USER MOD reduce.3.24.130724 H: found=0, std=0, add=1162, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1161 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 73 THR OG1 : rot 180:sc= 0.785 USER MOD Set 1.2: A 119 ASN : amide:sc= 1.04 K(o=1.8,f=-4.3!) USER MOD Set 2.1: A 88 CYS SG : rot -107:sc= 0.852 USER MOD Set 2.2: A 137 TYR OH : rot 180:sc= 0.00731 USER MOD Set 3.1: A 6 LYS NZ :NH3+ 156:sc= 1.2 (180deg=0.00193) USER MOD Set 3.2: A 50 TYR OH : rot -38:sc= 0.62 USER MOD Set 4.1: A 16 THR OG1 : rot 96:sc= 0.611 USER MOD Set 4.2: A 20 CYS SG : rot 50:sc= 1.28 USER MOD Set 4.3: A 69 TYR OH : rot -39:sc= 1.08 USER MOD Set 5.1: A 5 GLN : amide:sc= 0.358 X(o=0.81,f=0.4) USER MOD Set 5.2: A 35 THR OG1 : rot -70:sc= 0.448 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 167:sc= 1.41 (180deg=1.22) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 10 MET CE :methyl -175:sc= 0 (180deg=-0.0303) USER MOD Single : A 11 GLN : amide:sc= -0.0701 K(o=-0.07,f=-1.4) USER MOD Single : A 13 SER OG : rot 77:sc= 0.952 USER MOD Single : A 15 MET CE :methyl 161:sc= -1.18 (180deg=-1.46) USER MOD Single : A 17 CYS SG : rot -46:sc= -0.303 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 174:sc= 1.26 (180deg=1.23) USER MOD Single : A 31 MET CE :methyl 179:sc= 0 (180deg=-0.000293) USER MOD Single : A 38 ASN : amide:sc= 0.521 K(o=0.52,f=-0.2) USER MOD Single : A 40 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 THR OG1 : rot 180:sc= -0.0972 USER MOD Single : A 45 THR OG1 : rot -86:sc= 1.26 USER MOD Single : A 47 ASN : amide:sc= -0.242 K(o=-0.24,f=-4.9!) USER MOD Single : A 55 THR OG1 : rot -170:sc= 0.0827 USER MOD Single : A 57 THR OG1 : rot -152:sc= 1.07 USER MOD Single : A 61 GLN : amide:sc= 0.454 K(o=0.45,f=-0.82) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ -160:sc= 0.998 (180deg=0.355) USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 MET CE :methyl 164:sc= -0.899 (180deg=-1.23) USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 CYS SG : rot 180:sc= 0 USER MOD Single : A 90 ASN : amide:sc=-0.00866 K(o=-0.0087,f=-0.71) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 1.13 K(o=1.1,f=-0.51) USER MOD Single : A 98 LYS NZ :NH3+ 159:sc= 2.03 (180deg=1.21) USER MOD Single : A 104 ASN : amide:sc= 0.951 K(o=0.95,f=-0.28) USER MOD Single : A 108 ASN : amide:sc= -0.161 K(o=-0.16,f=-1.4) USER MOD Single : A 113 THR OG1 : rot 180:sc=-0.00592 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 TYR OH : rot 150:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 129 LYS NZ :NH3+ 160:sc= -0.562 (180deg=-0.975) USER MOD Single : A 134 LYS NZ :NH3+ 162:sc= 1.08 (180deg=-0.239!) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 LYS NZ :NH3+ -165:sc= 1.31 (180deg=1.11) USER MOD Single : A 142 LYS NZ :NH3+ -161:sc= 0.827 (180deg=0.33) USER MOD Single : A 145 GLN : amide:sc= 0 K(o=0,f=-1.6) USER MOD Single : A 147 SER OG : rot -47:sc= 0.79 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.201 -13.254 11.111 1.00 11.47 N ATOM 2 CA MET A 1 3.213 -14.267 10.043 1.00 10.14 C ATOM 3 C MET A 1 1.784 -14.672 9.698 1.00 9.24 C ATOM 4 O MET A 1 1.149 -13.968 8.925 1.00 9.72 O ATOM 5 CB MET A 1 4.111 -15.469 10.388 1.00 10.17 C ATOM 6 CG MET A 1 5.596 -15.098 10.291 1.00 11.26 C ATOM 7 SD MET A 1 6.171 -13.898 11.517 1.00 13.09 S ATOM 8 CE MET A 1 7.743 -13.422 10.764 1.00 14.24 C ATOM 0 H1 MET A 1 4.161 -13.142 11.494 1.00 11.47 H new ATOM 0 H2 MET A 1 2.875 -12.345 10.724 1.00 11.47 H new ATOM 0 H3 MET A 1 2.558 -13.558 11.870 1.00 11.47 H new ATOM 0 HA MET A 1 3.659 -13.826 9.152 1.00 10.14 H new ATOM 0 HB2 MET A 1 3.886 -15.817 11.396 1.00 10.17 H new ATOM 0 HB3 MET A 1 3.895 -16.294 9.710 1.00 10.17 H new ATOM 0 HG2 MET A 1 6.189 -16.007 10.390 1.00 11.26 H new ATOM 0 HG3 MET A 1 5.790 -14.698 9.296 1.00 11.26 H new ATOM 0 HE1 MET A 1 8.238 -12.681 11.392 1.00 14.24 H new ATOM 0 HE2 MET A 1 8.381 -14.300 10.668 1.00 14.24 H new ATOM 0 HE3 MET A 1 7.560 -12.997 9.777 1.00 14.24 H new ATOM 20 N LEU A 2 1.279 -15.759 10.296 1.00 8.63 N ATOM 21 CA LEU A 2 0.130 -16.490 9.771 1.00 8.09 C ATOM 22 C LEU A 2 0.486 -16.985 8.363 1.00 6.35 C ATOM 23 O LEU A 2 -0.208 -16.700 7.390 1.00 6.57 O ATOM 24 CB LEU A 2 -1.183 -15.684 9.830 1.00 9.61 C ATOM 25 CG LEU A 2 -1.564 -15.235 11.256 1.00 11.19 C ATOM 26 CD1 LEU A 2 -1.136 -13.787 11.538 1.00 12.36 C ATOM 27 CD2 LEU A 2 -3.083 -15.333 11.449 1.00 12.33 C ATOM 0 H LEU A 2 1.659 -16.152 11.157 1.00 8.63 H new ATOM 0 HA LEU A 2 -0.076 -17.350 10.408 1.00 8.09 H new ATOM 0 HB2 LEU A 2 -1.089 -14.804 9.193 1.00 9.61 H new ATOM 0 HB3 LEU A 2 -1.991 -16.290 9.420 1.00 9.61 H new ATOM 0 HG LEU A 2 -1.042 -15.896 11.948 1.00 11.19 H new ATOM 0 HD11 LEU A 2 -1.424 -13.513 12.553 1.00 12.36 H new ATOM 0 HD12 LEU A 2 -0.055 -13.700 11.432 1.00 12.36 H new ATOM 0 HD13 LEU A 2 -1.625 -13.119 10.829 1.00 12.36 H new ATOM 0 HD21 LEU A 2 -3.343 -15.014 12.458 1.00 12.33 H new ATOM 0 HD22 LEU A 2 -3.584 -14.690 10.725 1.00 12.33 H new ATOM 0 HD23 LEU A 2 -3.403 -16.364 11.301 1.00 12.33 H new ATOM 39 N SER A 3 1.611 -17.711 8.287 1.00 4.95 N ATOM 40 CA SER A 3 2.279 -18.121 7.057 1.00 3.43 C ATOM 41 C SER A 3 2.818 -16.904 6.299 1.00 2.18 C ATOM 42 O SER A 3 2.586 -15.760 6.691 1.00 2.88 O ATOM 43 CB SER A 3 1.359 -19.001 6.200 1.00 3.40 C ATOM 44 OG SER A 3 0.834 -20.048 6.997 1.00 4.56 O ATOM 0 H SER A 3 2.096 -18.040 9.122 1.00 4.95 H new ATOM 0 HA SER A 3 3.142 -18.735 7.314 1.00 3.43 H new ATOM 0 HB2 SER A 3 0.548 -18.403 5.785 1.00 3.40 H new ATOM 0 HB3 SER A 3 1.914 -19.414 5.357 1.00 3.40 H new ATOM 0 HG SER A 3 0.245 -20.610 6.452 1.00 4.56 H new ATOM 50 N GLU A 4 3.557 -17.136 5.214 1.00 1.34 N ATOM 51 CA GLU A 4 4.065 -16.088 4.347 1.00 1.79 C ATOM 52 C GLU A 4 2.942 -15.561 3.451 1.00 1.72 C ATOM 53 O GLU A 4 3.081 -15.524 2.234 1.00 2.68 O ATOM 54 CB GLU A 4 5.236 -16.658 3.539 1.00 2.97 C ATOM 55 CG GLU A 4 6.406 -17.032 4.464 1.00 3.96 C ATOM 56 CD GLU A 4 6.932 -18.426 4.163 1.00 5.36 C ATOM 57 OE1 GLU A 4 6.212 -19.375 4.542 1.00 6.25 O ATOM 58 OE2 GLU A 4 8.031 -18.509 3.576 1.00 6.06 O ATOM 0 H GLU A 4 3.820 -18.074 4.913 1.00 1.34 H new ATOM 0 HA GLU A 4 4.426 -15.241 4.930 1.00 1.79 H new ATOM 0 HB2 GLU A 4 4.908 -17.538 2.986 1.00 2.97 H new ATOM 0 HB3 GLU A 4 5.568 -15.925 2.804 1.00 2.97 H new ATOM 0 HG2 GLU A 4 7.210 -16.306 4.347 1.00 3.96 H new ATOM 0 HG3 GLU A 4 6.080 -16.982 5.503 1.00 3.96 H new ATOM 65 N GLN A 5 1.840 -15.115 4.055 1.00 1.10 N ATOM 66 CA GLN A 5 0.844 -14.300 3.385 1.00 0.95 C ATOM 67 C GLN A 5 1.058 -12.877 3.878 1.00 1.27 C ATOM 68 O GLN A 5 1.719 -12.664 4.895 1.00 1.90 O ATOM 69 CB GLN A 5 -0.585 -14.763 3.715 1.00 0.92 C ATOM 70 CG GLN A 5 -0.794 -16.284 3.708 1.00 1.08 C ATOM 71 CD GLN A 5 -0.039 -17.006 2.597 1.00 1.23 C ATOM 72 OE1 GLN A 5 0.856 -17.797 2.881 1.00 3.01 O ATOM 73 NE2 GLN A 5 -0.388 -16.760 1.338 1.00 1.22 N ATOM 0 H GLN A 5 1.618 -15.314 5.030 1.00 1.10 H new ATOM 0 HA GLN A 5 0.954 -14.379 2.303 1.00 0.95 H new ATOM 0 HB2 GLN A 5 -0.857 -14.379 4.698 1.00 0.92 H new ATOM 0 HB3 GLN A 5 -1.271 -14.314 2.997 1.00 0.92 H new ATOM 0 HG2 GLN A 5 -0.480 -16.689 4.670 1.00 1.08 H new ATOM 0 HG3 GLN A 5 -1.859 -16.494 3.606 1.00 1.08 H new ATOM 0 HE21 GLN A 5 -1.136 -16.097 1.136 1.00 1.22 H new ATOM 0 HE22 GLN A 5 0.092 -17.235 0.574 1.00 1.22 H new ATOM 82 N LYS A 6 0.475 -11.900 3.192 1.00 0.93 N ATOM 83 CA LYS A 6 0.360 -10.567 3.738 1.00 1.03 C ATOM 84 C LYS A 6 -0.901 -9.893 3.235 1.00 1.14 C ATOM 85 O LYS A 6 -1.331 -10.115 2.100 1.00 1.33 O ATOM 86 CB LYS A 6 1.622 -9.748 3.474 1.00 1.23 C ATOM 87 CG LYS A 6 2.038 -9.628 2.006 1.00 1.72 C ATOM 88 CD LYS A 6 1.305 -8.513 1.238 1.00 1.21 C ATOM 89 CE LYS A 6 2.337 -7.653 0.486 1.00 1.41 C ATOM 90 NZ LYS A 6 1.785 -6.370 0.003 1.00 2.09 N ATOM 0 H LYS A 6 0.078 -12.013 2.259 1.00 0.93 H new ATOM 0 HA LYS A 6 0.269 -10.639 4.822 1.00 1.03 H new ATOM 0 HB2 LYS A 6 1.473 -8.745 3.874 1.00 1.23 H new ATOM 0 HB3 LYS A 6 2.446 -10.194 4.031 1.00 1.23 H new ATOM 0 HG2 LYS A 6 3.111 -9.444 1.957 1.00 1.72 H new ATOM 0 HG3 LYS A 6 1.854 -10.580 1.508 1.00 1.72 H new ATOM 0 HD2 LYS A 6 0.594 -8.946 0.535 1.00 1.21 H new ATOM 0 HD3 LYS A 6 0.733 -7.894 1.929 1.00 1.21 H new ATOM 0 HE2 LYS A 6 3.182 -7.452 1.145 1.00 1.41 H new ATOM 0 HE3 LYS A 6 2.722 -8.218 -0.363 1.00 1.41 H new ATOM 0 HZ1 LYS A 6 2.557 -5.684 -0.118 1.00 2.09 H new ATOM 0 HZ2 LYS A 6 1.308 -6.519 -0.909 1.00 2.09 H new ATOM 0 HZ3 LYS A 6 1.101 -6.004 0.696 1.00 2.09 H new ATOM 104 N GLU A 7 -1.465 -9.075 4.118 1.00 1.10 N ATOM 105 CA GLU A 7 -2.671 -8.311 3.937 1.00 1.07 C ATOM 106 C GLU A 7 -2.312 -6.928 3.411 1.00 1.09 C ATOM 107 O GLU A 7 -1.265 -6.355 3.760 1.00 1.48 O ATOM 108 CB GLU A 7 -3.416 -8.173 5.277 1.00 1.26 C ATOM 109 CG GLU A 7 -3.408 -9.452 6.135 1.00 1.79 C ATOM 110 CD GLU A 7 -2.203 -9.560 7.077 1.00 2.21 C ATOM 111 OE1 GLU A 7 -1.142 -8.981 6.738 1.00 3.07 O ATOM 112 OE2 GLU A 7 -2.359 -10.234 8.116 1.00 2.66 O ATOM 0 H GLU A 7 -1.054 -8.926 5.040 1.00 1.10 H new ATOM 0 HA GLU A 7 -3.317 -8.823 3.224 1.00 1.07 H new ATOM 0 HB2 GLU A 7 -2.966 -7.362 5.849 1.00 1.26 H new ATOM 0 HB3 GLU A 7 -4.449 -7.888 5.078 1.00 1.26 H new ATOM 0 HG2 GLU A 7 -4.323 -9.487 6.726 1.00 1.79 H new ATOM 0 HG3 GLU A 7 -3.421 -10.320 5.476 1.00 1.79 H new ATOM 119 N ILE A 8 -3.222 -6.401 2.595 1.00 0.74 N ATOM 120 CA ILE A 8 -3.304 -4.986 2.266 1.00 0.67 C ATOM 121 C ILE A 8 -4.787 -4.611 2.127 1.00 0.58 C ATOM 122 O ILE A 8 -5.540 -5.338 1.475 1.00 0.59 O ATOM 123 CB ILE A 8 -2.463 -4.692 1.008 1.00 0.74 C ATOM 124 CG1 ILE A 8 -2.552 -3.219 0.597 1.00 0.82 C ATOM 125 CG2 ILE A 8 -2.872 -5.593 -0.159 1.00 0.82 C ATOM 126 CD1 ILE A 8 -1.493 -2.833 -0.440 1.00 2.11 C ATOM 0 H ILE A 8 -3.939 -6.962 2.135 1.00 0.74 H new ATOM 0 HA ILE A 8 -2.883 -4.363 3.055 1.00 0.67 H new ATOM 0 HB ILE A 8 -1.426 -4.909 1.264 1.00 0.74 H new ATOM 0 HG12 ILE A 8 -3.543 -3.018 0.191 1.00 0.82 H new ATOM 0 HG13 ILE A 8 -2.436 -2.591 1.481 1.00 0.82 H new ATOM 0 HG21 ILE A 8 -2.260 -5.360 -1.030 1.00 0.82 H new ATOM 0 HG22 ILE A 8 -2.726 -6.637 0.119 1.00 0.82 H new ATOM 0 HG23 ILE A 8 -3.922 -5.425 -0.398 1.00 0.82 H new ATOM 0 HD11 ILE A 8 -1.601 -1.779 -0.696 1.00 2.11 H new ATOM 0 HD12 ILE A 8 -0.499 -3.006 -0.027 1.00 2.11 H new ATOM 0 HD13 ILE A 8 -1.624 -3.439 -1.336 1.00 2.11 H new ATOM 138 N ALA A 9 -5.198 -3.502 2.757 1.00 0.61 N ATOM 139 CA ALA A 9 -6.545 -2.956 2.726 1.00 0.54 C ATOM 140 C ALA A 9 -6.454 -1.575 2.093 1.00 0.51 C ATOM 141 O ALA A 9 -5.645 -0.772 2.546 1.00 0.64 O ATOM 142 CB ALA A 9 -7.068 -2.847 4.162 1.00 0.63 C ATOM 0 H ALA A 9 -4.564 -2.941 3.326 1.00 0.61 H new ATOM 0 HA ALA A 9 -7.223 -3.590 2.155 1.00 0.54 H new ATOM 0 HB1 ALA A 9 -8.078 -2.438 4.151 1.00 0.63 H new ATOM 0 HB2 ALA A 9 -7.081 -3.836 4.620 1.00 0.63 H new ATOM 0 HB3 ALA A 9 -6.417 -2.189 4.737 1.00 0.63 H new ATOM 148 N MET A 10 -7.222 -1.297 1.037 1.00 0.40 N ATOM 149 CA MET A 10 -7.202 0.001 0.360 1.00 0.40 C ATOM 150 C MET A 10 -8.581 0.329 -0.213 1.00 0.37 C ATOM 151 O MET A 10 -9.367 -0.577 -0.469 1.00 0.47 O ATOM 152 CB MET A 10 -6.145 -0.005 -0.759 1.00 0.45 C ATOM 153 CG MET A 10 -4.707 0.073 -0.222 1.00 0.58 C ATOM 154 SD MET A 10 -3.430 0.531 -1.422 1.00 1.37 S ATOM 155 CE MET A 10 -3.688 -0.733 -2.687 1.00 1.91 C ATOM 0 H MET A 10 -7.875 -1.965 0.628 1.00 0.40 H new ATOM 0 HA MET A 10 -6.942 0.770 1.087 1.00 0.40 H new ATOM 0 HB2 MET A 10 -6.257 -0.912 -1.353 1.00 0.45 H new ATOM 0 HB3 MET A 10 -6.325 0.838 -1.427 1.00 0.45 H new ATOM 0 HG2 MET A 10 -4.685 0.795 0.594 1.00 0.58 H new ATOM 0 HG3 MET A 10 -4.447 -0.897 0.202 1.00 0.58 H new ATOM 0 HE1 MET A 10 -2.919 -0.642 -3.454 1.00 1.91 H new ATOM 0 HE2 MET A 10 -3.630 -1.721 -2.231 1.00 1.91 H new ATOM 0 HE3 MET A 10 -4.670 -0.599 -3.140 1.00 1.91 H new ATOM 165 N GLN A 11 -8.874 1.611 -0.456 1.00 0.39 N ATOM 166 CA GLN A 11 -10.073 2.028 -1.172 1.00 0.34 C ATOM 167 C GLN A 11 -9.849 2.044 -2.685 1.00 0.33 C ATOM 168 O GLN A 11 -8.792 2.485 -3.155 1.00 0.46 O ATOM 169 CB GLN A 11 -10.536 3.404 -0.698 1.00 0.41 C ATOM 170 CG GLN A 11 -11.097 3.356 0.723 1.00 1.16 C ATOM 171 CD GLN A 11 -11.829 4.646 1.070 1.00 1.32 C ATOM 172 OE1 GLN A 11 -11.798 5.629 0.333 1.00 1.69 O ATOM 173 NE2 GLN A 11 -12.500 4.657 2.212 1.00 1.92 N ATOM 0 H GLN A 11 -8.282 2.386 -0.159 1.00 0.39 H new ATOM 0 HA GLN A 11 -10.851 1.297 -0.953 1.00 0.34 H new ATOM 0 HB2 GLN A 11 -9.699 4.102 -0.735 1.00 0.41 H new ATOM 0 HB3 GLN A 11 -11.299 3.785 -1.377 1.00 0.41 H new ATOM 0 HG2 GLN A 11 -11.779 2.511 0.819 1.00 1.16 H new ATOM 0 HG3 GLN A 11 -10.285 3.193 1.432 1.00 1.16 H new ATOM 0 HE21 GLN A 11 -12.510 3.828 2.806 1.00 1.92 H new ATOM 0 HE22 GLN A 11 -13.007 5.495 2.498 1.00 1.92 H new ATOM 182 N VAL A 12 -10.866 1.591 -3.428 1.00 0.30 N ATOM 183 CA VAL A 12 -10.896 1.424 -4.872 1.00 0.30 C ATOM 184 C VAL A 12 -12.164 2.077 -5.430 1.00 0.27 C ATOM 185 O VAL A 12 -13.197 2.077 -4.764 1.00 0.36 O ATOM 186 CB VAL A 12 -10.819 -0.076 -5.200 1.00 0.41 C ATOM 187 CG1 VAL A 12 -11.884 -0.893 -4.455 1.00 0.54 C ATOM 188 CG2 VAL A 12 -10.973 -0.328 -6.701 1.00 0.55 C ATOM 0 H VAL A 12 -11.748 1.314 -2.998 1.00 0.30 H new ATOM 0 HA VAL A 12 -10.042 1.914 -5.340 1.00 0.30 H new ATOM 0 HB VAL A 12 -9.833 -0.402 -4.870 1.00 0.41 H new ATOM 0 HG11 VAL A 12 -11.787 -1.946 -4.721 1.00 0.54 H new ATOM 0 HG12 VAL A 12 -11.746 -0.776 -3.380 1.00 0.54 H new ATOM 0 HG13 VAL A 12 -12.876 -0.538 -4.734 1.00 0.54 H new ATOM 0 HG21 VAL A 12 -10.914 -1.398 -6.898 1.00 0.55 H new ATOM 0 HG22 VAL A 12 -11.939 0.050 -7.036 1.00 0.55 H new ATOM 0 HG23 VAL A 12 -10.176 0.185 -7.240 1.00 0.55 H new ATOM 198 N SER A 13 -12.076 2.633 -6.642 1.00 0.33 N ATOM 199 CA SER A 13 -13.129 3.425 -7.264 1.00 0.38 C ATOM 200 C SER A 13 -13.907 2.627 -8.313 1.00 0.43 C ATOM 201 O SER A 13 -13.566 1.490 -8.632 1.00 0.81 O ATOM 202 CB SER A 13 -12.517 4.663 -7.926 1.00 0.67 C ATOM 203 OG SER A 13 -11.419 5.160 -7.186 1.00 1.10 O ATOM 0 H SER A 13 -11.247 2.539 -7.229 1.00 0.33 H new ATOM 0 HA SER A 13 -13.827 3.717 -6.479 1.00 0.38 H new ATOM 0 HB2 SER A 13 -12.192 4.413 -8.936 1.00 0.67 H new ATOM 0 HB3 SER A 13 -13.276 5.440 -8.018 1.00 0.67 H new ATOM 0 HG SER A 13 -10.635 4.594 -7.345 1.00 1.10 H new ATOM 209 N GLY A 14 -14.950 3.251 -8.875 1.00 0.47 N ATOM 210 CA GLY A 14 -15.806 2.648 -9.892 1.00 0.64 C ATOM 211 C GLY A 14 -16.625 1.485 -9.330 1.00 0.67 C ATOM 212 O GLY A 14 -17.177 0.677 -10.081 1.00 0.74 O ATOM 0 H GLY A 14 -15.223 4.203 -8.629 1.00 0.47 H new ATOM 0 HA2 GLY A 14 -16.479 3.405 -10.296 1.00 0.64 H new ATOM 0 HA3 GLY A 14 -15.192 2.293 -10.720 1.00 0.64 H new ATOM 216 N MET A 15 -16.722 1.416 -8.000 1.00 0.80 N ATOM 217 CA MET A 15 -17.453 0.381 -7.294 1.00 0.93 C ATOM 218 C MET A 15 -18.954 0.544 -7.525 1.00 0.86 C ATOM 219 O MET A 15 -19.677 1.100 -6.707 1.00 1.03 O ATOM 220 CB MET A 15 -17.054 0.401 -5.811 1.00 1.15 C ATOM 221 CG MET A 15 -15.766 -0.406 -5.639 1.00 1.31 C ATOM 222 SD MET A 15 -16.049 -2.195 -5.630 1.00 1.55 S ATOM 223 CE MET A 15 -14.543 -2.723 -6.455 1.00 3.04 C ATOM 0 H MET A 15 -16.283 2.095 -7.379 1.00 0.80 H new ATOM 0 HA MET A 15 -17.194 -0.604 -7.681 1.00 0.93 H new ATOM 0 HB2 MET A 15 -16.905 1.427 -5.473 1.00 1.15 H new ATOM 0 HB3 MET A 15 -17.850 -0.023 -5.200 1.00 1.15 H new ATOM 0 HG2 MET A 15 -15.077 -0.157 -6.446 1.00 1.31 H new ATOM 0 HG3 MET A 15 -15.283 -0.115 -4.706 1.00 1.31 H new ATOM 0 HE1 MET A 15 -14.367 -3.779 -6.250 1.00 3.04 H new ATOM 0 HE2 MET A 15 -14.646 -2.574 -7.530 1.00 3.04 H new ATOM 0 HE3 MET A 15 -13.701 -2.137 -6.086 1.00 3.04 H new ATOM 233 N THR A 16 -19.426 -0.009 -8.645 1.00 0.80 N ATOM 234 CA THR A 16 -20.838 -0.016 -9.005 1.00 0.86 C ATOM 235 C THR A 16 -21.652 -0.901 -8.049 1.00 0.92 C ATOM 236 O THR A 16 -22.878 -0.891 -8.099 1.00 1.04 O ATOM 237 CB THR A 16 -20.992 -0.402 -10.485 1.00 1.01 C ATOM 238 OG1 THR A 16 -20.108 0.378 -11.275 1.00 1.06 O ATOM 239 CG2 THR A 16 -22.406 -0.176 -11.031 1.00 1.21 C ATOM 0 H THR A 16 -18.828 -0.468 -9.332 1.00 0.80 H new ATOM 0 HA THR A 16 -21.251 0.986 -8.891 1.00 0.86 H new ATOM 0 HB THR A 16 -20.768 -1.467 -10.541 1.00 1.01 H new ATOM 0 HG1 THR A 16 -19.284 -0.127 -11.440 1.00 1.06 H new ATOM 0 HG21 THR A 16 -22.442 -0.469 -12.080 1.00 1.21 H new ATOM 0 HG22 THR A 16 -23.116 -0.776 -10.462 1.00 1.21 H new ATOM 0 HG23 THR A 16 -22.667 0.878 -10.940 1.00 