USER MOD reduce.3.24.130724 H: found=0, std=0, add=1157, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1157 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 57 LYS NZ :NH3+ -121:sc= 0.796 (180deg=0) USER MOD Set 1.2: A 59 ASN : amide:sc= 1.21 K(o=2,f=-5.4!) USER MOD Single : A 1 MET CE :methyl -149:sc= -0.62 (180deg=-1.64) USER MOD Single : A 1 MET N :NH3+ -131:sc= 0.917 (180deg=-0.00226) USER MOD Single : A 2 LYS NZ :NH3+ -144:sc= -1.23 (180deg=-2.47!) USER MOD Single : A 8 ASN : amide:sc= -0.457 X(o=-0.46,f=-0.6) USER MOD Single : A 9 THR OG1 : rot 50:sc= 0.463 USER MOD Single : A 10 ASN : amide:sc= 0.0961 X(o=0.096,f=-0.13) USER MOD Single : A 11 ASN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 16 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000765) USER MOD Single : A 17 LYS NZ :NH3+ 179:sc= 0.364 (180deg=0.364) USER MOD Single : A 19 LYS NZ :NH3+ -159:sc= 0.426 (180deg=-0.076) USER MOD Single : A 20 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00818) USER MOD Single : A 24 ASN : amide:sc= -0.0175 K(o=-0.017,f=-1.7) USER MOD Single : A 25 GLN : amide:sc=-0.00272 X(o=-0.0027,f=-0.0027) USER MOD Single : A 27 TYR OH : rot 71:sc= 1.15 USER MOD Single : A 28 GLN : amide:sc= -1.83 X(o=-1.8,f=-1.4) USER MOD Single : A 33 ASN : amide:sc= 0.0451 X(o=0.045,f=0) USER MOD Single : A 35 SER OG : rot 180:sc= -0.0214 USER MOD Single : A 39 LYS NZ :NH3+ -131:sc= 0.153 (180deg=-0.821) USER MOD Single : A 40 LYS NZ :NH3+ 143:sc= 0.0537 (180deg=-1.33) USER MOD Single : A 42 MET CE :methyl 168:sc= -1.52 (180deg=-1.86) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ -123:sc= 0.642 (180deg=0.124) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= -0.595 K(o=-0.59,f=-2!) USER MOD Single : A 53 LYS NZ :NH3+ -162:sc= 0.821 (180deg=0.658) USER MOD Single : A 58 SER OG : rot -94:sc= 0.136 USER MOD Single : A 61 LYS NZ :NH3+ -128:sc= 0.762 (180deg=0.171) USER MOD Single : A 62 GLN : amide:sc= -0.299 X(o=-0.3,f=-0.18) USER MOD Single : A 65 LYS NZ :NH3+ 166:sc= 0.45 (180deg=0.182) USER MOD Single : A 67 MET CE :methyl 170:sc= -1.07 (180deg=-1.41) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 TYR OH : rot 180:sc= -0.172 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0.659 (180deg=0.659) USER MOD Single : A 96 LYS NZ :NH3+ 164:sc= 0.563 (180deg=0.434) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= -1.78 K(o=-1.8,f=-4.8!) USER MOD Single : A 102 TYR OH : rot -136:sc= 0.414 USER MOD Single : A 106 LYS NZ :NH3+ 150:sc= -0.659 (180deg=-2.47!) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ -139:sc= 1.26 (180deg=0.159) USER MOD Single : A 121 MET CE :methyl 141:sc= -0.827 (180deg=-2.27!) USER MOD Single : A 122 GLN : amide:sc=-0.00869 K(o=-0.0087,f=-3!) USER MOD Single : A 123 LYS NZ :NH3+ -127:sc= -2.07! (180deg=-2.58!) USER MOD Single : A 126 SER OG : rot 58:sc= 0.917 USER MOD Single : A 129 HIS : no HD1:sc= -0.0198 X(o=-0.02,f=-0.18) USER MOD Single : A 130 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 131 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 132 HIS : no HD1:sc= -0.296 K(o=-0.3,f=-0.98) USER MOD Single : A 133 HIS : no HD1:sc= -0.0924 X(o=-0.092,f=0) USER MOD Single : A 134 HIS : no HD1:sc= -0.0401 X(o=-0.04,f=-0.0011) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.631 9.726 13.048 1.00 42.12 N ATOM 2 CA MET A 1 5.032 9.438 11.650 1.00 3.43 C ATOM 3 C MET A 1 4.836 7.933 11.348 1.00 63.15 C ATOM 4 O MET A 1 5.764 7.125 11.464 1.00 32.11 O ATOM 5 CB MET A 1 6.497 9.915 11.398 1.00 32.41 C ATOM 6 CG MET A 1 7.055 9.710 9.968 1.00 34.33 C ATOM 7 SD MET A 1 6.220 10.698 8.689 1.00 32.23 S ATOM 8 CE MET A 1 4.915 9.604 8.120 1.00 44.51 C ATOM 0 H1 MET A 1 3.995 10.549 13.064 1.00 42.12 H new ATOM 0 H2 MET A 1 4.139 8.900 13.445 1.00 42.12 H new ATOM 0 H3 MET A 1 5.477 9.931 13.617 1.00 42.12 H new ATOM 0 HA MET A 1 4.396 9.994 10.961 1.00 3.43 H new ATOM 0 HB2 MET A 1 6.556 10.977 11.638 1.00 32.41 H new ATOM 0 HB3 MET A 1 7.151 9.393 12.097 1.00 32.41 H new ATOM 0 HG2 MET A 1 8.117 9.957 9.966 1.00 34.33 H new ATOM 0 HG3 MET A 1 6.973 8.655 9.707 1.00 34.33 H new ATOM 0 HE1 MET A 1 4.710 9.799 7.067 1.00 44.51 H new ATOM 0 HE2 MET A 1 5.230 8.568 8.243 1.00 44.51 H new ATOM 0 HE3 MET A 1 4.012 9.780 8.704 1.00 44.51 H new ATOM 20 N LYS A 2 3.588 7.547 11.019 1.00 12.12 N ATOM 21 CA LYS A 2 3.240 6.150 10.691 1.00 41.40 C ATOM 22 C LYS A 2 3.414 5.963 9.178 1.00 61.21 C ATOM 23 O LYS A 2 2.666 6.540 8.391 1.00 44.22 O ATOM 24 CB LYS A 2 1.775 5.824 11.133 1.00 32.24 C ATOM 25 CG LYS A 2 1.514 4.357 11.544 1.00 22.30 C ATOM 26 CD LYS A 2 2.260 3.981 12.843 1.00 53.11 C ATOM 27 CE LYS A 2 1.869 2.610 13.403 1.00 33.21 C ATOM 28 NZ LYS A 2 2.492 2.371 14.739 1.00 24.50 N ATOM 0 H LYS A 2 2.797 8.190 10.973 1.00 12.12 H new ATOM 0 HA LYS A 2 3.895 5.463 11.228 1.00 41.40 H new ATOM 0 HB2 LYS A 2 1.515 6.470 11.972 1.00 32.24 H new ATOM 0 HB3 LYS A 2 1.102 6.079 10.314 1.00 32.24 H new ATOM 0 HG2 LYS A 2 0.444 4.204 11.683 1.00 22.30 H new ATOM 0 HG3 LYS A 2 1.829 3.693 10.739 1.00 22.30 H new ATOM 0 HD2 LYS A 2 3.333 3.993 12.652 1.00 53.11 H new ATOM 0 HD3 LYS A 2 2.062 4.742 13.598 1.00 53.11 H new ATOM 0 HE2 LYS A 2 0.784 2.546 13.489 1.00 33.21 H new ATOM 0 HE3 LYS A 2 2.181 1.829 12.709 1.00 33.21 H new ATOM 0 HZ1 LYS A 2 2.749 1.367 14.827 1.00 24.50 H new ATOM 0 HZ2 LYS A 2 3.346 2.957 14.834 1.00 24.50 H new ATOM 0 HZ3 LYS A 2 1.815 2.622 15.488 1.00 24.50 H new ATOM 42 N ILE A 3 4.435 5.211 8.775 1.00 73.01 N ATOM 43 CA ILE A 3 4.730 4.984 7.355 1.00 41.42 C ATOM 44 C ILE A 3 4.066 3.672 6.900 1.00 22.24 C ATOM 45 O ILE A 3 4.513 2.584 7.271 1.00 42.11 O ATOM 46 CB ILE A 3 6.285 4.949 7.111 1.00 74.32 C ATOM 47 CG1 ILE A 3 6.941 6.281 7.615 1.00 1.23 C ATOM 48 CG2 ILE A 3 6.613 4.683 5.623 1.00 71.15 C ATOM 49 CD1 ILE A 3 8.457 6.324 7.556 1.00 54.42 C ATOM 0 H ILE A 3 5.078 4.744 9.414 1.00 73.01 H new ATOM 0 HA ILE A 3 4.324 5.806 6.765 1.00 41.42 H new ATOM 0 HB ILE A 3 6.707 4.123 7.684 1.00 74.32 H new ATOM 0 HG12 ILE A 3 6.548 7.107 7.022 1.00 1.23 H new ATOM 0 HG13 ILE A 3 6.630 6.452 8.645 1.00 1.23 H new ATOM 0 HG21 ILE A 3 7.694 4.665 5.486 1.00 71.15 H new ATOM 0 HG22 ILE A 3 6.193 3.723 5.324 1.00 71.15 H new ATOM 0 HG23 ILE A 3 6.183 5.474 5.009 1.00 71.15 H new ATOM 0 HD11 ILE A 3 8.808 7.287 7.927 1.00 54.42 H new ATOM 0 HD12 ILE A 3 8.868 5.526 8.174 1.00 54.42 H new ATOM 0 HD13 ILE A 3 8.785 6.190 6.525 1.00 54.42 H new ATOM 61 N LEU A 4 2.966 3.792 6.144 1.00 14.22 N ATOM 62 CA LEU A 4 2.275 2.645 5.529 1.00 14.35 C ATOM 63 C LEU A 4 2.640 2.567 4.045 1.00 61.01 C ATOM 64 O LEU A 4 2.695 3.588 3.359 1.00 72.21 O ATOM 65 CB LEU A 4 0.718 2.749 5.704 1.00 33.11 C ATOM 66 CG LEU A 4 0.114 2.133 7.012 1.00 71.13 C ATOM 67 CD1 LEU A 4 0.675 2.794 8.286 1.00 45.10 C ATOM 68 CD2 LEU A 4 -1.433 2.178 6.972 1.00 2.15 C ATOM 0 H LEU A 4 2.527 4.690 5.940 1.00 14.22 H new ATOM 0 HA LEU A 4 2.600 1.736 6.034 1.00 14.35 H new ATOM 0 HB2 LEU A 4 0.441 3.802 5.665 1.00 33.11 H new ATOM 0 HB3 LEU A 4 0.246 2.263 4.850 1.00 33.11 H new ATOM 0 HG LEU A 4 0.421 1.088 7.054 1.00 71.13 H new ATOM 0 HD11 LEU A 4 0.225 2.331 9.164 1.00 45.10 H new ATOM 0 HD12 LEU A 4 1.756 2.660 8.319 1.00 45.10 H new ATOM 0 HD13 LEU A 4 0.441 3.859 8.277 1.00 45.10 H new ATOM 0 HD21 LEU A 4 -1.833 1.746 7.889 1.00 2.15 H new ATOM 0 HD22 LEU A 4 -1.765 3.213 6.883 1.00 2.15 H new ATOM 0 HD23 LEU A 4 -1.792 1.607 6.115 1.00 2.15 H new ATOM 80 N ILE A 5 2.921 1.350 3.568 1.00 23.13 N ATOM 81 CA ILE A 5 3.013 1.045 2.137 1.00 11.11 C ATOM 82 C ILE A 5 1.869 0.073 1.803 1.00 21.44 C ATOM 83 O ILE A 5 1.867 -1.074 2.272 1.00 3.11 O ATOM 84 CB ILE A 5 4.412 0.426 1.732 1.00 31.43 C ATOM 85 CG1 ILE A 5 5.580 1.402 2.106 1.00 53.25 C ATOM 86 CG2 ILE A 5 4.447 0.065 0.222 1.00 60.20 C ATOM 87 CD1 ILE A 5 6.975 0.901 1.751 1.00 4.53 C ATOM 0 H ILE A 5 3.092 0.543 4.169 1.00 23.13 H new ATOM 0 HA ILE A 5 2.925 1.970 1.566 1.00 11.11 H new ATOM 0 HB ILE A 5 4.549 -0.497 2.296 1.00 31.43 H new ATOM 0 HG12 ILE A 5 5.413 2.354 1.603 1.00 53.25 H new ATOM 0 HG13 ILE A 5 5.542 1.597 3.178 1.00 53.25 H new ATOM 0 HG21 ILE A 5 5.420 -0.358 -0.028 1.00 60.20 H new ATOM 0 HG22 ILE A 5 3.667 -0.664 0.004 1.00 60.20 H new ATOM 0 HG23 ILE A 5 4.279 0.964 -0.371 1.00 60.20 H new ATOM 0 HD11 ILE A 5 7.715 1.644 2.048 1.00 4.53 H new ATOM 0 HD12 ILE A 5 7.170 -0.035 2.275 1.00 4.53 H new ATOM 0 HD13 ILE A 5 7.039 0.735 0.676 1.00 4.53 H new ATOM 99 N LEU A 6 0.882 0.555 1.028 1.00 64.02 N ATOM 100 CA LEU A 6 -0.282 -0.246 0.630 1.00 1.14 C ATOM 101 C LEU A 6 0.024 -0.963 -0.679 1.00 33.54 C ATOM 102 O LEU A 6 0.378 -0.329 -1.679 1.00 24.22 O ATOM 103 CB LEU A 6 -1.555 0.626 0.461 1.00 23.45 C ATOM 104 CG LEU A 6 -2.050 1.390 1.714 1.00 54.40 C ATOM 105 CD1 LEU A 6 -3.387 2.123 1.438 1.00 74.05 C ATOM 106 CD2 LEU A 6 -2.150 0.477 2.942 1.00 52.04 C ATOM 0 H LEU A 6 0.871 1.507 0.663 1.00 64.02 H new ATOM 0 HA LEU A 6 -0.479 -0.969 1.421 1.00 1.14 H new ATOM 0 HB2 LEU A 6 -1.366 1.354 -0.328 1.00 23.45 H new ATOM 0 HB3 LEU A 6 -2.364 -0.017 0.114 1.00 23.45 H new ATOM 0 HG LEU A 6 -1.301 2.148 1.943 1.00 54.40 H new ATOM 0 HD11 LEU A 6 -3.706 2.649 2.338 1.00 74.05 H new ATOM 0 HD12 LEU A 6 -3.249 2.840 0.629 1.00 74.05 H new ATOM 0 HD13 LEU A 6 -4.148 1.397 1.153 1.00 74.05 H new ATOM 0 HD21 LEU A 6 -2.501 1.055 3.797 1.00 52.04 H new ATOM 0 HD22 LEU A 6 -2.852 -0.332 2.738 1.00 52.04 H new ATOM 0 HD23 LEU A 6 -1.169 0.058 3.165 1.00 52.04 H new ATOM 118 N ILE A 7 -0.106 -2.285 -0.658 1.00 10.32 N ATOM 119 CA ILE A 7 0.110 -3.137 -1.827 1.00 50.30 C ATOM 120 C ILE A 7 -1.209 -3.813 -2.211 1.00 33.11 C ATOM 121 O ILE A 7 -1.759 -4.618 -1.439 1.00 72.44 O ATOM 122 CB ILE A 7 1.216 -4.223 -1.543 1.00 62.34 C ATOM 123 CG1 ILE A 7 2.574 -3.548 -1.200 1.00 54.10 C ATOM 124 CG2 ILE A 7 1.374 -5.208 -2.729 1.00 11.00 C ATOM 125 CD1 ILE A 7 3.179 -2.691 -2.302 1.00 64.32 C ATOM 0 H ILE A 7 -0.367 -2.804 0.180 1.00 10.32 H new ATOM 0 HA ILE A 7 0.458 -2.516 -2.652 1.00 50.30 H new ATOM 0 HB ILE A 7 0.890 -4.804 -0.680 1.00 62.34 H new ATOM 0 HG12 ILE A 7 2.437 -2.927 -0.315 1.00 54.10 H new ATOM 0 HG13 ILE A 7 3.290 -4.326 -0.935 1.00 54.10 H new ATOM 0 HG21 ILE A 7 2.146 -5.941 -2.493 1.00 11.00 H new ATOM 0 HG22 ILE A 7 0.428 -5.721 -2.904 1.00 11.00 H new ATOM 0 HG23 ILE A 7 1.659 -4.656 -3.625 1.00 11.00 H new ATOM 0 HD11 ILE A 7 4.123 -2.269 -1.958 1.00 64.32 H new ATOM 0 HD12 ILE A 7 3.357 -3.305 -3.185 1.00 64.32 H new ATOM 0 HD13 ILE A 7 2.491 -1.884 -2.554 1.00 64.32 H new ATOM 137 N ASN A 8 -1.708 -3.466 -3.398 1.00 71.24 N ATOM 138 CA ASN A 8 -2.811 -4.161 -4.045 1.00 34.02 C ATOM 139 C ASN A 8 -2.291 -4.756 -5.346 1.00 63.43 C ATOM 140 O ASN A 8 -2.081 -4.038 -6.328 1.00 31.22 O ATOM 141 CB ASN A 8 -3.987 -3.199 -4.324 1.00 2.44 C ATOM 142 CG ASN A 8 -5.134 -3.868 -5.087 1.00 51.32 C ATOM 143 OD1 ASN A 8 -5.212 -3.805 -6.319 1.00 31.31 O ATOM 144 ND2 ASN A 8 -6.012 -4.533 -4.370 1.00 74.24 N ATOM 0 H ASN A 8 -1.349 -2.681 -3.942 1.00 71.24 H new ATOM 0 HA ASN A 8 -3.186 -4.947 -3.390 1.00 34.02 H new ATOM 0 HB2 ASN A 8 -4.364 -2.810 -3.378 1.00 2.44 H new ATOM 0 HB3 ASN A 8 -3.624 -2.346 -4.897 1.00 2.44 H new ATOM 0 HD21 ASN A 8 -6.785 -5.016 -4.829 1.00 74.24 H new ATOM 0 HD22 ASN A 8 -5.921 -4.567 -3.355 1.00 74.24 H new ATOM 151 N THR A 9 -2.021 -6.058 -5.331 1.00 42.44 N ATOM 152 CA THR A 9 -1.760 -6.822 -6.543 1.00 13.21 C ATOM 153 C THR A 9 -2.580 -8.115 -6.544 1.00 64.32 C ATOM 154 O THR A 9 -2.700 -8.799 -5.513 1.00 32.12 O ATOM 155 CB THR A 9 -0.228 -7.074 -6.792 1.00 54.52 C ATOM 156 OG1 THR A 9 -0.032 -7.965 -7.908 1.00 53.22 O ATOM 157 CG2 THR A 9 0.509 -7.606 -5.575 1.00 22.25 C ATOM 0 H THR A 9 -1.977 -6.612 -4.476 1.00 42.44 H new ATOM 0 HA THR A 9 -2.086 -6.218 -7.390 1.00 13.21 H new ATOM 0 HB THR A 9 0.199 -6.097 -7.016 1.00 54.52 H new ATOM 0 HG1 THR A 9 -0.554 -7.648 -8.675 1.00 53.22 H new ATOM 0 HG21 THR A 9 1.560 -7.755 -5.823 1.00 22.25 H new ATOM 0 HG22 THR A 9 0.427 -6.889 -4.758 1.00 22.25 H new ATOM 0 HG23 THR A 9 0.070 -8.556 -5.270 1.00 22.25 H new ATOM 165 N ASN A 10 -3.166 -8.413 -7.719 1.00 13.13 N ATOM 166 CA ASN A 10 -3.932 -9.652 -7.976 1.00 33.04 C ATOM 167 C ASN A 10 -2.976 -10.871 -8.048 1.00 62.31 C ATOM 168 O ASN A 10 -3.388 -12.017 -7.852 1.00 61.51 O ATOM 169 CB ASN A 10 -4.741 -9.480 -9.298 1.00 63.42 C ATOM 170 CG ASN A 10 -5.628 -10.678 -9.698 1.00 51.45 C ATOM 171 OD1 ASN A 10 -6.146 -11.412 -8.850 1.00 1.52 O ATOM 172 ND2 ASN A 10 -5.820 -10.876 -10.998 1.00 61.24 N ATOM 0 H ASN A 10 -3.121 -7.794 -8.528 1.00 13.13 H new ATOM 0 HA ASN A 10 -4.630 -9.836 -7.159 1.00 33.04 H new ATOM 0 HB2 ASN A 10 -5.374 -8.598 -9.203 1.00 63.42 H new ATOM 0 HB3 ASN A 10 -4.040 -9.283 -10.109 1.00 63.42 H new ATOM 0 HD21 ASN A 10 -6.406 -11.648 -11.315 1.00 61.24 H new ATOM 0 HD22 ASN A 10 -5.381 -10.256 -11.679 1.00 61.24 H new ATOM 179 N ASN A 11 -1.685 -10.580 -8.271 1.00 23.31 N ATOM 180 CA ASN A 11 -0.629 -11.579 -8.462 1.00 72.35 C ATOM 181 C ASN A 11 -0.005 -11.949 -7.103 1.00 75.33 C ATOM 182 O ASN A 11 0.743 -11.144 -6.530 1.00 24.24 O ATOM 183 CB ASN A 11 0.454 -11.006 -9.416 1.00 5.41 C ATOM 184 CG ASN A 11 -0.120 -10.412 -10.706 1.00 54.23 C ATOM 185 OD1 ASN A 11 -1.158 -10.846 -11.208 1.00 31.13 O ATOM 186 ND2 ASN A 11 0.544 -9.402 -11.245 1.00 21.00 N ATOM 0 H ASN A 11 -1.341 -9.621 -8.324 1.00 23.31 H new ATOM 0 HA ASN A 11 -1.054 -12.480 -8.905 1.00 72.35 H new ATOM 0 HB2 ASN A 11 1.019 -10.236 -8.891 1.00 5.41 H new ATOM 0 HB3 ASN A 11 1.157 -11.798 -9.672 1.00 5.41 H new ATOM 0 HD21 ASN A 11 0.199 -8.962 -12.098 1.00 21.00 H new ATOM 0 HD22 ASN A 11 1.401 -9.064 -10.807 1.00 21.00 H new ATOM 193 N ASP A 12 -0.318 -13.162 -6.599 1.00 42.55 N ATOM 194 CA ASP A 12 0.167 -13.650 -5.283 1.00 40.20 C ATOM 195 C ASP A 12 1.696 -13.805 -5.259 1.00 44.02 C ATOM 196 O ASP A 12 2.327 -13.580 -4.225 1.00 31.40 O ATOM 197 CB ASP A 12 -0.482 -15.009 -4.902 1.00 31.42 C ATOM 198 CG ASP A 12 -2.000 -14.927 -4.701 1.00 43.53 C ATOM 199 OD1 ASP A 12 -2.744 -14.997 -5.699 1.00 53.10 O ATOM 200 OD2 ASP A 12 -2.459 -14.806 -3.544 1.00 2.33 O ATOM 0 H ASP A 12 -0.912 -13.831 -7.089 1.00 42.55 H new ATOM 0 HA ASP A 12 -0.125 -12.895 -4.553 1.00 40.20 H new ATOM 0 HB2 ASP A 12 -0.266 -15.738 -5.683 1.00 31.42 H new ATOM 0 HB3 ASP A 12 -0.022 -15.378 -3.986 1.00 31.42 H new ATOM 205 N GLU A 13 2.273 -14.202 -6.405 1.00 22.42 N ATOM 206 CA GLU A 13 3.727 -14.397 -6.551 1.00 1.34 C ATOM 207 C GLU A 13 4.475 -13.062 -6.399 1.00 51.12 C ATOM 208 O GLU A 13 5.561 -13.014 -5.816 1.00 25.10 O ATOM 209 CB GLU A 13 4.059 -15.061 -7.910 1.00 73.55 C ATOM 210 CG GLU A 13 3.443 -16.461 -8.095 1.00 63.35 C ATOM 211 CD GLU A 13 3.920 -17.166 -9.373 1.00 74.02 C ATOM 212 OE1 GLU A 13 4.961 -17.860 -9.328 1.00 62.44 O ATOM 213 OE2 GLU A 13 3.268 -17.022 -10.430 1.00 22.31 O ATOM 0 H GLU A 13 1.746 -14.397 -7.256 1.00 22.42 H new ATOM 0 HA GLU A 13 4.061 -15.065 -5.757 1.00 1.34 H new ATOM 0 HB2 GLU A 13 3.709 -14.413 -8.714 1.00 73.55 H new ATOM 0 HB3 GLU A 13 5.142 -15.136 -8.010 1.00 73.55 H new ATOM 0 HG2 GLU A 13 3.693 -17.078 -7.232 1.00 63.35 H new ATOM 0 HG3 GLU A 13 2.357 -16.373 -8.120 1.00 63.35 H new ATOM 220 N LEU A 14 3.856 -11.977 -6.901 1.00 34.30 N ATOM 221 CA LEU A 14 4.393 -10.616 -6.767 1.00 64.53 C ATOM 222 C LEU A 14 4.263 -10.124 -5.307 1.00 53.45 C ATOM 223 O LEU A 14 5.174 -9.456 -4.803 1.00 13.03 O ATOM 224 CB LEU A 14 3.678 -9.655 -7.753 1.00 43.22 C ATOM 225 CG LEU A 14 4.098 -8.150 -7.693 1.00 33.33 C ATOM 226 CD1 LEU A 14 5.634 -7.967 -7.785 1.00 41.43 C ATOM 227 CD2 LEU A 14 3.357 -7.340 -8.780 1.00 32.42 C ATOM 0 H LEU A 14 2.973 -12.022 -7.409 1.00 34.30 H new ATOM 0 HA LEU A 14 5.453 -10.629 -7.020 1.00 64.53 H new ATOM 0 HB2 LEU A 14 3.851 -10.017 -8.767 1.00 43.22 H new ATOM 0 HB3 LEU A 14 2.605 -9.717 -7.571 1.00 43.22 H new ATOM 0 HG LEU A 14 3.803 -7.761 -6.719 1.00 33.33 H new ATOM 0 HD11 LEU A 14 5.877 -6.905 -7.739 1.00 41.43 H new ATOM 0 HD12 LEU A 14 6.113 -8.485 -6.954 1.00 41.43 H new ATOM 0 HD13 LEU A 14 5.994 -8.381 -8.727 1.00 41.43 H new ATOM 0 HD21 LEU A 14 3.660 -6.295 -8.725 1.00 32.42 H new ATOM 0 HD22 LEU A 14 3.606 -7.739 -9.764 1.00 32.42 H new ATOM 0 HD23 LEU A 14 2.281 -7.415 -8.620 1.00 32.42 H new ATOM 239 N ILE A 15 3.137 -10.483 -4.636 1.00 72.54 N ATOM 240 CA ILE A 15 2.929 -10.198 -3.192 1.00 23.50 C ATOM 241 C ILE A 15 4.100 -10.772 -2.370 1.00 30.05 C ATOM 242 O ILE A 15 4.715 -10.058 -1.576 1.00 43.04 O ATOM 243 CB ILE A 15 1.566 -10.793 -2.641 1.00 45.53 C ATOM 244 CG1 ILE A 15 0.354 -10.229 -3.428 1.00 51.32 C ATOM 245 CG2 ILE A 15 1.402 -10.514 -1.134 1.00 31.34 C ATOM 246 CD1 ILE A 15 -1.007 -10.729 -2.984 1.00 53.20 C ATOM 0 H ILE A 15 2.357 -10.972 -5.075 1.00 72.54 H new ATOM 0 HA ILE A 15 2.883 -9.114 -3.087 1.00 23.50 H new ATOM 0 HB ILE A 15 1.599 -11.873 -2.785 1.00 45.53 H new ATOM 0 HG12 ILE A 15 0.366 -9.142 -3.347 1.00 51.32 H new ATOM 0 HG13 ILE A 15 0.484 -10.472 -4.483 1.00 51.32 H new ATOM 0 HG21 ILE A 15 0.458 -10.934 -0.787 1.00 31.34 H new ATOM 0 HG22 ILE A 15 2.226 -10.972 -0.587 1.00 31.34 H new ATOM 0 HG23 ILE A 15 1.405 -9.438 -0.961 1.00 31.34 H new ATOM 0 HD11 ILE A 15 -1.781 -10.272 -3.600 1.00 53.20 H new ATOM 0 HD12 ILE A 15 -1.050 -11.813 -3.092 1.00 53.20 H new ATOM 0 HD13 ILE A 15 -1.170 -10.462 -1.940 1.00 53.20 H new ATOM 258 N LYS A 16 4.420 -12.052 -2.647 1.00 70.40 N ATOM 259 CA LYS A 16 5.513 -12.800 -1.991 1.00 50.05 C ATOM 260 C LYS A 16 6.855 -12.046 -2.074 1.00 72.22 C ATOM 261 O LYS A 16 7.567 -11.921 -1.072 1.00 70.14 O ATOM 262 CB LYS A 16 5.663 -14.201 -2.644 1.00 21.52 C ATOM 263 CG LYS A 16 4.470 -15.155 -2.423 1.00 14.31 C ATOM 264 CD LYS A 16 4.584 -16.460 -3.243 1.00 70.43 C ATOM 265 CE LYS A 16 5.850 -17.273 -2.925 1.00 61.13 C ATOM 266 NZ LYS A 16 5.882 -17.748 -1.515 1.00 14.25 N ATOM 0 H LYS A 16 3.919 -12.604 -3.343 1.00 70.40 H new ATOM 0 HA LYS A 16 5.252 -12.907 -0.938 1.00 50.05 H new ATOM 0 HB2 LYS A 16 5.811 -14.072 -3.716 1.00 21.52 H new ATOM 0 HB3 LYS A 16 6.564 -14.673 -2.252 1.00 21.52 H new ATOM 0 HG2 LYS A 16 4.400 -15.402 -1.364 1.00 14.31 H new ATOM 0 HG3 LYS A 16 3.547 -14.642 -2.692 1.00 14.31 H new ATOM 0 HD2 LYS A 16 3.707 -17.078 -3.052 1.00 70.43 H new ATOM 0 HD3 LYS A 16 4.576 -16.215 -4.305 1.00 70.43 H new ATOM 0 HE2 LYS A 16 5.905 -18.131 -3.595 1.00 61.13 H new ATOM 0 HE3 LYS A 16 6.730 -16.660 -3.119 1.00 61.13 H new ATOM 0 HZ1 LYS A 16 6.746 -18.305 -1.356 1.00 14.25 H new ATOM 0 HZ2 LYS A 16 5.874 -16.930 -0.873 1.00 14.25 H new ATOM 0 HZ3 LYS A 16 5.049 -18.342 -1.330 1.00 14.25 H new ATOM 280 N LYS A 17 7.160 -11.523 -3.271 1.00 3.25 N ATOM 281 CA LYS A 17 8.435 -10.837 -3.550 1.00 65.41 C ATOM 282 C LYS A 17 8.518 -9.474 -2.832 1.00 70.03 C ATOM 283 O LYS A 17 9.586 -9.090 -2.344 1.00 53.02 O ATOM 284 CB LYS A 17 8.617 -10.676 -5.081 1.00 51.30 C ATOM 285 CG LYS A 17 8.625 -12.024 -5.841 1.00 3.24 C ATOM 286 CD LYS A 17 8.766 -11.868 -7.373 1.00 21.33 C ATOM 287 CE LYS A 17 10.108 -11.253 -7.782 1.00 0.44 C ATOM 288 NZ LYS A 17 10.270 -11.186 -9.265 1.00 34.03 N ATOM 0 H LYS A 17 6.532 -11.563 -4.074 1.00 3.25 H new ATOM 0 HA LYS A 17 9.248 -11.449 -3.160 1.00 65.41 H new ATOM 0 HB2 LYS A 17 7.814 -10.051 -5.472 1.00 51.30 H new ATOM 0 HB3 LYS A 17 9.552 -10.151 -5.276 1.00 51.30 H new ATOM 0 HG2 LYS A 17 9.446 -12.637 -5.469 1.00 3.24 H new ATOM 0 HG3 LYS A 17 7.702 -12.561 -5.622 1.00 3.24 H new ATOM 0 HD2 LYS A 17 8.659 -12.845 -7.845 1.00 21.33 H new ATOM 0 HD3 LYS A 17 7.955 -11.243 -7.747 1.00 21.33 H new ATOM 0 HE2 LYS A 17 10.188 -10.250 -7.364 1.00 0.44 H new ATOM 0 HE3 LYS A 17 10.920 -11.842 -7.356 1.00 0.44 H new ATOM 0 HZ1 LYS A 17 11.185 -10.748 -9.495 1.00 34.03 H new ATOM 0 HZ2 LYS A 17 10.237 -12.147 -9.662 1.00 34.03 H new ATOM 0 HZ3 LYS A 17 9.501 -10.617 -9.673 1.00 34.03 H new ATOM 302 N ILE A 18 7.375 -8.772 -2.749 1.00 34.41 N ATOM 303 CA ILE A 18 7.279 -7.464 -2.070 1.00 50.54 C ATOM 304 C ILE A 18 7.436 -7.633 -0.536 1.00 44.24 C ATOM 305 O ILE A 18 7.999 -6.752 0.135 1.00 52.12 O ATOM 306 CB ILE A 18 5.935 -6.732 -2.452 1.00 41.44 C ATOM 307 CG1 ILE A 18 5.920 -6.429 -3.991 1.00 41.02 C ATOM 308 CG2 ILE A 18 5.731 -5.439 -1.624 1.00 44.45 C ATOM 309 CD1 ILE A 18 4.629 -5.831 -4.526 1.00 34.44 C ATOM 0 H ILE A 18 6.493 -9.092 -3.149 1.00 34.41 H new ATOM 0 HA ILE A 18 8.097 -6.831 -2.412 1.00 50.54 H new ATOM 0 HB ILE A 18 5.102 -7.393 -2.212 1.00 41.44 H new ATOM 0 HG12 ILE A 18 6.738 -5.745 -4.217 1.00 41.02 H new ATOM 0 HG13 ILE A 18 6.121 -7.356 -4.528 1.00 41.02 H new ATOM 0 HG21 ILE A 18 4.795 -4.964 -1.916 1.00 44.45 H new ATOM 0 HG22 ILE A 18 5.696 -5.688 -0.563 1.00 44.45 H new ATOM 0 HG23 ILE A 18 6.559 -4.754 -1.809 1.00 44.45 H new ATOM 0 HD11 ILE A 18 4.724 -5.660 -5.598 1.00 34.44 H new ATOM 0 HD12 ILE A 18 3.805 -6.519 -4.340 1.00 34.44 H new ATOM 0 HD13 ILE A 18 4.431 -4.884 -4.024 1.00 34.44 H new ATOM 321 N LYS A 19 6.982 -8.795 0.002 1.00 3.11 N ATOM 322 CA LYS A 19 7.276 -9.182 1.402 1.00 32.33 C ATOM 323 C LYS A 19 8.792 -9.261 1.601 1.00 2.12 C ATOM 324 O LYS A 19 9.325 -8.600 2.477 1.00 53.52 O ATOM 325 CB LYS A 19 6.623 -10.541 1.823 1.00 34.34 C ATOM 326 CG LYS A 19 5.217 -10.428 2.430 1.00 14.50 C ATOM 327 CD LYS A 19 4.162 -9.979 1.414 1.00 55.41 C ATOM 328 CE LYS A 19 2.789 -9.802 2.045 1.00 75.32 C ATOM 329 NZ LYS A 19 2.331 -11.027 2.757 1.00 30.11 N ATOM 0 H LYS A 19 6.416 -9.473 -0.509 1.00 3.11 H new ATOM 0 HA LYS A 19 6.839 -8.413 2.039 1.00 32.33 H new ATOM 0 HB2 LYS A 19 6.573 -11.189 0.948 1.00 34.34 H new ATOM 0 HB3 LYS A 19 7.275 -11.031 2.546 1.00 34.34 H new ATOM 0 HG2 LYS A 19 4.927 -11.394 2.844 1.00 14.50 H new ATOM 0 HG3 LYS A 19 5.240 -9.720 3.258 1.00 14.50 H new ATOM 0 HD2 LYS A 19 4.475 -9.038 0.961 1.00 55.41 H new ATOM 0 HD3 LYS A 19 4.098 -10.714 0.611 1.00 55.41 H new ATOM 0 HE2 LYS A 19 2.819 -8.967 2.745 1.00 75.32 H new ATOM 0 HE3 LYS A 19 2.067 -9.543 1.271 1.00 75.32 H new ATOM 0 HZ1 LYS A 19 1.296 -11.003 2.858 1.00 30.11 H new ATOM 0 HZ2 LYS A 19 2.607 -11.869 2.212 1.00 30.11 H new ATOM 0 HZ3 LYS A 19 2.770 -11.065 3.699 1.00 30.11 H new ATOM 343 N LYS A 20 9.465 -10.033 0.729 1.00 40.33 N ATOM 344 CA LYS A 20 10.925 -10.275 0.829 1.00 54.45 C ATOM 345 C LYS A 20 11.723 -8.952 0.819 1.00 23.12 C ATOM 346 O LYS A 20 12.724 -8.818 1.536 1.00 23.20 O ATOM 347 CB LYS A 20 11.435 -11.213 -0.305 1.00 10.15 C ATOM 348 CG LYS A 20 10.679 -12.558 -0.445 1.00 73.23 C ATOM 349 CD LYS A 20 10.544 -13.365 0.875 1.00 0.44 C ATOM 350 CE LYS A 20 11.897 -13.766 1.499 1.00 61.41 C ATOM 351 NZ LYS A 20 12.740 -14.577 0.578 1.00 4.31 N ATOM 0 H LYS A 20 9.022 -10.505 -0.059 1.00 40.33 H new ATOM 0 HA LYS A 20 11.092 -10.772 1.785 1.00 54.45 H new ATOM 0 HB2 LYS A 20 11.369 -10.678 -1.253 1.00 10.15 H new ATOM 0 HB3 LYS A 20 12.490 -11.425 -0.131 1.00 10.15 H new ATOM 0 HG2 LYS A 20 9.682 -12.360 -0.838 1.00 73.23 H new ATOM 0 HG3 LYS A 20 11.195 -13.175 -1.181 1.00 73.23 H new ATOM 0 HD2 LYS A 20 9.983 -12.772 1.597 1.00 0.44 H new ATOM 0 HD3 LYS A 20 9.962 -14.266 0.681 1.00 0.44 H new ATOM 0 HE2 LYS A 20 12.441 -12.866 1.784 1.00 61.41 H new ATOM 0 HE3 LYS A 20 11.717 -14.332 2.413 1.00 61.41 H new ATOM 0 HZ1 LYS A 20 13.613 -14.861 1.066 1.00 4.31 H new ATOM 0 HZ2 LYS A 20 12.216 -15.426 0.285 1.00 4.31 H new ATOM 0 HZ3 LYS A 20 12.980 -14.012 -0.261 1.00 4.31 H new ATOM 365 N GLU A 21 11.243 -7.978 0.020 1.00 34.24 N ATOM 366 CA GLU A 21 11.800 -6.614 -0.012 1.00 64.45 C ATOM 367 C GLU A 21 11.691 -5.924 1.364 1.00 54.01 C ATOM 368 O GLU A 21 12.697 -5.421 1.891 1.00 34.01 O ATOM 369 CB GLU A 21 11.098 -5.749 -1.100 1.00 43.20 C ATOM 370 CG GLU A 21 11.391 -6.171 -2.551 1.00 72.52 C ATOM 371 CD GLU A 21 12.894 -6.149 -2.891 1.00 65.23 C ATOM 372 OE1 GLU A 21 13.462 -5.044 -3.049 1.00 10.44 O ATOM 373 OE2 GLU A 21 13.518 -7.234 -2.968 1.00 71.34 O ATOM 0 H GLU A 21 10.460 -8.116 -0.619 1.00 34.24 H new ATOM 0 HA GLU A 21 12.857 -6.705 -0.264 1.00 64.45 H new ATOM 0 HB2 GLU A 21 10.021 -5.788 -0.936 1.00 43.20 H new ATOM 0 HB3 GLU A 21 11.403 -4.710 -0.970 1.00 43.20 H new ATOM 0 HG2 GLU A 21 11.001 -7.175 -2.718 1.00 72.52 H new ATOM 0 HG3 GLU A 21 10.860 -5.506 -3.232 1.00 72.52 H new ATOM 380 N VAL A 22 10.476 -5.919 1.948 1.00 2.03 N ATOM 381 CA VAL A 22 10.217 -5.214 3.225 1.00 50.41 C ATOM 382 C VAL A 22 10.793 -5.976 4.449 1.00 3.13 C ATOM 383 O VAL A 22 11.021 -5.364 5.495 1.00 34.43 O ATOM 384 CB VAL A 22 8.688 -4.900 3.430 1.00 25.55 C ATOM 385 CG1 VAL A 22 8.087 -4.190 2.195 1.00 64.41 C ATOM 386 CG2 VAL A 22 7.877 -6.152 3.818 1.00 25.41 C ATOM 0 H VAL A 22 9.660 -6.392 1.560 1.00 2.03 H new ATOM 0 HA VAL A 22 10.744 -4.263 3.155 1.00 50.41 H new ATOM 0 HB VAL A 22 8.618 -4.212 4.273 1.00 25.55 H new ATOM 0 HG11 VAL A 22 7.030 -3.988 2.370 1.00 64.41 H new ATOM 0 HG12 VAL A 22 8.613 -3.251 2.024 1.00 64.41 H new ATOM 0 HG13 VAL A 22 8.194 -4.830 1.319 1.00 64.41 H new ATOM 0 HG21 VAL A 22 6.829 -5.881 3.948 1.00 25.41 H new ATOM 0 HG22 VAL A 22 7.964 -6.900 3.030 1.00 25.41 H new ATOM 0 HG23 VAL A 22 8.264 -6.561 4.751 1.00 25.41 H new ATOM 396 N GLU A 23 11.053 -7.298 4.296 1.00 33.43 N ATOM 397 CA GLU A 23 11.673 -8.131 5.357 1.00 75.13 C ATOM 398 C GLU A 23 13.127 -7.696 5.583 1.00 72.14 C ATOM 399 O GLU A 23 13.587 -7.570 6.724 1.00 5.13 O ATOM 400 CB GLU A 23 11.628 -9.646 5.001 1.00 75.51 C ATOM 401 CG GLU A 23 10.222 -10.278 4.961 1.00 24.23 C ATOM 402 CD GLU A 23 9.440 -10.144 6.281 1.00 21.31 C ATOM 403 OE1 GLU A 23 9.614 -11.005 7.178 1.00 60.50 O ATOM 404 OE2 GLU A 23 8.633 -9.199 6.422 1.00 42.31 O ATOM 0 H GLU A 23 10.841 -7.813 3.442 1.00 33.43 H new ATOM 0 HA GLU A 23 11.098 -7.983 6.271 1.00 75.13 H new ATOM 0 HB2 GLU A 23 12.098 -9.787 4.028 1.00 75.51 H new ATOM 0 HB3 GLU A 23 12.231 -10.190 5.728 1.00 75.51 H new ATOM 0 HG2 GLU A 23 9.647 -9.812 4.161 1.00 24.23 H new ATOM 0 HG3 GLU A 23 10.316 -11.335 4.712 1.00 24.23 H new ATOM 411 N ASN A 24 13.821 -7.451 4.462 1.00 74.45 N ATOM 412 CA ASN A 24 15.206 -6.939 4.444 1.00 73.43 C ATOM 413 C ASN A 24 15.304 -5.554 5.114 1.00 23.31 C ATOM 414 O ASN A 24 16.351 -5.183 5.641 1.00 5.30 O ATOM 415 CB ASN A 24 15.711 -6.859 2.973 1.00 42.34 C ATOM 416 CG ASN A 24 15.893 -8.232 2.307 1.00 42.03 C ATOM 417 OD1 ASN A 24 15.289 -9.230 2.701 1.00 11.44 O ATOM 418 ND2 ASN A 24 16.705 -8.283 1.265 1.00 24.15 N ATOM 0 H ASN A 24 13.435 -7.603 3.530 1.00 74.45 H new ATOM 0 HA ASN A 24 15.833 -7.627 5.012 1.00 73.43 H new ATOM 0 HB2 ASN A 24 15.004 -6.272 2.387 1.00 42.34 H new ATOM 0 HB3 ASN A 24 16.662 -6.326 2.953 1.00 42.34 H new ATOM 0 HD21 ASN A 24 16.842 -9.163 0.768 1.00 24.15 H new ATOM 0 HD22 ASN A 24 17.194 -7.442 0.958 1.00 24.15 H new ATOM 425 N GLN A 25 14.193 -4.800 5.074 1.00 41.15 N ATOM 426 CA GLN A 25 14.116 -3.417 5.594 1.00 54.42 C ATOM 427 C GLN A 25 13.544 -3.364 7.026 1.00 34.41 C ATOM 428 O GLN A 25 13.642 -2.329 7.701 1.00 50.30 O ATOM 429 CB GLN A 25 13.262 -2.567 4.625 1.00 64.43 C ATOM 430 CG GLN A 25 13.776 -2.550 3.174 1.00 55.24 C ATOM 431 CD GLN A 25 15.151 -1.896 3.025 1.00 42.10 C ATOM 432 OE1 GLN A 25 15.248 -0.690 2.804 1.00 42.12 O ATOM 433 NE2 GLN A 25 16.219 -2.678 3.135 1.00 25.21 N ATOM 0 H GLN A 25 13.314 -5.132 4.677 1.00 41.15 H new ATOM 0 HA GLN A 25 15.126 -3.010 5.652 1.00 54.42 H new ATOM 0 HB2 GLN A 25 12.240 -2.947 4.631 1.00 64.43 H new ATOM 0 HB3 GLN A 25 13.224 -1.543 4.996 1.00 64.43 H new ATOM 0 HG2 GLN A 25 13.826 -3.573 2.802 1.00 55.24 H new ATOM 0 HG3 GLN A 25 13.059 -2.018 2.548 1.00 55.24 H new ATOM 0 HE21 GLN A 25 16.105 -3.675 3.319 1.00 25.21 H new ATOM 0 HE22 GLN A 25 17.154 -2.282 3.036 1.00 25.21 H new ATOM 442 N GLY A 26 12.932 -4.477 7.471 1.00 22.31 N ATOM 443 CA GLY A 26 12.428 -4.612 8.841 1.00 61.32 C ATOM 444 C GLY A 26 11.046 -4.000 9.063 1.00 65.32 C ATOM 445 O GLY A 26 10.741 -3.533 10.170 1.00 44.43 O ATOM 0 H GLY A 26 12.776 -5.301 6.891 1.00 22.31 H new ATOM 0 HA2 GLY A 26 12.390 -5.670 9.100 1.00 61.32 H new ATOM 0 HA3 GLY A 26 13.135 -4.142 9.524 1.00 61.32 H new ATOM 449 N TYR A 27 10.214 -3.982 8.006 1.00 20.52 N ATOM 450 CA TYR A 27 8.790 -3.585 8.102 1.00 4.01 C ATOM 451 C TYR A 27 7.952 -4.769 8.610 1.00 71.42 C ATOM 452 O TYR A 27 8.293 -5.931 8.357 1.00 11.13 O ATOM 453 CB TYR A 27 8.221 -3.138 6.722 1.00 30.51 C ATOM 454 CG TYR A 27 8.737 -1.807 6.146 1.00 4.53 C ATOM 455 CD1 TYR A 27 10.098 -1.499 6.110 1.00 44.43 C ATOM 456 CD2 TYR A 27 7.849 -0.869 5.600 1.00 22.23 C ATOM 457 CE1 TYR A 27 10.552 -0.312 5.562 1.00 4.45 C ATOM 458 CE2 TYR A 27 8.302 0.319 5.056 1.00 74.43 C ATOM 459 CZ TYR A 27 9.653 0.593 5.036 1.00 34.32 C ATOM 460 OH TYR A 27 10.113 1.779 4.493 1.00 22.41 O ATOM 0 H TYR A 27 10.504 -4.240 7.063 1.00 20.52 H new ATOM 0 HA TYR A 27 8.733 -2.745 8.795 1.00 4.01 H new ATOM 0 HB2 TYR A 27 8.434 -3.925 5.998 1.00 30.51 H new ATOM 0 HB3 TYR A 27 7.137 -3.070 6.810 1.00 30.51 H new ATOM 0 HD1 TYR A 27 10.811 -2.201 6.518 1.00 44.43 H new ATOM 0 HD2 TYR A 27 6.790 -1.079 5.604 1.00 22.23 H new ATOM 0 HE1 TYR A 27 11.610 -0.094 5.546 1.00 4.45 H new ATOM 0 HE2 TYR A 27 7.599 1.030 4.648 1.00 74.43 H new ATOM 0 HH TYR A 27 10.568 1.596 3.645 1.00 22.41 H new ATOM 470 N GLN A 28 6.849 -4.463 9.308 1.00 31.20 N ATOM 471 CA GLN A 28 5.846 -5.474 9.688 1.00 22.43 C ATOM 472 C GLN A 28 4.939 -5.726 8.481 1.00 14.24 C ATOM 473 O GLN A 28 4.840 -4.884 7.593 1.00 63.13 O ATOM 474 CB GLN A 28 4.981 -5.035 10.907 1.00 53.02 C ATOM 475 CG GLN A 28 5.744 -4.724 12.211 1.00 64.35 C ATOM 476 CD GLN A 28 6.551 -3.425 12.151 1.00 0.30 C ATOM 477 OE1 GLN A 28 7.753 -3.414 11.861 1.00 53.22 O ATOM 478 NE2 GLN A 28 5.878 -2.313 12.359 1.00 22.22 N ATOM 0 H GLN A 28 6.626 -3.519 9.623 1.00 31.20 H new ATOM 0 HA GLN A 28 6.373 -6.380 9.986 1.00 22.43 H new ATOM 0 HB2 GLN A 28 4.414 -4.148 10.623 1.00 53.02 H new ATOM 0 HB3 GLN A 28 4.257 -5.823 11.114 1.00 53.02 H new ATOM 0 HG2 GLN A 28 5.032 -4.662 13.034 1.00 64.35 H new ATOM 0 HG3 GLN A 28 6.418 -5.551 12.434 1.00 64.35 H new ATOM 0 HE21 GLN A 28 4.887 -2.354 12.597 1.00 22.22 H new ATOM 0 HE22 GLN A 28 6.348 -1.411 12.282 1.00 22.22 H new ATOM 487 N VAL A 29 4.282 -6.882 8.449 1.00 11.32 N ATOM 488 CA VAL A 29 3.401 -7.271 7.335 1.00 42.35 C ATOM 489 C VAL A 29 2.057 -7.759 7.883 1.00 64.11 C ATOM 490 O VAL A 29 1.996 -8.814 8.524 1.00 41.22 O ATOM 491 CB VAL A 29 4.042 -8.396 6.427 1.00 64.13 C ATOM 492 CG1 VAL A 29 3.042 -8.864 5.351 1.00 25.41 C ATOM 493 CG2 VAL A 29 5.368 -7.925 5.781 1.00 45.14 C ATOM 0 H VAL A 29 4.340 -7.580 9.191 1.00 11.32 H new ATOM 0 HA VAL A 29 3.256 -6.388 6.712 1.00 42.35 H new ATOM 0 HB VAL A 29 4.277 -9.243 7.071 1.00 64.13 H new ATOM 0 HG11 VAL A 29 3.503 -9.638 4.738 1.00 25.41 H new ATOM 0 HG12 VAL A 29 2.151 -9.266 5.833 1.00 25.41 H new ATOM 0 HG13 VAL A 29 2.764 -8.019 4.721 1.00 25.41 H new ATOM 0 HG21 VAL A 29 5.777 -8.726 5.165 1.00 45.14 H new ATOM 0 HG22 VAL A 29 5.179 -7.050 5.160 1.00 45.14 H new ATOM 0 HG23 VAL A 29 6.082 -7.668 6.563 1.00 45.14 H new ATOM 503 N ARG A 30 0.993 -6.976 7.645 1.00 60.41 N ATOM 504 CA ARG A 30 -0.386 -7.404 7.897 1.00 33.12 C ATOM 505 C ARG A 30 -1.069 -7.734 6.557 1.00 42.33 C ATOM 506 O ARG A 30 -1.150 -6.878 5.672 1.00 41.23 O ATOM 507 CB ARG A 30 -1.188 -6.311 8.654 1.00 23.02 C ATOM 508 CG ARG A 30 -2.679 -6.672 8.870 1.00 22.14 C ATOM 509 CD ARG A 30 -2.884 -7.937 9.740 1.00 13.15 C ATOM 510 NE ARG A 30 -4.197 -8.560 9.511 1.00 54.03 N ATOM 511 CZ ARG A 30 -4.720 -9.544 10.253 1.00 2.10 C ATOM 512 NH1 ARG A 30 -4.074 -10.045 11.310 1.00 11.15 N ATOM 513 NH2 ARG A 30 -5.875 -10.077 9.897 1.00 43.04 N ATOM 0 H ARG A 30 1.068 -6.029 7.273 1.00 60.41 H new ATOM 0 HA ARG A 30 -0.364 -8.293 8.528 1.00 33.12 H new ATOM 0 HB2 ARG A 30 -0.721 -6.136 9.623 1.00 23.02 H new ATOM 0 HB3 ARG A 30 -1.126 -5.376 8.097 1.00 23.02 H new ATOM 0 HG2 ARG A 30 -3.185 -5.829 9.342 1.00 22.14 H new ATOM 0 HG3 ARG A 30 -3.152 -6.826 7.900 1.00 22.14 H new ATOM 0 HD2 ARG A 30 -2.098 -8.659 9.520 1.00 13.15 H new ATOM 0 HD3 ARG A 30 -2.788 -7.672 10.793 1.00 13.15 H new ATOM 0 HE ARG A 30 -4.751 -8.216 8.727 1.00 54.03 H new ATOM 0 HH11 ARG A 30 -3.158 -9.678 11.569 1.00 11.15 H new ATOM 0 HH12 ARG A 30 -4.496 -10.795 11.858 1.00 11.15 H new ATOM 0 HH21 ARG A 30 -6.358 -9.738 9.065 1.00 43.04 H new ATOM 0 HH22 ARG A 30 -6.284 -10.827 10.454 1.00 43.04 H new ATOM 527 N ASP A 31 -1.531 -8.986 6.422 1.00 74.42 N ATOM 528 CA ASP A 31 -2.371 -9.431 5.301 1.00 24.10 C ATOM 529 C ASP A 31 -3.849 -9.225 5.666 1.00 52.15 C ATOM 530 O ASP A 31 -4.332 -9.749 6.679 1.00 54.43 O ATOM 531 CB ASP A 31 -2.077 -10.919 4.977 1.00 40.31 C ATOM 532 CG ASP A 31 -0.667 -11.131 4.400 1.00 60.04 C ATOM 533 OD1 ASP A 31 0.312 -11.242 5.173 1.00 3.12 O ATOM 534 