USER MOD reduce.3.24.130724 H: found=0, std=0, add=1403, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1403 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 85 LYS NZ :NH3+ -177:sc= 2.24 (180deg=0.972) USER MOD Set 1.2: B 74 ASN : amide:sc= 1.46 K(o=3.7,f=-4.3) USER MOD Set 2.1: A 74 ASN : amide:sc= -0.136 K(o=0.23,f=1.5) USER MOD Set 2.2: B 85 LYS NZ :NH3+ -142:sc= 0.367 (180deg=1.15) USER MOD Set 3.1: A 60 MET CE :methyl 180:sc=-0.00796 (180deg=-0.00796) USER MOD Set 3.2: A 69 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 55 SER OG : rot -60:sc= 0.107 USER MOD Set 4.2: A 59 LYS NZ :NH3+ -172:sc= 2.32 (180deg=2.2) USER MOD Set 5.1: A 7 THR OG1 : rot 160:sc= 0.799 USER MOD Set 5.2: B 45 GLN : amide:sc= 0.913 X(o=1.7,f=1.3) USER MOD Single : A 12 SER OG : rot -26:sc= 1.2 USER MOD Single : A 15 THR OG1 : rot 117:sc= 1.25 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 89:sc= 1.07 USER MOD Single : A 22 THR OG1 : rot 47:sc= 1.25 USER MOD Single : A 26 GLN : amide:sc= 0 K(o=0,f=-0.95) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot -90:sc= -0.0118 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= 1.18 K(o=1.2,f=-0.19) USER MOD Single : A 39 LYS NZ :NH3+ 146:sc= 1.25 (180deg=-2.04!) USER MOD Single : A 43 THR OG1 : rot 81:sc= 1.22 USER MOD Single : A 44 GLN : amide:sc= -0.0394 X(o=-0.039,f=-0.00023) USER MOD Single : A 45 GLN : amide:sc= 1.68 K(o=1.7,f=-6!) USER MOD Single : A 48 HIS : no HD1:sc= 0 X(o=0,f=-0.047) USER MOD Single : A 51 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0926) USER MOD Single : A 61 LYS NZ :NH3+ -111:sc= -0.233 (180deg=-1.49) USER MOD Single : A 62 SER OG : rot 70:sc= 1.05 USER MOD Single : A 66 ASN : amide:sc= 0.74 K(o=0.74,f=-1.8) USER MOD Single : A 67 GLN : amide:sc= 0.827 K(o=0.83,f=-0.33) USER MOD Single : A 72 LYS NZ :NH3+ -161:sc= 0.722 (180deg=-0.448) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 171:sc=-0.000887 (180deg=-0.111) USER MOD Single : B 7 THR OG1 : rot 180:sc= 0.397 USER MOD Single : B 12 SER OG : rot -38:sc= 1.23 USER MOD Single : B 15 THR OG1 : rot 180:sc= 0 USER MOD Single : B 18 THR OG1 : rot 180:sc= 0 USER MOD Single : B 19 THR OG1 : rot 96:sc= 0.406 USER MOD Single : B 22 THR OG1 : rot -17:sc= 1.2 USER MOD Single : B 26 GLN : amide:sc= 1.57 K(o=1.6,f=-12!) USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 SER OG : rot 93:sc= 0.914 USER MOD Single : B 34 SER OG : rot 138:sc= 1.22 USER MOD Single : B 36 ASN : amide:sc= 0.37 K(o=0.37,f=-0.42) USER MOD Single : B 39 LYS NZ :NH3+ -144:sc= 0.125 (180deg=-1.17!) USER MOD Single : B 43 THR OG1 : rot 85:sc= 0.494 USER MOD Single : B 44 GLN : amide:sc= -0.0992 X(o=-0.099,f=0) USER MOD Single : B 48 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 51 LYS NZ :NH3+ -137:sc= 0.943 (180deg=-0.172!) USER MOD Single : B 55 SER OG : rot -138:sc= 1.22 USER MOD Single : B 59 LYS NZ :NH3+ 150:sc= 2.9 (180deg=0.702) USER MOD Single : B 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 SER OG : rot 78:sc= 1.18 USER MOD Single : B 66 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 67 GLN : amide:sc= 0.675 K(o=0.67,f=-0.13) USER MOD Single : B 69 SER OG : rot 58:sc= 0.149 USER MOD Single : B 72 LYS NZ :NH3+ 142:sc= 0.0101 (180deg=0) USER MOD Single : B 76 TYR OH : rot 30:sc= 0 USER MOD Single : B 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 40 N GLU A 4 7.681 -15.657 -16.852 1.00 1.67 N ATOM 41 CA GLU A 4 8.200 -16.231 -15.633 1.00 1.53 C ATOM 42 C GLU A 4 7.310 -15.850 -14.438 1.00 1.32 C ATOM 43 O GLU A 4 6.934 -14.685 -14.307 1.00 1.33 O ATOM 44 CB GLU A 4 9.659 -15.775 -15.462 1.00 2.12 C ATOM 45 CG GLU A 4 10.589 -16.280 -16.588 1.00 2.96 C ATOM 46 CD GLU A 4 10.554 -15.452 -17.873 1.00 3.57 C ATOM 47 OE1 GLU A 4 9.598 -15.649 -18.660 1.00 4.25 O ATOM 48 OE2 GLU A 4 11.469 -14.622 -18.040 1.00 4.30 O ATOM 0 HA GLU A 4 8.188 -17.320 -15.684 1.00 1.53 H new ATOM 0 HB2 GLU A 4 9.692 -14.686 -15.433 1.00 2.12 H new ATOM 0 HB3 GLU A 4 10.034 -16.131 -14.502 1.00 2.12 H new ATOM 0 HG2 GLU A 4 11.612 -16.299 -16.213 1.00 2.96 H new ATOM 0 HG3 GLU A 4 10.319 -17.308 -16.828 1.00 2.96 H new ATOM 55 N PRO A 5 6.946 -16.812 -13.573 1.00 1.47 N ATOM 56 CA PRO A 5 6.013 -16.580 -12.484 1.00 1.51 C ATOM 57 C PRO A 5 6.657 -15.722 -11.391 1.00 1.26 C ATOM 58 O PRO A 5 7.504 -16.194 -10.635 1.00 1.51 O ATOM 59 CB PRO A 5 5.619 -17.972 -11.980 1.00 2.03 C ATOM 60 CG PRO A 5 6.837 -18.830 -12.318 1.00 2.21 C ATOM 61 CD PRO A 5 7.339 -18.211 -13.623 1.00 1.91 C ATOM 0 HA PRO A 5 5.132 -16.024 -12.804 1.00 1.51 H new ATOM 0 HB2 PRO A 5 5.415 -17.969 -10.909 1.00 2.03 H new ATOM 0 HB3 PRO A 5 4.720 -18.339 -12.475 1.00 2.03 H new ATOM 0 HG2 PRO A 5 7.592 -18.786 -11.533 1.00 2.21 H new ATOM 0 HG3 PRO A 5 6.570 -19.879 -12.445 1.00 2.21 H new ATOM 0 HD2 PRO A 5 8.421 -18.311 -13.713 1.00 1.91 H new ATOM 0 HD3 PRO A 5 6.900 -18.710 -14.487 1.00 1.91 H new ATOM 69 N LEU A 6 6.234 -14.460 -11.308 1.00 1.04 N ATOM 70 CA LEU A 6 6.602 -13.533 -10.247 1.00 0.99 C ATOM 71 C LEU A 6 6.017 -14.006 -8.906 1.00 0.96 C ATOM 72 O LEU A 6 5.109 -14.839 -8.886 1.00 1.01 O ATOM 73 CB LEU A 6 6.074 -12.144 -10.631 1.00 1.05 C ATOM 74 CG LEU A 6 6.662 -11.604 -11.952 1.00 0.97 C ATOM 75 CD1 LEU A 6 5.839 -10.387 -12.392 1.00 1.24 C ATOM 76 CD2 LEU A 6 8.125 -11.181 -11.772 1.00 1.24 C ATOM 0 H LEU A 6 5.608 -14.047 -11.999 1.00 1.04 H new ATOM 0 HA LEU A 6 7.685 -13.490 -10.129 1.00 0.99 H new ATOM 0 HB2 LEU A 6 4.988 -12.188 -10.717 1.00 1.05 H new ATOM 0 HB3 LEU A 6 6.302 -11.443 -9.828 1.00 1.05 H new ATOM 0 HG LEU A 6 6.622 -12.392 -12.704 1.00 0.97 H new ATOM 0 HD11 LEU A 6 6.242 -9.993 -13.325 1.00 1.24 H new ATOM 0 HD12 LEU A 6 4.801 -10.685 -12.542 1.00 1.24 H new ATOM 0 HD13 LEU A 6 5.888 -9.617 -11.622 1.00 1.24 H new ATOM 0 HD21 LEU A 6 8.514 -10.805 -12.718 1.00 1.24 H new ATOM 0 HD22 LEU A 6 8.187 -10.397 -11.017 1.00 1.24 H new ATOM 0 HD23 LEU A 6 8.715 -12.040 -11.453 1.00 1.24 H new ATOM 88 N THR A 7 6.525 -13.497 -7.778 1.00 0.97 N ATOM 89 CA THR A 7 6.040 -13.911 -6.464 1.00 1.00 C ATOM 90 C THR A 7 4.696 -13.252 -6.176 1.00 0.91 C ATOM 91 O THR A 7 4.289 -12.337 -6.884 1.00 1.06 O ATOM 92 CB THR A 7 7.070 -13.654 -5.349 1.00 1.07 C ATOM 93 OG1 THR A 7 6.793 -14.521 -4.263 1.00 1.72 O ATOM 94 CG2 THR A 7 7.077 -12.236 -4.771 1.00 0.88 C ATOM 0 H THR A 7 7.269 -12.800 -7.752 1.00 0.97 H new ATOM 0 HA THR A 7 5.894 -14.991 -6.481 1.00 1.00 H new ATOM 0 HB THR A 7 8.038 -13.820 -5.821 1.00 1.07 H new ATOM 0 HG1 THR A 7 7.591 -14.607 -3.701 1.00 1.72 H new ATOM 0 HG21 THR A 7 7.838 -12.163 -3.994 1.00 0.88 H new ATOM 0 HG22 THR A 7 7.298 -11.521 -5.564 1.00 0.88 H new ATOM 0 HG23 THR A 7 6.100 -12.013 -4.343 1.00 0.88 H new ATOM 102 N GLU A 8 4.026 -13.685 -5.107 1.00 0.95 N ATOM 103 CA GLU A 8 2.684 -13.240 -4.767 1.00 0.92 C ATOM 104 C GLU A 8 2.682 -11.723 -4.560 1.00 0.76 C ATOM 105 O GLU A 8 1.888 -10.993 -5.153 1.00 0.78 O ATOM 106 CB GLU A 8 2.229 -14.016 -3.526 1.00 1.12 C ATOM 107 CG GLU A 8 0.734 -13.864 -3.235 1.00 1.32 C ATOM 108 CD GLU A 8 0.305 -14.840 -2.144 1.00 1.53 C ATOM 109 OE1 GLU A 8 1.109 -15.015 -1.202 1.00 2.00 O ATOM 110 OE2 GLU A 8 -0.792 -15.417 -2.291 1.00 1.99 O ATOM 0 H GLU A 8 4.409 -14.363 -4.448 1.00 0.95 H new ATOM 0 HA GLU A 8 1.977 -13.442 -5.572 1.00 0.92 H new ATOM 0 HB2 GLU A 8 2.461 -15.073 -3.661 1.00 1.12 H new ATOM 0 HB3 GLU A 8 2.798 -13.673 -2.662 1.00 1.12 H new ATOM 0 HG2 GLU A 8 0.519 -12.842 -2.923 1.00 1.32 H new ATOM 0 HG3 GLU A 8 0.159 -14.047 -4.143 1.00 1.32 H new ATOM 117 N LEU A 9 3.618 -11.242 -3.741 1.00 0.68 N ATOM 118 CA LEU A 9 3.783 -9.817 -3.519 1.00 0.62 C ATOM 119 C LEU A 9 4.156 -9.080 -4.814 1.00 0.57 C ATOM 120 O LEU A 9 3.437 -8.151 -5.165 1.00 0.53 O ATOM 121 CB LEU A 9 4.700 -9.544 -2.313 1.00 0.63 C ATOM 122 CG LEU A 9 3.829 -9.371 -1.049 1.00 0.84 C ATOM 123 CD1 LEU A 9 4.547 -9.698 0.263 1.00 1.40 C ATOM 124 CD2 LEU A 9 3.353 -7.918 -0.940 1.00 1.56 C ATOM 0 H LEU A 9 4.273 -11.826 -3.221 1.00 0.68 H new ATOM 0 HA LEU A 9 2.822 -9.387 -3.237 1.00 0.62 H new ATOM 0 HB2 LEU A 9 5.400 -10.368 -2.178 1.00 0.63 H new ATOM 0 HB3 LEU A 9 5.294 -8.647 -2.487 1.00 0.63 H new ATOM 0 HG LEU A 9 3.009 -10.078 -1.174 1.00 0.84 H new ATOM 0 HD11 LEU A 9 3.863 -9.550 1.099 1.00 1.40 H new ATOM 0 HD12 LEU A 9 4.880 -10.736 0.246 1.00 1.40 H new ATOM 0 HD13 LEU A 9 5.409 -9.042 0.379 1.00 1.40 H new ATOM 0 HD21 LEU A 9 2.739 -7.802 -0.047 1.00 1.56 H new ATOM 0 HD22 LEU A 9 4.217 -7.256 -0.875 1.00 1.56 H new ATOM 0 HD23 LEU A 9 2.764 -7.661 -1.821 1.00 1.56 H new ATOM 136 N GLU A 10 5.207 -9.496 -5.538 1.00 0.60 N ATOM 137 CA GLU A 10 5.639 -8.912 -6.817 1.00 0.60 C ATOM 138 C GLU A 10 4.450 -8.730 -7.759 1.00 0.61 C ATOM 139 O GLU A 10 4.173 -7.634 -8.237 1.00 0.63 O ATOM 140 CB GLU A 10 6.691 -9.802 -7.502 1.00 0.64 C ATOM 141 CG GLU A 10 8.105 -9.579 -6.944 1.00 1.05 C ATOM 142 CD GLU A 10 9.118 -10.681 -7.256 1.00 1.20 C ATOM 143 OE1 GLU A 10 8.658 -11.763 -7.693 1.00 2.11 O ATOM 144 OE2 GLU A 10 10.327 -10.425 -7.021 1.00 2.28 O ATOM 0 H GLU A 10 5.798 -10.272 -5.240 1.00 0.60 H new ATOM 0 HA GLU A 10 6.080 -7.939 -6.599 1.00 0.60 H new ATOM 0 HB2 GLU A 10 6.415 -10.849 -7.375 1.00 0.64 H new ATOM 0 HB3 GLU A 10 6.691 -9.600 -8.573 1.00 0.64 H new ATOM 0 HG2 GLU A 10 8.487 -8.637 -7.337 1.00 1.05 H new ATOM 0 HG3 GLU A 10 8.036 -9.469 -5.862 1.00 1.05 H new ATOM 151 N GLU A 11 3.749 -9.831 -7.999 1.00 0.63 N ATOM 152 CA GLU A 11 2.514 -9.892 -8.750 1.00 0.61 C ATOM 153 C GLU A 11 1.540 -8.828 -8.227 1.00 0.58 C ATOM 154 O GLU A 11 1.182 -7.901 -8.952 1.00 0.67 O ATOM 155 CB GLU A 11 2.034 -11.346 -8.628 1.00 0.70 C ATOM 156 CG GLU A 11 0.623 -11.678 -9.090 1.00 1.75 C ATOM 157 CD GLU A 11 0.237 -11.000 -10.395 1.00 2.48 C ATOM 158 OE1 GLU A 11 0.536 -11.590 -11.453 1.00 2.26 O ATOM 159 OE2 GLU A 11 -0.348 -9.899 -10.295 1.00 3.94 O ATOM 0 H GLU A 11 4.045 -10.745 -7.657 1.00 0.63 H new ATOM 0 HA GLU A 11 2.619 -9.654 -9.809 1.00 0.61 H new ATOM 0 HB2 GLU A 11 2.725 -11.973 -9.191 1.00 0.70 H new ATOM 0 HB3 GLU A 11 2.119 -11.638 -7.581 1.00 0.70 H new ATOM 0 HG2 GLU A 11 0.533 -12.758 -9.210 1.00 1.75 H new ATOM 0 HG3 GLU A 11 -0.084 -11.384 -8.314 1.00 1.75 H new ATOM 166 N SER A 12 1.165 -8.895 -6.946 1.00 0.56 N ATOM 167 CA SER A 12 0.169 -7.979 -6.399 1.00 0.58 C ATOM 168 C SER A 12 0.572 -6.506 -6.579 1.00 0.55 C ATOM 169 O SER A 12 -0.270 -5.670 -6.912 1.00 0.64 O ATOM 170 CB SER A 12 -0.152 -8.323 -4.940 1.00 0.65 C ATOM 171 OG SER A 12 0.915 -7.976 -4.087 1.00 1.66 O ATOM 0 H SER A 12 1.535 -9.569 -6.276 1.00 0.56 H new ATOM 0 HA SER A 12 -0.748 -8.111 -6.973 1.00 0.58 H new ATOM 0 HB2 SER A 12 -1.055 -7.797 -4.630 1.00 0.65 H new ATOM 0 HB3 SER A 12 -0.359 -9.390 -4.852 1.00 0.65 H new ATOM 0 HG SER A 12 1.754 -7.982 -4.594 1.00 1.66 H new ATOM 177 N ILE A 13 1.855 -6.176 -6.381 1.00 0.48 N ATOM 178 CA ILE A 13 2.319 -4.811 -6.575 1.00 0.48 C ATOM 179 C ILE A 13 2.294 -4.451 -8.055 1.00 0.48 C ATOM 180 O ILE A 13 1.820 -3.370 -8.398 1.00 0.50 O ATOM 181 CB ILE A 13 3.613 -4.447 -5.814 1.00 0.51 C ATOM 182 CG1 ILE A 13 4.818 -5.372 -6.019 1.00 0.53 C ATOM 183 CG2 ILE A 13 3.268 -4.417 -4.316 1.00 0.56 C ATOM 184 CD1 ILE A 13 5.705 -4.978 -7.192 1.00 0.58 C ATOM 0 H ILE A 13 2.578 -6.834 -6.090 1.00 0.48 H new ATOM 0 HA ILE A 13 1.606 -4.149 -6.084 1.00 0.48 H new ATOM 0 HB ILE A 13 3.936 -3.489 -6.221 1.00 0.51 H new ATOM 0 HG12 ILE A 13 5.418 -5.379 -5.109 1.00 0.53 H new ATOM 0 HG13 ILE A 13 4.460 -6.390 -6.172 1.00 0.53 H new ATOM 0 HG21 ILE A 13 4.159 -4.163 -3.742 1.00 0.56 H new ATOM 0 HG22 ILE A 13 2.495 -3.670 -4.136 1.00 0.56 H new ATOM 0 HG23 ILE A 13 2.905 -5.397 -4.007 1.00 0.56 H new ATOM 0 HD11 ILE A 13 6.535 -5.680 -7.272 1.00 0.58 H new ATOM 0 HD12 ILE A 13 5.122 -4.999 -8.113 1.00 0.58 H new ATOM 0 HD13 ILE A 13 6.094 -3.972 -7.032 1.00 0.58 H new ATOM 196 N GLU A 14 2.720 -5.349 -8.947 1.00 0.49 N ATOM 197 CA GLU A 14 2.656 -5.077 -10.373 1.00 0.51 C ATOM 198 C GLU A 14 1.206 -4.799 -10.784 1.00 0.51 C ATOM 199 O GLU A 14 0.935 -3.789 -11.424 1.00 0.52 O ATOM 200 CB GLU A 14 3.317 -6.187 -11.199 1.00 0.56 C ATOM 201 CG GLU A 14 3.676 -5.625 -12.583 1.00 0.56 C ATOM 202 CD GLU A 14 4.383 -6.650 -13.457 1.00 1.95 C ATOM 203 OE1 GLU A 14 5.482 -7.077 -13.044 1.00 3.47 O ATOM 204 OE2 GLU A 14 3.827 -6.961 -14.532 1.00 2.51 O ATOM 0 H GLU A 14 3.108 -6.260 -8.704 1.00 0.49 H new ATOM 0 HA GLU A 14 3.236 -4.179 -10.588 1.00 0.51 H new ATOM 0 HB2 GLU A 14 4.213 -6.550 -10.695 1.00 0.56 H new ATOM 0 HB3 GLU A 14 2.641 -7.036 -11.300 1.00 0.56 H new ATOM 0 HG2 GLU A 14 2.768 -5.289 -13.083 1.00 0.56 H new ATOM 0 HG3 GLU A 14 4.315 -4.750 -12.463 1.00 0.56 H new ATOM 211 N THR A 15 0.267 -5.645 -10.353 1.00 0.54 N ATOM 212 CA THR A 15 -1.172 -5.484 -10.540 1.00 0.64 C ATOM 213 C THR A 15 -1.660 -4.056 -10.215 1.00 0.63 C ATOM 214 O THR A 15 -2.425 -3.462 -10.981 1.00 0.69 O ATOM 215 CB THR A 15 -1.897 -6.588 -9.744 1.00 0.96 C ATOM 216 OG1 THR A 15 -1.872 -7.787 -10.490 1.00 1.84 O ATOM 217 CG2 THR A 15 -3.366 -6.268 -9.455 1.00 1.01 C ATOM 0 H THR A 15 0.502 -6.496 -9.843 1.00 0.54 H new ATOM 0 HA THR A 15 -1.418 -5.606 -11.595 1.00 0.64 H new ATOM 0 HB THR A 15 -1.372 -6.673 -8.792 1.00 0.96 H new ATOM 0 HG1 THR A 15 -1.370 -8.469 -9.997 1.00 1.84 H new ATOM 0 HG21 THR A 15 -3.813 -7.088 -8.892 1.00 1.01 H new ATOM 0 HG22 THR A 15 -3.430 -5.350 -8.871 1.00 1.01 H new ATOM 0 HG23 THR A 15 -3.902 -6.139 -10.395 1.00 1.01 H new ATOM 225 N VAL A 16 -1.230 -3.465 -9.098 1.00 0.62 N ATOM 226 CA VAL A 16 -1.634 -2.094 -8.777 1.00 0.62 C ATOM 227 C VAL A 16 -0.799 -1.079 -9.560 1.00 0.58 C ATOM 228 O VAL A 16 -1.331 -0.055 -9.979 1.00 0.63 O ATOM 229 CB VAL A 16 -1.693 -1.800 -7.268 1.00 0.67 C ATOM 230 CG1 VAL A 16 -2.692 -2.735 -6.577 1.00 0.73 C ATOM 231 CG2 VAL A 16 -0.341 -1.896 -6.567 1.00 0.62 C ATOM 0 H VAL A 16 -0.615 -3.903 -8.413 1.00 0.62 H new ATOM 0 HA VAL A 16 -2.667 -1.987 -9.107 1.00 0.62 H new ATOM 0 HB VAL A 16 -2.020 -0.764 -7.183 1.00 0.67 H new ATOM 0 HG11 VAL A 16 -2.721 -2.513 -5.510 1.00 0.73 H new ATOM 0 HG12 VAL A 16 -3.684 -2.588 -7.005 1.00 0.73 H new ATOM 0 HG13 VAL A 16 -2.383 -3.770 -6.724 1.00 0.73 H new ATOM 0 HG21 VAL A 16 -0.464 -1.676 -5.507 1.00 0.62 H new ATOM 0 HG22 VAL A 16 0.059 -2.903 -6.684 1.00 0.62 H new ATOM 0 HG23 VAL A 16 0.350 -1.178 -7.009 1.00 0.62 H new ATOM 241 N VAL A 17 0.490 -1.347 -9.790 1.00 0.52 N ATOM 242 CA VAL A 17 1.360 -0.482 -10.578 1.00 0.50 C ATOM 243 C VAL A 17 0.799 -0.305 -11.991 1.00 0.48 C ATOM 244 O VAL A 17 0.770 0.813 -12.493 1.00 0.52 O ATOM 245 CB VAL A 17 2.806 -1.010 -10.575 1.00 0.50 C ATOM 246 CG1 VAL A 17 3.689 -0.300 -11.611 1.00 0.52 C ATOM 247 CG2 VAL A 17 3.440 -0.807 -9.190 1.00 0.57 C ATOM 0 H VAL A 17 0.959 -2.178 -9.430 1.00 0.52 H new ATOM 0 HA VAL A 17 1.389 0.506 -10.119 1.00 0.50 H new ATOM 0 HB VAL A 17 2.751 -2.069 -10.829 1.00 0.50 H new ATOM 0 HG11 VAL A 17 4.699 -0.708 -11.569 1.00 0.52 H new ATOM 0 HG12 VAL A 17 3.276 -0.454 -12.608 1.00 0.52 H new ATOM 0 HG13 VAL A 17 3.720 0.767 -11.392 1.00 0.52 H new ATOM 0 HG21 VAL A 17 4.463 -1.184 -9.199 1.00 0.57 H new ATOM 0 HG22 VAL A 17 3.447 0.255 -8.945 1.00 0.57 H new ATOM 0 HG23 VAL A 17 2.861 -1.348 -8.442 1.00 0.57 H new ATOM 257 N THR A 18 0.337 -1.373 -12.642 1.00 0.47 N ATOM 258 CA THR A 18 -0.251 -1.267 -13.970 1.00 0.50 C ATOM 259 C THR A 18 -1.517 -0.405 -13.917 1.00 0.51 C ATOM 260 O THR A 18 -1.667 0.507 -14.730 1.00 0.51 O ATOM 261 CB THR A 18 -0.441 -2.650 -14.622 1.00 0.56 C ATOM 262 OG1 THR A 18 -0.902 -2.505 -15.951 1.00 0.62 O ATOM 263 CG2 THR A 18 -1.379 -3.590 -13.864 1.00 0.59 C ATOM 0 H THR A 18 0.360 -2.321 -12.267 1.00 0.47 H new ATOM 0 HA THR A 18 0.441 -0.749 -14.634 1.00 0.50 H new ATOM 0 HB THR A 18 0.544 -3.115 -14.597 1.00 0.56 H new ATOM 0 HG1 THR A 18 -1.018 -3.390 -16.356 1.00 0.62 H new ATOM 0 HG21 THR A 18 -1.452 -4.538 -14.396 1.00 0.59 H new ATOM 0 HG22 THR A 18 -0.987 -3.765 -12.862 1.00 0.59 H new ATOM 0 HG23 THR A 18 -2.368 -3.137 -13.792 1.00 0.59 H new ATOM 271 N THR A 19 -2.406 -0.643 -12.946 1.00 0.54 N ATOM 272 CA THR A 19 -3.629 0.125 -12.805 1.00 0.58 C ATOM 273 C THR A 19 -3.290 1.610 -12.604 1.00 0.59 C ATOM 274 O THR A 19 -3.788 2.475 -13.331 1.00 0.63 O ATOM 275 CB THR A 19 -4.468 -0.497 -11.678 1.00 0.62 C ATOM 276 OG1 THR A 19 -4.543 -1.897 -11.879 1.00 0.66 O ATOM 277 CG2 THR A 19 -5.899 0.039 -11.704 1.00 0.67 C ATOM 0 H THR A 19 -2.290 -1.373 -12.243 1.00 0.54 H new ATOM 0 HA THR A 19 -4.238 0.087 -13.708 1.00 0.58 H new ATOM 0 HB THR A 19 -3.996 -0.249 -10.727 1.00 0.62 H new ATOM 0 HG1 THR A 19 -3.785 -2.332 -11.436 1.00 0.66 H new ATOM 0 HG21 THR A 19 -6.473 -0.416 -10.897 1.00 0.67 H new ATOM 0 HG22 THR A 19 -5.885 1.121 -11.573 1.00 0.67 H new ATOM 0 HG23 THR A 19 -6.362 -0.205 -12.660 1.00 0.67 H new ATOM 285 N PHE A 20 -2.376 1.895 -11.669 1.00 0.59 N ATOM 286 CA PHE A 20 -1.752 3.201 -11.507 1.00 0.64 C ATOM 287 C PHE A 20 -1.294 3.732 -12.859 1.00 0.59 C ATOM 288 O PHE A 20 -1.626 4.854 -13.200 1.00 0.69 O ATOM 289 CB PHE A 20 -0.569 3.134 -10.525 1.00 0.72 C ATOM 290 CG PHE A 20 0.449 4.256 -10.673 1.00 1.34 C ATOM 291 CD1 PHE A 20 0.210 5.515 -10.091 1.00 2.30 C ATOM 292 CD2 PHE A 20 1.586 4.073 -11.486 1.00 2.75 C ATOM 293 CE1 PHE A 20 1.109 6.576 -10.307 1.00 3.03 C ATOM 294 CE2 PHE A 20 2.462 5.144 -11.732 1.00 3.52 C ATOM 295 CZ PHE A 20 2.228 6.395 -11.137 1.00 3.25 C ATOM 0 H PHE A 20 -2.047 1.206 -10.993 1.00 0.59 H new ATOM 0 HA PHE A 20 -2.492 3.884 -11.090 1.00 0.64 H new ATOM 0 HB2 PHE A 20 -0.959 3.148 -9.507 1.00 0.72 H new ATOM 0 HB3 PHE A 20 -0.059 2.180 -10.658 1.00 0.72 H new ATOM 0 HD1 PHE A 20 -0.665 5.667 -9.477 1.00 2.30 H new ATOM 0 HD2 PHE A 20 1.785 3.105 -11.922 1.00 2.75 H new ATOM 0 HE1 PHE A 20 0.938 7.532 -9.834 1.00 3.03 H new ATOM 0 HE2 PHE A 20 3.316 5.005 -12.379 1.00 3.52 H new ATOM 0 HZ PHE A 20 2.907 7.216 -11.317 1.00 3.25 H new ATOM 305 N PHE A 21 -0.531 2.952 -13.625 1.00 0.56 N ATOM 306 CA PHE A 21 0.064 3.401 -14.873 1.00 0.64 C ATOM 307 C PHE A 21 -1.023 3.882 -15.833 1.00 0.62 C ATOM 308 O PHE A 21 -0.938 4.997 -16.348 1.00 0.68 O ATOM 309 CB PHE A 21 0.931 2.285 -15.475 1.00 0.84 C ATOM 310 CG PHE A 21 1.966 2.722 -16.495 1.00 1.28 C ATOM 311 CD1 PHE A 21 3.011 3.578 -16.095 1.00 1.80 C ATOM 312 CD2 PHE A 21 2.058 2.046 -17.727 1.00 2.81 C ATOM 313 CE1 PHE A 21 4.168 3.700 -16.884 1.00 2.30 C ATOM 314 CE2 PHE A 21 3.221 2.157 -18.509 1.00 3.39 C ATOM 315 CZ PHE A 21 4.292 2.954 -18.069 1.00 2.69 C ATOM 0 H PHE A 21 -0.310 1.984 -13.390 1.00 0.56 H new ATOM 0 HA PHE A 21 0.720 4.250 -14.682 1.00 0.64 H new ATOM 0 HB2 PHE A 21 1.445 1.773 -14.662 1.00 0.84 H new ATOM 0 HB3 PHE A 21 0.273 1.555 -15.945 1.00 0.84 H new ATOM 0 HD1 PHE A 21 2.923 4.143 -15.179 1.00 1.80 H new ATOM 0 HD2 PHE A 21 1.233 1.441 -18.072 1.00 2.81 H new ATOM 0 HE1 PHE A 21 4.961 4.367 -16.580 1.00 2.30 H new ATOM 0 HE2 PHE A 21 3.292 1.629 -19.449 1.00 3.39 H new ATOM 0 HZ PHE A 21 5.208 2.993 -18.640 1.00 2.69 H new ATOM 325 N THR A 22 -2.070 3.078 -16.046 1.00 0.69 N ATOM 326 CA THR A 22 -3.206 3.504 -16.852 1.00 0.93 C ATOM 327 C THR A 22 -3.803 4.805 -16.306 1.00 1.00 C ATOM 328 O THR A 22 -3.821 5.811 -17.017 1.00 1.35 O ATOM 329 CB THR A 22 -4.244 2.375 -16.968 1.00 1.25 C ATOM 330 OG1 THR A 22 -4.207 1.525 -15.843 1.00 2.49 O ATOM 331 CG2 THR A 22 -3.941 1.500 -18.186 1.00 1.88 C ATOM 0 H THR A 22 -2.149 2.133 -15.671 1.00 0.69 H new ATOM 0 HA THR A 22 -2.861 3.719 -17.863 1.00 0.93 H new ATOM 0 HB THR A 22 -5.220 2.853 -17.052 1.00 1.25 H new ATOM 0 HG1 THR A 22 -4.188 2.065 -15.025 1.00 2.49 H new ATOM 0 HG21 THR A 22 -4.683 0.705 -18.256 1.00 1.88 H new ATOM 0 HG22 THR A 22 -3.975 2.109 -19.089 1.00 1.88 H new ATOM 0 HG23 THR A 22 -2.948 1.062 -18.081 1.00 1.88 H new ATOM 339 N PHE A 23 -4.244 