1.21 H new ATOM 247 N CYS A 17 -20.985 -1.643 -7.156 1.00 1.14 N ATOM 248 CA CYS A 17 -21.608 -2.194 -5.953 1.00 1.60 C ATOM 249 C CYS A 17 -22.499 -3.372 -6.336 1.00 1.51 C ATOM 250 O CYS A 17 -23.694 -3.413 -6.056 1.00 2.83 O ATOM 251 CB CYS A 17 -22.311 -1.095 -5.134 1.00 2.86 C ATOM 252 SG CYS A 17 -23.039 -1.794 -3.635 1.00 3.68 S ATOM 0 H CYS A 17 -19.997 -1.877 -7.250 1.00 1.14 H new ATOM 0 HA CYS A 17 -20.846 -2.589 -5.281 1.00 1.60 H new ATOM 0 HB2 CYS A 17 -21.596 -0.316 -4.869 1.00 2.86 H new ATOM 0 HB3 CYS A 17 -23.087 -0.624 -5.737 1.00 2.86 H new ATOM 0 HG CYS A 17 -23.687 -2.881 -3.933 1.00 3.68 H new ATOM 258 N ALA A 18 -21.859 -4.336 -7.003 1.00 1.22 N ATOM 259 CA ALA A 18 -22.415 -5.584 -7.497 1.00 1.64 C ATOM 260 C ALA A 18 -21.284 -6.290 -8.252 1.00 1.42 C ATOM 261 O ALA A 18 -20.328 -6.764 -7.640 1.00 2.38 O ATOM 262 CB ALA A 18 -23.658 -5.334 -8.372 1.00 2.56 C ATOM 0 H ALA A 18 -20.867 -4.252 -7.224 1.00 1.22 H new ATOM 0 HA ALA A 18 -22.769 -6.217 -6.683 1.00 1.64 H new ATOM 0 HB1 ALA A 18 -24.051 -6.287 -8.727 1.00 2.56 H new ATOM 0 HB2 ALA A 18 -24.420 -4.823 -7.784 1.00 2.56 H new ATOM 0 HB3 ALA A 18 -23.383 -4.715 -9.226 1.00 2.56 H new ATOM 268 N ALA A 19 -21.338 -6.301 -9.585 1.00 1.08 N ATOM 269 CA ALA A 19 -20.408 -7.056 -10.411 1.00 0.88 C ATOM 270 C ALA A 19 -18.972 -6.529 -10.353 1.00 0.73 C ATOM 271 O ALA A 19 -18.045 -7.280 -10.639 1.00 0.72 O ATOM 272 CB ALA A 19 -20.913 -7.056 -11.854 1.00 1.20 C ATOM 0 H ALA A 19 -22.034 -5.782 -10.120 1.00 1.08 H new ATOM 0 HA ALA A 19 -20.371 -8.070 -10.013 1.00 0.88 H new ATOM 0 HB1 ALA A 19 -20.222 -7.620 -12.481 1.00 1.20 H new ATOM 0 HB2 ALA A 19 -21.899 -7.518 -11.894 1.00 1.20 H new ATOM 0 HB3 ALA A 19 -20.978 -6.030 -12.217 1.00 1.20 H new ATOM 278 N CYS A 20 -18.770 -5.248 -10.023 1.00 0.71 N ATOM 279 CA CYS A 20 -17.446 -4.624 -10.065 1.00 0.73 C ATOM 280 C CYS A 20 -16.501 -5.358 -9.119 1.00 0.61 C ATOM 281 O CYS A 20 -15.443 -5.852 -9.510 1.00 0.62 O ATOM 282 CB CYS A 20 -17.559 -3.142 -9.685 1.00 0.85 C ATOM 283 SG CYS A 20 -18.123 -2.199 -11.117 1.00 1.00 S ATOM 0 H CYS A 20 -19.515 -4.620 -9.722 1.00 0.71 H new ATOM 0 HA CYS A 20 -17.042 -4.690 -11.075 1.00 0.73 H new ATOM 0 HB2 CYS A 20 -18.257 -3.019 -8.857 1.00 0.85 H new ATOM 0 HB3 CYS A 20 -16.593 -2.767 -9.346 1.00 0.85 H new ATOM 0 HG CYS A 20 -19.174 -2.770 -11.626 1.00 1.00 H new ATOM 289 N ALA A 21 -16.943 -5.468 -7.867 1.00 0.58 N ATOM 290 CA ALA A 21 -16.315 -6.299 -6.857 1.00 0.65 C ATOM 291 C ALA A 21 -16.018 -7.690 -7.400 1.00 0.54 C ATOM 292 O ALA A 21 -14.861 -8.100 -7.454 1.00 0.52 O ATOM 293 CB ALA A 21 -17.255 -6.391 -5.657 1.00 0.92 C ATOM 0 H ALA A 21 -17.765 -4.969 -7.526 1.00 0.58 H new ATOM 0 HA ALA A 21 -15.366 -5.853 -6.560 1.00 0.65 H new ATOM 0 HB1 ALA A 21 -16.800 -7.012 -4.886 1.00 0.92 H new ATOM 0 HB2 ALA A 21 -17.436 -5.392 -5.259 1.00 0.92 H new ATOM 0 HB3 ALA A 21 -18.201 -6.834 -5.969 1.00 0.92 H new ATOM 299 N ALA A 22 -17.065 -8.388 -7.838 1.00 0.57 N ATOM 300 CA ALA A 22 -16.956 -9.774 -8.270 1.00 0.66 C ATOM 301 C ALA A 22 -15.921 -9.911 -9.386 1.00 0.57 C ATOM 302 O ALA A 22 -15.171 -10.884 -9.431 1.00 0.62 O ATOM 303 CB ALA A 22 -18.326 -10.289 -8.710 1.00 0.82 C ATOM 0 H ALA A 22 -18.009 -8.007 -7.902 1.00 0.57 H new ATOM 0 HA ALA A 22 -16.615 -10.383 -7.433 1.00 0.66 H new ATOM 0 HB1 ALA A 22 -18.238 -11.327 -9.032 1.00 0.82 H new ATOM 0 HB2 ALA A 22 -19.024 -10.226 -7.875 1.00 0.82 H new ATOM 0 HB3 ALA A 22 -18.694 -9.682 -9.537 1.00 0.82 H new ATOM 309 N ARG A 23 -15.863 -8.928 -10.284 1.00 0.53 N ATOM 310 CA ARG A 23 -14.890 -8.893 -11.354 1.00 0.60 C ATOM 311 C ARG A 23 -13.480 -8.781 -10.796 1.00 0.51 C ATOM 312 O ARG A 23 -12.605 -9.536 -11.217 1.00 0.55 O ATOM 313 CB ARG A 23 -15.196 -7.737 -12.317 1.00 0.71 C ATOM 314 CG ARG A 23 -16.024 -8.223 -13.506 1.00 0.87 C ATOM 315 CD ARG A 23 -15.211 -9.220 -14.353 1.00 0.97 C ATOM 316 NE ARG A 23 -15.276 -8.860 -15.781 1.00 1.26 N ATOM 317 CZ ARG A 23 -14.642 -9.496 -16.778 1.00 1.47 C ATOM 318 NH1 ARG A 23 -13.915 -10.586 -16.511 1.00 2.09 N ATOM 319 NH2 ARG A 23 -14.739 -9.040 -18.032 1.00 1.65 N ATOM 0 H ARG A 23 -16.499 -8.131 -10.282 1.00 0.53 H new ATOM 0 HA ARG A 23 -14.955 -9.827 -11.912 1.00 0.60 H new ATOM 0 HB2 ARG A 23 -15.737 -6.952 -11.789 1.00 0.71 H new ATOM 0 HB3 ARG A 23 -14.264 -7.298 -12.673 1.00 0.71 H new ATOM 0 HG2 ARG A 23 -16.938 -8.698 -13.151 1.00 0.87 H new ATOM 0 HG3 ARG A 23 -16.324 -7.374 -14.120 1.00 0.87 H new ATOM 0 HD2 ARG A 23 -14.173 -9.226 -14.021 1.00 0.97 H new ATOM 0 HD3 ARG A 23 -15.598 -10.229 -14.209 1.00 0.97 H new ATOM 0 HE ARG A 23 -15.853 -8.058 -16.033 1.00 1.26 H new ATOM 0 HH11 ARG A 23 -13.845 -10.930 -15.553 1.00 2.09 H new ATOM 0 HH12 ARG A 23 -13.431 -11.073 -17.265 1.00 2.09 H new ATOM 0 HH21 ARG A 23 -15.295 -8.208 -18.231 1.00 1.65 H new ATOM 0 HH22 ARG A 23 -14.257 -9.524 -18.789 1.00 1.65 H new ATOM 333 N ILE A 24 -13.240 -7.848 -9.873 1.00 0.46 N ATOM 334 CA ILE A 24 -11.913 -7.689 -9.306 1.00 0.46 C ATOM 335 C ILE A 24 -11.531 -8.959 -8.551 1.00 0.41 C ATOM 336 O ILE A 24 -10.437 -9.472 -8.757 1.00 0.52 O ATOM 337 CB ILE A 24 -11.862 -6.425 -8.443 1.00 0.48 C ATOM 338 CG1 ILE A 24 -11.893 -5.202 -9.373 1.00 0.65 C ATOM 339 CG2 ILE A 24 -10.618 -6.386 -7.556 1.00 0.67 C ATOM 340 CD1 ILE A 24 -12.360 -3.943 -8.650 1.00 0.58 C ATOM 0 H ILE A 24 -13.941 -7.202 -9.510 1.00 0.46 H new ATOM 0 HA ILE A 24 -11.171 -7.552 -10.092 1.00 0.46 H new ATOM 0 HB ILE A 24 -12.724 -6.420 -7.776 1.00 0.48 H new ATOM 0 HG12 ILE A 24 -10.898 -5.035 -9.785 1.00 0.65 H new ATOM 0 HG13 ILE A 24 -12.556 -5.404 -10.214 1.00 0.65 H new ATOM 0 HG21 ILE A 24 -10.623 -5.472 -6.962 1.00 0.67 H new ATOM 0 HG22 ILE A 24 -10.617 -7.251 -6.892 1.00 0.67 H new ATOM 0 HG23 ILE A 24 -9.725 -6.407 -8.181 1.00 0.67 H new ATOM 0 HD11 ILE A 24 -12.366 -3.105 -9.346 1.00 0.58 H new ATOM 0 HD12 ILE A 24 -13.366 -4.099 -8.261 1.00 0.58 H new ATOM 0 HD13 ILE A 24 -11.682 -3.725 -7.825 1.00 0.58 H new ATOM 352 N GLU A 25 -12.422 -9.489 -7.714 1.00 0.40 N ATOM 353 CA GLU A 25 -12.178 -10.709 -6.963 1.00 0.51 C ATOM 354 C GLU A 25 -11.855 -11.866 -7.912 1.00 0.52 C ATOM 355 O GLU A 25 -10.829 -12.524 -7.748 1.00 0.55 O ATOM 356 CB GLU A 25 -13.379 -11.010 -6.061 1.00 0.71 C ATOM 357 CG GLU A 25 -13.507 -9.948 -4.956 1.00 0.75 C ATOM 358 CD GLU A 25 -14.775 -10.126 -4.132 1.00 2.36 C ATOM 359 OE1 GLU A 25 -15.829 -10.357 -4.764 1.00 3.65 O ATOM 360 OE2 GLU A 25 -14.674 -9.993 -2.893 1.00 2.97 O ATOM 0 H GLU A 25 -13.339 -9.077 -7.540 1.00 0.40 H new ATOM 0 HA GLU A 25 -11.308 -10.577 -6.320 1.00 0.51 H new ATOM 0 HB2 GLU A 25 -14.291 -11.034 -6.657 1.00 0.71 H new ATOM 0 HB3 GLU A 25 -13.265 -11.997 -5.613 1.00 0.71 H new ATOM 0 HG2 GLU A 25 -12.638 -10.002 -4.300 1.00 0.75 H new ATOM 0 HG3 GLU A 25 -13.505 -8.955 -5.406 1.00 0.75 H new ATOM 367 N LYS A 26 -12.691 -12.103 -8.932 1.00 0.58 N ATOM 368 CA LYS A 26 -12.443 -13.160 -9.897 1.00 0.69 C ATOM 369 C LYS A 26 -11.109 -12.924 -10.617 1.00 0.63 C ATOM 370 O LYS A 26 -10.314 -13.845 -10.804 1.00 0.73 O ATOM 371 CB LYS A 26 -13.626 -13.320 -10.871 1.00 0.84 C ATOM 372 CG LYS A 26 -13.604 -14.762 -11.394 1.00 0.94 C ATOM 373 CD LYS A 26 -14.324 -14.994 -12.729 1.00 1.36 C ATOM 374 CE LYS A 26 -15.843 -14.794 -12.627 1.00 1.31 C ATOM 375 NZ LYS A 26 -16.547 -15.285 -13.833 1.00 2.07 N ATOM 0 H LYS A 26 -13.544 -11.571 -9.102 1.00 0.58 H new ATOM 0 HA LYS A 26 -12.359 -14.107 -9.364 1.00 0.69 H new ATOM 0 HB2 LYS A 26 -14.569 -13.110 -10.366 1.00 0.84 H new ATOM 0 HB3 LYS A 26 -13.542 -12.612 -11.696 1.00 0.84 H new ATOM 0 HG2 LYS A 26 -12.565 -15.074 -11.503 1.00 0.94 H new ATOM 0 HG3 LYS A 26 -14.054 -15.409 -10.642 1.00 0.94 H new ATOM 0 HD2 LYS A 26 -13.921 -14.311 -13.477 1.00 1.36 H new ATOM 0 HD3 LYS A 26 -14.118 -16.006 -13.077 1.00 1.36 H new ATOM 0 HE2 LYS A 26 -16.220 -15.318 -11.748 1.00 1.31 H new ATOM 0 HE3 LYS A 26 -16.061 -13.735 -12.485 1.00 1.31 H new ATOM 0 HZ1 LYS A 26 -17.570 -15.132 -13.724 1.00 2.07 H new ATOM 0 HZ2 LYS A 26 -16.206 -14.768 -14.669 1.00 2.07 H new ATOM 0 HZ3 LYS A 26 -16.360 -16.301 -13.955 1.00 2.07 H new ATOM 389 N GLY A 27 -10.866 -11.676 -11.017 1.00 0.56 N ATOM 390 CA GLY A 27 -9.660 -11.274 -11.720 1.00 0.61 C ATOM 391 C GLY A 27 -8.427 -11.507 -10.855 1.00 0.54 C ATOM 392 O GLY A 27 -7.379 -11.906 -11.357 1.00 0.66 O ATOM 0 H GLY A 27 -11.516 -10.907 -10.856 1.00 0.56 H new ATOM 0 HA2 GLY A 27 -9.570 -11.837 -12.649 1.00 0.61 H new ATOM 0 HA3 GLY A 27 -9.726 -10.220 -11.991 1.00 0.61 H new ATOM 396 N LEU A 28 -8.543 -11.240 -9.556 1.00 0.45 N ATOM 397 CA LEU A 28 -7.480 -11.437 -8.594 1.00 0.45 C ATOM 398 C LEU A 28 -7.230 -12.915 -8.335 1.00 0.43 C ATOM 399 O LEU A 28 -6.091 -13.358 -8.417 1.00 0.45 O ATOM 400 CB LEU A 28 -7.758 -10.673 -7.299 1.00 0.59 C ATOM 401 CG LEU A 28 -7.158 -9.256 -7.298 1.00 0.76 C ATOM 402 CD1 LEU A 28 -7.662 -8.583 -6.035 1.00 2.67 C ATOM 403 CD2 LEU A 28 -5.630 -9.281 -7.272 1.00 2.69 C ATOM 0 H LEU A 28 -9.400 -10.873 -9.142 1.00 0.45 H new ATOM 0 HA LEU A 28 -6.565 -11.028 -9.023 1.00 0.45 H new ATOM 0 HB2 LEU A 28 -8.835 -10.606 -7.147 1.00 0.59 H new ATOM 0 HB3 LEU A 28 -7.352 -11.235 -6.458 1.00 0.59 H new ATOM 0 HG LEU A 28 -7.455 -8.729 -8.205 1.00 0.76 H new ATOM 0 HD11 LEU A 28 -7.266 -7.569 -5.980 1.00 2.67 H new ATOM 0 HD12 LEU A 28 -8.751 -8.547 -6.052 1.00 2.67 H new ATOM 0 HD13 LEU A 28 -7.331 -9.149 -5.164 1.00 2.67 H new ATOM 0 HD21 LEU A 28 -5.249 -8.260 -7.272 1.00 2.69 H new ATOM 0 HD22 LEU A 28 -5.290 -9.795 -6.373 1.00 2.69 H new ATOM 0 HD23 LEU A 28 -5.260 -9.806 -8.152 1.00 2.69 H new ATOM 415 N LYS A 29 -8.276 -13.690 -8.038 1.00 0.48 N ATOM 416 CA LYS A 29 -8.165 -15.120 -7.754 1.00 0.54 C ATOM 417 C LYS A 29 -7.515 -15.883 -8.921 1.00 0.59 C ATOM 418 O LYS A 29 -6.988 -16.975 -8.737 1.00 0.66 O ATOM 419 CB LYS A 29 -9.558 -15.661 -7.391 1.00 0.63 C ATOM 420 CG LYS A 29 -9.536 -17.078 -6.788 1.00 1.34 C ATOM 421 CD LYS A 29 -9.987 -17.132 -5.318 1.00 1.93 C ATOM 422 CE LYS A 29 -8.933 -16.605 -4.334 1.00 2.97 C ATOM 423 NZ LYS A 29 -9.262 -16.940 -2.928 1.00 3.34 N ATOM 0 H LYS A 29 -9.232 -13.338 -7.988 1.00 0.48 H new ATOM 0 HA LYS A 29 -7.501 -15.275 -6.903 1.00 0.54 H new ATOM 0 HB2 LYS A 29 -10.028 -14.981 -6.680 1.00 0.63 H new ATOM 0 HB3 LYS A 29 -10.180 -15.667 -8.286 1.00 0.63 H new ATOM 0 HG2 LYS A 29 -10.182 -17.726 -7.381 1.00 1.34 H new ATOM 0 HG3 LYS A 29 -8.526 -17.480 -6.864 1.00 1.34 H new ATOM 0 HD2 LYS A 29 -10.901 -16.549 -5.205 1.00 1.93 H new ATOM 0 HD3 LYS A 29 -10.231 -18.162 -5.059 1.00 1.93 H new ATOM 0 HE2 LYS A 29 -7.960 -17.025 -4.588 1.00 2.97 H new ATOM 0 HE3 LYS A 29 -8.850 -15.523 -4.438 1.00 2.97 H new ATOM 0 HZ1 LYS A 29 -8.476 -16.655 -2.310 1.00 3.34 H new ATOM 0 HZ2 LYS A 29 -10.126 -16.436 -2.644 1.00 3.34 H new ATOM 0 HZ3 LYS A 29 -9.416 -17.965 -2.842 1.00 3.34 H new ATOM 437 N ARG A 30 -7.527 -15.300 -10.124 1.00 0.61 N ATOM 438 CA ARG A 30 -6.767 -15.778 -11.273 1.00 0.69 C ATOM 439 C ARG A 30 -5.269 -15.949 -10.965 1.00 0.67 C ATOM 440 O ARG A 30 -4.613 -16.803 -11.557 1.00 0.76 O ATOM 441 CB ARG A 30 -6.968 -14.779 -12.422 1.00 0.75 C ATOM 442 CG ARG A 30 -6.647 -15.375 -13.803 1.00 0.94 C ATOM 443 CD ARG A 30 -7.525 -14.714 -14.878 1.00 1.80 C ATOM 444 NE ARG A 30 -6.964 -14.824 -16.238 1.00 2.55 N ATOM 445 CZ ARG A 30 -6.901 -15.933 -16.994 1.00 2.44 C ATOM 446 NH1 ARG A 30 -7.295 -17.109 -16.496 1.00 2.79 N ATOM 447 NH2 ARG A 30 -6.445 -15.857 -18.250 1.00 3.26 N ATOM 0 H ARG A 30 -8.078 -14.466 -10.326 1.00 0.61 H new ATOM 0 HA ARG A 30 -7.134 -16.767 -11.547 1.00 0.69 H new ATOM 0 HB2 ARG A 30 -8.000 -14.429 -12.415 1.00 0.75 H new ATOM 0 HB3 ARG A 30 -6.335 -13.908 -12.253 1.00 0.75 H new ATOM 0 HG2 ARG A 30 -5.594 -15.223 -14.038 1.00 0.94 H new ATOM 0 HG3 ARG A 30 -6.819 -16.451 -13.793 1.00 0.94 H new ATOM 0 HD2 ARG A 30 -8.514 -15.172 -14.862 1.00 1.80 H new ATOM 0 HD3 ARG A 30 -7.658 -13.661 -14.631 1.00 1.80 H new ATOM 0 HE ARG A 30 -6.585 -13.970 -16.647 1.00 2.55 H new ATOM 0 HH11 ARG A 30 -7.645 -17.166 -15.540 1.00 2.79 H new ATOM 0 HH12 ARG A 30 -7.246 -17.949 -17.072 1.00 2.79 H new ATOM 0 HH21 ARG A 30 -6.147 -14.959 -18.631 1.00 3.26 H new ATOM 0 HH22 ARG A 30 -6.396 -16.697 -18.826 1.00 3.26 H new ATOM 461 N MET A 31 -4.716 -15.098 -10.096 1.00 0.57 N ATOM 462 CA MET A 31 -3.313 -15.096 -9.703 1.00 0.56 C ATOM 463 C MET A 31 -3.094 -16.172 -8.629 1.00 0.56 C ATOM 464 O MET A 31 -3.934 -16.313 -7.742 1.00 0.62 O ATOM 465 CB MET A 31 -2.942 -13.712 -9.146 1.00 0.52 C ATOM 466 CG MET A 31 -3.324 -12.538 -10.069 1.00 0.76 C ATOM 467 SD MET A 31 -1.962 -11.533 -10.715 1.00 1.28 S ATOM 468 CE MET A 31 -1.062 -12.775 -11.668 1.00 1.36 C ATOM 0 H MET A 31 -5.256 -14.367 -9.633 1.00 0.57 H new ATOM 0 HA MET A 31 -2.682 -15.312 -10.565 1.00 0.56 H new ATOM 0 HB2 MET A 31 -3.433 -13.577 -8.182 1.00 0.52 H new ATOM 0 HB3 MET A 31 -1.868 -13.682 -8.964 1.00 0.52 H new ATOM 0 HG2 MET A 31 -3.882 -12.938 -10.915 1.00 0.76 H new ATOM 0 HG3 MET A 31 -4.001 -11.882 -9.522 1.00 0.76 H new ATOM 0 HE1 MET A 31 -0.200 -12.311 -12.147 1.00 1.36 H new ATOM 0 HE2 MET A 31 -0.724 -13.570 -11.003 1.00 1.36 H new ATOM 0 HE3 MET A 31 -1.718 -13.195 -12.430 1.00 1.36 H new ATOM 478 N PRO A 32 -1.980 -16.920 -8.670 1.00 0.65 N ATOM 479 CA PRO A 32 -1.764 -18.056 -7.785 1.00 0.74 C ATOM 480 C PRO A 32 -1.678 -17.642 -6.313 1.00 0.84 C ATOM 481 O PRO A 32 -2.298 -18.275 -5.462 1.00 1.40 O ATOM 482 CB PRO A 32 -0.483 -18.732 -8.288 1.00 0.86 C ATOM 483 CG PRO A 32 0.267 -17.606 -8.998 1.00 0.89 C ATOM 484 CD PRO A 32 -0.861 -16.757 -9.583 1.00 0.78 C ATOM 0 HA PRO A 32 -2.607 -18.747 -7.814 1.00 0.74 H new ATOM 0 HB2 PRO A 32 0.101 -19.145 -7.466 1.00 0.86 H new ATOM 0 HB3 PRO A 32 -0.705 -19.555 -8.967 1.00 0.86 H new ATOM 0 HG2 PRO A 32 0.885 -17.034 -8.306 1.00 0.89 H new ATOM 0 HG3 PRO A 32 0.929 -17.989 -9.775 1.00 0.89 H new ATOM 0 HD2 PRO A 32 -0.566 -15.711 -9.660 1.00 0.78 H new ATOM 0 HD3 PRO A 32 -1.122 -17.089 -10.588 1.00 0.78 H new ATOM 492 N GLY A 33 -0.942 -16.571 -5.997 1.00 0.63 N ATOM 493 CA GLY A 33 -0.615 -16.254 -4.618 1.00 0.65 C ATOM 494 C GLY A 33 -1.774 -15.582 -3.897 1.00 0.48 C ATOM 495 O GLY A 33 -1.731 -15.432 -2.676 1.00 0.46 O ATOM 0 H GLY A 33 -0.566 -15.915 -6.682 1.00 0.63 H new ATOM 0 HA2 GLY A 33 -0.341 -17.168 -4.091 1.00 0.65 H new ATOM 0 HA3 GLY A 33 0.256 -15.599 -4.593 1.00 0.65 H new ATOM 499 N VAL A 34 -2.797 -15.135 -4.638 1.00 0.47 N ATOM 500 CA VAL A 34 -3.995 -14.574 -4.043 1.00 0.42 C ATOM 501 C VAL A 34 -4.636 -15.631 -3.160 1.00 0.51 C ATOM 502 O VAL A 34 -5.250 -16.583 -3.641 1.00 0.78 O ATOM 503 CB VAL A 34 -4.934 -14.022 -5.128 1.00 0.48 C ATOM 504 CG1 VAL A 34 -6.341 -13.772 -4.583 1.00 1.38 C ATOM 505 CG2 VAL A 34 -4.391 -12.684 -5.631 1.00 1.10 C ATOM 0 H VAL A 34 -2.808 -15.156 -5.658 1.00 0.47 H new ATOM 0 HA VAL A 34 -3.751 -13.720 -3.412 1.00 0.42 H new ATOM 0 HB VAL A 34 -4.984 -14.762 -5.927 1.00 0.48 H new ATOM 0 HG11 VAL A 34 -6.976 -13.382 -5.379 1.00 1.38 H new ATOM 0 HG12 VAL A 34 -6.759 -14.708 -4.211 1.00 1.38 H new ATOM 0 HG13 VAL A 34 -6.293 -13.048 -3.770 1.00 1.38 H new ATOM 0 HG21 VAL A 34 -5.054 -12.289 -6.401 1.00 1.10 H new ATOM 0 HG22 VAL A 34 -4.336 -11.979 -4.802 1.00 1.10 H new ATOM 0 HG23 VAL A 34 -3.395 -12.830 -6.049 1.00 1.10 H new ATOM 515 N THR A 35 -4.508 -15.434 -1.851 1.00 0.42 N ATOM 516 CA THR A 35 -5.013 -16.370 -0.885 1.00 0.50 C ATOM 517 C THR A 35 -6.488 -16.028 -0.733 1.00 0.57 C ATOM 518 O THR A 35 -7.356 -16.848 -1.047 1.00 0.67 O ATOM 519 CB THR A 35 -4.207 -16.211 0.410 1.00 0.60 C ATOM 520 OG1 THR A 35 -2.818 -16.202 0.132 1.00 0.86 O ATOM 521 CG2 THR A 35 -4.516 -17.343 1.392 1.00 0.76 C ATOM 0 H THR A 35 -4.050 -14.619 -1.443 1.00 0.42 H new ATOM 0 HA THR A 35 -4.915 -17.416 -1.175 1.00 0.50 H new ATOM 0 HB THR A 35 -4.494 -15.262 0.862 1.00 0.60 H new ATOM 0 HG1 THR A 35 -2.535 -17.097 -0.148 1.00 0.86 H new ATOM 0 HG21 THR A 35 -3.931 -17.206 2.301 1.00 0.76 H new ATOM 0 HG22 THR A 35 -5.578 -17.331 1.638 1.00 0.76 H new ATOM 0 HG23 THR A 35 -4.260 -18.300 0.937 1.00 0.76 H new ATOM 529 N ASP A 36 -6.783 -14.785 -0.337 1.00 0.61 N ATOM 530 CA ASP A 36 -8.138 -14.373 -0.017 1.00 0.89 C ATOM 531 C ASP A 36 -8.359 -12.932 -0.494 1.00 0.79 C ATOM 532 O ASP A 36 -7.827 -11.988 0.088 1.00 1.16 O ATOM 533 CB ASP A 36 -8.356 -14.588 