM 0 H111 WW7 T 91 79.320 2.108 -3.265 1.00 0.00 H new HETATM 0 HN1 WW7 T 91 78.664 1.790 -6.135 1.00 0.00 H new HETATM 0 H8 WW7 T 91 81.751 1.351 -5.328 1.00 0.00 H new HETATM 0 H7 WW7 T 91 83.381 -0.441 -4.564 1.00 0.00 H new HETATM 0 H6 WW7 T 91 84.600 -0.226 -2.341 1.00 0.00 H new HETATM 0 H4 WW7 T 91 83.010 4.013 -0.401 1.00 0.00 H new HETATM 0 H3 WW7 T 91 81.367 5.796 -1.159 1.00 0.00 H new HETATM 0 H2 WW7 T 91 80.158 5.585 -3.383 1.00 0.00 H new