4.815 -15.043 1.00 0.88 N ATOM 340 CA PHE A 23 -4.870 6.004 -14.474 1.00 0.99 C ATOM 341 C PHE A 23 -3.912 7.194 -14.414 1.00 1.04 C ATOM 342 O PHE A 23 -4.358 8.326 -14.367 1.00 1.55 O ATOM 343 CB PHE A 23 -5.471 5.717 -13.095 1.00 0.99 C ATOM 344 CG PHE A 23 -6.790 4.973 -13.142 1.00 0.95 C ATOM 345 CD1 PHE A 23 -7.969 5.668 -13.471 1.00 1.95 C ATOM 346 CD2 PHE A 23 -6.849 3.600 -12.847 1.00 2.19 C ATOM 347 CE1 PHE A 23 -9.200 4.992 -13.495 1.00 2.23 C ATOM 348 CE2 PHE A 23 -8.074 2.915 -12.908 1.00 2.66 C ATOM 349 CZ PHE A 23 -9.253 3.619 -13.199 1.00 2.10 C ATOM 0 H PHE A 23 -4.178 4.021 -14.406 1.00 0.88 H new ATOM 0 HA PHE A 23 -5.682 6.278 -15.147 1.00 0.99 H new ATOM 0 HB2 PHE A 23 -4.757 5.134 -12.513 1.00 0.99 H new ATOM 0 HB3 PHE A 23 -5.616 6.661 -12.569 1.00 0.99 H new ATOM 0 HD1 PHE A 23 -7.927 6.721 -13.705 1.00 1.95 H new ATOM 0 HD2 PHE A 23 -5.949 3.070 -12.572 1.00 2.19 H new ATOM 0 HE1 PHE A 23 -10.105 5.527 -13.741 1.00 2.23 H new ATOM 0 HE2 PHE A 23 -8.109 1.850 -12.732 1.00 2.66 H new ATOM 0 HZ PHE A 23 -10.203 3.105 -13.195 1.00 2.10 H new ATOM 359 N ALA A 24 -2.603 6.974 -14.403 1.00 0.69 N ATOM 360 CA ALA A 24 -1.606 8.025 -14.434 1.00 0.68 C ATOM 361 C ALA A 24 -1.409 8.527 -15.861 1.00 0.72 C ATOM 362 O ALA A 24 -0.959 9.661 -16.038 1.00 0.81 O ATOM 363 CB ALA A 24 -0.284 7.520 -13.849 1.00 0.69 C ATOM 0 H ALA A 24 -2.201 6.037 -14.372 1.00 0.69 H new ATOM 0 HA ALA A 24 -1.955 8.858 -13.824 1.00 0.68 H new ATOM 0 HB1 ALA A 24 0.456 8.320 -13.879 1.00 0.69 H new ATOM 0 HB2 ALA A 24 -0.439 7.207 -12.816 1.00 0.69 H new ATOM 0 HB3 ALA A 24 0.073 6.673 -14.435 1.00 0.69 H new ATOM 369 N ARG A 25 -1.671 7.693 -16.870 1.00 0.76 N ATOM 370 CA ARG A 25 -1.475 8.029 -18.272 1.00 0.91 C ATOM 371 C ARG A 25 -2.627 8.867 -18.836 1.00 0.95 C ATOM 372 O ARG A 25 -2.401 9.591 -19.802 1.00 1.08 O ATOM 373 CB ARG A 25 -1.237 6.737 -19.071 1.00 1.09 C ATOM 374 CG ARG A 25 -0.855 7.003 -20.534 1.00 2.13 C ATOM 375 CD ARG A 25 -0.501 5.697 -21.258 1.00 2.97 C ATOM 376 NE ARG A 25 -1.668 4.811 -21.414 1.00 3.38 N ATOM 377 CZ ARG A 25 -2.614 4.928 -22.363 1.00 3.53 C ATOM 378 NH1 ARG A 25 -2.590 5.969 -23.204 1.00 3.53 N ATOM 379 NH2 ARG A 25 -3.573 4.002 -22.472 1.00 4.37 N ATOM 0 H ARG A 25 -2.032 6.750 -16.727 1.00 0.76 H new ATOM 0 HA ARG A 25 -0.592 8.662 -18.364 1.00 0.91 H new ATOM 0 HB2 ARG A 25 -0.445 6.160 -18.593 1.00 1.09 H new ATOM 0 HB3 ARG A 25 -2.139 6.126 -19.041 1.00 1.09 H new ATOM 0 HG2 ARG A 25 -1.683 7.494 -21.046 1.00 2.13 H new ATOM 0 HG3 ARG A 25 -0.006 7.686 -20.573 1.00 2.13 H new ATOM 0 HD2 ARG A 25 -0.089 5.929 -22.240 1.00 2.97 H new ATOM 0 HD3 ARG A 25 0.277 5.175 -20.701 1.00 2.97 H new ATOM 0 HE ARG A 25 -1.767 4.046 -20.747 1.00 3.38 H new ATOM 0 HH11 ARG A 25 -1.855 6.672 -23.125 1.00 3.53 H new ATOM 0 HH12 ARG A 25 -3.307 6.059 -23.924 1.00 3.53 H new ATOM 0 HH21 ARG A 25 -3.588 3.206 -21.835 1.00 4.37 H new ATOM 0 HH22 ARG A 25 -4.290 4.092 -23.192 1.00 4.37 H new ATOM 393 N GLN A 26 -3.835 8.764 -18.265 1.00 0.90 N ATOM 394 CA GLN A 26 -5.034 9.472 -18.703 1.00 0.91 C ATOM 395 C GLN A 26 -4.751 10.915 -19.141 1.00 0.97 C ATOM 396 O GLN A 26 -5.009 11.297 -20.281 1.00 1.07 O ATOM 397 CB GLN A 26 -6.024 9.496 -17.528 1.00 0.82 C ATOM 398 CG GLN A 26 -7.422 9.061 -17.916 1.00 0.92 C ATOM 399 CD GLN A 26 -7.512 7.563 -18.194 1.00 1.10 C ATOM 400 OE1 GLN A 26 -7.040 6.742 -17.414 1.00 1.86 O ATOM 401 NE2 GLN A 26 -8.085 7.183 -19.332 1.00 2.30 N ATOM 0 H GLN A 26 -4.004 8.163 -17.458 1.00 0.90 H new ATOM 0 HA GLN A 26 -5.436 8.948 -19.570 1.00 0.91 H new ATOM 0 HB2 GLN A 26 -5.654 8.844 -16.737 1.00 0.82 H new ATOM 0 HB3 GLN A 26 -6.065 10.505 -17.117 1.00 0.82 H new ATOM 0 HG2 GLN A 26 -8.115 9.321 -17.116 1.00 0.92 H new ATOM 0 HG3 GLN A 26 -7.737 9.611 -18.802 1.00 0.92 H new ATOM 0 HE21 GLN A 26 -8.471 7.882 -19.967 1.00 2.30 H new ATOM 0 HE22 GLN A 26 -8.138 6.193 -19.570 1.00 2.30 H new ATOM 410 N GLU A 27 -4.237 11.697 -18.196 1.00 0.96 N ATOM 411 CA GLU A 27 -3.869 13.092 -18.312 1.00 1.08 C ATOM 412 C GLU A 27 -2.370 13.166 -18.031 1.00 1.10 C ATOM 413 O GLU A 27 -1.808 12.223 -17.467 1.00 1.68 O ATOM 414 CB GLU A 27 -4.620 13.910 -17.247 1.00 1.14 C ATOM 415 CG GLU A 27 -6.151 13.784 -17.273 1.00 1.20 C ATOM 416 CD GLU A 27 -6.743 14.629 -16.143 1.00 1.61 C ATOM 417 OE1 GLU A 27 -6.658 14.195 -14.970 1.00 2.24 O ATOM 418 OE2 GLU A 27 -7.217 15.740 -16.458 1.00 2.37 O ATOM 0 H GLU A 27 -4.056 11.337 -17.259 1.00 0.96 H new ATOM 0 HA GLU A 27 -4.116 13.487 -19.297 1.00 1.08 H new ATOM 0 HB2 GLU A 27 -4.265 13.605 -16.263 1.00 1.14 H new ATOM 0 HB3 GLU A 27 -4.357 14.961 -17.369 1.00 1.14 H new ATOM 0 HG2 GLU A 27 -6.539 14.118 -18.235 1.00 1.20 H new ATOM 0 HG3 GLU A 27 -6.444 12.741 -17.156 1.00 1.20 H new ATOM 425 N GLY A 28 -1.742 14.308 -18.326 1.00 1.08 N ATOM 426 CA GLY A 28 -0.364 14.669 -17.988 1.00 1.31 C ATOM 427 C GLY A 28 0.435 13.601 -17.226 1.00 1.16 C ATOM 428 O GLY A 28 0.148 13.326 -16.053 1.00 1.28 O ATOM 0 H GLY A 28 -2.214 15.052 -18.840 1.00 1.08 H new ATOM 0 HA2 GLY A 28 0.167 14.905 -18.910 1.00 1.31 H new ATOM 0 HA3 GLY A 28 -0.383 15.579 -17.389 1.00 1.31 H new ATOM 432 N ARG A 29 1.407 12.982 -17.905 1.00 1.23 N ATOM 433 CA ARG A 29 2.465 12.175 -17.307 1.00 1.34 C ATOM 434 C ARG A 29 1.988 10.878 -16.632 1.00 1.21 C ATOM 435 O ARG A 29 1.453 10.904 -15.517 1.00 1.13 O ATOM 436 CB ARG A 29 3.375 13.037 -16.418 1.00 1.58 C ATOM 437 CG ARG A 29 4.147 14.038 -17.289 1.00 1.95 C ATOM 438 CD ARG A 29 5.223 14.772 -16.485 1.00 2.19 C ATOM 439 NE ARG A 29 6.109 15.527 -17.387 1.00 2.94 N ATOM 440 CZ ARG A 29 7.237 16.151 -17.011 1.00 3.67 C ATOM 441 NH1 ARG A 29 7.556 16.217 -15.714 1.00 4.19 N ATOM 442 NH2 ARG A 29 8.036 16.696 -17.936 1.00 4.65 N ATOM 0 H ARG A 29 1.477 13.034 -18.921 1.00 1.23 H new ATOM 0 HA ARG A 29 3.069 11.806 -18.135 1.00 1.34 H new ATOM 0 HB2 ARG A 29 2.778 13.569 -15.677 1.00 1.58 H new ATOM 0 HB3 ARG A 29 4.072 12.403 -15.870 1.00 1.58 H new ATOM 0 HG2 ARG A 29 4.611 13.513 -18.124 1.00 1.95 H new ATOM 0 HG3 ARG A 29 3.452 14.762 -17.714 1.00 1.95 H new ATOM 0 HD2 ARG A 29 4.754 15.451 -15.772 1.00 2.19 H new ATOM 0 HD3 ARG A 29 5.806 14.056 -15.907 1.00 2.19 H new ATOM 0 HE ARG A 29 5.846 15.580 -18.371 1.00 2.94 H new ATOM 0 HH11 ARG A 29 6.944 15.795 -15.016 1.00 4.19 H new ATOM 0 HH12 ARG A 29 8.412 16.690 -15.423 1.00 4.19 H new ATOM 0 HH21 ARG A 29 7.787 16.637 -18.923 1.00 4.65 H new ATOM 0 HH22 ARG A 29 8.893 17.171 -17.654 1.00 4.65 H new ATOM 456 N LYS A 30 2.205 9.749 -17.329 1.00 1.32 N ATOM 457 CA LYS A 30 2.117 8.374 -16.825 1.00 1.33 C ATOM 458 C LYS A 30 3.160 8.124 -15.722 1.00 1.28 C ATOM 459 O LYS A 30 4.101 7.349 -15.878 1.00 1.57 O ATOM 460 CB LYS A 30 2.215 7.374 -17.994 1.00 1.55 C ATOM 461 CG LYS A 30 3.474 7.517 -18.869 1.00 1.64 C ATOM 462 CD LYS A 30 3.626 6.287 -19.773 1.00 2.26 C ATOM 463 CE LYS A 30 4.915 6.388 -20.602 1.00 2.71 C ATOM 464 NZ LYS A 30 5.144 5.184 -21.429 1.00 4.01 N ATOM 0 H LYS A 30 2.461 9.777 -18.316 1.00 1.32 H new ATOM 0 HA LYS A 30 1.144 8.221 -16.358 1.00 1.33 H new ATOM 0 HB2 LYS A 30 2.185 6.362 -17.590 1.00 1.55 H new ATOM 0 HB3 LYS A 30 1.336 7.491 -18.627 1.00 1.55 H new ATOM 0 HG2 LYS A 30 3.404 8.419 -19.477 1.00 1.64 H new ATOM 0 HG3 LYS A 30 4.356 7.626 -18.237 1.00 1.64 H new ATOM 0 HD2 LYS A 30 3.646 5.382 -19.166 1.00 2.26 H new ATOM 0 HD3 LYS A 30 2.765 6.207 -20.436 1.00 2.26 H new ATOM 0 HE2 LYS A 30 4.862 7.265 -21.247 1.00 2.71 H new ATOM 0 HE3 LYS A 30 5.764 6.535 -19.934 1.00 2.71 H new ATOM 0 HZ1 LYS A 30 6.025 5.297 -21.971 1.00 4.01 H new ATOM 0 HZ2 LYS A 30 5.221 4.349 -20.813 1.00 4.01 H new ATOM 0 HZ3 LYS A 30 4.348 5.057 -22.086 1.00 4.01 H new ATOM 478 N ASP A 31 2.978 8.845 -14.620 1.00 1.25 N ATOM 479 CA ASP A 31 3.977 9.169 -13.605 1.00 1.34 C ATOM 480 C ASP A 31 3.339 9.969 -12.452 1.00 1.32 C ATOM 481 O ASP A 31 3.787 9.864 -11.303 1.00 1.96 O ATOM 482 CB ASP A 31 5.155 9.919 -14.256 1.00 1.70 C ATOM 483 CG ASP A 31 5.770 10.930 -13.305 1.00 2.44 C ATOM 484 OD1 ASP A 31 6.614 10.540 -12.468 1.00 3.07 O ATOM 485 OD2 ASP A 31 5.277 12.077 -13.289 1.00 3.61 O ATOM 0 H ASP A 31 2.067 9.246 -14.397 1.00 1.25 H new ATOM 0 HA ASP A 31 4.368 8.249 -13.171 1.00 1.34 H new ATOM 0 HB2 ASP A 31 5.915 9.203 -14.567 1.00 1.70 H new ATOM 0 HB3 ASP A 31 4.810 10.428 -15.156 1.00 1.70 H new ATOM 490 N SER A 32 2.294 10.763 -12.722 1.00 1.03 N ATOM 491 CA SER A 32 1.465 11.325 -11.671 1.00 1.06 C ATOM 492 C SER A 32 -0.023 11.198 -11.988 1.00 0.93 C ATOM 493 O SER A 32 -0.438 11.268 -13.154 1.00 0.92 O ATOM 494 CB SER A 32 1.837 12.786 -11.435 1.00 1.21 C ATOM 495 OG SER A 32 1.069 13.278 -10.362 1.00 3.08 O ATOM 0 H SER A 32 2.010 11.026 -13.666 1.00 1.03 H new ATOM 0 HA SER A 32 1.652 10.755 -10.761 1.00 1.06 H new ATOM 0 HB2 SER A 32 2.900 12.874 -11.211 1.00 1.21 H new ATOM 0 HB3 SER A 32 1.651 13.374 -12.334 1.00 1.21 H new ATOM 0 HG SER A 32 0.233 13.657 -10.705 1.00 3.08 H new ATOM 501 N LEU A 33 -0.807 11.059 -10.917 1.00 0.88 N ATOM 502 CA LEU A 33 -2.246 11.223 -10.901 1.00 0.79 C ATOM 503 C LEU A 33 -2.537 12.720 -10.742 1.00 0.77 C ATOM 504 O LEU A 33 -2.143 13.340 -9.753 1.00 0.90 O ATOM 505 CB LEU A 33 -2.853 10.441 -9.723 1.00 0.81 C ATOM 506 CG LEU A 33 -3.220 8.980 -9.992 1.00 1.05 C ATOM 507 CD1 LEU A 33 -4.400 8.847 -10.945 1.00 1.94 C ATOM 508 CD2 LEU A 33 -2.019 8.165 -10.459 1.00 1.68 C ATOM 0 H LEU A 33 -0.430 10.818 -10.000 1.00 0.88 H new ATOM 0 HA LEU A 33 -2.686 10.842 -11.823 1.00 0.79 H new ATOM 0 HB2 LEU A 33 -2.145 10.468 -8.894 1.00 0.81 H new ATOM 0 HB3 LEU A 33 -3.751 10.963 -9.393 1.00 0.81 H new ATOM 0 HG LEU A 33 -3.539 8.560 -9.038 1.00 1.05 H new ATOM 0 HD11 LEU A 33 -4.622 7.792 -11.104 1.00 1.94 H new ATOM 0 HD12 LEU A 33 -5.272 9.340 -10.516 1.00 1.94 H new ATOM 0 HD13 LEU A 33 -4.152 9.314 -11.898 1.00 1.94 H new ATOM 0 HD21 LEU A 33 -2.326 7.135 -10.638 1.00 1.68 H new ATOM 0 HD22 LEU A 33 -1.626 8.592 -11.382 1.00 1.68 H new ATOM 0 HD23 LEU A 33 -1.245 8.185 -9.692 1.00 1.68 H new ATOM 520 N SER A 34 -3.233 13.286 -11.721 1.00 0.93 N ATOM 521 CA SER A 34 -3.860 14.593 -11.665 1.00 1.06 C ATOM 522 C SER A 34 -5.238 14.436 -11.000 1.00 0.97 C ATOM 523 O SER A 34 -5.690 13.316 -10.756 1.00 0.88 O ATOM 524 CB SER A 34 -3.938 15.124 -13.103 1.00 1.38 C ATOM 525 OG SER A 34 -2.651 15.057 -13.704 1.00 3.04 O ATOM 0 H SER A 34 -3.380 12.820 -12.617 1.00 0.93 H new ATOM 0 HA SER A 34 -3.297 15.312 -11.070 1.00 1.06 H new ATOM 0 HB2 SER A 34 -4.652 14.537 -13.681 1.00 1.38 H new ATOM 0 HB3 SER A 34 -4.298 16.153 -13.103 1.00 1.38 H new ATOM 0 HG SER A 34 -2.701 15.394 -14.623 1.00 3.04 H new ATOM 531 N VAL A 35 -5.910 15.538 -10.650 1.00 1.05 N ATOM 532 CA VAL A 35 -7.122 15.439 -9.840 1.00 1.04 C ATOM 533 C VAL A 35 -8.263 14.737 -10.587 1.00 0.94 C ATOM 534 O VAL A 35 -8.940 13.895 -9.997 1.00 0.88 O ATOM 535 CB VAL A 35 -7.520 16.805 -9.252 1.00 1.16 C ATOM 536 CG1 VAL A 35 -8.066 17.775 -10.303 1.00 2.01 C ATOM 537 CG2 VAL A 35 -8.562 16.639 -8.137 1.00 1.97 C ATOM 0 H VAL A 35 -5.641 16.487 -10.909 1.00 1.05 H new ATOM 0 HA VAL A 35 -6.899 14.797 -8.988 1.00 1.04 H new ATOM 0 HB VAL A 35 -6.602 17.232 -8.848 1.00 1.16 H new ATOM 0 HG11 VAL A 35 -8.328 18.719 -9.825 1.00 2.01 H new ATOM 0 HG12 VAL A 35 -7.306 17.952 -11.064 1.00 2.01 H new ATOM 0 HG13 VAL A 35 -8.953 17.345 -10.769 1.00 2.01 H new ATOM 0 HG21 VAL A 35 -8.827 17.618 -7.738 1.00 1.97 H new ATOM 0 HG22 VAL A 35 -9.453 16.158 -8.541 1.00 1.97 H new ATOM 0 HG23 VAL A 35 -8.147 16.022 -7.340 1.00 1.97 H new ATOM 547 N ASN A 36 -8.486 15.064 -11.868 1.00 1.00 N ATOM 548 CA ASN A 36 -9.572 14.449 -12.630 1.00 1.00 C ATOM 549 C ASN A 36 -9.293 12.959 -12.776 1.00 0.94 C ATOM 550 O ASN A 36 -10.110 12.150 -12.351 1.00 0.95 O ATOM 551 CB ASN A 36 -9.793 15.130 -13.982 1.00 1.13 C ATOM 552 CG ASN A 36 -11.170 14.784 -14.542 1.00 1.32 C ATOM 553 OD1 ASN A 36 -12.103 15.569 -14.394 1.00 2.20 O ATOM 554 ND2 ASN A 36 -11.348 13.627 -15.170 1.00 1.54 N ATOM 0 H ASN A 36 -7.933 15.744 -12.390 1.00 1.00 H new ATOM 0 HA ASN A 36 -10.505 14.584 -12.083 1.00 1.00 H new ATOM 0 HB2 ASN A 36 -9.702 16.210 -13.870 1.00 1.13 H new ATOM 0 HB3 ASN A 36 -9.020 14.816 -14.684 1.00 1.13 H new ATOM 0 HD21 ASN A 36 -12.268 13.382 -15.536 1.00 1.54 H new ATOM 0 HD22 ASN A 36 -10.565 12.984 -15.286 1.00 1.54 H new ATOM 561 N GLU A 37 -8.087 12.621 -13.242 1.00 0.92 N ATOM 562 CA GLU A 37 -7.519 11.280 -13.194 1.00 0.90 C ATOM 563 C GLU A 37 -7.869 10.553 -11.898 1.00 0.85 C ATOM 564 O GLU A 37 -8.379 9.432 -11.906 1.00 0.91 O ATOM 565 CB GLU A 37 -5.991 11.425 -13.271 1.00 0.93 C ATOM 566 CG GLU A 37 -5.502 11.071 -14.659 1.00 0.75 C ATOM 567 CD GLU A 37 -4.003 11.234 -14.808 1.00 0.78 C ATOM 568 OE1 GLU A 37 -3.312 11.877 -13.991 1.00 1.53 O ATOM 569 OE2 GLU A 37 -3.404 10.788 -15.803 1.00 1.85 O ATOM 0 H GLU A 37 -7.462 13.300 -13.677 1.00 0.92 H new ATOM 0 HA GLU A 37 -7.924 10.698 -14.022 1.00 0.90 H new ATOM 0 HB2 GLU A 37 -5.703 12.447 -13.025 1.00 0.93 H new ATOM 0 HB3 GLU A 37 -5.519 10.775 -12.534 1.00 0.93 H new ATOM 0 HG2 GLU A 37 -5.776 10.040 -14.885 1.00 0.75 H new ATOM 0 HG3 GLU A 37 -6.007 11.702 -15.390 1.00 0.75 H new ATOM 576 N PHE A 38 -7.562 11.181 -10.764 1.00 0.78 N ATOM 577 CA PHE A 38 -7.853 10.584 -9.477 1.00 0.77 C ATOM 578 C PHE A 38 -9.357 10.347 -9.343 1.00 0.79 C ATOM 579 O PHE A 38 -9.789 9.238 -9.028 1.00 0.80 O ATOM 580 CB PHE A 38 -7.306 11.457 -8.346 1.00 0.76 C ATOM 581 CG PHE A 38 -6.839 10.653 -7.151 1.00 0.96 C ATOM 582 CD1 PHE A 38 -7.706 9.752 -6.508 1.00 1.99 C ATOM 583 CD2 PHE A 38 -5.491 10.712 -6.766 1.00 2.52 C ATOM 584 CE1 PHE A 38 -7.236 8.945 -5.461 1.00 2.33 C ATOM 585 CE2 PHE A 38 -5.029 9.941 -5.689 1.00 3.05 C ATOM 586 CZ PHE A 38 -5.892 9.027 -5.063 1.00 2.33 C ATOM 0 H PHE A 38 -7.115 12.097 -10.718 1.00 0.78 H new ATOM 0 HA PHE A 38 -7.356 9.617 -9.405 1.00 0.77 H new ATOM 0 HB2 PHE A 38 -6.475 12.052 -8.724 1.00 0.76 H new ATOM 0 HB3 PHE A 38 -8.080 12.156 -8.027 1.00 0.76 H new ATOM 0 HD1 PHE A 38 -8.737 9.681 -6.821 1.00 1.99 H new ATOM 0 HD2 PHE A 38 -4.806 11.354 -7.301 1.00 2.52 H new ATOM 0 HE1 PHE A 38 -7.907 8.262 -4.962 1.00 2.33 H new ATOM 0 HE2 PHE A 38 -4.012 10.050 -5.342 1.00 3.05 H new ATOM 0 HZ PHE A 38 -5.522 8.387 -4.276 1.00 2.33 H new ATOM 596 N LYS A 39 -10.166 11.380 -9.584 1.00 0.83 N ATOM 597 CA LYS A 39 -11.607 11.257 -9.464 1.00 0.92 C ATOM 598 C LYS A 39 -12.134 10.114 -10.340 1.00 0.94 C ATOM 599 O LYS A 39 -12.980 9.347 -9.887 1.00 0.98 O ATOM 600 CB LYS A 39 -12.310 12.604 -9.669 1.00 1.02 C ATOM 601 CG LYS A 39 -13.738 12.568 -9.094 1.00 1.14 C ATOM 602 CD LYS A 39 -14.287 13.994 -8.882 1.00 1.40 C ATOM 603 CE LYS A 39 -13.944 14.449 -7.452 1.00 2.28 C ATOM 604 NZ LYS A 39 -14.239 15.865 -7.146 1.00 3.71 N ATOM 0 H LYS A 39 -9.842 12.306 -9.862 1.00 0.83 H new ATOM 0 HA LYS A 39 -11.855 10.974 -8.441 1.00 0.92 H new ATOM 0 HB2 LYS A 39 -11.738 13.395 -9.185 1.00 1.02 H new ATOM 0 HB3 LYS A 39 -12.347 12.842 -10.732 1.00 1.02 H new ATOM 0 HG2 LYS A 39 -14.393 12.020 -9.772 1.00 1.14 H new ATOM 0 HG3 LYS A 39 -13.738 12.030 -8.146 1.00 1.14 H new ATOM 0 HD2 LYS A 39 -13.852 14.678 -9.610 1.00 1.40 H new ATOM 0 HD3 LYS A 39 -15.366 14.010 -9.035 1.00 1.40 H new ATOM 0 HE2 LYS A 39 -14.492 13.822 -6.749 1.00 2.28 H new ATOM 0 HE3 LYS A 39 -12.883 14.271 -7.278 1.00 2.28 H new ATOM 0 HZ1 LYS A 39 -14.533 15.951 -6.152 1.00 3.71 H new ATOM 0 HZ2 LYS A 39 -13.387 16.440 -7.306 1.00 3.71 H new ATOM 0 HZ3 LYS A 39 -15.004 16.202 -7.764 1.00 3.71 H new ATOM 618 N GLU A 40 -11.600 9.938 -11.550 1.00 0.91 N ATOM 619 CA GLU A 40 -11.930 8.804 -12.401 1.00 0.91 C ATOM 620 C GLU A 40 -11.685 7.469 -11.692 1.00 0.85 C ATOM 621 O GLU A 40 -12.495 6.561 -11.833 1.00 0.87 O ATOM 622 CB GLU A 40 -11.163 8.863 -13.727 1.00 0.93 C ATOM 623 CG GLU A 40 -11.613 10.052 -14.586 1.00 1.04 C ATOM 624 CD GLU A 40 -10.644 10.290 -15.735 1.00 1.77 C ATOM 625 OE1 GLU A 40 -10.527 9.369 -16.571 1.00 2.56 O ATOM 626 OE2 GLU A 40 -10.037 11.384 -15.747 1.00 2.44 O ATOM 0 H GLU A 40 -10.926 10.582 -11.964 1.00 0.91 H new ATOM 0 HA GLU A 40 -12.996 8.869 -12.620 1.00 0.91 H new ATOM 0 HB2 GLU A 40 -10.094 8.941 -13.527 1.00 0.93 H new ATOM 0 HB3 GLU A 40 -11.317 7.936 -14.279 1.00 0.93 H new ATOM 0 HG2 GLU A 40 -12.612 9.863 -14.980 1.00 1.04 H new ATOM 0 HG3 GLU A 40 -11.678 10.948 -13.968 1.00 1.04 H new ATOM 633 N LEU A 41 -10.602 7.321 -10.922 1.00 0.80 N ATOM 634 CA LEU A 41 -10.290 6.056 -10.265 1.00 0.77 C ATOM 635 C LEU A 41 -11.408 5.729 -9.279 1.00 0.78 C ATOM 636 O LEU A 41 -11.991 4.642 -9.316 1.00 0.81 O ATOM 637 CB LEU A 41 -8.885 6.138 -9.630 1.00 0.79 C ATOM 638 CG LEU A 41 -8.426 4.964 -8.744 1.00 0.88 C ATOM 639 CD1 LEU A 41 -8.861 5.120 -7.284 1.00 2.60 C ATOM 640 CD2 LEU A 41 -8.797 3.594 -9.305 1.00 1.75 C ATOM 0 H LEU A 41 -9.928 8.065 -10.741 1.00 0.80 H new ATOM 0 HA LEU A 41 -10.247 5.230 -10.975 1.00 0.77 H new ATOM 0 HB2 LEU A 41 -8.160 6.253 -10.436 1.00 0.79 H new ATOM 0 HB3 LEU A 41 -8.841 7.047 -9.030 1.00 0.79 H new ATOM 0 HG LEU A 41 -7.337 5.009 -8.758 1.00 0.88 H new ATOM 0 HD11 LEU A 41 -8.510 4.265 -6.707 1.00 2.60 H new ATOM 0 HD12 LEU A 41 -8.434 6.035 -6.873 1.00 2.60 H new ATOM 0 HD13 LEU A 41 -9.949 5.172 -7.232 1.00 2.60 H new ATOM 0 HD21 LEU A 41 -8.442 2.816 -8.629 1.00 1.75 H new ATOM 0 HD22 LEU A 41 -9.880 3.523 -9.404 1.00 1.75 H new ATOM 0 HD23 LEU A 41 -8.334 3.464 -10.283 1.00 1.75 H new ATOM 652 N VAL A 42 -11.735 6.699 -8.423 1.00 0.80 N ATOM 653 CA VAL A 42 -12.710 6.490 -7.365 1.00 0.86 C ATOM 654 C VAL A 42 -14.107 6.326 -7.961 1.00 0.95 C ATOM 655 O VAL A 42 -14.885 5.493 -7.512 1.00 1.06 O ATOM 656 CB VAL A 42 -12.633 7.590 -6.292 1.00 0.89 C ATOM 657 CG1 VAL A 42 -11.440 7.356 -5.354 1.00 0.84 C ATOM 658 CG2 VAL A 42 -12.579 9.020 -6.813 1.00 0.96 C ATOM 0 H VAL A 42 -11.335 7.637 -8.447 1.00 0.80 H new ATOM 0 HA VAL A 42 -12.471 5.562 -6.846 1.00 0.86 H new ATOM 0 HB VAL A 42 -13.580 7.501 -5.760 1.00 0.89 H new ATOM 0 HG11 VAL A 42 -11.406 8.146 -4.604 1.00 0.84 H new ATOM 0 HG12 VAL A 42 -11.550 6.391 -4.859 1.00 0.84 H new ATOM 0 HG13 VAL A 42 -10.516 7.365 -5.932 1.00 0.84 H new ATOM 0 HG21 VAL A 42 -12.527 9.712 -5.972 1.00 0.96 H new ATOM 0 HG22 VAL A 42 -11.697 9.145 -7.441 1.00 0.96 H new ATOM 0 HG23 VAL A 42 -13.474 9.228 -7.399 1.00 0.96 H new ATOM 668 N THR A 43 -14.408 7.102 -8.998 1.00 0.97 N ATOM 669 CA THR A 43 -15.654 7.010 -9.737 1.00 1.07 C ATOM 670 C THR A 43 -15.793 5.646 -10.423 1.00 1.02 C ATOM 671 O THR A 43 -16.886 5.085 -10.460 1.00 1.18 O ATOM 672 CB THR A 43 -15.675 8.158 -10.752 1.00 1.16 C ATOM 673 OG1 THR A 43 -15.664 9.389 -10.059 1.00 1.26 O ATOM 674 CG2 THR A 43 -16.904 8.137 -11.664 1.00 1.34 C ATOM 0 H THR A 43 -13.779 7.823 -9.351 1.00 0.97 H new ATOM 0 HA THR A 43 -16.504 7.097 -9.060 1.00 1.07 H new ATOM 0 HB THR A 43 -14.793 8.035 -11.381 1.00 1.16 H new ATOM 0 HG1 THR A 43 -14.746 9.607 -9.794 1.00 1.26 H new ATOM 0 HG21 THR A 43 -16.856 8.976 -12.358 1.00 1.34 H new ATOM 0 HG22 THR A 43 -16.925 7.203 -12.225 1.00 1.34 H new ATOM 0 HG23 THR A 43 -17.807 8.217 -11.059 1.00 1.34 H new ATOM 682 N GLN A 44 -14.714 5.143 -11.031 1.00 0.89 N ATOM 683 CA GLN A 44 -14.778 3.995 -11.919 1.00 0.94 C ATOM 684 C GLN A 44 -14.834 2.702 -11.110 1.00 0.92 C ATOM 685 O GLN A 44 -15.722 1.884 -11.344 1.00 1.01 O ATOM 686 CB GLN A 44 -13.596 4.030 -12.896 1.00 0.99 C ATOM 687 CG GLN A 44 -13.686 2.916 -13.948 1.00 1.21 C ATOM 688 CD GLN A 44 -12.386 2.809 -14.731 1.00 1.43 C ATOM 689 OE1 GLN A 44 -11.806 1.735 -14.841 1.00 2.14 O ATOM 690 NE2 GLN A 44 -11.882 3.931 -15.232 1.00 1.77 N ATOM 0 H GLN A 44 -13.775 5.525 -10.917 1.00 0.89 H new ATOM 0 HA GLN A 44 -15.692 4.035 -12.512 1.00 0.94 H new ATOM 0 HB2 GLN A 44 -13.567 4.999 -13.395 1.00 0.99 H new ATOM 0 HB3 GLN A 44 -12.664 