OD2 ASP A 31 -0.523 -11.171 3.164 1.00 10.42 O ATOM 0 H ASP A 31 -1.330 -9.725 7.095 1.00 74.42 H new ATOM 0 HA ASP A 31 -2.145 -8.843 4.411 1.00 24.10 H new ATOM 0 HB2 ASP A 31 -2.188 -11.513 5.884 1.00 40.31 H new ATOM 0 HB3 ASP A 31 -2.816 -11.285 4.264 1.00 40.31 H new ATOM 539 N VAL A 32 -4.537 -8.418 4.853 1.00 1.04 N ATOM 540 CA VAL A 32 -5.975 -8.131 4.987 1.00 1.15 C ATOM 541 C VAL A 32 -6.720 -8.805 3.823 1.00 20.34 C ATOM 542 O VAL A 32 -6.300 -8.689 2.662 1.00 0.22 O ATOM 543 CB VAL A 32 -6.254 -6.574 4.993 1.00 51.04 C ATOM 544 CG1 VAL A 32 -7.770 -6.255 5.042 1.00 35.12 C ATOM 545 CG2 VAL A 32 -5.493 -5.887 6.153 1.00 4.51 C ATOM 0 H VAL A 32 -4.104 -7.934 4.066 1.00 1.04 H new ATOM 0 HA VAL A 32 -6.331 -8.527 5.938 1.00 1.15 H new ATOM 0 HB VAL A 32 -5.879 -6.169 4.053 1.00 51.04 H new ATOM 0 HG11 VAL A 32 -7.915 -5.175 5.045 1.00 35.12 H new ATOM 0 HG12 VAL A 32 -8.261 -6.685 4.169 1.00 35.12 H new ATOM 0 HG13 VAL A 32 -8.202 -6.681 5.947 1.00 35.12 H new ATOM 0 HG21 VAL A 32 -5.698 -4.817 6.139 1.00 4.51 H new ATOM 0 HG22 VAL A 32 -5.822 -6.307 7.103 1.00 4.51 H new ATOM 0 HG23 VAL A 32 -4.422 -6.053 6.034 1.00 4.51 H new ATOM 555 N ASN A 33 -7.790 -9.550 4.152 1.00 52.24 N ATOM 556 CA ASN A 33 -8.685 -10.189 3.159 1.00 51.33 C ATOM 557 C ASN A 33 -10.039 -9.462 3.173 1.00 43.33 C ATOM 558 O ASN A 33 -10.537 -8.992 2.142 1.00 51.11 O ATOM 559 CB ASN A 33 -8.902 -11.698 3.492 1.00 71.51 C ATOM 560 CG ASN A 33 -7.599 -12.490 3.632 1.00 3.41 C ATOM 561 OD1 ASN A 33 -7.099 -13.079 2.673 1.00 20.04 O ATOM 562 ND2 ASN A 33 -7.036 -12.502 4.833 1.00 63.33 N ATOM 0 H ASN A 33 -8.063 -9.729 5.118 1.00 52.24 H new ATOM 0 HA ASN A 33 -8.226 -10.120 2.173 1.00 51.33 H new ATOM 0 HB2 ASN A 33 -9.468 -11.779 4.420 1.00 71.51 H new ATOM 0 HB3 ASN A 33 -9.510 -12.150 2.708 1.00 71.51 H new ATOM 0 HD21 ASN A 33 -6.164 -13.009 4.982 1.00 63.33 H new ATOM 0 HD22 ASN A 33 -7.475 -12.004 5.607 1.00 63.33 H new ATOM 569 N ASP A 34 -10.600 -9.345 4.381 1.00 13.12 N ATOM 570 CA ASP A 34 -11.972 -8.851 4.612 1.00 25.01 C ATOM 571 C ASP A 34 -11.963 -7.472 5.305 1.00 70.43 C ATOM 572 O ASP A 34 -10.963 -7.073 5.926 1.00 72.34 O ATOM 573 CB ASP A 34 -12.752 -9.903 5.456 1.00 44.44 C ATOM 574 CG ASP A 34 -14.218 -9.523 5.756 1.00 41.14 C ATOM 575 OD1 ASP A 34 -14.974 -9.223 4.805 1.00 54.54 O ATOM 576 OD2 ASP A 34 -14.612 -9.496 6.935 1.00 25.14 O ATOM 0 H ASP A 34 -10.111 -9.593 5.241 1.00 13.12 H new ATOM 0 HA ASP A 34 -12.472 -8.717 3.653 1.00 25.01 H new ATOM 0 HB2 ASP A 34 -12.738 -10.857 4.928 1.00 44.44 H new ATOM 0 HB3 ASP A 34 -12.228 -10.053 6.400 1.00 44.44 H new ATOM 581 N SER A 35 -13.108 -6.765 5.185 1.00 41.41 N ATOM 582 CA SER A 35 -13.347 -5.428 5.762 1.00 24.11 C ATOM 583 C SER A 35 -13.190 -5.412 7.304 1.00 34.24 C ATOM 584 O SER A 35 -12.866 -4.365 7.892 1.00 21.55 O ATOM 585 CB SER A 35 -14.764 -4.956 5.362 1.00 63.34 C ATOM 586 OG SER A 35 -14.972 -5.080 3.958 1.00 44.40 O ATOM 0 H SER A 35 -13.913 -7.121 4.669 1.00 41.41 H new ATOM 0 HA SER A 35 -12.594 -4.747 5.364 1.00 24.11 H new ATOM 0 HB2 SER A 35 -15.510 -5.544 5.896 1.00 63.34 H new ATOM 0 HB3 SER A 35 -14.902 -3.917 5.662 1.00 63.34 H new ATOM 0 HG SER A 35 -15.876 -4.776 3.733 1.00 44.40 H new ATOM 592 N ASP A 36 -13.426 -6.580 7.938 1.00 72.23 N ATOM 593 CA ASP A 36 -13.179 -6.798 9.379 1.00 13.10 C ATOM 594 C ASP A 36 -11.712 -6.496 9.736 1.00 41.41 C ATOM 595 O ASP A 36 -11.437 -5.650 10.589 1.00 15.13 O ATOM 596 CB ASP A 36 -13.546 -8.258 9.796 1.00 2.01 C ATOM 597 CG ASP A 36 -12.929 -8.692 11.149 1.00 73.00 C ATOM 598 OD1 ASP A 36 -13.393 -8.222 12.213 1.00 53.54 O ATOM 599 OD2 ASP A 36 -11.971 -9.500 11.149 1.00 25.44 O ATOM 0 H ASP A 36 -13.795 -7.403 7.462 1.00 72.23 H new ATOM 0 HA ASP A 36 -13.819 -6.111 9.932 1.00 13.10 H new ATOM 0 HB2 ASP A 36 -14.631 -8.348 9.856 1.00 2.01 H new ATOM 0 HB3 ASP A 36 -13.212 -8.944 9.018 1.00 2.01 H new ATOM 604 N GLU A 37 -10.791 -7.182 9.046 1.00 43.41 N ATOM 605 CA GLU A 37 -9.343 -7.059 9.289 1.00 51.11 C ATOM 606 C GLU A 37 -8.870 -5.616 9.061 1.00 65.53 C ATOM 607 O GLU A 37 -8.033 -5.116 9.811 1.00 1.31 O ATOM 608 CB GLU A 37 -8.584 -8.035 8.370 1.00 40.20 C ATOM 609 CG GLU A 37 -8.956 -9.512 8.594 1.00 62.24 C ATOM 610 CD GLU A 37 -8.433 -10.414 7.479 1.00 34.22 C ATOM 611 OE1 GLU A 37 -7.204 -10.618 7.386 1.00 2.32 O ATOM 612 OE2 GLU A 37 -9.238 -10.881 6.662 1.00 75.44 O ATOM 0 H GLU A 37 -11.027 -7.839 8.302 1.00 43.41 H new ATOM 0 HA GLU A 37 -9.135 -7.313 10.328 1.00 51.11 H new ATOM 0 HB2 GLU A 37 -8.785 -7.772 7.331 1.00 40.20 H new ATOM 0 HB3 GLU A 37 -7.513 -7.911 8.529 1.00 40.20 H new ATOM 0 HG2 GLU A 37 -8.551 -9.846 9.549 1.00 62.24 H new ATOM 0 HG3 GLU A 37 -10.040 -9.606 8.657 1.00 62.24 H new ATOM 619 N LEU A 38 -9.472 -4.956 8.050 1.00 12.42 N ATOM 620 CA LEU A 38 -9.213 -3.543 7.722 1.00 31.24 C ATOM 621 C LEU A 38 -9.448 -2.632 8.950 1.00 63.43 C ATOM 622 O LEU A 38 -8.501 -1.989 9.443 1.00 54.42 O ATOM 623 CB LEU A 38 -10.128 -3.085 6.546 1.00 74.13 C ATOM 624 CG LEU A 38 -10.013 -1.574 6.143 1.00 14.31 C ATOM 625 CD1 LEU A 38 -8.629 -1.255 5.562 1.00 72.02 C ATOM 626 CD2 LEU A 38 -11.146 -1.150 5.186 1.00 31.45 C ATOM 0 H LEU A 38 -10.157 -5.395 7.435 1.00 12.42 H new ATOM 0 HA LEU A 38 -8.168 -3.456 7.423 1.00 31.24 H new ATOM 0 HB2 LEU A 38 -9.897 -3.694 5.672 1.00 74.13 H new ATOM 0 HB3 LEU A 38 -11.164 -3.293 6.814 1.00 74.13 H new ATOM 0 HG LEU A 38 -10.128 -0.985 7.053 1.00 14.31 H new ATOM 0 HD11 LEU A 38 -8.582 -0.200 5.293 1.00 72.02 H new ATOM 0 HD12 LEU A 38 -7.863 -1.474 6.306 1.00 72.02 H new ATOM 0 HD13 LEU A 38 -8.458 -1.864 4.674 1.00 72.02 H new ATOM 0 HD21 LEU A 38 -11.031 -0.097 4.930 1.00 31.45 H new ATOM 0 HD22 LEU A 38 -11.099 -1.751 4.278 1.00 31.45 H new ATOM 0 HD23 LEU A 38 -12.109 -1.302 5.673 1.00 31.45 H new ATOM 638 N LYS A 39 -10.708 -2.621 9.460 1.00 73.45 N ATOM 639 CA LYS A 39 -11.113 -1.712 10.553 1.00 33.24 C ATOM 640 C LYS A 39 -10.366 -2.018 11.865 1.00 64.22 C ATOM 641 O LYS A 39 -10.071 -1.092 12.617 1.00 54.44 O ATOM 642 CB LYS A 39 -12.670 -1.670 10.740 1.00 34.52 C ATOM 643 CG LYS A 39 -13.403 -3.020 10.957 1.00 72.40 C ATOM 644 CD LYS A 39 -13.323 -3.581 12.398 1.00 63.14 C ATOM 645 CE LYS A 39 -14.016 -4.946 12.521 1.00 62.55 C ATOM 646 NZ LYS A 39 -13.752 -5.608 13.827 1.00 45.10 N ATOM 0 H LYS A 39 -11.455 -3.232 9.129 1.00 73.45 H new ATOM 0 HA LYS A 39 -10.814 -0.706 10.257 1.00 33.24 H new ATOM 0 HB2 LYS A 39 -12.889 -1.028 11.593 1.00 34.52 H new ATOM 0 HB3 LYS A 39 -13.101 -1.191 9.861 1.00 34.52 H new ATOM 0 HG2 LYS A 39 -14.452 -2.894 10.689 1.00 72.40 H new ATOM 0 HG3 LYS A 39 -12.985 -3.758 10.272 1.00 72.40 H new ATOM 0 HD2 LYS A 39 -12.278 -3.677 12.693 1.00 63.14 H new ATOM 0 HD3 LYS A 39 -13.786 -2.876 13.088 1.00 63.14 H new ATOM 0 HE2 LYS A 39 -15.091 -4.816 12.395 1.00 62.55 H new ATOM 0 HE3 LYS A 39 -13.677 -5.595 11.714 1.00 62.55 H new ATOM 0 HZ1 LYS A 39 -13.456 -6.591 13.664 1.00 45.10 H new ATOM 0 HZ2 LYS A 39 -12.998 -5.098 14.329 1.00 45.10 H new ATOM 0 HZ3 LYS A 39 -14.618 -5.598 14.402 1.00 45.10 H new ATOM 660 N LYS A 40 -10.020 -3.308 12.108 1.00 74.11 N ATOM 661 CA LYS A 40 -9.241 -3.712 13.304 1.00 23.11 C ATOM 662 C LYS A 40 -7.904 -2.969 13.357 1.00 24.41 C ATOM 663 O LYS A 40 -7.567 -2.353 14.381 1.00 0.25 O ATOM 664 CB LYS A 40 -8.965 -5.227 13.330 1.00 40.41 C ATOM 665 CG LYS A 40 -10.211 -6.115 13.486 1.00 20.43 C ATOM 666 CD LYS A 40 -9.892 -7.535 13.992 1.00 4.10 C ATOM 667 CE LYS A 40 -8.914 -8.336 13.100 1.00 43.44 C ATOM 668 NZ LYS A 40 -7.484 -7.925 13.264 1.00 2.32 N ATOM 0 H LYS A 40 -10.268 -4.083 11.493 1.00 74.11 H new ATOM 0 HA LYS A 40 -9.848 -3.452 14.172 1.00 23.11 H new ATOM 0 HB2 LYS A 40 -8.454 -5.503 12.408 1.00 40.41 H new ATOM 0 HB3 LYS A 40 -8.280 -5.442 14.150 1.00 40.41 H new ATOM 0 HG2 LYS A 40 -10.904 -5.638 14.179 1.00 20.43 H new ATOM 0 HG3 LYS A 40 -10.720 -6.186 12.525 1.00 20.43 H new ATOM 0 HD2 LYS A 40 -9.471 -7.462 14.995 1.00 4.10 H new ATOM 0 HD3 LYS A 40 -10.824 -8.093 14.077 1.00 4.10 H new ATOM 0 HE2 LYS A 40 -9.008 -9.397 13.333 1.00 43.44 H new ATOM 0 HE3 LYS A 40 -9.202 -8.212 12.056 1.00 43.44 H new ATOM 0 HZ1 LYS A 40 -6.872 -8.764 13.202 1.00 2.32 H new ATOM 0 HZ2 LYS A 40 -7.227 -7.254 12.512 1.00 2.32 H new ATOM 0 HZ3 LYS A 40 -7.357 -7.472 14.191 1.00 2.32 H new ATOM 682 N GLU A 41 -7.171 -3.012 12.223 1.00 43.12 N ATOM 683 CA GLU A 41 -5.848 -2.384 12.119 1.00 12.41 C ATOM 684 C GLU A 41 -5.976 -0.851 12.216 1.00 2.10 C ATOM 685 O GLU A 41 -5.153 -0.214 12.853 1.00 12.42 O ATOM 686 CB GLU A 41 -5.107 -2.787 10.811 1.00 1.01 C ATOM 687 CG GLU A 41 -5.089 -4.300 10.494 1.00 11.22 C ATOM 688 CD GLU A 41 -4.757 -5.214 11.695 1.00 71.44 C ATOM 689 OE1 GLU A 41 -3.597 -5.201 12.166 1.00 43.52 O ATOM 690 OE2 GLU A 41 -5.658 -5.959 12.168 1.00 61.45 O ATOM 0 H GLU A 41 -7.479 -3.477 11.369 1.00 43.12 H new ATOM 0 HA GLU A 41 -5.248 -2.748 12.953 1.00 12.41 H new ATOM 0 HB2 GLU A 41 -5.572 -2.264 9.975 1.00 1.01 H new ATOM 0 HB3 GLU A 41 -4.077 -2.435 10.874 1.00 1.01 H new ATOM 0 HG2 GLU A 41 -6.064 -4.585 10.098 1.00 11.22 H new ATOM 0 HG3 GLU A 41 -4.359 -4.482 9.705 1.00 11.22 H new ATOM 697 N MET A 42 -7.051 -0.288 11.622 1.00 74.24 N ATOM 698 CA MET A 42 -7.302 1.175 11.617 1.00 2.31 C ATOM 699 C MET A 42 -7.467 1.738 13.050 1.00 41.41 C ATOM 700 O MET A 42 -6.926 2.816 13.372 1.00 50.01 O ATOM 701 CB MET A 42 -8.546 1.507 10.743 1.00 65.34 C ATOM 702 CG MET A 42 -8.356 1.285 9.222 1.00 24.12 C ATOM 703 SD MET A 42 -7.801 2.759 8.313 1.00 75.43 S ATOM 704 CE MET A 42 -6.135 3.037 8.910 1.00 51.52 C ATOM 0 H MET A 42 -7.766 -0.828 11.135 1.00 74.24 H new ATOM 0 HA MET A 42 -6.428 1.660 11.182 1.00 2.31 H new ATOM 0 HB2 MET A 42 -9.383 0.896 11.082 1.00 65.34 H new ATOM 0 HB3 MET A 42 -8.822 2.548 10.911 1.00 65.34 H new ATOM 0 HG2 MET A 42 -7.631 0.485 9.071 1.00 24.12 H new ATOM 0 HG3 MET A 42 -9.300 0.944 8.796 1.00 24.12 H new ATOM 0 HE1 MET A 42 -5.638 3.769 8.274 1.00 51.52 H new ATOM 0 HE2 MET A 42 -6.173 3.411 9.933 1.00 51.52 H new ATOM 0 HE3 MET A 42 -5.579 2.100 8.887 1.00 51.52 H new ATOM 714 N LYS A 43 -8.183 0.978 13.912 1.00 2.33 N ATOM 715 CA LYS A 43 -8.302 1.305 15.350 1.00 41.13 C ATOM 716 C LYS A 43 -6.905 1.255 16.009 1.00 32.10 C ATOM 717 O LYS A 43 -6.526 2.178 16.719 1.00 70.51 O ATOM 718 CB LYS A 43 -9.287 0.339 16.094 1.00 61.22 C ATOM 719 CG LYS A 43 -10.797 0.717 16.071 1.00 25.15 C ATOM 720 CD LYS A 43 -11.414 0.743 14.661 1.00 74.32 C ATOM 721 CE LYS A 43 -12.948 0.864 14.673 1.00 64.12 C ATOM 722 NZ LYS A 43 -13.419 2.108 15.338 1.00 50.50 N ATOM 0 H LYS A 43 -8.686 0.135 13.635 1.00 2.33 H new ATOM 0 HA LYS A 43 -8.714 2.311 15.432 1.00 41.13 H new ATOM 0 HB2 LYS A 43 -9.180 -0.655 15.660 1.00 61.22 H new ATOM 0 HB3 LYS A 43 -8.971 0.268 17.135 1.00 61.22 H new ATOM 0 HG2 LYS A 43 -11.349 0.005 16.685 1.00 25.15 H new ATOM 0 HG3 LYS A 43 -10.923 1.698 16.530 1.00 25.15 H new ATOM 0 HD2 LYS A 43 -10.994 1.580 14.103 1.00 74.32 H new ATOM 0 HD3 LYS A 43 -11.132 -0.167 14.131 1.00 74.32 H new ATOM 0 HE2 LYS A 43 -13.318 0.842 13.648 1.00 64.12 H new ATOM 0 HE3 LYS A 43 -13.373 0.000 15.184 1.00 64.12 H new ATOM 0 HZ1 LYS A 43 -14.458 2.140 15.319 1.00 50.50 H new ATOM 0 HZ2 LYS A 43 -13.091 2.120 16.325 1.00 50.50 H new ATOM 0 HZ3 LYS A 43 -13.038 2.935 14.836 1.00 50.50 H new ATOM 736 N LYS A 44 -6.137 0.181 15.712 1.00 54.43 N ATOM 737 CA LYS A 44 -4.789 -0.036 16.289 1.00 51.43 C ATOM 738 C LYS A 44 -3.810 1.090 15.901 1.00 14.10 C ATOM 739 O LYS A 44 -2.977 1.484 16.705 1.00 40.50 O ATOM 740 CB LYS A 44 -4.206 -1.416 15.855 1.00 62.31 C ATOM 741 CG LYS A 44 -5.017 -2.667 16.292 1.00 54.41 C ATOM 742 CD LYS A 44 -4.754 -3.164 17.748 1.00 71.31 C ATOM 743 CE LYS A 44 -5.297 -2.243 18.856 1.00 52.32 C ATOM 744 NZ LYS A 44 -6.759 -1.985 18.721 1.00 35.34 N ATOM 0 H LYS A 44 -6.431 -0.555 15.070 1.00 54.43 H new ATOM 0 HA LYS A 44 -4.906 -0.027 17.373 1.00 51.43 H new ATOM 0 HB2 LYS A 44 -4.119 -1.426 14.769 1.00 62.31 H new ATOM 0 HB3 LYS A 44 -3.196 -1.504 16.256 1.00 62.31 H new ATOM 0 HG2 LYS A 44 -6.079 -2.444 16.189 1.00 54.41 H new ATOM 0 HG3 LYS A 44 -4.794 -3.482 15.603 1.00 54.41 H new ATOM 0 HD2 LYS A 44 -5.200 -4.151 17.865 1.00 71.31 H new ATOM 0 HD3 LYS A 44 -3.679 -3.281 17.888 1.00 71.31 H new ATOM 0 HE2 LYS A 44 -5.100 -2.695 19.828 1.00 52.32 H new ATOM 0 HE3 LYS A 44 -4.760 -1.295 18.830 1.00 52.32 H new ATOM 0 HZ1 LYS A 44 -6.926 -0.961 18.658 1.00 35.34 H new ATOM 0 HZ2 LYS A 44 -7.115 -2.448 17.860 1.00 35.34 H new ATOM 0 HZ3 LYS A 44 -7.257 -2.366 19.551 1.00 35.34 H new ATOM 758 N LEU A 45 -3.938 1.617 14.673 1.00 44.32 N ATOM 759 CA LEU A 45 -3.048 2.684 14.171 1.00 31.41 C ATOM 760 C LEU A 45 -3.394 4.028 14.841 1.00 14.23 C ATOM 761 O LEU A 45 -2.503 4.842 15.103 1.00 20.21 O ATOM 762 CB LEU A 45 -3.135 2.773 12.619 1.00 1.01 C ATOM 763 CG LEU A 45 -2.718 1.474 11.851 1.00 33.14 C ATOM 764 CD1 LEU A 45 -2.937 1.613 10.333 1.00 22.44 C ATOM 765 CD2 LEU A 45 -1.269 1.057 12.182 1.00 1.20 C ATOM 0 H LEU A 45 -4.651 1.323 14.005 1.00 44.32 H new ATOM 0 HA LEU A 45 -2.017 2.442 14.430 1.00 31.41 H new ATOM 0 HB2 LEU A 45 -4.159 3.026 12.343 1.00 1.01 H new ATOM 0 HB3 LEU A 45 -2.502 3.594 12.282 1.00 1.01 H new ATOM 0 HG LEU A 45 -3.371 0.673 12.197 1.00 33.14 H new ATOM 0 HD11 LEU A 45 -2.636 0.691 9.836 1.00 22.44 H new ATOM 0 HD12 LEU A 45 -3.991 1.805 10.134 1.00 22.44 H new ATOM 0 HD13 LEU A 45 -2.339 2.442 9.954 1.00 22.44 H new ATOM 0 HD21 LEU A 45 -1.016 0.152 11.630 1.00 1.20 H new ATOM 0 HD22 LEU A 45 -0.586 1.858 11.898 1.00 1.20 H new ATOM 0 HD23 LEU A 45 -1.180 0.867 13.252 1.00 1.20 H new ATOM 777 N ALA A 46 -4.693 4.232 15.130 1.00 73.14 N ATOM 778 CA ALA A 46 -5.176 5.429 15.850 1.00 15.12 C ATOM 779 C ALA A 46 -4.776 5.405 17.348 1.00 31.33 C ATOM 780 O ALA A 46 -4.348 6.428 17.900 1.00 63.11 O ATOM 781 CB ALA A 46 -6.703 5.548 15.698 1.00 51.13 C ATOM 0 H ALA A 46 -5.433 3.578 14.874 1.00 73.14 H new ATOM 0 HA ALA A 46 -4.700 6.303 15.406 1.00 15.12 H new ATOM 0 HB1 ALA A 46 -7.054 6.432 16.231 1.00 51.13 H new ATOM 0 HB2 ALA A 46 -6.958 5.636 14.642 1.00 51.13 H new ATOM 0 HB3 ALA A 46 -7.180 4.661 16.114 1.00 51.13 H new ATOM 787 N GLU A 47 -4.908 4.225 17.988 1.00 64.23 N ATOM 788 CA GLU A 47 -4.722 4.053 19.454 1.00 42.21 C ATOM 789 C GLU A 47 -3.234 3.951 19.832 1.00 14.22 C ATOM 790 O GLU A 47 -2.755 4.676 20.715 1.00 64.04 O ATOM 791 CB GLU A 47 -5.471 2.777 19.942 1.00 62.30 C ATOM 792 CG GLU A 47 -7.007 2.830 19.787 1.00 73.10 C ATOM 793 CD GLU A 47 -7.696 1.497 20.134 1.00 25.21 C ATOM 794 OE1 GLU A 47 -7.747 0.598 19.267 1.00 40.31 O ATOM 795 OE2 GLU A 47 -8.181 1.335 21.279 1.00 32.22 O ATOM 0 H GLU A 47 -5.147 3.358 17.506 1.00 64.23 H new ATOM 0 HA GLU A 47 -5.136 4.935 19.943 1.00 42.21 H new ATOM 0 HB2 GLU A 47 -5.093 1.917 19.389 1.00 62.30 H new ATOM 0 HB3 GLU A 47 -5.231 2.611 20.992 1.00 62.30 H new ATOM 0 HG2 GLU A 47 -7.404 3.615 20.430 1.00 73.10 H new ATOM 0 HG3 GLU A 47 -7.253 3.103 18.761 1.00 73.10 H new ATOM 802 N GLU A 48 -2.521 3.036 19.160 1.00 32.33 N ATOM 803 CA GLU A 48 -1.114 2.710 19.476 1.00 15.24 C ATOM 804 C GLU A 48 -0.156 3.803 18.969 1.00 61.54 C ATOM 805 O GLU A 48 -0.557 4.690 18.200 1.00 41.23 O ATOM 806 CB GLU A 48 -0.744 1.322 18.887 1.00 61.41 C ATOM 807 CG GLU A 48 -1.621 0.156 19.397 1.00 62.40 C ATOM 808 CD GLU A 48 -1.440 -0.129 20.898 1.00 1.54 C ATOM 809 OE1 GLU A 48 -0.503 -0.872 21.259 1.00 1.22 O ATOM 810 OE2 GLU A 48 -2.225 0.396 21.722 1.00 53.30 O ATOM 0 H GLU A 48 -2.900 2.498 18.381 1.00 32.33 H new ATOM 0 HA GLU A 48 -1.007 2.667 20.560 1.00 15.24 H new ATOM 0 HB2 GLU A 48 -0.821 1.370 17.801 1.00 61.41 H new ATOM 0 HB3 GLU A 48 0.298 1.107 19.124 1.00 61.41 H new ATOM 0 HG2 GLU A 48 -2.668 0.386 19.201 1.00 62.40 H new ATOM 0 HG3 GLU A 48 -1.381 -0.744 18.832 1.00 62.40 H new ATOM 817 N LYS A 49 1.120 3.696 19.389 1.00 42.13 N ATOM 818 CA LYS A 49 2.154 4.729 19.179 1.00 71.42 C ATOM 819 C LYS A 49 2.432 4.899 17.670 1.00 42.53 C ATOM 820 O LYS A 49 2.933 3.986 17.001 1.00 72.41 O ATOM 821 CB LYS A 49 3.446 4.384 19.985 1.00 23.11 C ATOM 822 CG LYS A 49 3.336 4.559 21.528 1.00 25.31 C ATOM 823 CD LYS A 49 2.356 3.577 22.219 1.00 54.53 C ATOM 824 CE LYS A 49 2.213 3.860 23.721 1.00 52.24 C ATOM 825 NZ LYS A 49 1.226 2.959 24.381 1.00 73.44 N ATOM 0 H LYS A 49 1.466 2.878 19.891 