USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=18 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 69 SER OG : rot -127:sc= 1.26 USER MOD Set 1.2: T 71 THR OG1 : rot -71:sc= 0.202 USER MOD Single : T 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 1 MET N :NH3+ -157:sc= -0.0803 (180deg=-0.708) 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 K(o=0,f=-0.71) USER MOD Single : T 13 THR OG1 : rot 180:sc= 0 USER MOD Single : T 16 GLN : amide:sc= -6.46! C(o=-6.5!,f=-8.3!) USER MOD Single : T 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 18 ASN :FLIP amide:sc= -0.021 F(o=-3.6!,f=-0.021) USER MOD Single : T 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 35 SER OG : rot 39:sc= 0.604 USER MOD Single : T 37 SER OG : rot 180:sc= 0.0344! USER MOD Single : T 38 THR OG1 : rot 180:sc= 0 USER MOD Single : T 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 45 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 47 MET CE :methyl -158:sc= -0.094 (180deg=-0.822) USER MOD Single : T 50 GLN : amide:sc= -4.17! C(o=-4.2!,f=-4.2!) USER MOD Single : T 51 ASN :FLIP amide:sc= 0.391! F(o=-0.86,f=0.39!) USER MOD Single : T 53 THR OG1 : rot 180:sc= -0.466 USER MOD Single : T 58 GLN : amide:sc= -1.63 K(o=-1.6,f=-2.5) USER MOD Single : T 60 MET CE :methyl 177:sc= -2.41! (180deg=-2.65!) USER MOD Single : T 80 MET CE :methyl 179:sc= -0.0459 (180deg=-0.0461) USER MOD Single : T 81 MET CE :methyl 173:sc= -3.12 (180deg=-3.44) USER MOD Single : T 84 SER OG : rot 103:sc= 1.2 USER MOD Single : T 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 86 LYS NZ :NH3+ -161:sc= -0.074 (180deg=-0.722) USER MOD Single : T 89 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET T 1 76.966 -18.489 8.651 1.00 0.00 N ATOM 2 CA MET T 1 75.802 -18.699 7.745 1.00 0.00 C ATOM 3 C MET T 1 75.715 -17.541 6.757 1.00 0.00 C ATOM 4 O MET T 1 75.992 -17.704 5.568 1.00 0.00 O ATOM 5 CB MET T 1 74.519 -18.775 8.576 1.00 0.00 C ATOM 6 CG MET T 1 74.547 -20.033 9.445 1.00 0.00 C ATOM 7 SD MET T 1 73.168 -19.988 10.616 1.00 0.00 S ATOM 8 CE MET T 1 72.972 -21.777 10.805 1.00 0.00 C ATOM 0 H1 MET T 1 77.269 -19.403 9.045 1.00 0.00 H new ATOM 0 H2 MET T 1 77.751 -18.066 8.116 1.00 0.00 H new ATOM 0 H3 MET T 1 76.692 -17.852 9.426 1.00 0.00 H new ATOM 0 HA MET T 1 75.927 -19.631 7.194 1.00 0.00 H new ATOM 0 HB2 MET T 1 74.427 -17.889 9.204 1.00 0.00 H new ATOM 0 HB3 MET T 1 73.649 -18.793 7.920 1.00 0.00 H new ATOM 0 HG2 MET T 1 74.477 -20.922 8.819 1.00 0.00 H new ATOM 0 HG3 MET T 1 75.493 -20.095 9.983 1.00 0.00 H new ATOM 0 HE1 MET T 1 72.157 -21.982 11.500 1.00 0.00 H new ATOM 0 HE2 MET T 1 72.744 -22.222 9.837 1.00 0.00 H new ATOM 0 HE3 MET T 1 73.896 -22.205 11.193 1.00 0.00 H new ATOM 20 N ASP T 2 75.328 -16.372 7.256 1.00 0.00 N ATOM 21 CA ASP T 2 75.209 -15.192 6.406 1.00 0.00 C ATOM 22 C ASP T 2 74.366 -15.502 5.173 1.00 0.00 C ATOM 23 O ASP T 2 74.666 -15.042 4.072 1.00 0.00 O ATOM 24 CB ASP T 2 76.597 -14.719 5.972 1.00 0.00 C ATOM 25 CG ASP T 2 77.375 -14.206 7.180 1.00 0.00 C ATOM 26 OD1 ASP T 2 76.870 -13.324 7.853 1.00 0.00 O ATOM 27 OD2 ASP T 2 78.465 -14.704 7.412 1.00 0.00 O ATOM 0 H ASP T 2 75.093 -16.216 8.236 1.00 0.00 H new ATOM 0 HA ASP T 2 74.719 -14.404 6.978 1.00 0.00 H new ATOM 0 HB2 ASP T 2 77.139 -15.539 5.502 1.00 0.00 H new ATOM 0 HB3 ASP T 2 76.504 -13.929 5.227 1.00 0.00 H new ATOM 32 N ASP T 3 73.311 -16.287 5.367 1.00 0.00 N ATOM 33 CA ASP T 3 72.430 -16.655 4.264 1.00 0.00 C ATOM 34 C ASP T 3 71.455 -15.523 3.953 1.00 0.00 C ATOM 35 O ASP T 3 71.280 -15.143 2.795 1.00 0.00 O ATOM 36 CB ASP T 3 71.646 -17.920 4.621 1.00 0.00 C ATOM 37 CG ASP T 3 72.586 -18.966 5.211 1.00 0.00 C ATOM 38 OD1 ASP T 3 73.785 -18.826 5.031 1.00 0.00 O ATOM 39 OD2 ASP T 3 72.093 -19.892 5.834 1.00 0.00 O ATOM 0 H ASP T 3 73.046 -16.678 6.271 1.00 0.00 H new ATOM 0 HA ASP T 3 73.044 -16.843 3.383 1.00 0.00 H new ATOM 0 HB2 ASP T 3 70.860 -17.681 5.337 1.00 0.00 H new ATOM 0 HB3 ASP T 3 71.157 -18.318 3.732 1.00 0.00 H new ATOM 44 N ILE T 4 70.820 -14.992 4.992 1.00 0.00 N ATOM 45 CA ILE T 4 69.861 -13.907 4.819 1.00 0.00 C ATOM 46 C ILE T 4 70.391 -12.850 3.851 1.00 0.00 C ATOM 47 O ILE T 4 69.633 -12.015 3.357 1.00 0.00 O ATOM 48 CB ILE T 4 69.530 -13.261 6.173 1.00 0.00 C ATOM 49 CG1 ILE T 4 70.731 -12.459 6.708 1.00 0.00 C ATOM 50 CG2 ILE T 4 69.152 -14.351 7.179 1.00 0.00 C ATOM 51 CD1 ILE T 4 71.988 -13.336 6.780 1.00 0.00 C ATOM 0 H ILE T 4 70.951 -15.293 5.958 1.00 0.00 H new ATOM 0 HA ILE T 4 68.951 -14.332 4.396 1.00 0.00 H new ATOM 0 HB ILE T 4 68.693 -12.577 6.035 1.00 0.00 H new ATOM 0 HG12 ILE T 4 70.918 -11.602 6.061 1.00 0.00 H new ATOM 0 HG13 ILE T 4 70.499 -12.067 7.698 1.00 0.00 H new ATOM 0 HG21 ILE T 4 68.917 -13.893 8.140 1.00 0.00 H new ATOM 0 HG22 ILE T 4 68.282 -14.897 6.814 1.00 0.00 H new ATOM 0 HG23 ILE T 4 69.988 -15.040 7.300 1.00 0.00 H new ATOM 0 HD11 ILE T 4 72.822 -12.746 7.161 1.00 0.00 H new ATOM 0 HD12 ILE T 4 71.806 -14.179 7.446 1.00 0.00 H new ATOM 0 HD13 ILE T 4 72.231 -13.707 5.784 1.00 0.00 H new ATOM 63 N TYR T 5 71.694 -12.890 3.584 1.00 0.00 N ATOM 64 CA TYR T 5 72.313 -11.929 2.671 1.00 0.00 C ATOM 65 C TYR T 5 72.233 -12.432 1.233 1.00 0.00 C ATOM 66 O TYR T 5 71.560 -11.834 0.393 1.00 0.00 O ATOM 67 CB TYR T 5 73.778 -11.715 3.056 1.00 0.00 C ATOM 68 CG TYR T 5 73.852 -10.920 4.340 1.00 0.00 C ATOM 69 CD1 TYR T 5 73.469 -9.573 4.350 1.00 0.00 C ATOM 70 CD2 TYR T 5 74.303 -11.527 5.520 1.00 0.00 C ATOM 71 CE1 TYR T 5 73.536 -8.834 5.538 1.00 0.00 C ATOM 72 CE2 TYR T 5 74.370 -10.788 6.707 1.00 0.00 C ATOM 73 CZ TYR T 5 73.987 -9.441 6.715 1.00 0.00 C ATOM 74 OH TYR T 5 74.052 -8.713 7.886 1.00 0.00 O ATOM 0 H TYR T 5 72.339 -13.572 3.983 1.00 0.00 H new ATOM 0 HA TYR T 5 71.775 -10.984 2.746 1.00 0.00 H new ATOM 0 HB2 TYR T 5 74.276 -12.676 3.182 1.00 0.00 H new ATOM 0 HB3 TYR T 5 74.301 -11.187 2.259 1.00 0.00 H new ATOM 0 HD1 TYR T 5 73.122 -9.104 3.441 1.00 0.00 H new ATOM 0 HD2 TYR T 5 74.599 -12.566 5.514 1.00 0.00 H new ATOM 0 HE1 TYR T 5 73.239 -7.796 5.545 1.00 0.00 H new ATOM 0 HE2 TYR T 5 74.717 -11.256 7.616 1.00 0.00 H new ATOM 0 HH TYR T 5 74.385 -9.285 8.609 1.00 0.00 H new ATOM 84 N LYS T 6 72.924 -13.533 0.957 1.00 0.00 N ATOM 85 CA LYS T 6 72.925 -14.107 -0.384 1.00 0.00 C ATOM 86 C LYS T 6 71.503 -14.196 -0.928 1.00 0.00 C ATOM 87 O LYS T 6 71.294 -14.266 -2.139 1.00 0.00 O ATOM 88 CB LYS T 6 73.551 -15.507 -0.354 1.00 0.00 C ATOM 89 CG LYS T 6 74.992 -15.437 0.194 1.00 0.00 C ATOM 90 CD LYS T 6 75.988 -15.125 -0.942 1.00 0.00 C ATOM 91 CE LYS T 6 76.406 -16.420 -1.650 1.00 0.00 C ATOM 92 NZ LYS T 6 76.960 -16.093 -2.994 1.00 0.00 N ATOM 0 H LYS T 6 73.487 -14.043 1.638 1.00 0.00 H new ATOM 0 HA LYS T 6 73.513 -13.460 -1.036 1.00 0.00 H new ATOM 0 HB2 LYS T 6 72.949 -16.169 0.269 1.00 0.00 H new ATOM 0 HB3 LYS T 6 73.556 -15.932 -1.358 1.00 0.00 H new ATOM 0 HG2 LYS T 6 75.057 -14.668 0.964 1.00 0.00 H new ATOM 0 HG3 LYS T 6 75.254 -16.384 0.666 1.00 0.00 H new ATOM 0 HD2 LYS T 6 75.532 -14.441 -1.658 1.00 0.00 H new ATOM 0 HD3 LYS T 6 76.867 -14.623 -0.537 1.00 0.00 H new ATOM 0 HE2 LYS T 6 77.152 -16.948 -1.056 1.00 0.00 H new ATOM 0 HE3 LYS T 6 75.549 -17.086 -1.750 1.00 0.00 H new ATOM 0 HZ1 LYS T 6 77.244 -16.970 -3.475 1.00 0.00 H new ATOM 0 HZ2 LYS T 6 76.235 -15.607 -3.559 1.00 0.00 H new ATOM 0 HZ3 LYS T 6 77.788 -15.473 -2.887 1.00 0.00 H new ATOM 106 N ALA T 7 70.528 -14.191 -0.024 1.00 0.00 N ATOM 107 CA ALA T 7 69.128 -14.272 -0.424 1.00 0.00 C ATOM 108 C ALA T 7 68.710 -13.009 -1.169 1.00 0.00 C ATOM 109 O ALA T 7 67.978 -13.072 -2.156 1.00 0.00 O ATOM 110 CB ALA T 7 68.242 -14.456 0.809 1.00 0.00 C ATOM 0 H ALA T 7 70.680 -14.132 0.983 1.00 0.00 H new ATOM 0 HA ALA T 7 69.008 -15.128 -1.088 1.00 0.00 H new ATOM 0 HB1 ALA T 7 67.198 -14.516 0.501 1.00 0.00 H new ATOM 0 HB2 ALA T 7 68.521 -15.375 1.324 1.00 0.00 H new ATOM 0 HB3 ALA T 7 68.374 -13.609 1.482 1.00 0.00 H new ATOM 116 N ALA T 8 69.182 -11.862 -0.690 1.00 0.00 N ATOM 117 CA ALA T 8 68.850 -10.589 -1.321 1.00 0.00 C ATOM 118 C ALA T 8 69.679 -10.385 -2.585 1.00 0.00 C ATOM 119 O ALA T 8 69.362 -9.534 -3.416 1.00 0.00 O ATOM 120 CB ALA T 8 69.112 -9.440 -0.346 1.00 0.00 C ATOM 0 H ALA T 8 69.790 -11.787 0.126 1.00 0.00 H new ATOM 0 HA ALA T 8 67.794 -10.603 -1.591 1.00 0.00 H new ATOM 0 HB1 ALA T 8 68.862 -8.493 -0.824 1.00 0.00 H new ATOM 0 HB2 ALA T 8 68.497 -9.571 0.544 1.00 0.00 H new ATOM 0 HB3 ALA T 8 70.164 -9.436 -0.062 1.00 0.00 H new ATOM 126 N VAL T 9 70.741 -11.172 -2.722 1.00 0.00 N ATOM 127 CA VAL T 9 71.609 -11.069 -3.890 1.00 0.00 C ATOM 128 C VAL T 9 70.953 -11.718 -5.104 1.00 0.00 C ATOM 129 O VAL T 9 71.243 -11.359 -6.245 1.00 0.00 O ATOM 130 CB VAL T 9 72.948 -11.752 -3.606 1.00 0.00 C ATOM 131 CG1 VAL T 9 73.851 -11.638 -4.836 1.00 0.00 C ATOM 132 CG2 VAL T 9 73.624 -11.069 -2.415 1.00 0.00 C ATOM 0 H VAL T 9 71.020 -11.882 -2.045 1.00 0.00 H new ATOM 0 HA VAL T 9 71.777 -10.013 -4.103 1.00 0.00 H new ATOM 0 HB VAL T 9 72.778 -12.804 -3.376 1.00 0.00 H new ATOM 0 HG11 VAL T 9 74.805 -12.125 -4.633 1.00 0.00 H new ATOM 0 HG12 VAL T 9 73.370 -12.122 -5.686 1.00 0.00 H new ATOM 0 HG13 VAL T 9 74.022 -10.586 -5.066 1.00 0.00 H new ATOM 0 HG21 VAL T 9 74.578 -11.554 -2.211 1.00 0.00 H new ATOM 0 HG22 VAL T 9 73.794 -10.018 -2.647 1.00 0.00 H new ATOM 0 HG23 VAL T 9 72.982 -11.148 -1.538 1.00 0.00 H new ATOM 142 N GLU T 10 70.066 -12.675 -4.851 1.00 0.00 N ATOM 143 CA GLU T 10 69.374 -13.367 -5.932 1.00 0.00 C ATOM 144 C GLU T 10 68.360 -12.442 -6.597 1.00 0.00 C ATOM 145 O GLU T 10 67.933 -12.684 -7.726 1.00 0.00 O ATOM 146 CB GLU T 10 68.656 -14.603 -5.386 1.00 0.00 C ATOM 147 CG GLU T 10 69.689 -15.608 -4.874 1.00 0.00 C ATOM 148 CD GLU T 10 70.386 -16.286 -6.049 1.00 0.00 C ATOM 149 OE1 GLU T 10 69.771 -17.143 -6.663 1.00 0.00 O ATOM 150 OE2 GLU T 10 71.523 -15.937 -6.319 1.00 0.00 O ATOM 0 H GLU T 10 69.811 -12.987 -3.914 1.00 0.00 H new