3.930 -12.341 1.00 0.99 H new ATOM 0 HG2 GLN A 44 -13.902 1.965 -13.460 1.00 1.21 H new ATOM 0 HG3 GLN A 44 -14.511 3.119 -14.630 1.00 1.21 H new ATOM 0 HE21 GLN A 44 -12.388 4.810 -15.125 1.00 1.77 H new ATOM 0 HE22 GLN A 44 -10.989 3.914 -15.724 1.00 1.77 H new ATOM 699 N GLN A 45 -13.878 2.498 -10.195 1.00 0.91 N ATOM 700 CA GLN A 45 -13.953 1.381 -9.257 1.00 1.19 C ATOM 701 C GLN A 45 -14.516 1.865 -7.914 1.00 1.62 C ATOM 702 O GLN A 45 -15.602 2.434 -7.880 1.00 3.40 O ATOM 703 CB GLN A 45 -12.619 0.616 -9.169 1.00 1.52 C ATOM 704 CG GLN A 45 -12.232 0.014 -10.531 1.00 1.69 C ATOM 705 CD GLN A 45 -11.297 -1.198 -10.437 1.00 2.41 C ATOM 706 OE1 GLN A 45 -11.162 -1.830 -9.389 1.00 3.67 O ATOM 707 NE2 GLN A 45 -10.667 -1.538 -11.556 1.00 2.59 N ATOM 0 H GLN A 45 -13.053 3.088 -10.088 1.00 0.91 H new ATOM 0 HA GLN A 45 -14.656 0.635 -9.628 1.00 1.19 H new ATOM 0 HB2 GLN A 45 -11.832 1.290 -8.829 1.00 1.52 H new ATOM 0 HB3 GLN A 45 -12.701 -0.178 -8.427 1.00 1.52 H new ATOM 0 HG2 GLN A 45 -13.140 -0.281 -11.057 1.00 1.69 H new ATOM 0 HG3 GLN A 45 -11.751 0.785 -11.133 1.00 1.69 H new ATOM 0 HE21 GLN A 45 -10.804 -0.990 -12.405 1.00 2.59 H new ATOM 0 HE22 GLN A 45 -10.046 -2.347 -11.566 1.00 2.59 H new ATOM 716 N LEU A 46 -13.810 1.575 -6.816 1.00 0.87 N ATOM 717 CA LEU A 46 -14.199 1.809 -5.425 1.00 0.89 C ATOM 718 C LEU A 46 -15.719 1.762 -5.173 1.00 1.01 C ATOM 719 O LEU A 46 -16.292 2.732 -4.677 1.00 1.42 O ATOM 720 CB LEU A 46 -13.576 3.126 -4.934 1.00 1.04 C ATOM 721 CG LEU A 46 -12.056 3.098 -4.699 1.00 1.17 C ATOM 722 CD1 LEU A 46 -11.678 2.142 -3.569 1.00 1.91 C ATOM 723 CD2 LEU A 46 -11.195 2.798 -5.935 1.00 2.17 C ATOM 0 H LEU A 46 -12.889 1.141 -6.882 1.00 0.87 H new ATOM 0 HA LEU A 46 -13.806 0.977 -4.841 1.00 0.89 H new ATOM 0 HB2 LEU A 46 -13.798 3.906 -5.663 1.00 1.04 H new ATOM 0 HB3 LEU A 46 -14.064 3.412 -4.002 1.00 1.04 H new ATOM 0 HG LEU A 46 -11.825 4.126 -4.420 1.00 1.17 H new ATOM 0 HD11 LEU A 46 -10.597 2.149 -3.433 1.00 1.91 H new ATOM 0 HD12 LEU A 46 -12.162 2.460 -2.646 1.00 1.91 H new ATOM 0 HD13 LEU A 46 -12.005 1.133 -3.821 1.00 1.91 H new ATOM 0 HD21 LEU A 46 -10.142 2.803 -5.655 1.00 2.17 H new ATOM 0 HD22 LEU A 46 -11.460 1.819 -6.334 1.00 2.17 H new ATOM 0 HD23 LEU A 46 -11.372 3.559 -6.695 1.00 2.17 H new ATOM 735 N PRO A 47 -16.387 0.633 -5.461 1.00 0.89 N ATOM 736 CA PRO A 47 -17.814 0.497 -5.248 1.00 1.16 C ATOM 737 C PRO A 47 -18.167 0.466 -3.762 1.00 1.26 C ATOM 738 O PRO A 47 -19.172 1.068 -3.385 1.00 1.74 O ATOM 739 CB PRO A 47 -18.220 -0.802 -5.946 1.00 1.26 C ATOM 740 CG PRO A 47 -16.942 -1.634 -5.910 1.00 1.11 C ATOM 741 CD PRO A 47 -15.843 -0.580 -6.040 1.00 0.87 C ATOM 0 HA PRO A 47 -18.352 1.353 -5.655 1.00 1.16 H new ATOM 0 HB2 PRO A 47 -19.039 -1.299 -5.426 1.00 1.26 H new ATOM 0 HB3 PRO A 47 -18.554 -0.622 -6.968 1.00 1.26 H new ATOM 0 HG2 PRO A 47 -16.853 -2.198 -4.981 1.00 1.11 H new ATOM 0 HG3 PRO A 47 -16.907 -2.356 -6.726 1.00 1.11 H new ATOM 0 HD2 PRO A 47 -14.939 -0.891 -5.517 1.00 0.87 H new ATOM 0 HD3 PRO A 47 -15.570 -0.427 -7.084 1.00 0.87 H new ATOM 749 N HIS A 48 -17.401 -0.259 -2.929 1.00 1.12 N ATOM 750 CA HIS A 48 -17.795 -0.486 -1.542 1.00 1.27 C ATOM 751 C HIS A 48 -16.756 -0.016 -0.526 1.00 1.16 C ATOM 752 O HIS A 48 -17.121 0.214 0.626 1.00 1.67 O ATOM 753 CB HIS A 48 -18.213 -1.945 -1.329 1.00 1.50 C ATOM 754 CG HIS A 48 -19.070 -2.090 -0.097 1.00 1.94 C ATOM 755 ND1 HIS A 48 -20.326 -1.545 0.059 1.00 2.58 N ATOM 756 CD2 HIS A 48 -18.644 -2.500 1.137 1.00 2.98 C ATOM 757 CE1 HIS A 48 -20.650 -1.635 1.359 1.00 2.91 C ATOM 758 NE2 HIS A 48 -19.652 -2.196 2.063 1.00 3.10 N ATOM 0 H HIS A 48 -16.516 -0.691 -3.195 1.00 1.12 H new ATOM 0 HA HIS A 48 -18.666 0.142 -1.354 1.00 1.27 H new ATOM 0 HB2 HIS A 48 -18.762 -2.300 -2.201 1.00 1.50 H new ATOM 0 HB3 HIS A 48 -17.325 -2.571 -1.234 1.00 1.50 H new ATOM 0 HD2 HIS A 48 -17.699 -2.974 1.358 1.00 2.98 H new ATOM 0 HE1 HIS A 48 -21.586 -1.302 1.782 1.00 2.91 H new ATOM 0 HE2 HIS A 48 -19.632 -2.366 3.068 1.00 3.10 H new ATOM 766 N LEU A 49 -15.490 0.145 -0.924 1.00 0.98 N ATOM 767 CA LEU A 49 -14.476 0.737 -0.059 1.00 0.88 C ATOM 768 C LEU A 49 -14.799 2.207 0.251 1.00 1.01 C ATOM 769 O LEU A 49 -15.556 2.517 1.172 1.00 1.42 O ATOM 770 CB LEU A 49 -13.082 0.528 -0.690 1.00 0.94 C ATOM 771 CG LEU A 49 -12.248 -0.541 0.017 1.00 1.00 C ATOM 772 CD1 LEU A 49 -13.007 -1.856 0.239 1.00 1.30 C ATOM 773 CD2 LEU A 49 -10.974 -0.819 -0.787 1.00 1.27 C ATOM 0 H LEU A 49 -15.146 -0.129 -1.844 1.00 0.98 H new ATOM 0 HA LEU A 49 -14.473 0.235 0.908 1.00 0.88 H new ATOM 0 HB2 LEU A 49 -13.204 0.250 -1.737 1.00 0.94 H new ATOM 0 HB3 LEU A 49 -12.538 1.473 -0.672 1.00 0.94 H new ATOM 0 HG LEU A 49 -12.004 -0.144 1.002 1.00 1.00 H new ATOM 0 HD11 LEU A 49 -12.357 -2.570 0.745 1.00 1.30 H new ATOM 0 HD12 LEU A 49 -13.888 -1.668 0.853 1.00 1.30 H new ATOM 0 HD13 LEU A 49 -13.316 -2.265 -0.723 1.00 1.30 H new ATOM 0 HD21 LEU A 49 -10.383 -1.581 -0.280 1.00 1.27 H new ATOM 0 HD22 LEU A 49 -11.242 -1.171 -1.783 1.00 1.27 H new ATOM 0 HD23 LEU A 49 -10.390 0.097 -0.871 1.00 1.27 H new ATOM 785 N LEU A 50 -14.198 3.141 -0.483 1.00 0.94 N ATOM 786 CA LEU A 50 -14.148 4.533 -0.073 1.00 1.02 C ATOM 787 C LEU A 50 -15.380 5.257 -0.598 1.00 1.27 C ATOM 788 O LEU A 50 -15.306 6.071 -1.517 1.00 2.27 O ATOM 789 CB LEU A 50 -12.820 5.151 -0.523 1.00 0.96 C ATOM 790 CG LEU A 50 -11.632 4.595 0.289 1.00 0.94 C ATOM 791 CD1 LEU A 50 -10.335 4.999 -0.418 1.00 1.13 C ATOM 792 CD2 LEU A 50 -11.601 5.179 1.709 1.00 1.07 C ATOM 0 H LEU A 50 -13.736 2.951 -1.372 1.00 0.94 H new ATOM 0 HA LEU A 50 -14.175 4.627 1.013 1.00 1.02 H new ATOM 0 HB2 LEU A 50 -12.664 4.948 -1.583 1.00 0.96 H new ATOM 0 HB3 LEU A 50 -12.865 6.234 -0.409 1.00 0.96 H new ATOM 0 HG LEU A 50 -11.737 3.512 0.357 1.00 0.94 H new ATOM 0 HD11 LEU A 50 -9.481 4.615 0.141 1.00 1.13 H new ATOM 0 HD12 LEU A 50 -10.325 4.584 -1.426 1.00 1.13 H new ATOM 0 HD13 LEU A 50 -10.274 6.086 -0.473 1.00 1.13 H new ATOM 0 HD21 LEU A 50 -10.752 4.766 2.254 1.00 1.07 H new ATOM 0 HD22 LEU A 50 -11.505 6.263 1.654 1.00 1.07 H new ATOM 0 HD23 LEU A 50 -12.524 4.922 2.228 1.00 1.07 H new ATOM 804 N LYS A 51 -16.525 4.941 0.009 1.00 1.06 N ATOM 805 CA LYS A 51 -17.767 5.644 -0.203 1.00 1.18 C ATOM 806 C LYS A 51 -17.604 7.140 0.090 1.00 1.22 C ATOM 807 O LYS A 51 -16.709 7.559 0.820 1.00 1.99 O ATOM 808 CB LYS A 51 -18.817 4.947 0.662 1.00 1.39 C ATOM 809 CG LYS A 51 -20.113 5.725 0.886 1.00 2.69 C ATOM 810 CD LYS A 51 -21.082 4.839 1.675 1.00 3.47 C ATOM 811 CE LYS A 51 -21.842 3.821 0.808 1.00 4.57 C ATOM 812 NZ LYS A 51 -22.789 4.463 -0.128 1.00 6.01 N ATOM 0 H LYS A 51 -16.604 4.171 0.674 1.00 1.06 H new ATOM 0 HA LYS A 51 -18.090 5.607 -1.244 1.00 1.18 H new ATOM 0 HB2 LYS A 51 -19.064 3.991 0.201 1.00 1.39 H new ATOM 0 HB3 LYS A 51 -18.374 4.728 1.633 1.00 1.39 H new ATOM 0 HG2 LYS A 51 -19.912 6.646 1.432 1.00 2.69 H new ATOM 0 HG3 LYS A 51 -20.553 6.011 -0.069 1.00 2.69 H new ATOM 0 HD2 LYS A 51 -20.525 4.303 2.443 1.00 3.47 H new ATOM 0 HD3 LYS A 51 -21.803 5.474 2.189 1.00 3.47 H new ATOM 0 HE2 LYS A 51 -21.126 3.226 0.242 1.00 4.57 H new ATOM 0 HE3 LYS A 51 -22.387 3.134 1.455 1.00 4.57 H new ATOM 0 HZ1 LYS A 51 -23.404 3.739 -0.551 1.00 6.01 H new ATOM 0 HZ2 LYS A 51 -23.372 5.154 0.387 1.00 6.01 H new ATOM 0 HZ3 LYS A 51 -22.259 4.949 -0.879 1.00 6.01 H new ATOM 826 N ASP A 52 -18.488 7.922 -0.531 1.00 1.55 N ATOM 827 CA ASP A 52 -18.309 9.335 -0.807 1.00 1.72 C ATOM 828 C ASP A 52 -17.038 9.550 -1.624 1.00 1.41 C ATOM 829 O ASP A 52 -16.080 10.214 -1.228 1.00 1.56 O ATOM 830 CB ASP A 52 -18.423 10.254 0.410 1.00 2.29 C ATOM 831 CG ASP A 52 -18.398 11.712 -0.042 1.00 3.45 C ATOM 832 OD1 ASP A 52 -18.448 11.948 -1.274 1.00 4.82 O ATOM 833 OD2 ASP A 52 -18.310 12.582 0.847 1.00 3.84 O ATOM 0 H ASP A 52 -19.383 7.567 -0.867 1.00 1.55 H new ATOM 0 HA ASP A 52 -19.161 9.646 -1.412 1.00 1.72 H new ATOM 0 HB2 ASP A 52 -19.347 10.046 0.949 1.00 2.29 H new ATOM 0 HB3 ASP A 52 -17.601 10.063 1.100 1.00 2.29 H new ATOM 838 N VAL A 53 -17.112 9.023 -2.842 1.00 1.31 N ATOM 839 CA VAL A 53 -16.230 9.385 -3.935 1.00 1.28 C ATOM 840 C VAL A 53 -16.477 10.831 -4.409 1.00 1.42 C ATOM 841 O VAL A 53 -15.771 11.302 -5.300 1.00 1.68 O ATOM 842 CB VAL A 53 -16.398 8.362 -5.074 1.00 1.34 C ATOM 843 CG1 VAL A 53 -16.112 6.938 -4.572 1.00 2.00 C ATOM 844 CG2 VAL A 53 -17.792 8.399 -5.715 1.00 1.79 C ATOM 0 H VAL A 53 -17.803 8.318 -3.097 1.00 1.31 H new ATOM 0 HA VAL A 53 -15.197 9.357 -3.589 1.00 1.28 H new ATOM 0 HB VAL A 53 -15.675 8.643 -5.839 1.00 1.34 H new ATOM 0 HG11 VAL A 53 -16.236 6.231 -5.392 1.00 2.00 H new ATOM 0 HG12 VAL A 53 -15.090 6.883 -4.197 1.00 2.00 H new ATOM 0 HG13 VAL A 53 -16.807 6.689 -3.770 1.00 2.00 H new ATOM 0 HG21 VAL A 53 -17.847 7.655 -6.510 1.00 1.79 H new ATOM 0 HG22 VAL A 53 -18.546 8.178 -4.959 1.00 1.79 H new ATOM 0 HG23 VAL A 53 -17.975 9.390 -6.131 1.00 1.79 H new ATOM 854 N GLY A 54 -17.467 11.546 -3.850 1.00 1.44 N ATOM 855 CA GLY A 54 -17.723 12.934 -4.183 1.00 1.69 C ATOM 856 C GLY A 54 -16.660 13.787 -3.507 1.00 1.54 C ATOM 857 O GLY A 54 -15.916 14.499 -4.182 1.00 1.75 O ATOM 0 H GLY A 54 -18.108 11.165 -3.154 1.00 1.44 H new ATOM 0 HA2 GLY A 54 -17.696 13.077 -5.263 1.00 1.69 H new ATOM 0 HA3 GLY A 54 -18.717 13.229 -3.847 1.00 1.69 H new ATOM 861 N SER A 55 -16.542 13.656 -2.182 1.00 1.34 N ATOM 862 CA SER A 55 -15.508 14.283 -1.364 1.00 1.28 C ATOM 863 C SER A 55 -14.158 13.578 -1.565 1.00 1.18 C ATOM 864 O SER A 55 -13.473 13.196 -0.613 1.00 1.27 O ATOM 865 CB SER A 55 -15.944 14.282 0.108 1.00 1.38 C ATOM 866 OG SER A 55 -15.065 15.069 0.894 1.00 2.10 O ATOM 0 H SER A 55 -17.189 13.089 -1.633 1.00 1.34 H new ATOM 0 HA SER A 55 -15.376 15.319 -1.676 1.00 1.28 H new ATOM 0 HB2 SER A 55 -16.959 14.670 0.191 1.00 1.38 H new ATOM 0 HB3 SER A 55 -15.961 13.260 0.486 1.00 1.38 H new ATOM 0 HG SER A 55 -14.157 14.704 0.834 1.00 2.10 H new ATOM 872 N LEU A 56 -13.748 13.431 -2.822 1.00 1.16 N ATOM 873 CA LEU A 56 -12.435 12.987 -3.217 1.00 1.11 C ATOM 874 C LEU A 56 -11.446 14.105 -2.931 1.00 1.03 C ATOM 875 O LEU A 56 -10.369 13.866 -2.406 1.00 0.95 O ATOM 876 CB LEU A 56 -12.505 12.686 -4.716 1.00 1.19 C ATOM 877 CG LEU A 56 -11.195 12.268 -5.394 1.00 1.19 C ATOM 878 CD1 LEU A 56 -10.267 13.431 -5.770 1.00 1.14 C ATOM 879 CD2 LEU A 56 -10.468 11.250 -4.524 1.00 1.20 C ATOM 0 H LEU A 56 -14.354 13.629 -3.618 1.00 1.16 H new ATOM 0 HA LEU A 56 -12.114 12.098 -2.674 1.00 1.11 H new ATOM 0 HB2 LEU A 56 -13.237 11.893 -4.870 1.00 1.19 H new ATOM 0 HB3 LEU A 56 -12.884 13.573 -5.224 1.00 1.19 H new ATOM 0 HG LEU A 56 -11.477 11.819 -6.346 1.00 1.19 H new ATOM 0 HD11 LEU A 56 -9.367 13.040 -6.243 1.00 1.14 H new ATOM 0 HD12 LEU A 56 -10.781 14.097 -6.463 1.00 1.14 H new ATOM 0 HD13 LEU A 56 -9.993 13.983 -4.871 1.00 1.14 H new ATOM 0 HD21 LEU A 56 -9.537 10.955 -5.009 1.00 1.20 H new ATOM 0 HD22 LEU A 56 -10.246 11.693 -3.553 1.00 1.20 H new ATOM 0 HD23 LEU A 56 -11.099 10.372 -4.386 1.00 1.20 H new ATOM 891 N ASP A 57 -11.800 15.332 -3.303 1.00 1.20 N ATOM 892 CA ASP A 57 -10.883 16.459 -3.414 1.00 1.47 C ATOM 893 C ASP A 57 -10.182 16.710 -2.067 1.00 1.45 C ATOM 894 O ASP A 57 -8.980 16.973 -2.001 1.00 1.49 O ATOM 895 CB ASP A 57 -11.655 17.671 -3.974 1.00 1.94 C ATOM 896 CG ASP A 57 -12.617 17.258 -5.091 1.00 3.31 C ATOM 897 OD1 ASP A 57 -13.629 16.605 -4.749 1.00 3.78 O ATOM 898 OD2 ASP A 57 -12.342 17.463 -6.294 1.00 4.72 O ATOM 0 H ASP A 57 -12.761 15.575 -3.542 1.00 1.20 H new ATOM 0 HA ASP A 57 -10.077 16.249 -4.117 1.00 1.47 H new ATOM 0 HB2 ASP A 57 -12.214 18.150 -3.170 1.00 1.94 H new ATOM 0 HB3 ASP A 57 -10.949 18.409 -4.355 1.00 1.94 H new ATOM 903 N GLU A 58 -10.933 16.547 -0.975 1.00 1.47 N ATOM 904 CA GLU A 58 -10.409 16.485 0.383 1.00 1.52 C ATOM 905 C GLU A 58 -9.318 15.415 0.521 1.00 1.30 C ATOM 906 O GLU A 58 -8.213 15.706 0.988 1.00 1.36 O ATOM 907 CB GLU A 58 -11.578 16.204 1.336 1.00 1.68 C ATOM 908 CG GLU A 58 -11.114 16.011 2.784 1.00 1.98 C ATOM 909 CD GLU A 58 -12.292 15.669 3.681 1.00 2.21 C ATOM 910 OE1 GLU A 58 -12.744 14.506 3.579 1.00 2.34 O ATOM 911 OE2 GLU A 58 -12.726 16.573 4.422 1.00 3.16 O ATOM 0 H GLU A 58 -11.948 16.453 -1.017 1.00 1.47 H new ATOM 0 HA GLU A 58 -9.942 17.437 0.634 1.00 1.52 H new ATOM 0 HB2 GLU A 58 -12.287 17.030 1.291 1.00 1.68 H new ATOM 0 HB3 GLU A 58 -12.108 15.311 1.004 1.00 1.68 H new ATOM 0 HG2 GLU A 58 -10.371 15.215 2.831 1.00 1.98 H new ATOM 0 HG3 GLU A 58 -10.630 16.920 3.141 1.00 1.98 H new ATOM 918 N LYS A 59 -9.634 14.170 0.148 1.00 1.08 N ATOM 919 CA LYS A 59 -8.683 13.072 0.219 1.00 0.96 C ATOM 920 C LYS A 59 -7.455 13.470 -0.595 1.00 0.88 C ATOM 921 O LYS A 59 -6.351 13.433 -0.069 1.00 0.89 O ATOM 922 CB LYS A 59 -9.273 11.732 -0.276 1.00 0.94 C ATOM 923 CG LYS A 59 -9.829 10.790 0.810 1.00 1.27 C ATOM 924 CD LYS A 59 -11.342 10.911 1.054 1.00 1.46 C ATOM 925 CE LYS A 59 -11.675 12.077 2.003 1.00 2.00 C ATOM 926 NZ LYS A 59 -13.093 12.490 1.959 1.00 2.92 N ATOM 0 H LYS A 59 -10.552 13.903 -0.208 1.00 1.08 H new ATOM 0 HA LYS A 59 -8.416 12.900 1.262 1.00 0.96 H new ATOM 0 HB2 LYS A 59 -10.074 11.951 -0.982 1.00 0.94 H new ATOM 0 HB3 LYS A 59 -8.498 11.199 -0.827 1.00 0.94 H new ATOM 0 HG2 LYS A 59 -9.601 9.761 0.530 1.00 1.27 H new ATOM 0 HG3 LYS A 59 -9.307 10.989 1.746 1.00 1.27 H new ATOM 0 HD2 LYS A 59 -11.853 11.059 0.103 1.00 1.46 H new ATOM 0 HD3 LYS A 59 -11.718 9.979 1.477 1.00 1.46 H new ATOM 0 HE2 LYS A 59 -11.421 11.788 3.023 1.00 2.00 H new ATOM 0 HE3 LYS A 59 -11.048 12.932 1.748 1.00 2.00 H new ATOM 0 HZ1 LYS A 59 -13.219 13.360 2.515 1.00 2.92 H new ATOM 0 HZ2 LYS A 59 -13.373 12.666 0.973 1.00 2.92 H new ATOM 0 HZ3 LYS A 59 -13.687 11.735 2.358 1.00 2.92 H new ATOM 940 N MET A 60 -7.639 13.903 -1.843 1.00 0.94 N ATOM 941 CA MET A 60 -6.553 14.352 -2.706 1.00 0.99 C ATOM 942 C MET A 60 -5.627 15.314 -1.955 1.00 1.00 C ATOM 943 O MET A 60 -4.428 15.060 -1.870 1.00 0.95 O ATOM 944 CB MET A 60 -7.120 14.929 -4.014 1.00 1.21 C ATOM 945 CG MET A 60 -6.087 15.738 -4.805 1.00 1.13 C ATOM 946 SD MET A 60 -6.033 17.513 -4.434 1.00 1.27 S ATOM 947 CE MET A 60 -4.558 17.987 -5.359 1.00 1.49 C ATOM 0 H MET A 60 -8.557 13.951 -2.285 1.00 0.94 H new ATOM 0 HA MET A 60 -5.931 13.503 -2.989 1.00 0.99 H new ATOM 0 HB2 MET A 60 -7.489 14.113 -4.636 1.00 1.21 H new ATOM 0 HB3 MET A 60 -7.974 15.566 -3.784 1.00 1.21 H new ATOM 0 HG2 MET A 60 -5.100 15.315 -4.618 1.00 1.13 H new ATOM 0 HG3 MET A 60 -6.291 15.613 -5.868 1.00 1.13 H new ATOM 0 HE1 MET A 60 -4.380 19.056 -5.238 1.00 1.49 H new ATOM 0 HE2 MET A 60 -3.699 17.431 -4.984 1.00 1.49 H new ATOM 0 HE3 MET A 60 -4.703 17.761 -6.415 1.00 1.49 H new ATOM 957 N LYS A 61 -6.178 16.378 -1.364 1.00 1.13 N ATOM 958 CA LYS A 61 -5.383 17.328 -0.590 1.00 1.21 C ATOM 959 C LYS A 61 -4.660 16.675 0.597 1.00 1.15 C ATOM 960 O LYS A 61 -3.652 17.207 1.063 1.00 1.19 O ATOM 961 CB LYS A 61 -6.275 18.468 -0.091 1.00 1.35 C ATOM 962 CG LYS A 61 -6.701 19.408 -1.223 1.00 1.81 C ATOM 963 CD LYS A 61 -7.260 20.743 -0.708 1.00 1.99 C ATOM 964 CE LYS A 61 -8.489 20.599 0.206 1.00 1.80 C ATOM 965 NZ LYS A 61 -8.139 20.258 1.603 1.00 3.23 N ATOM 0 H LYS A 61 -7.172 16.601 -1.408 1.00 1.13 H new ATOM 0 HA LYS A 61 -4.614 17.716 -1.257 1.00 1.21 H new ATOM 0 HB2 LYS A 61 -7.162 18.051 0.386 1.00 1.35 H new ATOM 0 HB3 LYS A 61 -5.742 19.037 0.670 1.00 1.35 H new ATOM 0 HG2 LYS A 61 -5.845 19.603 -1.869 1.00 1.81 H new ATOM 0 HG3 LYS A 61 -7.456 18.914 -1.834 1.00 1.81 H new ATOM 0 HD2 LYS A 61 -6.475 21.267 -0.163 1.00 1.99 H new ATOM 0 HD3 LYS A 61 -7.526 21.366 -1.562 1.00 1.99 H new ATOM 0 HE2 LYS A 61 -9.052 21.532 0.197 1.00 1.80 H new ATOM 0 HE3 LYS A 61 -9.145 19.827 -0.196 1.00 1.80 H new ATOM 0 HZ1 LYS A 61 -8.446 19.286 1.810 1.00 3.23 H new ATOM 0 HZ2 LYS A 61 -7.109 20.331 1.731 1.00 3.23 H new ATOM 0 HZ3 LYS A 61 -8.615 20.917 2.251 1.00 3.23 H new ATOM 979 N SER A 62 -5.194 15.570 1.120 1.00 1.16 N ATOM 980 CA SER A 62 -4.600 14.821 2.219 1.00 1.12 C ATOM 981 C SER A 62 -3.460 13.914 1.730 1.00 0.99 C ATOM 982 O SER A 62 -2.385 13.907 2.326 1.00 1.13 O ATOM 983 CB SER A 62 -5.685 14.023 2.953 1.00 1.20 C ATOM 984 OG SER A 62 -6.795 14.853 3.247 1.00 2.30 O ATOM 0 H SER A 62 -6.068 15.166 0.782 1.00 1.16 H new ATOM 0 HA SER A 62 -4.158 15.527 2.922 1.00 1.12 H new ATOM 0 HB2 SER A 62 -6.005 13.181 2.338 1.00 1.20 H new ATOM 0 HB3 SER A 62 -5.279 13.608 3.875 1.00 1.20 H new ATOM 0 HG SER A 62 -7.268 15.073 2.417 1.00 2.30 H new ATOM 990 N LEU A 63 -3.682 13.133 0.663 1.00 0.90 N ATOM 991 CA LEU A 63 -2.643 12.278 0.089 1.00 0.97 C ATOM 992 C LEU A 63 -1.496 13.144 -0.412 1.00 0.98 C ATOM 993 O LEU A 63 -0.328 12.857 -0.146 1.00 1.02 O ATOM 994 CB LEU A 63 -3.143 11.460 -1.109 1.00 1.09 C ATOM 995 CG LEU A 63 -4.038 10.263 -0.774 1.00 1.18 C ATOM 996 CD1 LEU A 63 -5.484 10.695 -0.575 1.00 1.60 C ATOM 997 CD2 LEU A 63 -4.033 9.309 -1.966 1.00 1.34 C ATOM 0 H LEU A 63 -4.579 13.079 0.180 1.00 0.90 H new ATOM 0 HA LEU A 63 -2.332 11.595 0.879 1.00 0.97 H new ATOM 0 HB2 LEU A 63 -3.693 12.125 -1.775 1.00 1.09 H new ATOM 0 HB3 LEU A 63 -2.277 11.098 -1.664 1.00 1.09 H new ATOM 0 HG LEU A 63 -3.658 9.801 0.137 1.00 1.18 H new ATOM 0 HD11 LEU A 63 -6.095 9.824 -0.339 1.00 1.60 H new ATOM 0 HD12 LEU A 63 -5.540 11.411 0.245 1.00 1.60 H new ATOM 0 HD13 LEU A 63 -5.854 11.160 -1.489 1.00 1.60 H new ATOM 0 HD21 LEU A 63 -4.666 8.449 -1.746 1.00 1.34 H new ATOM 0 HD22 LEU A 63 -4.415 9.825 -2.847 1.00 1.34 H new ATOM 0 HD23 LEU A 63 -3.015 8.971 -2.157 1.00 1.34 H new ATOM 1009 N ASP A 64 -1.836 14.184 -1.176 1.00 0.99 N ATOM 1010 CA ASP A 64 -0.868 15.107 -1.729 1.00 1.01 C ATOM 1011 C ASP A 64 -0.378 16.004 -0.597 1.00 1.10 C ATOM 1012 O ASP A 64 -0.749 17.167 -0.525 1.00 1.22 O ATOM 1013 CB ASP A 64 -1.497 15.906 -2.884 1.00 1.04 C ATOM 1014 CG ASP A 64 -0.417 16.447 -3.800 1.00 1.26 C ATOM 1015 OD1 ASP A 64 0.425 15.624 -4.216 1.00 1.90 O ATOM 1016 OD2 ASP A 64 -0.401 17.660 -4.085 1.00 1.62 O ATOM 0 H ASP A 64 -2.801 14.403 -1.425 1.00 0.99 H new ATOM 0 HA ASP A 64 -0.014 14.577 -2.151 1.00 1.01 H new ATOM 0 HB2 ASP A 64 -2.176 15.268 -3.449 1.00 1.04 H new ATOM 0 HB3 ASP A 64 -2.090 16.729 -2.485 1.00 1.04 H new ATOM 1021 N VAL A 65 0.444 15.461 0.304 1.00 1.14 N ATOM 1022 CA VAL A 65 0.905 16.136 1.518 1.00 1.29 C ATOM 1023 C VAL A 65 1.453 17.547 1.252 1.00 1.28 C ATOM 1024 O VAL A 65 1.383 18.419 2.114 1.00 1.40 O ATOM 1025 CB VAL A 65 1.944 15.263 2.249 1.00 1.44 C ATOM 1026 CG1 VAL A 65 1.306 13.985 2.809 1.00 1.79 C ATOM 1027 CG2 VAL A 65 3.140 14.885 1.360 1.00 1.48 C ATOM 0 H VAL A 65 0.816 14.516 0.206 1.00 1.14 H new ATOM 0 HA VAL A 65 0.035 16.269 2.161 1.00 1.29 H new ATOM 0 HB VAL A 65 2.317 15.875 3.070 1.00 1.44 H new ATOM 0 HG11 VAL A 65 2.066 13.392 3.318 1.00 1.79 H new ATOM 0 HG12 VAL A 65 0.519 14.250 3.515 1.00 1.79 H new ATOM 0 HG13 VAL A 65 0.879 13.403 1.992 1.00 1.79 H new ATOM 0 HG21 VAL A 65 3.837 14.271 1.930 1.00 1.48 H new ATOM 0 HG22 VAL A 65 2.787 14.325 0.494 1.00 1.48 H new ATOM 0 HG23 VAL A 65 3.645 15.791 1.025 1.00 1.48 H new ATOM 1037 N ASN A 66 2.021 17.753 0.063 1.00 1.21 N ATOM 1038 CA ASN A 66 2.601 19.012 -0.402 1.00 1.24 C ATOM 1039 C ASN A 66 1.568 19.928 -1.064 1.00 1.25 C ATOM 1040 O ASN A 66 1.808 21.129 -1.145 1.00 1.42 O ATOM 1041 CB ASN A 66 3.784 18.745 -1.351 1.00 1.29 C ATOM 1042 CG ASN A 66 3.601 17.468 -2.167 1.00 1.41 C ATOM 1043 OD1 ASN A 66 2.577 17.256 -2.818 1.00 1.19 O ATOM 1044 ND2 ASN A 66 4.531 16.529 -2.045 1.00 2.54 N ATOM 0 H ASN A 66 2.092 17.012 -0.634 1.00 1.21 H new ATOM 0 HA ASN A 66 2.967 19.538 0.480 1.00 1.24 H new ATOM 0 HB2 ASN A 66 3.901 19.591 -2.028 1.00 1.29 H new ATOM 0 HB3 ASN A 66 4.703 18.672 -0.770 1.00 1.29 H new ATOM 0 HD21 ASN A 66 4.401 15.622 -2.493 1.00 2.54 H new ATOM 0 HD22 ASN A 66 5.375 16.715 -1.504 1.00 2.54 H new ATOM 1051 N GLN A 67 0.440 19.389 -1.539 1.00 1.18 N ATOM 1052 CA GLN A 67 -0.590 20.129 -2.259 1.00 1.23 C ATOM 1053 C GLN A 67 0.042 20.840 -3.460 1.00 1.24 C ATOM 1054 O GLN A 67 -0.147 22.035 -3.677 1.00 1.36 O ATOM 1055 CB GLN A 67 -1.417 21.003 -1.299 1.00 1.40 C ATOM 1056 CG GLN A 67 -2.225 20.059 -0.391 1.00 2.34 C ATOM 1057 CD GLN A 67 -3.010 20.742 0.719 1.00 2.62 C ATOM 1058 OE1 GLN A 67 -3.229 21.949 0.715 1.00 2.54 O ATOM 1059 NE2 GLN A 67 -3.457 19.953 1.693 1.00 3.92 N ATOM 0 H GLN A 67 0.217 18.400 -1.428 1.00 1.18 H new ATOM 0 HA GLN A 67 -1.335 19.457 -2.686 1.00 1.23 H new ATOM 0 HB2 GLN A 67 -0.764 21.641 -0.704 1.00 1.40 H new ATOM 0 HB3 GLN A 67 -2.083 21.661 -1.857 1.00 1.40 H new ATOM 0 HG2 GLN A 67 -2.920 19.492 -1.010 1.00 2.34 H new ATOM 0 HG3 GLN A 67 -1.541 19.340 0.059 1.00 2.34 H new ATOM 0 HE21 GLN A 67 -3.260 18.953 1.670 1.00 3.92 H new ATOM 0 HE22 GLN A 67 -3.997 20.349 2.462 1.00 3.92 H new ATOM 1068 N ASP A 68 0.787 20.048 -4.239 1.00 1.26 N ATOM 1069 CA ASP A 68 1.376 20.417 -5.521 1.00 1.35 C ATOM 1070 C ASP A 68 0.451 20.009 -6.679 1.00 1.47 C ATOM 1071 O ASP A 68 0.602 20.524 -7.785 1.00 1.94 O ATOM 1072 CB ASP A 68 2.800 19.837 -5.663 1.00 1.40 C ATOM 1073 CG ASP A 68 2.860 18.319 -5.691 1.00 1.33 C ATOM 1074 OD1 ASP A 68 1.874 17.651 -6.047 1.00 1.31 O ATOM 1075 OD2 ASP A 68 3.831 17.686 -5.227 1.00 1.42 O ATOM 0 H ASP A 68 1.003 19.087 -3.975 1.00 1.26 H new ATOM 0 HA ASP A 68 1.477 21.502 -5.562 1.00 1.35 H new ATOM 0 HB2 ASP A 68 3.247 20.223 -6.579 1.00 1.40 H new ATOM 0 HB3 ASP A 68 3.410 20.197 -4.835 1.00 1.40 H new ATOM 1080 N SER A 69 -0.502 19.100 -6.436 1.00 1.34 N ATOM 1081 CA SER A 69 -1.464 18.605 -7.412 1.00 1.37 C ATOM 1082 C SER A 69 -0.837 17.707 -8.486 1.00 1.34 C ATOM 1083 O SER A 69 -1.491 17.429 -9.491 1.00 1.39 O ATOM 1084 CB SER A 69 -2.295 19.747 -8.014 1.00 1.43 C ATOM 1085 OG SER A 69 -2.883 20.518 -6.981 1.00 1.79 O ATOM 0 H SER A 69 -0.623 18.677 -5.516 1.00 1.34 H new ATOM 0 HA SER A 69 -2.149 17.958 -6.864 1.00 1.37 H new ATOM 0 HB2 SER A 69 -1.661 20.380 -8.635 1.00 1.43 H new ATOM 0 HB3 SER A 69 -3.072 19.340 -8.662 1.00 1.43 H new ATOM 0 HG SER A 69 -3.410 21.245 -7.375 1.00 1.79 H new ATOM 1091 N GLU A 70 0.372 17.191 -8.244 1.00 1.33 N ATOM 1092 CA GLU A 70 0.864 15.971 -8.868 1.00 1.27 C ATOM 1093 C GLU A 70 0.829 14.941 -7.747 1.00 1.08 C ATOM 1094 O GLU A 70 1.675 15.008 -6.854 1.00 1.16 O ATOM 1095 CB GLU A 70 2.319 16.107 -9.381 1.00 1.49 C ATOM 1096 CG GLU A 70 2.447 16.311 -10.904 1.00 1.92 C ATOM 1097 CD GLU A 70 3.791 15.837 -11.479 1.00 2.76 C ATOM 1098 OE1 GLU A 70 4.279 14.766 -11.043 1.00 3.79 O ATOM 1099 OE2 GLU A 70 4.295 16.527 -12.391 1.00 3.19 O ATOM 0 H GLU A 70 1.040 17.618 -7.601 1.00 1.33 H new ATOM 0 HA GLU A 70 0.260 15.711 -9.738 1.00 1.27 H new ATOM 0 HB2 GLU A 70 2.792 16.948 -8.874 1.00 1.49 H new ATOM 0 HB3 GLU A 70 2.874 15.212 -9.100 1.00 1.49 H new ATOM 0 HG2 GLU A 70 1.639 15.775 -11.403 1.00 1.92 H new ATOM 0 HG3 GLU A 70 2.317 17.369 -11.132 1.00 1.92 H new ATOM 1106 N LEU A 71 -0.099 13.983 -7.778 1.00 0.87 N ATOM 1107 CA LEU A 71 -0.059 12.870 -6.841 1.00 0.76 C ATOM 1108 C LEU A 71 0.932 11.905 -7.479 1.00 0.77 C ATOM 1109 O LEU A 71 0.595 11.204 -8.436 1.00 0.72 O ATOM 1110 CB LEU A 71 -1.439 12.210 -6.698 1.00 0.70 C ATOM 1111 CG LEU A 71 -2.510 12.964 -5.896 1.00 0.79 C ATOM 1112 CD1 LEU A 71 -2.416 12.693 -4.387 1.00 0.80 C ATOM 1113 CD2 LEU A 71 -2.537 14.457 -6.238 1.00 1.03 C ATOM 0 H LEU A 71 -0.878 13.959 -8.436 1.00 0.87 H new ATOM 0 HA LEU A 71 0.226 13.179 -5.836 1.00 0.76 H new ATOM 0 HB2 LEU A 71 -1.832 12.033 -7.699 1.00 0.70 H new ATOM 0 HB3 LEU A 71 -1.298 11.234 -6.234 1.00 0.70 H new ATOM 0 HG LEU A 71 -3.476 12.564 -6.205 1.00 0.79 H new ATOM 0 HD11 LEU A 71 -3.196 13.250 -3.868 1.00 0.80 H new ATOM 0 HD12 LEU A 71 -2.546 11.627 -4.200 1.00 0.80 H new ATOM 0 HD13 LEU A 71 -1.439 13.009 -4.021 1.00 0.80 H new ATOM 0 HD21 LEU A 71 -3.309 14.951 -5.648 1.00 1.03 H new ATOM 0 HD22 LEU A 71 -1.567 14.900 -6.011 1.00 1.03 H new ATOM 0 HD23 LEU A 71 -2.754 14.583 -7.299 1.00 1.03 H new ATOM 1125 N LYS A 72 2.191 11.949 -7.050 1.00 0.93 N ATOM 1126 CA LYS A 72 3.211 11.029 -7.520 1.00 1.05 C ATOM 1127 C LYS A 72 2.818 9.619 -7.068 1.00 0.99 C ATOM 1128 O LYS A 72 2.029 9.480 -6.132 1.00 0.95 O ATOM 1129 CB LYS A 72 4.563 11.448 -6.921 1.00 1.43 C ATOM 1130 CG LYS A 72 5.776 10.894 -7.688 1.00 1.88 C ATOM 1131 CD LYS A 72 6.559 12.000 -8.418 1.00 2.27 C ATOM 1132 CE LYS A 72 5.767 12.796 -9.474 1.00 3.22 C ATOM 1133 NZ LYS A 72 5.432 12.025 -10.688 1.00 5.17 N ATOM 0 H LYS A 72 2.528 12.626 -6.366 1.00 0.93 H new ATOM 0 HA LYS A 72 3.297 11.044 -8.607 1.00 1.05 H new ATOM 0 HB2 LYS A 72 4.621 12.536 -6.903 1.00 1.43 H new ATOM 0 HB3 LYS A 72 4.613 11.109 -5.886 1.00 1.43 H new ATOM 0 HG2 LYS A 72 6.440 10.381 -6.992 1.00 1.88 H new ATOM 0 HG3 LYS A 72 5.438 10.153 -8.412 1.00 1.88 H new ATOM 0 HD2 LYS A 72 6.942 12.699 -7.675 1.00 2.27 H new ATOM 0 HD3 LYS A 72 7.423 11.547 -8.904 1.00 2.27 H new ATOM 0 HE2 LYS A 72 4.844 13.159 -9.022 1.00 3.22 H new ATOM 0 HE3 LYS A 72 6.347 13.672 -9.762 1.00 3.22 H new ATOM 0 HZ1 LYS A 72 5.199 12.680 -11.462 1.00 5.17 H new ATOM 0 HZ2 LYS A 72 6.246 11.439 -10.963 1.00 5.17 H new ATOM 0 HZ3 LYS A 72 4.614 11.412 -10.495 1.00 5.17 H new ATOM 1147 N PHE A 73 3.398 8.579 -7.682 1.00 1.11 N ATOM 1148 CA PHE A 73 3.177 7.186 -7.296 1.00 1.12 C ATOM 1149 C PHE A 73 3.110 7.026 -5.777 1.00 0.95 C ATOM 1150 O PHE A 73 2.149 6.475 -5.257 1.00 0.94 O ATOM 1151 CB PHE A 73 4.278 6.279 -7.867 1.00 1.33 C ATOM 1152 CG PHE A 73 4.101 4.821 -7.481 1.00 2.90 C ATOM 1153 CD1 PHE A 73 3.145 4.046 -8.160 1.00 4.29 C ATOM 1154 CD2 PHE A 73 4.752 4.286 -6.351 1.00 4.15 C ATOM 1155 CE1 PHE A 73 2.839 2.748 -7.722 1.00 6.00 C ATOM 1156 CE2 PHE A 73 4.436 2.989 -5.903 1.00 5.93 C ATOM 1157 CZ PHE A 73 3.482 2.221 -6.591 1.00 6.64 C ATOM 0 H PHE A 73 4.039 8.686 -8.468 1.00 1.11 H new ATOM 0 HA PHE A 73 2.216 6.885 -7.714 1.00 1.12 H new ATOM 0 HB2 PHE A 73 4.284 6.364 -8.954 1.00 1.33 H new ATOM 0 HB3 PHE A 73 5.249 6.628 -7.514 1.00 1.33 H new ATOM 0 HD1 PHE A 73 2.642 4.452 -9.025 1.00 4.29 H new ATOM 0 HD2 PHE A 73 5.494 4.871 -5.828 1.00 4.15 H new ATOM 0 HE1 PHE A 73 2.110 2.156 -8.255 1.00 6.00 H new ATOM 0 HE2 PHE A 73 4.927 2.585 -5.030 1.00 5.93 H new ATOM 0 HZ PHE A 73 3.243 1.225 -6.250 1.00 6.64 H new ATOM 1167 N ASN A 74 4.120 7.533 -5.064 1.00 0.84 N ATOM 1168 CA ASN A 74 4.218 7.376 -3.618 1.00 0.74 C ATOM 1169 C ASN A 74 3.122 8.117 -2.848 1.00 0.77 C ATOM 1170 O ASN A 74 2.778 7.718 -1.737 1.00 0.85 O ATOM 1171 CB ASN A 74 5.595 7.843 -3.147 1.00 0.67 C ATOM 1172 CG ASN A 74 5.808 7.580 -1.661 1.00 0.95 C ATOM 1173 OD1 ASN A 74 6.148 8.476 -0.899 1.00 1.73 O ATOM 1174 ND2 ASN A 74 5.677 6.324 -1.244 1.00 2.62 N ATOM 0 H ASN A 74 4.889 8.062 -5.476 1.00 0.84 H new ATOM 0 HA ASN A 74 4.079 6.316 -3.405 1.00 0.74 H new ATOM 0 HB2 ASN A 74 6.368 7.331 -3.720 1.00 0.67 H new ATOM 0 HB3 ASN A 74 5.704 8.909 -3.346 1.00 0.67 H new ATOM 0 HD21 ASN A 74 5.861 6.089 -0.269 1.00 2.62 H new ATOM 0 HD22 ASN A 74 5.392 5.596 -1.899 1.00 2.62 H new ATOM 1181 N GLU A 75 2.597 9.202 -3.415 1.00 0.83 N ATOM 1182 CA GLU A 75 1.540 9.978 -2.797 1.00 0.81 C ATOM 1183 C GLU A 75 0.220 9.247 -3.050 1.00 0.81 C ATOM 1184 O GLU A 75 -0.455 8.852 -2.104 1.00 0.93 O ATOM 1185 CB GLU A 75 1.571 11.411 -3.348 1.00 0.81 C ATOM 1186 CG GLU A 75 2.929 12.079 -3.061 1.00 1.03 C ATOM 1187 CD GLU A 75 3.043 13.432 -3.735 1.00 1.12 C ATOM 1188 OE1 GLU A 75 2.877 13.539 -4.963 1.00 2.02 O ATOM 1189 OE2 GLU A 75 3.251 14.472 -3.084 1.00 1.90 O ATOM 0 H GLU A 75 2.899 9.563 -4.320 1.00 0.83 H new ATOM 0 HA GLU A 75 1.669 10.069 -1.718 1.00 0.81 H new ATOM 0 HB2 GLU A 75 1.388 11.396 -4.422 1.00 0.81 H new ATOM 0 HB3 GLU A 75 0.770 11.996 -2.896 1.00 0.81 H new ATOM 0 HG2 GLU A 75 3.056 12.197 -1.985 1.00 1.03 H new ATOM 0 HG3 GLU A 75 3.734 11.431 -3.408 1.00 1.03 H new ATOM 1196 N TYR A 76 -0.102 8.995 -4.324 1.00 0.78 N ATOM 1197 CA TYR A 76 -1.244 8.183 -4.743 1.00 0.81 C ATOM 1198 C TYR A 76 -1.334 6.893 -3.928 1.00 0.82 C ATOM 1199 O TYR A 76 -2.388 6.568 -3.383 1.00 0.82 O ATOM 1200 CB TYR A 76 -1.114 7.867 -6.241 1.00 0.82 C ATOM 1201 CG TYR A 76 -2.000 6.733 -6.726 1.00 1.14 C ATOM 1202 CD1 TYR A 76 -3.369 6.953 -6.950 1.00 1.65 C ATOM 1203 CD2 TYR A 76 -1.472 5.437 -6.880 1.00 2.74 C ATOM 1204 CE1 TYR A 76 -4.190 5.914 -7.418 1.00 1.91 C ATOM 1205 CE2 TYR A 76 -2.298 4.391 -7.326 1.00 3.26 C ATOM 1206 CZ TYR A 76 -3.651 4.632 -7.616 1.00 2.32 C ATOM 1207 OH TYR A 76 -4.424 3.625 -8.110 1.00 3.00 O ATOM 0 H TYR A 76 0.438 9.360 -5.108 1.00 0.78 H new ATOM 0 HA TYR A 76 -2.161 8.745 -4.566 1.00 0.81 H new ATOM 0 HB2 TYR A 76 -1.352 8.765 -6.811 1.00 0.82 H new ATOM 0 HB3 TYR A 76 -0.075 7.617 -6.458 1.00 0.82 H new ATOM 0 HD1 TYR A 76 -3.793 7.928 -6.761 1.00 1.65 H new ATOM 0 HD2 TYR A 76 -0.433 5.247 -6.656 1.00 2.74 H new ATOM 0 HE1 TYR A 76 -5.233 6.100 -7.625 1.00 1.91 H new ATOM 0 HE2 TYR A 76 -1.891 3.398 -7.446 1.00 3.26 H new ATOM 0 HH TYR A 76 -3.889 2.807 -8.183 1.00 3.00 H new ATOM 1217 N TRP A 77 -0.207 6.182 -3.852 1.00 0.85 N ATOM 1218 CA TRP A 77 -0.020 4.937 -3.128 1.00 0.83 C ATOM 1219 C TRP A 77 -0.745 4.950 -1.779 1.00 0.82 C ATOM 1220 O TRP A 77 -1.363 3.947 -1.432 1.00 0.82 O ATOM 1221 CB TRP A 77 1.486 4.657 -2.988 1.00 0.81 C ATOM 1222 CG TRP A 77 1.891 3.878 -1.785 1.00 0.79 C ATOM 1223 CD1 TRP A 77 2.295 4.434 -0.623 1.00 1.86 C ATOM 1224 CD2 TRP A 77 1.838 2.443 -1.542 1.00 1.64 C ATOM 1225 NE1 TRP A 77 2.495 3.462 0.319 1.00 1.88 N ATOM 1226 CE2 TRP A 77 2.238 2.220 -0.193 1.00 1.39 C ATOM 1227 CE3 TRP A 77 1.471 1.306 -2.296 1.00 3.34 C ATOM 1228 CZ2 TRP A 77 2.284 0.954 0.381 1.00 2.17 C ATOM 1229 CZ3 TRP A 77 1.463 0.030 -1.701 1.00 4.13 C ATOM 1230 CH2 TRP A 77 1.873 -0.142 -0.377 1.00 3.54 C ATOM 0 H TRP A 77 0.645 6.483 -4.324 1.00 0.85 H new ATOM 0 HA TRP A 77 -0.470 4.121 -3.693 1.00 0.83 H new ATOM 0 HB2 TRP A 77 1.820 4.119 -3.875 1.00 0.81 H new ATOM 0 HB3 TRP A 77 2.014 5.610 -2.975 1.00 0.81 H new ATOM 0 HD1 TRP A 77 2.439 5.492 -0.461 1.00 1.86 H new ATOM 0 HE1 TRP A 77 2.796 3.640 1.277 1.00 1.88 H new ATOM 0 HE3 TRP A 77 1.195 1.416 -3.334 1.00 3.34 H new ATOM 0 HZ2 TRP A 77 2.632 0.822 1.395 1.00 2.17 H new ATOM 0 HZ3 TRP A 77 1.136 -0.825 -2.274 1.00 4.13 H new ATOM 0 HH2 TRP A 77 1.872 -1.129 0.062 1.00 3.54 H new ATOM 1241 N ARG A 78 -0.709 6.068 -1.037 1.00 0.83 N ATOM 1242 CA ARG A 78 -1.423 6.223 0.232 1.00 0.83 C ATOM 1243 C ARG A 78 -2.813 5.588 0.177 1.00 0.83 C ATOM 1244 O ARG A 78 -3.179 4.824 1.070 1.00 0.86 O ATOM 1245 CB ARG A 78 -1.597 7.709 0.560 1.00 0.86 C ATOM 1246 CG ARG A 78 -0.292 8.452 0.868 1.00 1.30 C ATOM 1247 CD ARG A 78 0.036 8.400 2.363 1.00 1.92 C ATOM 1248 NE ARG A 78 1.202 9.247 2.660 1.00 2.56 N ATOM 1249 CZ ARG A 78 1.477 9.804 3.851 1.00 3.23 C ATOM 1250 NH1 ARG A 78 0.711 9.530 4.914 1.00 3.49 N ATOM 1251 NH2 ARG A 78 2.521 10.631 3.973 1.00 4.43 N ATOM 0 H ARG A 78 -0.177 6.895 -1.307 1.00 0.83 H new ATOM 0 HA ARG A 78 -0.828 5.724 0.997 1.00 0.83 H new ATOM 0 HB2 ARG A 78 -2.088 8.198 -0.281 1.00 0.86 H new ATOM 0 HB3 ARG A 78 -2.264 7.803 1.417 1.00 0.86 H new ATOM 0 HG2 ARG A 78 0.525 8.009 0.298 1.00 1.30 H new ATOM 0 HG3 ARG A 78 -0.377 9.490 0.548 1.00 1.30 H new ATOM 0 HD2 ARG A 78 -0.824 8.737 2.943 1.00 1.92 H new ATOM 0 HD3 ARG A 78 0.239 7.372 2.662 1.00 1.92 H new ATOM 0 HE ARG A 78 1.856 9.426 1.898 1.00 2.56 H new ATOM 0 HH11 ARG A 78 -0.083 8.897 4.821 1.00 3.49 H new ATOM 0 HH12 ARG A 78 0.922 9.954 5.817 1.00 3.49 H new ATOM 0 HH21 ARG A 78 3.106 10.837 3.163 1.00 4.43 H new ATOM 0 HH22 ARG A 78 2.732 11.056 4.876 1.00 4.43 H new ATOM 1265 N LEU A 79 -3.566 5.890 -0.888 1.00 0.81 N ATOM 1266 CA LEU A 79 -4.923 5.406 -1.079 1.00 0.80 C ATOM 1267 C LEU A 79 -4.989 3.902 -0.842 1.00 0.84 C ATOM 1268 O LEU A 79 -5.873 3.432 -0.137 1.00 0.88 O ATOM 1269 CB LEU A 79 -5.407 5.722 -2.505 1.00 0.81 C ATOM 1270 CG LEU A 79 -6.940 5.709 -2.627 1.00 0.75 C ATOM 1271 CD1 LEU A 79 -7.590 7.008 -2.129 1.00 0.63 C ATOM 1272 CD2 LEU A 79 -7.332 5.435 -4.083 1.00 0.87 C ATOM 0 H LEU A 79 -3.237 6.486 -1.647 1.00 0.81 H new ATOM 0 HA LEU A 79 -5.570 5.910 -0.360 1.00 0.80 H new ATOM 0 HB2 LEU A 79 -5.031 6.701 -2.804 1.00 0.81 H new ATOM 0 HB3 LEU A 79 -4.985 4.994 -3.197 1.00 0.81 H new ATOM 0 HG LEU A 79 -7.314 4.913 -1.983 1.00 0.75 H new ATOM 0 HD11 LEU A 79 -8.672 6.939 -2.240 1.00 0.63 H new ATOM 0 HD12 LEU A 79 -7.342 7.159 -1.078 1.00 0.63 H new ATOM 0 HD13 LEU A 79 -7.218 7.849 -2.714 1.00 0.63 H new ATOM 0 HD21 LEU A 79 -8.418 5.425 -4.172 1.00 0.87 H new ATOM 0 HD22 LEU A 79 -6.923 6.216 -4.723 1.00 0.87 H new ATOM 0 HD23 LEU A 79 -6.934 4.468 -4.391 1.00 0.87 H new ATOM 1284 N ILE A 80 -4.048 3.141 -1.409 1.00 0.87 N ATOM 1285 CA ILE A 80 -4.065 1.697 -1.407 1.00 0.92 C ATOM 1286 C ILE A 80 -3.960 1.225 0.052 1.00 1.06 C ATOM 1287 O ILE A 80 -4.509 0.190 0.431 1.00 1.09 O ATOM 1288 CB ILE A 80 -2.930 1.216 -2.336 1.00 0.92 C ATOM 1289 CG1 ILE A 80 -3.086 1.813 -3.752 1.00 0.91 C ATOM 1290 CG2 ILE A 80 -2.947 -0.319 -2.448 1.00 1.01 C ATOM 1291 CD1 ILE A 80 -1.914 1.452 -4.667 1.00 1.62 C ATOM 0 H ILE A 80 -3.239 3.533 -1.891 1.00 0.87 H new ATOM 0 HA ILE A 80 -4.987 1.266 -1.798 1.00 0.92 H new ATOM 0 HB ILE A 80 -1.986 1.549 -1.904 1.00 0.92 H new ATOM 0 HG12 ILE A 80 -4.014 1.453 -4.195 1.00 0.91 H new ATOM 0 HG13 ILE A 80 -3.167 2.898 -3.680 1.00 0.91 H new ATOM 0 HG21 ILE A 80 -2.141 -0.645 -3.106 1.00 1.01 H new ATOM 0 HG22 ILE A 80 -2.808 -0.757 -1.460 1.00 1.01 H new ATOM 0 HG23 ILE A 80 -3.904 -0.643 -2.858 1.00 1.01 H new ATOM 0 HD11 ILE A 80 -2.070 1.895 -5.651 1.00 1.62 H new ATOM 0 HD12 ILE A 80 -0.987 1.835 -4.240 1.00 1.62 H new ATOM 0 HD13 ILE A 80 -1.848 0.368 -4.763 1.00 1.62 H new ATOM 1303 N GLY A 81 -3.300 2.022 0.898 1.00 1.23 N ATOM 1304 CA GLY A 81 -3.118 1.715 2.297 1.00 1.40 C ATOM 1305 C GLY A 81 -4.433 1.828 3.017 1.00 1.40 C ATOM 1306 O GLY A 81 -4.804 0.985 3.828 1.00 1.54 O ATOM 0 H GLY A 81 -2.877 2.906 0.615 1.00 1.23 H new ATOM 0 HA2 GLY A 81 -2.717 0.708 2.409 1.00 1.40 H new ATOM 0 HA3 GLY A 81 -2.392 2.398 2.737 1.00 1.40 H new ATOM 1310 N GLU A 82 -5.125 2.913 2.708 1.00 1.30 N ATOM 1311 CA GLU A 82 -6.367 3.264 3.340 1.00 1.32 C ATOM 1312 C GLU A 82 -7.392 2.229 2.894 1.00 1.31 C ATOM 1313 O GLU A 82 -8.003 1.599 3.740 1.00 1.45 O ATOM 1314 CB GLU A 82 -6.702 4.709 2.986 1.00 1.21 C ATOM 1315 CG GLU A 82 -5.481 5.619 3.255 1.00 1.17 C ATOM 1316 CD GLU A 82 -5.605 6.368 4.572 1.00 1.36 C ATOM 1317 OE1 GLU A 82 -5.348 5.708 5.607 1.00 2.50 O ATOM 1318 OE2 GLU A 82 -5.922 7.573 4.528 1.00 1.77 O ATOM 0 H GLU A 82 -4.826 3.580 1.997 1.00 1.30 H new ATOM 0 HA GLU A 82 -6.335 3.237 4.429 1.00 1.32 H new ATOM 0 HB2 GLU A 82 -6.992 4.777 1.937 1.00 1.21 H new ATOM 0 HB3 GLU A 82 -7.554 5.048 3.575 1.00 1.21 H new ATOM 0 HG2 GLU A 82 -4.574 5.014 3.266 1.00 1.17 H new ATOM 0 HG3 GLU A 82 -5.376 6.335 2.440 1.00 1.17 H new ATOM 1325 N LEU A 83 -7.482 1.937 1.594 1.00 1.18 N ATOM 1326 CA LEU A 83 -8.209 0.780 1.083 1.00 1.11 C ATOM 1327 C LEU A 83 -7.945 -0.465 1.953 1.00 1.11 C ATOM 1328 O LEU A 83 -8.869 -1.052 2.519 1.00 1.15 O ATOM 1329 CB LEU A 83 -7.775 0.471 -0.360 1.00 1.14 C ATOM 1330 CG LEU A 83 -8.562 1.113 -1.512 1.00 1.27 C ATOM 1331 CD1 LEU A 83 -8.101 2.519 -1.792 1.00 1.88 C ATOM 1332 CD2 LEU A 83 -8.390 0.277 -2.790 1.00 2.37 C ATOM 0 H LEU A 83 -7.048 2.503 0.864 1.00 1.18 H new ATOM 0 HA LEU A 83 -9.272 1.021 1.109 1.00 1.11 H new ATOM 0 HB2 LEU A 83 -6.732 0.769 -0.464 1.00 1.14 H new ATOM 0 HB3 LEU A 83 -7.813 -0.610 -0.494 1.00 1.14 H new ATOM 0 HG LEU A 83 -9.609 1.145 -1.211 1.00 1.27 H new ATOM 0 HD11 LEU A 83 -8.683 2.936 -2.614 1.00 1.88 H new ATOM 0 HD12 LEU A 83 -8.240 3.132 -0.901 1.00 1.88 H new ATOM 0 HD13 LEU A 83 -7.046 2.508 -2.064 1.00 1.88 H new ATOM 0 HD21 LEU A 83 -8.950 0.737 -3.604 1.00 2.37 H new ATOM 0 HD22 LEU A 83 -7.334 0.233 -3.056 1.00 2.37 H new ATOM 0 HD23 LEU A 83 -8.763 -0.732 -2.618 1.00 2.37 H new ATOM 1344 N ALA A 84 -6.669 -0.856 2.064 1.00 1.09 N ATOM 1345 CA ALA A 84 -6.246 -2.007 2.856 1.00 1.13 C ATOM 1346 C ALA A 84 -6.606 -1.881 4.343 1.00 1.16 C ATOM 1347 O ALA A 84 -6.629 -2.883 5.048 1.00 1.20 O ATOM 1348 CB ALA A 84 -4.744 -2.241 2.667 1.00 1.14 C ATOM 0 H ALA A 84 -5.898 -0.375 1.601 1.00 1.09 H new ATOM 0 HA ALA A 84 -6.797 -2.874 2.491 1.00 1.13 H new ATOM 0 HB1 ALA A 84 -4.432 -3.101 3.260 1.00 1.14 H new ATOM 0 HB2 ALA A 84 -4.535 -2.431 1.614 1.00 1.14 H new ATOM 0 HB3 ALA A 84 -4.194 -1.358 2.992 1.00 1.14 H new ATOM 1354 N LYS A 85 -6.866 -0.670 4.837 1.00 1.28 N ATOM 1355 CA LYS A 85 -7.327 -0.383 6.189 1.00 1.29 C ATOM 1356 C LYS A 85 -8.835 -0.626 6.284 1.00 1.36 C ATOM 1357 O LYS A 85 -9.309 -1.339 7.169 1.00 1.39 O ATOM 1358 CB LYS A 85 -6.990 1.086 6.492 1.00 1.51 C ATOM 1359 CG LYS A 85 -6.648 1.405 7.948 1.00 1.18 C ATOM 1360 CD LYS A 85 -6.007 2.804 7.987 1.00 1.61 C ATOM 1361 CE LYS A 85 -4.533 2.762 7.543 1.00 1.27 C ATOM 1362 NZ LYS A 85 -4.027 4.079 7.109 1.00 1.28 N ATOM 0 H LYS A 85 -6.755 0.175 4.276 1.00 1.28 H new ATOM 0 HA LYS A 85 -6.839 -1.034 6.915 1.00 1.29 H new ATOM 0 HB2 LYS A 85 -6.147 1.382 5.868 1.00 1.51 H new ATOM 0 HB3 LYS A 85 -7.838 1.702 6.195 1.00 1.51 H new ATOM 0 HG2 LYS A 85 -7.546 1.379 8.565 1.00 1.18 H new ATOM 0 HG3 LYS A 85 -5.962 0.660 8.351 1.00 1.18 H new ATOM 0 HD2 LYS A 85 -6.565 3.479 7.338 1.00 1.61 H new ATOM 0 HD3 LYS A 85 -6.072 3.207 8.998 1.00 1.61 H new ATOM 0 HE2 LYS A 85 -3.921 2.397 8.367 1.00 1.27 H new ATOM 0 HE3 LYS A 85 -4.425 2.049 6.725 1.00 1.27 H new ATOM 0 HZ1 LYS A 85 -3.047 3.981 6.774 1.00 1.28 H new ATOM 0 HZ2 LYS A 85 -4.622 4.443 6.338 1.00 1.28 H new ATOM 0 HZ3 LYS A 85 -4.054 4.742 7.909 1.00 1.28 H new ATOM 1376 N GLU A 86 -9.583 -0.003 5.371 1.00 1.43 N ATOM 1377 CA GLU A 86 -11.036 0.086 5.332 1.00 1.50 C ATOM 1378 C GLU A 86 -11.668 -1.305 5.285 1.00 1.48 C ATOM 1379 O GLU A 86 -12.754 -1.503 5.827 1.00 1.64 O ATOM 1380 CB GLU A 86 -11.449 0.954 4.133 1.00 1.50 C ATOM 1381 CG GLU A 86 -10.942 2.401 4.288 1.00 1.54 C ATOM 1382 CD GLU A 86 -11.818 3.243 5.209 1.00 1.90 C ATOM 1383 OE1 GLU A 86 -12.997 3.437 4.845 1.00 2.63 O ATOM 1384 OE2 GLU A 86 -11.284 3.684 6.253 1.00 2.16 O ATOM 0 H GLU A 86 -9.154 0.486 4.585 1.00 1.43 H new ATOM 0 HA GLU A 86 -11.403 0.558 6.243 1.00 1.50 H new ATOM 0 HB2 GLU A 86 -11.050 0.523 3.215 1.00 1.50 H new ATOM 0 HB3 GLU A 86 -12.535 0.955 4.039 1.00 1.50 H new ATOM 0 HG2 GLU A 86 -9.925 2.384 4.679 1.00 1.54 H new ATOM 0 HG3 GLU A 86 -10.898 2.872 3.306 1.00 1.54 H new ATOM 1391 N ILE A 87 -10.952 -2.277 4.702 1.00 1.34 N ATOM 1392 CA ILE A 87 -11.276 -3.703 4.773 1.00 1.34 C ATOM 1393 C ILE A 87 -11.754 -4.111 6.180 1.00 1.47 C ATOM 1394 O ILE A 87 -12.653 -4.939 6.314 1.00 1.62 O ATOM 1395 CB ILE A 87 -10.057 -4.539 4.314 1.00 1.29 C ATOM 1396 CG1 ILE A 87 -10.433 -5.985 3.955 1.00 1.62 C ATOM 1397 CG2 ILE A 87 -8.991 -4.613 5.411 1.00 1.39 C ATOM 1398 CD1 ILE A 87 -11.077 -6.095 2.576 1.00 1.27 C ATOM 0 H ILE A 87 -10.112 -2.085 4.156 1.00 1.34 H new ATOM 0 HA ILE A 87 -12.107 -3.904 4.097 1.00 1.34 H new ATOM 0 HB ILE A 87 -9.675 -4.029 3.429 1.00 1.29 H new ATOM 0 HG12 ILE A 87 -9.539 -6.608 3.986 1.00 1.62 H new ATOM 0 HG13 ILE A 87 -11.120 -6.376 4.706 1.00 1.62 H new ATOM 0 HG21 ILE A 87 -8.147 -5.207 5.059 1.00 1.39 H new ATOM 0 HG22 ILE A 87 -8.650 -3.607 5.655 1.00 1.39 H new ATOM 0 HG23 ILE A 87 -9.416 -5.078 6.300 1.00 1.39 H new ATOM 0 HD11 ILE A 87 -11.323 -7.137 2.371 1.00 1.27 H new ATOM 0 HD12 ILE A 87 -11.987 -5.495 2.550 1.00 1.27 H new ATOM 0 HD13 ILE A 87 -10.382 -5.731 1.820 1.00 1.27 H new ATOM 1410 N ARG A 88 -11.143 -3.540 7.228 1.00 1.58 N ATOM 1411 CA ARG A 88 -11.507 -3.769 8.619 1.00 1.86 C ATOM 1412 C ARG A 88 -12.035 -2.491 9.275 1.00 1.77 C ATOM 1413 O ARG A 88 -13.028 -2.535 10.012 1.00 2.14 O ATOM 1414 CB ARG A 88 -10.359 -4.465 9.382 1.00 2.22 C ATOM 1415 CG ARG A 88 -8.913 -3.963 9.174 1.00 1.68 C ATOM 1416 CD ARG A 88 -8.442 -2.779 10.033 1.00 2.34 C ATOM 1417 NE ARG A 88 -8.464 -3.103 11.470 1.00 2.69 N ATOM 1418 CZ ARG A 88 -9.478 -2.864 12.318 1.00 3.85 C ATOM 1419 NH1 ARG A 88 -10.486 -2.070 11.962 1.00 5.16 N ATOM 1420 NH2 ARG A 88 -9.496 -3.448 13.516 1.00 4.51 N ATOM 0 H ARG A 88 -10.363 -2.891 7.121 1.00 1.58 H new ATOM 0 HA ARG A 88 -12.343 -4.467 8.661 1.00 1.86 H new ATOM 0 HB2 ARG A 88 -10.582 -4.397 10.447 1.00 2.22 H new ATOM 0 HB3 ARG A 88 -10.382 -5.523 9.119 1.00 2.22 H new ATOM 0 HG2 ARG A 88 -8.238 -4.799 9.355 1.00 1.68 H new ATOM 0 HG3 ARG A 88 -8.801 -3.684 8.126 1.00 1.68 H new ATOM 0 HD2 ARG A 88 -7.431 -2.496 9.740 1.00 2.34 H new ATOM 0 HD3 ARG A 88 -9.081 -1.916 9.845 1.00 2.34 H new ATOM 0 HE ARG A 88 -7.633 -3.550 11.857 1.00 2.69 H new ATOM 0 HH11 ARG A 88 -10.493 -1.637 11.038 1.00 5.16 H new ATOM 0 HH12 ARG A 88 -11.251 -1.895 12.613 1.00 5.16 H new ATOM 0 HH21 ARG A 88 -8.740 -4.076 13.789 1.00 4.51 H new ATOM 0 HH22 ARG A 88 -10.266 -3.267 14.160 1.00 4.51 H new ATOM 1434 N LYS A 89 -11.382 -1.345 9.045 1.00 1.47 N ATOM 1435 CA LYS A 89 -11.803 -0.057 9.568 1.00 1.51 C ATOM 1436 C LYS A 89 -13.008 0.469 8.785 1.00 1.84 C ATOM 1437 O LYS A 89 -12.958 1.529 8.178 1.00 2.41 O ATOM 1438 CB LYS A 89 -10.619 0.921 9.544 1.00 1.31 C ATOM 1439 CG LYS A 89 -10.953 2.202 10.322 1.00 1.57 C ATOM 1440 CD LYS A 89 -9.813 3.212 10.196 1.00 1.52 C ATOM 1441 CE LYS A 89 -10.247 4.605 10.683 1.00 2.10 C ATOM 1442 NZ LYS A 89 -10.949 4.579 11.987 1.00 3.53 N ATOM 0 H LYS A 89 -10.534 -1.295 8.480 1.00 1.47 H new ATOM 0 HA LYS A 89 -12.122 -0.166 10.604 1.00 1.51 H new ATOM 0 HB2 LYS A 89 -9.740 0.445 9.979 1.00 1.31 H new ATOM 0 HB3 LYS A 89 -10.369 1.171 8.513 1.00 1.31 H new ATOM 0 HG2 LYS A 89 -11.877 2.637 9.940 1.00 1.57 H new ATOM 0 HG3 LYS A 89 -11.123 1.964 11.372 1.00 1.57 H new ATOM 0 HD2 LYS A 89 -8.956 2.871 10.777 1.00 1.52 H new ATOM 0 HD3 LYS A 89 -9.490 3.272 9.157 1.00 1.52 H new ATOM 0 HE2 LYS A 89 -9.367 5.244 10.765 1.00 2.10 H new ATOM 0 HE3 LYS A 89 -10.900 5.056 9.936 1.00 2.10 H new ATOM 0 HZ1 LYS A 89 -11.079 5.552 12.331 1.00 3.53 H new ATOM 0 HZ2 LYS A 89 -11.878 4.126 11.872 1.00 3.53 H new ATOM 0 HZ3 LYS A 89 -10.384 4.041 12.675 1.00 3.53 H new ATOM 1710 N LEU B 6 -15.673 -8.259 -2.490 1.00 1.16 N ATOM 1711 CA LEU B 6 -15.362 -6.951 -3.072 1.00 1.08 C ATOM 1712 C LEU B 6 -15.118 -6.987 -4.602 1.00 1.10 C ATOM 1713 O LEU B 6 -15.263 -8.044 -5.213 1.00 1.51 O ATOM 1714 CB LEU B 6 -14.097 -6.420 -2.389 1.00 1.32 C ATOM 1715 CG LEU B 6 -13.800 -6.720 -0.908 1.00 1.43 C ATOM 1716 CD1 LEU B 6 -12.299 -6.566 -0.645 1.00 2.16 C ATOM 1717 CD2 LEU B 6 -14.561 -5.762 0.020 1.00 2.19 C ATOM 0 HA LEU B 6 -16.229 -6.310 -2.910 1.00 1.08 H new ATOM 0 HB2 LEU B 6 -13.247 -6.788 -2.964 1.00 1.32 H new ATOM 0 HB3 LEU B 6 -14.109 -5.335 -2.497 1.00 1.32 H new ATOM 0 HG LEU B 6 -14.124 -7.740 -0.702 1.00 1.43 H new ATOM 0 HD11 LEU B 6 -12.090 -6.778 0.403 1.00 2.16 H new ATOM 0 HD12 LEU B 6 -11.746 -7.263 -1.274 1.00 2.16 H new ATOM 0 HD13 LEU B 6 -11.992 -5.546 -0.877 1.00 2.16 H new ATOM 0 HD21 LEU B 6 -14.330 -6.001 1.058 1.00 2.19 H new ATOM 0 HD22 LEU B 6 -14.262 -4.736 -0.192 1.00 2.19 H new ATOM 0 HD23 LEU B 6 -15.633 -5.869 -0.147 1.00 2.19 H new ATOM 1729 N THR B 7 -14.733 -5.847 -5.216 1.00 0.99 N ATOM 1730 CA THR B 7 -14.335 -5.733 -6.636 1.00 0.99 C ATOM 1731 C THR B 7 -12.835 -5.970 -6.872 1.00 0.95 C ATOM 1732 O THR B 7 -12.152 -6.466 -5.991 1.00 1.63 O ATOM 1733 CB THR B 7 -14.773 -4.379 -7.226 1.00 1.16 C ATOM 1734 OG1 THR B 7 -14.786 -4.465 -8.639 1.00 1.40 O ATOM 1735 CG2 THR B 7 -13.881 -3.179 -6.860 1.00 1.26 C ATOM 0 H THR B 7 -14.689 -4.955 -4.723 1.00 0.99 H new ATOM 0 HA THR B 7 -14.857 -6.534 -7.160 1.00 0.99 H new ATOM 0 HB THR B 7 -15.756 -4.195 -6.792 1.00 1.16 H new ATOM 0 HG1 THR B 7 -15.066 -3.605 -9.017 1.00 1.40 H new ATOM 0 HG21 THR B 7 -14.277 -2.276 -7.325 1.00 1.26 H new ATOM 0 HG22 THR B 7 -13.867 -3.053 -5.777 1.00 1.26 H new ATOM 0 HG23 THR B 7 -12.867 -3.357 -7.218 1.00 1.26 H new ATOM 1743 N GLU B 8 -12.313 -5.570 -8.042 1.00 1.00 N ATOM 1744 CA GLU B 8 -10.964 -5.829 -8.536 1.00 0.91 C ATOM 1745 C GLU B 8 -9.874 -5.155 -7.690 1.00 0.82 C ATOM 1746 O GLU B 8 -9.074 -5.836 -7.050 1.00 0.85 O ATOM 1747 CB GLU B 8 -10.898 -5.385 -10.002 1.00 1.04 C ATOM 1748 CG GLU B 8 -9.560 -5.735 -10.659 1.00 1.20 C ATOM 1749 CD GLU B 8 -9.462 -5.076 -12.026 1.00 1.51 C ATOM 1750 OE1 GLU B 8 -9.362 -3.829 -12.028 1.00 1.92 O ATOM 1751 OE2 GLU B 8 -9.523 -5.813 -13.032 1.00 2.10 O ATOM 0 H GLU B 8 -12.862 -5.023 -8.705 1.00 1.00 H new ATOM 0 HA GLU B 8 -10.762 -6.897 -8.457 1.00 0.91 H new ATOM 0 HB2 GLU B 8 -11.707 -5.858 -10.559 1.00 1.04 H new ATOM 0 HB3 GLU B 8 -11.057 -4.308 -10.060 1.00 1.04 H new ATOM 0 HG2 GLU B 8 -8.737 -5.402 -10.026 1.00 1.20 H new ATOM 0 HG3 GLU B 8 -9.467 -6.816 -10.760 1.00 1.20 H new ATOM 1758 N LEU B 9 -9.790 -3.818 -7.684 1.00 0.79 N ATOM 1759 CA LEU B 9 -8.786 -3.153 -6.853 1.00 0.77 C ATOM 1760 C LEU B 9 -8.963 -3.564 -5.390 1.00 0.76 C ATOM 1761 O LEU B 9 -7.991 -3.869 -4.698 1.00 0.76 O ATOM 1762 CB LEU B 9 -8.837 -1.631 -7.040 1.00 0.78 C ATOM 1763 CG LEU B 9 -8.008 -1.219 -8.267 1.00 0.85 C ATOM 1764 CD1 LEU B 9 -8.353 0.204 -8.698 1.00 0.99 C ATOM 1765 CD2 LEU B 9 -6.506 -1.194 -7.939 1.00 1.05 C ATOM 0 H LEU B 9 -10.386 -3.194 -8.228 1.00 0.79 H new ATOM 0 HA LEU B 9 -7.793 -3.473 -7.170 1.00 0.77 H new ATOM 0 HB2 LEU B 9 -9.870 -1.307 -7.165 1.00 0.78 H new ATOM 0 HB3 LEU B 9 -8.453 -1.135 -6.149 1.00 0.78 H new ATOM 0 HG LEU B 9 -8.234 -1.946 -9.047 1.00 0.85 H new ATOM 0 HD11 LEU B 9 -7.755 0.476 -9.568 1.00 0.99 H new ATOM 0 HD12 LEU B 9 -9.411 0.260 -8.953 1.00 0.99 H new ATOM 0 HD13 LEU B 9 -8.139 0.893 -7.881 1.00 0.99 H new ATOM 0 HD21 LEU B 9 -5.945 -0.899 -8.826 1.00 1.05 H new ATOM 0 HD22 LEU B 9 -6.320 -0.479 -7.138 1.00 1.05 H new ATOM 0 HD23 LEU B 9 -6.187 -2.186 -7.621 1.00 1.05 H new ATOM 1777 N GLU B 10 -10.215 -3.635 -4.946 1.00 0.78 N ATOM 1778 CA GLU B 10 -10.588 -4.240 -3.691 1.00 0.82 C ATOM 1779 C GLU B 10 -9.972 -5.665 -3.507 1.00 0.94 C ATOM 1780 O GLU B 10 -9.426 -5.957 -2.442 1.00 1.28 O ATOM 1781 CB GLU B 10 -12.112 -4.148 -3.559 1.00 0.93 C ATOM 1782 CG GLU B 10 -12.673 -2.716 -3.351 1.00 1.59 C ATOM 1783 CD GLU B 10 -14.208 -2.566 -3.350 1.00 2.28 C ATOM 1784 OE1 GLU B 10 -14.883 -3.540 -3.749 1.00 2.97 O ATOM 1785 OE2 GLU B 10 -14.699 -1.455 -3.022 1.00 3.15 O ATOM 0 H GLU B 10 -11.009 -3.263 -5.467 1.00 0.78 H new ATOM 0 HA GLU B 10 -10.157 -3.695 -2.851 1.00 0.82 H new ATOM 0 HB2 GLU B 10 -12.564 -4.571 -4.456 1.00 0.93 H new ATOM 0 HB3 GLU B 10 -12.426 -4.769 -2.720 1.00 0.93 H new ATOM 0 HG2 GLU B 10 -12.294 -2.337 -2.402 1.00 1.59 H new ATOM 0 HG3 GLU B 10 -12.269 -2.075 -4.135 1.00 1.59 H new ATOM 1792 N GLU B 11 -9.961 -6.543 -4.522 1.00 0.90 N ATOM 1793 CA GLU B 11 -9.250 -7.822 -4.457 1.00 0.97 C ATOM 1794 C GLU B 11 -7.758 -7.583 -4.253 1.00 0.92 C ATOM 1795 O GLU B 11 -7.134 -8.249 -3.433 1.00 1.02 O ATOM 1796 CB GLU B 11 -9.407 -8.711 -5.709 1.00 1.18 C ATOM 1797 CG GLU B 11 -10.826 -9.205 -6.021 1.00 1.48 C ATOM 1798 CD GLU B 11 -10.834 -10.636 -6.555 1.00 2.63 C ATOM 1799 OE1 GLU B 11 -10.344 -11.522 -5.821 1.00 3.05 O ATOM 1800 OE2 GLU B 11 -11.316 -10.820 -7.693 1.00 3.88 O ATOM 0 H GLU B 11 -10.444 -6.384 -5.406 1.00 0.90 H new ATOM 0 HA GLU B 11 -9.705 -8.349 -3.618 1.00 0.97 H new ATOM 0 HB2 GLU B 11 -9.042 -8.154 -6.572 1.00 1.18 H new ATOM 0 HB3 GLU B 11 -8.760 -9.581 -5.594 1.00 1.18 H new ATOM 0 HG2 GLU B 11 -11.434 -9.153 -5.118 1.00 1.48 H new ATOM 0 HG3 GLU B 11 -11.287 -8.543 -6.754 1.00 1.48 H new ATOM 1807 N SER B 12 -7.153 -6.670 -5.021 1.00 0.87 N ATOM 1808 CA SER B 12 -5.710 -6.471 -4.935 1.00 0.86 C ATOM 1809 C SER B 12 -5.297 -6.021 -3.528 1.00 0.78 C ATOM 1810 O SER B 12 -4.266 -6.456 -3.019 1.00 0.86 O ATOM 1811 CB SER B 12 -5.183 -5.556 -6.047 1.00 0.94 C ATOM 1812 OG SER B 12 -5.517 -4.203 -5.825 1.00 1.90 O ATOM 0 H SER B 12 -7.631 -6.071 -5.694 1.00 0.87 H new ATOM 0 HA SER B 12 -5.229 -7.434 -5.105 1.00 0.86 H new ATOM 0 HB2 SER B 12 -4.100 -5.655 -6.114 1.00 0.94 H new ATOM 0 HB3 SER B 12 -5.592 -5.877 -7.005 1.00 0.94 H new ATOM 0 HG SER B 12 -6.422 -4.146 -5.453 1.00 1.90 H new ATOM 1818 N ILE B 13 -6.108 -5.190 -2.866 1.00 0.70 N ATOM 1819 CA ILE B 13 -5.854 -4.880 -1.464 1.00 0.75 C ATOM 1820 C ILE B 13 -6.102 -6.113 -0.589 1.00 0.83 C ATOM 1821 O ILE B 13 -5.270 -6.422 0.263 1.00 0.93 O ATOM 1822 CB ILE B 13 -6.505 -3.559 -1.002 1.00 0.83 C ATOM 1823 CG1 ILE B 13 -8.014 -3.470 -1.235 1.00 0.85 C ATOM 1824 CG2 ILE B 13 -5.806 -2.431 -1.778 1.00 0.92 C ATOM 1825 CD1 ILE B 13 -8.859 -4.046 -0.097 1.00 1.04 C ATOM 0 H ILE B 13 -6.925 -4.732 -3.269 1.00 0.70 H new ATOM 0 HA ILE B 13 -4.795 -4.654 -1.337 1.00 0.75 H new ATOM 0 HB ILE B 13 -6.381 -3.487 0.078 1.00 0.83 H new ATOM 0 HG12 ILE B 13 -8.287 -2.425 -1.382 1.00 0.85 H new ATOM 0 HG13 ILE B 13 -8.260 -3.996 -2.157 1.00 0.85 H new ATOM 0 HG21 ILE B 13 -6.232 -1.471 -1.487 1.00 0.92 H new ATOM 0 HG22 ILE B 13 -4.740 -2.439 -1.551 1.00 0.92 H new ATOM 0 HG23 ILE B 13 -5.950 -2.582 -2.848 1.00 0.92 H new ATOM 0 HD11 ILE B 13 -9.916 -3.944 -0.341 1.00 1.04 H new ATOM 0 HD12 ILE B 13 -8.618 -5.100 0.037 1.00 1.04 H new ATOM 0 HD13 ILE B 13 -8.645 -3.505 0.825 1.00 1.04 H new ATOM 1837 N GLU B 14 -7.179 -6.872 -0.819 1.00 0.86 N ATOM 1838 CA GLU B 14 -7.447 -8.063 -0.018 1.00 0.97 C ATOM 1839 C GLU B 14 -6.264 -9.042 -0.081 1.00 0.96 C ATOM 1840 O GLU B 14 -5.829 -9.579 0.938 1.00 1.09 O ATOM 1841 CB GLU B 14 -8.770 -8.723 -0.433 1.00 1.13 C ATOM 1842 CG GLU B 14 -9.257 -9.667 0.679 1.00 1.41 C ATOM 1843 CD GLU B 14 -10.550 -10.391 0.322 1.00 2.91 C ATOM 1844 OE1 GLU B 14 -11.386 -9.768 -0.366 1.00 4.30 O ATOM 1845 OE2 GLU B 14 -10.681 -11.553 0.764 1.00 3.58 O ATOM 0 H GLU B 14 -7.870 -6.683 -1.545 1.00 0.86 H new ATOM 0 HA GLU B 14 -7.558 -7.759 1.023 1.00 0.97 H new ATOM 0 HB2 GLU B 14 -9.522 -7.959 -0.628 1.00 1.13 H new ATOM 0 HB3 GLU B 14 -8.633 -9.280 -1.360 1.00 1.13 H new ATOM 0 HG2 GLU B 14 -8.481 -10.403 0.889 1.00 1.41 H new ATOM 0 HG3 GLU B 14 -9.409 -9.094 1.594 1.00 1.41 H new ATOM 1852 N THR B 15 -5.712 -9.248 -1.278 1.00 0.95 N ATOM 1853 CA THR B 15 -4.661 -10.229 -1.511 1.00 1.07 C ATOM 1854 C THR B 15 -3.357 -9.850 -0.787 1.00 1.11 C ATOM 1855 O THR B 15 -2.605 -10.731 -0.381 1.00 1.38 O ATOM 1856 CB THR B 15 -4.520 -10.558 -3.012 1.00 1.15 C ATOM 1857 OG1 THR B 15 -4.151 -11.912 -3.163 1.00 1.42 O ATOM 1858 CG2 THR B 15 -3.498 -9.706 -3.767 1.00 1.12 C ATOM 0 H THR B 15 -5.986 -8.734 -2.115 1.00 0.95 H new ATOM 0 HA THR B 15 -4.952 -11.174 -1.053 1.00 1.07 H new ATOM 0 HB THR B 15 -5.496 -10.338 -3.445 1.00 1.15 H new ATOM 0 HG1 THR B 15 -4.063 -12.123 -4.116 1.00 1.42 H new ATOM 0 HG21 THR B 15 -3.471 -10.012 -4.813 1.00 1.12 H new ATOM 0 HG22 THR B 15 -3.782 -8.656 -3.703 1.00 1.12 H new ATOM 0 HG23 THR B 15 -2.512 -9.843 -3.324 1.00 1.12 H new ATOM 1866 N VAL B 16 -3.085 -8.556 -0.564 1.00 0.90 N ATOM 1867 CA VAL B 16 -1.994 -8.158 0.329 1.00 0.82 C ATOM 1868 C VAL B 16 -2.429 -8.214 1.798 1.00 0.81 C ATOM 1869 O VAL B 16 -1.629 -8.587 2.655 1.00 0.81 O ATOM 1870 CB VAL B 16 -1.335 -6.823 -0.063 1.00 0.79 C ATOM 1871 CG1 VAL B 16 -0.722 -6.921 -1.465 1.00 0.93 C ATOM 1872 CG2 VAL B 16 -2.278 -5.622 -0.012 1.00 0.80 C ATOM 0 H VAL B 16 -3.598 -7.780 -0.983 1.00 0.90 H new ATOM 0 HA VAL B 16 -1.201 -8.896 0.205 1.00 0.82 H new ATOM 0 HB VAL B 16 -0.563 -6.650 0.686 1.00 0.79 H new ATOM 0 HG11 VAL B 16 -0.260 -5.969 -1.727 1.00 0.93 H new ATOM 0 HG12 VAL B 16 0.033 -7.707 -1.478 1.00 0.93 H new ATOM 0 HG13 VAL B 16 -1.503 -7.157 -2.188 1.00 0.93 H new ATOM 0 HG21 VAL B 16 -1.736 -4.722 -0.302 1.00 0.80 H new ATOM 0 HG22 VAL B 16 -3.109 -5.783 -0.699 1.00 0.80 H new ATOM 0 HG23 VAL B 16 -2.662 -5.504 1.001 1.00 0.80 H new ATOM 1882 N VAL B 17 -3.680 -7.855 2.113 1.00 0.87 N ATOM 1883 CA VAL B 17 -4.205 -7.918 3.476 1.00 0.95 C ATOM 1884 C VAL B 17 -4.082 -9.337 4.038 1.00 0.97 C ATOM 1885 O VAL B 17 -3.676 -9.501 5.187 1.00 1.00 O ATOM 1886 CB VAL B 17 -5.648 -7.384 3.538 1.00 1.10 C ATOM 1887 CG1 VAL B 17 -6.351 -7.737 4.857 1.00 1.30 C ATOM 1888 CG2 VAL B 17 -5.654 -5.857 3.383 1.00 1.14 C ATOM 0 H VAL B 17 -4.354 -7.513 1.428 1.00 0.87 H new ATOM 0 HA VAL B 17 -3.603 -7.268 4.111 1.00 0.95 H new ATOM 0 HB VAL B 17 -6.189 -7.860 2.721 1.00 1.10 H new ATOM 0 HG11 VAL B 17 -7.365 -7.337 4.847 1.00 1.30 H new ATOM 0 HG12 VAL B 17 -6.390 -8.820 4.970 1.00 1.30 H new ATOM 0 HG13 VAL B 17 -5.798 -7.305 5.691 1.00 1.30 H new ATOM 0 HG21 VAL B 17 -6.680 -5.491 3.428 1.00 1.14 H new ATOM 0 HG22 VAL B 17 -5.072 -5.407 4.188 1.00 1.14 H new ATOM 0 HG23 VAL B 17 -5.215 -5.587 2.423 1.00 1.14 H new ATOM 1898 N THR B 18 -4.418 -10.365 3.256 1.00 1.03 N ATOM 1899 CA THR B 18 -4.255 -11.743 3.708 1.00 1.14 C ATOM 1900 C THR B 18 -2.782 -12.023 4.041 1.00 0.97 C ATOM 1901 O THR B 18 -2.482 -12.463 5.150 1.00 0.96 O ATOM 1902 CB THR B 18 -4.903 -12.744 2.735 1.00 1.50 C ATOM 1903 OG1 THR B 18 -4.824 -14.052 3.261 1.00 1.64 O ATOM 1904 CG2 THR B 18 -4.292 -12.726 1.337 1.00 1.65 C ATOM 0 H THR B 18 -4.801 -10.269 2.316 1.00 1.03 H new ATOM 0 HA THR B 18 -4.803 -11.886 4.639 1.00 1.14 H new ATOM 0 HB THR B 18 -5.942 -12.431 2.630 1.00 1.50 H new ATOM 0 HG1 THR B 18 -5.240 -14.682 2.636 1.00 1.64 H new ATOM 0 HG21 THR B 18 -4.800 -13.457 0.708 1.00 1.65 H new ATOM 0 HG22 THR B 18 -4.406 -11.733 0.903 1.00 1.65 H new ATOM 0 HG23 THR B 18 -3.233 -12.975 1.400 1.00 1.65 H new ATOM 1912 N THR B 19 -1.845 -11.704 3.141 1.00 0.91 N ATOM 1913 CA THR B 19 -0.418 -11.872 3.387 1.00 0.91 C ATOM 1914 C THR B 19 -0.014 -11.164 4.684 1.00 0.86 C ATOM 1915 O THR B 19 0.505 -11.799 5.604 1.00 0.92 O ATOM 1916 CB THR B 19 0.361 -11.378 2.161 1.00 0.96 C ATOM 1917 OG1 THR B 19 -0.298 -11.902 1.029 1.00 1.05 O ATOM 1918 CG2 THR B 19 1.817 -11.856 2.177 1.00 1.00 C ATOM 0 H THR B 19 -2.061 -11.321 2.221 1.00 0.91 H new ATOM 0 HA THR B 19 -0.175 -12.925 3.529 1.00 0.91 H new ATOM 0 HB THR B 19 0.388 -10.288 2.153 1.00 0.96 H new ATOM 0 HG1 THR B 19 -0.924 -11.235 0.677 1.00 1.05 H new ATOM 0 HG21 THR B 19 2.332 -11.484 1.291 1.00 1.00 H new ATOM 0 HG22 THR B 19 2.314 -11.479 3.071 1.00 1.00 H new ATOM 0 HG23 THR B 19 1.842 -12.946 2.180 1.00 1.00 H new ATOM 1926 N PHE B 20 -0.318 -9.866 4.785 1.00 0.82 N ATOM 1927 CA PHE B 20 -0.162 -9.087 6.006 1.00 0.92 C ATOM 1928 C PHE B 20 -0.649 -9.887 7.210 1.00 0.88 C ATOM 1929 O PHE B 20 0.120 -10.111 8.138 1.00 0.92 O ATOM 1930 CB PHE B 20 -0.909 -7.749 5.889 1.00 1.12 C ATOM 1931 CG PHE B 20 -1.286 -7.112 7.217 1.00 1.90 C ATOM 1932 CD1 PHE B 20 -0.284 -6.688 8.111 1.00 2.65 C ATOM 1933 CD2 PHE B 20 -2.629 -7.125 7.639 1.00 3.44 C ATOM 1934 CE1 PHE B 20 -0.627 -6.228 9.395 1.00 3.71 C ATOM 1935 CE2 PHE B 20 -2.963 -6.734 8.946 1.00 4.42 C ATOM 1936 CZ PHE B 20 -1.963 -6.283 9.824 1.00 4.26 C ATOM 0 H PHE B 20 -0.685 -9.323 4.004 1.00 0.82 H new ATOM 0 HA PHE B 20 0.896 -8.868 6.151 1.00 0.92 H new ATOM 0 HB2 PHE B 20 -0.288 -7.050 5.330 1.00 1.12 H new ATOM 0 HB3 PHE B 20 -1.817 -7.905 5.306 1.00 1.12 H new ATOM 0 HD1 PHE B 20 0.753 -6.716 7.809 1.00 2.65 H new ATOM 0 HD2 PHE B 20 -3.405 -7.437 6.956 1.00 3.44 H new ATOM 0 HE1 PHE B 20 0.136 -5.833 10.050 1.00 3.71 H new ATOM 0 HE2 PHE B 20 -3.990 -6.780 9.277 1.00 4.42 H new ATOM 0 HZ PHE B 20 -2.222 -5.979 10.828 1.00 4.26 H new ATOM 1946 N PHE B 21 -1.904 -10.337 7.189 1.00 0.91 N ATOM 1947 CA PHE B 21 -2.499 -11.059 8.299 1.00 1.01 C ATOM 1948 C PHE B 21 -1.679 -12.304 8.646 1.00 1.05 C ATOM 1949 O PHE B 21 -1.300 -12.490 9.801 1.00 1.08 O ATOM 1950 CB PHE B 21 -3.959 -11.406 7.987 1.00 1.26 C ATOM 1951 CG PHE B 21 -4.684 -12.012 9.171 1.00 1.54 C ATOM 1952 CD1 PHE B 21 -5.110 -11.185 10.227 1.00 1.56 C ATOM 1953 CD2 PHE B 21 -4.847 -13.407 9.266 1.00 3.07 C ATOM 1954 CE1 PHE B 21 -5.717 -11.747 11.363 1.00 2.04 C ATOM 1955 CE2 PHE B 21 -5.456 -13.969 10.402 1.00 3.62 C ATOM 1956 CZ PHE B 21 -5.895 -13.139 11.449 1.00 2.79 C ATOM 0 H PHE B 21 -2.533 -10.207 6.397 1.00 0.91 H new ATOM 0 HA PHE B 21 -2.491 -10.415 9.179 1.00 1.01 H new ATOM 0 HB2 PHE B 21 -4.482 -10.504 7.669 1.00 1.26 H new ATOM 0 HB3 PHE B 21 -3.991 -12.104 7.151 1.00 1.26 H new ATOM 0 HD1 PHE B 21 -4.970 -10.116 10.164 1.00 1.56 H new ATOM 0 HD2 PHE B 21 -4.504 -14.046 8.466 1.00 3.07 H new ATOM 0 HE1 PHE B 21 -6.047 -11.110 12.170 1.00 2.04 H new ATOM 0 HE2 PHE B 21 -5.587 -15.039 10.471 1.00 3.62 H new ATOM 0 HZ PHE B 21 -6.369 -13.571 12.318 1.00 2.79 H new ATOM 1966 N THR B 22 -1.388 -13.152 7.654 1.00 1.15 N ATOM 1967 CA THR B 22 -0.663 -14.398 7.872 1.00 1.33 C ATOM 1968 C THR B 22 0.697 -14.171 8.538 1.00 1.20 C ATOM 1969 O THR B 22 1.128 -15.014 9.321 1.00 1.38 O ATOM 1970 CB THR B 22 -0.528 -15.214 6.580 1.00 1.63 C ATOM 1971 OG1 THR B 22 0.141 -14.487 5.575 1.00 2.62 O ATOM 1972 CG2 THR B 22 -1.888 -15.691 6.060 1.00 1.61 C ATOM 0 H THR B 22 -1.650 -12.990 6.682 1.00 1.15 H new ATOM 0 HA THR B 22 -1.261 -14.986 8.568 1.00 1.33 H new ATOM 0 HB THR B 22 0.069 -16.091 6.830 1.00 1.63 H new ATOM 0 HG1 THR B 22 0.144 -13.535 5.807 1.00 2.62 H new ATOM 0 HG21 THR B 22 -1.746 -16.265 5.144 1.00 1.61 H new ATOM 0 HG22 THR B 22 -2.365 -16.320 6.812 1.00 1.61 H new ATOM 0 HG23 THR B 22 -2.522 -14.828 5.854 1.00 1.61 H new ATOM 1980 N PHE B 23 1.370 -13.051 8.263 1.00 1.08 N ATOM 1981 CA PHE B 23 2.580 -12.701 8.999 1.00 1.10 C ATOM 1982 C PHE B 23 2.251 -12.053 10.344 1.00 1.01 C ATOM 1983 O PHE B 23 2.794 -12.425 11.375 1.00 1.11 O ATOM 1984 CB PHE B 23 3.511 -11.842 8.135 1.00 1.23 C ATOM 1985 CG PHE B 23 4.293 -12.643 7.106 1.00 1.18 C ATOM 1986 CD1 PHE B 23 3.671 -13.092 5.926 1.00 2.23 C ATOM 1987 CD2 PHE B 23 5.629 -13.009 7.365 1.00 2.14 C ATOM 1988 CE1 PHE B 23 4.392 -13.848 4.986 1.00 2.71 C ATOM 1989 CE2 PHE B 23 6.349 -13.769 6.427 1.00 2.49 C ATOM 1990 CZ PHE B 23 5.737 -14.172 5.228 1.00 2.33 C ATOM 0 H PHE B 23 1.099 -12.380 7.544 1.00 1.08 H new ATOM 0 HA PHE B 23 3.120 -13.619 9.231 1.00 1.10 H new ATOM 0 HB2 PHE B 23 2.920 -11.084 7.621 1.00 1.23 H new ATOM 0 HB3 PHE B 23 4.212 -11.315 8.783 1.00 1.23 H new ATOM 0 HD1 PHE B 23 2.634 -12.854 5.742 1.00 2.23 H new ATOM 0 HD2 PHE B 23 6.101 -12.705 8.287 1.00 2.14 H new ATOM 0 HE1 PHE B 23 3.912 -14.180 4.077 1.00 2.71 H new ATOM 0 HE2 PHE B 23 7.374 -14.044 6.628 1.00 2.49 H new ATOM 0 HZ PHE B 23 6.300 -14.730 4.494 1.00 2.33 H new ATOM 2000 N ALA B 24 1.343 -11.087 10.366 1.00 0.93 N ATOM 2001 CA ALA B 24 0.997 -10.315 11.545 1.00 0.97 C ATOM 2002 C ALA B 24 0.609 -11.251 12.680 1.00 1.01 C ATOM 2003 O ALA B 24 1.005 -11.018 13.824 1.00 0.97 O ATOM 2004 CB ALA B 24 -0.147 -9.349 11.230 1.00 1.02 C ATOM 0 H ALA B 24 0.813 -10.813 9.539 1.00 0.93 H new ATOM 0 HA ALA B 24 1.863 -9.730 11.854 1.00 0.97 H new ATOM 0 HB1 ALA B 24 -0.396 -8.776 12.123 1.00 1.02 H new ATOM 0 HB2 ALA B 24 0.160 -8.668 10.436 1.00 1.02 H new ATOM 0 HB3 ALA B 24 -1.021 -9.914 10.906 1.00 1.02 H new ATOM 2010 N ARG B 25 -0.142 -12.302 12.348 1.00 1.13 N ATOM 2011 CA ARG B 25 -0.693 -13.253 13.296 1.00 1.35 C ATOM 2012 C ARG B 25 0.374 -14.102 13.981 1.00 1.43 C ATOM 2013 O ARG B 25 0.025 -14.767 14.951 1.00 1.72 O ATOM 2014 CB ARG B 25 -1.802 -14.112 12.656 1.00 1.66 C ATOM 2015 CG ARG B 25 -1.291 -15.080 11.581 1.00 2.19 C ATOM 2016 CD ARG B 25 -0.824 -16.449 12.110 1.00 2.04 C ATOM 2017 NE ARG B 25 0.340 -16.939 11.349 1.00 2.79 N ATOM 2018 CZ ARG B 25 0.323 -17.670 10.224 1.00 3.87 C ATOM 2019 NH1 ARG B 25 -0.831 -18.107 9.710 1.00 4.48 N ATOM 2020 NH2 ARG B 25 1.481 -17.949 9.623 