USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 785 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 54 GLN : amide:sc= 1.52 K(o=2.1,f=0.28) USER MOD Set 1.2: A 59 SER OG : rot 180:sc= 0.563 USER MOD Set 2.1: A 25 THR OG1 : rot -72:sc= 1.15 USER MOD Set 2.2: A 27 SER OG : rot 109:sc= 1.3 USER MOD Set 2.3: A 31 GLN : amide:sc= 1 K(o=5.8,f=-3!) USER MOD Set 2.4: A 53 LYS NZ :NH3+ -165:sc= 2.32 (180deg=0.683) USER MOD Set 3.1: A 10 ASN : amide:sc= 0.385 K(o=0.84,f=0.058) USER MOD Set 3.2: A 11 HIS : no HD1:sc= 0.454 K(o=0.84,f=-0.9) USER MOD Single : A 1 SER N :NH3+ 135:sc= 0.0366 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0.00248 USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.233 USER MOD Single : A 30 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 36 MET CE :methyl 180:sc= -0.222 (180deg=-0.222) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot -90:sc= 1.25 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 180:sc=-0.000857 USER MOD Single : A 55 THR OG1 : rot 120:sc= -0.429 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00126) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 173:sc= 1.3 (180deg=1.24) USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0.00338 USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 GLN : amide:sc= 0.575 K(o=0.58,f=-5.1!) USER MOD Single : A 90 ASN : amide:sc= 0.51 K(o=0.51,f=-4!) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 0.245 -13.582 -4.054 1.00 0.00 N ATOM 2 CA SER A 1 -1.003 -12.806 -4.298 1.00 0.00 C ATOM 3 C SER A 1 -0.713 -11.418 -4.886 1.00 0.00 C ATOM 4 O SER A 1 0.348 -10.845 -4.633 1.00 0.00 O ATOM 5 CB SER A 1 -1.838 -12.679 -3.014 1.00 0.00 C ATOM 6 OG SER A 1 -2.105 -13.976 -2.497 1.00 0.00 O ATOM 0 H1 SER A 1 0.198 -14.030 -3.116 1.00 0.00 H new ATOM 0 H2 SER A 1 0.345 -14.316 -4.784 1.00 0.00 H new ATOM 0 H3 SER A 1 1.064 -12.943 -4.091 1.00 0.00 H new ATOM 0 HA SER A 1 -1.581 -13.363 -5.035 1.00 0.00 H new ATOM 0 HB2 SER A 1 -1.302 -12.084 -2.275 1.00 0.00 H new ATOM 0 HB3 SER A 1 -2.773 -12.159 -3.224 1.00 0.00 H new ATOM 0 HG SER A 1 -2.636 -13.898 -1.677 1.00 0.00 H new ATOM 14 N VAL A 2 -1.651 -10.862 -5.670 1.00 0.00 N ATOM 15 CA VAL A 2 -1.482 -9.573 -6.393 1.00 0.00 C ATOM 16 C VAL A 2 -2.079 -8.348 -5.679 1.00 0.00 C ATOM 17 O VAL A 2 -1.816 -7.216 -6.089 1.00 0.00 O ATOM 18 CB VAL A 2 -2.001 -9.663 -7.845 1.00 0.00 C ATOM 19 CG1 VAL A 2 -1.232 -10.722 -8.644 1.00 0.00 C ATOM 20 CG2 VAL A 2 -3.502 -9.969 -7.938 1.00 0.00 C ATOM 0 H VAL A 2 -2.562 -11.293 -5.827 1.00 0.00 H new ATOM 0 HA VAL A 2 -0.405 -9.408 -6.406 1.00 0.00 H new ATOM 0 HB VAL A 2 -1.834 -8.674 -8.271 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -1.620 -10.762 -9.662 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -0.174 -10.462 -8.669 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -1.355 -11.696 -8.170 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -3.799 -10.018 -8.986 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -3.709 -10.925 -7.457 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -4.066 -9.182 -7.438 1.00 0.00 H new ATOM 30 N SER A 3 -2.871 -8.546 -4.617 1.00 0.00 N ATOM 31 CA SER A 3 -3.489 -7.456 -3.844 1.00 0.00 C ATOM 32 C SER A 3 -2.473 -6.709 -2.959 1.00 0.00 C ATOM 33 O SER A 3 -1.440 -7.260 -2.563 1.00 0.00 O ATOM 34 CB SER A 3 -4.659 -7.993 -3.012 1.00 0.00 C ATOM 35 OG SER A 3 -5.452 -6.913 -2.541 1.00 0.00 O ATOM 0 H SER A 3 -3.104 -9.475 -4.266 1.00 0.00 H new ATOM 0 HA SER A 3 -3.870 -6.726 -4.558 1.00 0.00 H new ATOM 0 HB2 SER A 3 -5.267 -8.666 -3.616 1.00 0.00 H new ATOM 0 HB3 SER A 3 -4.282 -8.573 -2.170 1.00 0.00 H new ATOM 0 HG SER A 3 -6.199 -7.262 -2.011 1.00 0.00 H new ATOM 41 N ILE A 4 -2.767 -5.441 -2.649 1.00 0.00 N ATOM 42 CA ILE A 4 -1.904 -4.540 -1.865 1.00 0.00 C ATOM 43 C ILE A 4 -1.922 -4.847 -0.357 1.00 0.00 C ATOM 44 O ILE A 4 -2.899 -5.375 0.181 1.00 0.00 O ATOM 45 CB ILE A 4 -2.211 -3.048 -2.148 1.00 0.00 C ATOM 46 CG1 ILE A 4 -3.536 -2.499 -1.562 1.00 0.00 C ATOM 47 CG2 ILE A 4 -2.087 -2.735 -3.651 1.00 0.00 C ATOM 48 CD1 ILE A 4 -4.842 -3.139 -2.057 1.00 0.00 C ATOM 0 H ILE A 4 -3.637 -4.997 -2.944 1.00 0.00 H new ATOM 0 HA ILE A 4 -0.887 -4.734 -2.204 1.00 0.00 H new ATOM 0 HB ILE A 4 -1.443 -2.508 -1.595 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -3.496 -2.608 -0.478 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -3.582 -1.431 -1.774 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -2.307 -1.681 -3.823 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -1.073 -2.953 -3.986 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -2.793 -3.349 -4.210 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -5.690 -2.661 -1.567 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -4.925 -3.008 -3.136 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -4.838 -4.203 -1.820 1.00 0.00 H new ATOM 60 N LEU A 5 -0.833 -4.484 0.333 1.00 0.00 N ATOM 61 CA LEU A 5 -0.681 -4.608 1.791 1.00 0.00 C ATOM 62 C LEU A 5 -1.151 -3.339 2.533 1.00 0.00 C ATOM 63 O LEU A 5 -1.254 -2.258 1.946 1.00 0.00 O ATOM 64 CB LEU A 5 0.784 -4.957 2.130 1.00 0.00 C ATOM 65 CG LEU A 5 1.317 -6.266 1.513 1.00 0.00 C ATOM 66 CD1 LEU A 5 2.777 -6.469 1.925 1.00 0.00 C ATOM 67 CD2 LEU A 5 0.524 -7.496 1.955 1.00 0.00 C ATOM 0 H LEU A 5 -0.010 -4.085 -0.119 1.00 0.00 H new ATOM 0 HA LEU A 5 -1.324 -5.417 2.137 1.00 0.00 H new ATOM 0 HB2 LEU A 5 1.420 -4.136 1.800 1.00 0.00 H new ATOM 0 HB3 LEU A 5 0.882 -5.021 3.214 1.00 0.00 H new ATOM 0 HG LEU A 5 1.216 -6.166 0.432 1.00 0.00 H new ATOM 0 HD11 LEU A 5 3.153 -7.394 1.489 1.00 0.00 H new ATOM 0 HD12 LEU A 5 3.375 -5.630 1.569 1.00 0.00 H new ATOM 0 HD13 LEU A 5 2.844 -6.527 3.011 1.00 0.00 H new ATOM 0 HD21 LEU A 5 0.945 -8.387 1.489 1.00 0.00 H new ATOM 0 HD22 LEU A 5 0.578 -7.593 3.039 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -0.517 -7.386 1.652 1.00 0.00 H new ATOM 79 N ARG A 6 -1.405 -3.463 3.846 1.00 0.00 N ATOM 80 CA ARG A 6 -1.851 -2.352 4.721 1.00 0.00 C ATOM 81 C ARG A 6 -0.752 -1.315 5.014 1.00 0.00 C ATOM 82 O ARG A 6 -1.066 -0.166 5.331 1.00 0.00 O ATOM 83 CB ARG A 6 -2.421 -2.918 6.035 1.00 0.00 C ATOM 84 CG ARG A 6 -3.712 -3.729 5.818 1.00 0.00 C ATOM 85 CD ARG A 6 -4.290 -4.266 7.136 1.00 0.00 C ATOM 86 NE ARG A 6 -4.803 -3.187 8.005 1.00 0.00 N ATOM 87 CZ ARG A 6 -5.214 -3.310 9.256 1.00 0.00 C ATOM 88 NH1 ARG A 6 -5.215 -4.457 9.878 1.00 0.00 N ATOM 89 NH2 ARG A 6 -5.644 -2.271 9.915 1.00 0.00 N ATOM 0 H ARG A 6 -1.307 -4.349 4.342 1.00 0.00 H new ATOM 0 HA ARG A 6 -2.628 -1.818 4.174 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -1.672 -3.553 6.508 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -2.623 -2.097 6.723 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -4.455 -3.101 5.327 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -3.506 -4.563 5.147 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -5.095 -4.967 6.918 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -3.518 -4.822 7.668 1.00 0.00 H new ATOM 0 HE ARG A 6 -4.844 -2.252 7.599 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -4.891 -5.297 9.399 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -5.539 -4.513 10.843 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -5.665 -1.355 9.466 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -5.959 -2.374 10.880 1.00 0.00 H new ATOM 103 N SER A 7 0.516 -1.710 4.871 1.00 0.00 N ATOM 104 CA SER A 7 1.714 -0.877 5.075 1.00 0.00 C ATOM 105 C SER A 7 2.739 -1.077 3.947 1.00 0.00 C ATOM 106 O SER A 7 2.770 -2.131 3.306 1.00 0.00 O ATOM 107 CB SER A 7 2.370 -1.203 6.428 1.00 0.00 C ATOM 108 OG SER A 7 1.472 -0.958 7.504 1.00 0.00 O ATOM 0 H SER A 7 0.751 -2.664 4.597 1.00 0.00 H new ATOM 0 HA SER A 7 1.393 0.164 5.067 1.00 0.00 H new ATOM 0 HB2 SER A 7 2.683 -2.247 6.442 1.00 0.00 H new ATOM 0 HB3 SER A 7 3.268 -0.599 6.555 1.00 0.00 H new ATOM 0 HG SER A 7 1.912 -1.174 8.353 1.00 0.00 H new ATOM 114 N SER A 8 3.591 -0.074 3.714 1.00 0.00 N ATOM 115 CA SER A 8 4.642 -0.087 2.682 1.00 0.00 C ATOM 116 C SER A 8 5.918 0.635 3.135 1.00 0.00 C ATOM 117 O SER A 8 5.876 1.539 3.973 1.00 0.00 O ATOM 118 CB SER A 8 4.104 0.539 1.389 1.00 0.00 C ATOM 119 OG SER A 8 5.071 0.463 0.353 1.00 0.00 O ATOM 0 H SER A 8 3.571 0.794 4.250 1.00 0.00 H new ATOM 0 HA SER A 8 4.915 -1.127 2.503 1.00 0.00 H new ATOM 0 HB2 SER A 8 3.194 0.024 1.082 1.00 0.00 H new ATOM 0 HB3 SER A 8 3.837 1.580 1.568 1.00 0.00 H new ATOM 0 HG SER A 8 4.708 0.866 -0.463 1.00 0.00 H new ATOM 125 N VAL A 9 7.059 0.237 2.558 1.00 0.00 N ATOM 126 CA VAL A 9 8.397 0.823 2.791 1.00 0.00 C ATOM 127 C VAL A 9 9.015 1.451 1.529 1.00 0.00 C ATOM 128 O VAL A 9 10.190 1.810 1.538 1.00 0.00 O ATOM 129 CB VAL A 9 9.348 -0.189 3.470 1.00 0.00 C ATOM 130 CG1 VAL A 9 8.834 -0.590 4.859 1.00 0.00 C ATOM 131 CG2 VAL A 9 9.581 -1.457 2.640 1.00 0.00 C ATOM 0 H VAL A 9 7.083 -0.532 1.889 1.00 0.00 H new ATOM 0 HA VAL A 9 8.252 1.651 3.485 1.00 0.00 H new ATOM 0 HB VAL A 9 10.303 0.330 3.560 1.00 0.00 H new ATOM 0 HG11 VAL A 9 9.524 -1.302 5.311 1.00 0.00 H new ATOM 0 HG12 VAL A 9 8.762 0.296 5.490 1.00 0.00 H new ATOM 0 HG13 VAL A 9 7.850 -1.049 4.764 1.00 0.00 H new ATOM 0 HG21 VAL A 9 10.257 -2.123 3.175 1.00 0.00 H new ATOM 0 HG22 VAL A 9 8.630 -1.963 2.474 1.00 0.00 H new ATOM 0 HG23 VAL A 9 10.021 -1.188 1.680 1.00 0.00 H new ATOM 141 N ASN A 10 8.232 1.620 0.452 1.00 0.00 N ATOM 142 CA ASN A 10 8.680 2.077 -0.876 1.00 0.00 C ATOM 143 C ASN A 10 9.610 3.302 -0.841 1.00 0.00 C ATOM 144 O ASN A 10 10.626 3.345 -1.535 1.00 0.00 O ATOM 145 CB ASN A 10 7.415 2.394 -1.703 1.00 0.00 C ATOM 146 CG ASN A 10 7.733 2.936 -3.092 1.00 0.00 C ATOM 147 OD1 ASN A 10 7.919 2.189 -4.042 1.00 0.00 O ATOM 148 ND2 ASN A 10 7.821 4.240 -3.259 1.00 0.00 N ATOM 0 H ASN A 10 7.229 1.435 0.482 1.00 0.00 H new ATOM 0 HA ASN A 10 9.277 1.281 -1.322 1.00 0.00 H new ATOM 0 HB2 ASN A 10 6.815 1.489 -1.800 1.00 0.00 H new ATOM 0 HB3 ASN A 10 6.808 3.122 -1.165 1.00 0.00 H new ATOM 0 HD21 ASN A 10 8.043 4.623 -4.178 1.00 0.00 H new ATOM 0 HD22 ASN A 10 7.667 4.867 -2.469 1.00 0.00 H new ATOM 155 N HIS A 11 9.283 4.298 -0.013 1.00 0.00 N ATOM 156 CA HIS A 11 10.004 5.576 0.019 1.00 0.00 C ATOM 157 C HIS A 11 11.419 5.478 0.606 1.00 0.00 C ATOM 158 O HIS A 11 12.235 6.348 0.313 1.00 0.00 O ATOM 159 CB HIS A 11 9.134 6.640 0.700 1.00 0.00 C ATOM 160 CG HIS A 11 7.885 6.960 -0.089 1.00 0.00 C ATOM 161 ND1 HIS A 11 7.744 6.824 -1.476 1.00 0.00 N ATOM 162 CD2 HIS A 11 6.709 7.412 0.429 1.00 0.00 C ATOM 163 CE1 HIS A 11 6.478 7.185 -1.753 1.00 0.00 C ATOM 164 NE2 HIS A 11 5.838 7.550 -0.629 1.00 0.00 N ATOM 0 H HIS A 11 8.513 4.243 0.653 1.00 0.00 H new ATOM 0 HA HIS A 11 10.179 5.885 -1.012 1.00 0.00 H new ATOM 0 HB2 HIS A 11 8.853 6.292 1.694 1.00 0.00 H new ATOM 0 HB3 HIS A 11 9.718 7.550 0.834 1.00 0.00 H new ATOM 0 HD2 HIS A 11 6.500 7.621 1.468 1.00 0.00 H new ATOM 0 HE1 HIS A 11 6.038 7.182 -2.739 1.00 0.00 H new ATOM 0 HE2 HIS A 11 4.873 7.874 -0.570 1.00 0.00 H new ATOM 172 N ARG A 12 11.768 4.396 1.321 1.00 0.00 N ATOM 173 CA ARG A 12 13.163 4.127 1.735 1.00 0.00 C ATOM 174 C ARG A 12 14.086 3.926 0.531 1.00 0.00 C ATOM 175 O ARG A 12 15.193 4.454 0.500 1.00 0.00 O ATOM 176 CB ARG A 12 13.239 2.880 2.634 1.00 0.00 C ATOM 177 CG ARG A 12 12.466 3.032 3.953 1.00 0.00 C ATOM 178 CD ARG A 12 12.681 1.808 4.852 1.00 0.00 C ATOM 179 NE ARG A 12 11.854 1.887 6.074 1.00 0.00 N ATOM 180 CZ ARG A 12 11.738 0.966 7.014 1.00 0.00 C ATOM 181 NH1 ARG A 12 12.372 -0.172 6.954 1.00 0.00 N ATOM 182 NH2 ARG A 12 10.971 1.171 8.047 1.00 0.00 N ATOM 0 H ARG A 12 11.102 3.687 1.628 1.00 0.00 H new ATOM 0 HA ARG A 12 13.498 5.003 2.291 1.00 0.00 H new ATOM 0 HB2 ARG A 12 12.846 2.023 2.088 1.00 0.00 H new ATOM 0 HB3 ARG A 12 14.284 2.664 2.856 1.00 0.00 H new ATOM 0 HG2 ARG A 12 12.795 3.932 4.471 1.00 0.00 H new ATOM 0 HG3 ARG A 12 11.403 3.155 3.745 1.00 0.00 H new ATOM 0 HD2 ARG A 12 12.433 0.901 4.301 1.00 0.00 H new ATOM 0 HD3 ARG A 12 13.733 1.736 5.127 1.00 0.00 H new ATOM 0 HE ARG A 12 11.316 2.743 6.206 1.00 0.00 H new ATOM 0 HH11 ARG A 12 12.982 -0.375 6.162 1.00 0.00 H new ATOM 0 HH12 ARG A 12 12.258 -0.859 7.699 1.00 0.00 H new ATOM 0 HH21 ARG A 12 10.455 2.047 8.134 1.00 0.00 H new ATOM 0 HH22 ARG A 12 10.886 0.456 8.769 1.00 0.00 H new ATOM 196 N GLU A 13 13.607 3.216 -0.490 1.00 0.00 N ATOM 197 CA GLU A 13 14.357 2.992 -1.736 1.00 0.00 C ATOM 198 C GLU A 13 14.459 4.277 -2.573 1.00 0.00 C ATOM 199 O GLU A 13 15.481 4.520 -3.211 1.00 0.00 O ATOM 200 CB GLU A 13 13.698 1.868 -2.548 1.00 0.00 C ATOM 201 CG GLU A 13 13.740 0.515 -1.827 1.00 0.00 C ATOM 202 CD GLU A 13 13.128 -0.592 -2.707 1.00 0.00 C ATOM 203 OE1 GLU A 13 13.869 -1.216 -3.508 1.00 0.00 O ATOM 204 OE2 GLU A 13 11.907 -0.857 -2.601 1.00 0.00 O ATOM 0 H GLU A 13 12.686 2.777 -0.481 1.00 0.00 H new ATOM 0 HA GLU A 13 15.372 2.694 -1.472 1.00 0.00 H new ATOM 0 HB2 GLU A 13 12.661 2.134 -2.754 1.00 0.00 H new ATOM 0 HB3 GLU A 13 14.201 1.778 -3.511 1.00 0.00 H new ATOM 0 HG2 GLU A 13 14.771 0.261 -1.580 1.00 0.00 H new ATOM 0 HG3 GLU A 13 13.194 0.582 -0.886 1.00 0.00 H new ATOM 211 N VAL A 14 13.435 5.141 -2.525 1.00 0.00 N ATOM 212 CA VAL A 14 13.463 6.466 -3.174 1.00 0.00 C ATOM 213 C VAL A 14 14.434 7.415 -2.458 1.00 0.00 C ATOM 214 O VAL A 14 15.220 8.097 -3.113 1.00 0.00 O ATOM 215 CB VAL A 14 12.055 7.087 -3.267 1.00 0.00 C ATOM 216 CG1 VAL A 14 12.085 8.369 -4.106 1.00 0.00 C ATOM 217 CG2 VAL A 14 11.039 6.143 -3.929 1.00 0.00 C ATOM 0 H VAL A 14 12.562 4.944 -2.036 1.00 0.00 H new ATOM 0 HA VAL A 14 13.824 6.318 -4.192 1.00 0.00 H new ATOM 0 HB VAL A 14 11.751 7.289 -2.240 1.00 0.00 H new ATOM 0 HG11 VAL A 14 11.082 8.792 -4.160 1.00 0.00 H new ATOM 0 HG12 VAL A 14 12.759 9.090 -3.644 1.00 0.00 H new ATOM 0 HG13 VAL A 14 12.436 8.137 -5.112 1.00 0.00 H new ATOM 0 HG21 VAL A 14 10.064 6.629 -3.970 1.00 0.00 H new ATOM 0 HG22 VAL A 14 11.368 5.905 -4.940 1.00 0.00 H new ATOM 0 HG23 VAL A 14 10.963 5.224 -3.347 1.00 0.00 H new ATOM 227 N ASP A 15 14.432 7.428 -1.122 1.00 0.00 N ATOM 228 CA ASP A 15 15.379 8.201 -0.309 1.00 0.00 C ATOM 229 C ASP A 15 16.832 7.751 -0.551 1.00 0.00 C ATOM 230 O ASP A 15 17.712 8.584 -0.775 1.00 0.00 O ATOM 231 CB ASP A 15 14.997 8.045 1.168 1.00 0.00 C ATOM 232 CG ASP A 15 15.821 8.981 2.064 1.00 0.00 C ATOM 233 OD1 ASP A 15 16.974 8.649 