ATOM 0 HA GLU T 10 70.112 -13.673 -6.673 1.00 0.00 H new ATOM 0 HB2 GLU T 10 67.980 -14.318 -4.580 1.00 0.00 H new ATOM 0 HB3 GLU T 10 68.047 -15.058 -6.167 1.00 0.00 H new ATOM 0 HG2 GLU T 10 70.424 -15.100 -4.249 1.00 0.00 H new ATOM 0 HG3 GLU T 10 69.202 -16.356 -4.249 1.00 0.00 H new ATOM 157 N GLN T 11 67.981 -11.381 -5.892 1.00 0.00 N ATOM 158 CA GLN T 11 67.017 -10.426 -6.425 1.00 0.00 C ATOM 159 C GLN T 11 67.689 -9.491 -7.427 1.00 0.00 C ATOM 160 O GLN T 11 67.053 -9.009 -8.364 1.00 0.00 O ATOM 161 CB GLN T 11 66.410 -9.605 -5.286 1.00 0.00 C ATOM 162 CG GLN T 11 65.723 -10.542 -4.291 1.00 0.00 C ATOM 163 CD GLN T 11 64.927 -9.731 -3.275 1.00 0.00 C ATOM 164 OE1 GLN T 11 65.243 -8.568 -3.022 1.00 0.00 O ATOM 165 NE2 GLN T 11 63.907 -10.278 -2.672 1.00 0.00 N ATOM 0 H GLN T 11 68.324 -11.162 -4.957 1.00 0.00 H new ATOM 0 HA GLN T 11 66.228 -10.980 -6.933 1.00 0.00 H new ATOM 0 HB2 GLN T 11 67.188 -9.030 -4.783 1.00 0.00 H new ATOM 0 HB3 GLN T 11 65.691 -8.889 -5.683 1.00 0.00 H new ATOM 0 HG2 GLN T 11 65.061 -11.227 -4.821 1.00 0.00 H new ATOM 0 HG3 GLN T 11 66.468 -11.151 -3.779 1.00 0.00 H new ATOM 0 HE21 GLN T 11 63.647 -11.241 -2.883 1.00 0.00 H new ATOM 0 HE22 GLN T 11 63.370 -9.742 -1.990 1.00 0.00 H new ATOM 174 N LEU T 12 68.977 -9.240 -7.222 1.00 0.00 N ATOM 175 CA LEU T 12 69.726 -8.361 -8.114 1.00 0.00 C ATOM 176 C LEU T 12 69.972 -9.044 -9.456 1.00 0.00 C ATOM 177 O LEU T 12 70.611 -10.094 -9.522 1.00 0.00 O ATOM 178 CB LEU T 12 71.066 -7.985 -7.473 1.00 0.00 C ATOM 179 CG LEU T 12 70.858 -7.690 -5.986 1.00 0.00 C ATOM 180 CD1 LEU T 12 72.172 -7.200 -5.375 1.00 0.00 C ATOM 181 CD2 LEU T 12 69.786 -6.608 -5.823 1.00 0.00 C ATOM 0 H LEU T 12 69.522 -9.629 -6.452 1.00 0.00 H new ATOM 0 HA LEU T 12 69.140 -7.458 -8.282 1.00 0.00 H new ATOM 0 HB2 LEU T 12 71.781 -8.799 -7.596 1.00 0.00 H new ATOM 0 HB3 LEU T 12 71.487 -7.112 -7.972 1.00 0.00 H new ATOM 0 HG LEU T 12 70.536 -8.599 -5.478 1.00 0.00 H new ATOM 0 HD11 LEU T 12 72.025 -6.990 -4.316 1.00 0.00 H new ATOM 0 HD12 LEU T 12 72.936 -7.969 -5.489 1.00 0.00 H new ATOM 0 HD13 LEU T 12 72.493 -6.291 -5.884 1.00 0.00 H new ATOM 0 HD21 LEU T 12 69.639 -6.399 -4.764 1.00 0.00 H new ATOM 0 HD22 LEU T 12 70.107 -5.699 -6.331 1.00 0.00 H new ATOM 0 HD23 LEU T 12 68.849 -6.956 -6.258 1.00 0.00 H new ATOM 193 N THR T 13 69.460 -8.439 -10.524 1.00 0.00 N ATOM 194 CA THR T 13 69.630 -8.997 -11.862 1.00 0.00 C ATOM 195 C THR T 13 71.005 -8.642 -12.419 1.00 0.00 C ATOM 196 O THR T 13 71.619 -7.661 -12.003 1.00 0.00 O ATOM 197 CB THR T 13 68.544 -8.452 -12.794 1.00 0.00 C ATOM 198 OG1 THR T 13 67.275 -8.586 -12.169 1.00 0.00 O ATOM 199 CG2 THR T 13 68.555 -9.237 -14.106 1.00 0.00 C ATOM 0 H THR T 13 68.928 -7.569 -10.490 1.00 0.00 H new ATOM 0 HA THR T 13 69.545 -10.082 -11.798 1.00 0.00 H new ATOM 0 HB THR T 13 68.737 -7.400 -13.002 1.00 0.00 H new ATOM 0 HG1 THR T 13 66.579 -8.236 -12.764 1.00 0.00 H new ATOM 0 HG21 THR T 13 67.782 -8.849 -14.769 1.00 0.00 H new ATOM 0 HG22 THR T 13 69.529 -9.133 -14.584 1.00 0.00 H new ATOM 0 HG23 THR T 13 68.362 -10.290 -13.902 1.00 0.00 H new ATOM 207 N GLU T 14 71.481 -9.447 -13.363 1.00 0.00 N ATOM 208 CA GLU T 14 72.785 -9.208 -13.970 1.00 0.00 C ATOM 209 C GLU T 14 72.737 -7.975 -14.867 1.00 0.00 C ATOM 210 O GLU T 14 72.960 -8.064 -16.075 1.00 0.00 O ATOM 211 CB GLU T 14 73.209 -10.425 -14.796 1.00 0.00 C ATOM 212 CG GLU T 14 73.607 -11.566 -13.857 1.00 0.00 C ATOM 213 CD GLU T 14 73.888 -12.830 -14.663 1.00 0.00 C ATOM 214 OE1 GLU T 14 73.566 -12.843 -15.839 1.00 0.00 O ATOM 215 OE2 GLU T 14 74.421 -13.766 -14.090 1.00 0.00 O ATOM 0 H GLU T 14 70.988 -10.264 -13.722 1.00 0.00 H new ATOM 0 HA GLU T 14 73.511 -9.039 -13.174 1.00 0.00 H new ATOM 0 HB2 GLU T 14 72.391 -10.741 -15.443 1.00 0.00 H new ATOM 0 HB3 GLU T 14 74.046 -10.164 -15.444 1.00 0.00 H new ATOM 0 HG2 GLU T 14 74.491 -11.285 -13.285 1.00 0.00 H new ATOM 0 HG3 GLU T 14 72.808 -11.753 -13.139 1.00 0.00 H new ATOM 222 N GLU T 15 72.443 -6.823 -14.268 1.00 0.00 N ATOM 223 CA GLU T 15 72.366 -5.572 -15.017 1.00 0.00 C ATOM 224 C GLU T 15 72.702 -4.389 -14.115 1.00 0.00 C ATOM 225 O GLU T 15 73.384 -3.453 -14.533 1.00 0.00 O ATOM 226 CB GLU T 15 70.958 -5.391 -15.592 1.00 0.00 C ATOM 227 CG GLU T 15 70.668 -6.503 -16.602 1.00 0.00 C ATOM 228 CD GLU T 15 69.438 -6.146 -17.429 1.00 0.00 C ATOM 229 OE1 GLU T 15 68.344 -6.477 -17.001 1.00 0.00 O ATOM 230 OE2 GLU T 15 69.606 -5.547 -18.479 1.00 0.00 O ATOM 0 H GLU T 15 72.255 -6.730 -13.270 1.00 0.00 H new ATOM 0 HA GLU T 15 73.089 -5.613 -15.832 1.00 0.00 H new ATOM 0 HB2 GLU T 15 70.221 -5.414 -14.789 1.00 0.00 H new ATOM 0 HB3 GLU T 15 70.874 -4.417 -16.074 1.00 0.00 H new ATOM 0 HG2 GLU T 15 71.528 -6.645 -17.256 1.00 0.00 H new ATOM 0 HG3 GLU T 15 70.505 -7.446 -16.081 1.00 0.00 H new ATOM 237 N GLN T 16 72.217 -4.436 -12.877 1.00 0.00 N ATOM 238 CA GLN T 16 72.470 -3.360 -11.923 1.00 0.00 C ATOM 239 C GLN T 16 73.838 -3.534 -11.269 1.00 0.00 C ATOM 240 O GLN T 16 74.193 -2.798 -10.348 1.00 0.00 O ATOM 241 CB GLN T 16 71.378 -3.346 -10.848 1.00 0.00 C ATOM 242 CG GLN T 16 71.378 -4.675 -10.080 1.00 0.00 C ATOM 243 CD GLN T 16 72.469 -4.672 -9.012 1.00 0.00 C ATOM 244 OE1 GLN T 16 73.141 -5.682 -8.808 1.00 0.00 O ATOM 245 NE2 GLN T 16 72.682 -3.592 -8.311 1.00 0.00 N ATOM 0 H GLN T 16 71.650 -5.202 -12.513 1.00 0.00 H new ATOM 0 HA GLN T 16 72.458 -2.412 -12.460 1.00 0.00 H new ATOM 0 HB2 GLN T 16 71.546 -2.519 -10.159 1.00 0.00 H new ATOM 0 HB3 GLN T 16 70.404 -3.184 -11.310 1.00 0.00 H new ATOM 0 HG2 GLN T 16 70.405 -4.834 -9.615 1.00 0.00 H new ATOM 0 HG3 GLN T 16 71.539 -5.502 -10.771 1.00 0.00 H new ATOM 0 HE21 GLN T 16 72.124 -2.755 -8.481 1.00 0.00 H new ATOM 0 HE22 GLN T 16 73.406 -3.585 -7.593 1.00 0.00 H new ATOM 254 N LYS T 17 74.602 -4.513 -11.753 1.00 0.00 N ATOM 255 CA LYS T 17 75.936 -4.783 -11.214 1.00 0.00 C ATOM 256 C LYS T 17 77.005 -4.113 -12.074 1.00 0.00 C ATOM 257 O LYS T 17 78.004 -3.609 -11.561 1.00 0.00 O ATOM 258 CB LYS T 17 76.187 -6.292 -11.181 1.00 0.00 C ATOM 259 CG LYS T 17 75.094 -6.974 -10.358 1.00 0.00 C ATOM 260 CD LYS T 17 75.216 -8.492 -10.504 1.00 0.00 C ATOM 261 CE LYS T 17 74.044 -9.170 -9.790 1.00 0.00 C ATOM 262 NZ LYS T 17 74.016 -10.617 -10.147 1.00 0.00 N ATOM 0 H LYS T 17 74.322 -5.131 -12.515 1.00 0.00 H new ATOM 0 HA LYS T 17 75.988 -4.380 -10.203 1.00 0.00 H new ATOM 0 HB2 LYS T 17 76.196 -6.692 -12.195 1.00 0.00 H new ATOM 0 HB3 LYS T 17 77.166 -6.499 -10.748 1.00 0.00 H new ATOM 0 HG2 LYS T 17 75.184 -6.691 -9.309 1.00 0.00 H new ATOM 0 HG3 LYS T 17 74.111 -6.644 -10.694 1.00 0.00 H new ATOM 0 HD2 LYS T 17 75.221 -8.767 -11.559 1.00 0.00 H new ATOM 0 HD3 LYS T 17 76.160 -8.834 -10.081 1.00 0.00 H new ATOM 0 HE2 LYS T 17 74.144 -9.052 -8.711 1.00 0.00 H new ATOM 0 HE3 LYS T 17 73.106 -8.695 -10.077 1.00 0.00 H new ATOM 0 HZ1 LYS T 17 73.220 -11.079 -9.662 1.00 0.00 H new ATOM 0 HZ2 LYS T 17 73.901 -10.719 -11.176 1.00 0.00 H new ATOM 0 HZ3 LYS T 17 74.907 -11.065 -9.852 1.00 0.00 H new ATOM 276 N ASN T 18 76.789 -4.120 -13.386 1.00 0.00 N ATOM 277 CA ASN T 18 77.740 -3.517 -14.314 1.00 0.00 C ATOM 278 C ASN T 18 78.196 -2.149 -13.814 1.00 0.00 C ATOM 279 O ASN T 18 79.305 -1.708 -14.117 1.00 0.00 O ATOM 280 CB ASN T 18 77.097 -3.370 -15.694 1.00 0.00 C ATOM 281 CG ASN T 18 76.912 -4.743 -16.331 1.00 0.00 C ATOM 282 OD1 ASN T 18 76.401 -5.715 -15.629 1.00 0.00 O flip ATOM 283 ND2 ASN T 18 77.241 -4.933 -17.502 1.00 0.00 N flip ATOM 0 H ASN T 18 75.969 -4.534 -13.829 1.00 0.00 H new ATOM 0 HA ASN T 18 78.611 -4.169 -14.383 1.00 0.00 H new ATOM 0 HB2 ASN T 18 76.133 -2.869 -15.604 1.00 0.00 H new ATOM 0 HB3 ASN T 18 77.723 -2.745 -16.331 1.00 0.00 H new ATOM 0 HD21 ASN T 18 77.641 -4.171 -18.050 1.00 0.00 H new ATOM 0 HD22 ASN T 18 77.114 -5.853 -17.925 1.00 0.00 H new ATOM 290 N GLU T 19 77.337 -1.482 -13.050 1.00 0.00 N ATOM 291 CA GLU T 19 77.668 -0.164 -12.516 1.00 0.00 C ATOM 292 C GLU T 19 78.595 -0.301 -11.307 1.00 0.00 C ATOM 293 O GLU T 19 79.621 0.372 -11.222 1.00 0.00 O ATOM 294 CB GLU T 19 76.380 0.587 -12.122 1.00 0.00 C ATOM 295 CG GLU T 19 75.302 -0.416 -11.683 1.00 0.00 C ATOM 296 CD GLU T 19 74.596 -1.001 -12.904 1.00 0.00 C ATOM 297 OE1 GLU T 19 73.789 -0.299 -13.490 1.00 0.00 O ATOM 298 OE2 GLU T 19 74.871 -2.143 -13.234 1.00 0.00 O ATOM 0 H GLU T 19 76.414 -1.828 -12.788 1.00 0.00 H new ATOM 0 HA GLU T 19 78.184 0.408 -13.287 1.00 0.00 H new ATOM 0 HB2 GLU T 19 76.590 1.286 -11.312 1.00 0.00 H new ATOM 0 HB3 GLU T 19 76.019 1.175 -12.966 1.00 0.00 H new ATOM 0 HG2 GLU T 19 75.756 -1.216 -11.099 1.00 0.00 H new ATOM 0 HG3 GLU T 19 74.577 0.078 -11.037 1.00 0.00 H new ATOM 305 N PHE T 20 78.226 -1.176 -10.377 1.00 0.00 N ATOM 306 CA PHE T 20 79.038 -1.386 -9.183 1.00 0.00 C ATOM 307 C PHE T 20 80.401 -1.961 -9.560 1.00 0.00 C ATOM 308 O PHE T 20 81.438 -1.430 -9.167 1.00 0.00 O ATOM 309 CB PHE T 20 78.324 -2.342 -8.222 1.00 0.00 C ATOM 310 CG PHE T 20 77.171 -1.623 -7.554 1.00 0.00 C ATOM 311 CD1 PHE T 20 77.427 -0.567 -6.671 1.00 0.00 C ATOM 312 CD2 PHE T 20 75.850 -2.011 -7.816 1.00 0.00 C ATOM 313 CE1 PHE T 20 76.364 0.100 -6.051 1.00 0.00 C ATOM 314 CE2 PHE T 20 74.788 -1.343 -7.195 1.00 0.00 C ATOM 315 CZ PHE T 20 75.045 -0.287 -6.312 1.00 0.00 C ATOM 0 H PHE T 20 77.381 -1.745 -10.425 1.00 0.00 H new ATOM 0 HA PHE T 20 79.184 -0.424 -8.691 1.00 0.00 H new ATOM 0 HB2 PHE T 20 77.957 -3.213 -8.765 1.00 0.00 H new ATOM 0 HB3 PHE T 20 79.023 -2.707 -7.470 1.00 0.00 H new ATOM 0 HD1 PHE T 20 78.445 -0.267 -6.468 1.00 0.00 H new ATOM 0 HD2 PHE T 20 75.651 -2.825 -8.497 1.00 0.00 H new ATOM 0 HE1 PHE T 20 76.562 0.915 -5.370 1.00 0.00 H new ATOM 0 HE2 PHE T 20 73.770 -1.642 -7.397 1.00 0.00 H new ATOM 0 HZ PHE T 20 74.226 0.228 -5.833 1.00 0.00 H new ATOM 325 N LYS T 21 80.389 -3.048 -10.325 1.00 0.00 N ATOM 326 CA LYS T 21 81.630 -3.685 -10.749 1.00 0.00 C ATOM 327 C LYS T 21 82.532 -2.680 -11.457 1.00 0.00 C ATOM 328 O