1.00 4.75 N ATOM 0 H ARG B 25 -0.387 -12.515 11.381 1.00 1.13 H new ATOM 0 HA ARG B 25 -1.154 -12.665 14.090 1.00 1.35 H new ATOM 0 HB2 ARG B 25 -2.303 -14.683 13.438 1.00 1.66 H new ATOM 0 HB3 ARG B 25 -2.549 -13.453 12.213 1.00 1.66 H new ATOM 0 HG2 ARG B 25 -2.084 -15.240 10.851 1.00 2.19 H new ATOM 0 HG3 ARG B 25 -0.462 -14.609 11.053 1.00 2.19 H new ATOM 0 HD2 ARG B 25 -0.565 -16.366 13.165 1.00 2.04 H new ATOM 0 HD3 ARG B 25 -1.640 -17.169 12.038 1.00 2.04 H new ATOM 0 HE ARG B 25 1.259 -16.696 11.718 1.00 2.79 H new ATOM 0 HH11 ARG B 25 -1.712 -17.886 10.174 1.00 4.48 H new ATOM 0 HH12 ARG B 25 -0.830 -18.662 8.854 1.00 4.48 H new ATOM 0 HH21 ARG B 25 2.357 -17.608 10.020 1.00 4.75 H new ATOM 0 HH22 ARG B 25 1.491 -18.503 8.767 1.00 4.75 H new ATOM 2034 N GLN B 26 1.607 -14.182 13.456 1.00 1.29 N ATOM 2035 CA GLN B 26 2.582 -15.154 13.921 1.00 1.32 C ATOM 2036 C GLN B 26 2.724 -15.224 15.447 1.00 1.53 C ATOM 2037 O GLN B 26 2.534 -16.287 16.034 1.00 1.60 O ATOM 2038 CB GLN B 26 3.932 -14.822 13.276 1.00 1.17 C ATOM 2039 CG GLN B 26 4.790 -16.035 12.989 1.00 1.21 C ATOM 2040 CD GLN B 26 4.274 -16.933 11.863 1.00 1.38 C ATOM 2041 OE1 GLN B 26 3.134 -16.825 11.407 1.00 1.82 O ATOM 2042 NE2 GLN B 26 5.113 -17.854 11.400 1.00 2.22 N ATOM 0 H GLN B 26 1.944 -13.578 12.706 1.00 1.29 H new ATOM 0 HA GLN B 26 2.227 -16.140 13.623 1.00 1.32 H new ATOM 0 HB2 GLN B 26 3.756 -14.285 12.344 1.00 1.17 H new ATOM 0 HB3 GLN B 26 4.481 -14.148 13.933 1.00 1.17 H new ATOM 0 HG2 GLN B 26 5.796 -15.700 12.735 1.00 1.21 H new ATOM 0 HG3 GLN B 26 4.872 -16.628 13.900 1.00 1.21 H new ATOM 0 HE21 GLN B 26 6.053 -17.929 11.789 1.00 2.22 H new ATOM 0 HE22 GLN B 26 4.817 -18.485 10.656 1.00 2.22 H new ATOM 2051 N GLU B 27 3.119 -14.117 16.078 1.00 1.68 N ATOM 2052 CA GLU B 27 3.722 -14.182 17.403 1.00 1.71 C ATOM 2053 C GLU B 27 2.801 -14.345 18.626 1.00 1.85 C ATOM 2054 O GLU B 27 3.224 -14.990 19.580 1.00 1.35 O ATOM 2055 CB GLU B 27 4.692 -13.019 17.580 1.00 2.00 C ATOM 2056 CG GLU B 27 5.994 -13.283 16.818 1.00 1.99 C ATOM 2057 CD GLU B 27 6.988 -12.151 17.035 1.00 2.41 C ATOM 2058 OE1 GLU B 27 6.648 -11.245 17.829 1.00 3.28 O ATOM 2059 OE2 GLU B 27 8.064 -12.187 16.405 1.00 2.54 O ATOM 0 H GLU B 27 3.032 -13.176 15.695 1.00 1.68 H new ATOM 0 HA GLU B 27 4.237 -15.143 17.401 1.00 1.71 H new ATOM 0 HB2 GLU B 27 4.234 -12.098 17.220 1.00 2.00 H new ATOM 0 HB3 GLU B 27 4.907 -12.875 18.639 1.00 2.00 H new ATOM 0 HG2 GLU B 27 6.431 -14.225 17.151 1.00 1.99 H new ATOM 0 HG3 GLU B 27 5.783 -13.388 15.754 1.00 1.99 H new ATOM 2066 N GLY B 28 1.584 -13.796 18.738 1.00 2.92 N ATOM 2067 CA GLY B 28 0.764 -13.078 17.783 1.00 3.13 C ATOM 2068 C GLY B 28 1.124 -11.607 17.629 1.00 1.55 C ATOM 2069 O GLY B 28 1.908 -11.250 16.750 1.00 1.38 O ATOM 0 H GLY B 28 1.095 -13.862 19.631 1.00 2.92 H new ATOM 0 HA2 GLY B 28 0.849 -13.564 16.811 1.00 3.13 H new ATOM 0 HA3 GLY B 28 -0.280 -13.155 18.088 1.00 3.13 H new ATOM 2073 N ARG B 29 0.463 -10.723 18.389 1.00 1.39 N ATOM 2074 CA ARG B 29 0.272 -9.328 17.986 1.00 1.54 C ATOM 2075 C ARG B 29 -0.254 -9.322 16.548 1.00 1.31 C ATOM 2076 O ARG B 29 0.510 -9.066 15.609 1.00 1.14 O ATOM 2077 CB ARG B 29 1.565 -8.505 18.136 1.00 1.98 C ATOM 2078 CG ARG B 29 1.807 -8.019 19.568 1.00 2.84 C ATOM 2079 CD ARG B 29 0.839 -6.894 19.967 1.00 2.26 C ATOM 2080 NE ARG B 29 1.552 -5.862 20.736 1.00 3.60 N ATOM 2081 CZ ARG B 29 1.489 -5.593 22.048 1.00 4.03 C ATOM 2082 NH1 ARG B 29 0.634 -6.255 22.837 1.00 3.73 N ATOM 2083 NH2 ARG B 29 2.288 -4.661 22.570 1.00 5.51 N ATOM 0 H ARG B 29 0.050 -10.955 19.292 1.00 1.39 H new ATOM 0 HA ARG B 29 -0.454 -8.848 18.642 1.00 1.54 H new ATOM 0 HB2 ARG B 29 2.413 -9.111 17.816 1.00 1.98 H new ATOM 0 HB3 ARG B 29 1.519 -7.644 17.470 1.00 1.98 H new ATOM 0 HG2 ARG B 29 1.695 -8.855 20.258 1.00 2.84 H new ATOM 0 HG3 ARG B 29 2.833 -7.664 19.662 1.00 2.84 H new ATOM 0 HD2 ARG B 29 0.395 -6.452 19.075 1.00 2.26 H new ATOM 0 HD3 ARG B 29 0.021 -7.301 20.561 1.00 2.26 H new ATOM 0 HE ARG B 29 2.182 -5.269 20.196 1.00 3.60 H new ATOM 0 HH11 ARG B 29 0.024 -6.970 22.441 1.00 3.73 H new ATOM 0 HH12 ARG B 29 0.592 -6.044 23.834 1.00 3.73 H new ATOM 0 HH21 ARG B 29 2.943 -4.157 21.972 1.00 5.51 H new ATOM 0 HH22 ARG B 29 2.244 -4.452 23.567 1.00 5.51 H new ATOM 2097 N LYS B 30 -1.527 -9.702 16.382 1.00 1.44 N ATOM 2098 CA LYS B 30 -2.213 -9.873 15.100 1.00 1.37 C ATOM 2099 C LYS B 30 -2.646 -8.519 14.525 1.00 1.40 C ATOM 2100 O LYS B 30 -3.798 -8.317 14.145 1.00 2.03 O ATOM 2101 CB LYS B 30 -3.367 -10.879 15.271 1.00 1.65 C ATOM 2102 CG LYS B 30 -4.496 -10.402 16.204 1.00 2.04 C ATOM 2103 CD LYS B 30 -5.349 -11.591 16.665 1.00 2.39 C ATOM 2104 CE LYS B 30 -6.496 -11.104 17.565 1.00 3.18 C ATOM 2105 NZ LYS B 30 -7.280 -12.225 18.127 1.00 3.71 N ATOM 0 H LYS B 30 -2.133 -9.908 17.176 1.00 1.44 H new ATOM 0 HA LYS B 30 -1.532 -10.293 14.360 1.00 1.37 H new ATOM 0 HB2 LYS B 30 -3.791 -11.097 14.291 1.00 1.65 H new ATOM 0 HB3 LYS B 30 -2.963 -11.814 15.659 1.00 1.65 H new ATOM 0 HG2 LYS B 30 -4.071 -9.894 17.070 1.00 2.04 H new ATOM 0 HG3 LYS B 30 -5.123 -9.676 15.685 1.00 2.04 H new ATOM 0 HD2 LYS B 30 -5.754 -12.115 15.799 1.00 2.39 H new ATOM 0 HD3 LYS B 30 -4.729 -12.304 17.208 1.00 2.39 H new ATOM 0 HE2 LYS B 30 -6.088 -10.505 18.379 1.00 3.18 H new ATOM 0 HE3 LYS B 30 -7.156 -10.454 16.990 1.00 3.18 H new ATOM 0 HZ1 LYS B 30 -8.042 -11.849 18.727 1.00 3.71 H new ATOM 0 HZ2 LYS B 30 -7.692 -12.783 17.352 1.00 3.71 H new ATOM 0 HZ3 LYS B 30 -6.658 -12.832 18.698 1.00 3.71 H new ATOM 2119 N ASP B 31 -1.694 -7.592 14.492 1.00 1.29 N ATOM 2120 CA ASP B 31 -1.869 -6.175 14.215 1.00 1.35 C ATOM 2121 C ASP B 31 -0.505 -5.614 13.819 1.00 1.21 C ATOM 2122 O ASP B 31 -0.381 -4.940 12.799 1.00 1.39 O ATOM 2123 CB ASP B 31 -2.447 -5.435 15.442 1.00 1.59 C ATOM 2124 CG ASP B 31 -1.441 -5.266 16.578 1.00 3.07 C ATOM 2125 OD1 ASP B 31 -0.830 -6.298 16.939 1.00 4.15 O ATOM 2126 OD2 ASP B 31 -1.184 -4.103 16.972 1.00 4.23 O ATOM 0 H ASP B 31 -0.718 -7.828 14.670 1.00 1.29 H new ATOM 0 HA ASP B 31 -2.584 -6.032 13.404 1.00 1.35 H new ATOM 0 HB2 ASP B 31 -2.801 -4.452 15.131 1.00 1.59 H new ATOM 0 HB3 ASP B 31 -3.313 -5.983 15.812 1.00 1.59 H new ATOM 2131 N SER B 32 0.511 -5.923 14.629 1.00 1.08 N ATOM 2132 CA SER B 32 1.855 -5.409 14.495 1.00 1.04 C ATOM 2133 C SER B 32 2.846 -6.538 14.196 1.00 0.95 C ATOM 2134 O SER B 32 2.737 -7.656 14.721 1.00 0.99 O ATOM 2135 CB SER B 32 2.213 -4.616 15.757 1.00 1.34 C ATOM 2136 OG SER B 32 1.262 -3.587 15.994 1.00 3.05 O ATOM 0 H SER B 32 0.406 -6.560 15.419 1.00 1.08 H new ATOM 0 HA SER B 32 1.913 -4.730 13.644 1.00 1.04 H new ATOM 0 HB2 SER B 32 2.251 -5.287 16.615 1.00 1.34 H new ATOM 0 HB3 SER B 32 3.207 -4.181 15.649 1.00 1.34 H new ATOM 0 HG SER B 32 0.566 -3.918 16.599 1.00 3.05 H new ATOM 2142 N LEU B 33 3.801 -6.262 13.308 1.00 0.98 N ATOM 2143 CA LEU B 33 4.856 -7.178 12.918 1.00 0.95 C ATOM 2144 C LEU B 33 6.088 -6.923 13.781 1.00 1.01 C ATOM 2145 O LEU B 33 6.634 -5.824 13.768 1.00 1.42 O ATOM 2146 CB LEU B 33 5.183 -7.036 11.427 1.00 0.98 C ATOM 2147 CG LEU B 33 4.196 -7.797 10.534 1.00 1.03 C ATOM 2148 CD1 LEU B 33 2.906 -7.009 10.283 1.00 2.17 C ATOM 2149 CD2 LEU B 33 4.868 -8.180 9.211 1.00 2.36 C ATOM 0 H LEU B 33 3.857 -5.363 12.829 1.00 0.98 H new ATOM 0 HA LEU B 33 4.519 -8.202 13.077 1.00 0.95 H new ATOM 0 HB2 LEU B 33 5.174 -5.980 11.155 1.00 0.98 H new ATOM 0 HB3 LEU B 33 6.192 -7.404 11.243 1.00 0.98 H new ATOM 0 HG LEU B 33 3.909 -8.705 11.065 1.00 1.03 H new ATOM 0 HD11 LEU B 33 2.242 -7.592 9.645 1.00 2.17 H new ATOM 0 HD12 LEU B 33 2.412 -6.807 11.234 1.00 2.17 H new ATOM 0 HD13 LEU B 33 3.145 -6.066 9.791 1.00 2.17 H new ATOM 0 HD21 LEU B 33 4.158 -8.720 8.585 1.00 2.36 H new ATOM 0 HD22 LEU B 33 5.194 -7.278 8.694 1.00 2.36 H new ATOM 0 HD23 LEU B 33 5.731 -8.815 9.412 1.00 2.36 H new ATOM 2161 N SER B 34 6.545 -7.929 14.517 1.00 1.14 N ATOM 2162 CA SER B 34 7.792 -7.831 15.265 1.00 1.09 C ATOM 2163 C SER B 34 8.951 -8.148 14.316 1.00 0.98 C ATOM 2164 O SER B 34 8.721 -8.629 13.204 1.00 1.26 O ATOM 2165 CB SER B 34 7.738 -8.851 16.396 1.00 1.47 C ATOM 2166 OG SER B 34 6.498 -8.769 17.072 1.00 2.41 O ATOM 0 H SER B 34 6.068 -8.826 14.612 1.00 1.14 H new ATOM 0 HA SER B 34 7.934 -6.833 15.679 1.00 1.09 H new ATOM 0 HB2 SER B 34 7.876 -9.855 15.996 1.00 1.47 H new ATOM 0 HB3 SER B 34 8.554 -8.672 17.096 1.00 1.47 H new ATOM 0 HG SER B 34 6.167 -9.672 17.259 1.00 2.41 H new ATOM 2172 N VAL B 35 10.213 -7.961 14.718 1.00 0.88 N ATOM 2173 CA VAL B 35 11.319 -8.319 13.827 1.00 0.93 C ATOM 2174 C VAL B 35 11.668 -9.806 13.974 1.00 1.08 C ATOM 2175 O VAL B 35 12.832 -10.192 14.021 1.00 2.14 O ATOM 2176 CB VAL B 35 12.492 -7.353 14.076 1.00 1.35 C ATOM 2177 CG1 VAL B 35 13.198 -7.516 15.429 1.00 1.35 C ATOM 2178 CG2 VAL B 35 13.512 -7.347 12.930 1.00 2.67 C ATOM 0 H VAL B 35 10.488 -7.577 15.622 1.00 0.88 H new ATOM 0 HA VAL B 35 11.036 -8.201 12.781 1.00 0.93 H new ATOM 0 HB VAL B 35 12.007 -6.378 14.112 1.00 1.35 H new ATOM 0 HG11 VAL B 35 14.008 -6.791 15.507 1.00 1.35 H new ATOM 0 HG12 VAL B 35 12.483 -7.349 16.235 1.00 1.35 H new ATOM 0 HG13 VAL B 35 13.605 -8.524 15.508 1.00 1.35 H new ATOM 0 HG21 VAL B 35 14.315 -6.648 13.162 1.00 2.67 H new ATOM 0 HG22 VAL B 35 13.926 -8.348 12.806 1.00 2.67 H new ATOM 0 HG23 VAL B 35 13.020 -7.041 12.007 1.00 2.67 H new ATOM 2188 N ASN B 36 10.640 -10.648 13.862 1.00 1.05 N ATOM 2189 CA ASN B 36 10.718 -12.056 13.507 1.00 1.04 C ATOM 2190 C ASN B 36 9.332 -12.440 12.985 1.00 1.03 C ATOM 2191 O ASN B 36 8.642 -13.316 13.494 1.00 1.43 O ATOM 2192 CB ASN B 36 11.216 -12.904 14.678 1.00 1.42 C ATOM 2193 CG ASN B 36 11.614 -14.282 14.149 1.00 1.68 C ATOM 2194 OD1 ASN B 36 12.796 -14.571 13.987 1.00 2.06 O ATOM 2195 ND2 ASN B 36 10.625 -15.096 13.803 1.00 1.94 N ATOM 0 H ASN B 36 9.680 -10.344 14.027 1.00 1.05 H new ATOM 0 HA ASN B 36 11.456 -12.246 12.728 1.00 1.04 H new ATOM 0 HB2 ASN B 36 12.068 -12.423 15.158 1.00 1.42 H new ATOM 0 HB3 ASN B 36 10.437 -13.000 15.434 1.00 1.42 H new ATOM 0 HD21 ASN B 36 10.833 -16.002 13.384 1.00 1.94 H new ATOM 0 HD22 ASN B 36 9.656 -14.815 13.956 1.00 1.94 H new ATOM 2202 N GLU B 37 8.950 -11.690 11.959 1.00 0.99 N ATOM 2203 CA GLU B 37 7.638 -11.568 11.351 1.00 0.93 C ATOM 2204 C GLU B 37 7.916 -10.630 10.181 1.00 0.85 C ATOM 2205 O GLU B 37 7.760 -10.982 9.015 1.00 1.00 O ATOM 2206 CB GLU B 37 6.631 -10.936 12.340 1.00 0.92 C ATOM 2207 CG GLU B 37 5.666 -11.946 12.970 1.00 0.79 C ATOM 2208 CD GLU B 37 4.730 -11.305 13.990 1.00 0.84 C ATOM 2209 OE1 GLU B 37 4.834 -10.096 14.295 1.00 1.43 O ATOM 2210 OE2 GLU B 37 3.724 -11.901 14.437 1.00 1.58 O ATOM 0 H GLU B 37 9.626 -11.091 11.485 1.00 0.99 H new ATOM 0 HA GLU B 37 7.197 -12.520 11.056 1.00 0.93 H new ATOM 0 HB2 GLU B 37 7.183 -10.431 13.133 1.00 0.92 H new ATOM 0 HB3 GLU B 37 6.054 -10.173 11.818 1.00 0.92 H new ATOM 0 HG2 GLU B 37 5.074 -12.416 12.185 1.00 0.79 H new ATOM 0 HG3 GLU B 37 6.239 -12.737 13.454 1.00 0.79 H new ATOM 2217 N PHE B 38 8.442 -9.449 10.519 1.00 0.70 N ATOM 2218 CA PHE B 38 8.936 -8.498 9.544 1.00 0.68 C ATOM 2219 C PHE B 38 10.113 -9.090 8.768 1.00 0.68 C ATOM 2220 O PHE B 38 10.044 -9.251 7.550 1.00 0.75 O ATOM 2221 CB PHE B 38 9.324 -7.191 10.246 1.00 0.68 C ATOM 2222 CG PHE B 38 9.126 -6.006 9.341 1.00 0.70 C ATOM 2223 CD1 PHE B 38 10.080 -5.692 8.356 1.00 1.92 C ATOM 2224 CD2 PHE B 38 7.880 -5.362 9.342 1.00 2.03 C ATOM 2225 CE1 PHE B 38 9.788 -4.718 7.389 1.00 2.04 C ATOM 2226 CE2 PHE B 38 7.609 -4.358 8.407 1.00 2.18 C ATOM 2227 CZ PHE B 38 8.541 -4.073 7.402 1.00 1.26 C ATOM 0 H PHE B 38 8.533 -9.133 11.485 1.00 0.70 H new ATOM 0 HA PHE B 38 8.148 -8.277 8.824 1.00 0.68 H new ATOM 0 HB2 PHE B 38 8.724 -7.067 11.147 1.00 0.68 H new ATOM 0 HB3 PHE B 38 10.366 -7.240 10.562 1.00 0.68 H new ATOM 0 HD1 PHE B 38 11.034 -6.199 8.344 1.00 1.92 H new ATOM 0 HD2 PHE B 38 7.129 -5.642 10.066 1.00 2.03 H new ATOM 0 HE1 PHE B 38 10.521 -4.465 6.637 1.00 2.04 H new ATOM 0 HE2 PHE B 38 6.683 -3.804 8.460 1.00 2.18 H new ATOM 0 HZ PHE B 38 8.300 -3.354 6.633 1.00 1.26 H new ATOM 2237 N LYS B 39 11.199 -9.437 9.472 1.00 0.68 N ATOM 2238 CA LYS B 39 12.396 -9.947 8.813 1.00 0.77 C ATOM 2239 C LYS B 39 12.056 -11.213 8.014 1.00 0.80 C ATOM 2240 O LYS B 39 12.515 -11.387 6.887 1.00 0.84 O ATOM 2241 CB LYS B 39 13.562 -10.124 9.802 1.00 0.84 C ATOM 2242 CG LYS B 39 14.885 -10.364 9.050 1.00 0.95 C ATOM 2243 CD LYS B 39 16.089 -10.570 9.994 1.00 1.12 C ATOM 2244 CE LYS B 39 17.010 -9.346 10.178 1.00 2.07 C ATOM 2245 NZ LYS B 39 16.452 -8.283 11.041 1.00 3.51 N ATOM 0 H LYS B 39 11.268 -9.373 10.488 1.00 0.68 H new ATOM 0 HA LYS B 39 12.752 -9.209 8.095 1.00 0.77 H new ATOM 0 HB2 LYS B 39 13.651 -9.237 10.429 1.00 0.84 H new ATOM 0 HB3 LYS B 39 13.358 -10.964 10.465 1.00 0.84 H new ATOM 0 HG2 LYS B 39 14.779 -11.240 8.410 1.00 0.95 H new ATOM 0 HG3 LYS B 39 15.084 -9.514 8.397 1.00 0.95 H new ATOM 0 HD2 LYS B 39 15.713 -10.870 10.972 1.00 1.12 H new ATOM 0 HD3 LYS B 39 16.687 -11.398 9.615 1.00 1.12 H new ATOM 0 HE2 LYS B 39 17.957 -9.680 10.601 1.00 2.07 H new ATOM 0 HE3 LYS B 39 17.231 -8.923 9.198 1.00 2.07 H new ATOM 0 HZ1 LYS B 39 16.739 -7.353 10.675 1.00 3.51 H new ATOM 0 HZ2 LYS B 39 15.414 -8.348 11.045 1.00 3.51 H new ATOM 0 HZ3 LYS B 39 16.810 -8.399 12.010 1.00 3.51 H new ATOM 2259 N GLU B 40 11.195 -12.072 8.565 1.00 0.80 N ATOM 2260 CA GLU B 40 10.727 -13.249 7.857 1.00 0.84 C ATOM 2261 C GLU B 40 10.119 -12.907 6.491 1.00 0.86 C ATOM 2262 O GLU B 40 10.288 -13.684 5.556 1.00 0.90 O ATOM 2263 CB GLU B 40 9.762 -14.059 8.731 1.00 0.88 C ATOM 2264 CG GLU B 40 10.461 -14.560 10.004 1.00 1.02 C ATOM 2265 CD GLU B 40 9.651 -15.626 10.736 1.00 1.61 C ATOM 2266 OE1 GLU B 40 8.425 -15.682 10.498 1.00 2.56 O ATOM 2267 OE2 GLU B 40 10.284 -16.370 11.519 1.00 2.54 O ATOM 0 H GLU B 40 10.811 -11.967 9.504 1.00 0.80 H new ATOM 0 HA GLU B 40 11.596 -13.874 7.650 1.00 0.84 H new ATOM 0 HB2 GLU B 40 8.905 -13.442 9.001 1.00 0.88 H new ATOM 0 HB3 GLU B 40 9.378 -14.907 8.165 1.00 0.88 H new ATOM 0 HG2 GLU B 40 11.438 -14.967 9.742 1.00 1.02 H new ATOM 0 HG3 GLU B 40 10.636 -13.718 10.674 1.00 1.02 H new ATOM 2274 N LEU B 41 9.445 -11.762 6.332 1.00 0.86 N ATOM 2275 CA LEU B 41 8.805 -11.428 5.063 1.00 0.90 C ATOM 2276 C LEU B 41 9.882 -11.190 4.010 1.00 0.91 C ATOM 2277 O LEU B 41 9.793 -11.708 2.898 1.00 0.96 O ATOM 2278 CB LEU B 41 7.890 -10.203 5.227 1.00 0.91 C ATOM 2279 CG LEU B 41 6.999 -9.885 4.005 1.00 0.96 C ATOM 2280 CD1 LEU B 41 5.954 -10.977 3.758 1.00 1.92 C ATOM 2281 CD2 LEU B 41 6.269 -8.564 4.267 1.00 1.65 C ATOM 0 H LEU B 41 9.331 -11.059 7.062 1.00 0.86 H new ATOM 0 HA LEU B 41 8.176 -12.256 4.737 1.00 0.90 H new ATOM 0 HB2 LEU B 41 7.249 -10.361 6.094 1.00 0.91 H new ATOM 0 HB3 LEU B 41 8.509 -9.332 5.443 1.00 0.91 H new ATOM 0 HG LEU B 41 7.639 -9.823 3.125 1.00 0.96 H new ATOM 0 HD11 LEU B 41 5.350 -10.713 2.890 1.00 1.92 H new ATOM 0 HD12 LEU B 41 6.457 -11.927 3.575 1.00 1.92 H new ATOM 0 HD13 LEU B 41 5.311 -11.070 4.633 1.00 1.92 H new ATOM 0 HD21 LEU B 41 5.635 -8.323 3.414 1.00 1.65 H new ATOM 0 HD22 LEU B 41 5.653 -8.660 5.161 1.00 1.65 H new ATOM 0 HD23 LEU B 41 6.999 -7.768 4.412 1.00 1.65 H new ATOM 2293 N VAL B 42 10.916 -10.423 4.371 1.00 0.89 N ATOM 2294 CA VAL B 42 11.980 -10.075 3.442 1.00 0.93 C ATOM 2295 C VAL B 42 12.803 -11.313 3.104 1.00 0.94 C ATOM 2296 O VAL B 42 13.078 -11.573 1.935 1.00 0.99 O ATOM 2297 CB VAL B 42 12.821 -8.885 3.928 1.00 0.91 C ATOM 2298 CG1 VAL B 42 12.045 -7.572 3.759 1.00 0.94 C ATOM 2299 CG2 VAL B 42 13.340 -8.994 5.355 1.00 0.85 C ATOM 0 H VAL B 42 11.033 -10.033 5.306 1.00 0.89 H new ATOM 0 HA VAL B 42 11.529 -9.725 2.513 1.00 0.93 H new ATOM 0 HB VAL B 42 13.707 -8.897 3.293 1.00 0.91 H new ATOM 0 HG11 VAL B 42 12.657 -6.740 4.109 1.00 0.94 H new ATOM 0 HG12 VAL B 42 11.801 -7.426 2.707 1.00 0.94 H new ATOM 0 HG13 VAL B 42 11.125 -7.616 4.342 1.00 0.94 H new ATOM 0 HG21 VAL B 42 13.921 -8.105 5.600 1.00 0.85 H new ATOM 0 HG22 VAL B 42 12.499 -9.079 6.043 1.00 0.85 H new ATOM 0 HG23 VAL B 42 13.973 -9.877 5.446 1.00 0.85 H new ATOM 2309 N THR B 43 13.156 -12.092 4.125 1.00 0.93 N ATOM 2310 CA THR B 43 13.841 -13.360 3.963 1.00 0.95 C ATOM 2311 C THR B 43 13.057 -14.297 3.035 1.00 1.00 C ATOM 2312 O THR B 43 13.626 -14.878 2.114 1.00 1.09 O ATOM 2313 CB THR B 43 14.019 -13.960 5.362 1.00 0.87 C ATOM 2314 OG1 THR B 43 14.802 -13.078 6.141 1.00 0.88 O ATOM 2315 CG2 THR B 43 14.704 -15.329 5.340 1.00 0.93 C ATOM 0 H THR B 43 12.969 -11.851 5.098 1.00 0.93 H new ATOM 0 HA THR B 43 14.814 -13.217 3.492 1.00 0.95 H new ATOM 0 HB THR B 43 13.024 -14.096 5.785 1.00 0.87 H new ATOM 0 HG1 THR B 43 14.226 -12.389 6.533 1.00 0.88 H new ATOM 0 HG21 THR B 43 14.802 -15.703 6.359 1.00 0.93 H new ATOM 0 HG22 THR B 43 14.105 -16.026 4.754 1.00 0.93 H new ATOM 0 HG23 THR B 43 15.693 -15.234 4.892 1.00 0.93 H new ATOM 2323 N GLN B 44 11.764 -14.488 3.309 1.00 0.97 N ATOM 2324 CA GLN B 44 10.961 -15.519 2.671 1.00 1.01 C ATOM 2325 C GLN B 44 10.497 -15.091 1.277 1.00 1.19 C ATOM 2326 O GLN B 44 10.694 -15.816 0.306 1.00 1.20 O ATOM 2327 CB GLN B 44 9.768 -15.838 3.584 1.00 1.01 C ATOM 2328 CG GLN B 44 8.942 -17.040 3.111 1.00 1.10 C ATOM 2329 CD GLN B 44 7.650 -17.173 3.912 1.00 1.30 C ATOM 2330 OE1 GLN B 44 6.576 -17.345 3.346 1.00 2.13 O ATOM 2331 NE2 GLN B 44 7.726 -17.063 5.235 1.00 1.40 N ATOM 0 H GLN B 44 11.247 -13.925 3.985 1.00 0.97 H new ATOM 0 HA GLN B 44 11.566 -16.415 2.531 1.00 1.01 H new ATOM 0 HB2 GLN B 44 10.134 -16.032 4.592 1.00 1.01 H new ATOM 0 HB3 GLN B 44 9.121 -14.963 3.643 1.00 1.01 H new ATOM 0 HG2 GLN B 44 8.707 -16.929 2.053 1.00 1.10 H new ATOM 0 HG3 GLN B 44 9.531 -17.952 3.212 1.00 1.10 H new ATOM 0 HE21 GLN B 44 8.631 -16.920 5.684 1.00 1.40 H new ATOM 0 HE22 GLN B 44 6.880 -17.121 5.801 1.00 1.40 H new ATOM 2340 N GLN B 45 9.787 -13.964 1.195 1.00 1.33 N ATOM 2341 CA GLN B 45 8.918 -13.689 0.062 1.00 1.39 C ATOM 2342 C GLN B 45 9.678 -13.171 -1.154 1.00 1.43 C ATOM 2343 O GLN B 45 9.434 -13.644 -2.258 1.00 1.51 O ATOM 2344 CB GLN B 45 7.858 -12.662 0.474 1.00 1.64 C ATOM 2345 CG GLN B 45 6.864 -12.353 -0.655 1.00 3.01 C ATOM 2346 CD GLN B 45 5.699 -13.337 -0.702 1.00 2.81 C ATOM 2347 OE1 GLN B 45 4.924 -13.413 0.243 1.00 2.82 O ATOM 2348 NE2 GLN B 45 5.540 -14.082 -1.793 1.00 3.84 N ATOM 0 H GLN B 45 9.801 -13.230 1.903 1.00 1.33 H new ATOM 0 HA GLN B 45 8.453 -14.632 -0.226 1.00 1.39 H new ATOM 0 HB2 GLN B 45 7.313 -13.036 1.341 1.00 1.64 H new ATOM 0 HB3 GLN B 45 8.351 -11.740 0.781 1.00 1.64 H new ATOM 0 HG2 GLN B 45 6.476 -11.343 -0.525 1.00 3.01 H new ATOM 0 HG3 GLN B 45 7.389 -12.372 -1.610 1.00 3.01 H new ATOM 0 HE21 GLN B 45 6.199 -14.000 -2.567 1.00 3.84 H new ATOM 0 HE22 GLN B 45 4.759 -14.735 -1.855 1.00 3.84 H new ATOM 2357 N LEU B 46 10.455 -12.100 -0.954 1.00 1.42 N ATOM 2358 CA LEU B 46 10.519 -10.958 -1.874 1.00 1.21 C ATOM 2359 C LEU B 46 10.485 -11.296 -3.373 1.00 1.37 C ATOM 2360 O LEU B 46 9.645 -10.729 -4.064 1.00 1.66 O ATOM 2361 CB LEU B 46 11.622 -9.977 -1.448 1.00 1.75 C ATOM 2362 CG LEU B 46 11.103 -8.759 -0.658 1.00 1.61 C ATOM 2363 CD1 LEU B 46 10.564 -7.673 -1.586 1.00 2.45 C ATOM 2364 CD2 LEU B 46 10.023 -9.069 0.389 1.00 1.46 C ATOM 0 H LEU B 46 11.063 -12.001 -0.141 1.00 1.42 H new ATOM 0 HA LEU B 46 9.569 -10.434 -1.770 1.00 1.21 H new ATOM 0 HB2 LEU B 46 12.352 -10.509 -0.838 1.00 1.75 H new ATOM 0 HB3 LEU B 46 12.145 -9.625 -2.337 1.00 1.75 H new ATOM 0 HG LEU B 46 11.986 -8.415 -0.120 1.00 1.61 H new ATOM 0 HD11 LEU B 46 10.207 -6.831 -0.992 1.00 2.45 H new ATOM 0 HD12 LEU B 46 11.358 -7.337 -2.252 1.00 2.45 H new ATOM 0 HD13 LEU B 46 9.741 -8.075 -2.177 1.00 2.45 H new ATOM 0 HD21 LEU B 46 9.726 -8.147 0.889 1.00 1.46 H new ATOM 0 HD22 LEU B 46 9.156 -9.511 -0.102 1.00 1.46 H new ATOM 0 HD23 LEU B 46 10.420 -9.769 1.125 1.00 