1.00 42.13 H new ATOM 0 HA LYS A 49 1.791 5.685 19.556 1.00 71.42 H new ATOM 0 HB2 LYS A 49 3.722 3.351 19.772 1.00 23.11 H new ATOM 0 HB3 LYS A 49 4.259 5.012 19.622 1.00 23.11 H new ATOM 0 HG2 LYS A 49 4.326 4.433 21.967 1.00 25.31 H new ATOM 0 HG3 LYS A 49 3.020 5.580 21.743 1.00 25.31 H new ATOM 0 HD2 LYS A 49 1.378 3.648 21.743 1.00 54.53 H new ATOM 0 HD3 LYS A 49 2.707 2.555 22.076 1.00 54.53 H new ATOM 0 HE2 LYS A 49 3.184 3.745 24.203 1.00 52.24 H new ATOM 0 HE3 LYS A 49 1.907 4.896 23.864 1.00 52.24 H new ATOM 0 HZ1 LYS A 49 1.167 3.191 25.393 1.00 73.44 H new ATOM 0 HZ2 LYS A 49 0.292 3.086 23.942 1.00 73.44 H new ATOM 0 HZ3 LYS A 49 1.530 1.971 24.270 1.00 73.44 H new ATOM 839 N ASN A 50 2.103 6.096 17.158 1.00 74.02 N ATOM 840 CA ASN A 50 1.924 6.362 15.714 1.00 2.00 C ATOM 841 C ASN A 50 3.269 6.613 14.967 1.00 42.22 C ATOM 842 O ASN A 50 3.299 7.309 13.956 1.00 72.22 O ATOM 843 CB ASN A 50 0.925 7.550 15.540 1.00 72.33 C ATOM 844 CG ASN A 50 0.204 7.574 14.179 1.00 13.11 C ATOM 845 OD1 ASN A 50 0.688 8.142 13.203 1.00 71.31 O ATOM 846 ND2 ASN A 50 -0.970 6.967 14.110 1.00 11.34 N ATOM 0 H ASN A 50 1.951 6.920 17.740 1.00 74.02 H new ATOM 0 HA ASN A 50 1.509 5.468 15.249 1.00 2.00 H new ATOM 0 HB2 ASN A 50 0.179 7.502 16.333 1.00 72.33 H new ATOM 0 HB3 ASN A 50 1.466 8.487 15.668 1.00 72.33 H new ATOM 0 HD21 ASN A 50 -1.492 6.965 13.234 1.00 11.34 H new ATOM 0 HD22 ASN A 50 -1.353 6.502 14.933 1.00 11.34 H new ATOM 853 N PHE A 51 4.387 6.045 15.465 1.00 21.42 N ATOM 854 CA PHE A 51 5.613 5.851 14.655 1.00 35.44 C ATOM 855 C PHE A 51 5.889 4.345 14.485 1.00 13.53 C ATOM 856 O PHE A 51 6.196 3.665 15.469 1.00 63.22 O ATOM 857 CB PHE A 51 6.870 6.540 15.270 1.00 72.33 C ATOM 858 CG PHE A 51 8.134 6.406 14.392 1.00 61.22 C ATOM 859 CD1 PHE A 51 8.272 7.155 13.224 1.00 41.45 C ATOM 860 CD2 PHE A 51 9.159 5.507 14.708 1.00 12.23 C ATOM 861 CE1 PHE A 51 9.383 7.019 12.409 1.00 74.32 C ATOM 862 CE2 PHE A 51 10.269 5.367 13.891 1.00 25.32 C ATOM 863 CZ PHE A 51 10.379 6.125 12.742 1.00 50.34 C ATOM 0 H PHE A 51 4.468 5.711 16.425 1.00 21.42 H new ATOM 0 HA PHE A 51 5.429 6.322 13.689 1.00 35.44 H new ATOM 0 HB2 PHE A 51 6.656 7.597 15.426 1.00 72.33 H new ATOM 0 HB3 PHE A 51 7.070 6.107 16.250 1.00 72.33 H new ATOM 0 HD1 PHE A 51 7.497 7.855 12.950 1.00 41.45 H new ATOM 0 HD2 PHE A 51 9.083 4.911 15.606 1.00 12.23 H new ATOM 0 HE1 PHE A 51 9.470 7.614 11.512 1.00 74.32 H new ATOM 0 HE2 PHE A 51 11.048 4.666 14.152 1.00 25.32 H new ATOM 0 HZ PHE A 51 11.244 6.018 12.105 1.00 50.34 H new ATOM 873 N GLU A 52 5.752 3.852 13.243 1.00 34.34 N ATOM 874 CA GLU A 52 6.235 2.523 12.792 1.00 13.13 C ATOM 875 C GLU A 52 6.058 2.408 11.272 1.00 74.44 C ATOM 876 O GLU A 52 5.184 3.064 10.684 1.00 30.23 O ATOM 877 CB GLU A 52 5.554 1.291 13.515 1.00 34.14 C ATOM 878 CG GLU A 52 6.405 0.644 14.645 1.00 13.30 C ATOM 879 CD GLU A 52 7.833 0.269 14.191 1.00 43.34 C ATOM 880 OE1 GLU A 52 7.978 -0.474 13.201 1.00 33.22 O ATOM 881 OE2 GLU A 52 8.813 0.748 14.798 1.00 33.51 O ATOM 0 H GLU A 52 5.290 4.376 12.500 1.00 34.34 H new ATOM 0 HA GLU A 52 7.288 2.472 13.070 1.00 13.13 H new ATOM 0 HB2 GLU A 52 4.603 1.616 13.937 1.00 34.14 H new ATOM 0 HB3 GLU A 52 5.328 0.529 12.769 1.00 34.14 H new ATOM 0 HG2 GLU A 52 6.467 1.335 15.485 1.00 13.30 H new ATOM 0 HG3 GLU A 52 5.898 -0.251 15.006 1.00 13.30 H new ATOM 888 N LYS A 53 6.900 1.566 10.660 1.00 74.10 N ATOM 889 CA LYS A 53 6.856 1.273 9.222 1.00 34.12 C ATOM 890 C LYS A 53 6.220 -0.109 9.009 1.00 51.12 C ATOM 891 O LYS A 53 6.810 -1.134 9.372 1.00 25.21 O ATOM 892 CB LYS A 53 8.285 1.337 8.626 1.00 24.31 C ATOM 893 CG LYS A 53 8.976 2.713 8.767 1.00 31.34 C ATOM 894 CD LYS A 53 10.289 2.810 7.962 1.00 41.45 C ATOM 895 CE LYS A 53 11.386 1.855 8.461 1.00 23.04 C ATOM 896 NZ LYS A 53 11.907 2.239 9.799 1.00 74.50 N ATOM 0 H LYS A 53 7.638 1.064 11.154 1.00 74.10 H new ATOM 0 HA LYS A 53 6.248 2.017 8.707 1.00 34.12 H new ATOM 0 HB2 LYS A 53 8.903 0.583 9.113 1.00 24.31 H new ATOM 0 HB3 LYS A 53 8.237 1.075 7.569 1.00 24.31 H new ATOM 0 HG2 LYS A 53 8.292 3.493 8.433 1.00 31.34 H new ATOM 0 HG3 LYS A 53 9.186 2.902 9.820 1.00 31.34 H new ATOM 0 HD2 LYS A 53 10.080 2.595 6.914 1.00 41.45 H new ATOM 0 HD3 LYS A 53 10.660 3.834 8.009 1.00 41.45 H new ATOM 0 HE2 LYS A 53 10.988 0.841 8.506 1.00 23.04 H new ATOM 0 HE3 LYS A 53 12.207 1.843 7.744 1.00 23.04 H new ATOM 0 HZ1 LYS A 53 12.824 1.776 9.960 1.00 74.50 H new ATOM 0 HZ2 LYS A 53 12.028 3.271 9.841 1.00 74.50 H new ATOM 0 HZ3 LYS A 53 11.234 1.939 10.533 1.00 74.50 H new ATOM 910 N ILE A 54 4.996 -0.123 8.449 1.00 32.13 N ATOM 911 CA ILE A 54 4.191 -1.347 8.272 1.00 50.23 C ATOM 912 C ILE A 54 3.724 -1.467 6.807 1.00 75.10 C ATOM 913 O ILE A 54 3.143 -0.528 6.253 1.00 23.44 O ATOM 914 CB ILE A 54 2.922 -1.356 9.222 1.00 14.12 C ATOM 915 CG1 ILE A 54 3.329 -1.123 10.713 1.00 74.44 C ATOM 916 CG2 ILE A 54 2.119 -2.680 9.075 1.00 20.23 C ATOM 917 CD1 ILE A 54 2.167 -1.032 11.687 1.00 35.41 C ATOM 0 H ILE A 54 4.535 0.719 8.105 1.00 32.13 H new ATOM 0 HA ILE A 54 4.825 -2.194 8.534 1.00 50.23 H new ATOM 0 HB ILE A 54 2.278 -0.532 8.914 1.00 14.12 H new ATOM 0 HG12 ILE A 54 3.984 -1.936 11.027 1.00 74.44 H new ATOM 0 HG13 ILE A 54 3.910 -0.203 10.776 1.00 74.44 H new ATOM 0 HG21 ILE A 54 1.255 -2.657 9.739 1.00 20.23 H new ATOM 0 HG22 ILE A 54 1.782 -2.789 8.044 1.00 20.23 H new ATOM 0 HG23 ILE A 54 2.757 -3.524 9.339 1.00 20.23 H new ATOM 0 HD11 ILE A 54 2.549 -0.870 12.695 1.00 35.41 H new ATOM 0 HD12 ILE A 54 1.521 -0.200 11.406 1.00 35.41 H new ATOM 0 HD13 ILE A 54 1.596 -1.960 11.660 1.00 35.41 H new ATOM 929 N LEU A 55 4.008 -2.621 6.198 1.00 25.43 N ATOM 930 CA LEU A 55 3.420 -3.044 4.926 1.00 24.42 C ATOM 931 C LEU A 55 2.005 -3.591 5.191 1.00 24.13 C ATOM 932 O LEU A 55 1.834 -4.491 6.027 1.00 32.44 O ATOM 933 CB LEU A 55 4.279 -4.176 4.284 1.00 25.21 C ATOM 934 CG LEU A 55 3.885 -4.579 2.823 1.00 34.31 C ATOM 935 CD1 LEU A 55 4.339 -3.503 1.827 1.00 14.11 C ATOM 936 CD2 LEU A 55 4.410 -5.983 2.433 1.00 32.45 C ATOM 0 H LEU A 55 4.665 -3.300 6.583 1.00 25.43 H new ATOM 0 HA LEU A 55 3.384 -2.191 4.248 1.00 24.42 H new ATOM 0 HB2 LEU A 55 5.322 -3.861 4.286 1.00 25.21 H new ATOM 0 HB3 LEU A 55 4.212 -5.061 4.916 1.00 25.21 H new ATOM 0 HG LEU A 55 2.798 -4.643 2.783 1.00 34.31 H new ATOM 0 HD11 LEU A 55 4.057 -3.800 0.817 1.00 14.11 H new ATOM 0 HD12 LEU A 55 3.861 -2.555 2.073 1.00 14.11 H new ATOM 0 HD13 LEU A 55 5.422 -3.389 1.883 1.00 14.11 H new ATOM 0 HD21 LEU A 55 4.109 -6.213 1.411 1.00 32.45 H new ATOM 0 HD22 LEU A 55 5.498 -5.997 2.503 1.00 32.45 H new ATOM 0 HD23 LEU A 55 3.993 -6.728 3.110 1.00 32.45 H new ATOM 948 N ILE A 56 0.998 -3.039 4.507 1.00 15.02 N ATOM 949 CA ILE A 56 -0.363 -3.598 4.510 1.00 54.51 C ATOM 950 C ILE A 56 -0.646 -4.200 3.123 1.00 64.33 C ATOM 951 O ILE A 56 -0.681 -3.476 2.122 1.00 44.15 O ATOM 952 CB ILE A 56 -1.470 -2.525 4.854 1.00 70.24 C ATOM 953 CG1 ILE A 56 -1.206 -1.818 6.228 1.00 11.22 C ATOM 954 CG2 ILE A 56 -2.885 -3.166 4.833 1.00 63.13 C ATOM 955 CD1 ILE A 56 -1.290 -2.720 7.450 1.00 62.10 C ATOM 0 H ILE A 56 1.099 -2.198 3.939 1.00 15.02 H new ATOM 0 HA ILE A 56 -0.409 -4.358 5.290 1.00 54.51 H new ATOM 0 HB ILE A 56 -1.420 -1.758 4.081 1.00 70.24 H new ATOM 0 HG12 ILE A 56 -0.216 -1.364 6.200 1.00 11.22 H new ATOM 0 HG13 ILE A 56 -1.925 -1.007 6.345 1.00 11.22 H new ATOM 0 HG21 ILE A 56 -3.631 -2.408 5.073 1.00 63.13 H new ATOM 0 HG22 ILE A 56 -3.086 -3.572 3.842 1.00 63.13 H new ATOM 0 HG23 ILE A 56 -2.932 -3.968 5.570 1.00 63.13 H new ATOM 0 HD11 ILE A 56 -1.092 -2.135 8.348 1.00 62.10 H new ATOM 0 HD12 ILE A 56 -2.287 -3.155 7.513 1.00 62.10 H new ATOM 0 HD13 ILE A 56 -0.551 -3.517 7.366 1.00 62.10 H new ATOM 967 N LYS A 57 -0.828 -5.522 3.075 1.00 12.51 N ATOM 968 CA LYS A 57 -1.289 -6.229 1.875 1.00 1.44 C ATOM 969 C LYS A 57 -2.819 -6.300 1.924 1.00 13.44 C ATOM 970 O LYS A 57 -3.394 -6.516 2.995 1.00 31.42 O ATOM 971 CB LYS A 57 -0.660 -7.669 1.808 1.00 41.25 C ATOM 972 CG LYS A 57 -1.206 -8.612 0.680 1.00 32.25 C ATOM 973 CD LYS A 57 -2.464 -9.436 1.092 1.00 5.42 C ATOM 974 CE LYS A 57 -3.091 -10.218 -0.066 1.00 32.21 C ATOM 975 NZ LYS A 57 -4.361 -10.895 0.332 1.00 55.13 N ATOM 0 H LYS A 57 -0.659 -6.136 3.871 1.00 12.51 H new ATOM 0 HA LYS A 57 -0.973 -5.696 0.978 1.00 1.44 H new ATOM 0 HB2 LYS A 57 0.417 -7.566 1.677 1.00 41.25 H new ATOM 0 HB3 LYS A 57 -0.819 -8.157 2.769 1.00 41.25 H new ATOM 0 HG2 LYS A 57 -1.450 -8.010 -0.195 1.00 32.25 H new ATOM 0 HG3 LYS A 57 -0.415 -9.301 0.383 1.00 32.25 H new ATOM 0 HD2 LYS A 57 -2.188 -10.133 1.883 1.00 5.42 H new ATOM 0 HD3 LYS A 57 -3.210 -8.760 1.509 1.00 5.42 H new ATOM 0 HE2 LYS A 57 -3.288 -9.539 -0.896 1.00 32.21 H new ATOM 0 HE3 LYS A 57 -2.381 -10.963 -0.425 1.00 32.21 H new ATOM 0 HZ1 LYS A 57 -4.269 -11.920 0.183 1.00 55.13 H new ATOM 0 HZ2 LYS A 57 -4.555 -10.707 1.336 1.00 55.13 H new ATOM 0 HZ3 LYS A 57 -5.145 -10.530 -0.246 1.00 55.13 H new ATOM 989 N SER A 58 -3.458 -6.125 0.759 1.00 50.34 N ATOM 990 CA SER A 58 -4.887 -6.388 0.570 1.00 44.10 C ATOM 991 C SER A 58 -5.168 -6.452 -0.936 1.00 43.41 C ATOM 992 O SER A 58 -4.953 -5.467 -1.659 1.00 31.32 O ATOM 993 CB SER A 58 -5.758 -5.315 1.274 1.00 72.04 C ATOM 994 OG SER A 58 -7.141 -5.492 0.995 1.00 64.34 O ATOM 0 H SER A 58 -2.991 -5.794 -0.085 1.00 50.34 H new ATOM 0 HA SER A 58 -5.152 -7.341 1.029 1.00 44.10 H new ATOM 0 HB2 SER A 58 -5.595 -5.364 2.351 1.00 72.04 H new ATOM 0 HB3 SER A 58 -5.446 -4.323 0.949 1.00 72.04 H new ATOM 0 HG SER A 58 -7.394 -4.937 0.228 1.00 64.34 H new ATOM 1000 N ASN A 59 -5.631 -7.627 -1.398 1.00 3.52 N ATOM 1001 CA ASN A 59 -5.906 -7.895 -2.827 1.00 0.40 C ATOM 1002 C ASN A 59 -7.221 -7.231 -3.292 1.00 31.13 C ATOM 1003 O ASN A 59 -7.478 -7.150 -4.496 1.00 31.55 O ATOM 1004 CB ASN A 59 -5.902 -9.424 -3.142 1.00 13.53 C ATOM 1005 CG ASN A 59 -6.810 -10.277 -2.238 1.00 34.33 C ATOM 1006 OD1 ASN A 59 -6.839 -10.105 -1.017 1.00 22.11 O ATOM 1007 ND2 ASN A 59 -7.571 -11.187 -2.827 1.00 51.40 N ATOM 0 H ASN A 59 -5.827 -8.423 -0.791 1.00 3.52 H new ATOM 0 HA ASN A 59 -5.093 -7.443 -3.395 1.00 0.40 H new ATOM 0 HB2 ASN A 59 -6.209 -9.567 -4.178 1.00 13.53 H new ATOM 0 HB3 ASN A 59 -4.880 -9.794 -3.058 1.00 13.53 H new ATOM 0 HD21 ASN A 59 -8.199 -11.765 -2.269 1.00 51.40 H new ATOM 0 HD22 ASN A 59 -7.529 -11.310 -3.839 1.00 51.40 H new ATOM 1014 N ASP A 60 -8.034 -6.735 -2.334 1.00 54.10 N ATOM 1015 CA ASP A 60 -9.221 -5.902 -2.621 1.00 64.14 C ATOM 1016 C ASP A 60 -8.837 -4.423 -2.463 1.00 11.12 C ATOM 1017 O ASP A 60 -8.540 -3.982 -1.353 1.00 32.15 O ATOM 1018 CB ASP A 60 -10.401 -6.254 -1.670 1.00 3.25 C ATOM 1019 CG ASP A 60 -11.688 -5.468 -2.008 1.00 4.42 C ATOM 1020 OD1 ASP A 60 -12.474 -5.938 -2.860 1.00 22.25 O ATOM 1021 OD2 ASP A 60 -11.902 -4.367 -1.451 1.00 3.25 O ATOM 0 H ASP A 60 -7.885 -6.902 -1.339 1.00 54.10 H new ATOM 0 HA ASP A 60 -9.552 -6.096 -3.641 1.00 64.14 H new ATOM 0 HB2 ASP A 60 -10.606 -7.323 -1.730 1.00 3.25 H new ATOM 0 HB3 ASP A 60 -10.110 -6.043 -0.641 1.00 3.25 H new ATOM 1026 N LYS A 61 -8.872 -3.668 -3.574 1.00 4.02 N ATOM 1027 CA LYS A 61 -8.395 -2.260 -3.626 1.00 15.15 C ATOM 1028 C LYS A 61 -9.385 -1.274 -3.000 1.00 41.32 C ATOM 1029 O LYS A 61 -8.968 -0.182 -2.594 1.00 52.23 O ATOM 1030 CB LYS A 61 -8.014 -1.821 -5.086 1.00 2.53 C ATOM 1031 CG LYS A 61 -8.772 -2.548 -6.209 1.00 74.11 C ATOM 1032 CD LYS A 61 -8.334 -2.122 -7.629 1.00 71.33 C ATOM 1033 CE LYS A 61 -8.651 -3.200 -8.681 1.00 70.31 C ATOM 1034 NZ LYS A 61 -10.046 -3.711 -8.594 1.00 50.42 N ATOM 0 H LYS A 61 -9.230 -4.009 -4.466 1.00 4.02 H new ATOM 0 HA LYS A 61 -7.490 -2.231 -3.020 1.00 15.15 H new ATOM 0 HB2 LYS A 61 -8.192 -0.750 -5.184 1.00 2.53 H new ATOM 0 HB3 LYS A 61 -6.945 -1.981 -5.229 1.00 2.53 H new ATOM 0 HG2 LYS A 61 -8.624 -3.622 -6.099 1.00 74.11 H new ATOM 0 HG3 LYS A 61 -9.840 -2.360 -6.096 1.00 74.11 H new ATOM 0 HD2 LYS A 61 -8.837 -1.193 -7.900 1.00 71.33 H new ATOM 0 HD3 LYS A 61 -7.263 -1.917 -7.632 1.00 71.33 H new ATOM 0 HE2 LYS A 61 -8.483 -2.788 -9.676 1.00 70.31 H new ATOM 0 HE3 LYS A 61 -7.958 -4.032 -8.559 1.00 70.31 H new ATOM 0 HZ1 LYS A 61 -10.033 -4.750 -8.545 1.00 50.42 H new ATOM 0 HZ2 LYS A 61 -10.503 -3.330 -7.741 1.00 50.42 H new ATOM 0 HZ3 LYS A 61 -10.579 -3.411 -9.435 1.00 50.42 H new ATOM 1048 N GLN A 62 -10.673 -1.651 -2.880 1.00 25.05 N ATOM 1049 CA GLN A 62 -11.683 -0.756 -2.283 1.00 23.30 C ATOM 1050 C GLN A 62 -11.331 -0.489 -0.813 1.00 74.05 C ATOM 1051 O GLN A 62 -11.385 0.656 -0.363 1.00 73.20 O ATOM 1052 CB GLN A 62 -13.115 -1.326 -2.428 1.00 55.44 C ATOM 1053 CG GLN A 62 -13.605 -1.434 -3.885 1.00 55.32 C ATOM 1054 CD GLN A 62 -13.544 -0.106 -4.648 1.00 61.13 C ATOM 1055 OE1 GLN A 62 -14.494 0.675 -4.642 1.00 21.35 O ATOM 1056 NE2 GLN A 62 -12.423 0.169 -5.305 1.00 72.02 N ATOM 0 H GLN A 62 -11.035 -2.555 -3.183 1.00 25.05 H new ATOM 0 HA GLN A 62 -11.670 0.189 -2.825 1.00 23.30 H new ATOM 0 HB2 GLN A 62 -13.149 -2.315 -1.970 1.00 55.44 H new ATOM 0 HB3 GLN A 62 -13.805 -0.693 -1.870 1.00 55.44 H new ATOM 0 HG2 GLN A 62 -13.001 -2.174 -4.410 1.00 55.32 H new ATOM 0 HG3 GLN A 62 -14.632 -1.800 -3.889 1.00 55.32 H new ATOM 0 HE21 GLN A 62 -11.649 -0.496 -5.294 1.00 72.02 H new ATOM 0 HE22 GLN A 62 -12.336 1.045 -5.820 1.00 72.02 H new ATOM 1065 N LEU A 63 -10.871 -1.557 -0.120 1.00 30.33 N ATOM 1066 CA LEU A 63 -10.407 -1.486 1.282 1.00 11.30 C ATOM 1067 C LEU A 63 -9.286 -0.437 1.466 1.00 70.55 C ATOM 1068 O LEU A 63 -9.223 0.220 2.502 1.00 53.43 O ATOM 1069 CB LEU A 63 -9.909 -2.881 1.770 1.00 32.21 C ATOM 1070 CG LEU A 63 -10.975 -4.020 1.797 1.00 24.34 C ATOM 1071 CD1 LEU A 63 -10.370 -5.347 2.310 1.00 43.31 C ATOM 1072 CD2 LEU A 63 -12.213 -3.601 2.616 1.00 52.23 C ATOM 0 H LEU A 63 -10.812 -2.493 -0.520 1.00 30.33 H new ATOM 0 HA LEU A 63 -11.261 -1.177 1.885 1.00 11.30 H new ATOM 0 HB2 LEU A 63 -9.087 -3.196 1.127 1.00 32.21 H new ATOM 0 HB3 LEU A 63 -9.502 -2.768 2.775 1.00 32.21 H new ATOM 0 HG LEU A 63 -11.304 -4.194 0.773 1.00 24.34 H new ATOM 0 HD11 LEU A 63 -11.139 -6.119 2.316 1.00 43.31 H new ATOM 0 HD12 LEU A 63 -9.554 -5.652 1.655 1.00 43.31 H new ATOM 0 HD13 LEU A 63 -9.989 -5.206 3.322 1.00 43.31 H new ATOM 0 HD21 LEU A 63 -12.940 -4.413 2.618 1.00 52.23 H new ATOM 0 HD22 LEU A 63 -11.914 -3.379 3.640 1.00 52.23 H new ATOM 0 HD23 LEU A 63 -12.662 -2.714 2.169 1.00 52.23 H new ATOM 1084 N LEU A 64 -8.426 -0.282 0.436 1.00 0.14 N ATOM 1085 CA LEU A 64 -7.268 0.642 0.478 1.00 73.25 C ATOM 1086 C LEU A 64 -7.716 2.107 0.335 1.00 42.32 C ATOM 1087 O LEU A 64 -7.205 2.969 1.047 1.00 30.45 O ATOM 1088 CB LEU A 64 -6.198 0.302 -0.608 1.00 3.31 C ATOM 1089 CG LEU A 64 -5.364 -1.001 -0.368 1.00 12.04 C ATOM 1090 CD1 LEU A 64 -6.229 -2.253 -0.432 1.00 71.32 C ATOM 1091 CD2 LEU A 64 -4.195 -1.110 -1.354 1.00 54.32 C ATOM 0 H LEU A 64 -8.513 -0.790 -0.444 1.00 0.14 H new ATOM 0 HA LEU A 64 -6.804 0.509 1.455 1.00 73.25 H new ATOM 0 HB2 LEU A 64 -6.702 0.215 -1.571 1.00 3.31 H new ATOM 0 HB3 LEU A 64 -5.508 1.142 -0.685 1.00 3.31 H new ATOM 0 HG LEU A 64 -4.957 -0.928 0.641 1.00 12.04 H new ATOM 0 HD11 LEU A 64 -5.609 -3.133 -0.260 1.00 71.32 H new ATOM 0 HD12 LEU A 64 -7.004 -2.200 0.333 1.00 71.32 H new ATOM 0 HD13 LEU A 64 -6.694 -2.324 -1.415 1.00 71.32 H new ATOM 0 HD21 LEU A 64 -3.638 -2.026 -1.158 1.00 54.32 H new ATOM 0 HD22 LEU A 64 -4.580 -1.130 -2.374 1.00 54.32 H new ATOM 0 HD23 LEU A 64 -3.535 -0.251 -1.232 1.00 54.32 H new ATOM 1103 N LYS A 65 -8.671 2.385 -0.579 1.00 24.24 N ATOM 1104 CA LYS A 65 -9.176 3.746 -0.806 1.00 54.23 C ATOM 1105 C LYS A 65 -9.963 4.231 0.426 1.00 61.11 C ATOM 1106 O LYS A 65 -9.780 5.364 0.887 1.00 5.32 O ATOM 1107 CB LYS A 65 -10.072 3.760 -2.064 1.00 22.51 C ATOM 1108 CG LYS A 65 -10.344 5.161 -2.636 1.00 25.44 C ATOM 1109 CD LYS A 65 -11.249 5.127 -3.880 1.00 75.10 C ATOM 1110 CE LYS A 65 -12.699 4.749 -3.548 1.00 44.05 C ATOM 1111 NZ LYS A 65 -13.325 5.707 -2.593 1.00 73.42 N ATOM 0 H LYS A 65 -9.106 1.678 -1.171 1.00 24.24 H new ATOM 0 HA LYS A 65 -8.336 4.423 -0.963 1.00 54.23 H new ATOM 0 HB2 LYS A 65 -9.602 3.151 -2.836 1.00 22.51 H new ATOM 0 HB3 LYS A 65 -11.025 3.289 -1.822 1.00 22.51 H new ATOM 0 HG2 LYS A 65 -10.811 5.778 -1.868 1.00 25.44 H new ATOM 0 HG3 LYS A 65 -9.397 5.635 -2.893 1.00 25.44 H new ATOM 0 HD2 LYS A 65 -11.234 6.105 -4.362 1.00 75.10 H new ATOM 0 HD3 LYS A 65 -10.847 4.412 -4.597 1.00 75.10 H new ATOM 0 HE2 LYS A 65 -13.285 4.719 -4.467 1.00 44.05 H new ATOM 0 HE3 LYS A 65 -12.723 3.746 -3.122 1.00 44.05 H new ATOM 0 HZ1 LYS A 65 -14.354 5.560 -2.579 1.00 73.42 H new ATOM 0 HZ2 LYS A 65 -12.939 5.549 -1.640 1.00 73.42 H new ATOM 0 HZ3 LYS A 65 -13.119 6.681 -2.893 1.00 73.42 H new ATOM 1125 N GLU A 66 -10.804 3.319 0.960 1.00 62.12 N ATOM 1126 CA GLU A 66 -11.583 3.535 2.195 1.00 53.11 C ATOM 1127 C GLU A 66 -10.643 3.775 3.393 1.00 24.42 C ATOM 1128 O GLU A 66 -10.925 4.613 4.255 1.00 25.51 O ATOM 1129 CB GLU A 66 -12.496 2.313 2.472 1.00 32.43 C ATOM 1130 CG GLU A 66 -13.559 2.042 1.387 1.00 64.22 C ATOM 1131 CD GLU A 66 -14.401 0.794 1.688 1.00 51.52 C ATOM 1132 OE1 GLU A 66 -15.384 0.900 2.457 1.00 71.12 O ATOM 1133 OE2 GLU A 66 -14.068 -0.303 1.190 1.00 15.14 O ATOM 0 H GLU A 66 -10.962 2.403 0.540 1.00 62.12 H new ATOM 0 HA GLU A 66 -12.206 4.419 2.060 1.00 53.11 H new ATOM 0 HB2 GLU A 66 -11.871 1.426 2.578 1.00 32.43 H new ATOM 0 HB3 GLU A 66 -13.001 2.463 3.426 1.00 32.43 H new ATOM 0 HG2 GLU A 66 -14.216 2.908 1.302 1.00 64.22 H new ATOM 0 HG3 GLU A 66 -13.066 1.920 0.422 1.00 64.22 H new ATOM 1140 N MET A 67 -9.513 3.037 3.399 1.00 4.40 N ATOM 1141 CA MET A 67 -8.462 3.152 4.427 1.00 65.30 C ATOM 1142 C MET A 67 -7.857 4.565 4.405 1.00 54.22 C ATOM 1143 O MET A 67 -7.699 5.186 5.445 1.00 12.20 O ATOM 1144 CB MET A 67 -7.339 2.104 4.181 1.00 52.12 C ATOM 1145 CG MET A 67 -6.302 1.972 5.305 1.00 1.22 C ATOM 1146 SD MET A 67 -4.816 1.079 4.802 1.00 22.53 S ATOM 1147 CE MET A 67 -5.473 -0.462 4.153 1.00 71.13 C ATOM 0 H MET A 67 -9.305 2.340 2.684 1.00 4.40 H new ATOM 0 HA MET A 67 -8.913 2.964 5.401 1.00 65.30 H new ATOM 0 HB2 MET A 67 -7.803 1.131 4.022 1.00 52.12 H new ATOM 0 HB3 MET A 67 -6.819 2.364 3.259 1.00 52.12 H new ATOM 0 HG2 MET A 67 -6.021 2.967 5.649 1.00 1.22 H new ATOM 0 HG3 MET A 67 -6.757 1.458 6.152 1.00 1.22 H new ATOM 0 HE1 MET A 67 -4.677 -1.015 3.654 1.00 71.13 H new ATOM 0 HE2 MET A 67 -5.873 -1.061 4.972 1.00 71.13 H new ATOM 0 HE3 MET A 67 -6.268 -0.247 3.439 1.00 71.13 H new ATOM 1157 N LEU A 68 -7.569 5.063 3.185 1.00 61.00 N ATOM 1158 CA LEU A 68 -6.982 6.403 2.956 1.00 0.14 C ATOM 1159 C LEU A 68 -7.942 7.529 3.392 1.00 74.12 C ATOM 1160 O LEU A 68 -7.502 8.618 3.774 1.00 22.23 O ATOM 1161 CB LEU A 68 -6.600 6.564 1.460 1.00 42.00 C ATOM 1162 CG LEU A 68 -5.459 5.636 0.942 1.00 53.43 C ATOM 1163 CD1 LEU A 68 -5.255 5.782 -0.579 1.00 43.22 C ATOM 1164 CD2 LEU A 68 -4.150 5.885 1.713 1.00 32.15 C ATOM 0 H LEU A 68 -7.738 4.544 2.323 1.00 61.00 H new ATOM 0 HA LEU A 68 -6.084 6.486 3.568 1.00 0.14 H new ATOM 0 HB2 LEU A 68 -7.490 6.384 0.857 1.00 42.00 H new ATOM 0 HB3 LEU A 68 -6.304 7.599 1.290 1.00 42.00 H new ATOM 0 HG LEU A 68 -5.763 4.606 1.128 1.00 53.43 H new ATOM 0 HD11 LEU A 68 -4.452 5.120 -0.904 1.00 43.22 H new ATOM 0 HD12 LEU A 68 -6.176 5.516 -1.097 1.00 43.22 H new ATOM 0 HD13 LEU A 68 -4.992 6.814 -0.813 1.00 43.22 H new ATOM 0 HD21 LEU A 68 -3.372 5.224 1.331 1.00 32.15 H new ATOM 0 HD22 LEU A 68 -3.842 6.922 1.582 1.00 32.15 H new ATOM 0 HD23 LEU A 68 -4.308 5.685 2.773 1.00 32.15 H new ATOM 1176 N GLU A 69 -9.250 7.242 3.329 1.00 60.10 N ATOM 1177 CA GLU A 69 -10.312 8.165 3.791 1.00 73.14 C ATOM 1178 C GLU A 69 -10.363 8.226 5.333 1.00 62.41 C ATOM 1179 O GLU A 69 -10.834 9.211 5.907 1.00 70.45 O ATOM 1180 CB GLU A 69 -11.674 7.731 3.183 1.00 73.35 C ATOM 1181 CG GLU A 69 -11.726 7.856 1.642 1.00 52.44 C ATOM 1182 CD GLU A 69 -12.972 7.224 1.000 1.00 12.30 C ATOM 1183 OE1 GLU A 69 -14.089 7.724 1.243 1.00 21.33 O ATOM 1184 OE2 GLU A 69 -12.847 6.227 0.249 1.00 13.10 O ATOM 0 H GLU A 69 -9.608 6.363 2.956 1.00 60.10 H new ATOM 0 HA GLU A 69 -10.087 9.174 3.446 1.00 73.14 H new ATOM 0 HB2 GLU A 69 -11.876 6.697 3.463 1.00 73.35 H new ATOM 0 HB3 GLU A 69 -12.468 8.340 3.617 1.00 73.35 H new ATOM 0 HG2 GLU A 69 -11.688 8.912 1.373 1.00 52.44 H new ATOM 0 HG3 GLU A 69 -10.837 7.388 1.220 1.00 52.44 H new ATOM 1191 N LEU A 70 -9.881 7.162 5.995 1.00 24.45 N ATOM 1192 CA LEU A 70 -9.715 7.128 7.463 1.00 34.41 C ATOM 1193 C LEU A 70 -8.354 7.759 7.865 1.00 12.12 C ATOM 1194 O LEU A 70 -8.248 8.445 8.890 1.00 51.23 O ATOM 1195 CB LEU A 70 -9.847 5.659 7.968 1.00 14.41 C ATOM 1196 CG LEU A 70 -11.150 4.911 7.518 1.00 41.43 C ATOM 1197 CD1 LEU A 70 -11.190 3.459 8.039 1.00 35.20 C ATOM 1198 CD2 LEU A 70 -12.419 5.692 7.921 1.00 62.32 C ATOM 0 H LEU A 70 -9.595 6.300 5.531 1.00 24.45 H new ATOM 0 HA LEU A 70 -10.498 7.720 7.937 1.00 34.41 H new ATOM 0 HB2 LEU A 70 -8.984 5.093 7.618 1.00 14.41 H new ATOM 0 HB3 LEU A 70 -9.807 5.661 9.057 1.00 14.41 H new ATOM 0 HG LEU A 70 -11.129 4.859 6.429 1.00 41.43 H new ATOM 0 HD11 LEU A 70 -12.109 2.978 7.704 1.00 35.20 H new ATOM 0 HD12 LEU A 70 -10.331 2.910 7.653 1.00 35.20 H new ATOM 0 HD13 LEU A 70 -11.158 3.462 9.129 1.00 35.20 H new ATOM 0 HD21 LEU A 70 -13.303 5.144 7.593 1.00 62.32 H new ATOM 0 HD22 LEU A 70 -12.446 5.809 9.004 1.00 62.32 H new ATOM 0 HD23 LEU A 70 -12.406 6.675 7.450 1.00 62.32 H new ATOM 1210 N ILE A 71 -7.338 7.539 7.001 1.00 61.25 N ATOM 1211 CA ILE A 71 -5.947 8.022 7.185 1.00 72.31 C ATOM 1212 C ILE A 71 -5.853 9.547 6.999 1.00 44.50 C ATOM 1213 O ILE A 71 -5.008 10.196 7.616 1.00 21.31 O ATOM 1214 CB ILE A 71 -4.964 7.270 6.190 1.00 40.52 C ATOM 1215 CG1 ILE A 71 -4.842 5.766 6.595 1.00 54.53 C ATOM 1216 CG2 ILE A 71 -3.567 7.940 6.100 1.00 0.01 C ATOM 1217 CD1 ILE A 71 -4.044 4.900 5.638 1.00 1.14 C ATOM 0 H ILE A 71 -7.463 7.010 6.138 1.00 61.25 H new ATOM 0 HA ILE A 71 -5.645 7.797 8.208 1.00 72.31 H new ATOM 0 HB ILE A 71 -5.397 7.339 5.192 1.00 40.52 H new ATOM 0 HG12 ILE A 71 -4.382 5.708 7.581 1.00 54.53 H new ATOM 0 HG13 ILE A 71 -5.845 5.349 6.687 1.00 54.53 H new ATOM 0 HG21 ILE A 71 -2.940 7.382 5.405 1.00 0.01 H new ATOM 0 HG22 ILE A 71 -3.677 8.965 5.746 1.00 0.01 H new ATOM 0 HG23 ILE A 71 -3.102 7.945 7.086 1.00 0.01 H new ATOM 0 HD11 ILE A 71 -4.019 3.875 6.009 1.00 1.14 H new ATOM 0 HD12 ILE A 71 -4.512 4.918 4.654 1.00 1.14 H new ATOM 0 HD13 ILE A 71 -3.026 5.283 5.563 1.00 1.14 H new ATOM 1229 N SER A 72 -6.741 10.112 6.167 1.00 24.24 N ATOM 1230 CA SER A 72 -6.810 11.566 5.931 1.00 11.24 C ATOM 1231 C SER A 72 -7.092 12.331 7.246 1.00 43.33 C ATOM 1232 O SER A 72 -6.619 13.450 7.440 1.00 32.14 O ATOM 1233 CB SER A 72 -7.885 11.868 4.867 1.00 53.10 C ATOM 1234 OG SER A 72 -9.152 11.372 5.265 1.00 34.00 O ATOM 0 H SER A 72 -7.431 9.577 5.639 1.00 24.24 H new ATOM 0 HA SER A 72 -5.844 11.909 5.560 1.00 11.24 H new ATOM 0 HB2 SER A 72 -7.947 12.944 4.704 1.00 53.10 H new ATOM 0 HB3 SER A 72 -7.597 11.418 3.917 1.00 53.10 H new ATOM 0 HG SER A 72 -9.816 11.578 4.574 1.00 34.00 H new ATOM 1240 N LYS A 73 -7.822 11.673 8.160 1.00 65.10 N ATOM 1241 CA LYS A 73 -8.163 12.227 9.480 1.00 33.31 C ATOM 1242 C LYS A 73 -6.994 12.035 10.475 1.00 44.35 C ATOM 1243 O LYS A 73 -6.795 12.856 11.378 1.00 61.40 O ATOM 1244 CB LYS A 73 -9.440 11.532 10.012 1.00 43.51 C ATOM 1245 CG LYS A 73 -10.640 11.564 9.033 1.00 3.44 C ATOM 1246 CD LYS A 73 -11.915 10.954 9.652 1.00 51.03 C ATOM 1247 CE LYS A 73 -11.757 9.469 10.021 1.00 73.13 C ATOM 1248 NZ LYS A 73 -12.897 8.991 10.855 1.00 24.00 N ATOM 0 H LYS A 73 -8.194 10.736 8.003 1.00 65.10 H new ATOM 0 HA LYS A 73 -8.346 13.297 9.379 1.00 33.31 H new ATOM 0 HB2 LYS A 73 -9.204 10.494 10.245 1.00 43.51 H new ATOM 0 HB3 LYS A 73 -9.736 12.009 10.946 1.00 43.51 H new ATOM 0 HG2 LYS A 73 -10.839 12.594 8.738 1.00 3.44 H new ATOM 0 HG3 LYS A 73 -10.381 11.017 8.126 1.00 3.44 H new ATOM 0 HD2 LYS A 73 -12.183 11.518 10.546 1.00 51.03 H new ATOM 0 HD3 LYS A 73 -12.740 11.061 8.948 1.00 51.03 H new ATOM 0 HE2 LYS A 73 -11.694 8.871 9.112 1.00 73.13 H new ATOM 0 HE3 LYS A 73 -10.822 9.325 10.563 1.00 73.13 H new ATOM 0 HZ1 LYS A 73 -12.760 7.986 11.087 1.00 24.00 H new ATOM 0 HZ2 LYS A 73 -12.941 9.546 11.733 1.00 24.00 H new ATOM 0 HZ3 LYS A 73 -13.786 9.107 10.327 1.00 24.00 H new ATOM 1262 N LEU A 74 -6.238 10.932 10.302 1.00 11.04 N ATOM 1263 CA LEU A 74 -5.116 10.560 11.197 1.00 65.23 C ATOM 1264 C LEU A 74 -3.877 11.448 10.936 1.00 24.53 C ATOM 1265 O LEU A 74 -3.266 11.974 11.875 1.00 13.23 O ATOM 1266 CB LEU A 74 -4.768 9.056 11.018 1.00 71.41 C ATOM 1267 CG LEU A 74 -5.935 8.049 11.288 1.00 42.54 C ATOM 1268 CD1 LEU A 74 -5.492 6.592 11.026 1.00 1.50 C ATOM 1269 CD2 LEU A 74 -6.514 8.227 12.710 1.00 14.30 C ATOM 0 H LEU A 74 -6.386 10.272 9.539 1.00 11.04 H new ATOM 0 HA LEU A 74 -5.428 10.726 12.228 1.00 65.23 H new ATOM 0 HB2 LEU A 74 -4.411 8.904 9.999 1.00 71.41 H new ATOM 0 HB3 LEU A 74 -3.941 8.812 11.685 1.00 71.41 H new ATOM 0 HG LEU A 74 -6.736 8.273 10.584 1.00 42.54 H new ATOM 0 HD11 LEU A 74 -6.325 5.917 11.223 1.00 1.50 H new ATOM 0 HD12 LEU A 74 -5.178 6.488 9.987 1.00 1.50 H new ATOM 0 HD13 LEU A 74 -4.659 6.341 11.683 1.00 1.50 H new ATOM 0 HD21 LEU A 74 -7.323 7.513 12.866 1.00 14.30 H new ATOM 0 HD22 LEU A 74 -5.730 8.053 13.447 1.00 14.30 H new ATOM 0 HD23 LEU A 74 -6.899 9.241 12.822 1.00 14.30 H new ATOM 1281 N GLY A 75 -3.525 11.600 9.650 1.00 4.02 N ATOM 1282 CA GLY A 75 -2.466 12.509 9.215 1.00 52.32 C ATOM 1283 C GLY A 75 -1.089 11.856 9.150 1.00 22.12 C ATOM 1284 O GLY A 75 -0.224 12.144 9.989 1.00 1.01 O ATOM 0 H GLY A 75 -3.970 11.093 8.885 1.00 4.02 H new ATOM 0 HA2 GLY A 75 -2.719 12.903 8.231 1.00 52.32 H new ATOM 0 HA3 GLY A 75 -2.424 13.358 9.897 1.00 52.32 H new ATOM 1288 N TYR A 76 -0.879 10.969 8.148 1.00 73.05 N ATOM 1289 CA TYR A 76 0.449 10.382 7.866 1.00 32.14 C ATOM 1290 C TYR A 76 0.610 9.973 6.389 1.00 11.21 C ATOM 1291 O TYR A 76 -0.370 9.919 5.626 1.00 13.03 O ATOM 1292 CB TYR A 76 0.785 9.205 8.829 1.00 54.34 C ATOM 1293 CG TYR A 76 -0.237 8.054 8.929 1.00 2.54 C ATOM 1294 CD1 TYR A 76 -0.310 7.055 7.952 1.00 50.51 C ATOM 1295 CD2 TYR A 76 -1.086 7.933 10.038 1.00 62.52 C ATOM 1296 CE1 TYR A 76 -1.189 5.998 8.069 1.00 44.44 C ATOM 1297 CE2 TYR A 76 -1.958 6.868 10.157 1.00 13.33 C ATOM 1298 CZ TYR A 76 -2.007 5.906 9.172 1.00 64.21 C ATOM 1299 OH TYR A 76 -2.877 4.842 9.291 1.00 62.10 O ATOM 0 H TYR A 76 -1.616 10.645 7.521 1.00 73.05 H new ATOM 0 HA TYR A 76 1.178 11.170 8.055 1.00 32.14 H new ATOM 0 HB2 TYR A 76 1.741 8.781 8.521 1.00 54.34 H new ATOM 0 HB3 TYR A 76 0.926 9.617 9.828 1.00 54.34 H new ATOM 0 HD1 TYR A 76 0.335 7.113 7.088 1.00 50.51 H new ATOM 0 HD2 TYR A 76 -1.058 8.685 10.813 1.00 62.52 H new ATOM 0 HE1 TYR A 76 -1.235 5.244 7.297 1.00 44.44 H new ATOM 0 HE2 TYR A 76 -2.601 6.790 11.021 1.00 13.33 H new ATOM 0 HH TYR A 76 -3.382 4.924 10.127 1.00 62.10 H new ATOM 1309 N LYS A 77 1.879 9.692 6.016 1.00 11.11 N ATOM 1310 CA LYS A 77 2.295 9.372 4.638 1.00 42.30 C ATOM 1311 C LYS A 77 2.039 7.903 4.315 1.00 1.31 C ATOM 1312 O LYS A 77 2.427 7.006 5.082 1.00 51.34 O ATOM 1313 CB LYS A 77 3.802 9.685 4.444 1.00 63.24 C ATOM 1314 CG LYS A 77 4.233 11.157 4.657 1.00 72.14 C ATOM 1315 CD LYS A 77 3.863 12.113 3.492 1.00 41.43 C ATOM 1316 CE LYS A 77 2.417 12.643 3.562 1.00 73.14 C ATOM 1317 NZ LYS A 77 2.115 13.606 2.465 1.00 31.35 N ATOM 0 H LYS A 77 2.654 9.682 6.679 1.00 11.11 H new ATOM 0 HA LYS A 77 1.704 9.988 3.961 1.00 42.30 H new ATOM 0 HB2 LYS A 77 4.372 9.059 5.131 1.00 63.24 H new ATOM 0 HB3 LYS A 77 4.085 9.389 3.434 1.00 63.24 H new ATOM 0 HG2 LYS A 77 3.774 11.527 5.573 1.00 72.14 H new ATOM 0 HG3 LYS A 77 5.312 11.188 4.806 1.00 72.14 H new ATOM 0 HD2 LYS A 77 4.551 12.958 3.495 1.00 41.43 H new ATOM 0 HD3 LYS A 77 4.004 11.590 2.546 1.00 41.43 H new ATOM 0 HE2 LYS A 77 1.722 11.805 3.509 1.00 73.14 H new ATOM 0 HE3 LYS A 77 2.257 13.129 4.524 1.00 73.14 H new ATOM 0 HZ1 LYS A 77 1.132 13.935 2.553 1.00 31.35 H new ATOM 0 HZ2 LYS A 77 2.760 14.419 2.530 1.00 31.35 H new ATOM 0 HZ3 LYS A 77 2.242 13.136 1.546 1.00 31.35 H new ATOM 1331 N VAL A 78 1.381 7.669 3.169 1.00 42.20 N ATOM 1332 CA VAL A 78 1.071 6.329 2.666 1.00 51.13 C ATOM 1333 C VAL A 78 1.477 6.224 1.185 1.00 21.42 C ATOM 1334 O VAL A 78 1.185 7.123 0.385 1.00 0.41 O ATOM 1335 CB VAL A 78 -0.448 5.982 2.835 1.00 61.51 C ATOM 1336 CG1 VAL A 78 -0.741 4.550 2.364 1.00 63.02 C ATOM 1337 CG2 VAL A 78 -0.907 6.184 4.294 1.00 64.11 C ATOM 0 H VAL A 78 1.047 8.417 2.561 1.00 42.20 H new ATOM 0 HA VAL A 78 1.640 5.609 3.254 1.00 51.13 H new ATOM 0 HB VAL A 78 -1.017 6.668 2.207 1.00 61.51 H new ATOM 0 HG11 VAL A 78 -1.802 4.335 2.492 1.00 63.02 H new ATOM 0 HG12 VAL A 78 -0.475 4.452 1.311 1.00 63.02 H new ATOM 0 HG13 VAL A 78 -0.154 3.846 2.954 1.00 63.02 H new ATOM 0 HG21 VAL A 78 -1.965 5.936 4.380 1.00 64.11 H new ATOM 0 HG22 VAL A 78 -0.327 5.536 4.951 1.00 64.11 H new ATOM 0 HG23 VAL A 78 -0.754 7.224 4.583 1.00 64.11 H new ATOM 1347 N PHE A 79 2.144 5.113 0.844 1.00 21.21 N ATOM 1348 CA PHE A 79 2.699 4.859 -0.487 1.00 11.24 C ATOM 1349 C PHE A 79 1.957 3.660 -1.117 1.00 70.21 C ATOM 1350 O PHE A 79 2.134 2.522 -0.682 1.00 33.15 O ATOM 1351 CB PHE A 79 4.217 4.569 -0.334 1.00 74.10 C ATOM 1352 CG PHE A 79 5.007 5.688 0.360 1.00 44.44 C ATOM 1353 CD1 PHE A 79 5.376 6.835 -0.339 1.00 55.41 C ATOM 1354 CD2 PHE A 79 5.375 5.594 1.710 1.00 63.15 C ATOM 1355 CE1 PHE A 79 6.074 7.854 0.281 1.00 34.20 C ATOM 1356 CE2 PHE A 79 6.078 6.618 2.327 1.00 23.22 C ATOM 1357 CZ PHE A 79 6.430 7.744 1.609 1.00 41.31 C ATOM 0 H PHE A 79 2.315 4.352 1.501 1.00 21.21 H new ATOM 0 HA PHE A 79 2.570 5.721 -1.142 1.00 11.24 H new ATOM 0 HB2 PHE A 79 4.343 3.646 0.232 1.00 74.10 H new ATOM 0 HB3 PHE A 79 4.644 4.398 -1.322 1.00 74.10 H new ATOM 0 HD1 PHE A 79 5.112 6.929 -1.382 1.00 55.41 H new ATOM 0 HD2 PHE A 79 5.108 4.714 2.276 1.00 63.15 H new ATOM 0 HE1 PHE A 79 6.342 8.740 -0.276 1.00 34.20 H new ATOM 0 HE2 PHE A 79 6.350 6.535 3.369 1.00 23.22 H new ATOM 0 HZ PHE A 79 6.984 8.538 2.087 1.00 41.31 H new ATOM 1367 N LEU A 80 1.134 3.928 -2.141 1.00 74.41 N ATOM 1368 CA LEU A 80 0.267 2.915 -2.782 1.00 2.30 C ATOM 1369 C LEU A 80 0.897 2.382 -4.082 1.00 32.45 C ATOM 1370 O LEU A 80 1.449 3.145 -4.881 1.00 44.32 O ATOM 1371 CB LEU A 80 -1.148 3.506 -3.075 1.00 42.11 C ATOM 1372 CG LEU A 80 -2.155 2.565 -3.839 1.00 43.13 C ATOM 1373 CD1 LEU A 80 -2.329 1.207 -3.145 1.00 72.41 C ATOM 1374 CD2 LEU A 80 -3.521 3.244 -4.045 1.00 25.51 C ATOM 0 H LEU A 80 1.047 4.857 -2.554 1.00 74.41 H new ATOM 0 HA LEU A 80 0.164 2.082 -2.087 1.00 2.30 H new ATOM 0 HB2 LEU A 80 -1.601 3.793 -2.126 1.00 42.11 H new ATOM 0 HB3 LEU A 80 -1.023 4.418 -3.658 1.00 42.11 H new ATOM 0 HG LEU A 80 -1.714 2.378 -4.818 1.00 43.13 H new ATOM 0 HD11 LEU A 80 -3.033 0.597 -3.711 1.00 72.41 H new ATOM 0 HD12 LEU A 80 -1.366 0.698 -3.094 1.00 72.41 H new ATOM 0 HD13 LEU A 80 -2.712 1.360 -2.136 1.00 72.41 H new ATOM 0 HD21 LEU A 80 -4.189 2.565 -4.575 1.00 25.51 H new ATOM 0 HD22 LEU A 80 -3.953 3.494 -3.076 1.00 25.51 H new ATOM 0 HD23 LEU A 80 -3.390 4.154 -4.630 1.00 25.51 H new ATOM 1386 N LEU A 81 0.761 1.062 -4.281 1.00 12.44 N ATOM 1387 CA LEU A 81 1.197 0.352 -5.483 1.00 12.31 C ATOM 1388 C LEU A 81 0.057 -0.577 -5.960 1.00 42.45 C ATOM 1389 O LEU A 81 -0.456 -1.384 -5.182 1.00 50.50 O ATOM 1390 CB LEU A 81 2.482 -0.454 -5.165 1.00 53.24 C ATOM 1391 CG LEU A 81 3.143 -1.209 -6.358 1.00 72.04 C ATOM 1392 CD1 LEU A 81 3.505 -0.243 -7.499 1.00 34.13 C ATOM 1393 CD2 LEU A 81 4.370 -2.016 -5.880 1.00 23.43 C ATOM 0 H LEU A 81 0.333 0.447 -3.589 1.00 12.44 H new ATOM 0 HA LEU A 81 1.426 1.058 -6.281 1.00 12.31 H new ATOM 0 HB2 LEU A 81 3.219 0.231 -4.744 1.00 53.24 H new ATOM 0 HB3 LEU A 81 2.245 -1.183 -4.390 1.00 53.24 H new ATOM 0 HG LEU A 81 2.416 -1.916 -6.757 1.00 72.04 H new ATOM 0 HD11 LEU A 81 3.964 -0.800 -8.316 1.00 34.13 H new ATOM 0 HD12 LEU A 81 2.602 0.250 -7.859 1.00 34.13 H new ATOM 0 HD13 LEU A 81 4.206 0.507 -7.132 1.00 34.13 H new ATOM 0 HD21 LEU A 81 4.817 -2.535 -6.728 1.00 23.43 H new ATOM 0 HD22 LEU A 81 5.103 -1.338 -5.442 1.00 23.43 H new ATOM 0 HD23 LEU A 81 4.057 -2.745 -5.132 1.00 23.43 H new ATOM 1405 N LEU A 82 -0.328 -0.433 -7.237 1.00 72.04 N ATOM 1406 CA LEU A 82 -1.411 -1.203 -7.888 1.00 71.14 C ATOM 1407 C LEU A 82 -0.798 -2.075 -8.998 1.00 11.12 C ATOM 1408 O LEU A 82 -0.050 -1.550 -9.818 1.00 52.11 O ATOM 1409 CB LEU A 82 -2.446 -0.218 -8.513 1.00 63.35 C ATOM 1410 CG LEU A 82 -3.189 0.743 -7.532 1.00 65.25 C ATOM 1411 CD1 LEU A 82 -4.063 1.747 -8.310 1.00 42.11 C ATOM 1412 CD2 LEU A 82 -4.022 -0.035 -6.491 1.00 62.31 C ATOM 0 H LEU A 82 0.113 0.238 -7.866 1.00 72.04 H new ATOM 0 HA LEU A 82 -1.913 -1.833 -7.154 1.00 71.14 H new ATOM 0 HB2 LEU A 82 -1.930 0.389 -9.257 1.00 63.35 H new ATOM 0 HB3 LEU A 82 -3.195 -0.805 -9.045 1.00 63.35 H new ATOM 0 HG LEU A 82 -2.433 1.304 -6.983 1.00 65.25 H new ATOM 0 HD11 LEU A 82 -4.572 2.407 -7.608 1.00 42.11 H new ATOM 0 HD12 LEU A 82 -3.433 2.340 -8.974 1.00 42.11 H new ATOM 0 HD13 LEU A 82 -4.803 1.205 -8.899 1.00 42.11 H new ATOM 0 HD21 LEU A 82 -4.524 0.669 -5.827 1.00 62.31 H new ATOM 0 HD22 LEU A 82 -4.767 -0.645 -7.003 1.00 62.31 H new ATOM 0 HD23 LEU A 82 -3.365 -0.679 -5.907 1.00 62.31 H new ATOM 1424 N ALA A 83 -1.116 -3.385 -9.040 1.00 31.13 N ATOM 1425 CA ALA A 83 -0.572 -4.305 -10.062 1.00 34.02 C ATOM 1426 C ALA A 83 -1.577 -5.419 -10.410 1.00 64.55 C ATOM 1427 O ALA A 83 -1.855 -6.299 -9.590 1.00 53.45 O ATOM 1428 CB ALA A 83 0.765 -4.893 -9.584 1.00 52.10 C ATOM 0 H ALA A 83 -1.749 -3.831 -8.376 1.00 31.13 H new ATOM 0 HA ALA A 83 -0.395 -3.736 -10.975 1.00 34.02 H new ATOM 0 HB1 ALA A 83 1.157 -5.569 -10.344 1.00 52.10 H new ATOM 0 HB2 ALA A 83 1.477 -4.086 -9.414 1.00 52.10 H new ATOM 0 HB3 ALA A 83 0.610 -5.442 -8.655 1.00 52.10 H new ATOM 1434 N ASP A 84 -2.102 -5.377 -11.637 1.00 61.01 N ATOM 1435 CA ASP A 84 -3.106 -6.338 -12.140 1.00 2.03 C ATOM 1436 C ASP A 84 -3.183 -6.223 -13.670 1.00 21.30 C ATOM 1437 O ASP A 84 -2.849 -5.170 -14.242 1.00 34.42 O ATOM 1438 CB ASP A 84 -4.495 -6.085 -11.453 1.00 62.21 C ATOM 1439 CG ASP A 84 -5.679 -6.900 -12.017 1.00 62.32 C ATOM 1440 OD1 ASP A 84 -5.524 -8.115 -12.285 1.00 14.13 O ATOM 1441 OD2 ASP A 84 -6.777 -6.329 -12.182 1.00 53.42 O ATOM 0 H ASP A 84 -1.843 -4.668 -12.323 1.00 61.01 H new ATOM 0 HA ASP A 84 -2.812 -7.357 -11.889 1.00 2.03 H new ATOM 0 HB2 ASP A 84 -4.399 -6.306 -10.390 1.00 62.21 H new ATOM 0 HB3 ASP A 84 -4.734 -5.025 -11.538 1.00 62.21 H new ATOM 1446 N GLN A 85 -3.598 -7.332 -14.317 1.00 51.24 N ATOM 1447 CA GLN A 85 -3.770 -7.423 -15.776 1.00 53.41 C ATOM 1448 C GLN A 85 -4.804 -6.389 -16.274 1.00 11.00 C ATOM 1449 O GLN A 85 -4.639 -5.794 -17.351 1.00 54.23 O ATOM 1450 CB GLN A 85 -4.194 -8.870 -16.149 1.00 14.31 C ATOM 1451 CG GLN A 85 -4.384 -9.130 -17.657 1.00 3.24 C ATOM 1452 CD GLN A 85 -4.796 -10.570 -17.994 1.00 73.12 C ATOM 1453 OE1 GLN A 85 -5.476 -11.242 -17.214 1.00 11.15 O ATOM 1454 NE2 GLN A 85 -4.386 -11.052 -19.157 1.00 44.05 N ATOM 0 H GLN A 85 -3.825 -8.199 -13.831 1.00 51.24 H new ATOM 0 HA GLN A 85 -2.824 -7.193 -16.267 1.00 53.41 H new ATOM 0 HB2 GLN A 85 -3.442 -9.561 -15.769 1.00 14.31 H new ATOM 0 HB3 GLN A 85 -5.127 -9.102 -15.636 1.00 14.31 H new ATOM 0 HG2 GLN A 85 -5.142 -8.447 -18.041 1.00 3.24 H new ATOM 0 HG3 GLN A 85 -3.454 -8.898 -18.176 1.00 3.24 H new ATOM 0 HE21 GLN A 85 -3.825 -10.472 -19.780 1.00 44.05 H new ATOM 0 HE22 GLN A 85 -4.631 -12.004 -19.430 1.00 44.05 H new ATOM 1463 N ASP A 86 -5.858 -6.167 -15.467 1.00 11.04 N ATOM 1464 CA ASP A 86 -6.873 -5.140 -15.750 1.00 64.53 C ATOM 1465 C ASP A 86 -6.350 -3.780 -15.262 1.00 21.43 C ATOM 1466 O ASP A 86 -6.652 -3.323 -14.158 1.00 41.14 O ATOM 1467 CB ASP A 86 -8.239 -5.492 -15.105 1.00 53.30 C ATOM 1468 CG ASP A 86 -9.385 -4.583 -15.583 1.00 5.45 C ATOM 1469 OD1 ASP A 86 -9.499 -3.442 -15.104 1.00 14.11 O ATOM 1470 OD2 ASP A 86 -10.173 -5.006 -16.453 1.00 71.54 O ATOM 0 H ASP A 86 -6.028 -6.690 -14.608 1.00 11.04 H new ATOM 0 HA ASP A 86 -7.047 -5.094 -16.825 1.00 64.53 H new ATOM 0 HB2 ASP A 86 -8.486 -6.529 -15.334 1.00 53.30 H new ATOM 0 HB3 ASP A 86 -8.152 -5.417 -14.021 1.00 53.30 H new ATOM 1475 N GLU A 87 -5.521 -3.175 -16.101 1.00 5.05 N ATOM 1476 CA GLU A 87 -4.888 -1.876 -15.833 1.00 72.33 C ATOM 1477 C GLU A 87 -5.870 -0.708 -16.058 1.00 31.01 C ATOM 1478 O GLU A 87 -5.577 0.422 -15.666 1.00 51.45 O ATOM 1479 CB GLU A 87 -3.637 -1.724 -16.717 1.00 11.24 C ATOM 1480 CG GLU A 87 -3.912 -1.794 -18.224 1.00 24.32 C ATOM 1481 CD GLU A 87 -2.631 -1.823 -19.059 1.00 60.31 C ATOM 1482 OE1 GLU A 87 -2.079 -2.921 -19.260 1.00 75.51 O ATOM 1483 OE2 GLU A 87 -2.172 -0.754 -19.512 1.00 35.11 O ATOM 0 H GLU A 87 -5.260 -3.573 -17.003 1.00 5.05 H new ATOM 0 HA GLU A 87 -4.592 -1.844 -14.784 1.00 72.33 H new ATOM 0 HB2 GLU A 87 -3.162 -0.770 -16.491 1.00 11.24 H new ATOM 0 HB3 GLU A 87 -2.924 -2.505 -16.454 1.00 11.24 H new ATOM 0 HG2 GLU A 87 -4.502 -2.685 -18.440 1.00 24.32 H new ATOM 0 HG3 GLU A 87 -4.514 -0.934 -18.519 1.00 24.32 H new ATOM 1490 N ASN A 88 -7.009 -0.995 -16.727 1.00 41.23 N ATOM 1491 CA ASN A 88 -8.059 -0.004 -17.048 1.00 54.12 C ATOM 1492 C ASN A 88 -8.730 0.535 -15.765 1.00 11.54 C ATOM 1493 O ASN A 88 -8.746 1.754 -15.529 1.00 14.13 O ATOM 1494 CB ASN A 88 -9.105 -0.641 -18.001 1.00 61.21 C ATOM 1495 CG ASN A 88 -10.237 0.316 -18.416 1.00 32.04 C ATOM 1496 OD1 ASN A 88 -10.102 1.064 -19.383 1.00 45.51 O ATOM 1497 ND2 ASN A 88 -11.354 0.297 -17.698 1.00 34.14 N ATOM 0 H ASN A 88 -7.227 -1.933 -17.063 1.00 41.23 H new ATOM 0 HA ASN A 88 -7.596 0.845 -17.551 1.00 54.12 H new ATOM 0 HB2 ASN A 88 -8.596 -0.996 -18.897 1.00 61.21 H new ATOM 0 HB3 ASN A 88 -9.541 -1.514 -17.515 1.00 61.21 H new ATOM 0 HD21 ASN A 88 -12.129 0.914 -17.943 1.00 34.14 H new ATOM 0 HD22 ASN A 88 -11.437 -0.334 -16.901 1.00 34.14 H new ATOM 1504 N GLU A 89 -9.261 -0.389 -14.937 1.00 40.41 N ATOM 1505 CA GLU A 89 -9.911 -0.037 -13.661 1.00 42.32 C ATOM 1506 C GLU A 89 -8.860 0.439 -12.646 1.00 10.31 C ATOM 1507 O GLU A 89 -9.161 1.292 -11.812 1.00 43.54 O ATOM 1508 CB GLU A 89 -10.733 -1.231 -13.097 1.00 41.11 C ATOM 1509 CG GLU A 89 -11.584 -0.896 -11.859 1.00 13.12 C ATOM 1510 CD GLU A 89 -12.391 -2.096 -11.348 1.00 73.30 C ATOM 1511 OE1 GLU A 89 -13.456 -2.404 -11.932 1.00 11.44 O ATOM 1512 OE2 GLU A 89 -11.962 -2.738 -10.369 1.00 5.22 O ATOM 0 H GLU A 89 -9.251 -1.390 -15.133 1.00 40.41 H new ATOM 0 HA GLU A 89 -10.610 0.779 -13.846 1.00 42.32 H new ATOM 0 HB2 GLU A 89 -11.390 -1.606 -13.882 1.00 41.11 H new ATOM 0 HB3 GLU A 89 -10.047 -2.039 -12.842 1.00 41.11 H new ATOM 0 HG2 GLU A 89 -10.932 -0.537 -11.062 1.00 13.12 H new ATOM 0 HG3 GLU A 89 -12.267 -0.082 -12.103 1.00 13.12 H new ATOM 1519 N LEU A 90 -7.621 -0.111 -12.739 1.00 54.33 N ATOM 1520 CA LEU A 90 -6.475 0.381 -11.943 1.00 65.34 C ATOM 1521 C LEU A 90 -6.180 1.861 -12.250 1.00 24.12 C ATOM 1522 O LEU A 90 -5.908 2.632 -11.336 1.00 65.44 O ATOM 1523 CB LEU A 90 -5.176 -0.434 -12.200 1.00 50.52 C ATOM 1524 CG LEU A 90 -5.117 -1.897 -11.682 1.00 35.31 C ATOM 1525 CD1 LEU A 90 -3.733 -2.508 -12.001 1.00 2.30 C ATOM 1526 CD2 LEU A 90 -5.438 -1.982 -10.175 1.00 63.14 C ATOM 0 H LEU A 90 -7.395 -0.892 -13.355 1.00 54.33 H new ATOM 0 HA LEU A 90 -6.767 0.260 -10.900 1.00 65.34 H new ATOM 0 HB2 LEU A 90 -5.002 -0.454 -13.276 1.00 50.52 H new ATOM 0 HB3 LEU A 90 -4.345 0.112 -11.753 1.00 50.52 H new ATOM 0 HG LEU A 90 -5.883 -2.477 -12.197 1.00 35.31 H new ATOM 0 HD11 LEU A 90 -3.696 -3.534 -11.636 1.00 2.30 H new ATOM 0 HD12 LEU A 90 -3.571 -2.500 -13.079 1.00 2.30 H new ATOM 0 HD13 LEU A 90 -2.955 -1.921 -11.513 1.00 2.30 H new ATOM 0 HD21 LEU A 90 -5.387 -3.021 -9.850 1.00 63.14 H new ATOM 0 HD22 LEU A 90 -4.714 -1.390 -9.615 1.00 63.14 H new ATOM 0 HD23 LEU A 90 -6.441 -1.594 -9.994 1.00 63.14 H new ATOM 1538 N GLU A 91 -6.234 2.232 -13.551 1.00 34.44 N ATOM 1539 CA GLU A 91 -5.910 3.598 -14.015 1.00 5.45 C ATOM 1540 C GLU A 91 -6.950 4.596 -13.490 1.00 43.31 C ATOM 1541 O GLU A 91 -6.603 5.678 -13.011 1.00 43.02 O ATOM 1542 CB GLU A 91 -5.829 3.688 -15.567 1.00 62.11 C ATOM 1543 CG GLU A 91 -5.342 5.068 -16.086 1.00 15.23 C ATOM 1544 CD GLU A 91 -5.400 5.250 -17.614 1.00 1.24 C ATOM 1545 OE1 GLU A 91 -5.010 4.323 -18.353 1.00 1.10 O ATOM 1546 OE2 GLU A 91 -5.786 6.346 -18.084 1.00 71.11 O ATOM 0 H GLU A 91 -6.502 1.596 -14.302 1.00 34.44 H new ATOM 0 HA GLU A 91 -4.926 3.849 -13.618 1.00 5.45 H new ATOM 0 HB2 GLU A 91 -5.155 2.913 -15.933 1.00 62.11 H new ATOM 0 HB3 GLU A 91 -6.813 3.478 -15.986 1.00 62.11 H new ATOM 0 HG2 GLU A 91 -5.945 5.847 -15.620 1.00 15.23 H new ATOM 0 HG3 GLU A 91 -4.314 5.220 -15.756 1.00 15.23 H new ATOM 1553 N GLU A 92 -8.226 4.200 -13.560 1.00 30.51 N ATOM 1554 CA GLU A 92 -9.343 5.037 -13.094 1.00 2.22 C ATOM 1555 C GLU A 92 -9.298 5.176 -11.550 1.00 33.22 C ATOM 1556 O GLU A 92 -9.604 6.235 -10.999 1.00 62.43 O ATOM 1557 CB GLU A 92 -10.706 4.440 -13.581 1.00 51.43 C ATOM 1558 CG GLU A 92 -11.716 5.482 -14.123 1.00 21.02 C ATOM 1559 CD GLU A 92 -12.098 6.579 -13.109 1.00 14.11 C ATOM 1560 OE1 GLU A 92 -12.965 6.319 -12.247 1.00 52.44 O ATOM 1561 OE2 GLU A 92 -11.543 7.708 -13.175 1.00 12.32 O ATOM 0 H GLU A 92 -8.515 3.298 -13.938 1.00 30.51 H new ATOM 0 HA GLU A 92 -9.247 6.035 -13.521 1.00 2.22 H new ATOM 0 HB2 GLU A 92 -10.507 3.707 -14.363 1.00 51.43 H new ATOM 0 HB3 GLU A 92 -11.168 3.904 -12.752 1.00 51.43 H new ATOM 0 HG2 GLU A 92 -11.293 5.954 -15.010 1.00 21.02 H new ATOM 0 HG3 GLU A 92 -12.621 4.964 -14.439 1.00 21.02 H new ATOM 1568 N PHE A 93 -8.883 4.084 -10.887 1.00 50.34 N ATOM 1569 CA PHE A 93 -8.781 4.005 -9.418 1.00 34.31 C ATOM 1570 C PHE A 93 -7.648 4.915 -8.883 1.00 52.01 C ATOM 1571 O PHE A 93 -7.862 5.671 -7.926 1.00 52.14 O ATOM 1572 CB PHE A 93 -8.563 2.527 -8.986 1.00 54.30 C ATOM 1573 CG PHE A 93 -8.527 2.294 -7.478 1.00 74.14 C ATOM 1574 CD1 PHE A 93 -9.709 2.199 -6.742 1.00 44.22 C ATOM 1575 CD2 PHE A 93 -7.316 2.171 -6.794 1.00 1.22 C ATOM 1576 CE1 PHE A 93 -9.673 1.997 -5.380 1.00 11.43 C ATOM 1577 CE2 PHE A 93 -7.285 1.968 -5.433 1.00 52.15 C ATOM 1578 CZ PHE A 93 -8.461 1.882 -4.730 1.00 64.12 C ATOM 0 H PHE A 93 -8.606 3.223 -11.359 1.00 50.34 H new ATOM 0 HA PHE A 93 -9.714 4.364 -8.984 1.00 34.31 H new ATOM 0 HB2 PHE A 93 -9.360 1.918 -9.414 1.00 54.30 H new ATOM 0 HB3 PHE A 93 -7.626 2.173 -9.416 1.00 54.30 H new ATOM 0 HD1 PHE A 93 -10.661 2.285 -7.245 1.00 44.22 H new ATOM 0 HD2 PHE A 93 -6.388 2.236 -7.342 1.00 1.22 H new ATOM 0 HE1 PHE A 93 -10.594 1.929 -4.820 1.00 11.43 H new ATOM 0 HE2 PHE A 93 -6.339 1.877 -4.920 1.00 52.15 H new ATOM 0 HZ PHE A 93 -8.438 1.723 -3.662 1.00 64.12 H new ATOM 1588 N LYS A 94 -6.453 4.847 -9.522 1.00 51.03 N ATOM 1589 CA LYS A 94 -5.260 5.614 -9.079 1.00 71.24 C ATOM 1590 C LYS A 94 -5.467 7.128 -9.231 1.00 62.42 C ATOM 1591 O LYS A 94 -4.860 7.903 -8.499 1.00 55.44 O ATOM 1592 CB LYS A 94 -3.937 5.121 -9.770 1.00 3.42 C ATOM 1593 CG LYS A 94 -3.912 5.049 -11.313 1.00 24.41 C ATOM 1594 CD LYS A 94 -3.580 6.381 -12.024 1.00 43.32 C ATOM 1595 CE LYS A 94 -2.123 6.826 -11.820 1.00 70.33 C ATOM 1596 NZ LYS A 94 -1.827 8.080 -12.572 1.00 21.25 N ATOM 0 H LYS A 94 -6.289 4.269 -10.346 1.00 51.03 H new ATOM 0 HA LYS A 94 -5.138 5.415 -8.014 1.00 71.24 H new ATOM 0 HB2 LYS A 94 -3.128 5.779 -9.453 1.00 3.42 H new ATOM 0 HB3 LYS A 94 -3.709 4.127 -9.385 1.00 3.42 H new ATOM 0 HG2 LYS A 94 -3.179 4.301 -11.615 1.00 24.41 H new ATOM 0 HG3 LYS A 94 -4.885 4.701 -11.661 1.00 24.41 H new ATOM 0 HD2 LYS A 94 -3.775 6.275 -13.091 1.00 43.32 H new ATOM 0 HD3 LYS A 94 -4.247 7.160 -11.654 1.00 43.32 H new ATOM 0 HE2 LYS A 94 -1.934 6.984 -10.758 1.00 70.33 H new ATOM 0 HE3 LYS A 94 -1.450 6.035 -12.149 1.00 70.33 H new ATOM 0 HZ1 LYS A 94 -0.836 8.354 -12.414 1.00 21.25 H new ATOM 0 HZ2 LYS A 94 -1.984 7.921 -13.588 1.00 21.25 H new ATOM 0 HZ3 LYS A 94 -2.454 8.840 -12.239 1.00 21.25 H new ATOM 1610 N ARG A 95 -6.349 7.520 -10.175 1.00 61.11 N ATOM 1611 CA ARG A 95 -6.783 8.925 -10.363 1.00 20.22 C ATOM 1612 C ARG A 95 -7.472 9.475 -9.094 1.00 42.32 C ATOM 1613 O ARG A 95 -7.269 10.635 -8.713 1.00 74.21 O ATOM 1614 CB ARG A 95 -7.743 9.021 -11.585 1.00 21.31 C ATOM 1615 CG ARG A 95 -7.047 8.871 -12.960 1.00 55.14 C ATOM 1616 CD ARG A 95 -8.036 8.587 -14.112 1.00 73.24 C ATOM 1617 NE ARG A 95 -9.201 9.496 -14.110 1.00 52.04 N ATOM 1618 CZ ARG A 95 -9.403 10.514 -14.965 1.00 3.13 C ATOM 1619 NH1 ARG A 95 -8.526 10.800 -15.926 1.00 32.22 N ATOM 1620 NH2 ARG A 95 -10.488 11.259 -14.838 1.00 12.41 N ATOM 0 H ARG A 95 -6.783 6.871 -10.831 1.00 61.11 H new ATOM 0 HA ARG A 95 -5.899 9.534 -10.551 1.00 20.22 H new ATOM 0 HB2 ARG A 95 -8.507 8.249 -11.492 1.00 21.31 H new ATOM 0 HB3 ARG A 95 -8.255 9.983 -11.554 1.00 21.31 H new ATOM 0 HG2 ARG A 95 -6.493 9.783 -13.181 1.00 55.14 H new ATOM 0 HG3 ARG A 95 -6.319 8.061 -12.906 1.00 55.14 H new ATOM 0 HD2 ARG A 95 -7.513 8.678 -15.064 1.00 73.24 H new ATOM 0 HD3 ARG A 95 -8.385 7.557 -14.038 1.00 73.24 H new ATOM 0 HE ARG A 95 -9.914 9.337 -13.398 1.00 52.04 H new ATOM 0 HH11 ARG A 95 -7.678 10.241 -16.026 1.00 32.22 H new ATOM 0 HH12 ARG A 95 -8.702 11.578 -16.562 1.00 32.22 H new ATOM 0 HH21 ARG A 95 -11.160 11.059 -14.098 1.00 12.41 H new ATOM 0 HH22 ARG A 95 -10.653 12.034 -15.480 1.00 12.41 H new ATOM 1634 N LYS A 96 -8.277 8.619 -8.447 1.00 21.03 N ATOM 1635 CA LYS A 96 -9.026 8.971 -7.221 1.00 43.30 C ATOM 1636 C LYS A 96 -8.088 9.034 -6.004 1.00 12.33 C ATOM 1637 O LYS A 96 -8.345 9.788 -5.066 1.00 62.11 O ATOM 1638 CB LYS A 96 -10.208 7.969 -6.989 1.00 14.02 C ATOM 1639 CG LYS A 96 -11.515 8.314 -7.756 1.00 20.42 C ATOM 1640 CD LYS A 96 -11.309 8.520 -9.279 1.00 24.24 C ATOM 1641 CE LYS A 96 -12.595 8.941 -10.005 1.00 44.34 C ATOM 1642 NZ LYS A 96 -13.647 7.896 -9.930 1.00 1.23 N ATOM 0 H LYS A 96 -8.431 7.659 -8.756 1.00 21.03 H new ATOM 0 HA LYS A 96 -9.456 9.964 -7.352 1.00 43.30 H new ATOM 0 HB2 LYS A 96 -9.883 6.971 -7.284 1.00 14.02 H new ATOM 0 HB3 LYS A 96 -10.429 7.930 -5.922 1.00 14.02 H new ATOM 0 HG2 LYS A 96 -12.238 7.513 -7.601 1.00 20.42 H new ATOM 0 HG3 LYS A 96 -11.947 9.220 -7.331 1.00 20.42 H new ATOM 0 HD2 LYS A 96 -10.543 9.279 -9.437 1.00 24.24 H new ATOM 0 HD3 LYS A 96 -10.936 7.595 -9.718 1.00 24.24 H new ATOM 0 HE2 LYS A 96 -12.971 9.866 -9.568 1.00 44.34 H new ATOM 0 HE3 LYS A 96 -12.368 9.152 -11.050 1.00 44.34 H new ATOM 0 HZ1 LYS A 96 -14.566 8.310 -10.184 1.00 1.23 H new ATOM 0 HZ2 LYS A 96 -13.419 7.126 -10.591 1.00 1.23 H new ATOM 0 HZ3 LYS A 96 -13.693 7.519 -8.962 1.00 1.23 H new ATOM 1656 N ILE A 97 -6.988 8.262 -6.047 1.00 40.04 N ATOM 1657 CA ILE A 97 -5.950 8.278 -4.993 1.00 74.32 C ATOM 1658 C ILE A 97 -5.102 9.566 -5.116 1.00 24.22 C ATOM 1659 O ILE A 97 -4.656 10.141 -4.114 1.00 0.14 O ATOM 1660 CB ILE A 97 -5.020 7.014 -5.090 1.00 23.43 C ATOM 1661 CG1 ILE A 97 -5.869 5.707 -5.232 1.00 61.42 C ATOM 1662 CG2 ILE A 97 -4.049 6.933 -3.885 1.00 73.23 C ATOM 1663 CD1 ILE A 97 -6.798 5.387 -4.070 1.00 70.24 C ATOM 0 H ILE A 97 -6.791 7.612 -6.808 1.00 40.04 H new ATOM 0 HA ILE A 97 -6.448 8.258 -4.023 1.00 74.32 H new ATOM 0 HB ILE A 97 -4.411 7.114 -5.988 1.00 23.43 H new ATOM 0 HG12 ILE A 97 -6.467 5.783 -6.140 1.00 61.42 H new ATOM 0 HG13 ILE A 97 -5.187 4.867 -5.369 1.00 61.42 H new ATOM 0 HG21 ILE A 97 -3.420 6.048 -3.983 1.00 73.23 H new ATOM 0 HG22 ILE A 97 -3.421 7.824 -3.863 1.00 73.23 H new ATOM 0 HG23 ILE A 97 -4.622 6.871 -2.960 1.00 73.23 H new ATOM 0 HD11 ILE A 97 -7.335 4.461 -4.278 1.00 70.24 H new ATOM 0 HD12 ILE A 97 -6.213 5.270 -3.158 1.00 70.24 H new ATOM 0 HD13 ILE A 97 -7.513 6.200 -3.941 1.00 70.24 H new ATOM 1675 N GLU A 98 -4.902 9.998 -6.378 1.00 4.43 N ATOM 1676 CA GLU A 98 -4.272 11.289 -6.720 1.00 12.22 C ATOM 1677 C GLU A 98 -5.155 12.460 -6.235 1.00 63.12 C ATOM 1678 O GLU A 98 -4.642 13.495 -5.806 1.00 64.42 O ATOM 1679 CB GLU A 98 -4.049 11.388 -8.256 1.00 42.02 C ATOM 1680 CG GLU A 98 -2.990 10.434 -8.836 1.00 0.32 C ATOM 1681 CD GLU A 98 -2.819 10.600 -10.353 1.00 41.24 C ATOM 1682 OE1 GLU A 98 -3.582 9.979 -11.126 1.00 52.42 O ATOM 1683 OE2 GLU A 98 -1.926 11.368 -10.780 1.00 22.42 O ATOM 0 H GLU A 98 -5.176 9.454 -7.196 1.00 4.43 H new ATOM 0 HA GLU A 98 -3.305 11.348 -6.220 1.00 12.22 H new ATOM 0 HB2 GLU A 98 -4.998 11.196 -8.756 1.00 42.02 H new ATOM 0 HB3 GLU A 98 -3.762 12.411 -8.498 1.00 42.02 H new ATOM 0 HG2 GLU A 98 -2.034 10.614 -8.344 1.00 0.32 H new ATOM 0 HG3 GLU A 98 -3.273 9.405 -8.616 1.00 0.32 H new ATOM 1690 N SER A 99 -6.487 12.264 -6.308 1.00 35.43 N ATOM 1691 CA SER A 99 -7.482 13.238 -5.814 1.00 53.12 C ATOM 1692 C SER A 99 -7.478 13.290 -4.266 1.00 15.34 C ATOM 1693 O SER A 99 -7.761 14.339 -3.677 1.00 5.41 O ATOM 1694 CB SER A 99 -8.889 12.884 -6.358 1.00 3.45 C ATOM 1695 OG SER A 99 -9.856 13.885 -6.049 1.00 64.15 O ATOM 0 H SER A 99 -6.904 11.425 -6.712 1.00 35.43 H new ATOM 0 HA SER A 99 -7.213 14.229 -6.178 1.00 53.12 H new ATOM 0 HB2 SER A 99 -8.836 12.754 -7.439 1.00 3.45 H new ATOM 0 HB3 SER A 99 -9.209 11.931 -5.938 