LYS T 21 83.755 -2.821 -11.456 1.00 0.00 O ATOM 329 CB LYS T 21 81.324 -4.853 -11.688 1.00 0.00 C ATOM 330 CG LYS T 21 80.400 -5.848 -10.983 1.00 0.00 C ATOM 331 CD LYS T 21 80.381 -7.170 -11.755 1.00 0.00 C ATOM 332 CE LYS T 21 79.770 -6.949 -13.140 1.00 0.00 C ATOM 333 NZ LYS T 21 79.394 -8.265 -13.732 1.00 0.00 N ATOM 0 H LYS T 21 79.540 -3.503 -10.662 1.00 0.00 H new ATOM 0 HA LYS T 21 82.146 -4.058 -9.865 1.00 0.00 H new ATOM 0 HB2 LYS T 21 80.853 -4.486 -12.600 1.00 0.00 H new ATOM 0 HB3 LYS T 21 82.249 -5.347 -11.984 1.00 0.00 H new ATOM 0 HG2 LYS T 21 80.742 -6.017 -9.962 1.00 0.00 H new ATOM 0 HG3 LYS T 21 79.392 -5.439 -10.918 1.00 0.00 H new ATOM 0 HD2 LYS T 21 81.394 -7.560 -11.852 1.00 0.00 H new ATOM 0 HD3 LYS T 21 79.804 -7.914 -11.207 1.00 0.00 H new ATOM 0 HE2 LYS T 21 78.892 -6.308 -13.064 1.00 0.00 H new ATOM 0 HE3 LYS T 21 80.483 -6.437 -13.787 1.00 0.00 H new ATOM 0 HZ1 LYS T 21 78.978 -8.116 -14.674 1.00 0.00 H new ATOM 0 HZ2 LYS T 21 80.241 -8.862 -13.818 1.00 0.00 H new ATOM 0 HZ3 LYS T 21 78.700 -8.736 -13.118 1.00 0.00 H new ATOM 347 N ALA T 22 81.923 -1.665 -12.061 1.00 0.00 N ATOM 348 CA ALA T 22 82.685 -0.642 -12.768 1.00 0.00 C ATOM 349 C ALA T 22 83.345 0.311 -11.777 1.00 0.00 C ATOM 350 O ALA T 22 84.400 0.879 -12.055 1.00 0.00 O ATOM 351 CB ALA T 22 81.766 0.145 -13.703 1.00 0.00 C ATOM 0 H ALA T 22 80.912 -1.529 -12.076 1.00 0.00 H new ATOM 0 HA ALA T 22 83.460 -1.134 -13.355 1.00 0.00 H new ATOM 0 HB1 ALA T 22 82.345 0.906 -14.226 1.00 0.00 H new ATOM 0 HB2 ALA T 22 81.319 -0.533 -14.429 1.00 0.00 H new ATOM 0 HB3 ALA T 22 80.979 0.624 -13.121 1.00 0.00 H new ATOM 357 N ALA T 23 82.716 0.479 -10.618 1.00 0.00 N ATOM 358 CA ALA T 23 83.253 1.365 -9.591 1.00 0.00 C ATOM 359 C ALA T 23 84.631 0.889 -9.143 1.00 0.00 C ATOM 360 O ALA T 23 85.591 1.660 -9.134 1.00 0.00 O ATOM 361 CB ALA T 23 82.309 1.404 -8.388 1.00 0.00 C ATOM 0 H ALA T 23 81.841 0.018 -10.368 1.00 0.00 H new ATOM 0 HA ALA T 23 83.345 2.366 -10.012 1.00 0.00 H new ATOM 0 HB1 ALA T 23 82.718 2.068 -7.626 1.00 0.00 H new ATOM 0 HB2 ALA T 23 81.333 1.771 -8.704 1.00 0.00 H new ATOM 0 HB3 ALA T 23 82.203 0.400 -7.976 1.00 0.00 H new ATOM 367 N PHE T 24 84.721 -0.386 -8.772 1.00 0.00 N ATOM 368 CA PHE T 24 85.989 -0.956 -8.325 1.00 0.00 C ATOM 369 C PHE T 24 87.127 -0.519 -9.242 1.00 0.00 C ATOM 370 O PHE T 24 88.156 -0.027 -8.780 1.00 0.00 O ATOM 371 CB PHE T 24 85.901 -2.484 -8.313 1.00 0.00 C ATOM 372 CG PHE T 24 85.031 -2.931 -7.163 1.00 0.00 C ATOM 373 CD1 PHE T 24 83.641 -2.992 -7.319 1.00 0.00 C ATOM 374 CD2 PHE T 24 85.614 -3.283 -5.939 1.00 0.00 C ATOM 375 CE1 PHE T 24 82.834 -3.405 -6.252 1.00 0.00 C ATOM 376 CE2 PHE T 24 84.808 -3.696 -4.873 1.00 0.00 C ATOM 377 CZ PHE T 24 83.417 -3.757 -5.030 1.00 0.00 C ATOM 0 H PHE T 24 83.938 -1.039 -8.772 1.00 0.00 H new ATOM 0 HA PHE T 24 86.191 -0.595 -7.316 1.00 0.00 H new ATOM 0 HB2 PHE T 24 85.488 -2.842 -9.256 1.00 0.00 H new ATOM 0 HB3 PHE T 24 86.898 -2.915 -8.218 1.00 0.00 H new ATOM 0 HD1 PHE T 24 83.191 -2.720 -8.263 1.00 0.00 H new ATOM 0 HD2 PHE T 24 86.686 -3.236 -5.818 1.00 0.00 H new ATOM 0 HE1 PHE T 24 81.762 -3.452 -6.372 1.00 0.00 H new ATOM 0 HE2 PHE T 24 85.258 -3.968 -3.929 1.00 0.00 H new ATOM 0 HZ PHE T 24 82.795 -4.076 -4.207 1.00 0.00 H new ATOM 387 N ASP T 25 86.933 -0.701 -10.544 1.00 0.00 N ATOM 388 CA ASP T 25 87.950 -0.318 -11.517 1.00 0.00 C ATOM 389 C ASP T 25 88.477 1.080 -11.215 1.00 0.00 C ATOM 390 O ASP T 25 89.666 1.355 -11.375 1.00 0.00 O ATOM 391 CB ASP T 25 87.362 -0.352 -12.928 1.00 0.00 C ATOM 392 CG ASP T 25 86.614 -1.661 -13.150 1.00 0.00 C ATOM 393 OD1 ASP T 25 86.567 -2.458 -12.228 1.00 0.00 O ATOM 394 OD2 ASP T 25 86.098 -1.849 -14.240 1.00 0.00 O ATOM 0 H ASP T 25 86.089 -1.108 -10.947 1.00 0.00 H new ATOM 0 HA ASP T 25 88.775 -1.027 -11.452 1.00 0.00 H new ATOM 0 HB2 ASP T 25 86.686 0.491 -13.069 1.00 0.00 H new ATOM 0 HB3 ASP T 25 88.158 -0.249 -13.665 1.00 0.00 H new ATOM 399 N ILE T 26 87.583 1.961 -10.776 1.00 0.00 N ATOM 400 CA ILE T 26 87.969 3.330 -10.453 1.00 0.00 C ATOM 401 C ILE T 26 88.800 3.364 -9.175 1.00 0.00 C ATOM 402 O ILE T 26 89.708 4.184 -9.035 1.00 0.00 O ATOM 403 CB ILE T 26 86.719 4.198 -10.277 1.00 0.00 C ATOM 404 CG1 ILE T 26 85.716 3.895 -11.397 1.00 0.00 C ATOM 405 CG2 ILE T 26 87.108 5.677 -10.325 1.00 0.00 C ATOM 406 CD1 ILE T 26 86.410 3.979 -12.761 1.00 0.00 C ATOM 0 H ILE T 26 86.594 1.754 -10.637 1.00 0.00 H new ATOM 0 HA ILE T 26 88.570 3.722 -11.274 1.00 0.00 H new ATOM 0 HB ILE T 26 86.261 3.975 -9.313 1.00 0.00 H new ATOM 0 HG12 ILE T 26 85.291 2.901 -11.257 1.00 0.00 H new ATOM 0 HG13 ILE T 26 84.889 4.604 -11.357 1.00 0.00 H new ATOM 0 HG21 ILE T 26 86.217 6.292 -10.200 1.00 0.00 H new ATOM 0 HG22 ILE T 26 87.814 5.894 -9.523 1.00 0.00 H new ATOM 0 HG23 ILE T 26 87.571 5.901 -11.286 1.00 0.00 H new ATOM 0 HD11 ILE T 26 85.690 3.762 -13.550 1.00 0.00 H new ATOM 0 HD12 ILE T 26 86.813 4.982 -12.903 1.00 0.00 H new ATOM 0 HD13 ILE T 26 87.222 3.253 -12.802 1.00 0.00 H new ATOM 418 N PHE T 27 88.486 2.469 -8.245 1.00 0.00 N ATOM 419 CA PHE T 27 89.213 2.405 -6.982 1.00 0.00 C ATOM 420 C PHE T 27 90.556 1.705 -7.179 1.00 0.00 C ATOM 421 O PHE T 27 91.613 2.321 -7.040 1.00 0.00 O ATOM 422 CB PHE T 27 88.387 1.647 -5.938 1.00 0.00 C ATOM 423 CG PHE T 27 87.248 2.517 -5.458 1.00 0.00 C ATOM 424 CD1 PHE T 27 87.470 3.469 -4.455 1.00 0.00 C ATOM 425 CD2 PHE T 27 85.971 2.372 -6.012 1.00 0.00 C ATOM 426 CE1 PHE T 27 86.415 4.274 -4.008 1.00 0.00 C ATOM 427 CE2 PHE T 27 84.917 3.177 -5.565 1.00 0.00 C ATOM 428 CZ PHE T 27 85.139 4.128 -4.563 1.00 0.00 C ATOM 0 H PHE T 27 87.738 1.782 -8.340 1.00 0.00 H new ATOM 0 HA PHE T 27 89.390 3.422 -6.632 1.00 0.00 H new ATOM 0 HB2 PHE T 27 87.996 0.725 -6.369 1.00 0.00 H new ATOM 0 HB3 PHE T 27 89.019 1.363 -5.097 1.00 0.00 H new ATOM 0 HD1 PHE T 27 88.455 3.582 -4.026 1.00 0.00 H new ATOM 0 HD2 PHE T 27 85.799 1.638 -6.785 1.00 0.00 H new ATOM 0 HE1 PHE T 27 86.586 5.008 -3.234 1.00 0.00 H new ATOM 0 HE2 PHE T 27 83.932 3.064 -5.994 1.00 0.00 H new ATOM 0 HZ PHE T 27 84.326 4.749 -4.218 1.00 0.00 H new ATOM 438 N VAL T 28 90.506 0.416 -7.503 1.00 0.00 N ATOM 439 CA VAL T 28 91.723 -0.359 -7.718 1.00 0.00 C ATOM 440 C VAL T 28 92.270 -0.120 -9.122 1.00 0.00 C ATOM 441 O VAL T 28 92.460 -1.060 -9.892 1.00 0.00 O ATOM 442 CB VAL T 28 91.435 -1.850 -7.531 1.00 0.00 C ATOM 443 CG1 VAL T 28 91.208 -2.146 -6.048 1.00 0.00 C ATOM 444 CG2 VAL T 28 90.181 -2.228 -8.322 1.00 0.00 C ATOM 0 H VAL T 28 89.641 -0.111 -7.622 1.00 0.00 H new ATOM 0 HA VAL T 28 92.467 -0.038 -6.989 1.00 0.00 H new ATOM 0 HB VAL T 28 92.284 -2.431 -7.891 1.00 0.00 H new ATOM 0 HG11 VAL T 28 91.003 -3.208 -5.916 1.00 0.00 H new ATOM 0 HG12 VAL T 28 92.100 -1.876 -5.482 1.00 0.00 H new ATOM 0 HG13 VAL T 28 90.359 -1.565 -5.687 1.00 0.00 H new ATOM 0 HG21 VAL T 28 89.974 -3.290 -8.190 1.00 0.00 H new ATOM 0 HG22 VAL T 28 89.334 -1.646 -7.961 1.00 0.00 H new ATOM 0 HG23 VAL T 28 90.341 -2.018 -9.380 1.00 0.00 H new ATOM 454 N LEU T 29 92.520 1.145 -9.448 1.00 0.00 N ATOM 455 CA LEU T 29 93.044 1.498 -10.766 1.00 0.00 C ATOM 456 C LEU T 29 94.561 1.309 -10.806 1.00 0.00 C ATOM 457 O LEU T 29 95.255 1.951 -11.595 1.00 0.00 O ATOM 458 CB LEU T 29 92.681 2.956 -11.109 1.00 0.00 C ATOM 459 CG LEU T 29 92.746 3.831 -9.851 1.00 0.00 C ATOM 460 CD1 LEU T 29 94.111 3.681 -9.175 1.00 0.00 C ATOM 461 CD2 LEU T 29 92.537 5.295 -10.248 1.00 0.00 C ATOM 0 H LEU T 29 92.370 1.938 -8.824 1.00 0.00 H new ATOM 0 HA LEU T 29 92.592 0.839 -11.507 1.00 0.00 H new ATOM 0 HB2 LEU T 29 93.367 3.341 -11.864 1.00 0.00 H new ATOM 0 HB3 LEU T 29 91.680 2.997 -11.538 1.00 0.00 H new ATOM 0 HG LEU T 29 91.968 3.517 -9.155 1.00 0.00 H new ATOM 0 HD11 LEU T 29 94.146 4.307 -8.283 1.00 0.00 H new ATOM 0 HD12 LEU T 29 94.265 2.639 -8.894 1.00 0.00 H new ATOM 0 HD13 LEU T 29 94.895 3.990 -9.866 1.00 0.00 H new ATOM 0 HD21 LEU T 29 92.582 5.923 -9.358 1.00 0.00 H new ATOM 0 HD22 LEU T 29 93.318 5.598 -10.946 1.00 0.00 H new ATOM 0 HD23 LEU T 29 91.562 5.408 -10.723 1.00 0.00 H new ATOM 473 N GLY T 30 95.067 0.424 -9.953 1.00 0.00 N ATOM 474 CA GLY T 30 96.502 0.162 -9.904 1.00 0.00 C ATOM 475 C GLY T 30 96.837 -0.854 -8.817 1.00 0.00 C ATOM 476 O GLY T 30 97.921 -1.437 -8.814 1.00 0.00 O ATOM 0 H GLY T 30 94.512 -0.119 -9.292 1.00 0.00 H new ATOM 0 HA2 GLY T 30 96.840 -0.210 -10.871 1.00 0.00 H new ATOM 0 HA3 GLY T 30 97.039 1.092 -9.715 1.00 0.00 H new ATOM 480 N ALA T 31 95.903 -1.059 -7.894 1.00 0.00 N ATOM 481 CA ALA T 31 96.116 -2.006 -6.806 1.00 0.00 C ATOM 482 C ALA T 31 96.534 -3.367 -7.357 1.00 0.00 C ATOM 483 O ALA T 31 95.901 -3.900 -8.268 1.00 0.00 O ATOM 484 CB ALA T 31 94.835 -2.156 -5.983 1.00 0.00 C ATOM 0 H ALA T 31 94.999 -0.587 -7.877 1.00 0.00 H new ATOM 0 HA ALA T 31 96.912 -1.624 -6.167 1.00 0.00 H new ATOM 0 HB1 ALA T 31 95.004 -2.865 -5.173 1.00 0.00 H new ATOM 0 HB2 ALA T 31 94.555 -1.189 -5.566 1.00 0.00 H new ATOM 0 HB3 ALA T 31 94.032 -2.521 -6.623 1.00 0.00 H new ATOM 490 N GLU T 32 97.604 -3.922 -6.797 1.00 0.00 N ATOM 491 CA GLU T 32 98.100 -5.221 -7.240 1.00 0.00 C ATOM 492 C GLU T 32 96.969 -6.245 -7.278 1.00 0.00 C ATOM 493 O GLU T 32 96.472 -6.596 -8.348 1.00 0.00 O ATOM 494 CB GLU T 32 99.201 -5.709 -6.298 1.00 0.00 C ATOM 495 CG GLU T 32 100.364 -4.716 -6.314 1.00 0.00 C ATOM 496 CD GLU T 32 101.469 -5.191 -5.377 1.00 0.00 C ATOM 497 OE1 GLU T 32 101.996 -6.266 -5.613 1.00 0.00 O ATOM 498 OE2 GLU T 32 101.772 -4.474 -4.438 1.00 0.00 O ATOM 0 H GLU T 32 98.141 -3.497 -6.041 1.00 0.00 H new ATOM 0 HA GLU T 32 98.506 -5.109 -8.246 1.00 0.00 H new ATOM 0 HB2 GLU T 32 98.810 -5.810 -5.286 1.00 0.00 H new ATOM 0 HB3 GLU T 32 99.547 -6.696 -6.606 1.00 0.00 H new ATOM 0 HG2 GLU T 32 100.753 -4.616 -7.327 1.00 0.00 H new ATOM 0 HG3 GLU T 32 100.015 -3.730 -6.008 1.00 0.00 H new ATOM 505 N ASP T 33 96.568 -6.721 -6.103 1.00 0.00 N ATOM 506 CA ASP T 33 95.496 -7.706 -6.013 1.00 