2.423 1.00 0.00 O ATOM 234 OD2 ASP A 15 15.327 10.082 2.389 1.00 0.00 O ATOM 0 H ASP A 15 13.764 6.895 -0.566 1.00 0.00 H new ATOM 0 HA ASP A 15 15.323 9.251 -0.597 1.00 0.00 H new ATOM 0 HB2 ASP A 15 13.936 8.259 1.295 1.00 0.00 H new ATOM 0 HB3 ASP A 15 15.153 7.012 1.478 1.00 0.00 H new ATOM 239 N GLU A 16 17.065 6.435 -0.608 1.00 0.00 N ATOM 240 CA GLU A 16 18.354 5.848 -0.980 1.00 0.00 C ATOM 241 C GLU A 16 18.779 6.231 -2.408 1.00 0.00 C ATOM 242 O GLU A 16 19.935 6.600 -2.618 1.00 0.00 O ATOM 243 CB GLU A 16 18.280 4.321 -0.808 1.00 0.00 C ATOM 244 CG GLU A 16 19.572 3.618 -1.241 1.00 0.00 C ATOM 245 CD GLU A 16 19.508 2.110 -0.925 1.00 0.00 C ATOM 246 OE1 GLU A 16 18.968 1.334 -1.751 1.00 0.00 O ATOM 247 OE2 GLU A 16 20.005 1.687 0.148 1.00 0.00 O ATOM 0 H GLU A 16 16.351 5.739 -0.393 1.00 0.00 H new ATOM 0 HA GLU A 16 19.121 6.251 -0.319 1.00 0.00 H new ATOM 0 HB2 GLU A 16 18.075 4.086 0.236 1.00 0.00 H new ATOM 0 HB3 GLU A 16 17.446 3.933 -1.392 1.00 0.00 H new ATOM 0 HG2 GLU A 16 19.730 3.764 -2.310 1.00 0.00 H new ATOM 0 HG3 GLU A 16 20.424 4.066 -0.729 1.00 0.00 H new ATOM 254 N ALA A 17 17.867 6.207 -3.386 1.00 0.00 N ATOM 255 CA ALA A 17 18.178 6.603 -4.760 1.00 0.00 C ATOM 256 C ALA A 17 18.521 8.105 -4.865 1.00 0.00 C ATOM 257 O ALA A 17 19.479 8.479 -5.549 1.00 0.00 O ATOM 258 CB ALA A 17 16.999 6.230 -5.666 1.00 0.00 C ATOM 0 H ALA A 17 16.900 5.914 -3.247 1.00 0.00 H new ATOM 0 HA ALA A 17 19.068 6.066 -5.088 1.00 0.00 H new ATOM 0 HB1 ALA A 17 17.222 6.522 -6.692 1.00 0.00 H new ATOM 0 HB2 ALA A 17 16.833 5.154 -5.623 1.00 0.00 H new ATOM 0 HB3 ALA A 17 16.102 6.749 -5.328 1.00 0.00 H new ATOM 264 N ILE A 18 17.796 8.961 -4.133 1.00 0.00 N ATOM 265 CA ILE A 18 18.113 10.392 -3.998 1.00 0.00 C ATOM 266 C ILE A 18 19.512 10.585 -3.396 1.00 0.00 C ATOM 267 O ILE A 18 20.314 11.326 -3.959 1.00 0.00 O ATOM 268 CB ILE A 18 16.993 11.106 -3.197 1.00 0.00 C ATOM 269 CG1 ILE A 18 15.789 11.340 -4.137 1.00 0.00 C ATOM 270 CG2 ILE A 18 17.466 12.428 -2.556 1.00 0.00 C ATOM 271 CD1 ILE A 18 14.499 11.785 -3.435 1.00 0.00 C ATOM 0 H ILE A 18 16.965 8.679 -3.613 1.00 0.00 H new ATOM 0 HA ILE A 18 18.145 10.858 -4.983 1.00 0.00 H new ATOM 0 HB ILE A 18 16.701 10.464 -2.366 1.00 0.00 H new ATOM 0 HG12 ILE A 18 16.063 12.095 -4.874 1.00 0.00 H new ATOM 0 HG13 ILE A 18 15.589 10.418 -4.684 1.00 0.00 H new ATOM 0 HG21 ILE A 18 16.640 12.883 -2.009 1.00 0.00 H new ATOM 0 HG22 ILE A 18 18.289 12.226 -1.870 1.00 0.00 H new ATOM 0 HG23 ILE A 18 17.804 13.110 -3.336 1.00 0.00 H new ATOM 0 HD11 ILE A 18 13.711 11.924 -4.175 1.00 0.00 H new ATOM 0 HD12 ILE A 18 14.193 11.023 -2.718 1.00 0.00 H new ATOM 0 HD13 ILE A 18 14.675 12.725 -2.912 1.00 0.00 H new ATOM 283 N ASP A 19 19.846 9.888 -2.306 1.00 0.00 N ATOM 284 CA ASP A 19 21.171 9.990 -1.683 1.00 0.00 C ATOM 285 C ASP A 19 22.295 9.423 -2.574 1.00 0.00 C ATOM 286 O ASP A 19 23.393 9.975 -2.621 1.00 0.00 O ATOM 287 CB ASP A 19 21.160 9.306 -0.309 1.00 0.00 C ATOM 288 CG ASP A 19 22.029 10.082 0.687 1.00 0.00 C ATOM 289 OD1 ASP A 19 21.471 10.988 1.354 1.00 0.00 O ATOM 290 OD2 ASP A 19 23.241 9.791 0.801 1.00 0.00 O ATOM 0 H ASP A 19 19.213 9.243 -1.833 1.00 0.00 H new ATOM 0 HA ASP A 19 21.389 11.050 -1.554 1.00 0.00 H new ATOM 0 HB2 ASP A 19 20.138 9.243 0.064 1.00 0.00 H new ATOM 0 HB3 ASP A 19 21.528 8.284 -0.402 1.00 0.00 H new ATOM 295 N ASN A 20 22.019 8.369 -3.347 1.00 0.00 N ATOM 296 CA ASN A 20 22.950 7.826 -4.336 1.00 0.00 C ATOM 297 C ASN A 20 23.240 8.830 -5.467 1.00 0.00 C ATOM 298 O ASN A 20 24.404 9.017 -5.818 1.00 0.00 O ATOM 299 CB ASN A 20 22.395 6.491 -4.864 1.00 0.00 C ATOM 300 CG ASN A 20 23.323 5.855 -5.888 1.00 0.00 C ATOM 301 OD1 ASN A 20 23.146 5.986 -7.089 1.00 0.00 O ATOM 302 ND2 ASN A 20 24.350 5.164 -5.445 1.00 0.00 N ATOM 0 H ASN A 20 21.134 7.865 -3.302 1.00 0.00 H new ATOM 0 HA ASN A 20 23.912 7.641 -3.858 1.00 0.00 H new ATOM 0 HB2 ASN A 20 22.249 5.804 -4.031 1.00 0.00 H new ATOM 0 HB3 ASN A 20 21.417 6.658 -5.315 1.00 0.00 H new ATOM 0 HD21 ASN A 20 25.000 4.737 -6.105 1.00 0.00 H new ATOM 0 HD22 ASN A 20 24.497 5.055 -4.441 1.00 0.00 H new ATOM 309 N ILE A 21 22.223 9.543 -5.972 1.00 0.00 N ATOM 310 CA ILE A 21 22.404 10.644 -6.938 1.00 0.00 C ATOM 311 C ILE A 21 23.190 11.805 -6.316 1.00 0.00 C ATOM 312 O ILE A 21 24.123 12.325 -6.930 1.00 0.00 O ATOM 313 CB ILE A 21 21.029 11.094 -7.498 1.00 0.00 C ATOM 314 CG1 ILE A 21 20.520 10.045 -8.509 1.00 0.00 C ATOM 315 CG2 ILE A 21 21.131 12.479 -8.165 1.00 0.00 C ATOM 316 CD1 ILE A 21 19.028 10.188 -8.843 1.00 0.00 C ATOM 0 H ILE A 21 21.248 9.374 -5.723 1.00 0.00 H new ATOM 0 HA ILE A 21 23.000 10.283 -7.777 1.00 0.00 H new ATOM 0 HB ILE A 21 20.322 11.174 -6.672 1.00 0.00 H new ATOM 0 HG12 ILE A 21 21.099 10.128 -9.429 1.00 0.00 H new ATOM 0 HG13 ILE A 21 20.700 9.048 -8.107 1.00 0.00 H new ATOM 0 HG21 ILE A 21 20.154 12.771 -8.549 1.00 0.00 H new ATOM 0 HG22 ILE A 21 21.466 13.212 -7.432 1.00 0.00 H new ATOM 0 HG23 ILE A 21 21.845 12.435 -8.987 1.00 0.00 H new ATOM 0 HD11 ILE A 21 18.740 9.418 -9.559 1.00 0.00 H new ATOM 0 HD12 ILE A 21 18.439 10.076 -7.933 1.00 0.00 H new ATOM 0 HD13 ILE A 21 18.844 11.172 -9.275 1.00 0.00 H new ATOM 328 N LEU A 22 22.854 12.174 -5.080 1.00 0.00 N ATOM 329 CA LEU A 22 23.523 13.230 -4.318 1.00 0.00 C ATOM 330 C LEU A 22 25.033 12.948 -4.158 1.00 0.00 C ATOM 331 O LEU A 22 25.858 13.839 -4.379 1.00 0.00 O ATOM 332 CB LEU A 22 22.792 13.302 -2.965 1.00 0.00 C ATOM 333 CG LEU A 22 23.161 14.476 -2.055 1.00 0.00 C ATOM 334 CD1 LEU A 22 22.566 15.775 -2.592 1.00 0.00 C ATOM 335 CD2 LEU A 22 22.589 14.231 -0.657 1.00 0.00 C ATOM 0 H LEU A 22 22.089 11.736 -4.567 1.00 0.00 H new ATOM 0 HA LEU A 22 23.472 14.188 -4.835 1.00 0.00 H new ATOM 0 HB2 LEU A 22 21.720 13.342 -3.157 1.00 0.00 H new ATOM 0 HB3 LEU A 22 22.984 12.376 -2.423 1.00 0.00 H new ATOM 0 HG LEU A 22 24.247 14.558 -2.020 1.00 0.00 H new ATOM 0 HD11 LEU A 22 22.838 16.600 -1.933 1.00 0.00 H new ATOM 0 HD12 LEU A 22 22.954 15.967 -3.592 1.00 0.00 H new ATOM 0 HD13 LEU A 22 21.480 15.688 -2.635 1.00 0.00 H new ATOM 0 HD21 LEU A 22 22.850 15.065 -0.006 1.00 0.00 H new ATOM 0 HD22 LEU A 22 21.504 14.144 -0.718 1.00 0.00 H new ATOM 0 HD23 LEU A 22 23.005 13.309 -0.250 1.00 0.00 H new ATOM 347 N ARG A 23 25.393 11.691 -3.851 1.00 0.00 N ATOM 348 CA ARG A 23 26.790 11.228 -3.743 1.00 0.00 C ATOM 349 C ARG A 23 27.484 11.139 -5.109 1.00 0.00 C ATOM 350 O ARG A 23 28.588 11.654 -5.265 1.00 0.00 O ATOM 351 CB ARG A 23 26.829 9.872 -2.999 1.00 0.00 C ATOM 352 CG ARG A 23 27.993 9.763 -1.998 1.00 0.00 C ATOM 353 CD ARG A 23 27.746 10.561 -0.705 1.00 0.00 C ATOM 354 NE ARG A 23 26.638 9.990 0.091 1.00 0.00 N ATOM 355 CZ ARG A 23 26.711 9.061 1.029 1.00 0.00 C ATOM 356 NH1 ARG A 23 27.835 8.496 1.376 1.00 0.00 N ATOM 357 NH2 ARG A 23 25.629 8.679 1.636 1.00 0.00 N ATOM 0 H ARG A 23 24.712 10.954 -3.668 1.00 0.00 H new ATOM 0 HA ARG A 23 27.349 11.967 -3.169 1.00 0.00 H new ATOM 0 HB2 ARG A 23 25.888 9.729 -2.469 1.00 0.00 H new ATOM 0 HB3 ARG A 23 26.909 9.067 -3.729 1.00 0.00 H new ATOM 0 HG2 ARG A 23 28.153 8.714 -1.747 1.00 0.00 H new ATOM 0 HG3 ARG A 23 28.907 10.121 -2.471 1.00 0.00 H new ATOM 