1.487 1.00 1.22 C ATOM 534 CG ASP A 36 -9.814 -14.846 1.812 1.00 1.58 C ATOM 535 OD1 ASP A 36 -10.655 -14.343 1.037 1.00 1.68 O ATOM 536 OD2 ASP A 36 -10.061 -15.547 2.811 1.00 2.64 O ATOM 0 H ASP A 36 -6.088 -14.046 -0.232 1.00 0.61 H new ATOM 0 HA ASP A 36 -8.887 -14.970 -0.536 1.00 0.89 H new ATOM 0 HB2 ASP A 36 -7.753 -15.431 1.825 1.00 1.22 H new ATOM 0 HB3 ASP A 36 -8.011 -13.710 2.034 1.00 1.22 H new ATOM 541 N ALA A 37 -9.079 -12.776 -1.610 1.00 0.59 N ATOM 542 CA ALA A 37 -9.423 -11.492 -2.205 1.00 0.46 C ATOM 543 C ALA A 37 -10.826 -11.132 -1.737 1.00 0.50 C ATOM 544 O ALA A 37 -11.749 -11.900 -1.994 1.00 0.65 O ATOM 545 CB ALA A 37 -9.382 -11.586 -3.737 1.00 0.50 C ATOM 0 H ALA A 37 -9.447 -13.568 -2.136 1.00 0.59 H new ATOM 0 HA ALA A 37 -8.709 -10.727 -1.900 1.00 0.46 H new ATOM 0 HB1 ALA A 37 -9.641 -10.619 -4.168 1.00 0.50 H new ATOM 0 HB2 ALA A 37 -8.379 -11.869 -4.057 1.00 0.50 H new ATOM 0 HB3 ALA A 37 -10.096 -12.337 -4.075 1.00 0.50 H new ATOM 551 N ASN A 38 -10.977 -9.999 -1.044 1.00 0.45 N ATOM 552 CA ASN A 38 -12.250 -9.547 -0.502 1.00 0.51 C ATOM 553 C ASN A 38 -12.432 -8.082 -0.872 1.00 0.42 C ATOM 554 O ASN A 38 -11.451 -7.353 -1.018 1.00 0.41 O ATOM 555 CB ASN A 38 -12.254 -9.693 1.027 1.00 0.70 C ATOM 556 CG ASN A 38 -12.183 -11.152 1.453 1.00 0.87 C ATOM 557 OD1 ASN A 38 -13.196 -11.747 1.807 1.00 1.64 O ATOM 558 ND2 ASN A 38 -10.989 -11.731 1.414 1.00 1.49 N ATOM 0 H ASN A 38 -10.203 -9.365 -0.844 1.00 0.45 H new ATOM 0 HA ASN A 38 -13.062 -10.148 -0.912 1.00 0.51 H new ATOM 0 HB2 ASN A 38 -11.407 -9.150 1.447 1.00 0.70 H new ATOM 0 HB3 ASN A 38 -13.158 -9.239 1.434 1.00 0.70 H new ATOM 0 HD21 ASN A 38 -10.887 -12.709 1.685 1.00 1.49 H new ATOM 0 HD22 ASN A 38 -10.173 -11.198 1.113 1.00 1.49 H new ATOM 565 N VAL A 39 -13.674 -7.618 -0.972 1.00 0.48 N ATOM 566 CA VAL A 39 -13.959 -6.199 -1.082 1.00 0.46 C ATOM 567 C VAL A 39 -15.261 -5.881 -0.365 1.00 0.56 C ATOM 568 O VAL A 39 -16.329 -6.394 -0.696 1.00 0.71 O ATOM 569 CB VAL A 39 -13.903 -5.735 -2.549 1.00 0.59 C ATOM 570 CG1 VAL A 39 -14.886 -6.490 -3.438 1.00 0.86 C ATOM 571 CG2 VAL A 39 -14.174 -4.233 -2.708 1.00 0.58 C ATOM 0 H VAL A 39 -14.502 -8.213 -0.979 1.00 0.48 H new ATOM 0 HA VAL A 39 -13.185 -5.619 -0.579 1.00 0.46 H new ATOM 0 HB VAL A 39 -12.883 -5.952 -2.866 1.00 0.59 H new ATOM 0 HG11 VAL A 39 -14.806 -6.124 -4.462 1.00 0.86 H new ATOM 0 HG12 VAL A 39 -14.654 -7.555 -3.414 1.00 0.86 H new ATOM 0 HG13 VAL A 39 -15.901 -6.331 -3.075 1.00 0.86 H new ATOM 0 HG21 VAL A 39 -14.121 -3.963 -3.763 1.00 0.58 H new ATOM 0 HG22 VAL A 39 -15.167 -4.000 -2.323 1.00 0.58 H new ATOM 0 HG23 VAL A 39 -13.427 -3.668 -2.151 1.00 0.58 H new ATOM 581 N ASN A 40 -15.176 -4.971 0.602 1.00 0.57 N ATOM 582 CA ASN A 40 -16.337 -4.420 1.259 1.00 0.70 C ATOM 583 C ASN A 40 -16.872 -3.369 0.306 1.00 0.69 C ATOM 584 O ASN A 40 -16.735 -2.173 0.537 1.00 0.70 O ATOM 585 CB ASN A 40 -15.954 -3.792 2.602 1.00 0.86 C ATOM 586 CG ASN A 40 -15.628 -4.835 3.659 1.00 1.27 C ATOM 587 OD1 ASN A 40 -14.479 -5.236 3.824 1.00 2.28 O ATOM 588 ND2 ASN A 40 -16.640 -5.276 4.400 1.00 1.51 N ATOM 0 H ASN A 40 -14.291 -4.599 0.947 1.00 0.57 H new ATOM 0 HA ASN A 40 -17.081 -5.185 1.478 1.00 0.70 H new ATOM 0 HB2 ASN A 40 -15.092 -3.139 2.462 1.00 0.86 H new ATOM 0 HB3 ASN A 40 -16.774 -3.166 2.954 1.00 0.86 H new ATOM 0 HD21 ASN A 40 -16.473 -5.968 5.131 1.00 1.51 H new ATOM 0 HD22 ASN A 40 -17.583 -4.923 4.238 1.00 1.51 H new ATOM 595 N LEU A 41 -17.520 -3.832 -0.764 1.00 0.81 N ATOM 596 CA LEU A 41 -18.247 -2.987 -1.703 1.00 0.92 C ATOM 597 C LEU A 41 -19.304 -2.123 -1.005 1.00 1.03 C ATOM 598 O LEU A 41 -19.739 -1.116 -1.550 1.00 1.30 O ATOM 599 CB LEU A 41 -18.832 -3.856 -2.824 1.00 1.16 C ATOM 600 CG LEU A 41 -19.815 -4.940 -2.350 1.00 1.53 C ATOM 601 CD1 LEU A 41 -21.266 -4.526 -2.604 1.00 1.71 C ATOM 602 CD2 LEU A 41 -19.546 -6.266 -3.068 1.00 2.16 C ATOM 0 H LEU A 41 -17.553 -4.823 -1.004 1.00 0.81 H new ATOM 0 HA LEU A 41 -17.551 -2.278 -2.152 1.00 0.92 H new ATOM 0 HB2 LEU A 41 -19.342 -3.209 -3.538 1.00 1.16 H new ATOM 0 HB3 LEU A 41 -18.012 -4.336 -3.358 1.00 1.16 H new ATOM 0 HG LEU A 41 -19.663 -5.065 -1.278 1.00 1.53 H new ATOM 0 HD11 LEU A 41 -21.935 -5.314 -2.258 1.00 1.71 H new ATOM 0 HD12 LEU A 41 -21.481 -3.604 -2.064 1.00 1.71 H new ATOM 0 HD13 LEU A 41 -21.417 -4.365 -3.671 1.00 1.71 H new ATOM 0 HD21 LEU A 41 -20.252 -7.019 -2.718 1.00 2.16 H new ATOM 0 HD22 LEU A 41 -19.665 -6.128 -4.143 1.00 2.16 H new ATOM 0 HD23 LEU A 41 -18.529 -6.595 -2.855 1.00 2.16 H new ATOM 614 N ALA A 42 -19.688 -2.501 0.218 1.00 0.95 N ATOM 615 CA ALA A 42 -20.560 -1.711 1.068 1.00 1.04 C ATOM 616 C ALA A 42 -19.882 -0.411 1.516 1.00 1.02 C ATOM 617 O ALA A 42 -20.564 0.595 1.692 1.00 1.16 O ATOM 618 CB ALA A 42 -20.985 -2.552 2.275 1.00 1.08 C ATOM 0 H ALA A 42 -19.393 -3.379 0.644 1.00 0.95 H new ATOM 0 HA ALA A 42 -21.444 -1.428 0.497 1.00 1.04 H new ATOM 0 HB1 ALA A 42 -21.640 -1.963 2.916 1.00 1.08 H new ATOM 0 HB2 ALA A 42 -21.516 -3.440 1.931 1.00 1.08 H new ATOM 0 HB3 ALA A 42 -20.101 -2.853 2.838 1.00 1.08 H new ATOM 624 N THR A 43 -18.561 -0.435 1.740 1.00 0.88 N ATOM 625 CA THR A 43 -17.789 0.718 2.203 1.00 0.85 C ATOM 626 C THR A 43 -16.660 1.104 1.230 1.00 0.69 C ATOM 627 O THR A 43 -15.871 1.992 1.540 1.00 0.82 O ATOM 628 CB THR A 43 -17.255 0.417 3.611 1.00 0.91 C ATOM 629 OG1 THR A 43 -16.531 -0.798 3.606 1.00 0.82 O ATOM 630 CG2 THR A 43 -18.404 0.282 4.617 1.00 1.13 C ATOM 0 H THR A 43 -17.993 -1.271 1.601 1.00 0.88 H new ATOM 0 HA THR A 43 -18.445 1.588 2.240 1.00 0.85 H new ATOM 0 HB THR A 43 -16.609 1.245 3.902 1.00 0.91 H new ATOM 0 HG1 THR A 43 -16.193 -0.981 4.507 1.00 0.82 H new ATOM 0 HG21 THR A 43 -17.998 0.069 5.606 1.00 1.13 H new ATOM 0 HG22 THR A 43 -18.970 1.213 4.650 1.00 1.13 H new ATOM 0 HG23 THR A 43 -19.061 -0.532 4.311 1.00 1.13 H new ATOM 638 N GLU A 44 -16.594 0.453 0.063 1.00 0.63 N ATOM 639 CA GLU A 44 -15.629 0.688 -1.004 1.00 0.60 C ATOM 640 C GLU A 44 -14.188 0.412 -0.552 1.00 0.55 C ATOM 641 O GLU A 44 -13.281 1.155 -0.926 1.00 0.73 O ATOM 642 CB GLU A 44 -15.796 2.096 -1.599 1.00 0.62 C ATOM 643 CG GLU A 44 -17.219 2.353 -2.113 1.00 0.78 C ATOM 644 CD GLU A 44 -17.312 3.717 -2.788 1.00 0.91 C ATOM 645 OE1 GLU A 44 -16.954 3.786 -3.982 1.00 1.81 O ATOM 646 OE2 GLU A 44 -17.724 4.669 -2.087 1.00 1.44 O ATOM 0 H GLU A 44 -17.251 -0.292 -0.170 1.00 0.63 H new ATOM 0 HA GLU A 44 -15.838 -0.027 -1.800 1.00 0.60 H new ATOM 0 HB2 GLU A 44 -15.548 2.839 -0.841 1.00 0.62 H new ATOM 0 HB3 GLU A 44 -15.088 2.227 -2.418 1.00 0.62 H new ATOM 0 HG2 GLU A 44 -17.502 1.573 -2.819 1.00 0.78 H new ATOM 0 HG3 GLU A 44 -17.925 2.304 -1.284 1.00 0.78 H new ATOM 653 N THR A 45 -13.964 -0.679 0.194 1.00 0.45 N ATOM 654 CA THR A 45 -12.641 -1.028 0.716 1.00 0.43 C ATOM 655 C THR A 45 -12.274 -2.421 0.201 1.00 0.37 C ATOM 656 O THR A 45 -12.905 -3.400 0.596 1.00 0.44 O ATOM 657 CB THR A 45 -12.642 -0.915 2.254 1.00 0.59 C ATOM 658 OG1 THR A 45 -12.621 0.448 2.637 1.00 0.90 O ATOM 659 CG2 THR A 45 -11.461 -1.629 2.914 1.00 0.54 C ATOM 0 H THR A 45 -14.696 -1.342 0.451 1.00 0.45 H new ATOM 0 HA THR A 45 -11.875 -0.337 0.365 1.00 0.43 H new ATOM 0 HB THR A 45 -13.554 -1.404 2.596 1.00 0.59 H new ATOM 0 HG1 THR A 45 -11.694 0.766 2.665 1.00 0.90 H new ATOM 0 HG21 THR A 45 -11.522 -1.510 3.996 1.00 0.54 H new ATOM 0 HG22 THR A 45 -11.491 -2.689 2.663 1.00 0.54 H new ATOM 0 HG23 THR A 45 -10.527 -1.197 2.554 1.00 0.54 H new ATOM 667 N VAL A 46 -11.287 -2.514 -0.697 1.00 0.32 N ATOM 668 CA VAL A 46 -10.737 -3.767 -1.186 1.00 0.33 C ATOM 669 C VAL A 46 -9.666 -4.245 -0.210 1.00 0.36 C ATOM 670 O VAL A 46 -8.757 -3.491 0.131 1.00 0.39 O ATOM 671 CB VAL A 46 -10.237 -3.625 -2.637 1.00 0.32 C ATOM 672 CG1 VAL A 46 -9.221 -2.499 -2.873 1.00 0.36 C ATOM 673 CG2 VAL A 46 -9.617 -4.935 -3.124 1.00 0.38 C ATOM 0 H VAL A 46 -10.842 -1.694 -1.110 1.00 0.32 H new ATOM 0 HA VAL A 46 -11.511 -4.533 -1.228 1.00 0.33 H new ATOM 0 HB VAL A 46 -11.132 -3.366 -3.202 1.00 0.32 H new ATOM 0 HG11 VAL A 46 -8.933 -2.483 -3.924 1.00 0.36 H new ATOM 0 HG12 VAL A 46 -9.670 -1.542 -2.606 1.00 0.36 H new ATOM 0 HG13 VAL A 46 -8.338 -2.671 -2.257 1.00 0.36 H new ATOM 0 HG21 VAL A 46 -9.270 -4.814 -4.150 1.00 0.38 H new ATOM 0 HG22 VAL A 46 -8.774 -5.198 -2.485 1.00 0.38 H new ATOM 0 HG23 VAL A 46 -10.364 -5.728 -3.085 1.00 0.38 H new ATOM 683 N ASN A 47 -9.785 -5.494 0.246 1.00 0.37 N ATOM 684 CA ASN A 47 -8.878 -6.118 1.192 1.00 0.41 C ATOM 685 C ASN A 47 -8.354 -7.391 0.537 1.00 0.40 C ATOM 686 O ASN A 47 -9.129 -8.322 0.312 1.00 0.40 O ATOM 687 CB ASN A 47 -9.622 -6.475 2.488 1.00 0.47 C ATOM 688 CG ASN A 47 -10.138 -5.253 3.239 1.00 1.70 C ATOM 689 OD1 ASN A 47 -9.559 -4.179 3.164 1.00 2.99 O ATOM 690 ND2 ASN A 47 -11.239 -5.399 3.970 1.00 2.19 N ATOM 0 H ASN A 47 -10.542 -6.112 -0.047 1.00 0.37 H new ATOM 0 HA ASN A 47 -8.063 -5.439 1.445 1.00 0.41 H new ATOM 0 HB2 ASN A 47 -10.461 -7.128 2.250 1.00 0.47 H new ATOM 0 HB3 ASN A 47 -8.954 -7.039 3.139 1.00 0.47 H new ATOM 0 HD21 ASN A 47 -11.619 -4.604 4.484 1.00 2.19 H new ATOM 0 HD22 ASN A 47 -11.704 -6.306 4.016 1.00 2.19 H new ATOM 697 N VAL A 48 -7.063 -7.442 0.208 1.00 0.44 N ATOM 698 CA VAL A 48 -6.481 -8.604 -0.452 1.00 0.46 C ATOM 699 C VAL A 48 -5.411 -9.193 0.460 1.00 0.52 C ATOM 700 O VAL A 48 -4.547 -8.463 0.950 1.00 0.53 O ATOM 701 CB VAL A 48 -5.924 -8.256 -1.845 1.00 0.41 C ATOM 702 CG1 VAL A 48 -5.836 -9.530 -2.699 1.00 0.45 C ATOM 703 CG2 VAL A 48 -6.807 -7.243 -2.585 1.00 0.42 C ATOM 0 H VAL A 48 -6.401 -6.688 0.390 1.00 0.44 H new ATOM 0 HA VAL A 48 -7.258 -9.349 -0.623 1.00 0.46 H new ATOM 0 HB VAL A 48 -4.939 -7.814 -1.695 1.00 0.41 H new ATOM 0 HG11 VAL A 48 -5.442 -9.281 -3.684 1.00 0.45 H new ATOM 0 HG12 VAL A 48 -5.175 -10.248 -2.214 1.00 0.45 H new ATOM 0 HG13 VAL A 48 -6.829 -9.966 -2.805 1.00 0.45 H new ATOM 0 HG21 VAL A 48 -6.374 -7.028 -3.562 1.00 0.42 H new ATOM 0 HG22 VAL A 48 -7.807 -7.658 -2.714 1.00 0.42 H new ATOM 0 HG23 VAL A 48 -6.868 -6.322 -2.005 1.00 0.42 H new ATOM 713 N ILE A 49 -5.485 -10.508 0.679 1.00 0.61 N ATOM 714 CA ILE A 49 -4.505 -11.279 1.418 1.00 0.65 C ATOM 715 C ILE A 49 -3.843 -12.227 0.420 1.00 0.54 C ATOM 716 O ILE A 49 -4.537 -12.983 -0.268 1.00 0.53 O ATOM 717 CB ILE A 49 -5.177 -12.051 2.568 1.00 0.80 C ATOM 718 CG1 ILE A 49 -5.887 -11.111 3.562 1.00 0.91 C ATOM 719 CG2 ILE A 49 -4.110 -12.855 3.328 1.00 0.90 C ATOM 720 CD1 ILE A 49 -7.338 -10.767 3.198 1.00 1.43 C ATOM 0 H ILE A 49 -6.258 -11.076 0.332 1.00 0.61 H new ATOM 0 HA ILE A 49 -3.758 -10.630 1.876 1.00 0.65 H new ATOM 0 HB ILE A 49 -5.927 -12.709 2.129 1.00 0.80 H new ATOM 0 HG12 ILE A 49 -5.875 -11.573 4.549 1.00 0.91 H new ATOM 0 HG13 ILE A 49 -5.316 -10.185 3.636 1.00 0.91 H new ATOM 0 HG21 ILE A 49 -4.580 -13.404 4.144 1.00 0.90 H new ATOM 0 HG22 ILE A 49 -3.630 -13.558 2.647 1.00 0.90 H new ATOM 0 HG23 ILE A 49 -3.361 -12.174 3.733 1.00 0.90 H new ATOM 0 HD11 ILE A 49 -7.755 -10.102 3.954 1.00 1.43 H new ATOM 0 HD12 ILE A 49 -7.362 -10.273 2.227 1.00 1.43 H new ATOM 0 HD13 ILE A 49 -7.929 -11.682 3.154 1.00 1.43 H new ATOM 732 N TYR A 50 -2.513 -12.171 0.299 1.00 0.51 N ATOM 733 CA TYR A 50 -1.816 -12.920 -0.737 1.00 0.41 C ATOM 734 C TYR A 50 -0.366 -13.203 -0.379 1.00 0.46 C ATOM 735 O TYR A 50 0.192 -12.568 0.517 1.00 0.59 O ATOM 736 CB TYR A 50 -1.893 -12.152 -2.057 1.00 0.39 C ATOM 737 CG TYR A 50 -1.350 -10.746 -1.965 1.00 0.41 C ATOM 738 CD1 TYR A 50 -2.227 -9.703 -1.636 1.00 1.84 C ATOM 739 CD2 TYR A 50 -0.012 -10.462 -2.285 1.00 1.97 C ATOM 740 CE1 TYR A 50 -1.806 -8.378 -1.769 1.00 1.80 C ATOM 741 CE2 TYR A 50 0.449 -9.136 -2.267 1.00 2.02 C ATOM 742 CZ TYR A 50 -0.461 -8.095 -2.029 1.00 0.52 C ATOM 743 OH TYR A 50 -0.027 -6.808 -1.954 1.00 0.74 O ATOM 0 H TYR A 50 -1.906 -11.617 0.904 1.00 0.51 H new ATOM 0 HA TYR A 50 -2.310 -13.887 -0.834 1.00 0.41 H new ATOM 0 HB2 TYR A 50 -1.338 -12.699 -2.820 1.00 0.39 H new ATOM 0 HB3 TYR A 50 -2.932 -12.112 -2.385 1.00 0.39 H new ATOM 0 HD1 TYR A 50 -3.223 -9.923 -1.281 1.00 1.84 H new ATOM 0 HD2 TYR A 50 0.663 -11.264 -2.545 1.00 1.97 H new ATOM 0 HE1 TYR A 50 -2.519 -7.572 -1.671 1.00 1.80 H new ATOM 0 HE2 TYR A 50 1.494 -8.919 -2.435 1.00 2.02 H new ATOM 0 HH TYR A 50 -0.716 -6.209 -2.310 1.00 0.74 H new ATOM 753 N ASP A 51 0.239 -14.131 -1.122 1.00 0.49 N ATOM 754 CA ASP A 51 1.646 -14.468 -1.009 1.00 0.65 C ATOM 755 C ASP A 51 2.503 -13.339 -1.616 1.00 0.67 C ATOM 756 O ASP A 51 2.273 -12.948 -2.765 1.00 0.68 O ATOM 757 CB ASP A 51 1.889 -15.796 -1.732 1.00 0.85 C ATOM 758 CG ASP A 51 3.372 -16.095 -1.812 1.00 1.78 C ATOM 759 OD1 ASP A 51 4.016 -15.408 -2.630 1.00 3.21 O ATOM 760 OD2 ASP A 51 3.841 -16.951 -1.037 1.00 1.96 O ATOM 0 H ASP A 51 -0.251 -14.676 -1.831 1.00 0.49 H new ATOM 0 HA ASP A 51 1.929 -14.576 0.038 1.00 0.65 H new ATOM 0 HB2 ASP A 51 1.378 -16.602 -1.206 1.00 0.85 H new ATOM 0 HB3 ASP A 51 1.466 -15.753 -2.736 1.00 0.85 H new ATOM 765 N PRO A 52 3.484 -12.791 -0.878 1.00 0.80 N ATOM 766 CA PRO A 52 4.276 -11.643 -1.302 1.00 0.78 C ATOM 767 C PRO A 52 5.404 -11.976 -2.282 1.00 1.01 C ATOM 768 O PRO A 52 6.272 -11.132 -2.504 1.00 1.41 O ATOM 769 CB PRO A 52 4.850 -11.075 0.002 1.00 0.93 C ATOM 770 CG PRO A 52 4.998 -12.306 0.903 1.00 1.18 C ATOM 771 CD PRO A 52 3.837 -13.195 0.470 1.00 1.07 C ATOM 0 HA PRO A 52 3.650 -10.943 -1.855 1.00 0.78 H new ATOM 0 HB2 PRO A 52 5.808 -10.583 -0.164 1.00 0.93 H new ATOM 0 HB3 PRO A 52 4.183 -10.334 0.443 1.00 0.93 H new ATOM 0 HG2 PRO A 52 5.959 -12.799 0.757 1.00 1.18 H new ATOM 0 HG3 PRO A 52 4.932 -12.043 1.959 1.00 1.18 H new ATOM 0 HD2 PRO A 52 4.124 -14.246 0.497 1.00 1.07 H new ATOM 0 HD3 PRO A 52 2.988 -13.079 1.144 1.00 1.07 H new ATOM 779 N ALA A 53 5.416 -13.178 -2.856 1.00 0.85 N ATOM 780 CA ALA A 53 6.520 -13.711 -3.643 1.00 1.00 C ATOM 781 C ALA A 53 6.042 -14.187 -5.014 1.00 1.18 C ATOM 782 O ALA A 53 6.763 -14.030 -5.998 1.00 2.09 O ATOM 783 CB ALA A 53 7.241 -14.799 -2.839 1.00 1.21 C ATOM 0 H ALA A 53 4.632 -13.826 -2.782 1.00 0.85 H new ATOM 0 HA ALA A 53 7.244 -12.921 -3.845 1.00 1.00 H new ATOM 0 HB1 ALA A 53 8.067 -15.199 -3.427 1.00 1.21 H new ATOM 0 HB2 ALA A 53 7.627 -14.372 -1.914 1.00 1.21 H new ATOM 0 HB3 ALA A 53 6.542 -15.601 -2.604 1.00 1.21 H new ATOM 789 N GLU A 54 4.823 -14.719 -5.102 1.00 0.84 N ATOM 790 CA GLU A 54 4.226 -15.129 -6.361 1.00 0.84 C ATOM 791 C GLU A 54 3.597 -13.959 -7.116 1.00 0.78 C ATOM 792 O GLU A 54 3.663 -13.912 -8.343 1.00 0.92 O ATOM 793 CB GLU A 54 3.150 -16.178 -6.090 1.00 0.85 C ATOM 794 CG GLU A 54 3.737 -17.457 -5.482 1.00 0.93 C ATOM 795 CD GLU A 54 2.765 -18.623 -5.620 1.00 0.98 C ATOM 796 OE1 GLU A 54 1.545 -18.354 -5.553 1.00 1.70 O ATOM 797 OE2 GLU A 54 3.251 -19.753 -5.837 1.00 1.91 O ATOM 0 H GLU A 54 4.222 -14.876 -4.293 1.00 0.84 H new ATOM 0 HA GLU A 54 5.023 -15.537 -6.983 1.00 0.84 H new ATOM 0 HB2 GLU A 54 2.402 -15.764 -5.413 1.00 0.85 H new ATOM 0 HB3 GLU A 54 2.637 -16.421 -7.021 1.00 0.85 H new ATOM 0 HG2 GLU A 54 4.677 -17.702 -5.977 1.00 0.93 H new ATOM 0 HG3 GLU A 54 3.965 -17.292 -4.429 1.00 0.93 H new ATOM 804 N THR A 55 2.904 -13.064 -6.405 1.00 0.64 N ATOM 805 CA THR A 55 1.870 -12.235 -6.983 1.00 0.71 C ATOM 806 C THR A 55 2.374 -10.793 -7.000 1.00 0.78 C ATOM 807 O THR A 55 2.870 -10.320 -8.021 1.00 1.01 O ATOM 808 CB THR A 55 0.631 -12.510 -6.128 1.00 0.64 C ATOM 809 OG1 THR A 55 0.142 -13.801 -6.433 1.00 0.75 O ATOM 810 CG2 THR A 55 -0.519 -11.546 -6.323 1.00 0.91 C ATOM 0 H THR A 55 3.054 -12.902 -5.409 1.00 0.64 H new ATOM 0 HA THR A 55 1.612 -12.444 -8.021 1.00 0.71 H new ATOM 0 HB THR A 55 0.969 -12.400 -5.098 1.00 0.64 H new ATOM 0 HG1 THR A 55 -0.734 -13.927 -6.013 1.00 0.75 H new ATOM 0 HG21 THR A 55 -1.346 -11.829 -5.672 1.00 0.91 H new ATOM 0 HG22 THR A 55 -0.193 -10.536 -6.077 1.00 0.91 H new ATOM 0 HG23 THR A 55 -0.848 -11.578 -7.362 1.00 0.91 H new ATOM 818 N GLY A 56 2.286 -10.099 -5.863 1.00 0.65 N ATOM 819 CA GLY A 56 2.909 -8.808 -5.670 1.00 0.71 C ATOM 820 C GLY A 56 1.855 -7.715 -5.737 1.00 0.68 C ATOM 821 O GLY A 56 1.109 -7.619 -6.705 1.00 0.70 O ATOM 0 H GLY A 56 1.772 -10.430 -5.047 1.00 0.65 H new ATOM 0 HA2 GLY A 56 3.416 -8.779 -4.706 1.00 0.71 H new ATOM 0 HA3 GLY A 56 3.668 -8.642 -6.434 1.00 0.71 H new ATOM 825 N THR A 57 1.825 -6.879 -4.698 1.00 0.65 N ATOM 826 CA THR A 57 1.065 -5.625 -4.617 1.00 0.65 C ATOM 