0.00 C ATOM 507 C ASP T 33 94.134 -7.029 -6.147 1.00 0.00 C ATOM 508 O ASP T 33 93.718 -6.660 -7.245 1.00 0.00 O ATOM 509 CB ASP T 33 95.576 -8.445 -4.676 1.00 0.00 C ATOM 510 CG ASP T 33 95.785 -7.449 -3.540 1.00 0.00 C ATOM 511 OD1 ASP T 33 95.579 -6.268 -3.768 1.00 0.00 O ATOM 512 OD2 ASP T 33 96.149 -7.881 -2.458 1.00 0.00 O ATOM 0 H ASP T 33 96.966 -6.443 -5.206 1.00 0.00 H new ATOM 0 HA ASP T 33 95.614 -8.421 -6.828 1.00 0.00 H new ATOM 0 HB2 ASP T 33 94.660 -9.012 -4.509 1.00 0.00 H new ATOM 0 HB3 ASP T 33 96.396 -9.163 -4.697 1.00 0.00 H new ATOM 517 N GLY T 34 93.444 -6.870 -5.022 1.00 0.00 N ATOM 518 CA GLY T 34 92.131 -6.238 -5.025 1.00 0.00 C ATOM 519 C GLY T 34 91.712 -5.847 -3.612 1.00 0.00 C ATOM 520 O GLY T 34 90.959 -6.566 -2.955 1.00 0.00 O ATOM 0 H GLY T 34 93.770 -7.168 -4.103 1.00 0.00 H new ATOM 0 HA2 GLY T 34 92.151 -5.353 -5.661 1.00 0.00 H new ATOM 0 HA3 GLY T 34 91.395 -6.920 -5.451 1.00 0.00 H new ATOM 524 N SER T 35 92.206 -4.700 -3.149 1.00 0.00 N ATOM 525 CA SER T 35 91.882 -4.213 -1.808 1.00 0.00 C ATOM 526 C SER T 35 91.794 -2.690 -1.801 1.00 0.00 C ATOM 527 O SER T 35 92.791 -1.999 -2.015 1.00 0.00 O ATOM 528 CB SER T 35 92.952 -4.666 -0.814 1.00 0.00 C ATOM 529 OG SER T 35 94.231 -4.263 -1.286 1.00 0.00 O ATOM 0 H SER T 35 92.830 -4.092 -3.680 1.00 0.00 H new ATOM 0 HA SER T 35 90.917 -4.626 -1.515 1.00 0.00 H new ATOM 0 HB2 SER T 35 92.760 -4.232 0.167 1.00 0.00 H new ATOM 0 HB3 SER T 35 92.920 -5.749 -0.696 1.00 0.00 H new ATOM 0 HG SER T 35 94.166 -3.371 -1.687 1.00 0.00 H new ATOM 535 N ILE T 36 90.592 -2.173 -1.558 1.00 0.00 N ATOM 536 CA ILE T 36 90.377 -0.729 -1.529 1.00 0.00 C ATOM 537 C ILE T 36 90.725 -0.160 -0.157 1.00 0.00 C ATOM 538 O ILE T 36 89.937 -0.258 0.784 1.00 0.00 O ATOM 539 CB ILE T 36 88.917 -0.414 -1.853 1.00 0.00 C ATOM 540 CG1 ILE T 36 88.524 -1.102 -3.164 1.00 0.00 C ATOM 541 CG2 ILE T 36 88.744 1.099 -2.001 1.00 0.00 C ATOM 542 CD1 ILE T 36 87.027 -0.917 -3.411 1.00 0.00 C ATOM 0 H ILE T 36 89.756 -2.729 -1.379 1.00 0.00 H new ATOM 0 HA ILE T 36 91.026 -0.271 -2.276 1.00 0.00 H new ATOM 0 HB ILE T 36 88.280 -0.777 -1.047 1.00 0.00 H new ATOM 0 HG12 ILE T 36 89.094 -0.682 -3.992 1.00 0.00 H new ATOM 0 HG13 ILE T 36 88.767 -2.164 -3.116 1.00 0.00 H new ATOM 0 HG21 ILE T 36 87.703 1.325 -2.232 1.00 0.00 H new ATOM 0 HG22 ILE T 36 89.024 1.590 -1.069 1.00 0.00 H new ATOM 0 HG23 ILE T 36 89.382 1.461 -2.807 1.00 0.00 H new ATOM 0 HD11 ILE T 36 86.749 -1.407 -4.344 1.00 0.00 H new ATOM 0 HD12 ILE T 36 86.465 -1.358 -2.588 1.00 0.00 H new ATOM 0 HD13 ILE T 36 86.798 0.147 -3.477 1.00 0.00 H new ATOM 554 N SER T 37 91.908 0.438 -0.051 1.00 0.00 N ATOM 555 CA SER T 37 92.351 1.027 1.212 1.00 0.00 C ATOM 556 C SER T 37 91.844 2.459 1.340 1.00 0.00 C ATOM 557 O SER T 37 90.994 2.898 0.565 1.00 0.00 O ATOM 558 CB SER T 37 93.879 1.018 1.282 1.00 0.00 C ATOM 559 OG SER T 37 94.298 1.650 2.484 1.00 0.00 O ATOM 0 H SER T 37 92.574 0.528 -0.818 1.00 0.00 H new ATOM 0 HA SER T 37 91.945 0.434 2.032 1.00 0.00 H new ATOM 0 HB2 SER T 37 94.250 -0.006 1.248 1.00 0.00 H new ATOM 0 HB3 SER T 37 94.297 1.537 0.420 1.00 0.00 H new ATOM 0 HG SER T 37 95.277 1.644 2.533 1.00 0.00 H new ATOM 565 N THR T 38 92.369 3.183 2.323 1.00 0.00 N ATOM 566 CA THR T 38 91.959 4.566 2.546 1.00 0.00 C ATOM 567 C THR T 38 92.667 5.501 1.570 1.00 0.00 C ATOM 568 O THR T 38 92.381 6.698 1.524 1.00 0.00 O ATOM 569 CB THR T 38 92.287 4.983 3.982 1.00 0.00 C ATOM 570 OG1 THR T 38 93.692 5.152 4.114 1.00 0.00 O ATOM 571 CG2 THR T 38 91.809 3.901 4.950 1.00 0.00 C ATOM 0 H THR T 38 93.075 2.839 2.974 1.00 0.00 H new ATOM 0 HA THR T 38 90.884 4.636 2.383 1.00 0.00 H new ATOM 0 HB THR T 38 91.784 5.922 4.213 1.00 0.00 H new ATOM 0 HG1 THR T 38 93.904 5.421 5.032 1.00 0.00 H new ATOM 0 HG21 THR T 38 92.043 4.198 5.972 1.00 0.00 H new ATOM 0 HG22 THR T 38 90.732 3.771 4.847 1.00 0.00 H new ATOM 0 HG23 THR T 38 92.311 2.961 4.722 1.00 0.00 H new ATOM 579 N LYS T 39 93.595 4.949 0.794 1.00 0.00 N ATOM 580 CA LYS T 39 94.342 5.743 -0.177 1.00 0.00 C ATOM 581 C LYS T 39 93.540 5.924 -1.461 1.00 0.00 C ATOM 582 O LYS T 39 93.362 7.043 -1.942 1.00 0.00 O ATOM 583 CB LYS T 39 95.671 5.058 -0.498 1.00 0.00 C ATOM 584 CG LYS T 39 96.408 4.731 0.803 1.00 0.00 C ATOM 585 CD LYS T 39 97.820 4.240 0.479 1.00 0.00 C ATOM 586 CE LYS T 39 98.569 3.940 1.778 1.00 0.00 C ATOM 587 NZ LYS T 39 99.957 3.500 1.460 1.00 0.00 N ATOM 0 H LYS T 39 93.847 3.961 0.818 1.00 0.00 H new ATOM 0 HA LYS T 39 94.532 6.724 0.258 1.00 0.00 H new ATOM 0 HB2 LYS T 39 95.493 4.145 -1.066 1.00 0.00 H new ATOM 0 HB3 LYS T 39 96.285 5.707 -1.122 1.00 0.00 H new ATOM 0 HG2 LYS T 39 96.456 5.615 1.439 1.00 0.00 H new ATOM 0 HG3 LYS T 39 95.865 3.967 1.359 1.00 0.00 H new ATOM 0 HD2 LYS T 39 97.771 3.344 -0.140 1.00 0.00 H new ATOM 0 HD3 LYS T 39 98.356 4.996 -0.096 1.00 0.00 H new ATOM 0 HE2 LYS T 39 98.593 4.828 2.410 1.00 0.00 H new ATOM 0 HE3 LYS T 39 98.049 3.163 2.339 1.00 0.00 H new ATOM 0 HZ1 LYS T 39 100.467 3.296 2.343 1.00 0.00 H new ATOM 0 HZ2 LYS T 39 99.923 2.642 0.873 1.00 0.00 H new ATOM 0 HZ3 LYS T 39 100.450 4.255 0.942 1.00 0.00 H new ATOM 601 N GLU T 40 93.063 4.814 -2.018 1.00 0.00 N ATOM 602 CA GLU T 40 92.287 4.860 -3.253 1.00 0.00 C ATOM 603 C GLU T 40 90.840 5.257 -2.973 1.00 0.00 C ATOM 604 O GLU T 40 90.023 5.337 -3.888 1.00 0.00 O ATOM 605 CB GLU T 40 92.316 3.491 -3.936 1.00 0.00 C ATOM 606 CG GLU T 40 93.748 2.949 -3.937 1.00 0.00 C ATOM 607 CD GLU T 40 94.688 3.965 -4.577 1.00 0.00 C ATOM 608 OE1 GLU T 40 94.411 4.381 -5.690 1.00 0.00 O ATOM 609 OE2 GLU T 40 95.672 4.313 -3.945 1.00 0.00 O ATOM 0 H GLU T 40 93.199 3.878 -1.637 1.00 0.00 H new ATOM 0 HA GLU T 40 92.733 5.608 -3.908 1.00 0.00 H new ATOM 0 HB2 GLU T 40 91.655 2.799 -3.415 1.00 0.00 H new ATOM 0 HB3 GLU T 40 91.947 3.575 -4.958 1.00 0.00 H new ATOM 0 HG2 GLU T 40 94.067 2.738 -2.916 1.00 0.00 H new ATOM 0 HG3 GLU T 40 93.789 2.007 -4.485 1.00 0.00 H new ATOM 616 N LEU T 41 90.529 5.500 -1.704 1.00 0.00 N ATOM 617 CA LEU T 41 89.174 5.883 -1.321 1.00 0.00 C ATOM 618 C LEU T 41 88.919 7.353 -1.660 1.00 0.00 C ATOM 619 O LEU T 41 88.173 7.665 -2.588 1.00 0.00 O ATOM 620 CB LEU T 41 88.974 5.639 0.186 1.00 0.00 C ATOM 621 CG LEU T 41 87.487 5.396 0.519 1.00 0.00 C ATOM 622 CD1 LEU T 41 86.628 6.521 -0.068 1.00 0.00 C ATOM 623 CD2 LEU T 41 87.016 4.036 -0.041 1.00 0.00 C ATOM 0 H LEU T 41 91.190 5.439 -0.929 1.00 0.00 H new ATOM 0 HA LEU T 41 88.462 5.275 -1.879 1.00 0.00 H new ATOM 0 HB2 LEU T 41 89.565 4.778 0.499 1.00 0.00 H new ATOM 0 HB3 LEU T 41 89.340 6.498 0.748 1.00 0.00 H new ATOM 0 HG LEU T 41 87.376 5.384 1.603 1.00 0.00 H new ATOM 0 HD11 LEU T 41 85.580 6.341 0.172 1.00 0.00 H new ATOM 0 HD12 LEU T 41 86.939 7.476 0.357 1.00 0.00 H new ATOM 0 HD13 LEU T 41 86.753 6.547 -1.150 1.00 0.00 H new ATOM 0 HD21 LEU T 41 85.965 3.885 0.205 1.00 0.00 H new ATOM 0 HD22 LEU T 41 87.140 4.026 -1.124 1.00 0.00 H new ATOM 0 HD23 LEU T 41 87.610 3.236 0.400 1.00 0.00 H new ATOM 635 N GLY T 42 89.539 8.248 -0.898 1.00 0.00 N ATOM 636 CA GLY T 42 89.367 9.680 -1.121 1.00 0.00 C ATOM 637 C GLY T 42 89.571 10.042 -2.589 1.00 0.00 C ATOM 638 O GLY T 42 88.780 10.786 -3.169 1.00 0.00 O ATOM 0 H GLY T 42 90.161 8.010 -0.126 1.00 0.00 H new ATOM 0 HA2 GLY T 42 88.368 9.982 -0.805 1.00 0.00 H new ATOM 0 HA3 GLY T 42 90.076 10.234 -0.506 1.00 0.00 H new ATOM 642 N LYS T 43 90.639 9.518 -3.181 1.00 0.00 N ATOM 643 CA LYS T 43 90.940 9.798 -4.583 1.00 0.00 C ATOM 644 C LYS T 43 89.677 9.723 -5.438 1.00 0.00 C ATOM 645 O LYS T 43 89.455 10.564 -6.309 1.00 0.00 O ATOM 646 CB LYS T 43 91.973 8.798 -5.106 1.00 0.00 C ATOM 647 CG LYS T 43 93.341 9.109 -4.494 1.00 0.00 C ATOM 648 CD LYS T 43 94.397 8.188 -5.110 1.00 0.00 C ATOM 649 CE LYS T 43 95.714 8.337 -4.348 1.00 0.00 C ATOM 650 NZ LYS T 43 96.774 7.537 -5.025 1.00 0.00 N ATOM 0 H LYS T 43 91.307 8.902 -2.718 1.00 0.00 H new ATOM 0 HA LYS T 43 91.344 10.808 -4.648 1.00 0.00 H new ATOM 0 HB2 LYS T 43 91.672 7.782 -4.852 1.00 0.00 H new ATOM 0 HB3 LYS T 43 92.029 8.852 -6.193 1.00 0.00 H new ATOM 0 HG2 LYS T 43 93.603 10.152 -4.674 1.00 0.00 H new ATOM 0 HG3 LYS T 43 93.308 8.970 -3.413 1.00 0.00 H new ATOM 0 HD2 LYS T 43 94.058 7.153 -5.072 1.00 0.00 H new ATOM 0 HD3 LYS T 43 94.543 8.437 -6.161 1.00 0.00 H new ATOM 0 HE2 LYS T 43 96.006 9.386 -4.307 1.00 0.00 H new ATOM 0 HE3 LYS T 43 95.591 8.000 -3.319 1.00 0.00 H new ATOM 0 HZ1 LYS T 43 97.670 7.638 -4.507 1.00 0.00 H new ATOM 0 HZ2 LYS T 43 96.495 6.535 -5.042 1.00 0.00 H new ATOM 0 HZ3 LYS T 43 96.897 7.878 -6.000 1.00 0.00 H new ATOM 664 N VAL T 44 88.855 8.710 -5.188 1.00 0.00 N ATOM 665 CA VAL T 44 87.620 8.537 -5.945 1.00 0.00 C ATOM 666 C VAL T 44 86.549 9.509 -5.459 1.00 0.00 C ATOM 667 O VAL T 44 85.876 10.158 -6.260 1.00 0.00 O ATOM 668 CB VAL T 44 87.117 7.098 -5.800 1.00 0.00 C ATOM 669 CG1 VAL T 44 85.766 6.951 -6.503 1.00 0.00 C ATOM 670 CG2 VAL T 44 88.126 6.142 -6.439 1.00 0.00 C ATOM 0 H VAL T 44 89.019 8.001 -4.473 1.00 0.00 H new ATOM 0 HA VAL T 44 87.827 8.744 -6.995 1.00 0.00 H new ATOM 0 HB VAL T 44 87.003 6.860 -4.742 1.00 0.00 H new ATOM 0 HG11 VAL T 44 85.411 5.926 -6.398 1.00 0.00 H new ATOM 0 HG12 VAL T 44 85.045 7.633 -6.052 1.00 0.00 H new ATOM 0 HG13 VAL T 44 85.878 7.189 -7.561 1.00 0.00 H new ATOM 0 HG21 VAL T 44 87.771 5.117 -6.337 1.00 0.00 H new ATOM 0 HG22 VAL T 44 88.238 6.384 -7.496 1.00 0.00 H new ATOM 0 HG23 VAL T 44 89.090 6.243 -5.940 1.00 0.00 H new ATOM 680 N MET T 45 86.395 9.606 -4.142 1.00 0.00 N ATOM 681 CA MET T 45 85.401 10.503 -3.563 1.00 0.00 C ATOM 682 C MET T 45 85.841 11.957 -3.705 1.00 0.00 C ATOM 683 O MET T 45 85.146 12.871 -3.261 1.00 0.00 O ATOM 684 CB MET T 45 85.195 10.174 -2.083 1.00 0.00 C ATOM 685 CG MET T 45 84.543 8.796 -1.949 1.00 0.00 C ATOM 686 SD MET T 45 84.019 8.541 -0.236 1.00 0.00 S ATOM 687 CE MET T 45 82.356 9.234 -0.400 1.00 0.00 C ATOM 0 H MET T 45 86.941 9.079 -3.460 