1.00 3.45 H new ATOM 0 HG SER A 99 -10.727 13.621 -6.412 1.00 64.15 H new ATOM 1701 N GLN A 100 -7.172 12.142 -3.619 1.00 22.01 N ATOM 1702 CA GLN A 100 -6.959 12.063 -2.151 1.00 62.21 C ATOM 1703 C GLN A 100 -5.570 12.632 -1.774 1.00 50.52 C ATOM 1704 O GLN A 100 -5.326 12.975 -0.612 1.00 44.31 O ATOM 1705 CB GLN A 100 -7.098 10.594 -1.663 1.00 34.33 C ATOM 1706 CG GLN A 100 -8.499 9.987 -1.849 1.00 40.43 C ATOM 1707 CD GLN A 100 -8.564 8.503 -1.484 1.00 73.52 C ATOM 1708 OE1 GLN A 100 -8.303 7.646 -2.315 1.00 31.13 O ATOM 1709 NE2 GLN A 100 -8.918 8.190 -0.246 1.00 60.34 N ATOM 0 H GLN A 100 -7.066 11.246 -4.095 1.00 22.01 H new ATOM 0 HA GLN A 100 -7.722 12.665 -1.657 1.00 62.21 H new ATOM 0 HB2 GLN A 100 -6.375 9.978 -2.198 1.00 34.33 H new ATOM 0 HB3 GLN A 100 -6.835 10.550 -0.606 1.00 34.33 H new ATOM 0 HG2 GLN A 100 -9.211 10.538 -1.235 1.00 40.43 H new ATOM 0 HG3 GLN A 100 -8.808 10.114 -2.886 1.00 40.43 H new ATOM 0 HE21 GLN A 100 -9.130 8.928 0.426 1.00 60.34 H new ATOM 0 HE22 GLN A 100 -8.978 7.211 0.035 1.00 60.34 H new ATOM 1718 N GLY A 101 -4.666 12.700 -2.772 1.00 33.30 N ATOM 1719 CA GLY A 101 -3.357 13.341 -2.629 1.00 64.42 C ATOM 1720 C GLY A 101 -2.333 12.478 -1.907 1.00 3.52 C ATOM 1721 O GLY A 101 -1.574 12.973 -1.061 1.00 12.51 O ATOM 0 H GLY A 101 -4.830 12.309 -3.700 1.00 33.30 H new ATOM 0 HA2 GLY A 101 -2.975 13.593 -3.618 1.00 64.42 H new ATOM 0 HA3 GLY A 101 -3.478 14.278 -2.086 1.00 64.42 H new ATOM 1725 N TYR A 102 -2.334 11.179 -2.221 1.00 33.10 N ATOM 1726 CA TYR A 102 -1.313 10.226 -1.743 1.00 24.03 C ATOM 1727 C TYR A 102 -0.408 9.819 -2.905 1.00 60.31 C ATOM 1728 O TYR A 102 -0.807 9.929 -4.080 1.00 73.10 O ATOM 1729 CB TYR A 102 -1.973 8.967 -1.121 1.00 55.30 C ATOM 1730 CG TYR A 102 -2.733 9.234 0.184 1.00 63.53 C ATOM 1731 CD1 TYR A 102 -2.089 9.159 1.426 1.00 0.11 C ATOM 1732 CD2 TYR A 102 -4.091 9.560 0.178 1.00 22.24 C ATOM 1733 CE1 TYR A 102 -2.774 9.397 2.603 1.00 75.02 C ATOM 1734 CE2 TYR A 102 -4.777 9.801 1.355 1.00 23.31 C ATOM 1735 CZ TYR A 102 -4.117 9.717 2.561 1.00 10.22 C ATOM 1736 OH TYR A 102 -4.802 9.957 3.734 1.00 31.11 O ATOM 0 H TYR A 102 -3.044 10.752 -2.816 1.00 33.10 H new ATOM 0 HA TYR A 102 -0.720 10.715 -0.970 1.00 24.03 H new ATOM 0 HB2 TYR A 102 -2.662 8.535 -1.847 1.00 55.30 H new ATOM 0 HB3 TYR A 102 -1.200 8.222 -0.932 1.00 55.30 H new ATOM 0 HD1 TYR A 102 -1.039 8.911 1.465 1.00 0.11 H new ATOM 0 HD2 TYR A 102 -4.616 9.625 -0.764 1.00 22.24 H new ATOM 0 HE1 TYR A 102 -2.261 9.333 3.551 1.00 75.02 H new ATOM 0 HE2 TYR A 102 -5.827 10.054 1.328 1.00 23.31 H new ATOM 0 HH TYR A 102 -5.671 9.505 3.704 1.00 31.11 H new ATOM 1746 N GLU A 103 0.815 9.362 -2.567 1.00 32.21 N ATOM 1747 CA GLU A 103 1.731 8.754 -3.537 1.00 53.12 C ATOM 1748 C GLU A 103 1.112 7.441 -4.039 1.00 11.33 C ATOM 1749 O GLU A 103 0.752 6.581 -3.233 1.00 64.51 O ATOM 1750 CB GLU A 103 3.126 8.491 -2.904 1.00 31.10 C ATOM 1751 CG GLU A 103 4.142 7.761 -3.822 1.00 61.20 C ATOM 1752 CD GLU A 103 4.527 8.553 -5.090 1.00 75.52 C ATOM 1753 OE1 GLU A 103 3.846 8.422 -6.133 1.00 44.22 O ATOM 1754 OE2 GLU A 103 5.520 9.306 -5.048 1.00 63.03 O ATOM 0 H GLU A 103 1.188 9.406 -1.619 1.00 32.21 H new ATOM 0 HA GLU A 103 1.878 9.439 -4.372 1.00 53.12 H new ATOM 0 HB2 GLU A 103 3.555 9.446 -2.601 1.00 31.10 H new ATOM 0 HB3 GLU A 103 2.990 7.901 -1.998 1.00 31.10 H new ATOM 0 HG2 GLU A 103 5.046 7.550 -3.250 1.00 61.20 H new ATOM 0 HG3 GLU A 103 3.721 6.801 -4.120 1.00 61.20 H new ATOM 1761 N VAL A 104 0.943 7.334 -5.356 1.00 72.14 N ATOM 1762 CA VAL A 104 0.299 6.178 -5.997 1.00 53.42 C ATOM 1763 C VAL A 104 1.017 5.827 -7.309 1.00 75.52 C ATOM 1764 O VAL A 104 1.387 6.721 -8.077 1.00 53.21 O ATOM 1765 CB VAL A 104 -1.226 6.462 -6.236 1.00 3.24 C ATOM 1766 CG1 VAL A 104 -1.457 7.753 -7.049 1.00 13.45 C ATOM 1767 CG2 VAL A 104 -1.946 5.255 -6.872 1.00 13.04 C ATOM 0 H VAL A 104 1.249 8.049 -6.016 1.00 72.14 H new ATOM 0 HA VAL A 104 0.376 5.317 -5.333 1.00 53.42 H new ATOM 0 HB VAL A 104 -1.670 6.620 -5.253 1.00 3.24 H new ATOM 0 HG11 VAL A 104 -2.527 7.908 -7.189 1.00 13.45 H new ATOM 0 HG12 VAL A 104 -1.035 8.602 -6.511 1.00 13.45 H new ATOM 0 HG13 VAL A 104 -0.973 7.662 -8.021 1.00 13.45 H new ATOM 0 HG21 VAL A 104 -2.999 5.496 -7.020 1.00 13.04 H new ATOM 0 HG22 VAL A 104 -1.488 5.024 -7.834 1.00 13.04 H new ATOM 0 HG23 VAL A 104 -1.860 4.391 -6.213 1.00 13.04 H new ATOM 1777 N ARG A 105 1.232 4.521 -7.542 1.00 60.21 N ATOM 1778 CA ARG A 105 1.858 4.006 -8.773 1.00 61.35 C ATOM 1779 C ARG A 105 1.024 2.856 -9.348 1.00 52.43 C ATOM 1780 O ARG A 105 0.655 1.934 -8.625 1.00 50.14 O ATOM 1781 CB ARG A 105 3.315 3.534 -8.493 1.00 21.44 C ATOM 1782 CG ARG A 105 4.308 4.668 -8.148 1.00 22.10 C ATOM 1783 CD ARG A 105 4.467 5.714 -9.286 1.00 32.30 C ATOM 1784 NE ARG A 105 4.215 7.081 -8.812 1.00 34.30 N ATOM 1785 CZ ARG A 105 4.213 8.186 -9.567 1.00 71.45 C ATOM 1786 NH1 ARG A 105 4.438 8.127 -10.880 1.00 63.54 N ATOM 1787 NH2 ARG A 105 3.973 9.360 -8.999 1.00 33.42 N ATOM 0 H ARG A 105 0.976 3.789 -6.879 1.00 60.21 H new ATOM 0 HA ARG A 105 1.896 4.812 -9.506 1.00 61.35 H new ATOM 0 HB2 ARG A 105 3.299 2.821 -7.669 1.00 21.44 H new ATOM 0 HB3 ARG A 105 3.684 3.001 -9.369 1.00 21.44 H new ATOM 0 HG2 ARG A 105 3.971 5.174 -7.244 1.00 22.10 H new ATOM 0 HG3 ARG A 105 5.282 4.233 -7.925 1.00 22.10 H new ATOM 0 HD2 ARG A 105 5.474 5.652 -9.698 1.00 32.30 H new ATOM 0 HD3 ARG A 105 3.777 5.477 -10.096 1.00 32.30 H new ATOM 0 HE ARG A 105 4.024 7.199 -7.817 1.00 34.30 H new ATOM 0 HH11 ARG A 105 4.616 7.228 -11.327 1.00 63.54 H new ATOM 0 HH12 ARG A 105 4.432 8.981 -11.437 1.00 63.54 H new ATOM 0 HH21 ARG A 105 3.792 9.414 -7.997 1.00 33.42 H new ATOM 0 HH22 ARG A 105 3.969 10.209 -9.565 1.00 33.42 H new ATOM 1801 N LYS A 106 0.733 2.937 -10.655 1.00 75.34 N ATOM 1802 CA LYS A 106 0.072 1.865 -11.411 1.00 22.33 C ATOM 1803 C LYS A 106 1.162 1.147 -12.226 1.00 40.55 C ATOM 1804 O LYS A 106 1.796 1.758 -13.096 1.00 64.11 O ATOM 1805 CB LYS A 106 -1.042 2.454 -12.345 1.00 65.32 C ATOM 1806 CG LYS A 106 -2.140 1.454 -12.807 1.00 53.13 C ATOM 1807 CD LYS A 106 -1.678 0.331 -13.776 1.00 53.22 C ATOM 1808 CE LYS A 106 -1.354 0.807 -15.212 1.00 71.35 C ATOM 1809 NZ LYS A 106 -0.107 1.616 -15.309 1.00 63.04 N ATOM 0 H LYS A 106 0.952 3.757 -11.221 1.00 75.34 H new ATOM 0 HA LYS A 106 -0.421 1.162 -10.739 1.00 22.33 H new ATOM 0 HB2 LYS A 106 -1.526 3.280 -11.824 1.00 65.32 H new ATOM 0 HB3 LYS A 106 -0.563 2.872 -13.230 1.00 65.32 H new ATOM 0 HG2 LYS A 106 -2.573 0.987 -11.922 1.00 53.13 H new ATOM 0 HG3 LYS A 106 -2.937 2.019 -13.291 1.00 53.13 H new ATOM 0 HD2 LYS A 106 -0.793 -0.148 -13.359 1.00 53.22 H new ATOM 0 HD3 LYS A 106 -2.458 -0.429 -13.827 1.00 53.22 H new ATOM 0 HE2 LYS A 106 -1.263 -0.063 -15.862 1.00 71.35 H new ATOM 0 HE3 LYS A 106 -2.190 1.398 -15.586 1.00 71.35 H new ATOM 0 HZ1 LYS A 106 0.324 1.478 -16.245 1.00 63.04 H new ATOM 0 HZ2 LYS A 106 -0.335 2.622 -15.177 1.00 63.04 H new ATOM 0 HZ3 LYS A 106 0.561 1.313 -14.572 1.00 63.04 H new ATOM 1823 N VAL A 107 1.359 -0.142 -11.945 1.00 13.20 N ATOM 1824 CA VAL A 107 2.363 -0.993 -12.617 1.00 0.15 C ATOM 1825 C VAL A 107 1.682 -2.260 -13.171 1.00 63.43 C ATOM 1826 O VAL A 107 0.584 -2.631 -12.727 1.00 62.21 O ATOM 1827 CB VAL A 107 3.558 -1.375 -11.657 1.00 34.04 C ATOM 1828 CG1 VAL A 107 4.282 -0.110 -11.124 1.00 22.22 C ATOM 1829 CG2 VAL A 107 3.085 -2.280 -10.503 1.00 41.10 C ATOM 0 H VAL A 107 0.821 -0.639 -11.235 1.00 13.20 H new ATOM 0 HA VAL A 107 2.790 -0.421 -13.441 1.00 0.15 H new ATOM 0 HB VAL A 107 4.280 -1.943 -12.243 1.00 34.04 H new ATOM 0 HG11 VAL A 107 5.099 -0.408 -10.467 1.00 22.22 H new ATOM 0 HG12 VAL A 107 4.681 0.461 -11.962 1.00 22.22 H new ATOM 0 HG13 VAL A 107 3.576 0.507 -10.568 1.00 22.22 H new ATOM 0 HG21 VAL A 107 3.932 -2.524 -9.861 1.00 41.10 H new ATOM 0 HG22 VAL A 107 2.326 -1.759 -9.920 1.00 41.10 H new ATOM 0 HG23 VAL A 107 2.662 -3.198 -10.911 1.00 41.10 H new ATOM 1839 N THR A 108 2.323 -2.895 -14.165 1.00 52.24 N ATOM 1840 CA THR A 108 1.809 -4.126 -14.808 1.00 12.01 C ATOM 1841 C THR A 108 2.919 -5.185 -14.966 1.00 31.02 C ATOM 1842 O THR A 108 2.663 -6.279 -15.483 1.00 41.22 O ATOM 1843 CB THR A 108 1.149 -3.802 -16.197 1.00 14.24 C ATOM 1844 OG1 THR A 108 2.032 -2.976 -16.981 1.00 62.23 O ATOM 1845 CG2 THR A 108 -0.219 -3.097 -16.047 1.00 54.42 C ATOM 0 H THR A 108 3.212 -2.574 -14.549 1.00 52.24 H new ATOM 0 HA THR A 108 1.043 -4.542 -14.154 1.00 12.01 H new ATOM 0 HB THR A 108 0.978 -4.753 -16.702 1.00 14.24 H new ATOM 0 HG1 THR A 108 1.615 -2.780 -17.846 1.00 62.23 H new ATOM 0 HG21 THR A 108 -0.634 -2.894 -17.034 1.00 54.42 H new ATOM 0 HG22 THR A 108 -0.901 -3.741 -15.492 1.00 54.42 H new ATOM 0 HG23 THR A 108 -0.087 -2.158 -15.509 1.00 54.42 H new ATOM 1853 N ASP A 109 4.143 -4.867 -14.504 1.00 42.02 N ATOM 1854 CA ASP A 109 5.281 -5.812 -14.487 1.00 62.11 C ATOM 1855 C ASP A 109 5.707 -6.050 -13.034 1.00 2.40 C ATOM 1856 O ASP A 109 5.621 -5.128 -12.210 1.00 15.45 O ATOM 1857 CB ASP A 109 6.476 -5.265 -15.304 1.00 50.33 C ATOM 1858 CG ASP A 109 6.129 -5.017 -16.775 1.00 53.42 C ATOM 1859 OD1 ASP A 109 6.130 -5.978 -17.567 1.00 23.24 O ATOM 1860 OD2 ASP A 109 5.840 -3.863 -17.143 1.00 32.31 O ATOM 0 H ASP A 109 4.373 -3.946 -14.131 1.00 42.02 H new ATOM 0 HA ASP A 109 4.966 -6.750 -14.945 1.00 62.11 H new ATOM 0 HB2 ASP A 109 6.820 -4.333 -14.855 1.00 50.33 H new ATOM 0 HB3 ASP A 109 7.304 -5.972 -15.245 1.00 50.33 H new ATOM 1865 N ASP A 110 6.184 -7.277 -12.730 1.00 53.14 N ATOM 1866 CA ASP A 110 6.650 -7.638 -11.374 1.00 55.22 C ATOM 1867 C ASP A 110 7.950 -6.893 -11.031 1.00 34.43 C ATOM 1868 O ASP A 110 8.123 -6.438 -9.899 1.00 21.23 O ATOM 1869 CB ASP A 110 6.837 -9.178 -11.204 1.00 54.33 C ATOM 1870 CG ASP A 110 7.928 -9.782 -12.103 1.00 33.43 C ATOM 1871 OD1 ASP A 110 7.666 -9.976 -13.304 1.00 3.21 O ATOM 1872 OD2 ASP A 110 9.050 -10.052 -11.614 1.00 60.45 O ATOM 0 H ASP A 110 6.256 -8.036 -13.408 1.00 53.14 H new ATOM 0 HA ASP A 110 5.873 -7.330 -10.675 1.00 55.22 H new ATOM 0 HB2 ASP A 110 7.080 -9.391 -10.163 1.00 54.33 H new ATOM 0 HB3 ASP A 110 5.890 -9.674 -11.418 1.00 54.33 H new ATOM 1877 N GLU A 111 8.853 -6.770 -12.027 1.00 1.25 N ATOM 1878 CA GLU A 111 10.119 -6.016 -11.883 1.00 42.13 C ATOM 1879 C GLU A 111 9.832 -4.517 -11.624 1.00 72.24 C ATOM 1880 O GLU A 111 10.508 -3.866 -10.813 1.00 1.41 O ATOM 1881 CB GLU A 111 11.007 -6.179 -13.150 1.00 15.21 C ATOM 1882 CG GLU A 111 10.394 -5.593 -14.442 1.00 63.34 C ATOM 1883 CD GLU A 111 11.352 -5.591 -15.639 1.00 1.43 C ATOM 1884 OE1 GLU A 111 12.253 -4.722 -15.681 1.00 73.44 O ATOM 1885 OE2 GLU A 111 11.196 -6.435 -16.546 1.00 63.03 O ATOM 0 H GLU A 111 8.727 -7.188 -12.949 1.00 1.25 H new ATOM 0 HA GLU A 111 10.659 -6.423 -11.028 1.00 42.13 H new ATOM 0 HB2 GLU A 111 11.968 -5.698 -12.969 1.00 15.21 H new ATOM 0 HB3 GLU A 111 11.205 -7.240 -13.305 1.00 15.21 H new ATOM 0 HG2 GLU A 111 9.504 -6.166 -14.702 1.00 63.34 H new ATOM 0 HG3 GLU A 111 10.069 -4.571 -14.247 1.00 63.34 H new ATOM 1892 N GLU A 112 8.782 -4.011 -12.300 1.00 63.25 N ATOM 1893 CA GLU A 112 8.380 -2.602 -12.250 1.00 65.41 C ATOM 1894 C GLU A 112 7.749 -2.291 -10.889 1.00 11.34 C ATOM 1895 O GLU A 112 7.882 -1.191 -10.389 1.00 63.13 O ATOM 1896 CB GLU A 112 7.405 -2.295 -13.412 1.00 3.13 C ATOM 1897 CG GLU A 112 6.968 -0.825 -13.552 1.00 44.04 C ATOM 1898 CD GLU A 112 6.046 -0.588 -14.759 1.00 51.20 C ATOM 1899 OE1 GLU A 112 4.940 -1.180 -14.805 1.00 54.55 O ATOM 1900 OE2 GLU A 112 6.424 0.168 -15.678 1.00 1.45 O ATOM 0 H GLU A 112 8.186 -4.580 -12.901 1.00 63.25 H new ATOM 0 HA GLU A 112 9.256 -1.964 -12.368 1.00 65.41 H new ATOM 0 HB2 GLU A 112 7.874 -2.605 -14.346 1.00 3.13 H new ATOM 0 HB3 GLU A 112 6.513 -2.909 -13.284 1.00 3.13 H new ATOM 0 HG2 GLU A 112 6.454 -0.516 -12.642 1.00 44.04 H new ATOM 0 HG3 GLU A 112 7.853 -0.196 -13.648 1.00 44.04 H new ATOM 1907 N ALA A 113 7.072 -3.282 -10.299 1.00 32.04 N ATOM 1908 CA ALA A 113 6.539 -3.173 -8.934 1.00 43.42 C ATOM 1909 C ALA A 113 7.672 -3.120 -7.893 1.00 20.41 C ATOM 1910 O ALA A 113 7.634 -2.290 -6.982 1.00 14.12 O ATOM 1911 CB ALA A 113 5.595 -4.341 -8.638 1.00 42.01 C ATOM 0 H ALA A 113 6.878 -4.177 -10.749 1.00 32.04 H new ATOM 0 HA ALA A 113 5.979 -2.240 -8.865 1.00 43.42 H new ATOM 0 HB1 ALA A 113 5.208 -4.248 -7.623 1.00 42.01 H new ATOM 0 HB2 ALA A 113 4.766 -4.327 -9.346 1.00 42.01 H new ATOM 0 HB3 ALA A 113 6.138 -5.281 -8.734 1.00 42.01 H new ATOM 1917 N LEU A 114 8.686 -4.000 -8.065 1.00 23.31 N ATOM 1918 CA LEU A 114 9.833 -4.108 -7.135 1.00 0.41 C ATOM 1919 C LEU A 114 10.619 -2.788 -7.043 1.00 72.33 C ATOM 1920 O LEU A 114 10.937 -2.339 -5.940 1.00 52.03 O ATOM 1921 CB LEU A 114 10.792 -5.257 -7.557 1.00 4.32 C ATOM 1922 CG LEU A 114 10.223 -6.706 -7.491 1.00 75.21 C ATOM 1923 CD1 LEU A 114 11.266 -7.724 -8.002 1.00 72.34 C ATOM 1924 CD2 LEU A 114 9.726 -7.053 -6.068 1.00 10.25 C ATOM 0 H LEU A 114 8.732 -4.652 -8.848 1.00 23.31 H new ATOM 0 HA LEU A 114 9.420 -4.332 -6.152 1.00 0.41 H new ATOM 0 HB2 LEU A 114 11.121 -5.067 -8.579 1.00 4.32 H new ATOM 0 HB3 LEU A 114 11.678 -5.210 -6.923 1.00 4.32 H new ATOM 0 HG LEU A 114 9.356 -6.762 -8.150 1.00 75.21 H new ATOM 0 HD11 LEU A 114 10.850 -8.730 -7.948 1.00 72.34 H new ATOM 0 HD12 LEU A 114 11.524 -7.493 -9.036 1.00 72.34 H new ATOM 0 HD13 LEU A 114 12.162 -7.669 -7.384 1.00 72.34 H new ATOM 0 HD21 LEU A 114 9.335 -8.071 -6.057 1.00 10.25 H new ATOM 0 HD22 LEU A 114 10.555 -6.975 -5.364 1.00 10.25 H new ATOM 0 HD23 LEU A 114 8.937 -6.359 -5.779 1.00 10.25 H new ATOM 1936 N LYS A 115 10.895 -2.160 -8.214 1.00 44.24 N ATOM 1937 CA LYS A 115 11.686 -0.909 -8.275 1.00 72.52 C ATOM 1938 C LYS A 115 10.953 0.225 -7.537 1.00 42.33 C ATOM 1939 O LYS A 115 11.587 1.040 -6.866 1.00 34.21 O ATOM 1940 CB LYS A 115 12.014 -0.486 -9.741 1.00 4.10 C ATOM 1941 CG LYS A 115 10.795 -0.147 -10.624 1.00 41.41 C ATOM 1942 CD LYS A 115 11.162 0.322 -12.056 1.00 2.21 C ATOM 1943 CE LYS A 115 11.834 1.703 -12.090 1.00 12.32 C ATOM 1944 NZ LYS A 115 10.931 2.777 -11.591 1.00 10.23 N ATOM 0 H LYS A 115 10.582 -2.499 -9.124 1.00 44.24 H new ATOM 0 HA LYS A 115 12.636 -1.103 -7.778 1.00 72.52 H new ATOM 0 HB2 LYS A 115 12.672 0.383 -9.711 1.00 4.10 H new ATOM 0 HB3 LYS A 115 12.572 -1.292 -10.217 1.00 4.10 H new ATOM 0 HG2 LYS A 115 10.155 -1.026 -10.694 1.00 41.41 H new ATOM 0 HG3 LYS A 115 10.212 0.634 -10.136 1.00 41.41 H new ATOM 0 HD2 LYS A 115 11.829 -0.410 -12.511 1.00 2.21 H new ATOM 0 HD3 LYS A 115 10.258 0.351 -12.664 1.00 2.21 H new ATOM 0 HE2 LYS A 115 12.739 1.680 -11.484 1.00 12.32 H new ATOM 0 HE3 LYS A 115 12.140 1.932 -13.111 1.00 12.32 H new ATOM 0 HZ1 LYS A 115 11.031 3.621 -12.190 1.00 10.23 H new ATOM 0 HZ2 LYS A 115 9.946 2.445 -11.623 1.00 10.23 H new ATOM 0 HZ3 LYS A 115 11.184 3.016 -10.611 1.00 10.23 H new ATOM 1958 N ILE A 116 9.606 0.223 -7.635 1.00 74.30 N ATOM 1959 CA ILE A 116 8.747 1.202 -6.957 1.00 30.33 C ATOM 1960 C ILE A 116 8.807 1.018 -5.423 1.00 74.31 C ATOM 1961 O ILE A 116 8.845 2.002 -4.690 1.00 31.35 O ATOM 1962 CB ILE A 116 7.258 1.103 -7.458 1.00 64.41 C ATOM 1963 CG1 ILE A 116 7.146 1.383 -8.989 1.00 64.22 C ATOM 1964 CG2 ILE A 116 6.332 2.042 -6.673 1.00 54.22 C ATOM 1965 CD1 ILE A 116 7.649 2.730 -9.460 1.00 71.44 C ATOM 0 H ILE A 116 9.089 -0.460 -8.188 1.00 74.30 H new ATOM 0 HA ILE A 116 9.124 2.194 -7.205 1.00 30.33 H new ATOM 0 HB ILE A 116 6.933 0.078 -7.276 1.00 64.41 H new ATOM 0 HG12 ILE A 116 7.696 0.607 -9.520 1.00 64.22 H new ATOM 0 HG13 ILE A 116 6.100 1.287 -9.279 1.00 64.22 H new ATOM 0 HG21 ILE A 116 5.313 1.945 -7.048 1.00 54.22 H new ATOM 0 HG22 ILE A 116 6.357 1.777 -5.616 1.00 54.22 H new ATOM 0 HG23 ILE A 116 6.668 3.072 -6.797 1.00 54.22 H new ATOM 0 HD11 ILE A 116 7.520 2.810 -10.539 1.00 71.44 H new ATOM 0 HD12 ILE A 116 7.084 3.522 -8.968 1.00 71.44 H new ATOM 0 HD13 ILE A 116 8.706 2.831 -9.213 1.00 71.44 H new ATOM 1977 N VAL A 117 8.828 -0.254 -4.960 1.00 2.42 N ATOM 1978 CA VAL A 117 8.952 -0.589 -3.518 1.00 55.35 C ATOM 1979 C VAL A 117 10.307 -0.082 -2.964 1.00 72.10 C ATOM 1980 O VAL A 117 10.369 0.461 -1.857 1.00 21.25 O ATOM 1981 CB VAL A 117 8.804 -2.145 -3.266 1.00 40.22 C ATOM 1982 CG1 VAL A 117 9.007 -2.524 -1.775 1.00 2.14 C ATOM 1983 CG2 VAL A 117 7.437 -2.660 -3.775 1.00 63.23 C ATOM 0 H VAL A 117 8.760 -1.071 -5.567 1.00 2.42 H new ATOM 0 HA VAL