827 C THR A 57 0.874 -4.954 -5.987 1.00 0.72 C ATOM 828 O THR A 57 -0.248 -4.628 -6.378 1.00 0.69 O ATOM 829 CB THR A 57 1.679 -4.694 -3.555 1.00 0.81 C ATOM 830 OG1 THR A 57 1.046 -3.432 -3.562 1.00 1.31 O ATOM 831 CG2 THR A 57 3.175 -4.527 -3.748 1.00 0.99 C ATOM 0 H THR A 57 2.355 -7.065 -3.847 1.00 0.65 H new ATOM 0 HA THR A 57 0.053 -5.864 -4.289 1.00 0.65 H new ATOM 0 HB THR A 57 1.515 -5.165 -2.586 1.00 0.81 H new ATOM 0 HG1 THR A 57 1.677 -2.748 -3.257 1.00 1.31 H new ATOM 0 HG21 THR A 57 3.569 -3.863 -2.979 1.00 0.99 H new ATOM 0 HG22 THR A 57 3.662 -5.499 -3.673 1.00 0.99 H new ATOM 0 HG23 THR A 57 3.369 -4.099 -4.731 1.00 0.99 H new ATOM 839 N ALA A 58 1.962 -4.807 -6.746 1.00 0.86 N ATOM 840 CA ALA A 58 1.930 -4.158 -8.044 1.00 0.97 C ATOM 841 C ALA A 58 1.028 -4.919 -9.013 1.00 0.93 C ATOM 842 O ALA A 58 0.256 -4.303 -9.731 1.00 0.93 O ATOM 843 CB ALA A 58 3.353 -4.031 -8.593 1.00 1.14 C ATOM 0 H ALA A 58 2.887 -5.137 -6.471 1.00 0.86 H new ATOM 0 HA ALA A 58 1.511 -3.158 -7.929 1.00 0.97 H new ATOM 0 HB1 ALA A 58 3.325 -3.543 -9.567 1.00 1.14 H new ATOM 0 HB2 ALA A 58 3.956 -3.436 -7.907 1.00 1.14 H new ATOM 0 HB3 ALA A 58 3.793 -5.023 -8.696 1.00 1.14 H new ATOM 849 N ALA A 59 1.077 -6.252 -9.029 1.00 0.90 N ATOM 850 CA ALA A 59 0.219 -7.020 -9.920 1.00 0.91 C ATOM 851 C ALA A 59 -1.241 -6.914 -9.484 1.00 0.78 C ATOM 852 O ALA A 59 -2.151 -6.874 -10.310 1.00 0.80 O ATOM 853 CB ALA A 59 0.647 -8.479 -9.908 1.00 0.96 C ATOM 0 H ALA A 59 1.695 -6.812 -8.442 1.00 0.90 H new ATOM 0 HA ALA A 59 0.314 -6.616 -10.928 1.00 0.91 H new ATOM 0 HB1 ALA A 59 0.004 -9.052 -10.575 1.00 0.96 H new ATOM 0 HB2 ALA A 59 1.681 -8.558 -10.244 1.00 0.96 H new ATOM 0 HB3 ALA A 59 0.564 -8.874 -8.896 1.00 0.96 H new ATOM 859 N ILE A 60 -1.471 -6.895 -8.171 1.00 0.69 N ATOM 860 CA ILE A 60 -2.815 -6.827 -7.610 1.00 0.61 C ATOM 861 C ILE A 60 -3.434 -5.510 -8.085 1.00 0.58 C ATOM 862 O ILE A 60 -4.514 -5.486 -8.679 1.00 0.58 O ATOM 863 CB ILE A 60 -2.760 -6.887 -6.069 1.00 0.56 C ATOM 864 CG1 ILE A 60 -1.796 -7.952 -5.512 1.00 0.65 C ATOM 865 CG2 ILE A 60 -4.097 -6.861 -5.323 1.00 0.40 C ATOM 866 CD1 ILE A 60 -2.433 -9.166 -4.867 1.00 0.65 C ATOM 0 H ILE A 60 -0.731 -6.926 -7.470 1.00 0.69 H new ATOM 0 HA ILE A 60 -3.418 -7.672 -7.941 1.00 0.61 H new ATOM 0 HB ILE A 60 -2.326 -5.914 -5.839 1.00 0.56 H new ATOM 0 HG12 ILE A 60 -1.157 -8.294 -6.326 1.00 0.65 H new ATOM 0 HG13 ILE A 60 -1.148 -7.475 -4.777 1.00 0.65 H new ATOM 0 HG21 ILE A 60 -3.916 -6.909 -4.249 1.00 0.40 H new ATOM 0 HG22 ILE A 60 -4.628 -5.939 -5.561 1.00 0.40 H new ATOM 0 HG23 ILE A 60 -4.700 -7.716 -5.627 1.00 0.40 H new ATOM 0 HD11 ILE A 60 -1.654 -9.842 -4.515 1.00 0.65 H new ATOM 0 HD12 ILE A 60 -3.048 -8.850 -4.024 1.00 0.65 H new ATOM 0 HD13 ILE A 60 -3.057 -9.681 -5.598 1.00 0.65 H new ATOM 878 N GLN A 61 -2.716 -4.409 -7.847 1.00 0.61 N ATOM 879 CA GLN A 61 -3.173 -3.092 -8.245 1.00 0.59 C ATOM 880 C GLN A 61 -3.251 -3.007 -9.775 1.00 0.62 C ATOM 881 O GLN A 61 -4.220 -2.465 -10.304 1.00 0.59 O ATOM 882 CB GLN A 61 -2.365 -1.998 -7.514 1.00 0.65 C ATOM 883 CG GLN A 61 -1.082 -1.504 -8.190 1.00 0.78 C ATOM 884 CD GLN A 61 -1.351 -0.536 -9.324 1.00 1.90 C ATOM 885 OE1 GLN A 61 -1.021 -0.812 -10.472 1.00 3.48 O ATOM 886 NE2 GLN A 61 -1.960 0.592 -9.001 1.00 1.75 N ATOM 0 H GLN A 61 -1.811 -4.413 -7.377 1.00 0.61 H new ATOM 0 HA GLN A 61 -4.197 -2.904 -7.921 1.00 0.59 H new ATOM 0 HB2 GLN A 61 -3.019 -1.139 -7.363 1.00 0.65 H new ATOM 0 HB3 GLN A 61 -2.102 -2.376 -6.526 1.00 0.65 H new ATOM 0 HG2 GLN A 61 -0.449 -1.019 -7.447 1.00 0.78 H new ATOM 0 HG3 GLN A 61 -0.526 -2.360 -8.573 1.00 0.78 H new ATOM 0 HE21 GLN A 61 -2.214 0.775 -8.030 1.00 1.75 H new ATOM 0 HE22 GLN A 61 -2.176 1.280 -9.723 1.00 1.75 H new ATOM 895 N GLU A 62 -2.302 -3.628 -10.493 1.00 0.72 N ATOM 896 CA GLU A 62 -2.343 -3.692 -11.949 1.00 0.78 C ATOM 897 C GLU A 62 -3.658 -4.335 -12.387 1.00 0.75 C ATOM 898 O GLU A 62 -4.262 -3.906 -13.364 1.00 0.77 O ATOM 899 CB GLU A 62 -1.142 -4.496 -12.470 1.00 0.92 C ATOM 900 CG GLU A 62 -1.039 -4.578 -13.997 1.00 1.04 C ATOM 901 CD GLU A 62 -0.309 -5.847 -14.412 1.00 1.64 C ATOM 902 OE1 GLU A 62 0.733 -6.156 -13.807 1.00 2.09 O ATOM 903 OE2 GLU A 62 -0.820 -6.475 -15.369 1.00 2.62 O ATOM 0 H GLU A 62 -1.495 -4.094 -10.078 1.00 0.72 H new ATOM 0 HA GLU A 62 -2.286 -2.686 -12.366 1.00 0.78 H new ATOM 0 HB2 GLU A 62 -0.227 -4.049 -12.081 1.00 0.92 H new ATOM 0 HB3 GLU A 62 -1.198 -5.508 -12.069 1.00 0.92 H new ATOM 0 HG2 GLU A 62 -2.036 -4.564 -14.436 1.00 1.04 H new ATOM 0 HG3 GLU A 62 -0.510 -3.705 -14.380 1.00 1.04 H new ATOM 910 N LYS A 63 -4.107 -5.375 -11.679 1.00 0.71 N ATOM 911 CA LYS A 63 -5.354 -6.044 -11.970 1.00 0.75 C ATOM 912 C LYS A 63 -6.513 -5.061 -11.850 1.00 0.64 C ATOM 913 O LYS A 63 -7.313 -4.950 -12.775 1.00 0.65 O ATOM 914 CB LYS A 63 -5.518 -7.263 -11.045 1.00 0.84 C ATOM 915 CG LYS A 63 -6.278 -8.394 -11.738 1.00 1.34 C ATOM 916 CD LYS A 63 -5.350 -9.410 -12.428 1.00 1.45 C ATOM 917 CE LYS A 63 -4.409 -8.767 -13.462 1.00 1.37 C ATOM 918 NZ LYS A 63 -3.490 -9.745 -14.077 1.00 2.18 N ATOM 0 H LYS A 63 -3.604 -5.770 -10.885 1.00 0.71 H new ATOM 0 HA LYS A 63 -5.350 -6.412 -12.996 1.00 0.75 H new ATOM 0 HB2 LYS A 63 -4.536 -7.620 -10.734 1.00 0.84 H new ATOM 0 HB3 LYS A 63 -6.050 -6.966 -10.141 1.00 0.84 H new ATOM 0 HG2 LYS A 63 -6.894 -8.913 -11.004 1.00 1.34 H new ATOM 0 HG3 LYS A 63 -6.956 -7.968 -12.478 1.00 1.34 H new ATOM 0 HD2 LYS A 63 -4.754 -9.920 -11.671 1.00 1.45 H new ATOM 0 HD3 LYS A 63 -5.956 -10.170 -12.921 1.00 1.45 H new ATOM 0 HE2 LYS A 63 -5.003 -8.291 -14.242 1.00 1.37 H new ATOM 0 HE3 LYS A 63 -3.828 -7.981 -12.980 1.00 1.37 H new ATOM 0 HZ1 LYS A 63 -2.878 -9.261 -14.765 1.00 2.18 H new ATOM 0 HZ2 LYS A 63 -2.902 -10.181 -13.338 1.00 2.18 H new ATOM 0 HZ3 LYS A 63 -4.041 -10.482 -14.561 1.00 2.18 H new ATOM 932 N ILE A 64 -6.597 -4.334 -10.733 1.00 0.55 N ATOM 933 CA ILE A 64 -7.627 -3.321 -10.541 1.00 0.51 C ATOM 934 C ILE A 64 -7.594 -2.321 -11.705 1.00 0.48 C ATOM 935 O ILE A 64 -8.634 -2.013 -12.289 1.00 0.53 O ATOM 936 CB ILE A 64 -7.455 -2.647 -9.165 1.00 0.45 C ATOM 937 CG1 ILE A 64 -7.641 -3.693 -8.046 1.00 0.50 C ATOM 938 CG2 ILE A 64 -8.471 -1.512 -8.999 1.00 0.46 C ATOM 939 CD1 ILE A 64 -7.328 -3.154 -6.646 1.00 0.58 C ATOM 0 H ILE A 64 -5.957 -4.433 -9.945 1.00 0.55 H new ATOM 0 HA ILE A 64 -8.614 -3.784 -10.544 1.00 0.51 H new ATOM 0 HB ILE A 64 -6.451 -2.227 -9.099 1.00 0.45 H new ATOM 0 HG12 ILE A 64 -8.669 -4.055 -8.066 1.00 0.50 H new ATOM 0 HG13 ILE A 64 -6.997 -4.549 -8.249 1.00 0.50 H new ATOM 0 HG21 ILE A 64 -8.338 -1.045 -8.023 1.00 0.46 H new ATOM 0 HG22 ILE A 64 -8.317 -0.769 -9.781 1.00 0.46 H new ATOM 0 HG23 ILE A 64 -9.481 -1.914 -9.074 1.00 0.46 H new ATOM 0 HD11 ILE A 64 -7.480 -3.943 -5.910 1.00 0.58 H new ATOM 0 HD12 ILE A 64 -6.292 -2.818 -6.609 1.00 0.58 H new ATOM 0 HD13 ILE A 64 -7.989 -2.317 -6.422 1.00 0.58 H new ATOM 951 N GLU A 65 -6.403 -1.838 -12.065 1.00 0.47 N ATOM 952 CA GLU A 65 -6.273 -0.871 -13.145 1.00 0.48 C ATOM 953 C GLU A 65 -6.739 -1.451 -14.483 1.00 0.55 C ATOM 954 O GLU A 65 -7.615 -0.888 -15.136 1.00 0.58 O ATOM 955 CB GLU A 65 -4.843 -0.328 -13.205 1.00 0.55 C ATOM 956 CG GLU A 65 -4.566 0.547 -11.970 1.00 0.57 C ATOM 957 CD GLU A 65 -3.285 1.364 -12.093 1.00 0.90 C ATOM 958 OE1 GLU A 65 -2.694 1.357 -13.195 1.00 1.71 O ATOM 959 OE2 GLU A 65 -2.928 1.990 -11.070 1.00 1.26 O ATOM 0 H GLU A 65 -5.522 -2.102 -11.624 1.00 0.47 H new ATOM 0 HA GLU A 65 -6.934 -0.030 -12.936 1.00 0.48 H new ATOM 0 HB2 GLU A 65 -4.132 -1.153 -13.244 1.00 0.55 H new ATOM 0 HB3 GLU A 65 -4.704 0.256 -14.115 1.00 0.55 H new ATOM 0 HG2 GLU A 65 -5.407 1.222 -11.814 1.00 0.57 H new ATOM 0 HG3 GLU A 65 -4.501 -0.090 -11.088 1.00 0.57 H new ATOM 966 N LYS A 66 -6.184 -2.595 -14.885 1.00 0.60 N ATOM 967 CA LYS A 66 -6.558 -3.287 -16.112 1.00 0.68 C ATOM 968 C LYS A 66 -8.051 -3.619 -16.148 1.00 0.69 C ATOM 969 O LYS A 66 -8.659 -3.598 -17.215 1.00 0.76 O ATOM 970 CB LYS A 66 -5.719 -4.554 -16.284 1.00 0.76 C ATOM 971 CG LYS A 66 -4.305 -4.215 -16.774 1.00 0.86 C ATOM 972 CD LYS A 66 -3.585 -5.522 -17.126 1.00 1.63 C ATOM 973 CE LYS A 66 -2.371 -5.323 -18.044 1.00 1.94 C ATOM 974 NZ LYS A 66 -1.214 -4.759 -17.326 1.00 2.17 N ATOM 0 H LYS A 66 -5.452 -3.071 -14.358 1.00 0.60 H new ATOM 0 HA LYS A 66 -6.357 -2.613 -16.945 1.00 0.68 H new ATOM 0 HB2 LYS A 66 -5.661 -5.087 -15.335 1.00 0.76 H new ATOM 0 HB3 LYS A 66 -6.204 -5.222 -16.996 1.00 0.76 H new ATOM 0 HG2 LYS A 66 -4.353 -3.562 -17.646 1.00 0.86 H new ATOM 0 HG3 LYS A 66 -3.756 -3.676 -16.002 1.00 0.86 H new ATOM 0 HD2 LYS A 66 -3.259 -6.008 -16.206 1.00 1.63 H new ATOM 0 HD3 LYS A 66 -4.290 -6.197 -17.610 1.00 1.63 H new ATOM 0 HE2 LYS A 66 -2.091 -6.280 -18.485 1.00 1.94 H new ATOM 0 HE3 LYS A 66 -2.644 -4.661 -18.866 1.00 1.94 H new ATOM 0 HZ1 LYS A 66 -0.556 -4.332 -18.009 1.00 2.17 H new ATOM 0 HZ2 LYS A 66 -1.541 -4.032 -16.658 1.00 2.17 H new ATOM 0 HZ3 LYS A 66 -0.727 -5.515 -16.803 1.00 2.17 H new ATOM 988 N LEU A 67 -8.652 -3.920 -14.995 1.00 0.63 N ATOM 989 CA LEU A 67 -10.082 -4.171 -14.887 1.00 0.64 C ATOM 990 C LEU A 67 -10.911 -2.893 -15.108 1.00 0.66 C ATOM 991 O LEU A 67 -12.135 -2.975 -15.181 1.00 0.78 O ATOM 992 CB LEU A 67 -10.375 -4.834 -13.534 1.00 0.58 C ATOM 993 CG LEU A 67 -10.119 -6.355 -13.433 1.00 0.60 C ATOM 994 CD1 LEU A 67 -11.457 -7.101 -13.444 1.00 1.73 C ATOM 995 CD2 LEU A 67 -9.205 -6.975 -14.502 1.00 2.18 C ATOM 0 H LEU A 67 -8.154 -3.996 -14.108 1.00 0.63 H new ATOM 0 HA LEU A 67 -10.384 -4.854 -15.681 1.00 0.64 H new ATOM 0 HB2 LEU A 67 -9.772 -4.337 -12.774 1.00 0.58 H new ATOM 0 HB3 LEU A 67 -11.419 -4.648 -13.284 1.00 0.58 H new ATOM 0 HG LEU A 67 -9.576 -6.469 -12.495 1.00 0.60 H new ATOM 0 HD11 LEU A 67 -11.276 -8.174 -13.373 1.00 1.73 H new ATOM 0 HD12 LEU A 67 -12.061 -6.778 -12.596 1.00 1.73 H new ATOM 0 HD13 LEU A 67 -11.987 -6.883 -14.371 1.00 1.73 H new ATOM 0 HD21 LEU A 67 -9.106 -8.045 -14.320 1.00 2.18 H new ATOM 0 HD22 LEU A 67 -9.638 -6.814 -15.489 1.00 2.18 H new ATOM 0 HD23 LEU A 67 -8.222 -6.507 -14.456 1.00 2.18 H new ATOM 1007 N GLY A 68 -10.269 -1.731 -15.264 1.00 0.62 N ATOM 1008 CA GLY A 68 -10.914 -0.493 -15.672 1.00 0.63 C ATOM 1009 C GLY A 68 -11.375 0.303 -14.458 1.00 0.58 C ATOM 1010 O GLY A 68 -12.459 0.881 -14.470 1.00 0.65 O ATOM 0 H GLY A 68 -9.267 -1.630 -15.105 1.00 0.62 H new ATOM 0 HA2 GLY A 68 -10.221 0.106 -16.263 1.00 0.63 H new ATOM 0 HA3 GLY A 68 -11.768 -0.716 -16.312 1.00 0.63 H new ATOM 1014 N TYR A 69 -10.542 0.337 -13.415 1.00 0.52 N ATOM 1015 CA TYR A 69 -10.809 1.051 -12.175 1.00 0.50 C ATOM 1016 C TYR A 69 -9.565 1.844 -11.765 1.00 0.43 C ATOM 1017 O TYR A 69 -8.542 1.786 -12.443 1.00 0.45 O ATOM 1018 CB TYR A 69 -11.234 0.046 -11.099 1.00 0.53 C ATOM 1019 CG TYR A 69 -12.391 -0.848 -11.507 1.00 0.56 C ATOM 1020 CD1 TYR A 69 -13.667 -0.296 -11.712 1.00 1.86 C ATOM 1021 CD2 TYR A 69 -12.186 -2.223 -11.721 1.00 1.68 C ATOM 1022 CE1 TYR A 69 -14.738 -1.113 -12.112 1.00 1.81 C ATOM 1023 CE2 TYR A 69 -13.274 -3.049 -12.054 1.00 1.83 C ATOM 1024 CZ TYR A 69 -14.531 -2.488 -12.309 1.00 0.84 C ATOM 1025 OH TYR A 69 -15.543 -3.299 -12.729 1.00 1.06 O ATOM 0 H TYR A 69 -9.643 -0.145 -13.415 1.00 0.52 H new ATOM 0 HA TYR A 69 -11.623 1.763 -12.309 1.00 0.50 H new ATOM 0 HB2 TYR A 69 -10.379 -0.579 -10.843 1.00 0.53 H new ATOM 0 HB3 TYR A 69 -11.511 0.592 -10.197 1.00 0.53 H new ATOM 0 HD1 TYR A 69 -13.825 0.762 -11.561 1.00 1.86 H new ATOM 0 HD2 TYR A 69 -11.195 -2.643 -11.630 1.00 1.68 H new ATOM 0 HE1 TYR A 69 -15.717 -0.685 -12.267 1.00 1.81 H new ATOM 0 HE2 TYR A 69 -13.140 -4.119 -12.113 1.00 1.83 H new ATOM 0 HH TYR A 69 -16.377 -3.037 -12.286 1.00 1.06 H new ATOM 1035 N HIS A 70 -9.658 2.607 -10.672 1.00 0.41 N ATOM 1036 CA HIS A 70 -8.537 3.336 -10.092 1.00 0.38 C ATOM 1037 C HIS A 70 -8.601 3.201 -8.574 1.00 0.34 C ATOM 1038 O HIS A 70 -9.688 3.132 -7.999 1.00 0.42 O ATOM 1039 CB HIS A 70 -8.576 4.815 -10.508 1.00 0.52 C ATOM 1040 CG HIS A 70 -7.693 5.133 -11.689 1.00 0.65 C ATOM 1041 ND1 HIS A 70 -8.112 5.501 -12.948 1.00 1.79 N ATOM 1042 CD2 HIS A 70 -6.325 5.218 -11.667 1.00 1.82 C ATOM 1043 CE1 HIS A 70 -7.015 5.800 -13.665 1.00 1.56 C ATOM 1044 NE2 HIS A 70 -5.905 5.652 -12.926 1.00 1.49 N ATOM 0 H HIS A 70 -10.531 2.735 -10.160 1.00 0.41 H new ATOM 0 HA HIS A 70 -7.600 2.917 -10.458 1.00 0.38 H new ATOM 0 HB2 HIS A 70 -9.603 5.089 -10.749 1.00 0.52 H new ATOM 0 HB3 HIS A 70 -8.272 5.430 -9.661 1.00 0.52 H new ATOM 0 HD2 HIS A 70 -5.686 4.990 -10.826 1.00 1.82 H new ATOM 0 HE1 HIS A 70 -7.026 6.117 -14.697 1.00 1.56 H new ATOM 0 HE2 HIS A 70 -4.945 5.823 -13.225 1.00 1.49 H new ATOM 1052 N VAL A 71 -7.430 3.162 -7.938 1.00 0.36 N ATOM 1053 CA VAL A 71 -7.271 3.040 -6.500 1.00 0.36 C ATOM 1054 C VAL A 71 -7.106 4.430 -5.887 1.00 0.40 C ATOM 1055 O VAL A 71 -6.456 5.296 -6.470 1.00 0.45 O ATOM 1056 CB VAL A 71 -6.098 2.092 -6.194 1.00 0.41 C ATOM 1057 CG1 VAL A 71 -6.442 0.666 -6.642 1.00 0.49 C ATOM 1058 CG2 VAL A 71 -4.771 2.517 -6.838 1.00 0.45 C ATOM 0 H VAL A 71 -6.539 3.217 -8.432 1.00 0.36 H new ATOM 0 HA VAL A 71 -8.158 2.600 -6.045 1.00 0.36 H new ATOM 0 HB VAL A 71 -5.953 2.136 -5.115 1.00 0.41 H new ATOM 0 HG11 VAL A 71 -5.605 0.003 -6.421 1.00 0.49 H new ATOM 0 HG12 VAL A 71 -7.328 0.321 -6.110 1.00 0.49 H new ATOM 0 HG13 VAL A 71 -6.637 0.659 -7.714 1.00 0.49 H new ATOM 0 HG21 VAL A 71 -3.993 1.800 -6.576 1.00 0.45 H new ATOM 0 HG22 VAL A 71 -4.886 2.548 -7.921 1.00 0.45 H new ATOM 0 HG23 VAL A 71 -4.490 3.505 -6.474 1.00 0.45 H new ATOM 1068 N VAL A 72 -7.674 4.650 -4.699 1.00 0.43 N ATOM 1069 CA VAL A 72 -7.683 5.957 -4.045 1.00 0.49 C ATOM 1070 C VAL A 72 -6.347 6.123 -3.307 1.00 0.54 C ATOM 1071 O VAL A 72 -6.311 6.306 -2.092 1.00 0.82 O ATOM 1072 CB VAL A 72 -8.910 6.031 -3.110 1.00 0.59 C ATOM 1073 CG1 VAL A 72 -9.112 7.420 -2.482 1.00 0.67 C ATOM 1074 CG2 VAL A 72 -10.221 5.676 -3.829 1.00 0.66 C ATOM 0 H VAL A 72 -8.143 3.921 -4.162 1.00 0.43 H new ATOM 0 HA VAL A 72 -7.774 6.778 -4.756 1.00 0.49 H new ATOM 0 HB VAL A 72 -8.688 5.300 -2.332 1.00 0.59 H new ATOM 0 HG11 VAL A 72 -9.990 7.403 -1.837 1.00 0.67 H new ATOM 0 HG12 VAL A 72 -8.234 7.684 -1.893 1.00 0.67 H new ATOM 0 HG13 VAL A 72 -9.255 8.159 -3.271 1.00 0.67 H new ATOM 0 HG21 VAL A 72 -11.051 5.744 -3.126 1.00 0.66 H new ATOM 0 HG22 VAL A 72 -10.385 6.372 -4.652 1.00 0.66 H new ATOM 0 HG23 VAL A 72 -10.158 4.660 -4.220 1.00 0.66 H new ATOM 1084 N THR A 73 -5.238 5.991 -4.042 1.00 0.51 N ATOM 1085 CA THR A 73 -3.901 5.819 -3.486 1.00 0.58 C ATOM 1086 C THR A 73 -2.958 6.839 -4.111 1.00 0.72 C ATOM 1087 O THR A 73 -3.008 7.042 -5.323 1.00 0.82 O ATOM 1088 CB THR A 73 -3.430 4.380 -3.735 1.00 0.59 C ATOM 1089 OG1 THR A 73 -4.501 3.485 -3.495 1.00 0.67 O ATOM 1090 CG2 THR A 73 -2.292 3.981 -2.804 1.00 0.81 C ATOM 0 H THR A 73 -5.250 6.002 -5.062 1.00 0.51 H new ATOM 0 HA THR A 73 -3.911 5.989 -2.409 1.00 0.58 H new ATOM 0 HB THR A 73 -3.084 4.332 -4.767 1.00 0.59 H new ATOM 0 HG1 THR A 73 -4.201 2.566 -3.655 1.00 0.67 H new ATOM 0 HG21 THR A 73 -1.991 2.955 -3.016 1.00 0.81 H new ATOM 0 HG22 THR A 73 -1.444 4.648 -2.960 1.00 0.81 H new ATOM 0 HG23 THR A 73 -2.626 4.055 -1.769 1.00 0.81 H new ATOM 1098 N GLU A 74 -2.129 7.488 -3.289 1.00 0.78 N ATOM 1099 CA GLU A 74 -1.359 8.655 -3.675 1.00 0.83 C ATOM 1100 C GLU A 74 0.090 8.510 -3.203 1.00 0.69 C ATOM 1101 O GLU A 74 0.346 8.032 -2.097 1.00 0.60 O ATOM 1102 CB GLU A 74 -2.022 9.912 -3.094 1.00 0.92 C ATOM 1103 CG GLU A 74 -3.488 10.029 -3.544 1.00 1.60 C ATOM 1104 CD GLU A 74 -4.124 11.328 -3.072 1.00 2.23 C ATOM 1105 OE1 GLU A 74 -3.845 12.359 -3.720 1.00 2.72 O ATOM 1106 OE2 GLU A 74 -4.880 11.264 -2.076 1.00 3.33 O ATOM 0 H GLU A 74 -1.977 7.205 -2.321 1.00 0.78 H new ATOM 0 HA GLU A 74 -1.341 8.747 -4.761 1.00 0.83 H new ATOM 0 HB2 GLU A 74 -1.975 9.881 -2.005 1.00 0.92 H new ATOM 0 HB3 GLU A 74 -1.470 10.797 -3.412 1.00 0.92 H new ATOM 0 HG2 GLU A 74 -3.540 9.974 -4.631 1.00 1.60 H new ATOM 0 HG3 GLU A 74 -4.056 9.184 -3.154 1.00 1.60 H new ATOM 1113 N LYS A 75 1.017 8.931 -4.069 1.00 0.73 N ATOM 1114 CA LYS A 75 2.457 8.948 -3.842 1.00 0.69 C ATOM 1115 C LYS A 75 2.860 10.212 -3.083 1.00 0.62 C ATOM 1116 O LYS A 75 3.173 11.239 -3.679 1.00 0.68 O ATOM 1117 CB LYS A 75 3.209 8.729 -5.164 1.00 0.84 C ATOM 1118 CG LYS A 75 3.059 9.830 -6.215 1.00 