1.00 0.00 H new ATOM 0 HA MET T 45 84.462 10.365 -4.099 1.00 0.00 H new ATOM 0 HB2 MET T 45 86.152 10.187 -1.561 1.00 0.00 H new ATOM 0 HB3 MET T 45 84.566 10.932 -1.616 1.00 0.00 H new ATOM 0 HG2 MET T 45 83.686 8.721 -2.618 1.00 0.00 H new ATOM 0 HG3 MET T 45 85.247 8.018 -2.245 1.00 0.00 H new ATOM 0 HE1 MET T 45 81.842 9.177 0.559 1.00 0.00 H new ATOM 0 HE2 MET T 45 82.425 10.276 -0.714 1.00 0.00 H new ATOM 0 HE3 MET T 45 81.797 8.667 -1.145 1.00 0.00 H new ATOM 697 N ARG T 46 86.997 12.164 -4.327 1.00 0.00 N ATOM 698 CA ARG T 46 87.518 13.513 -4.521 1.00 0.00 C ATOM 699 C ARG T 46 86.814 14.197 -5.688 1.00 0.00 C ATOM 700 O ARG T 46 86.627 15.415 -5.685 1.00 0.00 O ATOM 701 CB ARG T 46 89.023 13.459 -4.792 1.00 0.00 C ATOM 702 CG ARG T 46 89.567 14.882 -4.928 1.00 0.00 C ATOM 703 CD ARG T 46 91.096 14.853 -4.879 1.00 0.00 C ATOM 704 NE ARG T 46 91.632 16.192 -5.094 1.00 0.00 N ATOM 705 CZ ARG T 46 92.895 16.480 -4.800 1.00 0.00 C ATOM 706 NH1 ARG T 46 93.679 15.558 -4.312 1.00 0.00 N ATOM 707 NH2 ARG T 46 93.353 17.687 -5.000 1.00 0.00 N ATOM 0 H ARG T 46 87.587 11.422 -4.703 1.00 0.00 H new ATOM 0 HA ARG T 46 87.333 14.087 -3.613 1.00 0.00 H new ATOM 0 HB2 ARG T 46 89.531 12.940 -3.980 1.00 0.00 H new ATOM 0 HB3 ARG T 46 89.219 12.894 -5.703 1.00 0.00 H new ATOM 0 HG2 ARG T 46 89.231 15.322 -5.867 1.00 0.00 H new ATOM 0 HG3 ARG T 46 89.179 15.509 -4.125 1.00 0.00 H new ATOM 0 HD2 ARG T 46 91.429 14.471 -3.914 1.00 0.00 H new ATOM 0 HD3 ARG T 46 91.479 14.173 -5.640 1.00 0.00 H new ATOM 0 HE ARG T 46 91.027 16.919 -5.476 1.00 0.00 H new ATOM 0 HH11 ARG T 46 93.322 14.615 -4.156 1.00 0.00 H new ATOM 0 HH12 ARG T 46 94.649 15.780 -4.087 1.00 0.00 H new ATOM 0 HH21 ARG T 46 92.741 18.408 -5.382 1.00 0.00 H new ATOM 0 HH22 ARG T 46 94.323 17.908 -4.774 1.00 0.00 H new ATOM 721 N MET T 47 86.427 13.409 -6.685 1.00 0.00 N ATOM 722 CA MET T 47 85.745 13.952 -7.854 1.00 0.00 C ATOM 723 C MET T 47 84.380 14.513 -7.468 1.00 0.00 C ATOM 724 O MET T 47 83.929 15.514 -8.024 1.00 0.00 O ATOM 725 CB MET T 47 85.570 12.860 -8.911 1.00 0.00 C ATOM 726 CG MET T 47 86.935 12.265 -9.262 1.00 0.00 C ATOM 727 SD MET T 47 86.792 11.276 -10.771 1.00 0.00 S ATOM 728 CE MET T 47 85.691 10.003 -10.104 1.00 0.00 C ATOM 0 H MET T 47 86.572 12.400 -6.708 1.00 0.00 H new ATOM 0 HA MET T 47 86.353 14.759 -8.263 1.00 0.00 H new ATOM 0 HB2 MET T 47 84.907 12.080 -8.537 1.00 0.00 H new ATOM 0 HB3 MET T 47 85.102 13.275 -9.804 1.00 0.00 H new ATOM 0 HG2 MET T 47 87.665 13.062 -9.404 1.00 0.00 H new ATOM 0 HG3 MET T 47 87.295 11.645 -8.441 1.00 0.00 H new ATOM 0 HE1 MET T 47 85.773 9.099 -10.707 1.00 0.00 H new ATOM 0 HE2 MET T 47 85.974 9.780 -9.075 1.00 0.00 H new ATOM 0 HE3 MET T 47 84.662 10.363 -10.127 1.00 0.00 H new ATOM 738 N LEU T 48 83.726 13.860 -6.512 1.00 0.00 N ATOM 739 CA LEU T 48 82.411 14.303 -6.060 1.00 0.00 C ATOM 740 C LEU T 48 82.504 15.696 -5.442 1.00 0.00 C ATOM 741 O LEU T 48 82.130 16.689 -6.067 1.00 0.00 O ATOM 742 CB LEU T 48 81.850 13.314 -5.030 1.00 0.00 C ATOM 743 CG LEU T 48 81.311 12.068 -5.741 1.00 0.00 C ATOM 744 CD1 LEU T 48 82.412 11.448 -6.608 1.00 0.00 C ATOM 745 CD2 LEU T 48 80.848 11.049 -4.696 1.00 0.00 C ATOM 0 H LEU T 48 84.081 13.029 -6.039 1.00 0.00 H new ATOM 0 HA LEU T 48 81.742 14.343 -6.920 1.00 0.00 H new ATOM 0 HB2 LEU T 48 82.630 13.031 -4.323 1.00 0.00 H new ATOM 0 HB3 LEU T 48 81.055 13.787 -4.455 1.00 0.00 H new ATOM 0 HG LEU T 48 80.471 12.349 -6.376 1.00 0.00 H new ATOM 0 HD11 LEU T 48 82.024 10.563 -7.111 1.00 0.00 H new ATOM 0 HD12 LEU T 48 82.741 12.173 -7.352 1.00 0.00 H new ATOM 0 HD13 LEU T 48 83.256 11.166 -5.978 1.00 0.00 H new ATOM 0 HD21 LEU T 48 80.464 10.161 -5.199 1.00 0.00 H new ATOM 0 HD22 LEU T 48 81.689 10.771 -4.061 1.00 0.00 H new ATOM 0 HD23 LEU T 48 80.061 11.488 -4.083 1.00 0.00 H new ATOM 757 N GLY T 49 83.005 15.761 -4.212 1.00 0.00 N ATOM 758 CA GLY T 49 83.141 17.039 -3.522 1.00 0.00 C ATOM 759 C GLY T 49 83.393 16.830 -2.033 1.00 0.00 C ATOM 760 O GLY T 49 82.696 17.395 -1.190 1.00 0.00 O ATOM 0 H GLY T 49 83.321 14.952 -3.677 1.00 0.00 H new ATOM 0 HA2 GLY T 49 83.963 17.606 -3.958 1.00 0.00 H new ATOM 0 HA3 GLY T 49 82.236 17.630 -3.662 1.00 0.00 H new ATOM 764 N GLN T 50 84.397 16.012 -1.715 1.00 0.00 N ATOM 765 CA GLN T 50 84.744 15.727 -0.321 1.00 0.00 C ATOM 766 C GLN T 50 86.260 15.663 -0.156 1.00 0.00 C ATOM 767 O GLN T 50 86.984 15.356 -1.103 1.00 0.00 O ATOM 768 CB GLN T 50 84.131 14.392 0.108 1.00 0.00 C ATOM 769 CG GLN T 50 82.638 14.381 -0.227 1.00 0.00 C ATOM 770 CD GLN T 50 81.933 15.528 0.487 1.00 0.00 C ATOM 771 OE1 GLN T 50 81.014 16.134 -0.066 1.00 0.00 O ATOM 772 NE2 GLN T 50 82.311 15.867 1.689 1.00 0.00 N ATOM 0 H GLN T 50 84.983 15.536 -2.401 1.00 0.00 H new ATOM 0 HA GLN T 50 84.349 16.527 0.305 1.00 0.00 H new ATOM 0 HB2 GLN T 50 84.634 13.569 -0.400 1.00 0.00 H new ATOM 0 HB3 GLN T 50 84.275 14.241 1.178 1.00 0.00 H new ATOM 0 HG2 GLN T 50 82.498 14.472 -1.304 1.00 0.00 H new ATOM 0 HG3 GLN T 50 82.197 13.430 0.072 1.00 0.00 H new ATOM 0 HE21 GLN T 50 83.072 15.364 2.145 1.00 0.00 H new ATOM 0 HE22 GLN T 50 81.845 16.635 2.172 1.00 0.00 H new ATOM 781 N ASN T 51 86.732 15.952 1.052 1.00 0.00 N ATOM 782 CA ASN T 51 88.165 15.922 1.326 1.00 0.00 C ATOM 783 C ASN T 51 88.426 15.850 2.828 1.00 0.00 C ATOM 784 O ASN T 51 89.067 16.733 3.399 1.00 0.00 O ATOM 785 CB ASN T 51 88.831 17.172 0.750 1.00 0.00 C ATOM 786 CG ASN T 51 90.348 17.018 0.786 1.00 0.00 C ATOM 787 OD1 ASN T 51 90.987 16.698 -0.306 1.00 0.00 O flip ATOM 788 ND2 ASN T 51 90.966 17.193 1.836 1.00 0.00 N flip ATOM 0 H ASN T 51 86.150 16.207 1.850 1.00 0.00 H new ATOM 0 HA ASN T 51 88.586 15.034 0.855 1.00 0.00 H new ATOM 0 HB2 ASN T 51 88.498 17.332 -0.275 1.00 0.00 H new ATOM 0 HB3 ASN T 51 88.533 18.050 1.323 1.00 0.00 H new ATOM 0 HD21 ASN T 51 90.464 17.443 2.688 1.00 0.00 H new ATOM 0 HD22 ASN T 51 91.980 17.088 1.854 1.00 0.00 H new ATOM 795 N PRO T 52 87.945 14.820 3.472 1.00 0.00 N ATOM 796 CA PRO T 52 88.130 14.625 4.940 1.00 0.00 C ATOM 797 C PRO T 52 89.539 14.140 5.279 1.00 0.00 C ATOM 798 O PRO T 52 90.398 14.040 4.403 1.00 0.00 O ATOM 799 CB PRO T 52 87.077 13.566 5.285 1.00 0.00 C ATOM 800 CG PRO T 52 86.943 12.750 4.038 1.00 0.00 C ATOM 801 CD PRO T 52 87.169 13.720 2.870 1.00 0.00 C ATOM 0 HA PRO T 52 88.013 15.550 5.505 1.00 0.00 H new ATOM 0 HB2 PRO T 52 87.393 12.952 6.129 1.00 0.00 H new ATOM 0 HB3 PRO T 52 86.128 14.025 5.563 1.00 0.00 H new ATOM 0 HG2 PRO T 52 87.674 11.942 4.021 1.00 0.00 H new ATOM 0 HG3 PRO T 52 85.957 12.290 3.977 1.00 0.00 H new ATOM 0 HD2 PRO T 52 87.715 13.245 2.055 1.00 0.00 H new ATOM 0 HD3 PRO T 52 86.225 14.076 2.457 1.00 0.00 H new ATOM 809 N THR T 53 89.765 13.838 6.554 1.00 0.00 N ATOM 810 CA THR T 53 91.072 13.361 6.999 1.00 0.00 C ATOM 811 C THR T 53 91.221 11.867 6.698 1.00 0.00 C ATOM 812 O THR T 53 90.227 11.142 6.652 1.00 0.00 O ATOM 813 CB THR T 53 91.229 13.598 8.510 1.00 0.00 C ATOM 814 OG1 THR T 53 92.082 12.604 9.060 1.00 0.00 O ATOM 815 CG2 THR T 53 89.861 13.524 9.189 1.00 0.00 C ATOM 0 H THR T 53 89.066 13.914 7.293 1.00 0.00 H new ATOM 0 HA THR T 53 91.845 13.912 6.463 1.00 0.00 H new ATOM 0 HB THR T 53 91.662 14.584 8.676 1.00 0.00 H new ATOM 0 HG1 THR T 53 92.183 12.756 10.023 1.00 0.00 H new ATOM 0 HG21 THR T 53 89.977 13.692 10.260 1.00 0.00 H new ATOM 0 HG22 THR T 53 89.205 14.287 8.770 1.00 0.00 H new ATOM 0 HG23 THR T 53 89.425 12.539 9.022 1.00 0.00 H new ATOM 823 N PRO T 54 92.428 11.390 6.497 1.00 0.00 N ATOM 824 CA PRO T 54 92.676 9.947 6.200 1.00 0.00 C ATOM 825 C PRO T 54 92.459 9.067 7.433 1.00 0.00 C ATOM 826 O PRO T 54 93.128 8.049 7.606 1.00 0.00 O ATOM 827 CB PRO T 54 94.142 9.922 5.746 1.00 0.00 C ATOM 828 CG PRO T 54 94.773 11.085 6.440 1.00 0.00 C ATOM 829 CD PRO T 54 93.687 12.161 6.526 1.00 0.00 C ATOM 0 HA PRO T 54 91.991 9.551 5.450 1.00 0.00 H new ATOM 0 HB2 PRO T 54 94.626 8.985 6.022 1.00 0.00 H new ATOM 0 HB3 PRO T 54 94.223 10.015 4.663 1.00 0.00 H new ATOM 0 HG2 PRO T 54 95.124 10.804 7.433 1.00 0.00 H new ATOM 0 HG3 PRO T 54 95.639 11.447 5.886 1.00 0.00 H new ATOM 0 HD2 PRO T 54 93.776 12.748 7.440 1.00 0.00 H new ATOM 0 HD3 PRO T 54 93.748 12.859 5.691 1.00 0.00 H new ATOM 837 N GLU T 55 91.517 9.471 8.286 1.00 0.00 N ATOM 838 CA GLU T 55 91.211 8.719 9.506 1.00 0.00 C ATOM 839 C GLU T 55 89.707 8.506 9.638 1.00 0.00 C ATOM 840 O GLU T 55 89.258 7.538 10.253 1.00 0.00 O ATOM 841 CB GLU T 55 91.726 9.481 10.729 1.00 0.00 C ATOM 842 CG GLU T 55 91.645 8.579 11.963 1.00 0.00 C ATOM 843 CD GLU T 55 92.106 9.346 13.198 1.00 0.00 C ATOM 844 OE1 GLU T 55 91.741 10.503 13.323 1.00 0.00 O ATOM 845 OE2 GLU T 55 92.817 8.764 14.000 1.00 0.00 O ATOM 0 H GLU T 55 90.954 10.312 8.156 1.00 0.00 H new ATOM 0 HA GLU T 55 91.702 7.748 9.447 1.00 0.00 H new ATOM 0 HB2 GLU T 55 92.755 9.800 10.565 1.00 0.00 H new ATOM 0 HB3 GLU T 55 91.134 10.383 10.885 1.00 0.00 H new ATOM 0 HG2 GLU T 55 90.622 8.230 12.102 1.00 0.00 H new ATOM 0 HG3 GLU T 55 92.267 7.695 11.820 1.00 0.00 H new ATOM 852 N GLU T 56 88.930 9.415 9.055 1.00 0.00 N ATOM 853 CA GLU T 56 87.477 9.315 9.115 1.00 0.00 C ATOM 854 C GLU T 56 86.970 8.293 8.100 1.00 0.00 C ATOM 855 O GLU T 56 85.833 7.829 8.187 1.00 0.00 O ATOM 856 CB GLU T 56 86.846 10.681 8.829 1.00 0.00 C ATOM 857 CG GLU T 56 87.029 11.595 10.043 1.00 0.00 C ATOM 858 CD GLU T 56 86.749 13.043 9.653 1.00 0.00 C ATOM 859 OE1 GLU T 56 87.084 13.410 8.539 1.00 0.00 O ATOM 860 OE2 GLU T 56 86.204 13.762 10.473 1.00 0.00 O ATOM 0 H GLU T 56 89.280 10.223 8.540 1.00 0.00 H new ATOM 0 HA GLU T 56 87.194 8.989 10.116 1.00 0.00 H new ATOM 0 HB2 GLU T 56 87.309 11.130 7.950 1.00 0.00 H new ATOM 0 HB3 GLU T 56 85.786 10.564 8.606 1.00 0.00 H new ATOM 0 HG2 GLU T 56 86.356 11.289 10.844 1.00 0.00 H new ATOM 0 HG3 GLU T 56 88.045 11.503 10.428 1.00 0.00 H new ATOM 867 N LEU T 57 87.822 7.946 7.141 1.00 0.00 N ATOM 868 CA LEU T 57 87.450 6.976 6.117 1.00 0.00 C