0 HD2 ARG A 23 28.656 10.572 -0.105 1.00 0.00 H new ATOM 0 HD3 ARG A 23 27.517 11.597 -0.956 1.00 0.00 H new ATOM 0 HE ARG A 23 25.707 10.356 -0.107 1.00 0.00 H new ATOM 0 HH11 ARG A 23 28.705 8.767 0.918 1.00 0.00 H new ATOM 0 HH12 ARG A 23 27.844 7.783 2.106 1.00 0.00 H new ATOM 0 HH21 ARG A 23 24.731 9.095 1.388 1.00 0.00 H new ATOM 0 HH22 ARG A 23 25.677 7.963 2.361 1.00 0.00 H new ATOM 371 N TYR A 24 26.821 10.544 -6.105 1.00 0.00 N ATOM 372 CA TYR A 24 27.348 10.357 -7.465 1.00 0.00 C ATOM 373 C TYR A 24 27.699 11.685 -8.157 1.00 0.00 C ATOM 374 O TYR A 24 28.770 11.813 -8.754 1.00 0.00 O ATOM 375 CB TYR A 24 26.311 9.577 -8.288 1.00 0.00 C ATOM 376 CG TYR A 24 26.559 9.551 -9.789 1.00 0.00 C ATOM 377 CD1 TYR A 24 27.707 8.921 -10.307 1.00 0.00 C ATOM 378 CD2 TYR A 24 25.644 10.173 -10.663 1.00 0.00 C ATOM 379 CE1 TYR A 24 27.945 8.918 -11.696 1.00 0.00 C ATOM 380 CE2 TYR A 24 25.876 10.167 -12.049 1.00 0.00 C ATOM 381 CZ TYR A 24 27.030 9.546 -12.572 1.00 0.00 C ATOM 382 OH TYR A 24 27.240 9.548 -13.919 1.00 0.00 O ATOM 0 H TYR A 24 25.880 10.169 -5.988 1.00 0.00 H new ATOM 0 HA TYR A 24 28.281 9.797 -7.395 1.00 0.00 H new ATOM 0 HB2 TYR A 24 26.280 8.550 -7.924 1.00 0.00 H new ATOM 0 HB3 TYR A 24 25.327 10.010 -8.106 1.00 0.00 H new ATOM 0 HD1 TYR A 24 28.406 8.440 -9.639 1.00 0.00 H new ATOM 0 HD2 TYR A 24 24.763 10.655 -10.266 1.00 0.00 H new ATOM 0 HE1 TYR A 24 28.827 8.436 -12.092 1.00 0.00 H new ATOM 0 HE2 TYR A 24 25.169 10.639 -12.716 1.00 0.00 H new ATOM 0 HH TYR A 24 26.508 10.025 -14.363 1.00 0.00 H new ATOM 392 N THR A 25 26.822 12.689 -8.045 1.00 0.00 N ATOM 393 CA THR A 25 27.050 14.015 -8.649 1.00 0.00 C ATOM 394 C THR A 25 27.929 14.940 -7.790 1.00 0.00 C ATOM 395 O THR A 25 28.300 16.019 -8.252 1.00 0.00 O ATOM 396 CB THR A 25 25.735 14.719 -9.001 1.00 0.00 C ATOM 397 OG1 THR A 25 25.020 15.029 -7.828 1.00 0.00 O ATOM 398 CG2 THR A 25 24.812 13.913 -9.912 1.00 0.00 C ATOM 0 H THR A 25 25.940 12.611 -7.538 1.00 0.00 H new ATOM 0 HA THR A 25 27.600 13.814 -9.569 1.00 0.00 H new ATOM 0 HB THR A 25 26.032 15.615 -9.545 1.00 0.00 H new ATOM 0 HG1 THR A 25 24.653 14.207 -7.441 1.00 0.00 H new ATOM 0 HG21 THR A 25 23.906 14.485 -10.110 1.00 0.00 H new ATOM 0 HG22 THR A 25 25.322 13.703 -10.852 1.00 0.00 H new ATOM 0 HG23 THR A 25 24.549 12.974 -9.425 1.00 0.00 H new ATOM 406 N ASN A 26 28.267 14.531 -6.557 1.00 0.00 N ATOM 407 CA ASN A 26 29.006 15.330 -5.570 1.00 0.00 C ATOM 408 C ASN A 26 28.329 16.692 -5.323 1.00 0.00 C ATOM 409 O ASN A 26 28.893 17.758 -5.596 1.00 0.00 O ATOM 410 CB ASN A 26 30.501 15.390 -5.948 1.00 0.00 C ATOM 411 CG ASN A 26 31.379 15.971 -4.846 1.00 0.00 C ATOM 412 OD1 ASN A 26 30.974 16.168 -3.706 1.00 0.00 O ATOM 413 ND2 ASN A 26 32.628 16.245 -5.144 1.00 0.00 N ATOM 0 H ASN A 26 28.025 13.603 -6.209 1.00 0.00 H new ATOM 0 HA ASN A 26 28.972 14.842 -4.596 1.00 0.00 H new ATOM 0 HB2 ASN A 26 30.849 14.385 -6.188 1.00 0.00 H new ATOM 0 HB3 ASN A 26 30.617 15.991 -6.850 1.00 0.00 H new ATOM 0 HD21 ASN A 26 33.253 16.619 -4.429 1.00 0.00 H new ATOM 0 HD22 ASN A 26 32.974 16.084 -6.090 1.00 0.00 H new ATOM 420 N SER A 27 27.070 16.640 -4.873 1.00 0.00 N ATOM 421 CA SER A 27 26.203 17.818 -4.712 1.00 0.00 C ATOM 422 C SER A 27 25.623 17.982 -3.311 1.00 0.00 C ATOM 423 O SER A 27 25.519 17.025 -2.546 1.00 0.00 O ATOM 424 CB SER A 27 25.072 17.783 -5.744 1.00 0.00 C ATOM 425 OG SER A 27 25.636 17.740 -7.042 1.00 0.00 O ATOM 0 H SER A 27 26.616 15.766 -4.606 1.00 0.00 H new ATOM 0 HA SER A 27 26.844 18.684 -4.876 1.00 0.00 H new ATOM 0 HB2 SER A 27 24.438 16.911 -5.579 1.00 0.00 H new ATOM 0 HB3 SER A 27 24.438 18.663 -5.638 1.00 0.00 H new ATOM 0 HG SER A 27 25.495 16.852 -7.431 1.00 0.00 H new ATOM 431 N THR A 28 25.216 19.213 -2.988 1.00 0.00 N ATOM 432 CA THR A 28 24.418 19.505 -1.783 1.00 0.00 C ATOM 433 C THR A 28 22.936 19.254 -2.063 1.00 0.00 C ATOM 434 O THR A 28 22.492 19.241 -3.215 1.00 0.00 O ATOM 435 CB THR A 28 24.632 20.941 -1.288 1.00 0.00 C ATOM 436 OG1 THR A 28 24.098 21.830 -2.241 1.00 0.00 O ATOM 437 CG2 THR A 28 26.100 21.307 -1.103 1.00 0.00 C ATOM 0 H THR A 28 25.428 20.037 -3.550 1.00 0.00 H new ATOM 0 HA THR A 28 24.755 18.835 -0.992 1.00 0.00 H new ATOM 0 HB THR A 28 24.141 21.013 -0.318 1.00 0.00 H new ATOM 0 HG1 THR A 28 24.227 22.752 -1.936 1.00 0.00 H new ATOM 0 HG21 THR A 28 26.177 22.336 -0.752 1.00 0.00 H new ATOM 0 HG22 THR A 28 26.552 20.638 -0.370 1.00 0.00 H new ATOM 0 HG23 THR A 28 26.622 21.209 -2.055 1.00 0.00 H new ATOM 445 N GLU A 29 22.125 19.077 -1.019 1.00 0.00 N ATOM 446 CA GLU A 29 20.684 18.854 -1.198 1.00 0.00 C ATOM 447 C GLU A 29 19.974 20.083 -1.780 1.00 0.00 C ATOM 448 O GLU A 29 19.078 19.936 -2.610 1.00 0.00 O ATOM 449 CB GLU A 29 20.058 18.405 0.127 1.00 0.00 C ATOM 450 CG GLU A 29 20.508 16.988 0.494 1.00 0.00 C ATOM 451 CD GLU A 29 19.627 16.380 1.594 1.00 0.00 C ATOM 452 OE1 GLU A 29 19.744 16.798 2.771 1.00 0.00 O ATOM 453 OE2 GLU A 29 18.834 15.457 1.280 1.00 0.00 O ATOM 0 H GLU A 29 22.435 19.083 -0.047 1.00 0.00 H new ATOM 0 HA GLU A 29 20.552 18.058 -1.930 1.00 0.00 H new ATOM 0 HB2 GLU A 29 20.341 19.097 0.920 1.00 0.00 H new ATOM 0 HB3 GLU A 29 18.971 18.437 0.049 1.00 0.00 H new ATOM 0 HG2 GLU A 29 20.473 16.354 -0.392 1.00 0.00 H new ATOM 0 HG3 GLU A 29 21.545 17.011 0.829 1.00 0.00 H new ATOM 460 N GLN A 30 20.432 21.295 -1.442 1.00 0.00 N ATOM 461 CA GLN A 30 19.939 22.524 -2.076 1.00 0.00 C ATOM 462 C GLN A 30 20.345 22.629 -3.558 1.00 0.00 C ATOM 463 O GLN A 30 19.524 23.059 -4.369 1.00 0.00 O ATOM 464 CB GLN A 30 20.314 23.765 -1.244 1.00 0.00 C ATOM 465 CG GLN A 30 21.819 24.077 -1.136 1.00 0.00 C ATOM 466 CD GLN A 30 22.126 25.329 -0.300 1.00 0.00 C ATOM 467 OE1 GLN A 30 21.256 26.014 0.226 1.00 0.00 O ATOM 468 NE2 GLN A 30 23.386 25.684 -0.142 1.00 0.00 N ATOM 0 H GLN A 30 21.146 21.451 -0.730 1.00 0.00 H new ATOM 0 HA GLN A 30 18.850 22.477 -2.089 1.00 0.00 H new ATOM 0 HB2 GLN A 30 19.814 24.632 -1.676 1.00 0.00 H new ATOM 0 HB3 GLN A 30 19.917 23.636 -0.237 1.00 0.00 H new ATOM 0 HG2 GLN A 30 22.329 23.221 -0.694 1.00 0.00 H new ATOM 0 HG3 GLN A 30 22.228 24.209 -2.138 1.00 0.00 H new ATOM 0 HE21 GLN A 30 24.129 25.131 -0.569 1.00 0.00 H new ATOM 0 HE22 GLN A 30 23.618 26.511 0.408 1.00 0.00 H new ATOM 477 N GLN A 31 21.540 22.160 -3.951 1.00 0.00 N ATOM 478 CA GLN A 31 21.926 22.082 -5.370 1.00 0.00 C ATOM 479 C GLN A 31 21.043 21.094 -6.144 1.00 0.00 C ATOM 480 O GLN A 31 20.585 21.416 -7.239 1.00 0.00 O ATOM 481 CB GLN A 31 23.405 21.674 -5.511 1.00 0.00 C ATOM 482 CG GLN A 31 24.388 22.819 -5.218 1.00 0.00 C ATOM 483 CD GLN A 31 25.837 22.339 -5.087 1.00 0.00 C ATOM 484 OE1 GLN A 31 26.177 21.179 -5.299 1.00 0.00 O ATOM 485 NE2 GLN A 31 26.759 23.213 -4.756 1.00 0.00 N ATOM 0 H GLN A 31 22.257 21.829 -3.305 1.00 0.00 H new ATOM 0 HA GLN A 31 21.784 23.075 -5.797 1.00 0.00 H new ATOM 0 HB2 GLN A 31 23.611 20.846 -4.833 1.00 0.00 H new ATOM 0 HB3 GLN A 31 23.578 21.308 -6.523 1.00 0.00 H new ATOM 0 HG2 GLN A 31 24.326 23.558 -6.017 1.00 0.00 H new ATOM 0 HG3 GLN A 31 24.091 23.320 -4.296 1.00 0.00 H new ATOM 0 HE21 GLN A 31 26.501 24.183 -4.575 1.00 0.00 H new ATOM 0 HE22 GLN A 31 27.734 