1.46 H new ATOM 2376 N PRO B 47 11.301 -12.229 -3.882 1.00 1.91 N ATOM 2377 CA PRO B 47 12.664 -12.486 -3.467 1.00 1.79 C ATOM 2378 C PRO B 47 13.599 -11.518 -4.206 1.00 1.61 C ATOM 2379 O PRO B 47 14.672 -11.201 -3.703 1.00 1.76 O ATOM 2380 CB PRO B 47 12.922 -13.928 -3.907 1.00 2.21 C ATOM 2381 CG PRO B 47 12.122 -14.046 -5.207 1.00 2.71 C ATOM 2382 CD PRO B 47 10.921 -13.126 -4.966 1.00 2.71 C ATOM 0 HA PRO B 47 12.830 -12.350 -2.398 1.00 1.79 H new ATOM 0 HB2 PRO B 47 13.983 -14.116 -4.069 1.00 2.21 H new ATOM 0 HB3 PRO B 47 12.582 -14.644 -3.159 1.00 2.21 H new ATOM 0 HG2 PRO B 47 12.707 -13.727 -6.070 1.00 2.71 H new ATOM 0 HG3 PRO B 47 11.810 -15.073 -5.396 1.00 2.71 H new ATOM 0 HD2 PRO B 47 10.675 -12.564 -5.867 1.00 2.71 H new ATOM 0 HD3 PRO B 47 10.036 -13.704 -4.700 1.00 2.71 H new ATOM 2390 N HIS B 48 13.204 -11.080 -5.410 1.00 1.63 N ATOM 2391 CA HIS B 48 14.022 -10.309 -6.334 1.00 1.62 C ATOM 2392 C HIS B 48 13.648 -8.828 -6.255 1.00 1.53 C ATOM 2393 O HIS B 48 14.516 -7.968 -6.379 1.00 1.95 O ATOM 2394 CB HIS B 48 13.799 -10.860 -7.751 1.00 1.73 C ATOM 2395 CG HIS B 48 14.931 -10.589 -8.710 1.00 1.72 C ATOM 2396 ND1 HIS B 48 15.750 -11.547 -9.264 1.00 2.53 N ATOM 2397 CD2 HIS B 48 15.308 -9.375 -9.221 1.00 2.32 C ATOM 2398 CE1 HIS B 48 16.608 -10.919 -10.086 1.00 2.56 C ATOM 2399 NE2 HIS B 48 16.380 -9.596 -10.093 1.00 2.13 N ATOM 0 H HIS B 48 12.269 -11.264 -5.773 1.00 1.63 H new ATOM 0 HA HIS B 48 15.077 -10.397 -6.073 1.00 1.62 H new ATOM 0 HB2 HIS B 48 13.642 -11.937 -7.688 1.00 1.73 H new ATOM 0 HB3 HIS B 48 12.884 -10.427 -8.156 1.00 1.73 H new ATOM 0 HD2 HIS B 48 14.859 -8.420 -8.992 1.00 2.32 H new ATOM 0 HE1 HIS B 48 17.377 -11.412 -10.663 1.00 2.56 H new ATOM 0 HE2 HIS B 48 16.888 -8.891 -10.628 1.00 2.13 H new ATOM 2407 N LEU B 49 12.350 -8.551 -6.085 1.00 1.44 N ATOM 2408 CA LEU B 49 11.741 -7.229 -6.150 1.00 1.36 C ATOM 2409 C LEU B 49 12.603 -6.086 -5.608 1.00 1.64 C ATOM 2410 O LEU B 49 12.875 -5.125 -6.325 1.00 2.04 O ATOM 2411 CB LEU B 49 10.418 -7.291 -5.390 1.00 0.98 C ATOM 2412 CG LEU B 49 9.600 -6.002 -5.493 1.00 0.82 C ATOM 2413 CD1 LEU B 49 9.179 -5.725 -6.933 1.00 1.01 C ATOM 2414 CD2 LEU B 49 8.315 -6.164 -4.693 1.00 0.70 C ATOM 0 H LEU B 49 11.667 -9.283 -5.889 1.00 1.44 H new ATOM 0 HA LEU B 49 11.606 -6.992 -7.205 1.00 1.36 H new ATOM 0 HB2 LEU B 49 9.825 -8.121 -5.774 1.00 0.98 H new ATOM 0 HB3 LEU B 49 10.620 -7.502 -4.340 1.00 0.98 H new ATOM 0 HG LEU B 49 10.221 -5.188 -5.120 1.00 0.82 H new ATOM 0 HD11 LEU B 49 8.600 -4.803 -6.972 1.00 1.01 H new ATOM 0 HD12 LEU B 49 10.066 -5.623 -7.558 1.00 1.01 H new ATOM 0 HD13 LEU B 49 8.570 -6.551 -7.299 1.00 1.01 H new ATOM 0 HD21 LEU B 49 7.726 -5.249 -4.761 1.00 0.70 H new ATOM 0 HD22 LEU B 49 7.739 -6.997 -5.095 1.00 0.70 H new ATOM 0 HD23 LEU B 49 8.559 -6.361 -3.649 1.00 0.70 H new ATOM 2426 N LEU B 50 12.992 -6.171 -4.332 1.00 1.62 N ATOM 2427 CA LEU B 50 14.002 -5.302 -3.752 1.00 1.97 C ATOM 2428 C LEU B 50 15.119 -6.173 -3.185 1.00 1.75 C ATOM 2429 O LEU B 50 15.121 -7.389 -3.362 1.00 2.56 O ATOM 2430 CB LEU B 50 13.416 -4.250 -2.784 1.00 2.57 C ATOM 2431 CG LEU B 50 12.628 -4.721 -1.549 1.00 1.09 C ATOM 2432 CD1 LEU B 50 13.364 -5.744 -0.676 1.00 2.71 C ATOM 2433 CD2 LEU B 50 12.292 -3.509 -0.671 1.00 0.99 C ATOM 0 H LEU B 50 12.609 -6.851 -3.675 1.00 1.62 H new ATOM 0 HA LEU B 50 14.443 -4.673 -4.525 1.00 1.97 H new ATOM 0 HB2 LEU B 50 14.243 -3.634 -2.430 1.00 2.57 H new ATOM 0 HB3 LEU B 50 12.760 -3.601 -3.364 1.00 2.57 H new ATOM 0 HG LEU B 50 11.738 -5.215 -1.940 1.00 1.09 H new ATOM 0 HD11 LEU B 50 12.735 -6.019 0.171 1.00 2.71 H new ATOM 0 HD12 LEU B 50 13.587 -6.633 -1.266 1.00 2.71 H new ATOM 0 HD13 LEU B 50 14.294 -5.308 -0.310 1.00 2.71 H new ATOM 0 HD21 LEU B 50 11.734 -3.838 0.205 1.00 0.99 H new ATOM 0 HD22 LEU B 50 13.214 -3.024 -0.352 1.00 0.99 H new ATOM 0 HD23 LEU B 50 11.689 -2.803 -1.241 1.00 0.99 H new ATOM 2445 N LYS B 51 16.085 -5.541 -2.526 1.00 1.53 N ATOM 2446 CA LYS B 51 17.380 -6.104 -2.212 1.00 1.65 C ATOM 2447 C LYS B 51 17.873 -5.462 -0.925 1.00 1.74 C ATOM 2448 O LYS B 51 17.276 -4.490 -0.459 1.00 2.34 O ATOM 2449 CB LYS B 51 18.347 -5.877 -3.390 1.00 1.92 C ATOM 2450 CG LYS B 51 18.785 -4.421 -3.648 1.00 2.28 C ATOM 2451 CD LYS B 51 17.616 -3.437 -3.808 1.00 3.24 C ATOM 2452 CE LYS B 51 18.044 -2.130 -4.475 1.00 4.20 C ATOM 2453 NZ LYS B 51 16.988 -1.105 -4.371 1.00 5.74 N ATOM 0 H LYS B 51 15.976 -4.586 -2.186 1.00 1.53 H new ATOM 0 HA LYS B 51 17.316 -7.182 -2.060 1.00 1.65 H new ATOM 0 HB2 LYS B 51 19.241 -6.477 -3.219 1.00 1.92 H new ATOM 0 HB3 LYS B 51 17.876 -6.258 -4.296 1.00 1.92 H new ATOM 0 HG2 LYS B 51 19.415 -4.090 -2.822 1.00 2.28 H new ATOM 0 HG3 LYS B 51 19.398 -4.391 -4.549 1.00 2.28 H new ATOM 0 HD2 LYS B 51 16.830 -3.904 -4.401 1.00 3.24 H new ATOM 0 HD3 LYS B 51 17.190 -3.220 -2.828 1.00 3.24 H new ATOM 0 HE2 LYS B 51 18.958 -1.763 -4.008 1.00 4.20 H new ATOM 0 HE3 LYS B 51 18.274 -2.313 -5.525 1.00 4.20 H new ATOM 0 HZ1 LYS B 51 16.894 -0.610 -5.281 1.00 5.74 H new ATOM 0 HZ2 LYS B 51 16.085 -1.560 -4.130 1.00 5.74 H new ATOM 0 HZ3 LYS B 51 17.240 -0.421 -3.629 1.00 5.74 H new ATOM 2467 N ASP B 52 18.956 -6.010 -0.371 1.00 1.67 N ATOM 2468 CA ASP B 52 19.465 -5.651 0.941 1.00 1.72 C ATOM 2469 C ASP B 52 18.380 -5.910 1.987 1.00 1.60 C ATOM 2470 O ASP B 52 17.821 -5.011 2.626 1.00 1.92 O ATOM 2471 CB ASP B 52 20.066 -4.246 0.970 1.00 2.05 C ATOM 2472 CG ASP B 52 20.407 -3.852 2.393 1.00 2.75 C ATOM 2473 OD1 ASP B 52 20.797 -4.747 3.182 1.00 3.06 O ATOM 2474 OD2 ASP B 52 20.152 -2.665 2.691 1.00 4.24 O ATOM 0 H ASP B 52 19.510 -6.729 -0.836 1.00 1.67 H new ATOM 0 HA ASP B 52 20.311 -6.289 1.195 1.00 1.72 H new ATOM 0 HB2 ASP B 52 20.963 -4.213 0.351 1.00 2.05 H new ATOM 0 HB3 ASP B 52 19.360 -3.532 0.546 1.00 2.05 H new ATOM 2479 N VAL B 53 18.114 -7.208 2.126 1.00 1.40 N ATOM 2480 CA VAL B 53 17.386 -7.808 3.225 1.00 1.35 C ATOM 2481 C VAL B 53 18.334 -8.053 4.408 1.00 1.55 C ATOM 2482 O VAL B 53 17.880 -8.354 5.508 1.00 1.73 O ATOM 2483 CB VAL B 53 16.717 -9.106 2.737 1.00 1.34 C ATOM 2484 CG1 VAL B 53 15.845 -8.840 1.500 1.00 1.79 C ATOM 2485 CG2 VAL B 53 17.718 -10.226 2.417 1.00 1.65 C ATOM 0 H VAL B 53 18.418 -7.897 1.438 1.00 1.40 H new ATOM 0 HA VAL B 53 16.602 -7.135 3.574 1.00 1.35 H new ATOM 0 HB VAL B 53 16.099 -9.448 3.567 1.00 1.34 H new ATOM 0 HG11 VAL B 53 15.383 -9.772 1.174 1.00 1.79 H new ATOM 0 HG12 VAL B 53 15.068 -8.118 1.751 1.00 1.79 H new ATOM 0 HG13 VAL B 53 16.465 -8.442 0.697 1.00 1.79 H new ATOM 0 HG21 VAL B 53 17.178 -11.111 2.079 1.00 1.65 H new ATOM 0 HG22 VAL B 53 18.397 -9.894 1.632 1.00 1.65 H new ATOM 0 HG23 VAL B 53 18.290 -10.470 3.312 1.00 1.65 H new ATOM 2495 N GLY B 54 19.651 -7.935 4.188 1.00 1.86 N ATOM 2496 CA GLY B 54 20.647 -8.059 5.236 1.00 2.37 C ATOM 2497 C GLY B 54 20.466 -6.917 6.225 1.00 2.13 C ATOM 2498 O GLY B 54 20.118 -7.144 7.383 1.00 2.42 O ATOM 0 H GLY B 54 20.048 -7.749 3.267 1.00 1.86 H new ATOM 0 HA2 GLY B 54 20.542 -9.018 5.744 1.00 2.37 H new ATOM 0 HA3 GLY B 54 21.649 -8.032 4.809 1.00 2.37 H new ATOM 2502 N SER B 55 20.626 -5.675 5.759 1.00 1.76 N ATOM 2503 CA SER B 55 20.335 -4.506 6.573 1.00 1.56 C ATOM 2504 C SER B 55 18.817 -4.307 6.587 1.00 1.19 C ATOM 2505 O SER B 55 18.313 -3.266 6.182 1.00 1.21 O ATOM 2506 CB SER B 55 21.102 -3.300 6.002 1.00 1.76 C ATOM 2507 OG SER B 55 20.926 -2.128 6.768 1.00 2.82 O ATOM 0 H SER B 55 20.957 -5.460 4.818 1.00 1.76 H new ATOM 0 HA SER B 55 20.663 -4.629 7.605 1.00 1.56 H new ATOM 0 HB2 SER B 55 22.164 -3.541 5.953 1.00 1.76 H new ATOM 0 HB3 SER B 55 20.770 -3.114 4.981 1.00 1.76 H new ATOM 0 HG SER B 55 20.806 -1.361 6.170 1.00 2.82 H new ATOM 2513 N LEU B 56 18.033 -5.296 7.018 1.00 1.04 N ATOM 2514 CA LEU B 56 16.604 -5.110 7.174 1.00 0.89 C ATOM 2515 C LEU B 56 16.379 -4.005 8.200 1.00 0.89 C ATOM 2516 O LEU B 56 15.555 -3.116 8.014 1.00 0.99 O ATOM 2517 CB LEU B 56 15.993 -6.447 7.605 1.00 0.88 C ATOM 2518 CG LEU B 56 14.478 -6.439 7.838 1.00 0.87 C ATOM 2519 CD1 LEU B 56 14.094 -5.881 9.209 1.00 1.08 C ATOM 2520 CD2 LEU B 56 13.758 -5.700 6.709 1.00 0.83 C ATOM 0 H LEU B 56 18.369 -6.228 7.262 1.00 1.04 H new ATOM 0 HA LEU B 56 16.122 -4.807 6.245 1.00 0.89 H new ATOM 0 HB2 LEU B 56 16.221 -7.193 6.843 1.00 0.88 H new ATOM 0 HB3 LEU B 56 16.482 -6.770 8.524 1.00 0.88 H new ATOM 0 HG LEU B 56 14.149 -7.478 7.830 1.00 0.87 H new ATOM 0 HD11 LEU B 56 13.010 -5.899 9.319 1.00 1.08 H new ATOM 0 HD12 LEU B 56 14.548 -6.491 9.990 1.00 1.08 H new ATOM 0 HD13 LEU B 56 14.450 -4.855 9.297 1.00 1.08 H new ATOM 0 HD21 LEU B 56 12.684 -5.707 6.896 1.00 0.83 H new ATOM 0 HD22 LEU B 56 14.112 -4.670 6.665 1.00 0.83 H new ATOM 0 HD23 LEU B 56 13.964 -6.195 5.760 1.00 0.83 H new ATOM 2532 N ASP B 57 17.131 -4.065 9.292 1.00 0.92 N ATOM 2533 CA ASP B 57 16.888 -3.292 10.493 1.00 0.96 C ATOM 2534 C ASP B 57 17.054 -1.777 10.256 1.00 0.90 C ATOM 2535 O ASP B 57 16.420 -0.971 10.935 1.00 0.95 O ATOM 2536 CB ASP B 57 17.725 -3.902 11.630 1.00 1.43 C ATOM 2537 CG ASP B 57 17.517 -5.418 11.684 1.00 2.90 C ATOM 2538 OD1 ASP B 57 17.985 -6.108 10.748 1.00 3.49 O ATOM 2539 OD2 ASP B 57 16.788 -5.925 12.558 1.00 4.32 O ATOM 0 H ASP B 57 17.948 -4.671 9.364 1.00 0.92 H new ATOM 0 HA ASP B 57 15.845 -3.358 10.803 1.00 0.96 H new ATOM 0 HB2 ASP B 57 18.780 -3.678 11.475 1.00 1.43 H new ATOM 0 HB3 ASP B 57 17.440 -3.454 12.582 1.00 1.43 H new ATOM 2544 N GLU B 58 17.834 -1.388 9.236 1.00 0.95 N ATOM 2545 CA GLU B 58 17.807 -0.053 8.627 1.00 0.99 C ATOM 2546 C GLU B 58 16.367 0.317 8.266 1.00 0.90 C ATOM 2547 O GLU B 58 15.826 1.315 8.752 1.00 0.96 O ATOM 2548 CB GLU B 58 18.698 -0.086 7.370 1.00 1.08 C ATOM 2549 CG GLU B 58 18.540 1.013 6.293 1.00 1.51 C ATOM 2550 CD GLU B 58 19.119 0.564 4.947 1.00 1.52 C ATOM 2551 OE1 GLU B 58 19.878 -0.429 4.964 1.00 2.35 O ATOM 2552 OE2 GLU B 58 18.728 1.139 3.901 1.00 1.87 O ATOM 0 H GLU B 58 18.517 -2.009 8.803 1.00 0.95 H new ATOM 0 HA GLU B 58 18.183 0.699 9.321 1.00 0.99 H new ATOM 0 HB2 GLU B 58 19.735 -0.068 7.705 1.00 1.08 H new ATOM 0 HB3 GLU B 58 18.537 -1.047 6.881 1.00 1.08 H new ATOM 0 HG2 GLU B 58 17.485 1.258 6.173 1.00 1.51 H new ATOM 0 HG3 GLU B 58 19.043 1.922 6.622 1.00 1.51 H new ATOM 2559 N LYS B 59 15.749 -0.494 7.398 1.00 0.84 N ATOM 2560 CA LYS B 59 14.369 -0.289 7.009 1.00 0.84 C ATOM 2561 C LYS B 59 13.511 -0.308 8.274 1.00 0.75 C ATOM 2562 O LYS B 59 12.768 0.644 8.483 1.00 0.84 O ATOM 2563 CB LYS B 59 13.882 -1.299 5.950 1.00 0.93 C ATOM 2564 CG LYS B 59 14.364 -1.031 4.507 1.00 1.35 C ATOM 2565 CD LYS B 59 15.353 -2.073 3.940 1.00 1.57 C ATOM 2566 CE LYS B 59 16.790 -1.529 3.962 1.00 2.57 C ATOM 2567 NZ LYS B 59 17.815 -2.563 3.705 1.00 4.01 N ATOM 0 H LYS B 59 16.194 -1.298 6.956 1.00 0.84 H new ATOM 0 HA LYS B 59 14.278 0.680 6.518 1.00 0.84 H new ATOM 0 HB2 LYS B 59 14.210 -2.296 6.245 1.00 0.93 H new ATOM 0 HB3 LYS B 59 12.792 -1.308 5.955 1.00 0.93 H new ATOM 0 HG2 LYS B 59 13.493 -0.986 3.853 1.00 1.35 H new ATOM 0 HG3 LYS B 59 14.837 -0.050 4.475 1.00 1.35 H new ATOM 0 HD2 LYS B 59 15.298 -2.990 4.526 1.00 1.57 H new ATOM 0 HD3 LYS B 59 15.072 -2.330 2.919 1.00 1.57 H new ATOM 0 HE2 LYS B 59 16.884 -0.742 3.214 1.00 2.57 H new ATOM 0 HE3 LYS B 59 16.982 -1.071 4.932 1.00 2.57 H new ATOM 0 HZ1 LYS B 59 18.638 -2.128 3.241 1.00 4.01 H new ATOM 0 HZ2 LYS B 59 18.111 -2.990 4.606 1.00 4.01 H new ATOM 0 HZ3 LYS B 59 17.418 -3.299 3.087 1.00 4.01 H new ATOM 2581 N MET B 60 13.628 -1.334 9.132 1.00 0.68 N ATOM 2582 CA MET B 60 12.842 -1.416 10.369 1.00 0.71 C ATOM 2583 C MET B 60 12.823 -0.066 11.085 1.00 0.73 C ATOM 2584 O MET B 60 11.759 0.516 11.272 1.00 0.72 O ATOM 2585 CB MET B 60 13.360 -2.504 11.322 1.00 0.87 C ATOM 2586 CG MET B 60 12.464 -2.651 12.562 1.00 0.93 C ATOM 2587 SD MET B 60 13.340 -2.674 14.147 1.00 1.67 S ATOM 2588 CE MET B 60 11.960 -2.366 15.273 1.00 1.65 C ATOM 0 H MET B 60 14.262 -2.120 8.989 1.00 0.68 H new ATOM 0 HA MET B 60 11.827 -1.689 10.079 1.00 0.71 H new ATOM 0 HB2 MET B 60 13.409 -3.456 10.794 1.00 0.87 H new ATOM 0 HB3 MET B 60 14.375 -2.260 11.634 1.00 0.87 H new ATOM 0 HG2 MET B 60 11.748 -1.829 12.573 1.00 0.93 H new ATOM 0 HG3 MET B 60 11.890 -3.573 12.469 1.00 0.93 H new ATOM 0 HE1 MET B 60 12.325 -2.348 16.300 1.00 1.65 H new ATOM 0 HE2 MET B 60 11.503 -1.406 15.034 1.00 1.65 H new ATOM 0 HE3 MET B 60 11.219 -3.158 15.165 1.00 1.65 H new ATOM 2598 N LYS B 61 13.991 0.442 11.472 1.00 0.85 N ATOM 2599 CA LYS B 61 14.064 1.668 12.246 1.00 1.00 C ATOM 2600 C LYS B 61 13.475 2.848 11.461 1.00 1.04 C ATOM 2601 O LYS B 61 12.820 3.711 12.042 1.00 1.11 O ATOM 2602 CB LYS B 61 15.509 1.890 12.703 1.00 1.26 C ATOM 2603 CG LYS B 61 15.590 2.956 13.804 1.00 1.99 C ATOM 2604 CD LYS B 61 16.955 2.959 14.510 1.00 2.22 C ATOM 2605 CE LYS B 61 17.110 1.757 15.461 1.00 2.53 C ATOM 2606 NZ LYS B 61 18.388 1.791 16.203 1.00 3.16 N ATOM 0 H LYS B 61 14.895 0.021 11.260 1.00 0.85 H new ATOM 0 HA LYS B 61 13.451 1.585 13.144 1.00 1.00 H new ATOM 0 HB2 LYS B 61 15.924 0.952 13.071 1.00 1.26 H new ATOM 0 HB3 LYS B 61 16.118 2.196 11.853 1.00 1.26 H new ATOM 0 HG2 LYS B 61 15.405 3.939 13.370 1.00 1.99 H new ATOM 0 HG3 LYS B 61 14.804 2.778 14.538 1.00 1.99 H new ATOM 0 HD2 LYS B 61 17.750 2.937 13.764 1.00 2.22 H new ATOM 0 HD3 LYS B 61 17.071 3.885 15.073 1.00 2.22 H new ATOM 0 HE2 LYS B 61 16.281 1.747 16.169 1.00 2.53 H new ATOM 0 HE3 LYS B 61 17.050 0.832 14.887 1.00 2.53 H new ATOM 0 HZ1 LYS B 61 18.448 0.963 16.830 1.00 3.16 H new ATOM 0 HZ2 LYS B 61 19.181 1.774 15.530 1.00 3.16 H new ATOM 0 HZ3 LYS B 61 18.436 2.660 16.772 1.00 3.16 H new ATOM 2620 N SER B 62 13.679 2.877 10.141 1.00 1.05 N ATOM 2621 CA SER B 62 13.083 3.895 9.280 1.00 1.18 C ATOM 2622 C SER B 62 11.551 3.782 9.213 1.00 1.09 C ATOM 2623 O SER B 62 10.864 4.786 9.041 1.00 1.23 O ATOM 2624 CB SER B 62 13.690 3.811 7.877 1.00 1.29 C ATOM 2625 OG SER B 62 15.101 3.866 7.947 1.00 2.28 O ATOM 0 H SER B 62 14.258 2.200 9.645 1.00 1.05 H new ATOM 0 HA SER B 62 13.309 4.868 9.717 1.00 1.18 H new ATOM 0 HB2 SER B 62 13.379 2.885 7.394 1.00 1.29 H new ATOM 0 HB3 SER B 62 13.318 4.631 7.263 1.00 1.29 H new ATOM 0 HG SER B 62 15.449 2.995 8.230 1.00 2.28 H new ATOM 2631 N LEU B 63 11.008 2.566 9.306 1.00 0.94 N ATOM 2632 CA LEU B 63 9.580 2.282 9.207 1.00 0.88 C ATOM 2633 C LEU B 63 8.864 2.566 10.538 1.00 0.79 C ATOM 2634 O LEU B 63 7.764 3.123 10.561 1.00 0.77 O ATOM 2635 CB LEU B 63 9.397 0.803 8.840 1.00 0.85 C ATOM 2636 CG LEU B 63 9.902 0.384 7.448 1.00 1.13 C ATOM 2637 CD1 LEU B 63 10.164 -1.123 7.454 1.00 1.07 C ATOM 2638 CD2 LEU B 63 8.845 0.639 6.387 1.00 1.54 C ATOM 0 H LEU B 63 11.570 1.728 9.457 1.00 0.94 H new ATOM 0 HA LEU B 63 9.146 2.926 8.442 1.00 0.88 H new ATOM 0 HB2 LEU B 63 9.910 0.198 9.588 1.00 0.85 H new ATOM 0 HB3 LEU B 63 8.336 0.561 8.907 1.00 0.85 H new ATOM 0 HG LEU B 63 10.801 0.959 7.226 1.00 1.13 H new ATOM 0 HD11 LEU B 63 10.523 -1.434 6.473 1.00 1.07 H new ATOM 0 HD12 LEU B 63 10.916 -1.359 8.207 1.00 1.07 H new ATOM 0 HD13 LEU B 63 9.240 -1.652 7.687 1.00 1.07 H new ATOM 0 HD21 LEU B 63 9.227 0.334 5.413 1.00 1.54 H new ATOM 0 HD22 LEU B 63 7.949 0.065 6.621 1.00 1.54 H new ATOM 0 HD23 LEU B 63 8.600 1.701 6.365 1.00 1.54 H new ATOM 2650 N ASP B 64 9.498 2.127 11.628 1.00 0.80 N ATOM 2651 CA ASP B 64 9.014 1.981 12.999 1.00 0.83 C ATOM 2652 C ASP B 64 8.666 3.273 13.751 1.00 0.97 C ATOM 2653 O ASP B 64 8.316 3.211 14.930 1.00 1.11 O ATOM 2654 CB ASP B 64 9.923 1.046 13.806 1.00 0.86 C ATOM 2655 CG ASP B 64 9.243 0.586 15.079 1.00 1.04 C ATOM 2656 OD1 ASP B 64 8.035 0.256 14.998 1.00 1.12 O ATOM 2657 OD2 ASP B 64 9.925 0.591 16.120 1.00 1.59 O ATOM 0 H ASP B 64 10.472 1.833 11.561 1.00 0.80 H new ATOM 0 HA ASP B 64 8.035 1.515 12.890 1.00 0.83 H new ATOM 0 HB2 ASP B 64 10.189 0.180 13.199 1.00 0.86 H new ATOM 0 HB3 ASP B 64 10.852 1.561 14.052 1.00 0.86 H new ATOM 2662 N VAL B 65 8.963 4.435 13.165 1.00 1.02 N ATOM 2663 CA VAL B 65 9.108 5.760 13.779 1.00 1.26 C ATOM 2664 C VAL B 65 8.158 6.125 14.935 1.00 1.51 C ATOM 2665 O VAL B 65 8.487 7.030 15.698 1.00 1.99 O ATOM 2666 CB VAL B 65 8.995 6.847 12.691 1.00 1.24 C ATOM 2667 CG1 VAL B 65 9.995 6.627 11.552 1.00 1.42 C ATOM 2668 CG2 VAL B 65 7.579 6.921 12.100 1.00 1.53 C ATOM 0 H VAL B 65 9.123 4.478 12.159 1.00 1.02 H new ATOM 0 HA VAL B 65 10.092 5.711 14.245 1.00 1.26 H new ATOM 0 HB VAL B 65 9.225 7.789 13.189 1.00 1.24 H new ATOM 0 HG11 VAL B 65 9.879 7.416 10.809 1.00 1.42 H new ATOM 0 HG12 VAL B 65 11.010 6.649 11.949 1.00 1.42 H new ATOM 0 HG13 VAL B 65 9.809 5.659 11.086 1.00 1.42 H new ATOM 0 HG21 VAL B 65 7.543 7.699 11.338 1.00 1.53 H new ATOM 0 HG22 VAL B 65 7.321 5.962 11.652 1.00 1.53 H new ATOM 0 HG23 VAL B 65 6.866 7.155 12.891 1.00 1.53 H new ATOM 2678 N ASN B 66 7.006 5.465 15.107 1.00 1.48 N ATOM 2679 CA ASN B 66 6.192 5.651 16.306 1.00 2.00 C ATOM 2680 C ASN B 66 6.868 5.066 17.560 1.00 2.33 C ATOM 2681 O ASN B 66 6.328 5.200 18.656 1.00 3.20 O ATOM 2682 CB ASN B 66 4.776 5.102 16.087 1.00 2.23 C ATOM 2683 CG ASN B 66 4.028 5.889 15.015 1.00 3.07 C ATOM 2684 OD1 ASN B 66 4.060 5.551 13.834 1.00 4.01 O ATOM 2685 ND2 ASN B 66 3.347 6.961 15.412 1.00 3.74 N ATOM 0 H ASN B 66 6.622 4.802 14.434 1.00 1.48 H new ATOM 0 HA ASN B 66 6.101 6.721 16.490 1.00 2.00 H new ATOM 0 HB2 ASN B 66 4.833 4.053 15.796 1.00 2.23 H new ATOM 0 HB3 ASN B 66 4.220 5.143 17.024 1.00 2.23 H new ATOM 0 HD21 ASN B 66 2.836 7.522 14.730 1.00 3.74 H new ATOM 0 HD22 ASN B 66 3.335 7.221 16.398 1.00 3.74 H new ATOM 2692 N GLN B 67 8.055 4.455 17.428 1.00 1.87 N ATOM 2693 CA GLN B 67 9.028 4.171 18.471 1.00 2.32 C ATOM 2694 C GLN B 67 8.713 2.900 19.262 1.00 1.91 C ATOM 2695 O GLN B 67 9.631 2.224 19.729 1.00 1.76 O ATOM 2696 CB GLN B 67 9.279 5.413 19.339 1.00 3.60 C ATOM 2697 CG GLN B 67 10.401 5.208 20.355 1.00 4.60 C ATOM 2698 CD GLN B 67 11.759 4.905 19.728 1.00 4.16 C ATOM 2699 OE1 GLN B 67 12.566 5.802 19.509 1.00 4.54 O ATOM 2700 NE2 GLN B 67 12.034 3.635 19.448 1.00 4.23 N ATOM 0 H GLN B 67 8.375 4.125 16.517 1.00 1.87 H new ATOM 0 HA GLN B 67 9.976 3.940 17.985 1.00 2.32 H new ATOM 0 HB2 GLN B 67 9.528 6.256 18.695 1.00 3.60 H new ATOM 0 HB3 GLN B 67 8.361 5.674 19.866 1.00 3.60 H new ATOM 0 HG2 GLN B 67 10.488 6.104 20.970 1.00 4.60 H new ATOM 0 HG3 GLN B 67 10.129 4.389 21.021 1.00 4.60 H new ATOM 0 HE21 GLN B 67 11.344 2.909 19.641 1.00 4.23 H new ATOM 0 HE22 GLN B 67 12.935 3.386 19.040 1.00 4.23 H new ATOM 2709 N ASP B 68 7.433 2.554 19.384 1.00 2.19 N ATOM 2710 CA ASP B 68 6.981 1.217 19.728 1.00 1.85 C ATOM 2711 C ASP B 68 7.675 0.213 18.791 1.00 1.70 C ATOM 2712 O ASP B 68 7.363 0.193 17.601 1.00 3.31 O ATOM 2713 CB ASP B 68 5.445 1.175 19.571 1.00 1.90 C ATOM 2714 CG ASP B 68 5.018 1.431 18.133 1.00 1.64 C ATOM 2715 OD1 ASP B 68 5.503 2.396 17.502 1.00 1.74 O ATOM 2716 OD2 ASP B 68 4.525 0.510 17.461 1.00 2.27 O ATOM 0 H ASP B 68 6.668 3.214 19.242 1.00 2.19 H new ATOM 0 HA ASP B 68 7.233 0.956 20.756 1.00 1.85 H new ATOM 0 HB2 ASP B 68 5.073 0.202 19.893 1.00 1.90 H new ATOM 0 HB3 ASP B 68 4.992 1.922 20.223 1.00 1.90 H new ATOM 2721 N SER B 69 8.615 -0.590 19.302 1.00 1.56 N ATOM 2722 CA SER B 69 9.388 -1.592 18.571 1.00 1.34 C ATOM 2723 C SER B 69 8.499 -2.742 18.086 1.00 1.16 C ATOM 2724 O SER B 69 8.627 -3.871 18.558 1.00 1.68 O ATOM 2725 CB SER B 69 10.515 -2.086 19.481 1.00 1.53 C ATOM 2726 OG SER B 69 9.966 -2.525 20.707 1.00 2.75 O ATOM 0 H SER B 69 8.868 -0.554 20.289 1.00 1.56 H new ATOM 0 HA SER B 69 9.817 -1.145 17.674 1.00 1.34 H new ATOM 0 HB2 SER B 69 11.057 -2.900 18.999 1.00 1.53 H new ATOM 0 HB3 SER B 69 11.234 -1.285 19.657 1.00 1.53 H new ATOM 0 HG SER B 69 9.304 -3.228 20.536 1.00 2.75 H new ATOM 2732 N GLU B 70 7.605 -2.419 17.156 1.00 1.12 N ATOM 2733 CA GLU B 70 6.481 -3.197 16.678 1.00 1.20 C ATOM 2734 C GLU B 70 6.023 -2.483 15.410 1.00 1.08 C ATOM 