ATOM 869 C LEU T 57 87.475 5.562 6.686 1.00 0.00 C ATOM 870 O LEU T 57 86.501 4.818 6.569 1.00 0.00 O ATOM 871 CB LEU T 57 88.414 7.066 4.931 1.00 0.00 C ATOM 872 CG LEU T 57 88.508 8.515 4.440 1.00 0.00 C ATOM 873 CD1 LEU T 57 89.616 8.622 3.389 1.00 0.00 C ATOM 874 CD2 LEU T 57 87.170 8.948 3.821 1.00 0.00 C ATOM 0 H LEU T 57 88.767 8.318 7.051 1.00 0.00 H new ATOM 0 HA LEU T 57 86.439 7.205 5.780 1.00 0.00 H new ATOM 0 HB2 LEU T 57 89.401 6.709 5.226 1.00 0.00 H new ATOM 0 HB3 LEU T 57 88.070 6.421 4.122 1.00 0.00 H new ATOM 0 HG LEU T 57 88.737 9.166 5.284 1.00 0.00 H new ATOM 0 HD11 LEU T 57 89.686 9.651 3.037 1.00 0.00 H new ATOM 0 HD12 LEU T 57 90.567 8.324 3.831 1.00 0.00 H new ATOM 0 HD13 LEU T 57 89.385 7.967 2.549 1.00 0.00 H new ATOM 0 HD21 LEU T 57 87.246 9.979 3.475 1.00 0.00 H new ATOM 0 HD22 LEU T 57 86.932 8.299 2.978 1.00 0.00 H new ATOM 0 HD23 LEU T 57 86.382 8.874 4.570 1.00 0.00 H new ATOM 886 N GLN T 58 88.595 5.196 7.303 1.00 0.00 N ATOM 887 CA GLN T 58 88.735 3.866 7.885 1.00 0.00 C ATOM 888 C GLN T 58 87.490 3.504 8.694 1.00 0.00 C ATOM 889 O GLN T 58 87.241 2.332 8.975 1.00 0.00 O ATOM 890 CB GLN T 58 89.980 3.820 8.783 1.00 0.00 C ATOM 891 CG GLN T 58 90.018 2.509 9.584 1.00 0.00 C ATOM 892 CD GLN T 58 89.790 1.314 8.664 1.00 0.00 C ATOM 893 OE1 GLN T 58 88.962 0.452 8.957 1.00 0.00 O ATOM 894 NE2 GLN T 58 90.481 1.208 7.560 1.00 0.00 N ATOM 0 H GLN T 58 89.412 5.796 7.412 1.00 0.00 H new ATOM 0 HA GLN T 58 88.848 3.140 7.080 1.00 0.00 H new ATOM 0 HB2 GLN T 58 90.879 3.906 8.173 1.00 0.00 H new ATOM 0 HB3 GLN T 58 89.975 4.670 9.465 1.00 0.00 H new ATOM 0 HG2 GLN T 58 90.980 2.410 10.086 1.00 0.00 H new ATOM 0 HG3 GLN T 58 89.254 2.528 10.361 1.00 0.00 H new ATOM 0 HE21 GLN T 58 91.167 1.923 7.317 1.00 0.00 H new ATOM 0 HE22 GLN T 58 90.334 0.411 6.941 1.00 0.00 H new ATOM 903 N GLU T 59 86.713 4.518 9.061 1.00 0.00 N ATOM 904 CA GLU T 59 85.498 4.292 9.833 1.00 0.00 C ATOM 905 C GLU T 59 84.433 3.622 8.970 1.00 0.00 C ATOM 906 O GLU T 59 83.668 2.786 9.447 1.00 0.00 O ATOM 907 CB GLU T 59 84.962 5.622 10.367 1.00 0.00 C ATOM 908 CG GLU T 59 86.035 6.302 11.219 1.00 0.00 C ATOM 909 CD GLU T 59 85.416 7.434 12.032 1.00 0.00 C ATOM 910 OE1 GLU T 59 84.345 7.227 12.578 1.00 0.00 O ATOM 911 OE2 GLU T 59 86.022 8.491 12.096 1.00 0.00 O ATOM 0 H GLU T 59 86.901 5.495 8.838 1.00 0.00 H new ATOM 0 HA GLU T 59 85.738 3.636 10.670 1.00 0.00 H new ATOM 0 HB2 GLU T 59 84.677 6.270 9.538 1.00 0.00 H new ATOM 0 HB3 GLU T 59 84.065 5.452 10.962 1.00 0.00 H new ATOM 0 HG2 GLU T 59 86.496 5.574 11.886 1.00 0.00 H new ATOM 0 HG3 GLU T 59 86.826 6.693 10.579 1.00 0.00 H new ATOM 918 N MET T 60 84.393 3.998 7.694 1.00 0.00 N ATOM 919 CA MET T 60 83.420 3.427 6.770 1.00 0.00 C ATOM 920 C MET T 60 83.809 2.000 6.397 1.00 0.00 C ATOM 921 O MET T 60 82.950 1.132 6.249 1.00 0.00 O ATOM 922 CB MET T 60 83.339 4.285 5.504 1.00 0.00 C ATOM 923 CG MET T 60 82.614 5.595 5.815 1.00 0.00 C ATOM 924 SD MET T 60 80.836 5.286 5.940 1.00 0.00 S ATOM 925 CE MET T 60 80.447 5.484 4.185 1.00 0.00 C ATOM 0 H MET T 60 85.018 4.690 7.280 1.00 0.00 H new ATOM 0 HA MET T 60 82.446 3.409 7.260 1.00 0.00 H new ATOM 0 HB2 MET T 60 84.341 4.493 5.129 1.00 0.00 H new ATOM 0 HB3 MET T 60 82.811 3.743 4.719 1.00 0.00 H new ATOM 0 HG2 MET T 60 82.987 6.017 6.748 1.00 0.00 H new ATOM 0 HG3 MET T 60 82.812 6.327 5.033 1.00 0.00 H new ATOM 0 HE1 MET T 60 79.389 5.280 4.022 1.00 0.00 H new ATOM 0 HE2 MET T 60 80.672 6.505 3.875 1.00 0.00 H new ATOM 0 HE3 MET T 60 81.045 4.787 3.599 1.00 0.00 H new ATOM 935 N ILE T 61 85.107 1.768 6.245 1.00 0.00 N ATOM 936 CA ILE T 61 85.598 0.441 5.888 1.00 0.00 C ATOM 937 C ILE T 61 85.562 -0.482 7.105 1.00 0.00 C ATOM 938 O ILE T 61 85.589 -1.704 6.968 1.00 0.00 O ATOM 939 CB ILE T 61 87.034 0.543 5.349 1.00 0.00 C ATOM 940 CG1 ILE T 61 87.021 1.224 3.972 1.00 0.00 C ATOM 941 CG2 ILE T 61 87.639 -0.857 5.206 1.00 0.00 C ATOM 942 CD1 ILE T 61 86.598 2.693 4.102 1.00 0.00 C ATOM 0 H ILE T 61 85.834 2.474 6.362 1.00 0.00 H new ATOM 0 HA ILE T 61 84.954 0.024 5.114 1.00 0.00 H new ATOM 0 HB ILE T 61 87.632 1.129 6.047 1.00 0.00 H new ATOM 0 HG12 ILE T 61 88.011 1.163 3.521 1.00 0.00 H new ATOM 0 HG13 ILE T 61 86.335 0.700 3.307 1.00 0.00 H new ATOM 0 HG21 ILE T 61 88.657 -0.776 4.824 1.00 0.00 H new ATOM 0 HG22 ILE T 61 87.655 -1.348 6.179 1.00 0.00 H new ATOM 0 HG23 ILE T 61 87.037 -1.445 4.513 1.00 0.00 H new ATOM 0 HD11 ILE T 61 86.595 3.159 3.117 1.00 0.00 H new ATOM 0 HD12 ILE T 61 85.598 2.747 4.532 1.00 0.00 H new ATOM 0 HD13 ILE T 61 87.300 3.218 4.749 1.00 0.00 H new ATOM 954 N ASP T 62 85.506 0.110 8.293 1.00 0.00 N ATOM 955 CA ASP T 62 85.474 -0.670 9.526 1.00 0.00 C ATOM 956 C ASP T 62 84.146 -1.408 9.676 1.00 0.00 C ATOM 957 O ASP T 62 84.107 -2.637 9.701 1.00 0.00 O ATOM 958 CB ASP T 62 85.685 0.250 10.729 1.00 0.00 C ATOM 959 CG ASP T 62 85.618 -0.558 12.021 1.00 0.00 C ATOM 960 OD1 ASP T 62 85.609 -1.775 11.934 1.00 0.00 O ATOM 961 OD2 ASP T 62 85.575 0.052 13.077 1.00 0.00 O ATOM 0 H ASP T 62 85.482 1.121 8.429 1.00 0.00 H new ATOM 0 HA ASP T 62 86.276 -1.407 9.481 1.00 0.00 H new ATOM 0 HB2 ASP T 62 86.651 0.748 10.651 1.00 0.00 H new ATOM 0 HB3 ASP T 62 84.924 1.030 10.738 1.00 0.00 H new ATOM 966 N GLU T 63 83.063 -0.646 9.788 1.00 0.00 N ATOM 967 CA GLU T 63 81.734 -1.233 9.950 1.00 0.00 C ATOM 968 C GLU T 63 81.543 -2.437 9.026 1.00 0.00 C ATOM 969 O GLU T 63 81.044 -3.479 9.451 1.00 0.00 O ATOM 970 CB GLU T 63 80.660 -0.173 9.666 1.00 0.00 C ATOM 971 CG GLU T 63 81.107 0.707 8.497 1.00 0.00 C ATOM 972 CD GLU T 63 79.974 1.640 8.084 1.00 0.00 C ATOM 973 OE1 GLU T 63 79.093 1.193 7.370 1.00 0.00 O ATOM 974 OE2 GLU T 63 80.004 2.791 8.490 1.00 0.00 O ATOM 0 H GLU T 63 83.077 0.374 9.770 1.00 0.00 H new ATOM 0 HA GLU T 63 81.637 -1.581 10.978 1.00 0.00 H new ATOM 0 HB2 GLU T 63 79.712 -0.655 9.430 1.00 0.00 H new ATOM 0 HB3 GLU T 63 80.494 0.439 10.553 1.00 0.00 H new ATOM 0 HG2 GLU T 63 81.983 1.289 8.784 1.00 0.00 H new ATOM 0 HG3 GLU T 63 81.401 0.083 7.653 1.00 0.00 H new ATOM 981 N VAL T 64 81.933 -2.291 7.763 1.00 0.00 N ATOM 982 CA VAL T 64 81.785 -3.381 6.801 1.00 0.00 C ATOM 983 C VAL T 64 82.821 -4.473 7.047 1.00 0.00 C ATOM 984 O VAL T 64 82.498 -5.661 7.027 1.00 0.00 O ATOM 985 CB VAL T 64 81.924 -2.855 5.369 1.00 0.00 C ATOM 986 CG1 VAL T 64 80.762 -1.910 5.055 1.00 0.00 C ATOM 987 CG2 VAL T 64 83.250 -2.103 5.220 1.00 0.00 C ATOM 0 H VAL T 64 82.349 -1.440 7.384 1.00 0.00 H new ATOM 0 HA VAL T 64 80.790 -3.807 6.933 1.00 0.00 H new ATOM 0 HB VAL T 64 81.907 -3.695 4.675 1.00 0.00 H new ATOM 0 HG11 VAL T 64 80.862 -1.536 4.036 1.00 0.00 H new ATOM 0 HG12 VAL T 64 79.819 -2.448 5.153 1.00 0.00 H new ATOM 0 HG13 VAL T 64 80.776 -1.072 5.752 1.00 0.00 H new ATOM 0 HG21 VAL T 64 83.345 -1.731 4.200 1.00 0.00 H new ATOM 0 HG22 VAL T 64 83.273 -1.264 5.916 1.00 0.00 H new ATOM 0 HG23 VAL T 64 84.078 -2.778 5.438 1.00 0.00 H new ATOM 997 N ASP T 65 84.067 -4.071 7.276 1.00 0.00 N ATOM 998 CA ASP T 65 85.133 -5.036 7.519 1.00 0.00 C ATOM 999 C ASP T 65 84.809 -5.900 8.732 1.00 0.00 C ATOM 1000 O ASP T 65 85.329 -5.675 9.826 1.00 0.00 O ATOM 1001 CB ASP T 65 86.463 -4.306 7.746 1.00 0.00 C ATOM 1002 CG ASP T 65 87.025 -3.818 6.416 1.00 0.00 C ATOM 1003 OD1 ASP T 65 86.254 -3.704 5.477 1.00 0.00 O ATOM 1004 OD2 ASP T 65 88.218 -3.570 6.353 1.00 0.00 O ATOM 0 H ASP T 65 84.361 -3.095 7.298 1.00 0.00 H new ATOM 0 HA ASP T 65 85.219 -5.679 6.643 1.00 0.00 H new ATOM 0 HB2 ASP T 65 86.313 -3.461 8.418 1.00 0.00 H new ATOM 0 HB3 ASP T 65 87.176 -4.975 8.228 1.00 0.00 H new ATOM 1009 N GLU T 66 83.952 -6.895 8.531 1.00 0.00 N ATOM 1010 CA GLU T 66 83.575 -7.792 9.616 1.00 0.00 C ATOM 1011 C GLU T 66 84.733 -8.724 9.953 1.00 0.00 C ATOM 1012 O GLU T 66 84.838 -9.224 11.073 1.00 0.00 O ATOM 1013 CB GLU T 66 82.350 -8.617 9.213 1.00 0.00 C ATOM 1014 CG GLU T 66 81.104 -7.729 9.234 1.00 0.00 C ATOM 1015 CD GLU T 66 80.708 -7.419 10.674 1.00 0.00 C ATOM 1016 OE1 GLU T 66 80.887 -8.283 11.516 1.00 0.00 O ATOM 1017 OE2 GLU T 66 80.233 -6.321 10.913 1.00 0.00 O ATOM 0 H GLU T 66 83.509 -7.099 7.635 1.00 0.00 H new ATOM 0 HA GLU T 66 83.331 -7.195 10.495 1.00 0.00 H new ATOM 0 HB2 GLU T 66 82.493 -9.037 8.217 1.00 0.00 H new ATOM 0 HB3 GLU T 66 82.223 -9.456 9.897 1.00 0.00 H new ATOM 0 HG2 GLU T 66 81.299 -6.802 8.694 1.00 0.00 H new ATOM 0 HG3 GLU T 66 80.282 -8.229 8.722 1.00 0.00 H new ATOM 1024 N ASP T 67 85.603 -8.951 8.971 1.00 0.00 N ATOM 1025 CA ASP T 67 86.761 -9.822 9.164 1.00 0.00 C ATOM 1026 C ASP T 67 87.936 -9.032 9.729 1.00 0.00 C ATOM 1027 O ASP T 67 88.965 -9.605 10.089 1.00 0.00 O ATOM 1028 CB ASP T 67 87.164 -10.452 7.829 1.00 0.00 C ATOM 1029 CG ASP T 67 87.686 -9.376 6.881 1.00 0.00 C ATOM 1030 OD1 ASP T 67 86.933 -8.466 6.577 1.00 0.00 O ATOM 1031 OD2 ASP T 67 88.831 -9.480 6.474 1.00 0.00 O ATOM 0 H ASP T 67 85.529 -8.546 8.038 1.00 0.00 H new ATOM 0 HA ASP T 67 86.491 -10.606 9.871 1.00 0.00 H new ATOM 0 HB2 ASP T 67 87.932 -11.209 7.991 1.00 0.00 H new ATOM 0 HB3 ASP T 67 86.308 -10.957 7.383 1.00 0.00 H new ATOM 1036 N GLY T 68 87.777 -7.715 9.802 1.00 0.00 N ATOM 1037 CA GLY T 68 88.834 -6.857 10.323 1.00 0.00 C ATOM 1038 C GLY T 68 90.118 -7.029 9.519 1.00 0.00 C ATOM 1039 O GLY T 68 91.019 -7.766 9.920 1.00 0.00 O ATOM 0 H GLY T 68 86.933 -7.222 9.510 1.00 0.00 H new ATOM 0 HA2 GLY T 68 88.514 -5.816 10.287 1.00 0.00 H new ATOM 0 HA3 GLY T 68 89.020 -7.097 11.370 1.00 0.00 H new ATOM 1043 N SER T 69 90.193 -6.346 8.379 1.00 0.00 N ATOM 1044 CA SER T 69 91.371 -6.425 7.512 1.00 0.00 C ATOM 1045 C SER T 69 91.682 -5.062 6.901 1.00 0.00 C ATOM 1046 O SER T 69 92.800 -4.814 6.453 1.00 0.00 O ATOM 1047 CB SER T 69 91.126 -7.440 6.396 1.00 0.00 C ATOM 1048 OG SER T 69 89.917 -7.115 5.723 1.00 0.00 O ATOM 0 H SER T 69 89.455 -5.733 8.033 1.00 0.00 H new ATOM 0 HA SER T 69 92.222 -6.742 8.115 1.00 0.00 H new ATOM 0 HB2 SER T 69 91.960 -7.434 5.694 1.00 