0.97 C ATOM 1119 CD LYS A 75 3.474 9.328 -7.605 1.00 1.18 C ATOM 1120 CE LYS A 75 4.932 8.837 -7.611 1.00 3.21 C ATOM 1121 NZ LYS A 75 5.366 8.411 -8.955 1.00 3.85 N ATOM 0 H LYS A 75 0.766 9.286 -4.992 1.00 0.73 H new ATOM 0 HA LYS A 75 2.747 8.116 -3.200 1.00 0.69 H new ATOM 0 HB2 LYS A 75 4.269 8.611 -4.940 1.00 0.84 H new ATOM 0 HB3 LYS A 75 2.869 7.790 -5.600 1.00 0.84 H new ATOM 0 HG2 LYS A 75 2.024 10.172 -6.243 1.00 0.97 H new ATOM 0 HG3 LYS A 75 3.671 10.688 -5.937 1.00 0.97 H new ATOM 0 HD2 LYS A 75 2.814 8.517 -7.913 1.00 1.18 H new ATOM 0 HD3 LYS A 75 3.355 10.130 -8.334 1.00 1.18 H new ATOM 0 HE2 LYS A 75 5.585 9.634 -7.255 1.00 3.21 H new ATOM 0 HE3 LYS A 75 5.037 8.005 -6.915 1.00 3.21 H new ATOM 0 HZ1 LYS A 75 6.354 8.088 -8.915 1.00 3.85 H new ATOM 0 HZ2 LYS A 75 4.760 7.633 -9.285 1.00 3.85 H new ATOM 0 HZ3 LYS A 75 5.291 9.212 -9.614 1.00 3.85 H new ATOM 1135 N ALA A 76 2.844 10.137 -1.753 1.00 0.59 N ATOM 1136 CA ALA A 76 3.234 11.268 -0.914 1.00 0.57 C ATOM 1137 C ALA A 76 4.741 11.221 -0.648 1.00 0.53 C ATOM 1138 O ALA A 76 5.250 10.172 -0.264 1.00 0.76 O ATOM 1139 CB ALA A 76 2.437 11.241 0.390 1.00 0.61 C ATOM 0 H ALA A 76 2.565 9.305 -1.234 1.00 0.59 H new ATOM 0 HA ALA A 76 3.011 12.203 -1.429 1.00 0.57 H new ATOM 0 HB1 ALA A 76 2.730 12.086 1.013 1.00 0.61 H new ATOM 0 HB2 ALA A 76 1.372 11.307 0.167 1.00 0.61 H new ATOM 0 HB3 ALA A 76 2.639 10.311 0.921 1.00 0.61 H new ATOM 1145 N GLU A 77 5.467 12.327 -0.840 1.00 0.61 N ATOM 1146 CA GLU A 77 6.889 12.394 -0.517 1.00 0.56 C ATOM 1147 C GLU A 77 7.079 12.904 0.910 1.00 0.45 C ATOM 1148 O GLU A 77 6.806 14.073 1.194 1.00 0.58 O ATOM 1149 CB GLU A 77 7.630 13.336 -1.471 1.00 0.65 C ATOM 1150 CG GLU A 77 7.849 12.758 -2.872 1.00 0.90 C ATOM 1151 CD GLU A 77 8.677 13.700 -3.741 1.00 1.50 C ATOM 1152 OE1 GLU A 77 9.217 14.681 -3.177 1.00 2.28 O ATOM 1153 OE2 GLU A 77 8.764 13.426 -4.954 1.00 2.33 O ATOM 0 H GLU A 77 5.086 13.193 -1.221 1.00 0.61 H new ATOM 0 HA GLU A 77 7.297 11.388 -0.618 1.00 0.56 H new ATOM 0 HB2 GLU A 77 7.068 14.266 -1.557 1.00 0.65 H new ATOM 0 HB3 GLU A 77 8.598 13.588 -1.038 1.00 0.65 H new ATOM 0 HG2 GLU A 77 8.353 11.795 -2.795 1.00 0.90 H new ATOM 0 HG3 GLU A 77 6.885 12.576 -3.347 1.00 0.90 H new ATOM 1160 N PHE A 78 7.600 12.050 1.791 1.00 0.37 N ATOM 1161 CA PHE A 78 7.950 12.408 3.156 1.00 0.36 C ATOM 1162 C PHE A 78 9.472 12.375 3.294 1.00 0.35 C ATOM 1163 O PHE A 78 10.145 11.569 2.660 1.00 0.51 O ATOM 1164 CB PHE A 78 7.202 11.489 4.134 1.00 0.51 C ATOM 1165 CG PHE A 78 5.678 11.607 4.137 1.00 0.62 C ATOM 1166 CD1 PHE A 78 5.014 12.747 3.632 1.00 2.05 C ATOM 1167 CD2 PHE A 78 4.909 10.563 4.684 1.00 1.55 C ATOM 1168 CE1 PHE A 78 3.613 12.808 3.602 1.00 2.20 C ATOM 1169 CE2 PHE A 78 3.504 10.631 4.665 1.00 1.63 C ATOM 1170 CZ PHE A 78 2.856 11.734 4.089 1.00 1.16 C ATOM 0 H PHE A 78 7.792 11.074 1.567 1.00 0.37 H new ATOM 0 HA PHE A 78 7.636 13.422 3.404 1.00 0.36 H new ATOM 0 HB2 PHE A 78 7.466 10.457 3.904 1.00 0.51 H new ATOM 0 HB3 PHE A 78 7.564 11.694 5.142 1.00 0.51 H new ATOM 0 HD1 PHE A 78 5.592 13.582 3.264 1.00 2.05 H new ATOM 0 HD2 PHE A 78 5.400 9.706 5.120 1.00 1.55 H new ATOM 0 HE1 PHE A 78 3.118 13.682 3.204 1.00 2.20 H new ATOM 0 HE2 PHE A 78 2.921 9.830 5.096 1.00 1.63 H new ATOM 0 HZ PHE A 78 1.778 11.755 4.021 1.00 1.16 H new ATOM 1180 N ASP A 79 10.014 13.312 4.065 1.00 0.35 N ATOM 1181 CA ASP A 79 11.437 13.503 4.304 1.00 0.36 C ATOM 1182 C ASP A 79 11.797 12.720 5.569 1.00 0.37 C ATOM 1183 O ASP A 79 10.911 12.512 6.395 1.00 0.45 O ATOM 1184 CB ASP A 79 11.656 15.011 4.459 1.00 0.42 C ATOM 1185 CG ASP A 79 13.091 15.369 4.790 1.00 0.59 C ATOM 1186 OD1 ASP A 79 13.460 15.172 5.965 1.00 1.38 O ATOM 1187 OD2 ASP A 79 13.763 15.876 3.868 1.00 1.53 O ATOM 0 H ASP A 79 9.442 13.993 4.565 1.00 0.35 H new ATOM 0 HA ASP A 79 12.072 13.141 3.495 1.00 0.36 H new ATOM 0 HB2 ASP A 79 11.366 15.512 3.535 1.00 0.42 H new ATOM 0 HB3 ASP A 79 11.002 15.389 5.245 1.00 0.42 H new ATOM 1192 N ILE A 80 13.018 12.193 5.712 1.00 0.38 N ATOM 1193 CA ILE A 80 13.329 11.305 6.829 1.00 0.42 C ATOM 1194 C ILE A 80 14.463 11.847 7.695 1.00 0.50 C ATOM 1195 O ILE A 80 15.555 12.117 7.199 1.00 0.58 O ATOM 1196 CB ILE A 80 13.698 9.930 6.282 1.00 0.43 C ATOM 1197 CG1 ILE A 80 12.768 9.538 5.132 1.00 0.38 C ATOM 1198 CG2 ILE A 80 13.706 8.891 7.415 1.00 0.55 C ATOM 1199 CD1 ILE A 80 13.211 8.206 4.580 1.00 0.50 C ATOM 0 H ILE A 80 13.796 12.365 5.075 1.00 0.38 H new ATOM 0 HA ILE A 80 12.446 11.235 7.465 1.00 0.42 H new ATOM 0 HB ILE A 80 14.707 9.966 5.871 1.00 0.43 H new ATOM 0 HG12 ILE A 80 11.738 9.477 5.484 1.00 0.38 H new ATOM 0 HG13 ILE A 80 12.793 10.298 4.351 1.00 0.38 H new ATOM 0 HG21 ILE A 80 13.971 7.914 7.011 1.00 0.55 H new ATOM 0 HG22 ILE A 80 14.437 9.182 8.170 1.00 0.55 H new ATOM 0 HG23 ILE A 80 12.716 8.840 7.869 1.00 0.55 H new ATOM 0 HD11 ILE A 80 12.555 7.916 3.759 1.00 0.50 H new ATOM 0 HD12 ILE A 80 14.235 8.286 4.215 1.00 0.50 H new ATOM 0 HD13 ILE A 80 13.163 7.452 5.366 1.00 0.50 H new ATOM 1211 N GLU A 81 14.229 11.898 9.009 1.00 0.63 N ATOM 1212 CA GLU A 81 15.214 12.298 9.996 1.00 0.85 C ATOM 1213 C GLU A 81 15.570 11.077 10.844 1.00 1.00 C ATOM 1214 O GLU A 81 14.831 10.717 11.765 1.00 1.58 O ATOM 1215 CB GLU A 81 14.612 13.410 10.854 1.00 1.14 C ATOM 1216 CG GLU A 81 14.234 14.637 10.015 1.00 1.55 C ATOM 1217 CD GLU A 81 13.557 15.725 10.851 1.00 1.87 C ATOM 1218 OE1 GLU A 81 13.123 15.394 11.977 1.00 2.41 O ATOM 1219 OE2 GLU A 81 13.471 16.870 10.355 1.00 2.49 O ATOM 0 H GLU A 81 13.326 11.655 9.417 1.00 0.63 H new ATOM 0 HA GLU A 81 16.122 12.673 9.525 1.00 0.85 H new ATOM 0 HB2 GLU A 81 13.727 13.034 11.367 1.00 1.14 H new ATOM 0 HB3 GLU A 81 15.326 13.702 11.624 1.00 1.14 H new ATOM 0 HG2 GLU A 81 15.130 15.045 9.548 1.00 1.55 H new ATOM 0 HG3 GLU A 81 13.566 14.332 9.210 1.00 1.55 H new ATOM 1226 N GLY A 82 16.702 10.433 10.544 1.00 0.86 N ATOM 1227 CA GLY A 82 17.184 9.323 11.352 1.00 1.05 C ATOM 1228 C GLY A 82 18.337 8.579 10.693 1.00 0.99 C ATOM 1229 O GLY A 82 19.391 8.402 11.298 1.00 1.45 O ATOM 0 H GLY A 82 17.296 10.665 9.748 1.00 0.86 H new ATOM 0 HA2 GLY A 82 17.506 9.698 12.323 1.00 1.05 H new ATOM 0 HA3 GLY A 82 16.364 8.628 11.534 1.00 1.05 H new ATOM 1233 N MET A 83 18.123 8.101 9.466 1.00 0.79 N ATOM 1234 CA MET A 83 19.137 7.348 8.741 1.00 0.90 C ATOM 1235 C MET A 83 20.416 8.168 8.533 1.00 1.09 C ATOM 1236 O MET A 83 20.386 9.235 7.926 1.00 1.74 O ATOM 1237 CB MET A 83 18.580 6.751 7.431 1.00 1.17 C ATOM 1238 CG MET A 83 18.372 7.743 6.283 1.00 1.20 C ATOM 1239 SD MET A 83 17.118 9.000 6.595 1.00 2.60 S ATOM 1240 CE MET A 83 17.355 9.997 5.128 1.00 3.24 C ATOM 0 H MET A 83 17.249 8.225 8.954 1.00 0.79 H new ATOM 0 HA MET A 83 19.422 6.499 9.362 1.00 0.90 H new ATOM 0 HB2 MET A 83 19.260 5.969 7.092 1.00 1.17 H new ATOM 0 HB3 MET A 83 17.626 6.271 7.649 1.00 1.17 H new ATOM 0 HG2 MET A 83 19.320 8.239 6.072 1.00 1.20 H new ATOM 0 HG3 MET A 83 18.096 7.188 5.386 1.00 1.20 H new ATOM 0 HE1 MET A 83 16.496 10.654 4.992 1.00 3.24 H new ATOM 0 HE2 MET A 83 18.257 10.598 5.239 1.00 3.24 H new ATOM 0 HE3 MET A 83 17.456 9.347 4.259 1.00 3.24 H new ATOM 1250 N THR A 84 21.541 7.656 9.034 1.00 1.51 N ATOM 1251 CA THR A 84 22.862 8.235 8.828 1.00 1.81 C ATOM 1252 C THR A 84 23.896 7.152 8.487 1.00 1.51 C ATOM 1253 O THR A 84 25.089 7.449 8.446 1.00 2.09 O ATOM 1254 CB THR A 84 23.259 9.021 10.087 1.00 2.77 C ATOM 1255 OG1 THR A 84 23.050 8.206 11.225 1.00 3.61 O ATOM 1256 CG2 THR A 84 22.423 10.299 10.231 1.00 3.90 C ATOM 0 H THR A 84 21.556 6.811 9.605 1.00 1.51 H new ATOM 0 HA THR A 84 22.833 8.916 7.977 1.00 1.81 H new ATOM 0 HB THR A 84 24.309 9.302 10.000 1.00 2.77 H new ATOM 0 HG1 THR A 84 23.303 8.700 12.032 1.00 3.61 H new ATOM 0 HG21 THR A 84 22.727 10.833 11.131 1.00 3.90 H new ATOM 0 HG22 THR A 84 22.579 10.936 9.360 1.00 3.90 H new ATOM 0 HG23 THR A 84 21.367 10.037 10.304 1.00 3.90 H new ATOM 1264 N CYS A 85 23.455 5.912 8.220 1.00 1.34 N ATOM 1265 CA CYS A 85 24.340 4.823 7.808 1.00 2.12 C ATOM 1266 C CYS A 85 23.803 4.243 6.501 1.00 2.43 C ATOM 1267 O CYS A 85 23.907 4.892 5.466 1.00 3.70 O ATOM 1268 CB CYS A 85 24.504 3.781 8.933 1.00 3.27 C ATOM 1269 SG CYS A 85 25.869 4.234 10.031 1.00 4.41 S ATOM 0 H CYS A 85 22.474 5.642 8.285 1.00 1.34 H new ATOM 0 HA CYS A 85 25.349 5.192 7.623 1.00 2.12 H new ATOM 0 HB2 CYS A 85 23.579 3.708 9.505 1.00 3.27 H new ATOM 0 HB3 CYS A 85 24.690 2.798 8.501 1.00 3.27 H new ATOM 0 HG CYS A 85 25.985 3.343 10.970 1.00 4.41 H new ATOM 1275 N ALA A 86 23.215 3.042 6.532 1.00 2.34 N ATOM 1276 CA ALA A 86 22.756 2.331 5.343 1.00 3.24 C ATOM 1277 C ALA A 86 21.841 1.186 5.777 1.00 2.16 C ATOM 1278 O ALA A 86 21.973 0.057 5.308 1.00 2.77 O ATOM 1279 CB ALA A 86 23.968 1.815 4.554 1.00 5.05 C ATOM 0 H ALA A 86 23.044 2.533 7.399 1.00 2.34 H new ATOM 0 HA ALA A 86 22.192 2.998 4.691 1.00 3.24 H new ATOM 0 HB1 ALA A 86 23.625 1.284 3.666 1.00 5.05 H new ATOM 0 HB2 ALA A 86 24.593 2.657 4.255 1.00 5.05 H new ATOM 0 HB3 ALA A 86 24.548 1.137 5.180 1.00 5.05 H new ATOM 1285 N ALA A 87 20.944 1.473 6.728 1.00 1.18 N ATOM 1286 CA ALA A 87 20.155 0.456 7.409 1.00 1.01 C ATOM 1287 C ALA A 87 18.802 0.999 7.856 1.00 0.86 C ATOM 1288 O ALA A 87 17.777 0.369 7.601 1.00 0.80 O ATOM 1289 CB ALA A 87 20.943 -0.099 8.600 1.00 2.12 C ATOM 0 H ALA A 87 20.749 2.423 7.043 1.00 1.18 H new ATOM 0 HA ALA A 87 19.958 -0.352 6.705 1.00 1.01 H new ATOM 0 HB1 ALA A 87 20.349 -0.860 9.107 1.00 2.12 H new ATOM 0 HB2 ALA A 87 21.874 -0.542 8.246 1.00 2.12 H new ATOM 0 HB3 ALA A 87 21.168 0.709 9.296 1.00 2.12 H new ATOM 1295 N CYS A 88 18.771 2.165 8.511 1.00 0.87 N ATOM 1296 CA CYS A 88 17.543 2.697 9.092 1.00 0.78 C ATOM 1297 C CYS A 88 16.475 2.840 8.009 1.00 0.72 C ATOM 1298 O CYS A 88 15.339 2.408 8.194 1.00 0.73 O ATOM 1299 CB CYS A 88 17.814 4.045 9.759 1.00 0.77 C ATOM 1300 SG CYS A 88 19.065 3.903 11.056 1.00 0.89 S ATOM 0 H CYS A 88 19.589 2.758 8.650 1.00 0.87 H new ATOM 0 HA CYS A 88 17.180 2.005 9.852 1.00 0.78 H new ATOM 0 HB2 CYS A 88 18.146 4.763 9.009 1.00 0.77 H new ATOM 0 HB3 CYS A 88 16.889 4.434 10.185 1.00 0.77 H new ATOM 0 HG CYS A 88 18.496 4.005 12.221 1.00 0.89 H new ATOM 1306 N ALA A 89 16.865 3.398 6.855 1.00 0.71 N ATOM 1307 CA ALA A 89 15.996 3.521 5.688 1.00 0.70 C ATOM 1308 C ALA A 89 15.484 2.151 5.232 1.00 0.73 C ATOM 1309 O ALA A 89 14.339 2.014 4.815 1.00 0.66 O ATOM 1310 CB ALA A 89 16.754 4.192 4.543 1.00 0.77 C ATOM 0 H ALA A 89 17.800 3.778 6.709 1.00 0.71 H new ATOM 0 HA ALA A 89 15.138 4.132 5.969 1.00 0.70 H new ATOM 0 HB1 ALA A 89 16.100 4.280 3.676 1.00 0.77 H new ATOM 0 HB2 ALA A 89 17.080 5.184 4.855 1.00 0.77 H new ATOM 0 HB3 ALA A 89 17.624 3.590 4.281 1.00 0.77 H new ATOM 1316 N ASN A 90 16.324 1.121 5.314 1.00 0.88 N ATOM 1317 CA ASN A 90 15.936 -0.215 4.881 1.00 0.94 C ATOM 1318 C ASN A 90 14.894 -0.758 5.860 1.00 0.93 C ATOM 1319 O ASN A 90 13.894 -1.355 5.470 1.00 0.99 O ATOM 1320 CB ASN A 90 17.151 -1.152 4.778 1.00 1.07 C ATOM 1321 CG ASN A 90 18.297 -0.591 3.934 1.00 1.40 C ATOM 1322 OD1 ASN A 90 18.139 0.371 3.190 1.00 2.02 O ATOM 1323 ND2 ASN A 90 19.487 -1.165 4.078 1.00 2.02 N ATOM 0 H ASN A 90 17.275 1.188 5.676 1.00 0.88 H new ATOM 0 HA ASN A 90 15.505 -0.161 3.881 1.00 0.94 H new ATOM 0 HB2 ASN A 90 17.521 -1.363 5.781 1.00 1.07 H new ATOM 0 HB3 ASN A 90 16.830 -2.102 4.351 1.00 1.07 H new ATOM 0 HD21 ASN A 90 20.292 -0.806 3.564 1.00 2.02 H new ATOM 0 HD22 ASN A 90 19.596 -1.964 4.702 1.00 2.02 H new ATOM 1330 N ARG A 91 15.120 -0.534 7.157 1.00 0.92 N ATOM 1331 CA ARG A 91 14.194 -0.949 8.198 1.00 0.96 C ATOM 1332 C ARG A 91 12.840 -0.247 8.054 1.00 0.95 C ATOM 1333 O ARG A 91 11.802 -0.910 8.054 1.00 1.04 O ATOM 1334 CB ARG A 91 14.821 -0.731 9.585 1.00 0.97 C ATOM 1335 CG ARG A 91 15.225 -2.072 10.209 1.00 1.24 C ATOM 1336 CD ARG A 91 13.988 -2.838 10.704 1.00 2.33 C ATOM 1337 NE ARG A 91 14.277 -4.272 10.865 1.00 2.78 N ATOM 1338 CZ ARG A 91 13.373 -5.191 11.241 1.00 4.03 C ATOM 1339 NH1 ARG A 91 12.140 -4.806 11.585 1.00 5.14 N ATOM 1340 NH2 ARG A 91 13.704 -6.487 11.265 1.00 4.64 N ATOM 0 H ARG A 91 15.952 -0.059 7.508 1.00 0.92 H new ATOM 0 HA ARG A 91 14.000 -2.016 8.087 1.00 0.96 H new ATOM 0 HB2 ARG A 91 15.695 -0.086 9.498 1.00 0.97 H new ATOM 0 HB3 ARG A 91 14.111 -0.220 10.235 1.00 0.97 H new ATOM 0 HG2 ARG A 91 15.761 -2.673 9.475 1.00 1.24 H new ATOM 0 HG3 ARG A 91 15.909 -1.900 11.040 1.00 1.24 H new ATOM 0 HD2 ARG A 91 13.657 -2.422 11.656 1.00 2.33 H new ATOM 0 HD3 ARG A 91 13.169 -2.707 9.997 1.00 2.33 H new ATOM 0 HE ARG A 91 15.228 -4.589 10.678 1.00 2.78 H new ATOM 0 HH11 ARG A 91 11.889 -3.818 11.561 1.00 5.14 H new ATOM 0 HH12 ARG A 91 11.450 -5.501 11.871 1.00 5.14 H new ATOM 0 HH21 ARG A 91 14.644 -6.778 10.997 1.00 4.64 H new ATOM 0 HH22 ARG A 91 13.016 -7.184 11.551 1.00 4.64 H new ATOM 1354 N ILE A 92 12.837 1.084 7.943 1.00 0.87 N ATOM 1355 CA ILE A 92 11.598 1.825 7.723 1.00 0.81 C ATOM 1356 C ILE A 92 10.929 1.386 6.413 1.00 0.80 C ATOM 1357 O ILE A 92 9.720 1.183 6.415 1.00 0.83 O ATOM 1358 CB ILE A 92 11.771 3.355 7.877 1.00 0.79 C ATOM 1359 CG1 ILE A 92 12.818 3.973 6.961 1.00 1.11 C ATOM 1360 CG2 ILE A 92 12.090 3.726 9.331 1.00 2.03 C ATOM 1361 CD1 ILE A 92 12.199 4.680 5.753 1.00 1.59 C ATOM 0 H ILE A 92 13.673 1.665 8.002 1.00 0.87 H new ATOM 0 HA ILE A 92 10.903 1.566 8.522 1.00 0.81 H new ATOM 0 HB ILE A 92 10.811 3.773 7.575 1.00 0.79 H new ATOM 0 HG12 ILE A 92 13.416 4.687 7.528 1.00 1.11 H new ATOM 0 HG13 ILE A 92 13.496 3.194 6.613 1.00 1.11 H new ATOM 0 HG21 ILE A 92 12.207 4.807 9.413 1.00 2.03 H new ATOM 0 HG22 ILE A 92 11.275 3.399 9.977 1.00 2.03 H new ATOM 0 HG23 ILE A 92 13.015 3.237 9.637 1.00 2.03 H new ATOM 0 HD11 ILE A 92 12.990 5.102 5.134 1.00 1.59 H new ATOM 0 HD12 ILE A 92 11.623 3.963 5.167 1.00 1.59 H new ATOM 0 HD13 ILE A 92 11.542 5.479 6.096 1.00 1.59 H new ATOM 1373 N GLU A 93 11.686 1.153 5.331 1.00 0.80 N ATOM 1374 CA GLU A 93 11.173 0.659 4.066 1.00 0.84 C ATOM 1375 C GLU A 93 10.411 -0.625 4.330 1.00 0.89 C ATOM 1376 O GLU A 93 9.215 -0.687 4.077 1.00 0.91 O ATOM 1377 CB GLU A 93 12.324 0.435 3.073 1.00 0.87 C ATOM 1378 CG GLU A 93 11.829 0.022 1.685 1.00 0.92 C ATOM 1379 CD GLU A 93 11.442 -1.449 1.563 1.00 1.91 C ATOM 1380 OE1 GLU A 93 12.169 -2.284 2.144 1.00 2.57 O ATOM 1381 OE2 GLU A 93 10.422 -1.718 0.894 1.00 3.07 O ATOM 0 H GLU A 93 12.694 1.310 5.321 1.00 0.80 H new ATOM 0 HA GLU A 93 10.500 1.391 3.618 1.00 0.84 H new ATOM 0 HB2 GLU A 93 12.910 1.350 2.989 1.00 0.87 H new ATOM 0 HB3 GLU A 93 12.990 -0.335 3.462 1.00 0.87 H new ATOM 0 HG2 GLU A 93 10.966 0.635 1.424 1.00 0.92 H new ATOM 0 HG3 GLU A 93 12.608 0.241 0.955 1.00 0.92 H new ATOM 1388 N LYS A 94 11.082 -1.627 4.901 1.00 0.97 N ATOM 1389 CA LYS A 94 10.471 -2.922 5.135 1.00 1.03 C ATOM 1390 C LYS A 94 9.175 -2.809 5.938 1.00 0.94 C ATOM 1391 O LYS A 94 8.311 -3.673 5.795 1.00 0.99 O ATOM 1392 CB LYS A 94 11.465 -3.874 5.813 1.00 1.16 C ATOM 1393 CG LYS A 94 12.553 -4.360 4.846 1.00 1.34 C ATOM 1394 CD LYS A 94 11.969 -5.227 3.715 1.00 1.83 C ATOM 1395 CE LYS A 94 12.824 -6.463 3.412 1.00 2.40 C ATOM 1396 NZ LYS A 94 12.669 -7.505 4.449 1.00 4.46 N ATOM 0 H LYS A 94 12.052 -1.559 5.208 1.00 0.97 H new ATOM 0 HA LYS A 94 10.204 -3.339 4.164 1.00 1.03 H new ATOM 0 HB2 LYS A 94 11.932 -3.368 6.658 1.00 1.16 H new ATOM 0 HB3 LYS A 94 10.927 -4.733 6.214 1.00 1.16 H new ATOM 0 HG2 LYS A 94 13.067 -3.500 4.416 1.00 1.34 H new ATOM 0 HG3 LYS A 94 13.298 -4.935 5.396 1.00 1.34 H new ATOM 0 HD2 LYS A 94 10.963 -5.545 3.990 1.00 1.83 H new ATOM 0 HD3 LYS A 94 11.877 -4.624 2.812 1.00 1.83 H new ATOM 0 HE2 LYS A 94 12.542 -6.871 2.441 1.00 2.40 H new ATOM 0 HE3 LYS A 94 13.872 -6.172 3.343 1.00 2.40 H new ATOM 0 HZ1 LYS A 94 13.262 -8.325 4.209 1.00 4.46 H new ATOM 0 HZ2 LYS A 94 12.962 -7.123 5.371 1.00 4.46 H new ATOM 0 HZ3 LYS A 94 11.673 -7.801 4.498 1.00 4.46 H new ATOM 1410 N ARG A 95 9.023 -1.776 6.777 1.00 0.84 N ATOM 1411 CA ARG A 95 7.691 -1.493 7.310 1.00 0.68 C ATOM 1412 C ARG A 95 6.795 -0.868 6.246 1.00 0.47 C ATOM 1413 O ARG A 95 5.829 -1.488 5.796 1.00 0.44 O ATOM 1414 CB ARG A 95 7.750 -0.613 8.563 1.00 0.87 C ATOM 1415 CG ARG A 95 7.997 -1.456 9.820 1.00 1.29 C ATOM 1416 CD ARG A 95 6.999 -1.027 10.908 1.00 2.29 C ATOM 1417 NE ARG A 95 7.204 -1.751 12.173 1.00 2.92 N ATOM 1418 CZ ARG A 95 6.794 -3.006 12.420 1.00 2.86 C ATOM 1419 NH1 ARG A 95 6.201 -3.715 11.454 1.00 2.84 N ATOM 1420 NH2 ARG A 95 6.986 -3.545 13.630 1.00 3.75 N ATOM 0 H ARG A 95 9.767 -1.152 7.088 1.00 0.84 H new ATOM 0 HA ARG A 95 7.254 -2.447 7.605 1.00 0.68 H new ATOM 0 HB2 ARG A 95 8.544 0.126 8.455 1.00 0.87 H new ATOM 0 HB3 ARG A 95 6.815 -0.063 8.669 1.00 0.87 H new ATOM 0 HG2 ARG A 95 7.876 -2.515 9.594 1.00 1.29 H new ATOM 0 HG3 ARG A 95 9.020 -1.320 10.171 1.00 1.29 H new ATOM 0 HD2 ARG A 95 7.097 0.044 11.085 1.00 2.29 H new ATOM 0 HD3 ARG A 95 5.983 -1.200 10.554 1.00 2.29 H new ATOM 0 HE ARG A 95 7.696 -1.261 12.921 1.00 2.92 H new ATOM 0 HH11 ARG A 95 6.061 -3.303 10.532 1.00 2.84 H new ATOM 0 HH12 ARG A 95 5.889 -4.668 11.639 1.00 2.84 H new ATOM 0 HH21 ARG A 95 7.443 -3.003 14.363 1.00 3.75 H new ATOM 0 HH22 ARG A 95 6.675 -4.498 13.819 1.00 3.75 H new ATOM 1434 N LEU A 96 7.103 0.385 5.904 1.00 0.43 N ATOM 1435 CA LEU A 96 6.295 1.238 5.043 1.00 0.36 C ATOM 1436 C LEU A 96 5.759 0.473 3.829 1.00 0.40 C ATOM 1437 O LEU A 96 4.573 0.569 3.535 1.00 0.42 O ATOM 1438 CB LEU A 96 7.071 2.498 4.652 1.00 0.39 C ATOM 1439 CG LEU A 96 7.369 3.448 5.833 1.00 0.47 C ATOM 1440 CD1 LEU A 96 7.860 4.768 5.252 1.00 0.82 C ATOM 1441 CD2 LEU A 96 6.148 3.733 6.706 1.00 1.44 C ATOM 0 H LEU A 96 7.952 0.845 6.232 1.00 0.43 H new ATOM 0 HA LEU A 96 5.419 1.560 5.606 1.00 0.36 H new ATOM 0 HB2 LEU A 96 8.013 2.203 4.191 1.00 0.39 H new ATOM 0 HB3 LEU A 96 6.503 3.042 3.897 1.00 0.39 H new ATOM 0 HG LEU A 96 8.110 2.963 6.469 1.00 0.47 H new ATOM 0 HD11 LEU A 96 8.080 5.463 6.062 1.00 0.82 H new ATOM 0 HD12 LEU A 96 8.764 4.595 4.668 1.00 0.82 H new ATOM 0 HD13 LEU A 96 7.088 5.192 4.610 1.00 0.82 H new ATOM 0 HD21 LEU A 96 6.429 4.406 7.516 1.00 1.44 H new ATOM 0 HD22 LEU A 96 5.369 4.197 6.101 1.00 1.44 H new ATOM 0 HD23 LEU A 96 5.774 2.799 7.125 1.00 1.44 H new ATOM 1453 N ASN A 97 6.615 -0.336 3.193 1.00 0.47 N ATOM 1454 CA ASN A 97 6.332 -1.279 2.111 1.00 0.59 C ATOM 1455 C ASN A 97 4.910 -1.837 2.160 1.00 0.60 C ATOM 1456 O ASN A 97 4.218 -1.855 1.145 1.00 0.63 O ATOM 1457 CB ASN A 97 7.337 -2.435 2.193 1.00 0.76 C ATOM 1458 CG ASN A 97 7.306 -3.318 0.953 1.00 1.04 C ATOM 1459 OD1 ASN A 97 6.395 -4.121 0.771 1.00 1.53 O ATOM 1460 ND2 ASN A 97 8.323 -3.192 0.105 1.00 1.26 N ATOM 0 H ASN A 97 7.603 -0.347 3.445 1.00 0.47 H new ATOM 0 HA ASN A 97 6.425 -0.738 1.169 1.00 0.59 H new ATOM 0 HB2 ASN A 97 8.341 -2.032 2.324 1.00 0.76 H new ATOM 0 HB3 ASN A 97 7.120 -3.041 3.073 1.00 0.76 H new ATOM 0 HD21 ASN A 97 8.365 -3.774 -0.731 1.00 1.26 H new ATOM 0 HD22 ASN A 97 9.061 -2.513 0.291 1.00 1.26 H new ATOM 1467 N LYS A 98 4.478 -2.281 3.344 1.00 0.58 N ATOM 1468 CA LYS A 98 3.083 -2.600 3.603 1.00 0.55 C ATOM 1469 C LYS A 98 2.819 -2.584 5.103 1.00 0.58 C ATOM 1470 O LYS A 98 2.733 -3.647 5.710 1.00 0.70 O ATOM 1471 CB LYS A 98 2.661 -3.948 2.986 1.00 0.63 C ATOM 1472 CG LYS A 98 3.566 -5.122 3.401 1.00 0.82 C ATOM 1473 CD LYS A 98 2.784 -6.379 3.841 1.00 2.35 C ATOM 1474 CE LYS A 98 2.191 -6.406 5.271 1.00 3.78 C ATOM 1475 NZ LYS A 98 0.945 -5.615 5.444 1.00 5.54 N ATOM 0 H LYS A 98 5.091 -2.427 4.146 1.00 0.58 H new ATOM 0 HA LYS A 98 2.475 -1.835 3.121 1.00 0.55 H new ATOM 0 HB2 LYS A 98 1.635 -4.168 3.281 1.00 0.63 H new ATOM 0 HB3 LYS A 98 2.669 -3.860 1.900 1.00 0.63 H new ATOM 0 HG2 LYS A 98 4.216 -5.382 2.565 1.00 0.82 H new ATOM 0 HG3 LYS A 98 4.212 -4.801 4.219 1.00 0.82 H new ATOM 0 HD2 LYS A 98 1.964 -6.525 3.137 1.00 2.35 H new ATOM 0 HD3 LYS A 98 3.448 -7.237 3.739 1.00 2.35 H new ATOM 0 HE2 LYS A 98 1.989 -7.441 5.546 1.00 3.78 H new ATOM 0 HE3 LYS A 98 2.942 -6.032 5.968 1.00 3.78 H new ATOM 0 HZ1 LYS A 98 0.431 -5.955 6.282 1.00 5.54 H new ATOM 0 HZ2 LYS A 98 1.186 -4.611 5.570 1.00 5.54 H new ATOM 0 HZ3 LYS A 98 0.345 -5.724 4.602 1.00 5.54 H new ATOM 1489 N ILE A 99 2.603 -1.418 5.709 1.00 0.56 N ATOM 1490 CA ILE A 99 1.940 -1.419 7.010 1.00 0.67 C ATOM 1491 C ILE A 99 0.536 -1.984 6.776 1.00 0.77 C ATOM 1492 O ILE A 99 0.328 -3.194 6.907 1.00 1.34 O ATOM 1493 CB ILE A 99 2.011 -0.027 7.668 1.00 0.77 C ATOM 1494 CG1 ILE A 99 3.485 0.231 8.035 1.00 0.87 C ATOM 1495 CG2 ILE A 99 1.141 0.033 8.936 1.00 1.00 C ATOM 1496 CD1 ILE A 99 3.755 1.655 8.511 1.00 1.61 C ATOM 0 H ILE A 99 2.863 -0.502 5.342 1.00 0.56 H new ATOM 0 HA ILE A 99 2.435 -2.055 7.744 1.00 0.67 H new ATOM 0 HB ILE A 99 1.636 0.729 6.978 1.00 0.77 H new ATOM 0 HG12 ILE A 99 3.784 -0.467 8.817 1.00 0.87 H new ATOM 0 HG13 ILE A 99 4.109 0.023 7.166 1.00 0.87 H new ATOM 0 HG21 ILE A 99 1.211 1.027 9.379 1.00 1.00 H new ATOM 0 HG22 ILE A 99 0.103 -0.176 8.676 1.00 1.00 H new ATOM 0 HG23 ILE A 99 1.492 -0.709 9.653 1.00 1.00 H new ATOM 0 HD11 ILE A 99 4.813 1.764 8.752 1.00 1.61 H new ATOM 0 HD12 ILE A 99 3.488 2.359 7.723 1.00 1.61 H new ATOM 0 HD13 ILE A 99 3.158 1.861 9.399 1.00 1.61 H new ATOM 1508 N GLU A 100 -0.383 -1.133 6.320 1.00 0.57 N ATOM 1509 CA GLU A 100 -1.700 -1.540 5.865 1.00 0.63 C ATOM 1510 C GLU A 100 -1.872 -1.084 4.422 1.00 0.65 C ATOM 1511 O GLU A 100 -1.309 -1.702 3.520 1.00 1.00 O ATOM 1512 CB GLU A 100 -2.771 -1.005 6.830 1.00 0.78 C ATOM 1513 CG GLU A 100 -2.983 -1.984 7.991 1.00 1.03 C ATOM 1514 CD GLU A 100 -3.689 -3.270 7.560 1.00 2.85 C ATOM 1515 OE1 GLU A 100 -4.030 -3.376 6.359 1.00 4.03 O ATOM 1516 OE2 GLU A 100 -3.871 -4.131 8.447 1.00 3.53 O ATOM 0 H GLU A 100 -0.225 -0.127 6.258 1.00 0.57 H new ATOM 0 HA GLU A 100 -1.814 -2.624 5.872 1.00 0.63 H new ATOM 0 HB2 GLU A 100 -2.467 -0.032 7.217 1.00 0.78 H new ATOM 0 HB3 GLU A 100 -3.709 -0.856 6.296 1.00 0.78 H new ATOM 0 HG2 GLU A 100 -2.017 -2.235 8.430 1.00 1.03 H new ATOM 0 HG3 GLU A 100 -3.570 -1.496 8.769 1.00 1.03 H new ATOM 1523 N GLY A 101 -2.604 0.007 4.186 1.00 0.55 N ATOM 1524 CA GLY A 101 -3.028 0.409 2.855 1.00 0.59 C ATOM 1525 C GLY A 101 -1.949 1.172 2.108 1.00 0.58 C ATOM 1526 O GLY A 101 -2.205 2.257 1.589 1.00 0.72 O ATOM 0 H GLY A 101 -2.919 0.637 4.924 1.00 0.55 H new ATOM 0 HA2 GLY A 101 -3.305 -0.476 2.283 1.00 0.59 H new ATOM 0 HA3 GLY A 101 -3.920 1.030 2.933 1.00 0.59 H new ATOM 1530 N VAL A 102 -0.754 0.588 2.050 1.00 0.53 N ATOM 1531 CA VAL A 102 0.401 1.124 1.359 1.00 0.52 C ATOM 1532 C VAL A 102 0.657 0.237 0.149 1.00 0.55 C ATOM 1533 O VAL A 102 0.949 -0.947 0.298 1.00 0.61 O ATOM 1534 CB VAL A 102 1.607 1.210 2.307 1.00 0.46 C ATOM 1535 CG1 VAL A 102 2.732 1.980 1.607 1.00 0.50 C ATOM 1536 CG2 VAL A 102 1.242 1.884 3.637 1.00 0.43 C ATOM 0 H VAL A 102 -0.564 -0.306 2.503 1.00 0.53 H new ATOM 0 HA VAL A 102 0.224 2.144 1.019 1.00 0.52 H new ATOM 0 HB VAL A 102 1.937 0.198 2.544 1.00 0.46 H new ATOM 0 HG11 VAL A 102 3.594 2.048 2.270 1.00 0.50 H new ATOM 0 HG12 VAL A 102 3.017 1.458 0.694 1.00 0.50 H new ATOM 0 HG13 VAL A 102 2.386 2.983 1.358 1.00 0.50 H new ATOM 0 HG21 VAL A 102 2.123 1.925 4.278 1.00 0.43 H new ATOM 0 HG22 VAL A 102 0.885 2.896 3.446 1.00 0.43 H new ATOM 0 HG23 VAL A 102 0.459 1.311 4.133 1.00 0.43 H new ATOM 1546 N ALA A 103 0.504 0.801 -1.050 1.00 0.54 N ATOM 1547 CA ALA A 103 0.754 0.086 -2.285 1.00 0.57 C ATOM 1548 C ALA A 103 2.251 -0.165 -2.430 1.00 0.58 C ATOM 1549 O ALA A 103 2.650 -1.291 -2.728 1.00 0.60 O ATOM 1550 CB ALA A 103 0.198 0.863 -3.480 1.00 0.63 C ATOM 0 H ALA A 103 0.203 1.766 -1.184 1.00 0.54 H new ATOM 0 HA ALA A 103 0.242 -0.876 -2.258 1.00 0.57 H new ATOM 0 HB1 ALA A 103 0.396 0.309 -4.398 1.00 0.63 H new ATOM 0 HB2 ALA A 103 -0.877 0.994 -3.360 1.00 0.63 H new ATOM 0 HB3 ALA A 103 0.679 1.840 -3.535 1.00 0.63 H new ATOM 1556 N ASN A 104 3.064 0.881 -2.221 1.00 0.59 N ATOM 1557 CA ASN A 104 4.522 0.818 -2.303 1.00 0.63 C ATOM 1558 C ASN A 104 5.113 1.885 -1.390 1.00 0.57 C ATOM 1559 O ASN A 104 4.400 2.781 -0.936 1.00 0.54 O ATOM 1560 CB ASN A 104 5.035 1.086 -3.727 1.00 0.75 C ATOM 1561 CG ASN A 104 4.501 0.115 -4.764 1.00 0.75 C ATOM 1562 OD1 ASN A 104 4.886 -1.050 -4.795 1.00 0.82 O ATOM 1563 ND2 ASN A 104 3.634 0.593 -5.646 1.00 0.77 N ATOM 0 H ASN A 104 2.715 1.810 -1.986 1.00 0.59 H new ATOM 0 HA ASN A 104 4.824 -0.186 -2.006 1.00 0.63 H new ATOM 0 HB2 ASN A 104 4.760 2.100 -4.017 1.00 0.75 H new ATOM 0 HB3 ASN A 104 6.124 1.039 -3.726 1.00 0.75 H new ATOM 0 HD21 ASN A 104 3.266 -0.013 -6.379 1.00 0.77 H new ATOM 0 HD22 ASN A 104 3.335 1.567 -5.591 1.00 0.77 H new ATOM 1570 N ALA A 105 6.428 1.826 -1.166 1.00 0.56 N ATOM 1571 CA ALA A 105 7.115 2.838 -0.366 1.00 0.49 C ATOM 1572 C ALA A 105 8.631 2.911 -0.619 1.00 0.52 C ATOM 1573 O ALA A 105 9.407 2.631 0.293 1.00 0.53 O ATOM 1574 CB ALA A 105 6.823 2.612 1.122 1.00 0.47 C ATOM 0 H ALA A 105 7.035 1.090 -1.527 1.00 0.56 H new ATOM 0 HA ALA A 105 6.719 3.803 -0.681 1.00 0.49 H new ATOM 0 HB1 ALA A 105 7.338 3.369 1.713 1.00 0.47 H new ATOM 0 HB2 ALA A 105 5.749 2.683 1.297 1.00 0.47 H new ATOM 0 HB3 ALA A 105 7.174 1.623 1.415 1.00 0.47 H new ATOM 1580 N PRO A 106 9.093 3.275 -1.827 1.00 0.57 N ATOM 1581 CA PRO A 106 10.519 3.333 -2.117 1.00 0.63 C ATOM 1582 C PRO A 106 11.207 4.481 -1.362 1.00 0.58 C ATOM 1583 O PRO A 106 10.723 5.617 -1.348 1.00 0.52 O ATOM 1584 CB PRO A 106 10.627 3.476 -3.638 1.00 0.73 C ATOM 1585 CG PRO A 106 9.311 4.147 -4.027 1.00 0.71 C ATOM 1586 CD PRO A 106 8.309 3.595 -3.010 1.00 0.64 C ATOM 0 HA PRO A 106 11.036 2.435 -1.778 1.00 0.63 H new ATOM 0 HB2 PRO A 106 11.487 4.082 -3.924 1.00 0.73 H new ATOM 0 HB3 PRO A 106 10.743 2.508 -4.125 1.00 0.73 H new ATOM 0 HG2 PRO A 106 9.383 5.233 -3.970 1.00 0.71 H new ATOM 0 HG3 PRO A 106 9.022 3.900 -5.049 1.00 0.71 H new ATOM 0 HD2 PRO A 106 7.536 4.329 -2.782 1.00 0.64 H new ATOM 0 HD3 PRO A 106 7.804 2.710 -3.397 1.00 0.64 H new ATOM 1594 N VAL A 107 12.352 4.163 -0.743 1.00 0.67 N ATOM 1595 CA VAL A 107 13.195 5.082 0.012 1.00 0.66 C ATOM 1596 C VAL A 107 14.373 5.542 -0.852 1.00 0.74 C ATOM 1597 O VAL A 107 14.897 4.752 -1.635 1.00 0.86 O ATOM 1598 CB VAL A 107 13.682 4.416 1.316 1.00 0.71 C ATOM 1599 CG1 VAL A 107 12.493 4.011 2.193 1.00 1.63 C ATOM 1600 CG2 VAL A 107 14.567 3.180 1.090 1.00 1.75 C ATOM 0 H VAL A 107 12.727 3.215 -0.759 1.00 0.67 H new ATOM 0 HA VAL A 107 12.611 5.961 0.285 1.00 0.66 H new ATOM 0 HB VAL A 107 14.293 5.170 1.813 1.00 0.71 H new ATOM 0 HG11 VAL A 107 12.858 3.543 3.107 1.00 1.63 H new ATOM 0 HG12 VAL A 107 11.909 4.896 2.446 1.00 1.63 H new ATOM 0 HG13 VAL A 107 11.864 3.305 1.650 1.00 1.63 H new ATOM 0 HG21 VAL A 107 14.869 2.768 2.053 1.00 1.75 H new ATOM 0 HG22 VAL A 107 14.007 2.428 0.533 1.00 1.75 H new ATOM 0 HG23 VAL A 107 15.453 3.466 0.523 1.00 1.75 H new ATOM 1610 N ASN A 108 14.806 6.797 -0.691 1.00 0.73 N ATOM 1611 CA ASN A 108 15.978 7.347 -1.356 1.00 0.87 C ATOM 1612 C ASN A 108 17.022 7.717 -0.310 1.00 0.95 C ATOM 1613 O ASN A 108 16.687 8.059 0.822 1.00 1.92 O ATOM 1614 CB ASN A 108 15.615 8.614 -2.135 1.00 0.80 C ATOM 1615 CG ASN A 108 14.779 8.353 -3.388 1.00 1.18 C ATOM 1616 OD1 ASN A 108 14.369 7.234 -3.671 1.00 2.24 O ATOM 1617 ND2 ASN A 108 14.536 9.394 -4.178 1.00 1.30 N ATOM 0 H ASN A 108 14.338 7.467 -0.081 1.00 0.73 H new ATOM 0 HA ASN A 108 16.365 6.596 -2.044 1.00 0.87 H new ATOM 0 HB2 ASN A 108 15.066 9.288 -1.478 1.00 0.80 H new ATOM 0 HB3 ASN A 108 16.533 9.127 -2.423 1.00 0.80 H new ATOM 0 HD21 ASN A 108 14.000 9.268 -5.037 1.00 1.30 H new ATOM 0 HD22 ASN A 108 14.886 10.318 -3.926 1.00 1.30 H new ATOM 1624 N PHE A 109 18.286 7.700 -0.735 1.00 0.90 N ATOM 1625 CA PHE A 109 19.463 8.003 0.075 1.00 0.93 C ATOM 1626 C PHE A 109 20.268 9.146 -0.555 1.00 0.92 C ATOM 1627 O PHE A 109 21.486 9.227 -0.411 1.00 1.47 O ATOM 1628 CB PHE A 109 20.302 6.724 0.140 1.00 1.06 C ATOM 1629 CG PHE A 109 20.636 6.296 1.549 1.00 1.37 C ATOM 1630 CD1 PHE A 109 21.470 7.104 2.340 1.00 2.75 C ATOM 1631 CD2 PHE A 109 19.999 5.177 2.116 1.00 1.72 C ATOM 1632 CE1 PHE A 109 21.658 6.801 3.698 1.00 3.10 C ATOM 1633 CE2 PHE A 109 20.208 4.863 3.467 1.00 1.91 C ATOM 1634 CZ PHE A 109 21.031 5.679 4.262 1.00 2.15 C ATOM 0 H PHE A 109 18.526 7.464 -1.698 1.00 0.90 H new ATOM 0 HA PHE A 109 19.174 8.325 1.075 1.00 0.93 H new ATOM 0 HB2 PHE A 109 19.762 5.919 -0.358 1.00 1.06 H new ATOM 0 HB3 PHE A 109 21.228 6.877 -0.414 1.00 1.06 H new ATOM 0 HD1 PHE A 109 21.966 7.958 1.903 1.00 2.75 H new ATOM 0 HD2 PHE A 109 19.350 4.561 1.512 1.00 1.72 H new ATOM 0 HE1 PHE A 109 22.286 7.432 4.309 1.00 3.10 H new ATOM 0 HE2 PHE A 109 19.735 3.992 3.897 1.00 1.91 H new ATOM 0 HZ PHE A 109 21.181 5.443 5.305 1.00 2.15 H new ATOM 1644 N ALA A 110 19.564 9.957 -1.341 1.00 0.75 N ATOM 1645 CA ALA A 110 20.119 11.069 -2.109 1.00 0.85 C ATOM 1646 C ALA A 110 19.361 12.372 -1.853 1.00 1.04 C ATOM 1647 O ALA A 110 19.946 13.451 -1.901 1.00 1.46 O ATOM 1648 CB ALA A 110 20.098 10.708 -3.597 1.00 0.92 C ATOM 0 H ALA A 110 18.557 9.855 -1.465 1.00 0.75 H new ATOM 0 HA ALA A 110 21.147 11.236 -1.787 1.00 0.85 H new ATOM 0 HB1 ALA A 110 20.511 11.533 -4.177 1.00 0.92 H new ATOM 0 HB2 ALA A 110 20.697 9.812 -3.763 1.00 0.92 H new ATOM 0 HB3 ALA A 110 19.071 10.521 -3.912 1.00 0.92 H new ATOM 1654 N LEU A 111 18.042 12.274 -1.654 1.00 0.90 N ATOM 1655 CA LEU A 111 17.184 13.375 -1.257 1.00 1.07 C ATOM 1656 C LEU A 111 16.901 13.319 0.249 1.00 0.92 C ATOM 1657 O LEU A 111 16.355 14.273 0.793 1.00 0.97 O ATOM 1658 CB LEU A 111 15.846 13.251 -2.000 1.00 1.22 C ATOM 1659 CG LEU A 111 15.943 12.884 -3.488 1.00 1.24 C ATOM 1660 CD1 LEU A 111 14.533 12.873 -4.090 1.00 1.53 C ATOM 1661 CD2 LEU A 111 16.820 13.869 -4.270 1.00 1.37 C ATOM 0 H LEU A 111 17.535 11.396 -1.771 1.00 0.90 H new ATOM 0 HA LEU A 111 17.682 14.314 -1.498 1.00 1.07 H new ATOM 0 HB2 LEU A 111 15.241 12.497 -1.497 1.00 1.22 H new ATOM 0 HB3 LEU A 111 15.313 14.198 -1.912 1.00 1.22 H new ATOM 0 HG LEU A 111 16.406 11.900 -3.563 1.00 1.24 H new ATOM 0 HD11 LEU A 111 14.591 12.613 -5.147 1.00 1.53 H new ATOM 0 HD12 LEU A 111 13.920 12.137 -3.569 1.00 1.53 H new ATOM 0 HD13 LEU A 111 14.084 13.860 -3.983 1.00 1.53 H new ATOM 0 HD21 LEU A 111 16.859 13.569 -5.317 1.00 1.37 H new ATOM 0 HD22 LEU A 111 16.398 14.871 -4.195 1.00 1.37 H new ATOM 0 HD23 LEU A 111 17.828 13.868 -3.854 1.00 1.37 H new ATOM 1673 N GLU A 112 17.172 12.168 0.880 1.00 0.84 N ATOM 1674 CA GLU A 112 16.849 11.845 2.259 1.00 0.80 C ATOM 1675 C GLU A 112 15.330 11.795 2.478 1.00 0.59 C ATOM 1676 O GLU A 112 14.776 12.394 3.398 1.00 0.69 O ATOM 1677 CB GLU A 112 17.660 12.746 3.203 1.00 1.07 C ATOM 1678 CG GLU A 112 19.142 12.325 3.182 1.00 1.12 C ATOM 1679 CD GLU A 112 19.852 12.583 1.860 1.00 2.64 C ATOM 1680 OE1 GLU A 112 19.745 11.686 0.990 1.00 3.94 O ATOM 1681 OE2 GLU A 112 20.462 13.664 1.736 1.00 3.45 O ATOM 0 H GLU A 112 17.649 11.401 0.407 1.00 0.84 H new ATOM 0 HA GLU A 112 17.161 10.831 2.510 1.00 0.80 H new ATOM 0 HB2 GLU A 112 17.564 13.788 2.897 1.00 1.07 H new ATOM 0 HB3 GLU A 112 17.266 12.674 4.217 1.00 1.07 H new ATOM 0 HG2 GLU A 112 19.669 12.858 3.973 1.00 1.12 H new ATOM 0 HG3 GLU A 112 19.208 11.262 3.414 1.00 1.12 H new ATOM 1688 N THR A 113 14.667 11.018 1.613 1.00 0.42 N ATOM 1689 CA THR A 113 13.209 10.951 1.509 1.00 0.37 C ATOM 1690 C THR A 113 12.715 9.515 1.371 1.00 0.40 C ATOM 1691 O THR A 113 13.471 8.625 0.982 1.00 0.51 O ATOM 1692 CB THR A 113 12.713 11.764 0.304 1.00 0.53 C ATOM 1693 OG1 THR A 113 13.146 11.171 -0.900 1.00 0.69 O ATOM 1694 CG2 THR A 113 13.234 13.194 0.337 1.00 0.70 C ATOM 0 H THR A 113 15.143 10.405 0.951 1.00 0.42 H new ATOM 0 HA THR A 113 12.808 11.372 2.431 1.00 0.37 H new ATOM 0 HB THR A 113 11.624 11.776 0.357 1.00 0.53 H new ATOM 0 HG1 THR A 113 12.821 11.698 -1.660 1.00 0.69 H new ATOM 0 HG21 THR A 113 12.862 13.737 -0.532 1.00 0.70 H new ATOM 0 HG22 THR A 113 12.890 13.686 1.247 1.00 0.70 H new ATOM 0 HG23 THR A 113 14.324 13.185 0.319 1.00 0.70 H new ATOM 1702 N VAL A 114 11.421 9.324 1.631 1.00 0.38 N ATOM 1703 CA VAL A 114 10.644 8.182 1.190 1.00 0.36 C ATOM 1704 C VAL A 114 9.454 8.700 0.390 1.00 0.36 C ATOM 1705 O VAL A 114 8.755 9.612 0.835 1.00 0.37 O ATOM 1706 CB VAL A 114 10.213 7.301 2.379 1.00 0.39 C ATOM 1707 CG1 VAL A 114 9.441 8.058 3.470 1.00 0.47 C ATOM 1708 CG2 VAL A 114 9.380 6.104 1.907 1.00 0.40 C ATOM 0 H VAL A 114 10.872 9.989 2.175 1.00 0.38 H new ATOM 0 HA VAL A 114 11.251 7.539 0.553 1.00 0.36 H new ATOM 0 HB VAL A 114 11.145 6.956 2.828 1.00 0.39 H new ATOM 0 HG11 VAL A 114 9.174 7.369 4.271 1.00 0.47 H new ATOM 0 HG12 VAL A 114 10.066 8.856 3.871 1.00 0.47 H new ATOM 0 HG13 VAL A 114 8.535 8.487 3.043 1.00 