2735 O GLU B 70 5.700 -1.299 15.483 1.00 1.10 O ATOM 2736 CB GLU B 70 5.335 -3.148 17.702 1.00 1.33 C ATOM 2737 CG GLU B 70 5.581 -3.951 18.984 1.00 1.75 C ATOM 2738 CD GLU B 70 4.270 -4.216 19.705 1.00 2.27 C ATOM 2739 OE1 GLU B 70 3.384 -4.841 19.084 1.00 2.73 O ATOM 2740 OE2 GLU B 70 4.132 -3.808 20.878 1.00 3.00 O ATOM 0 H GLU B 70 7.660 -1.520 16.677 1.00 1.12 H new ATOM 0 HA GLU B 70 6.752 -4.240 16.512 1.00 1.20 H new ATOM 0 HB2 GLU B 70 5.152 -2.108 17.972 1.00 1.33 H new ATOM 0 HB3 GLU B 70 4.427 -3.519 17.227 1.00 1.33 H new ATOM 0 HG2 GLU B 70 6.067 -4.896 18.741 1.00 1.75 H new ATOM 0 HG3 GLU B 70 6.259 -3.403 19.639 1.00 1.75 H new ATOM 2747 N LEU B 71 6.028 -3.144 14.254 1.00 1.05 N ATOM 2748 CA LEU B 71 5.701 -2.512 12.983 1.00 1.03 C ATOM 2749 C LEU B 71 4.193 -2.601 12.802 1.00 1.06 C ATOM 2750 O LEU B 71 3.681 -3.633 12.375 1.00 1.13 O ATOM 2751 CB LEU B 71 6.451 -3.201 11.831 1.00 1.02 C ATOM 2752 CG LEU B 71 7.945 -2.829 11.750 1.00 0.99 C ATOM 2753 CD1 LEU B 71 8.147 -1.441 11.134 1.00 0.99 C ATOM 2754 CD2 LEU B 71 8.684 -2.929 13.089 1.00 1.03 C ATOM 0 H LEU B 71 6.260 -4.134 14.175 1.00 1.05 H new ATOM 0 HA LEU B 71 6.011 -1.467 12.978 1.00 1.03 H new ATOM 0 HB2 LEU B 71 6.361 -4.281 11.946 1.00 1.02 H new ATOM 0 HB3 LEU B 71 5.970 -2.940 10.889 1.00 1.02 H new ATOM 0 HG LEU B 71 8.389 -3.579 11.095 1.00 0.99 H new ATOM 0 HD11 LEU B 71 9.212 -1.213 11.093 1.00 0.99 H new ATOM 0 HD12 LEU B 71 7.734 -1.427 10.125 1.00 0.99 H new ATOM 0 HD13 LEU B 71 7.639 -0.694 11.745 1.00 0.99 H new ATOM 0 HD21 LEU B 71 9.729 -2.652 12.949 1.00 1.03 H new ATOM 0 HD22 LEU B 71 8.223 -2.254 13.810 1.00 1.03 H new ATOM 0 HD23 LEU B 71 8.627 -3.952 13.461 1.00 1.03 H new ATOM 2766 N LYS B 72 3.475 -1.531 13.131 1.00 1.08 N ATOM 2767 CA LYS B 72 2.035 -1.571 13.310 1.00 1.14 C ATOM 2768 C LYS B 72 1.345 -1.521 11.947 1.00 1.11 C ATOM 2769 O LYS B 72 1.969 -1.166 10.947 1.00 1.01 O ATOM 2770 CB LYS B 72 1.662 -0.351 14.170 1.00 1.26 C ATOM 2771 CG LYS B 72 0.213 -0.367 14.679 1.00 1.69 C ATOM 2772 CD LYS B 72 0.189 -0.327 16.213 1.00 2.39 C ATOM 2773 CE LYS B 72 -1.202 -0.698 16.747 1.00 3.13 C ATOM 2774 NZ LYS B 72 -1.148 -1.094 18.168 1.00 4.10 N ATOM 0 H LYS B 72 3.883 -0.608 13.281 1.00 1.08 H new ATOM 0 HA LYS B 72 1.714 -2.490 13.801 1.00 1.14 H new ATOM 0 HB2 LYS B 72 2.336 -0.302 15.025 1.00 1.26 H new ATOM 0 HB3 LYS B 72 1.821 0.555 13.586 1.00 1.26 H new ATOM 0 HG2 LYS B 72 -0.331 0.488 14.277 1.00 1.69 H new ATOM 0 HG3 LYS B 72 -0.295 -1.263 14.323 1.00 1.69 H new ATOM 0 HD2 LYS B 72 0.932 -1.018 16.611 1.00 2.39 H new ATOM 0 HD3 LYS B 72 0.462 0.670 16.560 1.00 2.39 H new ATOM 0 HE2 LYS B 72 -1.876 0.151 16.630 1.00 3.13 H new ATOM 0 HE3 LYS B 72 -1.614 -1.516 16.156 1.00 3.13 H new ATOM 0 HZ1 LYS B 72 -1.989 -0.732 18.661 1.00 4.10 H new ATOM 0 HZ2 LYS B 72 -1.125 -2.131 18.239 1.00 4.10 H new ATOM 0 HZ3 LYS B 72 -0.292 -0.698 18.606 1.00 4.10 H new ATOM 2788 N PHE B 73 0.038 -1.798 11.894 1.00 1.27 N ATOM 2789 CA PHE B 73 -0.745 -1.690 10.669 1.00 1.25 C ATOM 2790 C PHE B 73 -1.190 -0.234 10.454 1.00 1.24 C ATOM 2791 O PHE B 73 -2.359 0.043 10.198 1.00 1.40 O ATOM 2792 CB PHE B 73 -1.943 -2.648 10.805 1.00 1.51 C ATOM 2793 CG PHE B 73 -2.865 -2.877 9.617 1.00 1.89 C ATOM 2794 CD1 PHE B 73 -2.496 -2.532 8.300 1.00 3.31 C ATOM 2795 CD2 PHE B 73 -4.074 -3.566 9.838 1.00 2.68 C ATOM 2796 CE1 PHE B 73 -3.323 -2.889 7.220 1.00 4.68 C ATOM 2797 CE2 PHE B 73 -4.887 -3.941 8.756 1.00 3.95 C ATOM 2798 CZ PHE B 73 -4.503 -3.617 7.446 1.00 4.80 C ATOM 0 H PHE B 73 -0.503 -2.103 12.703 1.00 1.27 H new ATOM 0 HA PHE B 73 -0.157 -1.968 9.794 1.00 1.25 H new ATOM 0 HB2 PHE B 73 -1.550 -3.620 11.104 1.00 1.51 H new ATOM 0 HB3 PHE B 73 -2.558 -2.285 11.629 1.00 1.51 H new ATOM 0 HD1 PHE B 73 -1.577 -1.993 8.121 1.00 3.31 H new ATOM 0 HD2 PHE B 73 -4.377 -3.807 10.846 1.00 2.68 H new ATOM 0 HE1 PHE B 73 -3.050 -2.603 6.215 1.00 4.68 H new ATOM 0 HE2 PHE B 73 -5.807 -4.478 8.932 1.00 3.95 H new ATOM 0 HZ PHE B 73 -5.114 -3.927 6.612 1.00 4.80 H new ATOM 2808 N ASN B 74 -0.216 0.684 10.451 1.00 1.23 N ATOM 2809 CA ASN B 74 0.205 1.452 9.281 1.00 1.00 C ATOM 2810 C ASN B 74 1.546 2.148 9.631 1.00 0.91 C ATOM 2811 O ASN B 74 1.738 3.341 9.431 1.00 1.19 O ATOM 2812 CB ASN B 74 -0.957 2.416 8.942 1.00 1.13 C ATOM 2813 CG ASN B 74 -0.801 3.354 7.750 1.00 1.54 C ATOM 2814 OD1 ASN B 74 -1.478 3.207 6.735 1.00 2.20 O ATOM 2815 ND2 ASN B 74 -0.036 4.419 7.906 1.00 1.82 N ATOM 0 H ASN B 74 0.315 0.917 11.290 1.00 1.23 H new ATOM 0 HA ASN B 74 0.397 0.851 8.392 1.00 1.00 H new ATOM 0 HB2 ASN B 74 -1.850 1.813 8.775 1.00 1.13 H new ATOM 0 HB3 ASN B 74 -1.147 3.029 9.823 1.00 1.13 H new ATOM 0 HD21 ASN B 74 -0.002 5.133 7.179 1.00 1.82 H new ATOM 0 HD22 ASN B 74 0.520 4.527 8.754 1.00 1.82 H new ATOM 2822 N GLU B 75 2.530 1.405 10.142 1.00 0.83 N ATOM 2823 CA GLU B 75 3.946 1.508 9.844 1.00 0.78 C ATOM 2824 C GLU B 75 4.272 0.531 8.719 1.00 0.75 C ATOM 2825 O GLU B 75 4.724 0.919 7.649 1.00 0.73 O ATOM 2826 CB GLU B 75 4.762 1.238 11.106 1.00 0.84 C ATOM 2827 CG GLU B 75 4.466 2.305 12.167 1.00 0.95 C ATOM 2828 CD GLU B 75 5.003 1.872 13.508 1.00 0.96 C ATOM 2829 OE1 GLU B 75 4.676 0.766 13.978 1.00 1.53 O ATOM 2830 OE2 GLU B 75 5.807 2.578 14.141 1.00 1.85 O ATOM 0 H GLU B 75 2.337 0.668 10.820 1.00 0.83 H new ATOM 0 HA GLU B 75 4.204 2.513 9.511 1.00 0.78 H new ATOM 0 HB2 GLU B 75 4.523 0.249 11.498 1.00 0.84 H new ATOM 0 HB3 GLU B 75 5.825 1.238 10.867 1.00 0.84 H new ATOM 0 HG2 GLU B 75 4.918 3.253 11.875 1.00 0.95 H new ATOM 0 HG3 GLU B 75 3.391 2.472 12.235 1.00 0.95 H new ATOM 2837 N TYR B 76 4.029 -0.758 8.999 1.00 0.79 N ATOM 2838 CA TYR B 76 4.370 -1.900 8.158 1.00 0.78 C ATOM 2839 C TYR B 76 4.089 -1.616 6.690 1.00 0.78 C ATOM 2840 O TYR B 76 4.957 -1.794 5.834 1.00 0.82 O ATOM 2841 CB TYR B 76 3.582 -3.128 8.661 1.00 0.82 C ATOM 2842 CG TYR B 76 3.229 -4.176 7.619 1.00 0.97 C ATOM 2843 CD1 TYR B 76 4.130 -5.210 7.315 1.00 1.93 C ATOM 2844 CD2 TYR B 76 1.984 -4.126 6.962 1.00 2.21 C ATOM 2845 CE1 TYR B 76 3.775 -6.211 6.396 1.00 2.42 C ATOM 2846 CE2 TYR B 76 1.670 -5.074 5.975 1.00 2.88 C ATOM 2847 CZ TYR B 76 2.547 -6.140 5.720 1.00 2.56 C ATOM 2848 OH TYR B 76 2.231 -7.067 4.773 1.00 3.44 O ATOM 0 H TYR B 76 3.566 -1.039 9.863 1.00 0.79 H new ATOM 0 HA TYR B 76 5.439 -2.100 8.230 1.00 0.78 H new ATOM 0 HB2 TYR B 76 4.164 -3.610 9.447 1.00 0.82 H new ATOM 0 HB3 TYR B 76 2.658 -2.777 9.119 1.00 0.82 H new ATOM 0 HD1 TYR B 76 5.100 -5.235 7.790 1.00 1.93 H new ATOM 0 HD2 TYR B 76 1.270 -3.357 7.218 1.00 2.21 H new ATOM 0 HE1 TYR B 76 4.447 -7.036 6.209 1.00 2.42 H new ATOM 0 HE2 TYR B 76 0.753 -4.983 5.412 1.00 2.88 H new ATOM 0 HH TYR B 76 2.664 -7.919 4.992 1.00 3.44 H new ATOM 2858 N TRP B 77 2.868 -1.140 6.447 1.00 0.78 N ATOM 2859 CA TRP B 77 2.349 -0.765 5.150 1.00 0.75 C ATOM 2860 C TRP B 77 3.410 -0.062 4.294 1.00 0.67 C ATOM 2861 O TRP B 77 3.578 -0.421 3.131 1.00 0.69 O ATOM 2862 CB TRP B 77 1.107 0.098 5.381 1.00 0.83 C ATOM 2863 CG TRP B 77 0.680 0.896 4.199 1.00 0.79 C ATOM 2864 CD1 TRP B 77 0.964 2.204 4.033 1.00 1.99 C ATOM 2865 CD2 TRP B 77 0.066 0.458 2.949 1.00 1.80 C ATOM 2866 NE1 TRP B 77 0.544 2.619 2.799 1.00 1.80 N ATOM 2867 CE2 TRP B 77 -0.033 1.596 2.098 1.00 1.43 C ATOM 2868 CE3 TRP B 77 -0.350 -0.779 2.408 1.00 3.77 C ATOM 2869 CZ2 TRP B 77 -0.538 1.533 0.802 1.00 2.47 C ATOM 2870 CZ3 TRP B 77 -0.804 -0.852 1.076 1.00 4.81 C ATOM 2871 CH2 TRP B 77 -0.919 0.293 0.293 1.00 4.16 C ATOM 0 H TRP B 77 2.187 -1.002 7.193 1.00 0.78 H new ATOM 0 HA TRP B 77 2.071 -1.652 4.581 1.00 0.75 H new ATOM 0 HB2 TRP B 77 0.283 -0.548 5.684 1.00 0.83 H new ATOM 0 HB3 TRP B 77 1.302 0.777 6.211 1.00 0.83 H new ATOM 0 HD1 TRP B 77 1.451 2.831 4.766 1.00 1.99 H new ATOM 0 HE1 TRP B 77 0.648 3.570 2.446 1.00 1.80 H new ATOM 0 HE3 TRP B 77 -0.320 -1.671 3.017 1.00 3.77 H new ATOM 0 HZ2 TRP B 77 -0.633 2.427 0.203 1.00 2.47 H new ATOM 0 HZ3 TRP B 77 -1.067 -1.812 0.656 1.00 4.81 H new ATOM 0 HH2 TRP B 77 -1.305 0.220 -0.713 1.00 4.16 H new ATOM 2882 N ARG B 78 4.147 0.900 4.868 1.00 0.62 N ATOM 2883 CA ARG B 78 5.213 1.637 4.192 1.00 0.60 C ATOM 2884 C ARG B 78 6.045 0.722 3.278 1.00 0.59 C ATOM 2885 O ARG B 78 6.214 1.026 2.097 1.00 0.61 O ATOM 2886 CB ARG B 78 6.158 2.241 5.236 1.00 0.61 C ATOM 2887 CG ARG B 78 5.624 3.344 6.171 1.00 0.97 C ATOM 2888 CD ARG B 78 6.677 3.534 7.285 1.00 2.05 C ATOM 2889 NE ARG B 78 6.180 4.083 8.559 1.00 3.26 N ATOM 2890 CZ ARG B 78 5.661 5.298 8.769 1.00 4.02 C ATOM 2891 NH1 ARG B 78 5.596 6.168 7.757 1.00 3.91 N ATOM 2892 NH2 ARG B 78 5.223 5.633 9.987 1.00 5.58 N ATOM 0 H ARG B 78 4.012 1.190 5.836 1.00 0.62 H new ATOM 0 HA ARG B 78 4.742 2.412 3.588 1.00 0.60 H new ATOM 0 HB2 ARG B 78 6.523 1.426 5.861 1.00 0.61 H new ATOM 0 HB3 ARG B 78 7.020 2.646 4.706 1.00 0.61 H new ATOM 0 HG2 ARG B 78 5.469 4.273 5.623 1.00 0.97 H new ATOM 0 HG3 ARG B 78 4.661 3.059 6.594 1.00 0.97 H new ATOM 0 HD2 ARG B 78 7.143 2.569 7.485 1.00 2.05 H new ATOM 0 HD3 ARG B 78 7.459 4.193 6.909 1.00 2.05 H new ATOM 0 HE ARG B 78 6.238 3.468 9.371 1.00 3.26 H new ATOM 0 HH11 ARG B 78 5.940 5.903 6.834 1.00 3.91 H new ATOM 0 HH12 ARG B 78 5.202 7.097 7.907 1.00 3.91 H new ATOM 0 HH21 ARG B 78 5.285 4.963 10.753 1.00 5.58 H new ATOM 0 HH22 ARG B 78 4.827 6.559 10.150 1.00 5.58 H new ATOM 2906 N LEU B 79 6.552 -0.400 3.813 1.00 0.67 N ATOM 2907 CA LEU B 79 7.398 -1.324 3.079 1.00 0.78 C ATOM 2908 C LEU B 79 6.757 -1.738 1.766 1.00 0.78 C ATOM 2909 O LEU B 79 7.451 -1.807 0.757 1.00 0.82 O ATOM 2910 CB LEU B 79 7.679 -2.572 3.927 1.00 0.96 C ATOM 2911 CG LEU B 79 8.708 -3.509 3.266 1.00 0.92 C ATOM 2912 CD1 LEU B 79 10.117 -3.010 3.570 1.00 0.94 C ATOM 2913 CD2 LEU B 79 8.554 -4.969 3.710 1.00 1.09 C ATOM 0 H LEU B 79 6.378 -0.684 4.777 1.00 0.67 H new ATOM 0 HA LEU B 79 8.335 -0.812 2.859 1.00 0.78 H new ATOM 0 HB2 LEU B 79 8.046 -2.267 4.907 1.00 0.96 H new ATOM 0 HB3 LEU B 79 6.748 -3.115 4.089 1.00 0.96 H new ATOM 0 HG LEU B 79 8.526 -3.490 2.191 1.00 0.92 H new ATOM 0 HD11 LEU B 79 10.846 -3.672 3.103 1.00 0.94 H new ATOM 0 HD12 LEU B 79 10.238 -2.001 3.176 1.00 0.94 H new ATOM 0 HD13 LEU B 79 10.275 -3.000 4.648 1.00 0.94 H new ATOM 0 HD21 LEU B 79 9.305 -5.582 3.212 1.00 1.09 H new ATOM 0 HD22 LEU B 79 8.688 -5.037 4.790 1.00 1.09 H new ATOM 0 HD23 LEU B 79 7.559 -5.327 3.444 1.00 1.09 H new ATOM 2925 N ILE B 80 5.451 -2.017 1.766 1.00 0.82 N ATOM 2926 CA ILE B 80 4.764 -2.507 0.596 1.00 0.95 C ATOM 2927 C ILE B 80 4.861 -1.415 -0.472 1.00 1.05 C ATOM 2928 O ILE B 80 5.020 -1.704 -1.656 1.00 1.23 O ATOM 2929 CB ILE B 80 3.339 -2.964 0.969 1.00 1.02 C ATOM 2930 CG1 ILE B 80 3.394 -4.221 1.866 1.00 1.39 C ATOM 2931 CG2 ILE B 80 2.606 -3.439 -0.302 1.00 1.30 C ATOM 2932 CD1 ILE B 80 3.602 -3.975 3.360 1.00 2.91 C ATOM 0 H ILE B 80 4.851 -1.905 2.583 1.00 0.82 H new ATOM 0 HA ILE B 80 5.219 -3.404 0.175 1.00 0.95 H new ATOM 0 HB ILE B 80 2.847 -2.126 1.462 1.00 1.02 H new ATOM 0 HG12 ILE B 80 2.465 -4.775 1.736 1.00 1.39 H new ATOM 0 HG13 ILE B 80 4.200 -4.862 1.509 1.00 1.39 H new ATOM 0 HG21 ILE B 80 1.598 -3.763 -0.041 1.00 1.30 H new ATOM 0 HG22 ILE B 80 2.550 -2.619 -1.018 1.00 1.30 H new ATOM 0 HG23 ILE B 80 3.151 -4.272 -0.747 1.00 1.30 H new ATOM 0 HD11 ILE B 80 3.623 -4.929 3.886 1.00 2.91 H new ATOM 0 HD12 ILE B 80 4.547 -3.454 3.515 1.00 2.91 H new ATOM 0 HD13 ILE B 80 2.784 -3.366 3.746 1.00 2.91 H new ATOM 2944 N GLY B 81 4.853 -0.149 -0.044 1.00 1.06 N ATOM 2945 CA GLY B 81 4.935 0.987 -0.927 1.00 1.22 C ATOM 2946 C GLY B 81 6.287 1.039 -1.579 1.00 1.15 C ATOM 2947 O GLY B 81 6.413 1.301 -2.772 1.00 1.33 O ATOM 0 H GLY B 81 4.788 0.104 0.942 1.00 1.06 H new ATOM 0 HA2 GLY B 81 4.158 0.922 -1.689 1.00 1.22 H new ATOM 0 HA3 GLY B 81 4.757 1.905 -0.368 1.00 1.22 H new ATOM 2951 N GLU B 82 7.302 0.811 -0.756 1.00 0.95 N ATOM 2952 CA GLU B 82 8.673 0.883 -1.182 1.00 0.97 C ATOM 2953 C GLU B 82 8.934 -0.269 -2.135 1.00 1.10 C ATOM 2954 O GLU B 82 9.317 -0.015 -3.261 1.00 1.25 O ATOM 2955 CB GLU B 82 9.586 0.895 0.035 1.00 0.90 C ATOM 2956 CG GLU B 82 9.168 2.056 0.957 1.00 0.83 C ATOM 2957 CD GLU B 82 10.143 3.219 0.833 1.00 1.28 C ATOM 2958 OE1 GLU B 82 11.197 3.165 1.497 1.00 1.87 O ATOM 2959 OE2 GLU B 82 9.833 4.127 0.025 1.00 2.34 O ATOM 0 H GLU B 82 7.186 0.571 0.228 1.00 0.95 H new ATOM 0 HA GLU B 82 8.882 1.807 -1.722 1.00 0.97 H new ATOM 0 HB2 GLU B 82 9.518 -0.054 0.568 1.00 0.90 H new ATOM 0 HB3 GLU B 82 10.625 1.013 -0.273 1.00 0.90 H new ATOM 0 HG2 GLU B 82 8.163 2.389 0.698 1.00 0.83 H new ATOM 0 HG3 GLU B 82 9.134 1.712 1.991 1.00 0.83 H new ATOM 2966 N LEU B 83 8.669 -1.517 -1.748 1.00 1.15 N ATOM 2967 CA LEU B 83 8.854 -2.628 -2.672 1.00 1.32 C ATOM 2968 C LEU B 83 8.027 -2.453 -3.950 1.00 1.22 C ATOM 2969 O LEU B 83 8.529 -2.737 -5.035 1.00 1.18 O ATOM 2970 CB LEU B 83 8.728 -3.997 -1.989 1.00 1.94 C ATOM 2971 CG LEU B 83 7.376 -4.339 -1.349 1.00 0.82 C ATOM 2972 CD1 LEU B 83 6.340 -4.941 -2.301 1.00 1.53 C ATOM 2973 CD2 LEU B 83 7.567 -5.336 -0.199 1.00 1.67 C ATOM 0 H LEU B 83 8.333 -1.778 -0.821 1.00 1.15 H new ATOM 0 HA LEU B 83 9.890 -2.607 -3.011 1.00 1.32 H new ATOM 0 HB2 LEU B 83 8.956 -4.765 -2.728 1.00 1.94 H new ATOM 0 HB3 LEU B 83 9.494 -4.061 -1.216 1.00 1.94 H new ATOM 0 HG LEU B 83 6.991 -3.377 -1.010 1.00 0.82 H new ATOM 0 HD11 LEU B 83 5.420 -5.148 -1.754 1.00 1.53 H new ATOM 0 HD12 LEU B 83 6.133 -4.236 -3.106 1.00 1.53 H new ATOM 0 HD13 LEU B 83 6.728 -5.869 -2.722 1.00 1.53 H new ATOM 0 HD21 LEU B 83 6.599 -5.569 0.245 1.00 1.67 H new ATOM 0 HD22 LEU B 83 8.020 -6.250 -0.582 1.00 1.67 H new ATOM 0 HD23 LEU B 83 8.218 -4.898 0.558 1.00 1.67 H new ATOM 2985 N ALA B 84 6.797 -1.927 -3.858 1.00 1.25 N ATOM 2986 CA ALA B 84 6.029 -1.601 -5.053 1.00 1.30 C ATOM 2987 C ALA B 84 6.826 -0.643 -5.939 1.00 1.25 C ATOM 2988 O ALA B 84 7.152 -0.944 -7.083 1.00 1.66 O ATOM 2989 CB ALA B 84 4.655 -1.028 -4.690 1.00 1.32 C ATOM 0 H ALA B 84 6.324 -1.723 -2.978 1.00 1.25 H new ATOM 0 HA ALA B 84 5.850 -2.517 -5.616 1.00 1.30 H new ATOM 0 HB1 ALA B 84 4.106 -0.795 -5.602 1.00 1.32 H new ATOM 0 HB2 ALA B 84 4.097 -1.762 -4.108 1.00 1.32 H new ATOM 0 HB3 ALA B 84 4.784 -0.120 -4.101 1.00 1.32 H new ATOM 2995 N LYS B 85 7.175 0.507 -5.370 1.00 0.86 N ATOM 2996 CA LYS B 85 7.981 1.546 -5.986 1.00 0.79 C ATOM 2997 C LYS B 85 9.292 0.987 -6.558 1.00 0.70 C ATOM 2998 O LYS B 85 9.707 1.417 -7.632 1.00 0.70 O ATOM 2999 CB LYS B 85 8.184 2.617 -4.908 1.00 1.10 C ATOM 3000 CG LYS B 85 9.059 3.825 -5.240 1.00 0.83 C ATOM 3001 CD LYS B 85 9.448 4.522 -3.922 1.00 1.44 C ATOM 3002 CE LYS B 85 8.237 5.041 -3.125 1.00 0.71 C ATOM 3003 NZ LYS B 85 8.616 5.537 -1.784 1.00 1.49 N ATOM 0 H LYS B 85 6.888 0.747 -4.421 1.00 0.86 H new ATOM 0 HA LYS B 85 7.486 1.983 -6.853 1.00 0.79 H new ATOM 0 HB2 LYS B 85 7.201 2.988 -4.620 1.00 1.10 H new ATOM 0 HB3 LYS B 85 8.610 2.129 -4.031 1.00 1.10 H new ATOM 0 HG2 LYS B 85 9.952 3.509 -5.780 1.00 0.83 H new ATOM 0 HG3 LYS B 85 8.521 4.516 -5.890 1.00 0.83 H new ATOM 0 HD2 LYS B 85 10.009 3.823 -3.302 1.00 1.44 H new ATOM 0 HD3 LYS B 85 10.113 5.357 -4.143 1.00 1.44 H new ATOM 0 HE2 LYS B 85 7.755 5.843 -3.683 1.00 0.71 H new ATOM 0 HE3 LYS B 85 7.504 4.241 -3.020 1.00 0.71 H new ATOM 0 HZ1 LYS B 85 7.880 5.276 -1.097 1.00 1.49 H new ATOM 0 HZ2 LYS B 85 9.522 5.112 -1.500 1.00 1.49 H new ATOM 0 HZ3 LYS B 85 8.713 6.572 -1.811 1.00 1.49 H new ATOM 3017 N GLU B 86 9.946 0.046 -5.868 1.00 0.76 N ATOM 3018 CA GLU B 86 11.232 -0.531 -6.248 1.00 0.81 C ATOM 3019 C GLU B 86 11.155 -1.217 -7.609 1.00 0.79 C ATOM 3020 O GLU B 86 12.173 -1.311 -8.289 1.00 0.97 O ATOM 3021 CB GLU B 86 11.754 -1.514 -5.184 1.00 0.92 C ATOM 3022 CG GLU B 86 12.205 -0.792 -3.903 1.00 1.16 C ATOM 3023 CD GLU B 86 13.693 -0.435 -3.925 1.00 2.11 C ATOM 3024 OE1 GLU B 86 14.515 -1.378 -4.006 1.00 3.09 O ATOM 3025 OE2 GLU B 86 14.027 0.767 -3.835 1.00 2.61 O ATOM 0 H GLU B 86 9.579 -0.345 -5.001 1.00 0.76 H new ATOM 0 HA GLU B 86 11.939 0.296 -6.319 1.00 0.81 H new ATOM 0 HB2 GLU B 86 10.971 -2.232 -4.939 1.00 0.92 H new ATOM 0 HB3 GLU B 86 12.590 -2.081 -5.594 1.00 0.92 H new ATOM 0 HG2 GLU B 86 11.618 0.118 -3.777 1.00 1.16 H new ATOM 0 HG3 GLU B 86 11.999 -1.426 -3.041 1.00 1.16 H new ATOM 3032 N ILE B 87 9.965 -1.655 -8.048 1.00 0.68 N ATOM 3033 CA ILE B 87 9.815 -2.137 -9.410 1.00 0.71 C ATOM 3034 C ILE B 87 10.361 -1.091 -10.398 1.00 0.78 C ATOM 3035 O ILE B 87 10.993 -1.435 -11.394 1.00 0.93 O ATOM 3036 CB ILE B 87 8.345 -2.539 -9.664 1.00 0.73 C ATOM 3037 CG1 ILE B 87 8.289 -3.669 -10.705 1.00 0.83 C ATOM 3038 CG2 ILE B 87 7.472 -1.360 -10.123 1.00 0.87 C ATOM 3039 CD1 ILE B 87 6.967 -4.424 -10.601 1.00 0.89 C ATOM 0 H ILE B 87 9.115 -1.682 -7.485 1.00 0.68 H new ATOM 0 HA ILE B 87 10.407 -3.039 -9.568 1.00 0.71 H new ATOM 0 HB ILE B 87 7.938 -2.882 -8.713 1.00 0.73 H new ATOM 0 HG12 ILE B 87 8.400 -3.255 -11.707 1.00 0.83 H new ATOM 0 HG13 ILE B 87 9.121 -4.356 -10.550 1.00 0.83 H new ATOM 0 HG21 ILE B 87 6.451 -1.705 -10.285 1.00 0.87 H new ATOM 0 HG22 ILE B 87 7.476 -0.585 -9.357 1.00 0.87 H new ATOM 0 HG23 ILE B 87 7.870 -0.953 -11.053 1.00 0.87 H new ATOM 0 HD11 ILE B 87 6.943 -5.221 -11.345 1.00 0.89 H new ATOM 0 HD12 ILE B 87 6.872 -4.855 -9.604 1.00 0.89 H new ATOM 0 HD13 ILE B 87 6.140 -3.736 -10.779 1.00 0.89 H new ATOM 3051 N ARG B 88 10.107 0.195 -10.116 1.00 0.81 N ATOM 3052 CA ARG B 88 10.708 1.327 -10.800 1.00 1.09 C ATOM 3053 C ARG B 88 12.077 1.719 -10.220 1.00 1.17 C ATOM 3054 O ARG B 88 13.034 1.921 -10.965 1.00 1.54 O ATOM 3055 CB ARG B 88 9.714 2.503 -10.795 1.00 1.26 C ATOM 3056 CG ARG B 88 10.035 3.567 -11.854 1.00 1.96 C ATOM 3057 CD ARG B 88 9.641 3.093 -13.260 1.00 2.42 C ATOM 3058 NE ARG B 88 10.077 4.050 -14.289 1.00 2.69 N ATOM 3059 CZ ARG B 88 10.237 3.756 -15.591 1.00 3.70 C ATOM 3060 NH1 ARG B 88 9.883 2.552 -16.055 1.00 4.77 N ATOM 3061 NH2 ARG B 88 10.754 4.668 -16.422 1.00 4.15 N ATOM 0 H ARG B 88 9.456 0.474 -9.382 1.00 0.81 H new ATOM 0 HA ARG B 88 10.912 1.037 -11.831 1.00 1.09 H new ATOM 0 HB2 ARG B 88 8.708 2.121 -10.966 1.00 1.26 H new ATOM 0 HB3 ARG B 88 9.715 2.968 -9.809 1.00 1.26 H new ATOM 0 HG2 ARG B 88 9.505 4.490 -11.617 1.00 1.96 H new ATOM 0 HG3 ARG B 88 11.100 3.796 -11.831 1.00 1.96 H new ATOM 0 HD2 ARG B 88 10.087 2.118 -13.455 1.00 2.42 H new ATOM 0 HD3 ARG B 88 8.560 2.966 -13.313 1.00 2.42 H new ATOM 0 HE ARG B 88 10.272 5.006 -13.993 1.00 2.69 H new ATOM 0 HH11 ARG B 88 9.491 1.856 -15.421 1.00 4.77 H new ATOM 0 HH12 ARG B 88 10.005 2.330 -17.043 1.00 4.77 H new ATOM 0 HH21 ARG B 88 11.026 5.585 -16.067 1.00 4.15 H new ATOM 0 HH22 ARG B 88 10.876 4.446 -17.410 1.00 4.15 H new ATOM 3075 N LYS B 89 12.131 1.968 -8.907 1.00 1.00 N ATOM 3076 CA LYS B 89 13.184 2.751 -8.269 1.00 1.18 C ATOM 3077 C LYS B 89 14.349 1.878 -7.783 1.00 1.33 C ATOM 3078 O LYS B 89 14.161 0.796 -7.243 1.00 1.60 O ATOM 3079 CB LYS B 89 12.582 3.570 -7.114 1.00 1.26 C ATOM 3080 CG LYS B 89 13.468 4.763 -6.729 1.00 2.21 C ATOM 3081 CD LYS B 89 12.910 5.463 -5.483 1.00 2.66 C ATOM 3082 CE LYS B 89 13.886 6.557 -5.012 1.00 3.90 C ATOM 3083 NZ LYS B 89 13.492 7.188 -3.735 1.00 5.00 N ATOM 0 H LYS B 89 11.430 1.623 -8.251 1.00 1.00 H new ATOM 0 HA LYS B 89 13.602 3.428 -9.014 1.00 1.18 H new ATOM 0 HB2 LYS B 89 11.594 3.930 -7.402 1.00 1.26 H new ATOM 0 HB3 LYS B 89 12.445 2.925 -6.246 1.00 1.26 H new ATOM 0 HG2 LYS B 89 14.485 4.422 -6.537 1.00 2.21 H new ATOM 0 HG3 LYS B 89 13.519 5.469 -7.558 1.00 2.21 H new ATOM 0 HD2 LYS B 89 11.938 5.903 -5.707 1.00 2.66 H new ATOM 0 HD3 LYS B 89 12.754 4.736 -4.686 1.00 2.66 H new ATOM 0 HE2 LYS B 89 14.880 6.123 -4.902 1.00 3.90 H new ATOM 0 HE3 LYS B 89 13.957 7.326 -5.782 1.00 3.90 H new ATOM 0 HZ1 LYS B 89 14.191 7.914 -3.476 1.00 5.00 H new ATOM 0 HZ2 LYS B 89 12.556 7.630 -3.840 1.00 5.00 H new ATOM 0 HZ3 LYS B 89 13.451 6.465 -2.989 1.00 5.00 H new