0.00 H new ATOM 0 HB3 SER T 69 91.066 -8.446 6.811 1.00 0.00 H new ATOM 0 HG SER T 69 89.332 -7.901 5.704 1.00 0.00 H new ATOM 1054 N GLY T 70 90.685 -4.182 6.887 1.00 0.00 N ATOM 1055 CA GLY T 70 90.868 -2.847 6.328 1.00 0.00 C ATOM 1056 C GLY T 70 90.797 -2.878 4.804 1.00 0.00 C ATOM 1057 O GLY T 70 91.647 -2.306 4.123 1.00 0.00 O ATOM 0 H GLY T 70 89.751 -4.367 7.253 1.00 0.00 H new ATOM 0 HA2 GLY T 70 90.101 -2.177 6.718 1.00 0.00 H new ATOM 0 HA3 GLY T 70 91.831 -2.446 6.643 1.00 0.00 H new ATOM 1061 N THR T 71 89.776 -3.549 4.276 1.00 0.00 N ATOM 1062 CA THR T 71 89.596 -3.653 2.828 1.00 0.00 C ATOM 1063 C THR T 71 88.115 -3.765 2.481 1.00 0.00 C ATOM 1064 O THR T 71 87.273 -3.923 3.364 1.00 0.00 O ATOM 1065 CB THR T 71 90.337 -4.882 2.296 1.00 0.00 C ATOM 1066 OG1 THR T 71 89.794 -6.053 2.888 1.00 0.00 O ATOM 1067 CG2 THR T 71 91.824 -4.777 2.641 1.00 0.00 C ATOM 0 H THR T 71 89.063 -4.028 4.826 1.00 0.00 H new ATOM 0 HA THR T 71 90.002 -2.754 2.365 1.00 0.00 H new ATOM 0 HB THR T 71 90.222 -4.933 1.213 1.00 0.00 H new ATOM 0 HG1 THR T 71 90.047 -6.089 3.834 1.00 0.00 H new ATOM 0 HG21 THR T 71 92.349 -5.654 2.261 1.00 0.00 H new ATOM 0 HG22 THR T 71 92.241 -3.879 2.185 1.00 0.00 H new ATOM 0 HG23 THR T 71 91.944 -4.724 3.723 1.00 0.00 H new ATOM 1075 N VAL T 72 87.801 -3.685 1.189 1.00 0.00 N ATOM 1076 CA VAL T 72 86.413 -3.779 0.732 1.00 0.00 C ATOM 1077 C VAL T 72 86.338 -4.515 -0.602 1.00 0.00 C ATOM 1078 O VAL T 72 86.274 -3.894 -1.662 1.00 0.00 O ATOM 1079 CB VAL T 72 85.818 -2.376 0.576 1.00 0.00 C ATOM 1080 CG1 VAL T 72 84.367 -2.484 0.097 1.00 0.00 C ATOM 1081 CG2 VAL T 72 85.856 -1.656 1.925 1.00 0.00 C ATOM 0 H VAL T 72 88.484 -3.556 0.443 1.00 0.00 H new ATOM 0 HA VAL T 72 85.842 -4.336 1.475 1.00 0.00 H new ATOM 0 HB VAL T 72 86.400 -1.814 -0.155 1.00 0.00 H new ATOM 0 HG11 VAL T 72 83.945 -1.485 -0.014 1.00 0.00 H new ATOM 0 HG12 VAL T 72 84.338 -2.998 -0.864 1.00 0.00 H new ATOM 0 HG13 VAL T 72 83.784 -3.046 0.827 1.00 0.00 H new ATOM 0 HG21 VAL T 72 85.433 -0.657 1.816 1.00 0.00 H new ATOM 0 HG22 VAL T 72 85.274 -2.219 2.655 1.00 0.00 H new ATOM 0 HG23 VAL T 72 86.888 -1.578 2.267 1.00 0.00 H new ATOM 1091 N ASP T 73 86.342 -5.843 -0.540 1.00 0.00 N ATOM 1092 CA ASP T 73 86.270 -6.658 -1.748 1.00 0.00 C ATOM 1093 C ASP T 73 84.821 -6.793 -2.210 1.00 0.00 C ATOM 1094 O ASP T 73 83.892 -6.514 -1.453 1.00 0.00 O ATOM 1095 CB ASP T 73 86.854 -8.046 -1.480 1.00 0.00 C ATOM 1096 CG ASP T 73 86.278 -8.615 -0.189 1.00 0.00 C ATOM 1097 OD1 ASP T 73 85.554 -7.896 0.482 1.00 0.00 O ATOM 1098 OD2 ASP T 73 86.568 -9.761 0.113 1.00 0.00 O ATOM 0 H ASP T 73 86.394 -6.375 0.329 1.00 0.00 H new ATOM 0 HA ASP T 73 86.849 -6.169 -2.531 1.00 0.00 H new ATOM 0 HB2 ASP T 73 86.628 -8.712 -2.313 1.00 0.00 H new ATOM 0 HB3 ASP T 73 87.940 -7.985 -1.407 1.00 0.00 H new ATOM 1103 N PHE T 74 84.638 -7.221 -3.454 1.00 0.00 N ATOM 1104 CA PHE T 74 83.297 -7.387 -4.005 1.00 0.00 C ATOM 1105 C PHE T 74 82.430 -8.234 -3.077 1.00 0.00 C ATOM 1106 O PHE T 74 81.224 -8.364 -3.289 1.00 0.00 O ATOM 1107 CB PHE T 74 83.377 -8.054 -5.380 1.00 0.00 C ATOM 1108 CG PHE T 74 82.022 -8.003 -6.044 1.00 0.00 C ATOM 1109 CD1 PHE T 74 81.593 -6.825 -6.666 1.00 0.00 C ATOM 1110 CD2 PHE T 74 81.194 -9.133 -6.036 1.00 0.00 C ATOM 1111 CE1 PHE T 74 80.337 -6.776 -7.281 1.00 0.00 C ATOM 1112 CE2 PHE T 74 79.938 -9.084 -6.652 1.00 0.00 C ATOM 1113 CZ PHE T 74 79.509 -7.904 -7.274 1.00 0.00 C ATOM 0 H PHE T 74 85.394 -7.458 -4.096 1.00 0.00 H new ATOM 0 HA PHE T 74 82.843 -6.401 -4.103 1.00 0.00 H new ATOM 0 HB2 PHE T 74 84.117 -7.547 -6.000 1.00 0.00 H new ATOM 0 HB3 PHE T 74 83.704 -9.089 -5.276 1.00 0.00 H new ATOM 0 HD1 PHE T 74 82.231 -5.954 -6.671 1.00 0.00 H new ATOM 0 HD2 PHE T 74 81.525 -10.042 -5.555 1.00 0.00 H new ATOM 0 HE1 PHE T 74 80.006 -5.867 -7.761 1.00 0.00 H new ATOM 0 HE2 PHE T 74 79.300 -9.955 -6.648 1.00 0.00 H new ATOM 0 HZ PHE T 74 78.539 -7.865 -7.748 1.00 0.00 H new ATOM 1123 N ASP T 75 83.049 -8.810 -2.053 1.00 0.00 N ATOM 1124 CA ASP T 75 82.320 -9.646 -1.104 1.00 0.00 C ATOM 1125 C ASP T 75 81.557 -8.788 -0.097 1.00 0.00 C ATOM 1126 O ASP T 75 80.404 -8.421 -0.329 1.00 0.00 O ATOM 1127 CB ASP T 75 83.295 -10.560 -0.360 1.00 0.00 C ATOM 1128 CG ASP T 75 83.952 -11.527 -1.339 1.00 0.00 C ATOM 1129 OD1 ASP T 75 84.696 -11.066 -2.189 1.00 0.00 O ATOM 1130 OD2 ASP T 75 83.702 -12.716 -1.225 1.00 0.00 O ATOM 0 H ASP T 75 84.046 -8.715 -1.859 1.00 0.00 H new ATOM 0 HA ASP T 75 81.604 -10.250 -1.661 1.00 0.00 H new ATOM 0 HB2 ASP T 75 84.057 -9.962 0.141 1.00 0.00 H new ATOM 0 HB3 ASP T 75 82.767 -11.116 0.414 1.00 0.00 H new ATOM 1135 N GLU T 76 82.203 -8.480 1.022 1.00 0.00 N ATOM 1136 CA GLU T 76 81.573 -7.673 2.063 1.00 0.00 C ATOM 1137 C GLU T 76 81.000 -6.381 1.483 1.00 0.00 C ATOM 1138 O GLU T 76 80.267 -5.660 2.159 1.00 0.00 O ATOM 1139 CB GLU T 76 82.592 -7.343 3.158 1.00 0.00 C ATOM 1140 CG GLU T 76 83.622 -6.342 2.626 1.00 0.00 C ATOM 1141 CD GLU T 76 84.838 -6.306 3.544 1.00 0.00 C ATOM 1142 OE1 GLU T 76 85.343 -7.369 3.869 1.00 0.00 O ATOM 1143 OE2 GLU T 76 85.248 -5.216 3.910 1.00 0.00 O ATOM 0 H GLU T 76 83.157 -8.774 1.232 1.00 0.00 H new ATOM 0 HA GLU T 76 80.754 -8.250 2.492 1.00 0.00 H new ATOM 0 HB2 GLU T 76 82.083 -6.927 4.027 1.00 0.00 H new ATOM 0 HB3 GLU T 76 83.093 -8.253 3.487 1.00 0.00 H new ATOM 0 HG2 GLU T 76 83.926 -6.622 1.617 1.00 0.00 H new ATOM 0 HG3 GLU T 76 83.176 -5.349 2.560 1.00 0.00 H new ATOM 1150 N PHE T 77 81.336 -6.093 0.230 1.00 0.00 N ATOM 1151 CA PHE T 77 80.841 -4.883 -0.419 1.00 0.00 C ATOM 1152 C PHE T 77 79.326 -4.943 -0.578 1.00 0.00 C ATOM 1153 O PHE T 77 78.612 -4.033 -0.156 1.00 0.00 O ATOM 1154 CB PHE T 77 81.496 -4.720 -1.794 1.00 0.00 C ATOM 1155 CG PHE T 77 80.913 -3.509 -2.489 1.00 0.00 C ATOM 1156 CD1 PHE T 77 81.196 -2.225 -2.009 1.00 0.00 C ATOM 1157 CD2 PHE T 77 80.091 -3.670 -3.613 1.00 0.00 C ATOM 1158 CE1 PHE T 77 80.657 -1.102 -2.649 1.00 0.00 C ATOM 1159 CE2 PHE T 77 79.553 -2.547 -4.253 1.00 0.00 C ATOM 1160 CZ PHE T 77 79.836 -1.264 -3.771 1.00 0.00 C ATOM 0 H PHE T 77 81.942 -6.673 -0.351 1.00 0.00 H new ATOM 0 HA PHE T 77 81.096 -4.028 0.207 1.00 0.00 H new ATOM 0 HB2 PHE T 77 82.574 -4.606 -1.684 1.00 0.00 H new ATOM 0 HB3 PHE T 77 81.330 -5.613 -2.396 1.00 0.00 H new ATOM 0 HD1 PHE T 77 81.831 -2.100 -1.144 1.00 0.00 H new ATOM 0 HD2 PHE T 77 79.873 -4.660 -3.985 1.00 0.00 H new ATOM 0 HE1 PHE T 77 80.875 -0.112 -2.277 1.00 0.00 H new ATOM 0 HE2 PHE T 77 78.919 -2.671 -5.119 1.00 0.00 H new ATOM 0 HZ PHE T 77 79.421 -0.398 -4.265 1.00 0.00 H new ATOM 1170 N LEU T 78 78.840 -6.020 -1.187 1.00 0.00 N ATOM 1171 CA LEU T 78 77.406 -6.186 -1.394 1.00 0.00 C ATOM 1172 C LEU T 78 76.653 -5.999 -0.080 1.00 0.00 C ATOM 1173 O LEU T 78 75.499 -5.569 -0.071 1.00 0.00 O ATOM 1174 CB LEU T 78 77.113 -7.579 -1.958 1.00 0.00 C ATOM 1175 CG LEU T 78 77.962 -7.828 -3.211 1.00 0.00 C ATOM 1176 CD1 LEU T 78 77.815 -9.290 -3.638 1.00 0.00 C ATOM 1177 CD2 LEU T 78 77.499 -6.910 -4.354 1.00 0.00 C ATOM 0 H LEU T 78 79.413 -6.785 -1.543 1.00 0.00 H new ATOM 0 HA LEU T 78 77.071 -5.431 -2.106 1.00 0.00 H new ATOM 0 HB2 LEU T 78 77.329 -8.338 -1.206 1.00 0.00 H new ATOM 0 HB3 LEU T 78 76.054 -7.666 -2.203 1.00 0.00 H new ATOM 0 HG LEU T 78 79.006 -7.613 -2.985 1.00 0.00 H new ATOM 0 HD11 LEU T 78 78.417 -9.471 -4.528 1.00 0.00 H new ATOM 0 HD12 LEU T 78 78.155 -9.940 -2.832 1.00 0.00 H new ATOM 0 HD13 LEU T 78 76.769 -9.501 -3.858 1.00 0.00 H new ATOM 0 HD21 LEU T 78 78.108 -7.095 -5.239 1.00 0.00 H new ATOM 0 HD22 LEU T 78 76.453 -7.115 -4.584 1.00 0.00 H new ATOM 0 HD23 LEU T 78 77.607 -5.869 -4.051 1.00 0.00 H new ATOM 1189 N VAL T 79 77.312 -6.323 1.028 1.00 0.00 N ATOM 1190 CA VAL T 79 76.692 -6.185 2.340 1.00 0.00 C ATOM 1191 C VAL T 79 76.544 -4.712 2.709 1.00 0.00 C ATOM 1192 O VAL T 79 75.725 -4.352 3.554 1.00 0.00 O ATOM 1193 CB VAL T 79 77.540 -6.894 3.397 1.00 0.00 C ATOM 1194 CG1 VAL T 79 76.794 -6.901 4.732 1.00 0.00 C ATOM 1195 CG2 VAL T 79 77.804 -8.335 2.953 1.00 0.00 C ATOM 0 H VAL T 79 78.267 -6.680 1.044 1.00 0.00 H new ATOM 0 HA VAL T 79 75.703 -6.641 2.303 1.00 0.00 H new ATOM 0 HB VAL T 79 78.488 -6.368 3.515 1.00 0.00 H new ATOM 0 HG11 VAL T 79 77.399 -7.407 5.484 1.00 0.00 H new ATOM 0 HG12 VAL T 79 76.604 -5.875 5.048 1.00 0.00 H new ATOM 0 HG13 VAL T 79 75.846 -7.426 4.616 1.00 0.00 H new ATOM 0 HG21 VAL T 79 78.408 -8.842 3.705 1.00 0.00 H new ATOM 0 HG22 VAL T 79 76.856 -8.859 2.836 1.00 0.00 H new ATOM 0 HG23 VAL T 79 78.336 -8.331 2.002 1.00 0.00 H new ATOM 1205 N MET T 80 77.343 -3.864 2.067 1.00 0.00 N ATOM 1206 CA MET T 80 77.291 -2.431 2.334 1.00 0.00 C ATOM 1207 C MET T 80 76.025 -1.821 1.741 1.00 0.00 C ATOM 1208 O MET T 80 75.387 -0.970 2.359 1.00 0.00 O ATOM 1209 CB MET T 80 78.525 -1.745 1.737 1.00 0.00 C ATOM 1210 CG MET T 80 78.634 -0.313 2.272 1.00 0.00 C ATOM 1211 SD MET T 80 79.680 0.664 1.164 1.00 0.00 S ATOM 1212 CE MET T 80 81.278 0.140 1.831 1.00 0.00 C ATOM 0 H MET T 80 78.028 -4.142 1.364 1.00 0.00 H new ATOM 0 HA MET T 80 77.279 -2.279 3.413 1.00 0.00 H new ATOM 0 HB2 MET T 80 79.423 -2.307 1.991 1.00 0.00 H new ATOM 0 HB3 MET T 80 78.454 -1.732 0.649 1.00 0.00 H new ATOM 0 HG2 MET T 80 77.644 0.136 2.345 1.00 0.00 H new ATOM 0 HG3 MET T 80 79.056 -0.319 3.277 1.00 0.00 H new ATOM 0 HE1 MET T 80 82.081 0.619 1.270 1.00 0.00 H new ATOM 0 HE2 MET T 80 81.346 0.428 2.880 1.00 0.00 H new ATOM 0 HE3 MET T 80 81.371 -0.943 1.745 1.00 0.00 H new ATOM 1222 N MET T 81 75.666 -2.261 0.537 1.00 0.00 N ATOM 1223 CA MET T 81 74.473 -1.748 -0.127 1.00 0.00 C ATOM 1224 C MET T 81 73.216 -2.375 0.472 1.00 0.00 C ATOM 1225 O MET T 81 72.319 -1.671 0.936 1.00 0.00 O ATOM 1226 CB MET T 81 74.534 -2.055 -1.629 1.00 0.00 C ATOM 1227 CG MET T 81 75.512 -1.095 -2.315 1.00 0.00 C ATOM 1228 SD MET T 81 77.185 -1.390 -1.689 1.00 0.00 S ATOM 1229 CE MET T 81 77.774 0.320 -1.773 1.00 0.00 C ATOM 0 H MET T 81 76.179 -2.965 