0.47 H new ATOM 0 HG21 VAL A 114 9.090 5.501 2.767 1.00 0.40 H new ATOM 0 HG22 VAL A 114 8.486 6.462 1.397 1.00 0.40 H new ATOM 0 HG23 VAL A 114 9.971 5.497 1.221 1.00 0.40 H new ATOM 1718 N THR A 115 9.210 8.104 -0.776 1.00 0.42 N ATOM 1719 CA THR A 115 7.912 8.216 -1.412 1.00 0.47 C ATOM 1720 C THR A 115 7.062 7.129 -0.774 1.00 0.50 C ATOM 1721 O THR A 115 7.422 5.963 -0.884 1.00 0.69 O ATOM 1722 CB THR A 115 8.037 7.992 -2.921 1.00 0.56 C ATOM 1723 OG1 THR A 115 8.950 8.912 -3.480 1.00 0.56 O ATOM 1724 CG2 THR A 115 6.681 8.138 -3.617 1.00 0.67 C ATOM 0 H THR A 115 9.891 7.545 -1.290 1.00 0.42 H new ATOM 0 HA THR A 115 7.472 9.204 -1.278 1.00 0.47 H new ATOM 0 HB THR A 115 8.401 6.976 -3.075 1.00 0.56 H new ATOM 0 HG1 THR A 115 9.022 8.756 -4.445 1.00 0.56 H new ATOM 0 HG21 THR A 115 6.802 7.973 -4.688 1.00 0.67 H new ATOM 0 HG22 THR A 115 5.984 7.404 -3.213 1.00 0.67 H new ATOM 0 HG23 THR A 115 6.290 9.141 -3.446 1.00 0.67 H new ATOM 1732 N VAL A 116 5.970 7.488 -0.102 1.00 0.49 N ATOM 1733 CA VAL A 116 5.006 6.528 0.414 1.00 0.50 C ATOM 1734 C VAL A 116 3.783 6.560 -0.509 1.00 0.52 C ATOM 1735 O VAL A 116 3.101 7.580 -0.605 1.00 0.52 O ATOM 1736 CB VAL A 116 4.723 6.776 1.909 1.00 0.56 C ATOM 1737 CG1 VAL A 116 4.107 8.139 2.238 1.00 0.64 C ATOM 1738 CG2 VAL A 116 3.827 5.670 2.475 1.00 0.67 C ATOM 0 H VAL A 116 5.731 8.459 0.099 1.00 0.49 H new ATOM 0 HA VAL A 116 5.392 5.509 0.398 1.00 0.50 H new ATOM 0 HB VAL A 116 5.706 6.767 2.380 1.00 0.56 H new ATOM 0 HG11 VAL A 116 3.946 8.216 3.313 1.00 0.64 H new ATOM 0 HG12 VAL A 116 4.782 8.931 1.915 1.00 0.64 H new ATOM 0 HG13 VAL A 116 3.153 8.242 1.721 1.00 0.64 H new ATOM 0 HG21 VAL A 116 3.637 5.860 3.531 1.00 0.67 H new ATOM 0 HG22 VAL A 116 2.881 5.655 1.933 1.00 0.67 H new ATOM 0 HG23 VAL A 116 4.324 4.706 2.364 1.00 0.67 H new ATOM 1748 N GLU A 117 3.543 5.463 -1.231 1.00 0.60 N ATOM 1749 CA GLU A 117 2.397 5.305 -2.111 1.00 0.64 C ATOM 1750 C GLU A 117 1.331 4.589 -1.302 1.00 0.60 C ATOM 1751 O GLU A 117 1.373 3.364 -1.184 1.00 0.57 O ATOM 1752 CB GLU A 117 2.793 4.472 -3.342 1.00 0.72 C ATOM 1753 CG GLU A 117 2.945 5.330 -4.597 1.00 0.93 C ATOM 1754 CD GLU A 117 3.329 4.520 -5.831 1.00 1.85 C ATOM 1755 OE1 GLU A 117 3.238 3.270 -5.755 1.00 2.49 O ATOM 1756 OE2 GLU A 117 3.719 5.176 -6.821 1.00 2.84 O ATOM 0 H GLU A 117 4.155 4.647 -1.216 1.00 0.60 H new ATOM 0 HA GLU A 117 2.032 6.267 -2.471 1.00 0.64 H new ATOM 0 HB2 GLU A 117 3.732 3.955 -3.142 1.00 0.72 H new ATOM 0 HB3 GLU A 117 2.038 3.705 -3.518 1.00 0.72 H new ATOM 0 HG2 GLU A 117 2.007 5.852 -4.789 1.00 0.93 H new ATOM 0 HG3 GLU A 117 3.703 6.092 -4.419 1.00 0.93 H new ATOM 1763 N TYR A 118 0.394 5.340 -0.722 1.00 0.61 N ATOM 1764 CA TYR A 118 -0.585 4.761 0.182 1.00 0.59 C ATOM 1765 C TYR A 118 -1.937 5.430 0.043 1.00 0.65 C ATOM 1766 O TYR A 118 -2.083 6.418 -0.670 1.00 0.78 O ATOM 1767 CB TYR A 118 -0.084 4.810 1.630 1.00 0.54 C ATOM 1768 CG TYR A 118 -0.315 6.117 2.357 1.00 0.51 C ATOM 1769 CD1 TYR A 118 0.312 7.297 1.922 1.00 1.84 C ATOM 1770 CD2 TYR A 118 -1.207 6.159 3.444 1.00 1.55 C ATOM 1771 CE1 TYR A 118 0.067 8.510 2.587 1.00 1.85 C ATOM 1772 CE2 TYR A 118 -1.437 7.368 4.118 1.00 1.53 C ATOM 1773 CZ TYR A 118 -0.803 8.544 3.692 1.00 0.52 C ATOM 1774 OH TYR A 118 -1.044 9.713 4.352 1.00 0.59 O ATOM 0 H TYR A 118 0.297 6.345 -0.865 1.00 0.61 H new ATOM 0 HA TYR A 118 -0.715 3.715 -0.095 1.00 0.59 H new ATOM 0 HB2 TYR A 118 -0.570 4.012 2.191 1.00 0.54 H new ATOM 0 HB3 TYR A 118 0.985 4.597 1.633 1.00 0.54 H new ATOM 0 HD1 TYR A 118 0.983 7.271 1.076 1.00 1.84 H new ATOM 0 HD2 TYR A 118 -1.715 5.260 3.760 1.00 1.55 H new ATOM 0 HE1 TYR A 118 0.547 9.417 2.250 1.00 1.85 H new ATOM 0 HE2 TYR A 118 -2.104 7.393 4.967 1.00 1.53 H new ATOM 0 HH TYR A 118 -1.949 9.696 4.728 1.00 0.59 H new ATOM 1784 N ASN A 119 -2.928 4.814 0.684 1.00 0.60 N ATOM 1785 CA ASN A 119 -4.339 5.097 0.527 1.00 0.65 C ATOM 1786 C ASN A 119 -4.776 5.910 1.746 1.00 0.61 C ATOM 1787 O ASN A 119 -5.058 5.321 2.792 1.00 0.71 O ATOM 1788 CB ASN A 119 -5.042 3.736 0.404 1.00 0.88 C ATOM 1789 CG ASN A 119 -6.424 3.793 -0.232 1.00 1.25 C ATOM 1790 OD1 ASN A 119 -7.415 4.042 0.447 1.00 1.56 O ATOM 1791 ND2 ASN A 119 -6.522 3.453 -1.518 1.00 2.51 N ATOM 0 H ASN A 119 -2.752 4.069 1.358 1.00 0.60 H new ATOM 0 HA ASN A 119 -4.587 5.685 -0.357 1.00 0.65 H new ATOM 0 HB2 ASN A 119 -4.413 3.068 -0.184 1.00 0.88 H new ATOM 0 HB3 ASN A 119 -5.131 3.297 1.397 1.00 0.88 H new ATOM 0 HD21 ASN A 119 -7.439 3.395 -1.962 1.00 2.51 H new ATOM 0 HD22 ASN A 119 -5.680 3.251 -2.058 1.00 2.51 H new ATOM 1798 N PRO A 120 -4.822 7.256 1.671 1.00 0.57 N ATOM 1799 CA PRO A 120 -4.948 8.115 2.846 1.00 0.58 C ATOM 1800 C PRO A 120 -6.383 8.149 3.390 1.00 0.60 C ATOM 1801 O PRO A 120 -6.815 9.160 3.945 1.00 0.70 O ATOM 1802 CB PRO A 120 -4.485 9.496 2.366 1.00 0.64 C ATOM 1803 CG PRO A 120 -4.953 9.511 0.914 1.00 0.67 C ATOM 1804 CD PRO A 120 -4.667 8.075 0.476 1.00 0.63 C ATOM 0 HA PRO A 120 -4.350 7.749 3.681 1.00 0.58 H new ATOM 0 HB2 PRO A 120 -4.936 10.300 2.947 1.00 0.64 H new ATOM 0 HB3 PRO A 120 -3.404 9.613 2.446 1.00 0.64 H new ATOM 0 HG2 PRO A 120 -6.010 9.761 0.828 1.00 0.67 H new ATOM 0 HG3 PRO A 120 -4.404 10.238 0.315 1.00 0.67 H new ATOM 0 HD2 PRO A 120 -5.358 7.760 -0.306 1.00 0.63 H new ATOM 0 HD3 PRO A 120 -3.660 7.984 0.068 1.00 0.63 H new ATOM 1812 N LYS A 121 -7.142 7.068 3.191 1.00 0.64 N ATOM 1813 CA LYS A 121 -8.487 6.877 3.692 1.00 0.70 C ATOM 1814 C LYS A 121 -8.456 5.766 4.741 1.00 0.68 C ATOM 1815 O LYS A 121 -8.978 5.948 5.838 1.00 0.78 O ATOM 1816 CB LYS A 121 -9.414 6.550 2.516 1.00 0.84 C ATOM 1817 CG LYS A 121 -9.227 7.508 1.328 1.00 1.87 C ATOM 1818 CD LYS A 121 -9.492 8.975 1.699 1.00 3.07 C ATOM 1819 CE LYS A 121 -9.430 9.867 0.450 1.00 4.54 C ATOM 1820 NZ LYS A 121 -9.292 11.296 0.798 1.00 5.73 N ATOM 0 H LYS A 121 -6.811 6.270 2.649 1.00 0.64 H new ATOM 0 HA LYS A 121 -8.871 7.779 4.168 1.00 0.70 H new ATOM 0 HB2 LYS A 121 -9.228 5.528 2.186 1.00 0.84 H new ATOM 0 HB3 LYS A 121 -10.450 6.593 2.852 1.00 0.84 H new ATOM 0 HG2 LYS A 121 -8.210 7.412 0.947 1.00 1.87 H new ATOM 0 HG3 LYS A 121 -9.899 7.215 0.521 1.00 1.87 H new ATOM 0 HD2 LYS A 121 -10.471 9.066 2.169 1.00 3.07 H new ATOM 0 HD3 LYS A 121 -8.755 9.310 2.429 1.00 3.07 H new ATOM 0 HE2 LYS A 121 -8.588 9.562 -0.172 1.00 4.54 H new ATOM 0 HE3 LYS A 121 -10.333 9.724 -0.143 1.00 4.54 H new ATOM 0 HZ1 LYS A 121 -9.254 11.863 -0.073 1.00 5.73 H new ATOM 0 HZ2 LYS A 121 -10.108 11.594 1.370 1.00 5.73 H new ATOM 0 HZ3 LYS A 121 -8.417 11.438 1.342 1.00 5.73 H new ATOM 1834 N GLU A 122 -7.806 4.637 4.424 1.00 0.65 N ATOM 1835 CA GLU A 122 -7.555 3.593 5.406 1.00 0.58 C ATOM 1836 C GLU A 122 -6.601 4.108 6.494 1.00 0.55 C ATOM 1837 O GLU A 122 -6.893 3.990 7.682 1.00 0.63 O ATOM 1838 CB GLU A 122 -6.970 2.335 4.738 1.00 0.61 C ATOM 1839 CG GLU A 122 -7.880 1.579 3.755 1.00 1.01 C ATOM 1840 CD GLU A 122 -9.274 1.244 4.279 1.00 1.58 C ATOM 1841 OE1 GLU A 122 -9.366 0.921 5.482 1.00 2.58 O ATOM 1842 OE2 GLU A 122 -10.219 1.282 3.457 1.00 2.69 O ATOM 0 H GLU A 122 -7.447 4.431 3.492 1.00 0.65 H new ATOM 0 HA GLU A 122 -8.506 3.322 5.865 1.00 0.58 H new ATOM 0 HB2 GLU A 122 -6.063 2.624 4.206 1.00 0.61 H new ATOM 0 HB3 GLU A 122 -6.671 1.642 5.524 1.00 0.61 H new ATOM 0 HG2 GLU A 122 -7.985 2.177 2.850 1.00 1.01 H new ATOM 0 HG3 GLU A 122 -7.385 0.651 3.469 1.00 1.01 H new ATOM 1849 N ALA A 123 -5.443 4.653 6.092 1.00 0.55 N ATOM 1850 CA ALA A 123 -4.394 5.108 7.004 1.00 0.54 C ATOM 1851 C ALA A 123 -4.170 6.614 6.844 1.00 0.50 C ATOM 1852 O ALA A 123 -4.873 7.273 6.081 1.00 0.50 O ATOM 1853 CB ALA A 123 -3.117 4.303 6.741 1.00 0.56 C ATOM 0 H ALA A 123 -5.210 4.790 5.109 1.00 0.55 H new ATOM 0 HA ALA A 123 -4.696 4.939 8.038 1.00 0.54 H new ATOM 0 HB1 ALA A 123 -2.330 4.637 7.418 1.00 0.56 H new ATOM 0 HB2 ALA A 123 -3.314 3.244 6.908 1.00 0.56 H new ATOM 0 HB3 ALA A 123 -2.797 4.455 5.710 1.00 0.56 H new ATOM 1859 N SER A 124 -3.189 7.172 7.561 1.00 0.51 N ATOM 1860 CA SER A 124 -2.875 8.595 7.525 1.00 0.47 C ATOM 1861 C SER A 124 -1.416 8.823 7.924 1.00 0.48 C ATOM 1862 O SER A 124 -0.761 7.923 8.449 1.00 0.58 O ATOM 1863 CB SER A 124 -3.824 9.350 8.465 1.00 0.52 C ATOM 1864 OG SER A 124 -3.645 8.906 9.797 1.00 2.03 O ATOM 0 H SER A 124 -2.587 6.638 8.188 1.00 0.51 H new ATOM 0 HA SER A 124 -3.010 8.973 6.512 1.00 0.47 H new ATOM 0 HB2 SER A 124 -3.634 10.421 8.402 1.00 0.52 H new ATOM 0 HB3 SER A 124 -4.857 9.191 8.156 1.00 0.52 H new ATOM 0 HG SER A 124 -4.254 9.395 10.389 1.00 2.03 H new ATOM 1870 N VAL A 125 -0.922 10.048 7.721 1.00 0.45 N ATOM 1871 CA VAL A 125 0.427 10.451 8.108 1.00 0.50 C ATOM 1872 C VAL A 125 0.717 10.060 9.560 1.00 0.49 C ATOM 1873 O VAL A 125 1.807 9.590 9.873 1.00 0.52 O ATOM 1874 CB VAL A 125 0.631 11.964 7.909 1.00 0.58 C ATOM 1875 CG1 VAL A 125 2.131 12.282 7.947 1.00 1.39 C ATOM 1876 CG2 VAL A 125 0.053 12.476 6.583 1.00 1.48 C ATOM 0 H VAL A 125 -1.457 10.795 7.277 1.00 0.45 H new ATOM 0 HA VAL A 125 1.129 9.924 7.462 1.00 0.50 H new ATOM 0 HB VAL A 125 0.098 12.466 8.716 1.00 0.58 H new ATOM 0 HG11 VAL A 125 2.280 13.353 7.806 1.00 1.39 H new ATOM 0 HG12 VAL A 125 2.542 11.982 8.911 1.00 1.39 H new ATOM 0 HG13 VAL A 125 2.639 11.738 7.151 1.00 1.39 H new ATOM 0 HG21 VAL A 125 0.228 13.549 6.500 1.00 1.48 H new ATOM 0 HG22 VAL A 125 0.539 11.964 5.752 1.00 1.48 H new ATOM 0 HG23 VAL A 125 -1.019 12.279 6.553 1.00 1.48 H new ATOM 1886 N SER A 126 -0.243 10.267 10.463 1.00 0.49 N ATOM 1887 CA SER A 126 -0.076 9.931 11.865 1.00 0.52 C ATOM 1888 C SER A 126 0.322 8.469 12.063 1.00 0.46 C ATOM 1889 O SER A 126 1.248 8.213 12.825 1.00 0.51 O ATOM 1890 CB SER A 126 -1.347 10.294 12.630 1.00 0.58 C ATOM 1891 OG SER A 126 -1.572 11.684 12.471 1.00 0.71 O ATOM 0 H SER A 126 -1.152 10.671 10.237 1.00 0.49 H new ATOM 0 HA SER A 126 0.750 10.517 12.268 1.00 0.52 H new ATOM 0 HB2 SER A 126 -2.196 9.725 12.251 1.00 0.58 H new ATOM 0 HB3 SER A 126 -1.241 10.043 13.686 1.00 0.58 H new ATOM 0 HG SER A 126 -2.386 11.941 12.953 1.00 0.71 H new ATOM 1897 N ASP A 127 -0.335 7.530 11.373 1.00 0.42 N ATOM 1898 CA ASP A 127 -0.009 6.108 11.461 1.00 0.43 C ATOM 1899 C ASP A 127 1.448 5.887 11.047 1.00 0.43 C ATOM 1900 O ASP A 127 2.243 5.266 11.752 1.00 0.44 O ATOM 1901 CB ASP A 127 -0.957 5.318 10.549 1.00 0.48 C ATOM 1902 CG ASP A 127 -0.511 3.870 10.413 1.00 0.83 C ATOM 1903 OD1 ASP A 127 -0.924 3.067 11.272 1.00 2.14 O ATOM 1904 OD2 ASP A 127 0.235 3.604 9.444 1.00 1.95 O ATOM 0 H ASP A 127 -1.107 7.737 10.739 1.00 0.42 H new ATOM 0 HA ASP A 127 -0.132 5.760 12.487 1.00 0.43 H new ATOM 0 HB2 ASP A 127 -1.968 5.353 10.954 1.00 0.48 H new ATOM 0 HB3 ASP A 127 -0.991 5.785 9.565 1.00 0.48 H new ATOM 1909 N LEU A 128 1.795 6.464 9.900 1.00 0.47 N ATOM 1910 CA LEU A 128 3.107 6.335 9.291 1.00 0.54 C ATOM 1911 C LEU A 128 4.185 6.858 10.243 1.00 0.54 C ATOM 1912 O LEU A 128 5.192 6.192 10.490 1.00 0.55 O ATOM 1913 CB LEU A 128 3.102 7.063 7.947 1.00 0.66 C ATOM 1914 CG LEU A 128 2.123 6.412 6.952 1.00 0.77 C ATOM 1915 CD1 LEU A 128 1.947 7.326 5.750 1.00 0.98 C ATOM 1916 CD2 LEU A 128 2.640 5.076 6.416 1.00 0.82 C ATOM 0 H LEU A 128 1.155 7.046 9.360 1.00 0.47 H new ATOM 0 HA LEU A 128 3.341 5.287 9.104 1.00 0.54 H new ATOM 0 HB2 LEU A 128 2.826 8.107 8.099 1.00 0.66 H new ATOM 0 HB3 LEU A 128 4.107 7.057 7.526 1.00 0.66 H new ATOM 0 HG LEU A 128 1.190 6.248 7.491 1.00 0.77 H new ATOM 0 HD11 LEU A 128 1.255 6.869 5.043 1.00 0.98 H new ATOM 0 HD12 LEU A 128 1.549 8.286 6.078 1.00 0.98 H new ATOM 0 HD13 LEU A 128 2.911 7.480 5.265 1.00 0.98 H new ATOM 0 HD21 LEU A 128 1.914 4.658 5.719 1.00 0.82 H new ATOM 0 HD22 LEU A 128 3.588 5.233 5.902 1.00 0.82 H new ATOM 0 HD23 LEU A 128 2.787 4.384 7.245 1.00 0.82 H new ATOM 1928 N LYS A 129 3.955 8.046 10.807 1.00 0.56 N ATOM 1929 CA LYS A 129 4.802 8.585 11.854 1.00 0.62 C ATOM 1930 C LYS A 129 4.889 7.597 13.015 1.00 0.57 C ATOM 1931 O LYS A 129 5.991 7.203 13.365 1.00 0.65 O ATOM 1932 CB LYS A 129 4.316 9.975 12.294 1.00 0.70 C ATOM 1933 CG LYS A 129 4.595 10.998 11.182 1.00 0.81 C ATOM 1934 CD LYS A 129 4.715 12.460 11.645 1.00 0.76 C ATOM 1935 CE LYS A 129 3.378 13.161 11.922 1.00 2.06 C ATOM 1936 NZ LYS A 129 2.664 12.579 13.075 1.00 3.00 N ATOM 0 H LYS A 129 3.178 8.653 10.547 1.00 0.56 H new ATOM 0 HA LYS A 129 5.811 8.722 11.465 1.00 0.62 H new ATOM 0 HB2 LYS A 129 3.249 9.945 12.514 1.00 0.70 H new ATOM 0 HB3 LYS A 129 4.822 10.274 13.212 1.00 0.70 H new ATOM 0 HG2 LYS A 129 5.520 10.718 10.677 1.00 0.81 H new ATOM 0 HG3 LYS A 129 3.796 10.933 10.443 1.00 0.81 H new ATOM 0 HD2 LYS A 129 5.319 12.490 12.552 1.00 0.76 H new ATOM 0 HD3 LYS A 129 5.254 13.024 10.884 1.00 0.76 H new ATOM 0 HE2 LYS A 129 3.558 14.220 12.107 1.00 2.06 H new ATOM 0 HE3 LYS A 129 2.746 13.095 11.036 1.00 2.06 H new ATOM 0 HZ1 LYS A 129 1.967 13.263 13.433 1.00 3.00 H new ATOM 0 HZ2 LYS A 129 2.175 11.710 12.778 1.00 3.00 H new ATOM 0 HZ3 LYS A 129 3.346 12.353 13.827 1.00 3.00 H new ATOM 1950 N GLU A 130 3.754 7.146 13.559 1.00 0.51 N ATOM 1951 CA GLU A 130 3.715 6.218 14.691 1.00 0.50 C ATOM 1952 C GLU A 130 4.617 4.999 14.430 1.00 0.45 C ATOM 1953 O GLU A 130 5.400 4.578 15.285 1.00 0.52 O ATOM 1954 CB GLU A 130 2.252 5.822 14.970 1.00 0.59 C ATOM 1955 CG GLU A 130 1.904 5.741 16.461 1.00 0.94 C ATOM 1956 CD GLU A 130 2.400 4.480 17.144 1.00 1.67 C ATOM 1957 OE1 GLU A 130 2.476 3.414 16.488 1.00 2.40 O ATOM 1958 OE2 GLU A 130 2.656 4.531 18.367 1.00 2.64 O ATOM 0 H GLU A 130 2.830 7.418 13.223 1.00 0.51 H new ATOM 0 HA GLU A 130 4.109 6.705 15.583 1.00 0.50 H new ATOM 0 HB2 GLU A 130 1.592 6.546 14.492 1.00 0.59 H new ATOM 0 HB3 GLU A 130 2.053 4.855 14.507 1.00 0.59 H new ATOM 0 HG2 GLU A 130 2.327 6.607 16.970 1.00 0.94 H new ATOM 0 HG3 GLU A 130 0.822 5.801 16.575 1.00 0.94 H new ATOM 1965 N ALA A 131 4.552 4.461 13.209 1.00 0.43 N ATOM 1966 CA ALA A 131 5.403 3.353 12.816 1.00 0.48 C ATOM 1967 C ALA A 131 6.884 3.744 12.871 1.00 0.45 C ATOM 1968 O ALA A 131 7.692 3.053 13.492 1.00 0.55 O ATOM 1969 CB ALA A 131 4.992 2.857 11.430 1.00 0.57 C ATOM 0 H ALA A 131 3.915 4.781 12.480 1.00 0.43 H new ATOM 0 HA ALA A 131 5.272 2.534 13.524 1.00 0.48 H new ATOM 0 HB1 ALA A 131 5.632 2.025 11.137 1.00 0.57 H new ATOM 0 HB2 ALA A 131 3.954 2.525 11.455 1.00 0.57 H new ATOM 0 HB3 ALA A 131 5.096 3.667 10.708 1.00 0.57 H new ATOM 1975 N VAL A 132 7.269 4.842 12.219 1.00 0.38 N ATOM 1976 CA VAL A 132 8.666 5.253 12.174 1.00 0.39 C ATOM 1977 C VAL A 132 9.170 5.649 13.571 1.00 0.44 C ATOM 1978 O VAL A 132 10.345 5.445 13.892 1.00 0.53 O ATOM 1979 CB VAL A 132 8.861 6.331 11.095 1.00 0.38 C ATOM 1980 CG1 VAL A 132 10.294 6.869 11.120 1.00 1.49 C ATOM 1981 CG2 VAL A 132 8.596 5.708 9.714 1.00 1.29 C ATOM 0 H VAL A 132 6.631 5.460 11.717 1.00 0.38 H new ATOM 0 HA VAL A 132 9.293 4.412 11.878 1.00 0.39 H new ATOM 0 HB VAL A 132 8.169 7.151 11.290 1.00 0.38 H new ATOM 0 HG11 VAL A 132 10.410 7.630 10.349 1.00 1.49 H new ATOM 0 HG12 VAL A 132 10.501 7.307 12.096 1.00 1.49 H new ATOM 0 HG13 VAL A 132 10.992 6.053 10.933 1.00 1.49 H new ATOM 0 HG21 VAL A 132 8.732 6.465 8.941 1.00 1.29 H new ATOM 0 HG22 VAL A 132 9.294 4.888 9.545 1.00 1.29 H new ATOM 0 HG23 VAL A 132 7.575 5.329 9.676 1.00 1.29 H new ATOM 1991 N ASP A 133 8.273 6.146 14.423 1.00 0.45 N ATOM 1992 CA ASP A 133 8.540 6.386 15.822 1.00 0.55 C ATOM 1993 C ASP A 133 8.920 5.062 16.485 1.00 0.59 C ATOM 1994 O ASP A 133 9.978 4.977 17.102 1.00 0.67 O ATOM 1995 CB ASP A 133 7.341 7.067 16.498 1.00 0.63 C ATOM 1996 CG ASP A 133 7.445 8.589 16.478 1.00 1.60 C ATOM 1997 OD1 ASP A 133 8.215 9.109 17.314 1.00 1.77 O ATOM 1998 OD2 ASP A 133 6.742 9.212 15.651 1.00 3.23 O ATOM 0 H ASP A 133 7.324 6.395 14.144 1.00 0.45 H new ATOM 0 HA ASP A 133 9.378 7.074 15.933 1.00 0.55 H new ATOM 0 HB2 ASP A 133 6.423 6.762 15.995 1.00 0.63 H new ATOM 0 HB3 ASP A 133 7.267 6.725 17.530 1.00 0.63 H new ATOM 2003 N LYS A 134 8.118 4.001 16.303 1.00 0.60 N ATOM 2004 CA LYS A 134 8.517 2.661 16.743 1.00 0.67 C ATOM 2005 C LYS A 134 9.911 2.279 16.219 1.00 0.74 C ATOM 2006 O LYS A 134 10.711 1.721 16.966 1.00 0.99 O ATOM 2007 CB LYS A 134 7.498 1.577 16.338 1.00 0.71 C ATOM 2008 CG LYS A 134 6.570 1.134 17.476 1.00 0.86 C ATOM 2009 CD LYS A 134 5.301 1.988 17.552 1.00 1.49 C ATOM 2010 CE LYS A 134 4.367 1.402 18.622 1.00 1.87 C ATOM 2011 NZ LYS A 134 3.028 