22.922 -4.680 1.00 0.00 H new ATOM 494 N PHE A 32 20.758 19.908 -5.587 1.00 0.00 N ATOM 495 CA PHE A 32 19.915 18.912 -6.266 1.00 0.00 C ATOM 496 C PHE A 32 18.446 19.360 -6.342 1.00 0.00 C ATOM 497 O PHE A 32 17.830 19.250 -7.401 1.00 0.00 O ATOM 498 CB PHE A 32 20.097 17.532 -5.606 1.00 0.00 C ATOM 499 CG PHE A 32 19.398 16.335 -6.251 1.00 0.00 C ATOM 500 CD1 PHE A 32 18.956 16.341 -7.595 1.00 0.00 C ATOM 501 CD2 PHE A 32 19.229 15.162 -5.493 1.00 0.00 C ATOM 502 CE1 PHE A 32 18.320 15.217 -8.147 1.00 0.00 C ATOM 503 CE2 PHE A 32 18.608 14.029 -6.052 1.00 0.00 C ATOM 504 CZ PHE A 32 18.132 14.063 -7.372 1.00 0.00 C ATOM 0 H PHE A 32 21.098 19.615 -4.671 1.00 0.00 H new ATOM 0 HA PHE A 32 20.241 18.822 -7.302 1.00 0.00 H new ATOM 0 HB2 PHE A 32 21.165 17.316 -5.570 1.00 0.00 H new ATOM 0 HB3 PHE A 32 19.751 17.606 -4.575 1.00 0.00 H new ATOM 0 HD1 PHE A 32 19.109 17.220 -8.203 1.00 0.00 H new ATOM 0 HD2 PHE A 32 19.579 15.130 -4.472 1.00 0.00 H new ATOM 0 HE1 PHE A 32 17.975 15.241 -9.170 1.00 0.00 H new ATOM 0 HE2 PHE A 32 18.497 13.130 -5.463 1.00 0.00 H new ATOM 0 HZ PHE A 32 17.624 13.206 -7.789 1.00 0.00 H new ATOM 514 N LEU A 33 17.907 19.957 -5.274 1.00 0.00 N ATOM 515 CA LEU A 33 16.569 20.558 -5.287 1.00 0.00 C ATOM 516 C LEU A 33 16.472 21.666 -6.346 1.00 0.00 C ATOM 517 O LEU A 33 15.575 21.636 -7.180 1.00 0.00 O ATOM 518 CB LEU A 33 16.222 21.007 -3.850 1.00 0.00 C ATOM 519 CG LEU A 33 14.804 21.541 -3.564 1.00 0.00 C ATOM 520 CD1 LEU A 33 14.585 22.977 -4.046 1.00 0.00 C ATOM 521 CD2 LEU A 33 13.706 20.643 -4.137 1.00 0.00 C ATOM 0 H LEU A 33 18.385 20.037 -4.377 1.00 0.00 H new ATOM 0 HA LEU A 33 15.815 19.831 -5.588 1.00 0.00 H new ATOM 0 HB2 LEU A 33 16.396 20.159 -3.188 1.00 0.00 H new ATOM 0 HB3 LEU A 33 16.932 21.784 -3.566 1.00 0.00 H new ATOM 0 HG LEU A 33 14.731 21.535 -2.476 1.00 0.00 H new ATOM 0 HD11 LEU A 33 13.567 23.288 -3.812 1.00 0.00 H new ATOM 0 HD12 LEU A 33 15.291 23.640 -3.546 1.00 0.00 H new ATOM 0 HD13 LEU A 33 14.741 23.027 -5.124 1.00 0.00 H new ATOM 0 HD21 LEU A 33 12.730 21.069 -3.905 1.00 0.00 H new ATOM 0 HD22 LEU A 33 13.823 20.571 -5.218 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.782 19.649 -3.697 1.00 0.00 H new ATOM 533 N GLU A 34 17.439 22.581 -6.387 1.00 0.00 N ATOM 534 CA GLU A 34 17.488 23.660 -7.386 1.00 0.00 C ATOM 535 C GLU A 34 17.596 23.133 -8.826 1.00 0.00 C ATOM 536 O GLU A 34 16.875 23.596 -9.708 1.00 0.00 O ATOM 537 CB GLU A 34 18.634 24.628 -7.045 1.00 0.00 C ATOM 538 CG GLU A 34 18.672 25.849 -7.969 1.00 0.00 C ATOM 539 CD GLU A 34 19.761 26.838 -7.516 1.00 0.00 C ATOM 540 OE1 GLU A 34 20.934 26.688 -7.933 1.00 0.00 O ATOM 541 OE2 GLU A 34 19.452 27.785 -6.751 1.00 0.00 O ATOM 0 H GLU A 34 18.217 22.599 -5.727 1.00 0.00 H new ATOM 0 HA GLU A 34 16.542 24.201 -7.342 1.00 0.00 H new ATOM 0 HB2 GLU A 34 18.527 24.962 -6.013 1.00 0.00 H new ATOM 0 HB3 GLU A 34 19.584 24.098 -7.112 1.00 0.00 H new ATOM 0 HG2 GLU A 34 18.866 25.531 -8.993 1.00 0.00 H new ATOM 0 HG3 GLU A 34 17.701 26.343 -7.967 1.00 0.00 H new ATOM 548 N ALA A 35 18.430 22.120 -9.063 1.00 0.00 N ATOM 549 CA ALA A 35 18.549 21.469 -10.371 1.00 0.00 C ATOM 550 C ALA A 35 17.241 20.772 -10.796 1.00 0.00 C ATOM 551 O ALA A 35 16.871 20.817 -11.969 1.00 0.00 O ATOM 552 CB ALA A 35 19.729 20.486 -10.325 1.00 0.00 C ATOM 0 H ALA A 35 19.045 21.725 -8.351 1.00 0.00 H new ATOM 0 HA ALA A 35 18.738 22.229 -11.129 1.00 0.00 H new ATOM 0 HB1 ALA A 35 19.830 19.993 -11.292 1.00 0.00 H new ATOM 0 HB2 ALA A 35 20.646 21.029 -10.097 1.00 0.00 H new ATOM 0 HB3 ALA A 35 19.549 19.737 -9.554 1.00 0.00 H new ATOM 558 N MET A 36 16.503 20.170 -9.858 1.00 0.00 N ATOM 559 CA MET A 36 15.200 19.549 -10.134 1.00 0.00 C ATOM 560 C MET A 36 14.084 20.579 -10.368 1.00 0.00 C ATOM 561 O MET A 36 13.289 20.399 -11.288 1.00 0.00 O ATOM 562 CB MET A 36 14.870 18.571 -8.998 1.00 0.00 C ATOM 563 CG MET A 36 15.658 17.266 -9.169 1.00 0.00 C ATOM 564 SD MET A 36 15.019 16.172 -10.469 1.00 0.00 S ATOM 565 CE MET A 36 13.611 15.443 -9.589 1.00 0.00 C ATOM 0 H MET A 36 16.792 20.099 -8.882 1.00 0.00 H new ATOM 0 HA MET A 36 15.266 18.998 -11.072 1.00 0.00 H new ATOM 0 HB2 MET A 36 15.111 19.025 -8.037 1.00 0.00 H new ATOM 0 HB3 MET A 36 13.801 18.359 -8.991 1.00 0.00 H new ATOM 0 HG2 MET A 36 16.697 17.509 -9.393 1.00 0.00 H new ATOM 0 HG3 MET A 36 15.654 16.726 -8.222 1.00 0.00 H new ATOM 0 HE1 MET A 36 13.098 14.739 -10.244 1.00 0.00 H new ATOM 0 HE2 MET A 36 13.968 14.920 -8.702 1.00 0.00 H new ATOM 0 HE3 MET A 36 12.920 16.232 -9.291 1.00 0.00 H new ATOM 575 N GLU A 37 14.056 21.692 -9.634 1.00 0.00 N ATOM 576 CA GLU A 37 13.127 22.802 -9.909 1.00 0.00 C ATOM 577 C GLU A 37 13.413 23.476 -11.265 1.00 0.00 C ATOM 578 O GLU A 37 12.488 23.767 -12.023 1.00 0.00 O ATOM 579 CB GLU A 37 13.191 23.856 -8.787 1.00 0.00 C ATOM 580 CG GLU A 37 12.644 23.386 -7.433 1.00 0.00 C ATOM 581 CD GLU A 37 11.166 22.952 -7.455 1.00 0.00 C ATOM 582 OE1 GLU A 37 10.344 23.475 -8.242 1.00 0.00 O ATOM 583 OE2 GLU A 37 10.786 22.073 -6.652 1.00 0.00 O ATOM 0 H GLU A 37 14.670 21.854 -8.836 1.00 0.00 H new ATOM 0 HA GLU A 37 12.126 22.372 -9.950 1.00 0.00 H new ATOM 0 HB2 GLU A 37 14.228 24.165 -8.657 1.00 0.00 H new ATOM 0 HB3 GLU A 37 12.633 24.737 -9.103 1.00 0.00 H new ATOM 0 HG2 GLU A 37 13.249 22.550 -7.081 1.00 0.00 H new ATOM 0 HG3 GLU A 37 12.762 24.192 -6.709 1.00 0.00 H new ATOM 590 N SER A 38 14.697 23.670 -11.600 1.00 0.00 N ATOM 591 CA SER A 38 15.139 24.274 -12.869 1.00 0.00 C ATOM 592 C SER A 38 14.848 23.398 -14.106 1.00 0.00 C ATOM 593 O SER A 38 14.724 23.909 -15.223 1.00 0.00 O ATOM 594 CB SER A 38 16.639 24.575 -12.764 1.00 0.00 C ATOM 595 OG SER A 38 17.089 25.362 -13.859 1.00 0.00 O ATOM 0 H SER A 38 15.470 23.408 -10.989 1.00 0.00 H new ATOM 0 HA SER A 38 14.566 25.189 -13.019 1.00 0.00 H new ATOM 0 HB2 SER A 38 16.842 25.099 -11.830 1.00 0.00 H new ATOM 0 HB3 SER A 38 17.198 23.640 -12.733 1.00 0.00 H new ATOM 0 HG SER A 38 18.048 25.538 -13.763 1.00 0.00 H new ATOM 601 N THR A 39 14.677 22.082 -13.910 1.00 0.00 N ATOM 602 CA THR A 39 14.414 21.104 -14.990 1.00 0.00 C ATOM 603 C THR A 39 12.989 20.527 -14.981 1.00 0.00 C ATOM 604 O THR A 39 12.662 19.685 -15.820 1.00 0.00 O ATOM 605 CB THR A 39 15.452 19.971 -14.974 1.00 0.00 C ATOM 606 OG1 THR A 39 15.420 19.312 -13.736 1.00 0.00 O ATOM 607 CG2 THR A 39 16.873 20.474 -15.213 1.00 0.00 C ATOM 0 H THR A 39 14.717 21.655 -12.984 1.00 0.00 H new ATOM 0 HA THR A 39 14.506 21.667 -15.919 1.00 0.00 H new ATOM 0 HB THR A 39 15.188 19.293 -15.786 1.00 0.00 H new ATOM 0 HG1 THR A 39 16.046 19.745 -13.119 1.00 0.00 H new ATOM 0 HG21 THR A 39 17.565 19.632 -15.191 1.00 0.00 H new ATOM 0 HG22 THR A 39 16.927 20.963 -16.185 1.00 0.00 H new ATOM 0 HG23 THR A 39 17.143 21.186 -14.433 1.00 0.00 H new ATOM 615 N GLY A 40 12.126 20.960 -14.051 1.00 0.00 N ATOM 616 CA GLY A 40 10.740 20.479 -13.947 1.00 0.00 C ATOM 617 C GLY A 40 10.621 19.017 -13.487 1.00 0.00 C ATOM 618 O GLY A 40 9.684 18.321 -13.874 1.00 0.00 O ATOM 0 H GLY A 40 12.370 21.656 -13.347 1.00 0.00 H new ATOM 0 HA2 GLY A 40 10.197 21.115 -13.248 1.00 0.00 H new ATOM 0 HA3 GLY A 40 10.255 20.585 -14.917 1.00 