A 117 8.140 -0.089 -2.990 1.00 55.35 H new ATOM 0 HB VAL A 117 9.596 -2.632 -3.834 1.00 40.22 H new ATOM 0 HG11 VAL A 117 8.895 -3.602 -1.655 1.00 2.14 H new ATOM 0 HG12 VAL A 117 10.006 -2.225 -1.456 1.00 2.14 H new ATOM 0 HG13 VAL A 117 8.263 -2.012 -1.165 1.00 2.14 H new ATOM 0 HG21 VAL A 117 7.360 -3.731 -3.590 1.00 63.23 H new ATOM 0 HG22 VAL A 117 6.635 -2.143 -3.249 1.00 63.23 H new ATOM 0 HG23 VAL A 117 7.352 -2.469 -4.845 1.00 63.23 H new ATOM 1993 N ARG A 118 11.370 -0.228 -3.784 1.00 12.44 N ATOM 1994 CA ARG A 118 12.741 0.231 -3.448 1.00 11.45 C ATOM 1995 C ARG A 118 12.792 1.766 -3.312 1.00 65.30 C ATOM 1996 O ARG A 118 13.451 2.309 -2.416 1.00 43.10 O ATOM 1997 CB ARG A 118 13.740 -0.244 -4.537 1.00 43.20 C ATOM 1998 CG ARG A 118 13.826 -1.777 -4.697 1.00 23.54 C ATOM 1999 CD ARG A 118 14.829 -2.207 -5.781 1.00 34.31 C ATOM 2000 NE ARG A 118 16.198 -1.751 -5.477 1.00 65.42 N ATOM 2001 CZ ARG A 118 17.333 -2.413 -5.765 1.00 44.45 C ATOM 2002 NH1 ARG A 118 17.312 -3.587 -6.402 1.00 3.42 N ATOM 2003 NH2 ARG A 118 18.496 -1.883 -5.409 1.00 61.20 N ATOM 0 H ARG A 118 11.304 -0.669 -4.702 1.00 12.44 H new ATOM 0 HA ARG A 118 13.023 -0.203 -2.489 1.00 11.45 H new ATOM 0 HB2 ARG A 118 13.452 0.193 -5.493 1.00 43.20 H new ATOM 0 HB3 ARG A 118 14.731 0.140 -4.296 1.00 43.20 H new ATOM 0 HG2 ARG A 118 14.114 -2.222 -3.745 1.00 23.54 H new ATOM 0 HG3 ARG A 118 12.839 -2.168 -4.946 1.00 23.54 H new ATOM 0 HD2 ARG A 118 14.820 -3.293 -5.873 1.00 34.31 H new ATOM 0 HD3 ARG A 118 14.518 -1.803 -6.744 1.00 34.31 H new ATOM 0 HE ARG A 118 16.293 -0.852 -5.005 1.00 65.42 H new ATOM 0 HH11 ARG A 118 16.422 -4.000 -6.681 1.00 3.42 H new ATOM 0 HH12 ARG A 118 18.186 -4.070 -6.609 1.00 3.42 H new ATOM 0 HH21 ARG A 118 18.521 -0.986 -4.924 1.00 61.20 H new ATOM 0 HH22 ARG A 118 19.366 -2.373 -5.620 1.00 61.20 H new ATOM 2017 N GLU A 119 12.069 2.448 -4.213 1.00 75.10 N ATOM 2018 CA GLU A 119 11.950 3.915 -4.221 1.00 33.13 C ATOM 2019 C GLU A 119 11.086 4.406 -3.044 1.00 73.24 C ATOM 2020 O GLU A 119 11.349 5.469 -2.478 1.00 24.32 O ATOM 2021 CB GLU A 119 11.353 4.375 -5.568 1.00 42.13 C ATOM 2022 CG GLU A 119 12.286 4.152 -6.775 1.00 73.35 C ATOM 2023 CD GLU A 119 11.584 4.333 -8.131 1.00 20.40 C ATOM 2024 OE1 GLU A 119 11.074 5.437 -8.398 1.00 4.03 O ATOM 2025 OE2 GLU A 119 11.543 3.372 -8.932 1.00 23.14 O ATOM 0 H GLU A 119 11.546 1.994 -4.962 1.00 75.10 H new ATOM 0 HA GLU A 119 12.942 4.350 -4.103 1.00 33.13 H new ATOM 0 HB2 GLU A 119 10.418 3.842 -5.741 1.00 42.13 H new ATOM 0 HB3 GLU A 119 11.108 5.435 -5.502 1.00 42.13 H new ATOM 0 HG2 GLU A 119 13.123 4.848 -6.712 1.00 73.35 H new ATOM 0 HG3 GLU A 119 12.703 3.146 -6.722 1.00 73.35 H new ATOM 2032 N PHE A 120 10.053 3.614 -2.696 1.00 34.15 N ATOM 2033 CA PHE A 120 9.174 3.868 -1.536 1.00 51.14 C ATOM 2034 C PHE A 120 9.973 3.848 -0.221 1.00 23.32 C ATOM 2035 O PHE A 120 9.604 4.533 0.732 1.00 11.35 O ATOM 2036 CB PHE A 120 8.000 2.836 -1.474 1.00 64.12 C ATOM 2037 CG PHE A 120 6.824 3.081 -2.431 1.00 1.34 C ATOM 2038 CD1 PHE A 120 6.706 4.258 -3.182 1.00 63.24 C ATOM 2039 CD2 PHE A 120 5.804 2.130 -2.540 1.00 60.54 C ATOM 2040 CE1 PHE A 120 5.611 4.467 -4.007 1.00 75.43 C ATOM 2041 CE2 PHE A 120 4.711 2.348 -3.357 1.00 25.22 C ATOM 2042 CZ PHE A 120 4.614 3.515 -4.089 1.00 4.42 C ATOM 0 H PHE A 120 9.803 2.773 -3.216 1.00 34.15 H new ATOM 0 HA PHE A 120 8.746 4.862 -1.664 1.00 51.14 H new ATOM 0 HB2 PHE A 120 8.405 1.845 -1.678 1.00 64.12 H new ATOM 0 HB3 PHE A 120 7.613 2.819 -0.455 1.00 64.12 H new ATOM 0 HD1 PHE A 120 7.477 5.012 -3.118 1.00 63.24 H new ATOM 0 HD2 PHE A 120 5.872 1.211 -1.977 1.00 60.54 H new ATOM 0 HE1 PHE A 120 5.538 5.376 -4.586 1.00 75.43 H new ATOM 0 HE2 PHE A 120 3.931 1.604 -3.423 1.00 25.22 H new ATOM 0 HZ PHE A 120 3.758 3.683 -4.726 1.00 4.42 H new ATOM 2052 N MET A 121 11.076 3.072 -0.199 1.00 73.22 N ATOM 2053 CA MET A 121 11.991 3.000 0.961 1.00 62.32 C ATOM 2054 C MET A 121 12.798 4.301 1.106 1.00 24.35 C ATOM 2055 O MET A 121 13.117 4.709 2.220 1.00 65.54 O ATOM 2056 CB MET A 121 12.969 1.803 0.839 1.00 31.40 C ATOM 2057 CG MET A 121 12.281 0.449 0.720 1.00 74.12 C ATOM 2058 SD MET A 121 11.225 0.085 2.131 1.00 72.13 S ATOM 2059 CE MET A 121 10.515 -1.475 1.624 1.00 34.34 C ATOM 0 H MET A 121 11.357 2.480 -0.980 1.00 73.22 H new ATOM 0 HA MET A 121 11.372 2.859 1.847 1.00 62.32 H new ATOM 0 HB2 MET A 121 13.604 1.954 -0.034 1.00 31.40 H new ATOM 0 HB3 MET A 121 13.623 1.791 1.711 1.00 31.40 H new ATOM 0 HG2 MET A 121 11.684 0.428 -0.192 1.00 74.12 H new ATOM 0 HG3 MET A 121 13.036 -0.331 0.625 1.00 74.12 H new ATOM 0 HE1 MET A 121 10.442 -2.139 2.486 1.00 34.34 H new ATOM 0 HE2 MET A 121 9.520 -1.305 1.212 1.00 34.34 H new ATOM 0 HE3 MET A 121 11.149 -1.934 0.865 1.00 34.34 H new ATOM 2069 N GLN A 122 13.121 4.942 -0.036 1.00 4.04 N ATOM 2070 CA GLN A 122 13.909 6.195 -0.056 1.00 5.23 C ATOM 2071 C GLN A 122 13.021 7.362 0.406 1.00 72.30 C ATOM 2072 O GLN A 122 13.434 8.204 1.211 1.00 22.53 O ATOM 2073 CB GLN A 122 14.469 6.477 -1.479 1.00 61.21 C ATOM 2074 CG GLN A 122 15.300 5.334 -2.083 1.00 4.31 C ATOM 2075 CD GLN A 122 15.855 5.677 -3.467 1.00 12.45 C ATOM 2076 OE1 GLN A 122 15.197 5.454 -4.485 1.00 72.31 O ATOM 2077 NE2 GLN A 122 17.059 6.228 -3.514 1.00 2.32 N ATOM 0 H GLN A 122 12.847 4.612 -0.961 1.00 4.04 H new ATOM 0 HA GLN A 122 14.755 6.089 0.623 1.00 5.23 H new ATOM 0 HB2 GLN A 122 13.635 6.693 -2.146 1.00 61.21 H new ATOM 0 HB3 GLN A 122 15.086 7.375 -1.440 1.00 61.21 H new ATOM 0 HG2 GLN A 122 16.126 5.097 -1.413 1.00 4.31 H new ATOM 0 HG3 GLN A 122 14.682 4.439 -2.155 1.00 4.31 H new ATOM 0 HE21 GLN A 122 17.576 6.398 -2.651 1.00 2.32 H new ATOM 0 HE22 GLN A 122 17.469 6.482 -4.413 1.00 2.32 H new ATOM 2086 N LYS A 123 11.779 7.351 -0.104 1.00 12.25 N ATOM 2087 CA LYS A 123 10.734 8.330 0.229 1.00 10.05 C ATOM 2088 C LYS A 123 10.337 8.219 1.719 1.00 64.13 C ATOM 2089 O LYS A 123 10.135 9.230 2.394 1.00 70.22 O ATOM 2090 CB LYS A 123 9.503 8.076 -0.677 1.00 61.40 C ATOM 2091 CG LYS A 123 9.759 8.254 -2.197 1.00 20.11 C ATOM 2092 CD LYS A 123 8.576 7.732 -3.046 1.00 2.53 C ATOM 2093 CE LYS A 123 8.736 8.012 -4.552 1.00 53.04 C ATOM 2094 NZ LYS A 123 9.880 7.276 -5.155 1.00 42.00 N ATOM 0 H LYS A 123 11.468 6.647 -0.773 1.00 12.25 H new ATOM 0 HA LYS A 123 11.114 9.337 0.059 1.00 10.05 H new ATOM 0 HB2 LYS A 123 9.144 7.062 -0.501 1.00 61.40 H new ATOM 0 HB3 LYS A 123 8.704 8.754 -0.377 1.00 61.40 H new ATOM 0 HG2 LYS A 123 9.926 9.309 -2.416 1.00 20.11 H new ATOM 0 HG3 LYS A 123 10.669 7.723 -2.477 1.00 20.11 H new ATOM 0 HD2 LYS A 123 8.474 6.658 -2.892 1.00 2.53 H new ATOM 0 HD3 LYS A 123 7.654 8.194 -2.694 1.00 2.53 H new ATOM 0 HE2 LYS A 123 7.817 7.734 -5.069 1.00 53.04 H new ATOM 0 HE3 LYS A 123 8.876 9.082 -4.705 1.00 53.04 H new ATOM 0 HZ1 LYS A 123 10.497 7.945 -5.659 1.00 42.00 H new ATOM 0 HZ2 LYS A 123 10.423 6.803 -4.405 1.00 42.00 H new ATOM 0 HZ3 LYS A 123 9.521 6.565 -5.824 1.00 42.00 H new ATOM 2108 N ALA A 124 10.250 6.970 2.211 1.00 13.24 N ATOM 2109 CA ALA A 124 9.937 6.665 3.621 1.00 42.45 C ATOM 2110 C ALA A 124 11.105 7.080 4.533 1.00 51.42 C ATOM 2111 O ALA A 124 10.898 7.589 5.640 1.00 13.11 O ATOM 2112 CB ALA A 124 9.647 5.165 3.786 1.00 13.32 C ATOM 0 H ALA A 124 10.396 6.138 1.639 1.00 13.24 H new ATOM 0 HA ALA A 124 9.051 7.231 3.910 1.00 42.45 H new ATOM 0 HB1 ALA A 124 9.417 4.951 4.830 1.00 13.32 H new ATOM 0 HB2 ALA A 124 8.796 4.888 3.163 1.00 13.32 H new ATOM 0 HB3 ALA A 124 10.521 4.590 3.482 1.00 13.32 H new ATOM 2118 N GLY A 125 12.340 6.870 4.026 1.00 35.32 N ATOM 2119 CA GLY A 125 13.564 7.254 4.738 1.00 44.13 C ATOM 2120 C GLY A 125 13.735 8.762 4.854 1.00 44.03 C ATOM 2121 O GLY A 125 14.378 9.250 5.791 1.00 43.41 O ATOM 0 H GLY A 125 12.508 6.433 3.120 1.00 35.32 H new ATOM 0 HA2 GLY A 125 13.549 6.817 5.737 1.00 44.13 H new ATOM 0 HA3 GLY A 125 14.426 6.835 4.220 1.00 44.13 H new ATOM 2125 N SER A 126 13.123 9.496 3.899 1.00 22.21 N ATOM 2126 CA SER A 126 13.104 10.970 3.891 1.00 41.33 C ATOM 2127 C SER A 126 12.318 11.521 5.103 1.00 30.20 C ATOM 2128 O SER A 126 12.665 12.562 5.667 1.00 63.13 O ATOM 2129 CB SER A 126 12.492 11.492 2.574 1.00 1.02 C ATOM 2130 OG SER A 126 13.219 11.035 1.435 1.00 54.32 O ATOM 0 H SER A 126 12.628 9.079 3.111 1.00 22.21 H new ATOM 0 HA SER A 126 14.133 11.322 3.965 1.00 41.33 H new ATOM 0 HB2 SER A 126 11.455 11.163 2.499 1.00 1.02 H new ATOM 0 HB3 SER A 126 12.481 12.582 2.585 1.00 1.02 H new ATOM 0 HG SER A 126 13.233 10.055 1.427 1.00 54.32 H new ATOM 2136 N LEU A 127 11.287 10.769 5.512 1.00 70.51 N ATOM 2137 CA LEU A 127 10.331 11.170 6.564 1.00 23.52 C ATOM 2138 C LEU A 127 10.947 11.066 7.968 1.00 43.41 C ATOM 2139 O LEU A 127 10.709 11.923 8.827 1.00 2.43 O ATOM 2140 CB LEU A 127 9.078 10.260 6.467 1.00 13.02 C ATOM 2141 CG LEU A 127 8.427 10.192 5.056 1.00 62.32 C ATOM 2142 CD1 LEU A 127 7.338 9.107 4.992 1.00 20.12 C ATOM 2143 CD2 LEU A 127 7.902 11.575 4.617 1.00 12.40 C ATOM 0 H LEU A 127 11.087 9.850 5.118 1.00 70.51 H new ATOM 0 HA LEU A 127 10.060 12.214 6.407 1.00 23.52 H new ATOM 0 HB2 LEU A 127 9.355 9.251 6.773 1.00 13.02 H new ATOM 0 HB3 LEU A 127 8.333 10.615 7.179 1.00 13.02 H new ATOM 0 HG LEU A 127 9.199 9.904 4.343 1.00 62.32 H new ATOM 0 HD11 LEU A 127 6.904 9.086 3.993 1.00 20.12 H new ATOM 0 HD12 LEU A 127 7.779 8.136 5.217 1.00 20.12 H new ATOM 0 HD13 LEU A 127 6.559 9.330 5.722 1.00 20.12 H new ATOM 0 HD21 LEU A 127 7.452 11.496 3.627 1.00 12.40 H new ATOM 0 HD22 LEU A 127 7.153 11.923 5.329 1.00 12.40 H new ATOM 0 HD23 LEU A 127 8.729 12.285 4.584 1.00 12.40 H new ATOM 2155 N GLU A 128 11.748 10.009 8.168 1.00 4.31 N ATOM 2156 CA GLU A 128 12.273 9.622 9.486 1.00 12.24 C ATOM 2157 C GLU A 128 13.329 10.622 10.013 1.00 72.24 C ATOM 2158 O GLU A 128 13.024 11.457 10.873 1.00 1.23 O ATOM 2159 CB GLU A 128 12.848 8.181 9.420 1.00 22.45 C ATOM 2160 CG GLU A 128 11.811 7.104 9.066 1.00 33.43 C ATOM 2161 CD GLU A 128 12.392 5.686 9.083 1.00 10.30 C ATOM 2162 OE1 GLU A 128 12.491 5.082 10.176 1.00 35.32 O ATOM 2163 OE2 GLU A 128 12.777 5.172 8.007 1.00 51.50 O ATOM 0 H GLU A 128 12.052 9.394 7.413 1.00 4.31 H new ATOM 0 HA GLU A 128 11.446 9.644 10.196 1.00 12.24 H new ATOM 0 HB2 GLU A 128 13.649 8.155 8.681 1.00 22.45 H new ATOM 0 HB3 GLU A 128 13.295 7.936 10.383 1.00 22.45 H new ATOM 0 HG2 GLU A 128 10.982 7.160 9.771 1.00 33.43 H new ATOM 0 HG3 GLU A 128 11.402 7.312 8.077 1.00 33.43 H new ATOM 2170 N HIS A 129 14.549 10.566 9.452 1.00 15.24 N ATOM 2171 CA HIS A 129 15.724 11.280 10.010 1.00 1.23 C ATOM 2172 C HIS A 129 16.756 11.551 8.888 1.00 52.31 C ATOM 2173 O HIS A 129 17.967 11.595 9.131 1.00 32.40 O ATOM 2174 CB HIS A 129 16.331 10.416 11.168 1.00 54.14 C ATOM 2175 CG HIS A 129 17.217 11.153 12.150 1.00 53.14 C ATOM 2176 ND1 HIS A 129 16.756 11.606 13.361 1.00 33.40 N ATOM 2177 CD2 HIS A 129 18.541 11.463 12.129 1.00 13.20 C ATOM 2178 CE1 HIS A 129 17.738 12.152 14.035 1.00 13.32 C ATOM 2179 NE2 HIS A 129 18.833 12.082 13.316 1.00 64.14 N ATOM 0 H HIS A 129 14.754 10.032 8.607 1.00 15.24 H new ATOM 0 HA HIS A 129 15.429 12.247 10.418 1.00 1.23 H new ATOM 0 HB2 HIS A 129 15.511 9.958 11.721 1.00 54.14 H new ATOM 0 HB3 HIS A 129 16.909 9.605 10.725 1.00 54.14 H new ATOM 0 HD2 HIS A 129 19.234 11.259 11.326 1.00 13.20 H new ATOM 0 HE1 HIS A 129 17.659 12.588 15.020 1.00 13.32 H new ATOM 0 HE2 HIS A 129 19.750 12.431 13.595 1.00 64.14 H new ATOM 2188 N HIS A 130 16.250 11.774 7.657 1.00 23.24 N ATOM 2189 CA HIS A 130 17.083 12.052 6.462 1.00 32.02 C ATOM 2190 C HIS A 130 17.898 13.352 6.624 1.00 53.42 C ATOM 2191 O HIS A 130 18.949 13.518 5.989 1.00 23.13 O ATOM 2192 CB HIS A 130 16.190 12.131 5.207 1.00 33.13 C ATOM 2193 CG HIS A 130 16.930 12.305 3.901 1.00 75.52 C ATOM 2194 ND1 HIS A 130 16.724 13.372 3.050 1.00 32.21 N ATOM 2195 CD2 HIS A 130 17.868 11.533 3.300 1.00 15.22 C ATOM 2196 CE1 HIS A 130 17.497 13.245 1.991 1.00 64.15 C ATOM 2197 NE2 HIS A 130 18.200 12.144 2.121 1.00 25.23 N ATOM 0 H HIS A 130 15.249 11.767 7.460 1.00 23.24 H new ATOM 0 HA HIS A 130 17.793 11.233 6.349 1.00 32.02 H new ATOM 0 HB2 HIS A 130 15.591 11.222 5.149 1.00 33.13 H new ATOM 0 HB3 HIS A 130 15.496 12.963 5.326 1.00 33.13 H new ATOM 0 HD2 HIS A 130 18.277 10.609 3.680 1.00 15.22 H new ATOM 0 HE1 HIS A 130 17.544 13.930 1.158 1.00 64.15 H new ATOM 0 HE2 HIS A 130 18.885 11.798 1.449 1.00 25.23 H new ATOM 2206 N HIS A 131 17.392 14.271 7.466 1.00 62.31 N ATOM 2207 CA HIS A 131 18.137 15.466 7.890 1.00 1.24 C ATOM 2208 C HIS A 131 19.274 15.056 8.855 1.00 20.11 C ATOM 2209 O HIS A 131 19.137 15.157 10.081 1.00 30.22 O ATOM 2210 CB HIS A 131 17.189 16.507 8.555 1.00 35.32 C ATOM 2211 CG HIS A 131 16.231 17.185 7.610 1.00 13.24 C ATOM 2212 ND1 HIS A 131 16.630 18.164 6.731 1.00 32.22 N ATOM 2213 CD2 HIS A 131 14.893 17.047 7.427 1.00 31.45 C ATOM 2214 CE1 HIS A 131 15.590 18.600 6.054 1.00 62.12 C ATOM 2215 NE2 HIS A 131 14.523 17.943 6.456 1.00 10.35 N ATOM 0 H HIS A 131 16.458 14.205 7.870 1.00 62.31 H new ATOM 0 HA HIS A 131 18.575 15.938 7.011 1.00 1.24 H new ATOM 0 HB2 HIS A 131 16.615 16.008 9.336 1.00 35.32 H new ATOM 0 HB3 HIS A 131 17.796 17.269 9.044 1.00 35.32 H new ATOM 0 HD2 HIS A 131 14.242 16.361 7.948 1.00 31.45 H new ATOM 0 HE1 HIS A 131 15.609 19.368 5.295 1.00 62.12 H new ATOM 0 HE2 HIS A 131 13.575 18.078 6.103 1.00 10.35 H new ATOM 2224 N HIS A 132 20.385 14.547 8.291 1.00 4.43 N ATOM 2225 CA HIS A 132 21.541 14.090 9.083 1.00 64.43 C ATOM 2226 C HIS A 132 22.419 15.298 9.478 1.00 31.01 C ATOM 2227 O HIS A 132 23.327 15.701 8.754 1.00 63.30 O ATOM 2228 CB HIS A 132 22.338 12.972 8.342 1.00 14.04 C ATOM 2229 CG HIS A 132 22.851 13.316 6.960 1.00 75.52 C ATOM 2230 ND1 HIS A 132 24.086 13.890 6.744 1.00 53.22 N ATOM 2231 CD2 HIS A 132 22.310 13.138 5.725 1.00 12.12 C ATOM 2232 CE1 HIS A 132 24.279 14.050 5.454 1.00 32.34 C ATOM 2233 NE2 HIS A 132 23.223 13.600 4.810 1.00 42.43 N ATOM 0 H HIS A 132 20.506 14.442 7.284 1.00 4.43 H new ATOM 0 HA HIS A 132 21.182 13.633 10.005 1.00 64.43 H new ATOM 0 HB2 HIS A 132 23.189 12.690 8.962 1.00 14.04 H new ATOM 0 HB3 HIS A 132 21.698 12.093 8.260 1.00 14.04 H new ATOM 0 HD2 HIS A 132 21.342 12.712 5.505 1.00 12.12 H new ATOM 0 HE1 HIS A 132 25.159 14.480 4.998 1.00 32.34 H new ATOM 0 HE2 HIS A 132 23.103 13.595 3.797 1.00 42.43 H new ATOM 2242 N HIS A 133 22.067 15.914 10.616 1.00 41.00 N ATOM 2243 CA HIS A 133 22.813 17.054 11.207 1.00 74.33 C ATOM 2244 C HIS A 133 22.601 17.106 12.740 1.00 64.42 C ATOM 2245 O HIS A 133 23.283 17.857 13.448 1.00 3.51 O ATOM 2246 CB HIS A 133 22.370 18.396 10.552 1.00 52.41 C ATOM 2247 CG HIS A 133 21.017 18.901 10.998 1.00 23.14 C ATOM 2248 ND1 HIS A 133 20.866 20.008 11.806 1.00 22.04 N ATOM 2249 CD2 HIS A 133 19.761 18.443 10.763 1.00 52.13 C ATOM 2250 CE1 HIS A 133 19.590 20.207 12.048 1.00 70.44 C ATOM 2251 NE2 HIS A 133 18.898 19.274 11.427 1.00 33.43 N ATOM 0 H HIS A 133 21.251 15.639 11.163 1.00 41.00 H new ATOM 0 HA HIS A 133 23.875 16.907 11.010 1.00 74.33 H new ATOM 0 HB2 HIS A 133 23.118 19.157 10.774 1.00 52.41 H new ATOM 0 HB3 HIS A 133 22.356 18.269 9.470 1.00 52.41 H new ATOM 0 HD2 HIS A 133 19.493 17.585 10.165 1.00 52.13 H new ATOM 0 HE1 HIS A 133 19.178 21.001 12.653 1.00 70.44 H new ATOM 0 HE2 HIS A 133 17.882 19.185 11.439 1.00 33.43 H new ATOM 2260 N HIS A 134 21.635 16.303 13.210 1.00 34.41 N ATOM 2261 CA HIS A 134 21.186 16.222 14.609 1.00 33.53 C ATOM 2262 C HIS A 134 20.305 14.961 14.712 1.00 3.33 C ATOM 2263 O HIS A 134 19.243 14.937 14.053 1.00 54.03 O ATOM 2264 CB HIS A 134 20.385 17.498 15.027 1.00 72.51 C ATOM 2265 CG HIS A 134 19.741 17.436 16.403 1.00 72.22 C ATOM 2266 ND1 HIS A 134 20.269 18.055 17.515 1.00 24.31 N ATOM 2267 CD2 HIS A 134 18.579 16.863 16.826 1.00 61.44 C ATOM 2268 CE1 HIS A 134 19.470 17.864 18.548 1.00 42.15 C ATOM 2269 NE2 HIS A 134 18.442 17.145 18.158 1.00 52.31 N ATOM 2270 OXT HIS A 134 20.682 13.997 15.404 1.00 38.16 O ATOM 0 H HIS A 134 21.123 15.665 12.600 1.00 34.41 H new ATOM 0 HA HIS A 134 22.039 16.164 15.285 1.00 33.53 H new ATOM 0 HB2 HIS A 134 21.057 18.356 14.996 1.00 72.51 H new ATOM 0 HB3 HIS A 134 19.606 17.677 14.286 1.00 72.51 H new ATOM 0 HD2 HIS A 134 17.892 16.291 16.220 1.00 61.44 H new ATOM 0 HE1 HIS A 134 19.634 18.237 19.548 1.00 42.15 H new ATOM 0 HE2 HIS A 134 17.668 16.846 18.751 1.00 52.31 H new TER 2279 HIS A 134