0.007 1.00 0.00 H new ATOM 0 HA MET T 81 74.434 -0.669 0.020 1.00 0.00 H new ATOM 0 HB2 MET T 81 74.851 -3.086 -1.786 1.00 0.00 H new ATOM 0 HB3 MET T 81 73.542 -1.956 -2.071 1.00 0.00 H new ATOM 0 HG2 MET T 81 75.485 -1.241 -3.395 1.00 0.00 H new ATOM 0 HG3 MET T 81 75.218 -0.063 -2.126 1.00 0.00 H new ATOM 0 HE1 MET T 81 78.759 0.389 -1.311 1.00 0.00 H new ATOM 0 HE2 MET T 81 77.840 0.631 -2.816 1.00 0.00 H new ATOM 0 HE3 MET T 81 77.079 0.971 -1.243 1.00 0.00 H new ATOM 1239 N VAL T 82 73.157 -3.703 0.458 1.00 0.00 N ATOM 1240 CA VAL T 82 72.004 -4.415 1.000 1.00 0.00 C ATOM 1241 C VAL T 82 71.587 -3.822 2.343 1.00 0.00 C ATOM 1242 O VAL T 82 70.478 -3.306 2.486 1.00 0.00 O ATOM 1243 CB VAL T 82 72.340 -5.897 1.175 1.00 0.00 C ATOM 1244 CG1 VAL T 82 71.161 -6.617 1.832 1.00 0.00 C ATOM 1245 CG2 VAL T 82 72.616 -6.521 -0.195 1.00 0.00 C ATOM 0 H VAL T 82 73.889 -4.305 0.080 1.00 0.00 H new ATOM 0 HA VAL T 82 71.176 -4.311 0.299 1.00 0.00 H new ATOM 0 HB VAL T 82 73.223 -5.996 1.807 1.00 0.00 H new ATOM 0 HG11 VAL T 82 71.403 -7.673 1.956 1.00 0.00 H new ATOM 0 HG12 VAL T 82 70.962 -6.174 2.808 1.00 0.00 H new ATOM 0 HG13 VAL T 82 70.277 -6.518 1.201 1.00 0.00 H new ATOM 0 HG21 VAL T 82 72.856 -7.577 -0.072 1.00 0.00 H new ATOM 0 HG22 VAL T 82 71.732 -6.420 -0.825 1.00 0.00 H new ATOM 0 HG23 VAL T 82 73.457 -6.010 -0.665 1.00 0.00 H new ATOM 1255 N ARG T 83 72.481 -3.898 3.323 1.00 0.00 N ATOM 1256 CA ARG T 83 72.191 -3.364 4.649 1.00 0.00 C ATOM 1257 C ARG T 83 71.603 -1.960 4.543 1.00 0.00 C ATOM 1258 O ARG T 83 70.480 -1.712 4.981 1.00 0.00 O ATOM 1259 CB ARG T 83 73.470 -3.322 5.489 1.00 0.00 C ATOM 1260 CG ARG T 83 73.867 -4.744 5.890 1.00 0.00 C ATOM 1261 CD ARG T 83 75.066 -4.690 6.839 1.00 0.00 C ATOM 1262 NE ARG T 83 74.687 -4.057 8.097 1.00 0.00 N ATOM 1263 CZ ARG T 83 75.602 -3.538 8.908 1.00 0.00 C ATOM 1264 NH1 ARG T 83 76.865 -3.589 8.585 1.00 0.00 N ATOM 1265 NH2 ARG T 83 75.238 -2.977 10.029 1.00 0.00 N ATOM 0 H ARG T 83 73.404 -4.320 3.226 1.00 0.00 H new ATOM 0 HA ARG T 83 71.463 -4.016 5.131 1.00 0.00 H new ATOM 0 HB2 ARG T 83 74.275 -2.855 4.921 1.00 0.00 H new ATOM 0 HB3 ARG T 83 73.313 -2.713 6.379 1.00 0.00 H new ATOM 0 HG2 ARG T 83 73.028 -5.244 6.374 1.00 0.00 H new ATOM 0 HG3 ARG T 83 74.117 -5.327 5.004 1.00 0.00 H new ATOM 0 HD2 ARG T 83 75.435 -5.698 7.028 1.00 0.00 H new ATOM 0 HD3 ARG T 83 75.881 -4.134 6.375 1.00 0.00 H new ATOM 0 HE ARG T 83 73.702 -4.012 8.359 1.00 0.00 H new ATOM 0 HH11 ARG T 83 77.150 -4.028 7.709 1.00 0.00 H new ATOM 0 HH12 ARG T 83 77.567 -3.190 9.208 1.00 0.00 H new ATOM 0 HH21 ARG T 83 74.251 -2.937 10.282 1.00 0.00 H new ATOM 0 HH22 ARG T 83 75.941 -2.579 10.652 1.00 0.00 H new ATOM 1279 N SER T 84 72.371 -1.045 3.959 1.00 0.00 N ATOM 1280 CA SER T 84 71.917 0.331 3.801 1.00 0.00 C ATOM 1281 C SER T 84 70.536 0.367 3.151 1.00 0.00 C ATOM 1282 O SER T 84 69.688 1.181 3.519 1.00 0.00 O ATOM 1283 CB SER T 84 72.908 1.112 2.940 1.00 0.00 C ATOM 1284 OG SER T 84 74.170 1.150 3.594 1.00 0.00 O ATOM 0 H SER T 84 73.304 -1.230 3.590 1.00 0.00 H new ATOM 0 HA SER T 84 71.855 0.789 4.788 1.00 0.00 H new ATOM 0 HB2 SER T 84 73.007 0.642 1.961 1.00 0.00 H new ATOM 0 HB3 SER T 84 72.542 2.125 2.772 1.00 0.00 H new ATOM 0 HG SER T 84 74.775 0.503 3.175 1.00 0.00 H new ATOM 1290 N MET T 85 70.319 -0.516 2.184 1.00 0.00 N ATOM 1291 CA MET T 85 69.038 -0.575 1.489 1.00 0.00 C ATOM 1292 C MET T 85 67.962 -1.160 2.398 1.00 0.00 C ATOM 1293 O MET T 85 67.067 -0.449 2.854 1.00 0.00 O ATOM 1294 CB MET T 85 69.166 -1.433 0.229 1.00 0.00 C ATOM 1295 CG MET T 85 70.014 -0.695 -0.808 1.00 0.00 C ATOM 1296 SD MET T 85 69.042 0.642 -1.542 1.00 0.00 S ATOM 1297 CE MET T 85 70.333 1.289 -2.633 1.00 0.00 C ATOM 0 H MET T 85 71.008 -1.197 1.864 1.00 0.00 H new ATOM 0 HA MET T 85 68.750 0.439 1.210 1.00 0.00 H new ATOM 0 HB2 MET T 85 69.625 -2.391 0.474 1.00 0.00 H new ATOM 0 HB3 MET T 85 68.178 -1.647 -0.179 1.00 0.00 H new ATOM 0 HG2 MET T 85 70.911 -0.291 -0.339 1.00 0.00 H new ATOM 0 HG3 MET T 85 70.343 -1.387 -1.583 1.00 0.00 H new ATOM 0 HE1 MET T 85 69.943 2.138 -3.194 1.00 0.00 H new ATOM 0 HE2 MET T 85 71.187 1.610 -2.036 1.00 0.00 H new ATOM 0 HE3 MET T 85 70.648 0.509 -3.327 1.00 0.00 H new ATOM 1307 N LYS T 86 68.055 -2.461 2.658 1.00 0.00 N ATOM 1308 CA LYS T 86 67.084 -3.131 3.513 1.00 0.00 C ATOM 1309 C LYS T 86 66.910 -2.373 4.826 1.00 0.00 C ATOM 1310 O LYS T 86 65.916 -2.553 5.530 1.00 0.00 O ATOM 1311 CB LYS T 86 67.542 -4.561 3.804 1.00 0.00 C ATOM 1312 CG LYS T 86 66.390 -5.352 4.425 1.00 0.00 C ATOM 1313 CD LYS T 86 66.825 -6.801 4.648 1.00 0.00 C ATOM 1314 CE LYS T 86 65.598 -7.665 4.946 1.00 0.00 C ATOM 1315 NZ LYS T 86 64.653 -6.902 5.811 1.00 0.00 N ATOM 0 H LYS T 86 68.788 -3.068 2.291 1.00 0.00 H new ATOM 0 HA LYS T 86 66.127 -3.155 2.992 1.00 0.00 H new ATOM 0 HB2 LYS T 86 67.872 -5.042 2.883 1.00 0.00 H new ATOM 0 HB3 LYS T 86 68.396 -4.549 4.482 1.00 0.00 H new ATOM 0 HG2 LYS T 86 66.094 -4.901 5.372 1.00 0.00 H new ATOM 0 HG3 LYS T 86 65.519 -5.320 3.771 1.00 0.00 H new ATOM 0 HD2 LYS T 86 67.341 -7.177 3.764 1.00 0.00 H new ATOM 0 HD3 LYS T 86 67.531 -6.856 5.477 1.00 0.00 H new ATOM 0 HE2 LYS T 86 65.107 -7.951 4.016 1.00 0.00 H new ATOM 0 HE3 LYS T 86 65.901 -8.586 5.444 1.00 0.00 H new ATOM 0 HZ1 LYS T 86 63.996 -7.562 6.274 1.00 0.00 H new ATOM 0 HZ2 LYS T 86 65.188 -6.381 6.535 1.00 0.00 H new ATOM 0 HZ3 LYS T 86 64.114 -6.230 5.228 1.00 0.00 H new ATOM 1329 N ASP T 87 67.882 -1.526 5.148 1.00 0.00 N ATOM 1330 CA ASP T 87 67.828 -0.744 6.379 1.00 0.00 C ATOM 1331 C ASP T 87 68.733 0.478 6.279 1.00 0.00 C ATOM 1332 O ASP T 87 69.947 0.382 6.463 1.00 0.00 O ATOM 1333 CB ASP T 87 68.263 -1.607 7.566 1.00 0.00 C ATOM 1334 CG ASP T 87 67.282 -2.758 7.761 1.00 0.00 C ATOM 1335 OD1 ASP T 87 66.171 -2.497 8.192 1.00 0.00 O ATOM 1336 OD2 ASP T 87 67.656 -3.884 7.478 1.00 0.00 O ATOM 0 H ASP T 87 68.712 -1.364 4.578 1.00 0.00 H new ATOM 0 HA ASP T 87 66.801 -0.410 6.529 1.00 0.00 H new ATOM 0 HB2 ASP T 87 69.266 -1.998 7.394 1.00 0.00 H new ATOM 0 HB3 ASP T 87 68.309 -1.000 8.470 1.00 0.00 H new ATOM 1341 N ASP T 88 68.135 1.629 5.987 1.00 0.00 N ATOM 1342 CA ASP T 88 68.897 2.867 5.865 1.00 0.00 C ATOM 1343 C ASP T 88 69.212 3.441 7.243 1.00 0.00 C ATOM 1344 O ASP T 88 68.325 3.581 8.086 1.00 0.00 O ATOM 1345 CB ASP T 88 68.102 3.893 5.054 1.00 0.00 C ATOM 1346 CG ASP T 88 66.693 4.026 5.620 1.00 0.00 C ATOM 1347 OD1 ASP T 88 66.398 3.347 6.590 1.00 0.00 O ATOM 1348 OD2 ASP T 88 65.929 4.806 5.076 1.00 0.00 O ATOM 0 H ASP T 88 67.132 1.730 5.831 1.00 0.00 H new ATOM 0 HA ASP T 88 69.833 2.645 5.353 1.00 0.00 H new ATOM 0 HB2 ASP T 88 68.606 4.859 5.080 1.00 0.00 H new ATOM 0 HB3 ASP T 88 68.056 3.586 4.009 1.00 0.00 H new ATOM 1353 N SER T 89 70.480 3.770 7.465 1.00 0.00 N ATOM 1354 CA SER T 89 70.901 4.329 8.746 1.00 0.00 C ATOM 1355 C SER T 89 72.271 4.987 8.619 1.00 0.00 C ATOM 1356 O SER T 89 72.831 4.939 7.536 1.00 0.00 O ATOM 1357 CB SER T 89 70.960 3.224 9.802 1.00 0.00 C ATOM 1358 OG SER T 89 72.102 2.412 9.567 1.00 0.00 O ATOM 1359 OXT SER T 89 72.740 5.529 9.605 1.00 0.00 O ATOM 0 H SER T 89 71.229 3.661 6.781 1.00 0.00 H new ATOM 0 HA SER T 89 70.175 5.084 9.049 1.00 0.00 H new ATOM 0 HB2 SER T 89 71.009 3.660 10.800 1.00 0.00 H new ATOM 0 HB3 SER T 89 70.054 2.619 9.763 1.00 0.00 H new ATOM 0 HG SER T 89 72.144 1.704 10.243 1.00 0.00 H new TER 1365 SER T 89 HETATM 1366 CA CA T 90 87.374 -6.219 4.964 1.00 0.00 CA HETATM 1367 S1 WW7 T 91 80.565 3.853 -4.927 1.00 0.00 S HETATM 1368 O1 WW7 T 91 81.219 3.400 -6.109 1.00 0.00 O HETATM 1369 O2 WW7 T 91 80.092 5.217 -4.929 1.00 0.00 O HETATM 1370 N1 WW7 T 91 79.182 2.823 -4.702 1.00 0.00 N HETATM 1371 C4 WW7 T 91 83.390 3.406 -1.176 1.00 0.00 C HETATM 1372 C3 WW7 T 91 82.599 4.606 -1.394 1.00 0.00 C HETATM 1373 C2 WW7 T 91 81.733 4.732 -2.566 1.00 0.00 C HETATM 1374 C1 WW7 T 91 81.638 3.652 -3.541 1.00 0.00 C HETATM 1375 C9 WW7 T 91 82.422 2.438 -3.355 1.00 0.00 C HETATM 1376 C10 WW7 T 91 83.319 2.312 -2.139 1.00 0.00 C HETATM 1377 CL1 WW7 T 91 85.119 0.851 -0.585 1.00 0.00 CL HETATM 1378 C5 WW7 T 91 84.089 1.090 -1.949 1.00 0.00 C HETATM 1379 C6 WW7 T 91 83.996 0.006 -2.916 1.00 0.00 C HETATM 1380 C7 WW7 T 91 83.128 0.134 -4.089 1.00 0.00 C HETATM 1381 C8 WW7 T 91 82.344 1.340 -4.312 1.00 0.00 C HETATM 1382 C11 WW7 T 91 77.889 3.475 -4.505 1.00 0.00 C HETATM 1383 C12 WW7 T 91 77.401 3.460 -3.058 1.00 0.00 C HETATM 1384 C14 WW7 T 91 78.072 3.799 -0.670 1.00 0.00 C HETATM 1385 C13 WW7 T 91 78.578 3.679 -2.105 1.00 0.00 C HETATM 1386 C15 WW7 T 91 79.233 4.170 0.260 1.00 0.00 C HETATM 1387 C16 WW7 T 91 78.920 3.726 1.692 1.00 0.00 C HETATM 1388 N2 WW7 T 91 77.559 4.046 2.096 1.00 0.00 N HETATM 0 HN22 WW7 T 91 77.233 3.799 3.030 1.00 0.00 H new HETATM 0 HN21 WW7 T 91 76.931 4.517 1.445 1.00 0.00 H new HETATM 0 H162 WW7 T 91 79.076 2.651 1.777 1.00 0.00 H new HETATM 0 H161 WW7 T 91 79.620 4.204 2.377 1.00 0.00 H new HETATM 0 H152 WW7 T 91 80.152 3.695 -0.084 1.00 0.00 H new HETATM 0 H151 WW7 T 91 79.402 5.247 0.233 1.00 0.00 H new HETATM 0 H142 WW7 T 91 77.291 4.557 -0.612 1.00 0.00 H new HETATM 0 H141 WW7 T 91 77.626 2.857 -0.352 1.00 0.00 H new HETATM 0 H132 WW7 T 91 79.280 2.849 -2.184 1.00 0.00 H new HETATM 0 H131 WW7 T 91 79.120 4.582 -2.385 1.00 0.00 H new HETATM 0 H122 WW7 T 91 76.653 4.239 -2.910 1.00 0.00 H new HETATM 0 H121 WW7 T 91 76.917 2.508 -2.839 1.00 0.00 H new HETATM 0 H112 WW7 T 91 77.959 4.509 -4.843 1.00 0.00 H new HETATM 0 H111 WW7 T 91 77.146 2.984 -5.133 1.00 0.00 H new HETATM 0 HN1 WW7 T 91 79.270 1.807 -4.707 1.00 0.00 H new HETATM 0 H8 WW7 T 91 81.702 1.422 -5.189 1.00 0.00 H new HETATM 0 H7 WW7 T 91 83.068 -0.686 -4.805 1.00 0.00 H new HETATM 0 H6 WW7 T 91 84.575 -0.905 -2.767 1.00 0.00 H new HETATM 0 H4 WW7 T 91 84.032 3.324 -0.299 1.00 0.00 H new HETATM 0 H3 WW7 T 91 82.652 5.423 -0.674 1.00 0.00 H new HETATM 0 H2 WW7 T 91 81.153 5.643 -2.712 1.00 0.00 H new