0.00 H new ATOM 622 N GLY A 41 11.584 18.539 -12.691 1.00 0.00 N ATOM 623 CA GLY A 41 11.631 17.155 -12.193 1.00 0.00 C ATOM 624 C GLY A 41 12.233 16.128 -13.154 1.00 0.00 C ATOM 625 O GLY A 41 12.111 14.927 -12.910 1.00 0.00 O ATOM 0 H GLY A 41 12.366 19.110 -12.368 1.00 0.00 H new ATOM 0 HA2 GLY A 41 12.206 17.140 -11.267 1.00 0.00 H new ATOM 0 HA3 GLY A 41 10.617 16.843 -11.944 1.00 0.00 H new ATOM 629 N ARG A 42 12.899 16.555 -14.237 1.00 0.00 N ATOM 630 CA ARG A 42 13.597 15.645 -15.173 1.00 0.00 C ATOM 631 C ARG A 42 14.929 15.209 -14.567 1.00 0.00 C ATOM 632 O ARG A 42 15.950 15.846 -14.799 1.00 0.00 O ATOM 633 CB ARG A 42 13.775 16.332 -16.548 1.00 0.00 C ATOM 634 CG ARG A 42 12.547 16.208 -17.461 1.00 0.00 C ATOM 635 CD ARG A 42 12.428 14.806 -18.083 1.00 0.00 C ATOM 636 NE ARG A 42 11.249 14.710 -18.972 1.00 0.00 N ATOM 637 CZ ARG A 42 11.159 15.002 -20.260 1.00 0.00 C ATOM 638 NH1 ARG A 42 12.170 15.448 -20.951 1.00 0.00 N ATOM 639 NH2 ARG A 42 10.028 14.853 -20.887 1.00 0.00 N ATOM 0 H ARG A 42 12.972 17.540 -14.493 1.00 0.00 H new ATOM 0 HA ARG A 42 12.999 14.748 -15.336 1.00 0.00 H new ATOM 0 HB2 ARG A 42 13.996 17.388 -16.391 1.00 0.00 H new ATOM 0 HB3 ARG A 42 14.638 15.898 -17.053 1.00 0.00 H new ATOM 0 HG2 ARG A 42 11.646 16.428 -16.888 1.00 0.00 H new ATOM 0 HG3 ARG A 42 12.609 16.952 -18.255 1.00 0.00 H new ATOM 0 HD2 ARG A 42 13.332 14.579 -18.648 1.00 0.00 H new ATOM 0 HD3 ARG A 42 12.351 14.060 -17.292 1.00 0.00 H new ATOM 0 HE ARG A 42 10.391 14.374 -18.534 1.00 0.00 H new ATOM 0 HH11 ARG A 42 13.075 15.584 -20.501 1.00 0.00 H new ATOM 0 HH12 ARG A 42 12.056 15.661 -21.942 1.00 0.00 H new ATOM 0 HH21 ARG A 42 9.208 14.511 -20.386 1.00 0.00 H new ATOM 0 HH22 ARG A 42 9.961 15.079 -21.879 1.00 0.00 H new ATOM 653 N VAL A 43 14.932 14.083 -13.848 1.00 0.00 N ATOM 654 CA VAL A 43 16.119 13.578 -13.111 1.00 0.00 C ATOM 655 C VAL A 43 17.348 13.464 -14.017 1.00 0.00 C ATOM 656 O VAL A 43 18.420 13.892 -13.616 1.00 0.00 O ATOM 657 CB VAL A 43 15.826 12.235 -12.400 1.00 0.00 C ATOM 658 CG1 VAL A 43 17.015 11.753 -11.554 1.00 0.00 C ATOM 659 CG2 VAL A 43 14.632 12.353 -11.442 1.00 0.00 C ATOM 0 H VAL A 43 14.111 13.485 -13.753 1.00 0.00 H new ATOM 0 HA VAL A 43 16.346 14.316 -12.341 1.00 0.00 H new ATOM 0 HB VAL A 43 15.618 11.527 -13.202 1.00 0.00 H new ATOM 0 HG11 VAL A 43 16.761 10.807 -11.075 1.00 0.00 H new ATOM 0 HG12 VAL A 43 17.885 11.613 -12.196 1.00 0.00 H new ATOM 0 HG13 VAL A 43 17.243 12.497 -10.790 1.00 0.00 H new ATOM 0 HG21 VAL A 43 14.455 11.391 -10.961 1.00 0.00 H new ATOM 0 HG22 VAL A 43 14.848 13.105 -10.683 1.00 0.00 H new ATOM 0 HG23 VAL A 43 13.744 12.647 -12.002 1.00 0.00 H new ATOM 669 N ARG A 44 17.202 13.019 -15.276 1.00 0.00 N ATOM 670 CA ARG A 44 18.326 12.920 -16.233 1.00 0.00 C ATOM 671 C ARG A 44 18.982 14.275 -16.547 1.00 0.00 C ATOM 672 O ARG A 44 20.204 14.395 -16.533 1.00 0.00 O ATOM 673 CB ARG A 44 17.884 12.135 -17.489 1.00 0.00 C ATOM 674 CG ARG A 44 16.830 12.813 -18.392 1.00 0.00 C ATOM 675 CD ARG A 44 16.366 11.892 -19.534 1.00 0.00 C ATOM 676 NE ARG A 44 17.465 11.596 -20.480 1.00 0.00 N ATOM 677 CZ ARG A 44 18.045 10.429 -20.719 1.00 0.00 C ATOM 678 NH1 ARG A 44 17.703 9.334 -20.101 1.00 0.00 N ATOM 679 NH2 ARG A 44 18.999 10.341 -21.598 1.00 0.00 N ATOM 0 H ARG A 44 16.307 12.718 -15.662 1.00 0.00 H new ATOM 0 HA ARG A 44 19.125 12.352 -15.756 1.00 0.00 H new ATOM 0 HB2 ARG A 44 18.769 11.931 -18.092 1.00 0.00 H new ATOM 0 HB3 ARG A 44 17.488 11.172 -17.167 1.00 0.00 H new ATOM 0 HG2 ARG A 44 15.970 13.103 -17.789 1.00 0.00 H new ATOM 0 HG3 ARG A 44 17.248 13.728 -18.812 1.00 0.00 H new ATOM 0 HD2 ARG A 44 15.984 10.960 -19.117 1.00 0.00 H new ATOM 0 HD3 ARG A 44 15.542 12.363 -20.070 1.00 0.00 H new ATOM 0 HE ARG A 44 17.820 12.389 -21.014 1.00 0.00 H new ATOM 0 HH11 ARG A 44 16.961 9.354 -19.401 1.00 0.00 H new ATOM 0 HH12 ARG A 44 18.177 8.457 -20.317 1.00 0.00 H new ATOM 0 HH21 ARG A 44 19.303 11.172 -22.106 1.00 0.00 H new ATOM 0 HH22 ARG A 44 19.444 9.441 -21.780 1.00 0.00 H new ATOM 693 N ILE A 45 18.169 15.321 -16.732 1.00 0.00 N ATOM 694 CA ILE A 45 18.660 16.687 -17.003 1.00 0.00 C ATOM 695 C ILE A 45 19.204 17.311 -15.710 1.00 0.00 C ATOM 696 O ILE A 45 20.232 17.977 -15.732 1.00 0.00 O ATOM 697 CB ILE A 45 17.575 17.572 -17.674 1.00 0.00 C ATOM 698 CG1 ILE A 45 16.941 16.871 -18.900 1.00 0.00 C ATOM 699 CG2 ILE A 45 18.197 18.910 -18.117 1.00 0.00 C ATOM 700 CD1 ILE A 45 15.846 17.680 -19.611 1.00 0.00 C ATOM 0 H ILE A 45 17.152 15.250 -16.699 1.00 0.00 H new ATOM 0 HA ILE A 45 19.478 16.625 -17.720 1.00 0.00 H new ATOM 0 HB ILE A 45 16.789 17.747 -16.940 1.00 0.00 H new ATOM 0 HG12 ILE A 45 17.729 16.643 -19.618 1.00 0.00 H new ATOM 0 HG13 ILE A 45 16.518 15.919 -18.578 1.00 0.00 H new ATOM 0 HG21 ILE A 45 17.433 19.528 -18.587 1.00 0.00 H new ATOM 0 HG22 ILE A 45 18.600 19.430 -17.248 1.00 0.00 H new ATOM 0 HG23 ILE A 45 18.999 18.720 -18.830 1.00 0.00 H new ATOM 0 HD11 ILE A 45 15.462 17.108 -20.456 1.00 0.00 H new ATOM 0 HD12 ILE A 45 15.034 17.886 -18.913 1.00 0.00 H new ATOM 0 HD13 ILE A 45 16.263 18.621 -19.969 1.00 0.00 H new ATOM 712 N ALA A 46 18.583 17.030 -14.562 1.00 0.00 N ATOM 713 CA ALA A 46 19.061 17.501 -13.262 1.00 0.00 C ATOM 714 C ALA A 46 20.450 16.930 -12.936 1.00 0.00 C ATOM 715 O ALA A 46 21.365 17.700 -12.651 1.00 0.00 O ATOM 716 CB ALA A 46 18.021 17.155 -12.187 1.00 0.00 C ATOM 0 H ALA A 46 17.733 16.468 -14.509 1.00 0.00 H new ATOM 0 HA ALA A 46 19.179 18.584 -13.290 1.00 0.00 H new ATOM 0 HB1 ALA A 46 18.372 17.504 -11.216 1.00 0.00 H new ATOM 0 HB2 ALA A 46 17.075 17.640 -12.427 1.00 0.00 H new ATOM 0 HB3 ALA A 46 17.877 16.075 -12.154 1.00 0.00 H new ATOM 722 N ILE A 47 20.661 15.613 -13.066 1.00 0.00 N ATOM 723 CA ILE A 47 21.991 15.018 -12.846 1.00 0.00 C ATOM 724 C ILE A 47 22.995 15.475 -13.910 1.00 0.00 C ATOM 725 O ILE A 47 24.133 15.768 -13.556 1.00 0.00 O ATOM 726 CB ILE A 47 21.954 13.487 -12.659 1.00 0.00 C ATOM 727 CG1 ILE A 47 21.617 12.708 -13.947 1.00 0.00 C ATOM 728 CG2 ILE A 47 21.009 13.145 -11.496 1.00 0.00 C ATOM 729 CD1 ILE A 47 21.572 11.185 -13.767 1.00 0.00 C ATOM 0 H ILE A 47 19.936 14.942 -13.320 1.00 0.00 H new ATOM 0 HA ILE A 47 22.350 15.402 -11.891 1.00 0.00 H new ATOM 0 HB ILE A 47 22.963 13.157 -12.410 1.00 0.00 H new ATOM 0 HG12 ILE A 47 20.651 13.047 -14.321 1.00 0.00 H new ATOM 0 HG13 ILE A 47 22.357 12.951 -14.709 1.00 0.00 H new ATOM 0 HG21 ILE A 47 20.978 12.064 -11.358 1.00 0.00 H new ATOM 0 HG22 ILE A 47 21.371 13.617 -10.582 1.00 0.00 H new ATOM 0 HG23 ILE A 47 20.007 13.511 -11.721 1.00 0.00 H new ATOM 0 HD11 ILE A 47 21.329 10.713 -14.719 1.00 0.00 H new ATOM 0 HD12 ILE A 47 22.544 10.830 -13.424 1.00 0.00 H new ATOM 0 HD13 ILE A 47 20.811 10.928 -13.030 1.00 0.00 H new ATOM 741 N ALA A 48 22.578 15.665 -15.171 1.00 0.00 N ATOM 742 CA ALA A 48 23.431 16.285 -16.191 1.00 0.00 C ATOM 743 C ALA A 48 23.908 17.692 -15.776 1.00 0.00 C ATOM 744 O ALA A 48 25.108 17.961 -15.826 1.00 0.00 O ATOM 745 CB ALA A 48 22.662 16.302 -17.515 1.00 0.00 C ATOM 0 H ALA A 48 21.653 15.397 -15.507 1.00 0.00 H new ATOM 0 HA ALA A 48 24.341 15.697 -16.308 1.00 0.00 H new ATOM 0 HB1 