2.009 18.561 1.00 2.57 N ATOM 0 H LYS A 134 7.201 4.046 15.859 1.00 0.60 H new ATOM 0 HA LYS A 134 8.549 2.706 17.832 1.00 0.67 H new ATOM 0 HB2 LYS A 134 6.891 1.953 15.514 1.00 0.71 H new ATOM 0 HB3 LYS A 134 8.038 0.707 15.964 1.00 0.71 H new ATOM 0 HG2 LYS A 134 6.295 0.089 17.333 1.00 0.86 H new ATOM 0 HG3 LYS A 134 7.105 1.196 18.424 1.00 0.86 H new ATOM 0 HD2 LYS A 134 5.555 3.019 17.798 1.00 1.49 H new ATOM 0 HD3 LYS A 134 4.800 2.005 16.584 1.00 1.49 H new ATOM 0 HE2 LYS A 134 4.285 0.324 18.484 1.00 1.87 H new ATOM 0 HE3 LYS A 134 4.797 1.565 19.610 1.00 1.87 H new ATOM 0 HZ1 LYS A 134 2.349 1.404 19.065 1.00 2.57 H new ATOM 0 HZ2 LYS A 134 3.052 2.948 19.007 1.00 2.57 H new ATOM 0 HZ3 LYS A 134 2.735 2.105 17.568 1.00 2.57 H new ATOM 2025 N LEU A 135 10.203 2.543 14.941 1.00 0.60 N ATOM 2026 CA LEU A 135 11.528 2.250 14.384 1.00 0.62 C ATOM 2027 C LEU A 135 12.627 3.107 15.036 1.00 0.67 C ATOM 2028 O LEU A 135 13.800 2.744 14.956 1.00 0.79 O ATOM 2029 CB LEU A 135 11.554 2.408 12.853 1.00 0.56 C ATOM 2030 CG LEU A 135 11.005 1.226 12.035 1.00 0.57 C ATOM 2031 CD1 LEU A 135 11.834 -0.052 12.167 1.00 0.62 C ATOM 2032 CD2 LEU A 135 9.543 0.905 12.321 1.00 0.72 C ATOM 0 H LEU A 135 9.547 2.955 14.278 1.00 0.60 H new ATOM 0 HA LEU A 135 11.737 1.206 14.616 1.00 0.62 H new ATOM 0 HB2 LEU A 135 10.983 3.299 12.592 1.00 0.56 H new ATOM 0 HB3 LEU A 135 12.584 2.588 12.545 1.00 0.56 H new ATOM 0 HG LEU A 135 11.082 1.581 11.007 1.00 0.57 H new ATOM 0 HD11 LEU A 135 11.386 -0.841 11.563 1.00 0.62 H new ATOM 0 HD12 LEU A 135 12.851 0.136 11.822 1.00 0.62 H new ATOM 0 HD13 LEU A 135 11.858 -0.364 13.211 1.00 0.62 H new ATOM 0 HD21 LEU A 135 9.229 0.061 11.707 1.00 0.72 H new ATOM 0 HD22 LEU A 135 9.426 0.651 13.374 1.00 0.72 H new ATOM 0 HD23 LEU A 135 8.927 1.773 12.087 1.00 0.72 H new ATOM 2044 N GLY A 136 12.265 4.221 15.679 1.00 0.65 N ATOM 2045 CA GLY A 136 13.171 5.051 16.457 1.00 0.71 C ATOM 2046 C GLY A 136 13.730 6.212 15.641 1.00 0.81 C ATOM 2047 O GLY A 136 14.834 6.678 15.921 1.00 1.02 O ATOM 0 H GLY A 136 11.308 4.574 15.669 1.00 0.65 H new ATOM 0 HA2 GLY A 136 12.646 5.441 17.329 1.00 0.71 H new ATOM 0 HA3 GLY A 136 13.994 4.440 16.828 1.00 0.71 H new ATOM 2051 N TYR A 137 12.977 6.696 14.649 1.00 0.73 N ATOM 2052 CA TYR A 137 13.344 7.852 13.835 1.00 0.77 C ATOM 2053 C TYR A 137 12.131 8.780 13.767 1.00 0.74 C ATOM 2054 O TYR A 137 11.166 8.557 14.494 1.00 0.78 O ATOM 2055 CB TYR A 137 13.794 7.370 12.448 1.00 0.73 C ATOM 2056 CG TYR A 137 14.802 6.234 12.489 1.00 0.86 C ATOM 2057 CD1 TYR A 137 16.044 6.417 13.127 1.00 2.43 C ATOM 2058 CD2 TYR A 137 14.407 4.941 12.099 1.00 1.57 C ATOM 2059 CE1 TYR A 137 16.842 5.306 13.449 1.00 2.64 C ATOM 2060 CE2 TYR A 137 15.208 3.833 12.418 1.00 1.54 C ATOM 2061 CZ TYR A 137 16.377 4.010 13.175 1.00 1.35 C ATOM 2062 OH TYR A 137 17.042 2.930 13.669 1.00 1.74 O ATOM 0 H TYR A 137 12.080 6.286 14.387 1.00 0.73 H new ATOM 0 HA TYR A 137 14.178 8.405 14.268 1.00 0.77 H new ATOM 0 HB2 TYR A 137 12.919 7.046 11.885 1.00 0.73 H new ATOM 0 HB3 TYR A 137 14.229 8.210 11.906 1.00 0.73 H new ATOM 0 HD1 TYR A 137 16.384 7.413 13.369 1.00 2.43 H new ATOM 0 HD2 TYR A 137 13.486 4.801 11.553 1.00 1.57 H new ATOM 0 HE1 TYR A 137 17.810 5.449 13.906 1.00 2.64 H new ATOM 0 HE2 TYR A 137 14.925 2.846 12.082 1.00 1.54 H new ATOM 0 HH TYR A 137 16.588 2.109 13.387 1.00 1.74 H new ATOM 2072 N LYS A 138 12.141 9.798 12.899 1.00 0.74 N ATOM 2073 CA LYS A 138 10.919 10.536 12.599 1.00 0.81 C ATOM 2074 C LYS A 138 10.839 10.881 11.116 1.00 0.66 C ATOM 2075 O LYS A 138 11.862 11.033 10.444 1.00 0.62 O ATOM 2076 CB LYS A 138 10.683 11.739 13.528 1.00 1.30 C ATOM 2077 CG LYS A 138 11.631 12.932 13.346 1.00 1.65 C ATOM 2078 CD LYS A 138 13.034 12.716 13.923 1.00 1.55 C ATOM 2079 CE LYS A 138 13.067 12.719 15.455 1.00 2.79 C ATOM 2080 NZ LYS A 138 14.431 12.464 15.959 1.00 3.38 N ATOM 0 H LYS A 138 12.970 10.122 12.401 1.00 0.74 H new ATOM 0 HA LYS A 138 10.083 9.871 12.815 1.00 0.81 H new ATOM 0 HB2 LYS A 138 9.661 12.088 13.383 1.00 1.30 H new ATOM 0 HB3 LYS A 138 10.759 11.395 14.560 1.00 1.30 H new ATOM 0 HG2 LYS A 138 11.718 13.153 12.282 1.00 1.65 H new ATOM 0 HG3 LYS A 138 11.188 13.809 13.818 1.00 1.65 H new ATOM 0 HD2 LYS A 138 13.426 11.766 13.560 1.00 1.55 H new ATOM 0 HD3 LYS A 138 13.697 13.497 13.551 1.00 1.55 H new ATOM 0 HE2 LYS A 138 12.712 13.680 15.827 1.00 2.79 H new ATOM 0 HE3 LYS A 138 12.387 11.958 15.838 1.00 2.79 H new ATOM 0 HZ1 LYS A 138 14.424 12.472 16.999 1.00 3.38 H new ATOM 0 HZ2 LYS A 138 14.758 11.536 15.622 1.00 3.38 H new ATOM 0 HZ3 LYS A 138 15.073 13.204 15.612 1.00 3.38 H new ATOM 2094 N LEU A 139 9.602 10.991 10.623 1.00 0.68 N ATOM 2095 CA LEU A 139 9.300 11.471 9.288 1.00 0.64 C ATOM 2096 C LEU A 139 8.921 12.940 9.362 1.00 0.61 C ATOM 2097 O LEU A 139 8.185 13.351 10.260 1.00 0.77 O ATOM 2098 CB LEU A 139 8.134 10.697 8.673 1.00 0.91 C ATOM 2099 CG LEU A 139 8.490 9.262 8.283 1.00 0.44 C ATOM 2100 CD1 LEU A 139 7.205 8.587 7.808 1.00 1.42 C ATOM 2101 CD2 LEU A 139 9.524 9.217 7.152 1.00 1.16 C ATOM 0 H LEU A 139 8.771 10.741 11.159 1.00 0.68 H new ATOM 0 HA LEU A 139 10.183 11.328 8.665 1.00 0.64 H new ATOM 0 HB2 LEU A 139 7.307 10.677 9.383 1.00 0.91 H new ATOM 0 HB3 LEU A 139 7.782 11.228 7.789 1.00 0.91 H new ATOM 0 HG LEU A 139 8.924 8.755 9.145 1.00 0.44 H new ATOM 0 HD11 LEU A 139 7.420 7.558 7.520 1.00 1.42 H new ATOM 0 HD12 LEU A 139 6.471 8.593 8.614 1.00 1.42 H new ATOM 0 HD13 LEU A 139 6.806 9.128 6.950 1.00 1.42 H new ATOM 0 HD21 LEU A 139 9.749 8.179 6.906 1.00 1.16 H new ATOM 0 HD22 LEU A 139 9.123 9.720 6.272 1.00 1.16 H new ATOM 0 HD23 LEU A 139 10.436 9.720 7.473 1.00 1.16 H new ATOM 2113 N LYS A 140 9.378 13.693 8.370 1.00 0.55 N ATOM 2114 CA LYS A 140 8.875 15.006 8.026 1.00 0.56 C ATOM 2115 C LYS A 140 8.082 14.874 6.730 1.00 0.47 C ATOM 2116 O LYS A 140 8.159 13.854 6.051 1.00 0.47 O ATOM 2117 CB LYS A 140 10.046 15.977 7.834 1.00 0.67 C ATOM 2118 CG LYS A 140 10.252 16.882 9.051 1.00 1.29 C ATOM 2119 CD LYS A 140 11.046 18.103 8.577 1.00 1.79 C ATOM 2120 CE LYS A 140 11.111 19.195 9.651 1.00 2.03 C ATOM 2121 NZ LYS A 140 11.292 20.525 9.036 1.00 2.77 N ATOM 0 H LYS A 140 10.139 13.389 7.762 1.00 0.55 H new ATOM 0 HA LYS A 140 8.238 15.394 8.821 1.00 0.56 H new ATOM 0 HB2 LYS A 140 10.958 15.411 7.646 1.00 0.67 H new ATOM 0 HB3 LYS A 140 9.865 16.592 6.952 1.00 0.67 H new ATOM 0 HG2 LYS A 140 9.293 17.186 9.471 1.00 1.29 H new ATOM 0 HG3 LYS A 140 10.792 16.353 9.837 1.00 1.29 H new ATOM 0 HD2 LYS A 140 12.057 17.797 8.309 1.00 1.79 H new ATOM 0 HD3 LYS A 140 10.586 18.507 7.675 1.00 1.79 H new ATOM 0 HE2 LYS A 140 10.196 19.184 10.243 1.00 2.03 H new ATOM 0 HE3 LYS A 140 11.935 18.990 10.335 1.00 2.03 H new ATOM 0 HZ1 LYS A 140 11.585 21.207 9.764 1.00 2.77 H new ATOM 0 HZ2 LYS A 140 12.023 20.470 8.299 1.00 2.77 H new ATOM 0 HZ3 LYS A 140 10.395 20.836 8.611 1.00 2.77 H new ATOM 2135 N LEU A 141 7.324 15.910 6.376 1.00 0.49 N ATOM 2136 CA LEU A 141 6.551 15.947 5.150 1.00 0.50 C ATOM 2137 C LEU A 141 7.122 17.057 4.272 1.00 0.64 C ATOM 2138 O LEU A 141 7.367 18.153 4.770 1.00 0.99 O ATOM 2139 CB LEU A 141 5.078 16.221 5.450 1.00 0.75 C ATOM 2140 CG LEU A 141 4.358 15.306 6.457 1.00 0.96 C ATOM 2141 CD1 LEU A 141 4.802 15.511 7.915 1.00 1.02 C ATOM 2142 CD2 LEU A 141 2.868 15.639 6.313 1.00 1.71 C ATOM 0 H LEU A 141 7.233 16.753 6.943 1.00 0.49 H new ATOM 0 HA LEU A 141 6.613 14.985 4.641 1.00 0.50 H new ATOM 0 HB2 LEU A 141 4.997 17.245 5.814 1.00 0.75 H new ATOM 0 HB3 LEU A 141 4.532 16.174 4.508 1.00 0.75 H new ATOM 0 HG LEU A 141 4.595 14.265 6.237 1.00 0.96 H new ATOM 0 HD11 LEU A 141 4.249 14.830 8.563 1.00 1.02 H new ATOM 0 HD12 LEU A 141 5.869 15.308 8.002 1.00 1.02 H new ATOM 0 HD13 LEU A 141 4.602 16.540 8.215 1.00 1.02 H new ATOM 0 HD21 LEU A 141 2.289 15.024 7.002 1.00 1.71 H new ATOM 0 HD22 LEU A 141 2.707 16.692 6.544 1.00 1.71 H new ATOM 0 HD23 LEU A 141 2.547 15.438 5.291 1.00 1.71 H new ATOM 2154 N LYS A 142 7.318 16.818 2.973 1.00 0.53 N ATOM 2155 CA LYS A 142 7.947 17.814 2.123 1.00 0.70 C ATOM 2156 C LYS A 142 6.905 18.847 1.720 1.00 0.93 C ATOM 2157 O LYS A 142 6.141 18.657 0.778 1.00 1.10 O ATOM 2158 CB LYS A 142 8.593 17.163 0.899 1.00 0.72 C ATOM 2159 CG LYS A 142 9.869 16.433 1.342 1.00 0.93 C ATOM 2160 CD LYS A 142 10.708 15.800 0.224 1.00 1.01 C ATOM 2161 CE LYS A 142 11.096 16.756 -0.913 1.00 1.91 C ATOM 2162 NZ LYS A 142 10.062 16.823 -1.965 1.00 3.19 N ATOM 0 H LYS A 142 7.053 15.955 2.499 1.00 0.53 H new ATOM 0 HA LYS A 142 8.746 18.311 2.674 1.00 0.70 H new ATOM 0 HB2 LYS A 142 7.899 16.462 0.434 1.00 0.72 H new ATOM 0 HB3 LYS A 142 8.831 17.919 0.151 1.00 0.72 H new ATOM 0 HG2 LYS A 142 10.497 17.139 1.884 1.00 0.93 H new ATOM 0 HG3 LYS A 142 9.589 15.650 2.046 1.00 0.93 H new ATOM 0 HD2 LYS A 142 11.618 15.390 0.661 1.00 1.01 H new ATOM 0 HD3 LYS A 142 10.152 14.963 -0.198 1.00 1.01 H new ATOM 0 HE2 LYS A 142 11.262 17.753 -0.506 1.00 1.91 H new ATOM 0 HE3 LYS A 142 12.039 16.430 -1.353 1.00 1.91 H new ATOM 0 HZ1 LYS A 142 10.479 17.204 -2.838 1.00 3.19 H new ATOM 0 HZ2 LYS A 142 9.690 15.869 -2.147 1.00 3.19 H new ATOM 0 HZ3 LYS A 142 9.288 17.443 -1.652 1.00 3.19 H new ATOM 2176 N GLY A 143 6.856 19.939 2.477 1.00 1.15 N ATOM 2177 CA GLY A 143 5.999 21.078 2.186 1.00 1.48 C ATOM 2178 C GLY A 143 4.611 20.853 2.766 1.00 1.58 C ATOM 2179 O GLY A 143 4.096 21.724 3.466 1.00 1.99 O ATOM 0 H GLY A 143 7.418 20.057 3.320 1.00 1.15 H new ATOM 0 HA2 GLY A 143 6.433 21.986 2.605 1.00 1.48 H new ATOM 0 HA3 GLY A 143 5.931 21.225 1.108 1.00 1.48 H new ATOM 2183 N GLU A 144 4.064 19.654 2.548 1.00 1.41 N ATOM 2184 CA GLU A 144 2.766 19.200 3.047 1.00 1.69 C ATOM 2185 C GLU A 144 2.505 19.550 4.525 1.00 2.72 C ATOM 2186 O GLU A 144 1.362 19.758 4.919 1.00 2.75 O ATOM 2187 CB GLU A 144 2.623 17.707 2.704 1.00 1.64 C ATOM 2188 CG GLU A 144 1.384 16.996 3.274 1.00 2.50 C ATOM 2189 CD GLU A 144 0.062 17.487 2.693 1.00 3.56 C ATOM 2190 OE1 GLU A 144 0.110 18.207 1.673 1.00 4.22 O ATOM 2191 OE2 GLU A 144 -0.974 17.100 3.274 1.00 4.48 O ATOM 0 H GLU A 144 4.537 18.941 1.993 1.00 1.41 H new ATOM 0 HA GLU A 144 1.971 19.751 2.545 1.00 1.69 H new ATOM 0 HB2 GLU A 144 2.608 17.604 1.619 1.00 1.64 H new ATOM 0 HB3 GLU A 144 3.512 17.187 3.061 1.00 1.64 H new ATOM 0 HG2 GLU A 144 1.475 15.926 3.088 1.00 2.50 H new ATOM 0 HG3 GLU A 144 1.366 17.132 4.355 1.00 2.50 H new ATOM 2198 N GLN A 145 3.553 19.672 5.344 1.00 4.13 N ATOM 2199 CA GLN A 145 3.478 20.337 6.649 1.00 5.53 C ATOM 2200 C GLN A 145 4.715 21.198 6.955 1.00 6.76 C ATOM 2201 O GLN A 145 4.958 21.553 8.106 1.00 8.57 O ATOM 2202 CB GLN A 145 3.260 19.296 7.746 1.00 6.27 C ATOM 2203 CG GLN A 145 1.786 18.897 7.894 1.00 6.30 C ATOM 2204 CD GLN A 145 1.550 17.965 9.080 1.00 7.56 C ATOM 2205 OE1 GLN A 145 2.464 17.321 9.588 1.00 8.57 O ATOM 2206 NE2 GLN A 145 0.306 17.885 9.545 1.00 7.88 N ATOM 0 H GLN A 145 4.481 19.311 5.121 1.00 4.13 H new ATOM 0 HA GLN A 145 2.630 21.021 6.617 1.00 5.53 H new ATOM 0 HB2 GLN A 145 3.852 18.409 7.523 1.00 6.27 H new ATOM 0 HB3 GLN A 145 3.623 19.691 8.695 1.00 6.27 H new ATOM 0 HG2 GLN A 145 1.180 19.795 8.015 1.00 6.30 H new ATOM 0 HG3 GLN A 145 1.452 18.408 6.979 1.00 6.30 H new ATOM 0 HE21 GLN A 145 -0.438 18.429 9.108 1.00 7.88 H new ATOM 0 HE22 GLN A 145 0.096 17.280 10.339 1.00 7.88 H new ATOM 2215 N ASP A 146 5.475 21.560 5.925 1.00 5.90 N ATOM 2216 CA ASP A 146 6.687 22.376 6.033 1.00 6.95 C ATOM 2217 C ASP A 146 6.570 23.670 5.215 1.00 6.63 C ATOM 2218 O ASP A 146 7.506 24.461 5.165 1.00 7.62 O ATOM 2219 CB ASP A 146 7.919 21.530 5.646 1.00 7.62 C ATOM 2220 CG ASP A 146 9.073 21.650 6.642 1.00 8.96 C ATOM 2221 OD1 ASP A 146 9.075 20.880 7.630 1.00 10.22 O ATOM 2222 OD2 ASP A 146 9.997 22.450 6.404 1.00 9.06 O ATOM 0 H ASP A 146 5.262 21.288 4.965 1.00 5.90 H new ATOM 0 HA ASP A 146 6.814 22.693 7.068 1.00 6.95 H new ATOM 0 HB2 ASP A 146 7.623 20.484 5.568 1.00 7.62 H new ATOM 0 HB3 ASP A 146 8.266 21.837 4.660 1.00 7.62 H new ATOM 2227 N SER A 147 5.422 23.892 4.562 1.00 5.65 N ATOM 2228 CA SER A 147 5.172 25.071 3.735 1.00 5.88 C ATOM 2229 C SER A 147 3.675 25.240 3.435 1.00 5.98 C ATOM 2230 O SER A 147 3.323 25.695 2.346 1.00 6.40 O ATOM 2231 CB SER A 147 5.992 24.974 2.435 1.00 5.95 C ATOM 2232 OG SER A 147 5.865 26.149 1.655 1.00 5.90 O ATOM 0 H SER A 147 4.633 23.247 4.596 1.00 5.65 H new ATOM 0 HA SER A 147 5.488 25.956 4.287 1.00 5.88 H new ATOM 0 HB2 SER A 147 7.042 24.808 2.677 1.00 5.95 H new ATOM 0 HB3 SER A 147 5.658 24.113 1.856 1.00 5.95 H new ATOM 0 HG SER A 147 4.919 26.397 1.588 1.00 5.90 H new ATOM 2238 N ILE A 148 2.792 24.883 4.374 1.00 6.07 N ATOM 2239 CA ILE A 148 1.354 25.086 4.197 1.00 6.73 C ATOM 2240 C ILE A 148 0.989 26.561 4.398 1.00 8.13 C ATOM 2241 O ILE A 148 0.567 27.223 3.451 1.00 8.57 O ATOM 2242 CB ILE A 148 0.555 24.144 5.119 1.00 7.17 C ATOM 2243 CG1 ILE A 148 0.741 22.670 4.720 1.00 6.63 C ATOM 2244 CG2 ILE A 148 -0.942 24.492 5.149 1.00 8.08 C ATOM 2245 CD1 ILE A 148 0.241 22.313 3.312 1.00 6.91 C ATOM 0 H ILE A 148 3.050 24.453 5.262 1.00 6.07 H new ATOM 0 HA ILE A 148 1.081 24.830 3.173 1.00 6.73 H new ATOM 0 HB ILE A 148 0.956 24.288 6.122 1.00 7.17 H new ATOM 0 HG12 ILE A 148 1.800 22.421 4.788 1.00 6.63 H new ATOM 0 HG13 ILE A 148 0.220 22.044 5.444 1.00 6.63 H new ATOM 0 HG21 ILE A 148 -1.463 23.801 5.812 1.00 8.08 H new ATOM 0 HG22 ILE A 148 -1.071 25.511 5.513 1.00 8.08 H new ATOM 0 HG23 ILE A 148 -1.355 24.411 4.143 1.00 8.08 H new ATOM 0 HD11 ILE A 148 0.415 21.254 3.122 1.00 6.91 H new ATOM 0 HD12 ILE A 148 -0.826 22.524 3.240 1.00 6.91 H new ATOM 0 HD13 ILE A 148 0.779 22.907 2.573 1.00 6.91 H new ATOM 2257 N GLU A 149 1.114 27.061 5.631 1.00 9.26 N ATOM 2258 CA GLU A 149 0.809 28.447 5.976 1.00 10.94 C ATOM 2259 C GLU A 149 2.111 29.254 5.954 1.00 11.71 C ATOM 2260 O GLU A 149 3.188 28.707 5.714 1.00 11.58 O ATOM 2261 CB GLU A 149 0.075 28.496 7.337 1.00 12.38 C ATOM 2262 CG GLU A 149 -1.163 29.420 7.377 1.00 13.61 C ATOM 2263 CD GLU A 149 -0.924 30.752 8.083 1.00 15.14 C ATOM 2264 OE1 GLU A 149 0.009 31.465 7.653 1.00 15.39 O ATOM 2265 OE2 GLU A 149 -1.684 31.051 9.028 1.00 16.24 O ATOM 0 H GLU A 149 1.434 26.506 6.425 1.00 9.26 H new ATOM 0 HA GLU A 149 0.134 28.898 5.249 1.00 10.94 H new ATOM 0 HB2 GLU A 149 -0.236 27.485 7.602 1.00 12.38 H new ATOM 0 HB3 GLU A 149 0.780 28.824 8.101 1.00 12.38 H new ATOM 0 HG2 GLU A 149 -1.490 29.616 6.356 1.00 13.61 H new ATOM 0 HG3 GLU A 149 -1.978 28.897 7.878 1.00 13.61 H new ATOM 2272 N GLY A 150 2.002 30.561 6.185 1.00 12.84 N ATOM 2273 CA GLY A 150 3.125 31.464 6.354 1.00 14.12 C ATOM 2274 C GLY A 150 3.519 31.553 7.827 1.00 15.23 C ATOM 2275 O GLY A 150 4.704 31.654 8.139 1.00 16.00 O ATOM 0 H GLY A 150 1.099 31.029 6.261 1.00 12.84 H new ATOM 0 HA2 GLY A 150 3.973 31.115 5.765 1.00 14.12 H new ATOM 0 HA3 GLY A 150 2.863 32.454 5.980 1.00 14.12 H new ATOM 2279 N ARG A 151 2.525 31.563 8.719 1.00 15.57 N ATOM 2280 CA ARG A 151 2.721 31.564 10.161 1.00 16.82 C ATOM 2281 C ARG A 151 2.781 30.139 10.715 1.00 17.05 C ATOM 2282 O ARG A 151 3.031 30.031 11.937 1.00 17.97 O ATOM 2283 CB ARG A 151 1.587 32.350 10.829 1.00 17.32 C ATOM 2284 CG ARG A 151 1.605 33.819 10.384 1.00 17.69 C ATOM 2285 CD ARG A 151 0.554 34.647 11.128 1.00 18.23 C ATOM 2286 NE ARG A 151 0.833 34.690 12.572 1.00 19.29 N ATOM 2287 CZ ARG A 151 0.165 35.437 13.464 1.00 20.13 C ATOM 2288 NH1 ARG A 151 -0.839 36.220 13.052 1.00 20.05 N ATOM 2289 NH2 ARG A 151 0.505 35.401 14.758 1.00 21.22 N ATOM 2290 OXT ARG A 151 2.563 29.188 9.931 1.00 16.57 O ATOM 0 H ARG A 151 1.542 31.571 8.447 1.00 15.57 H new ATOM 0 HA ARG A 151 3.675 32.043 10.382 1.00 16.82 H new ATOM 0 HB2 ARG A 151 0.628 31.900 10.574 1.00 17.32 H new ATOM 0 HB3 ARG A 151 1.688 32.293 11.913 1.00 17.32 H new ATOM 0 HG2 ARG A 151 2.594 34.241 10.562 1.00 17.69 H new ATOM 0 HG3 ARG A 151 1.422 33.877 9.311 1.00 17.69 H new ATOM 0 HD2 ARG A 151 0.537 35.661 10.728 1.00 18.23 H new ATOM 0 HD3 ARG A 151 -0.435 34.221 10.959 1.00 18.23 H new ATOM 0 HE ARG A 151 1.593 34.107 12.922 1.00 19.29 H new ATOM 0 HH11 ARG A 151 -1.093 36.247 12.064 1.00 20.05 H new ATOM 0 HH12 ARG A 151 -1.351 36.790 13.726 1.00 20.05 H new ATOM 0 HH21 ARG A 151 1.273 34.805 15.067 1.00 21.22 H new ATOM 0 HH22 ARG A 151 -0.004 35.970 15.435 1.00 21.22 H new TER 2304 ARG A 151