ALA A 48 23.279 16.760 -18.288 1.00 0.00 H new ATOM 0 HB2 ALA A 48 22.415 15.281 -17.805 1.00 0.00 H new ATOM 0 HB3 ALA A 48 21.744 16.878 -17.395 1.00 0.00 H new ATOM 751 N LYS A 49 23.012 18.561 -15.279 1.00 0.00 N ATOM 752 CA LYS A 49 23.361 19.910 -14.781 1.00 0.00 C ATOM 753 C LYS A 49 24.228 19.889 -13.517 1.00 0.00 C ATOM 754 O LYS A 49 25.085 20.756 -13.358 1.00 0.00 O ATOM 755 CB LYS A 49 22.077 20.736 -14.557 1.00 0.00 C ATOM 756 CG LYS A 49 21.362 21.165 -15.854 1.00 0.00 C ATOM 757 CD LYS A 49 22.166 22.079 -16.797 1.00 0.00 C ATOM 758 CE LYS A 49 22.626 23.384 -16.123 1.00 0.00 C ATOM 759 NZ LYS A 49 23.330 24.284 -17.083 1.00 0.00 N ATOM 0 H LYS A 49 22.017 18.349 -15.209 1.00 0.00 H new ATOM 0 HA LYS A 49 23.971 20.384 -15.550 1.00 0.00 H new ATOM 0 HB2 LYS A 49 21.385 20.152 -13.951 1.00 0.00 H new ATOM 0 HB3 LYS A 49 22.329 21.628 -13.983 1.00 0.00 H new ATOM 0 HG2 LYS A 49 21.080 20.267 -16.404 1.00 0.00 H new ATOM 0 HG3 LYS A 49 20.438 21.677 -15.584 1.00 0.00 H new ATOM 0 HD2 LYS A 49 23.039 21.538 -17.161 1.00 0.00 H new ATOM 0 HD3 LYS A 49 21.555 22.322 -17.667 1.00 0.00 H new ATOM 0 HE2 LYS A 49 21.762 23.902 -15.706 1.00 0.00 H new ATOM 0 HE3 LYS A 49 23.290 23.149 -15.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 23.625 25.152 -16.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 24.168 23.799 -17.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 22.688 24.528 -17.864 1.00 0.00 H new ATOM 773 N LEU A 50 24.055 18.895 -12.639 1.00 0.00 N ATOM 774 CA LEU A 50 24.936 18.693 -11.477 1.00 0.00 C ATOM 775 C LEU A 50 26.331 18.162 -11.872 1.00 0.00 C ATOM 776 O LEU A 50 27.304 18.446 -11.176 1.00 0.00 O ATOM 777 CB LEU A 50 24.269 17.755 -10.457 1.00 0.00 C ATOM 778 CG LEU A 50 22.988 18.273 -9.780 1.00 0.00 C ATOM 779 CD1 LEU A 50 22.437 17.168 -8.876 1.00 0.00 C ATOM 780 CD2 LEU A 50 23.228 19.520 -8.932 1.00 0.00 C ATOM 0 H LEU A 50 23.304 18.209 -12.711 1.00 0.00 H new ATOM 0 HA LEU A 50 25.090 19.670 -11.020 1.00 0.00 H new ATOM 0 HB2 LEU A 50 24.033 16.817 -10.960 1.00 0.00 H new ATOM 0 HB3 LEU A 50 24.997 17.525 -9.679 1.00 0.00 H new ATOM 0 HG LEU A 50 22.285 18.543 -10.568 1.00 0.00 H new ATOM 0 HD11 LEU A 50 21.528 17.518 -8.387 1.00 0.00 H new ATOM 0 HD12 LEU A 50 22.211 16.286 -9.476 1.00 0.00 H new ATOM 0 HD13 LEU A 50 23.180 16.912 -8.120 1.00 0.00 H new ATOM 0 HD21 LEU A 50 22.289 19.839 -8.480 1.00 0.00 H new ATOM 0 HD22 LEU A 50 23.950 19.293 -8.147 1.00 0.00 H new ATOM 0 HD23 LEU A 50 23.617 20.320 -9.563 1.00 0.00 H new ATOM 792 N LEU A 51 26.453 17.432 -12.989 1.00 0.00 N ATOM 793 CA LEU A 51 27.743 16.980 -13.532 1.00 0.00 C ATOM 794 C LEU A 51 28.464 18.076 -14.345 1.00 0.00 C ATOM 795 O LEU A 51 29.685 18.198 -14.244 1.00 0.00 O ATOM 796 CB LEU A 51 27.524 15.701 -14.361 1.00 0.00 C ATOM 797 CG LEU A 51 27.140 14.459 -13.528 1.00 0.00 C ATOM 798 CD1 LEU A 51 26.673 13.339 -14.458 1.00 0.00 C ATOM 799 CD2 LEU A 51 28.305 13.929 -12.690 1.00 0.00 C ATOM 0 H LEU A 51 25.652 17.135 -13.547 1.00 0.00 H new ATOM 0 HA LEU A 51 28.406 16.756 -12.696 1.00 0.00 H new ATOM 0 HB2 LEU A 51 26.740 15.888 -15.095 1.00 0.00 H new ATOM 0 HB3 LEU A 51 28.436 15.483 -14.917 1.00 0.00 H new ATOM 0 HG LEU A 51 26.344 14.769 -12.851 1.00 0.00 H new ATOM 0 HD11 LEU A 51 26.403 12.464 -13.867 1.00 0.00 H new ATOM 0 HD12 LEU A 51 25.805 13.675 -15.026 1.00 0.00 H new ATOM 0 HD13 LEU A 51 27.477 13.078 -15.146 1.00 0.00 H new ATOM 0 HD21 LEU A 51 27.979 13.056 -12.125 1.00 0.00 H new ATOM 0 HD22 LEU A 51 29.128 13.649 -13.347 1.00 0.00 H new ATOM 0 HD23 LEU A 51 28.639 14.704 -12.000 1.00 0.00 H new ATOM 811 N SER A 52 27.738 18.927 -15.084 1.00 0.00 N ATOM 812 CA SER A 52 28.277 20.099 -15.814 1.00 0.00 C ATOM 813 C SER A 52 28.409 21.379 -14.957 1.00 0.00 C ATOM 814 O SER A 52 28.622 22.478 -15.474 1.00 0.00 O ATOM 815 CB SER A 52 27.483 20.345 -17.103 1.00 0.00 C ATOM 816 OG SER A 52 26.154 20.766 -16.828 1.00 0.00 O ATOM 0 H SER A 52 26.730 18.822 -15.198 1.00 0.00 H new ATOM 0 HA SER A 52 29.303 19.844 -16.080 1.00 0.00 H new ATOM 0 HB2 SER A 52 27.988 21.102 -17.703 1.00 0.00 H new ATOM 0 HB3 SER A 52 27.460 19.431 -17.697 1.00 0.00 H new ATOM 0 HG SER A 52 25.677 20.915 -17.671 1.00 0.00 H new ATOM 822 N LYS A 53 28.326 21.225 -13.624 1.00 0.00 N ATOM 823 CA LYS A 53 28.337 22.280 -12.587 1.00 0.00 C ATOM 824 C LYS A 53 29.643 23.097 -12.515 1.00 0.00 C ATOM 825 O LYS A 53 29.624 24.224 -12.024 1.00 0.00 O ATOM 826 CB LYS A 53 28.014 21.561 -11.266 1.00 0.00 C ATOM 827 CG LYS A 53 27.757 22.447 -10.037 1.00 0.00 C ATOM 828 CD LYS A 53 27.222 21.623 -8.852 1.00 0.00 C ATOM 829 CE LYS A 53 28.221 20.550 -8.378 1.00 0.00 C ATOM 830 NZ LYS A 53 27.675 19.733 -7.264 1.00 0.00 N ATOM 0 H LYS A 53 28.244 20.296 -13.210 1.00 0.00 H new ATOM 0 HA LYS A 53 27.598 23.044 -12.827 1.00 0.00 H new ATOM 0 HB2 LYS A 53 27.134 20.938 -11.425 1.00 0.00 H new ATOM 0 HB3 LYS A 53 28.841 20.890 -11.034 1.00 0.00 H new ATOM 0 HG2 LYS A 53 28.681 22.946 -9.747 1.00 0.00 H new ATOM 0 HG3 LYS A 53 27.040 23.227 -10.293 1.00 0.00 H new ATOM 0 HD2 LYS A 53 26.993 22.292 -8.023 1.00 0.00 H new ATOM 0 HD3 LYS A 53 26.288 21.142 -9.141 1.00 0.00 H new ATOM 0 HE2 LYS A 53 28.477 19.898 -9.214 1.00 0.00 H new ATOM 0 HE3 LYS A 53 29.144 21.032 -8.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 28.447 19.206 -6.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 27.223 20.357 -6.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 26.972 19.064 -7.637 1.00 0.00 H new ATOM 844 N GLN A 54 30.749 22.559 -13.047 1.00 0.00 N ATOM 845 CA GLN A 54 32.051 23.234 -13.207 1.00 0.00 C ATOM 846 C GLN A 54 32.688 23.695 -11.875 1.00 0.00 C ATOM 847 O GLN A 54 33.183 24.816 -11.741 1.00 0.00 O ATOM 848 CB GLN A 54 31.929 24.317 -14.302 1.00 0.00 C ATOM 849 CG GLN A 54 33.267 24.648 -14.984 1.00 0.00 C ATOM 850 CD GLN A 54 33.134 25.678 -16.111 1.00 0.00 C ATOM 851 OE1 GLN A 54 32.162 26.413 -16.239 1.00 0.00 O ATOM 852 NE2 GLN A 54 34.116 25.777 -16.981 1.00 0.00 N ATOM 0 H GLN A 54 30.765 21.600 -13.394 1.00 0.00 H new ATOM 0 HA GLN A 54 32.787 22.509 -13.556 1.00 0.00 H new ATOM 0 HB2 GLN A 54 31.218 23.982 -15.057 1.00 0.00 H new ATOM 0 HB3 GLN A 54 31.520 25.226 -13.860 1.00 0.00 H new ATOM 0 HG2 GLN A 54 33.964 25.026 -14.236 1.00 0.00 H new ATOM 0 HG3 GLN A 54 33.698 23.732 -15.388 1.00 0.00 H new ATOM 0 HE21 GLN A 54 34.936 25.176 -16.895 1.00 0.00 H new ATOM 0 HE22 GLN A 54 34.058 26.455 -17.741 1.00 0.00 H new ATOM 861 N THR A 55 32.669 22.802 -10.875 1.00 0.00 N ATOM 862 CA THR A 55 33.173 23.024 -9.499 1.00 0.00 C ATOM 863 C THR A 55 34.402 22.168 -9.143 1.00 0.00 C ATOM 864 O THR A 55 34.742 22.019 -7.968 1.00 0.00 O ATOM 865 CB THR A 55 32.033 22.842 -8.476 1.00 0.00 C ATOM 866 OG1 THR A 55 31.302 21.659 -8.743 1.00 0.00 O ATOM 867 CG2 THR A 55 31.043 24.000 -8.550 1.00 0.00 C ATOM 0 H THR A 55 32.288 21.864 -11.001 1.00 0.00 H new ATOM 0 HA THR A 55 33.524 24.055 -9.457 1.00 0.00 H new ATOM 0 HB THR A 55 32.499 22.796 -7.492 1.00 0.00 H new ATOM 0 HG1 THR A 55 31.353 21.061 -7.968 1.00 0.00 H new ATOM 0 HG21 THR A 55 30.249 23.847 -7.819 1.00 0.00 H new ATOM 0 HG22 THR A 55 31.560 24.935 -8.334 1.00 0.00 H new ATOM 0 HG23 THR A 55 30.611 24.046 -9.550 1.00 0.00 H new ATOM 875 N SER A 56 35.084 21.600 -10.146 1.00 0.00 N ATOM 876 CA SER A 56 36.256 20.719 -9.985 1.00 0.00 C ATOM 877 C SER A 56 37.328 20.963 -11.062 1.00 0.00 C ATOM 878 O SER A 56 37.077 21.617 -12.078 1.00 0.00 O ATOM 879 CB SER A 56 35.789 19.255 -9.991 1.00 0.00 C ATOM 880 OG SER A 56 36.822 18.396 -9.523 1.00 0.00 O ATOM 0 H SER A 56 34.830 21.743 -11.124 1.00 0.00 H new ATOM 0 HA SER A 56 36.728 20.950 -9.030 1.00 0.00 H new ATOM 0 HB2 SER A 56 34.906 19.147 -9.361 1.00 0.00 H new ATOM 0 HB3 SER A 56 35.498 18.965 -11.001 1.00 0.00 H new ATOM 0 HG SER A 56 36.506 17.469 -9.532 1.00 0.00 H new ATOM 886 N GLY A 57 38.546 20.462 -10.827 1.00 0.00 N ATOM 887 CA GLY A 57 39.677 20.504 -11.766 1.00 0.00 C ATOM 888 C GLY A 57 40.244 21.900 -12.069 1.00 0.00 C ATOM 889 O GLY A 57 40.977 22.065 -13.046 1.00 0.00 O ATOM 0 H GLY A 57 38.781 20.000 -9.949 1.00 0.00 H new ATOM 0 HA2 GLY A 57 40.480 19.885 -11.366 1.00 0.00 H new ATOM 0 HA3 GLY A 57 39.362 20.049 -12.705 1.00 0.00 H new ATOM 893 N GLY A 58 39.877 22.919 -11.279 1.00 0.00 N ATOM 894 CA GLY A 58 40.227 24.325 -11.521 1.00 0.00 C ATOM 895 C GLY A 58 39.536 24.955 -12.744 1.00 0.00 C ATOM 896 O GLY A 58 39.970 26.008 -13.218 1.00 0.00 O ATOM 0 H GLY A 58 39.317 22.786 -10.437 1.00 0.00 H new ATOM 0 HA2 GLY A 58 39.971 24.907 -10.636 1.00 0.00 H new ATOM 0 HA3 GLY A 58 41.307 24.400 -11.651 1.00 0.00 H new ATOM 900 N SER A 59 38.484 24.319 -13.279 1.00 0.00 N ATOM 901 CA SER A 59 37.775 24.764 -14.488 1.00 0.00 C ATOM 902 C SER A 59 36.938 26.032 -14.251 1.00 0.00 C ATOM 903 O SER A 59 36.418 26.260 -13.155 1.00 0.00 O ATOM 904 CB SER A 59 36.913 23.621 -15.032 1.00 0.00 C ATOM 905 OG SER A 59 36.371 23.970 -16.298 1.00 0.00 O ATOM 0 H SER A 59 38.095 23.466 -12.877 1.00 0.00 H new ATOM 0 HA SER A 59 38.524 25.033 -15.233 1.00 0.00 H new ATOM 0 HB2 SER A 59 37.513 22.716 -15.123 1.00 0.00 H new ATOM 0 HB3 SER A 59 36.107 23.400 -14.332 1.00 0.00 H new ATOM 0 HG SER A 59 35.824 23.230 -16.635 1.00 0.00 H new ATOM 911 N GLY A 60 36.798 26.859 -15.292 1.00 0.00 N ATOM 912 CA GLY A 60 36.009 28.097 -15.283 1.00 0.00 C ATOM 913 C GLY A 60 35.856 28.713 -16.681 1.00 0.00 C ATOM 914 O GLY A 60 36.705 28.513 -17.554 1.00 0.00 O ATOM 0 H GLY A 60 37.244 26.681 -16.192 1.00 0.00 H new ATOM 0 HA2 GLY A 60 35.021 27.890 -14.872 1.00 0.00 H new ATOM 0 HA3 GLY A 60 36.485 28.821 -14.622 1.00 0.00 H new ATOM 918 N GLY A 61 34.764 29.454 -16.895 1.00 0.00 N ATOM 919 CA GLY A 61 34.399 30.044 -18.193 1.00 0.00 C ATOM 920 C GLY A 61 33.876 29.035 -19.232 1.00 0.00 C ATOM 921 O GLY A 61 33.852 27.823 -18.999 1.00 0.00 O ATOM 0 H GLY A 61 34.093 29.667 -16.157 1.00 0.00 H new ATOM 0 HA2 GLY A 61 33.636 30.805 -18.029 1.00 0.00 H new ATOM 0 HA3 GLY A 61 35.272 30.551 -18.605 1.00 0.00 H new ATOM 925 N SER A 62 33.434 29.547 -20.386 1.00 0.00 N ATOM 926 CA SER A 62 32.893 28.762 -21.511 1.00 0.00 C ATOM 927 C SER A 62 33.132 29.452 -22.866 1.00 0.00 C ATOM 928 O SER A 62 33.320 30.673 -22.925 1.00 0.00 O ATOM 929 CB SER A 62 31.391 28.521 -21.293 1.00 0.00 C ATOM 930 OG SER A 62 30.903 27.551 -22.208 1.00 0.00 O ATOM 0 H SER A 62 33.441 30.550 -20.573 1.00 0.00 H new ATOM 0 HA SER A 62 33.420 27.808 -21.539 1.00 0.00 H new ATOM 0 HB2 SER A 62 31.216 28.185 -20.271 1.00 0.00 H new ATOM 0 HB3 SER A 62 30.845 29.456 -21.420 1.00 0.00 H new ATOM 0 HG SER A 62 29.946 27.409 -22.054 1.00 0.00 H new ATOM 936 N LYS A 63 33.129 28.672 -23.955 1.00 0.00 N ATOM 937 CA LYS A 63 33.319 29.123 -25.349 1.00 0.00 C ATOM 938 C LYS A 63 32.488 28.305 -26.353 1.00 0.00 C ATOM 939 O LYS A 63 31.997 27.220 -26.031 1.00 0.00 O ATOM 940 CB LYS A 63 34.829 29.181 -25.693 1.00 0.00 C ATOM 941 CG LYS A 63 35.684 27.922 -25.436 1.00 0.00 C ATOM 942 CD LYS A 63 35.478 26.792 -26.459 1.00 0.00 C ATOM 943 CE LYS A 63 36.417 25.597 -26.222 1.00 0.00 C ATOM 944 NZ LYS A 63 37.838 25.897 -26.563 1.00 0.00 N ATOM 0 H LYS A 63 32.988 27.664 -23.891 1.00 0.00 H new ATOM 0 HA LYS A 63 32.931 30.138 -25.437 1.00 0.00 H new ATOM 0 HB2 LYS A 63 34.920 29.436 -26.749 1.00 0.00 H new ATOM 0 HB3 LYS A 63 35.268 30.003 -25.128 1.00 0.00 H new ATOM 0 HG2 LYS A 63 36.736 28.207 -25.435 1.00 0.00 H new ATOM 0 HG3 LYS A 63 35.456 27.540 -24.441 1.00 0.00 H new ATOM 0 HD2 LYS A 63 34.444 26.451 -26.413 1.00 0.00 H new ATOM 0 HD3 LYS A 63 35.641 27.183 -27.463 1.00 0.00 H new ATOM 0 HE2 LYS A 63 36.356 25.295 -25.176 1.00 0.00 H new ATOM 0 HE3 LYS A 63 36.077 24.750 -26.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 38.420 25.051 -26.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 37.904 26.175 -27.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 38.182 26.675 -25.964 1.00 0.00 H new ATOM 958 N LEU A 64 32.324 28.834 -27.570 1.00 0.00 N ATOM 959 CA LEU A 64 31.564 28.194 -28.656 1.00 0.00 C ATOM 960 C LEU A 64 32.309 26.988 -29.261 1.00 0.00 C ATOM 961 O LEU A 64 33.543 26.953 -29.289 1.00 0.00 O ATOM 962 CB LEU A 64 31.213 29.235 -29.739 1.00 0.00 C ATOM 963 CG LEU A 64 30.339 30.416 -29.268 1.00 0.00 C ATOM 964 CD1 LEU A 64 30.095 31.378 -30.433 1.00 0.00 C ATOM 965 CD2 LEU A 64 28.978 29.965 -28.734 1.00 0.00 C ATOM 0 H LEU A 64 32.722 29.735 -27.836 1.00 0.00 H new ATOM 0 HA LEU A 64 30.640 27.803 -28.229 1.00 0.00 H new ATOM 0 HB2 LEU A 64 32.141 29.634 -30.149 1.00 0.00 H new ATOM 0 HB3 LEU A 64 30.697 28.726 -30.553 1.00 0.00 H new ATOM 0 HG LEU A 64 30.883 30.903 -28.459 1.00 0.00 H new ATOM 0 HD11 LEU A 64 29.477 32.210 -30.095 1.00 0.00 H new ATOM 0 HD12 LEU A 64 31.049 31.759 -30.796 1.00 0.00 H new ATOM 0 HD13 LEU A 64 29.584 30.851 -31.239 1.00 0.00 H new ATOM 0 HD21 LEU A 64 28.405 30.836 -28.417 1.00 0.00 H new ATOM 0 HD22 LEU A 64 28.435 29.440 -29.520 1.00 0.00 H new ATOM 0 HD23 LEU A 64 29.123 29.297 -27.885 1.00 0.00 H new ATOM 977 N GLY A 65 31.557 26.006 -29.766 1.00 0.00 N ATOM 978 CA GLY A 65 32.088 24.776 -30.368 1.00 0.00 C ATOM 979 C GLY A 65 31.005 23.759 -30.754 1.00 0.00 C ATOM 980 O GLY A 65 29.810 24.066 -30.739 1.00 0.00 O ATOM 0 H GLY A 65 30.538 26.043 -29.768 1.00 0.00 H new ATOM 0 HA2 GLY A 65 32.663 25.036 -31.257 1.00 0.00 H new ATOM 0 HA3 GLY A 65 32.779 24.308 -29.667 1.00 0.00 H new ATOM 984 N GLY A 66 31.428 22.534 -31.086 1.00 0.00 N ATOM 985 CA GLY A 66 30.545 21.430 -31.491 1.00 0.00 C ATOM 986 C GLY A 66 29.984 21.553 -32.917 1.00 0.00 C ATOM 987 O GLY A 66 30.450 22.365 -33.724 1.00 0.00 O ATOM 0 H GLY A 66 32.415 22.275 -31.081 1.00 0.00 H new ATOM 0 HA2 GLY A 66 31.096 20.493 -31.410 1.00 0.00 H new ATOM 0 HA3 GLY A 66 29.712 21.372 -30.790 1.00 0.00 H new ATOM 991 N SER A 67 28.989 20.722 -33.236 1.00 0.00 N ATOM 992 CA SER A 67 28.346 20.624 -34.562 1.00 0.00 C ATOM 993 C SER A 67 26.842 20.300 -34.473 1.00 0.00 C ATOM 994 O SER A 67 26.343 19.854 -33.432 1.00 0.00 O ATOM 995 CB SER A 67 29.076 19.581 -35.425 1.00 0.00 C ATOM 996 OG SER A 67 29.062 18.295 -34.816 1.00 0.00 O ATOM 0 H SER A 67 28.590 20.073 -32.558 1.00 0.00 H new ATOM 0 HA SER A 67 28.425 21.604 -35.032 1.00 0.00 H new ATOM 0 HB2 SER A 67 28.604 19.525 -36.406 1.00 0.00 H new ATOM 0 HB3 SER A 67 30.107 19.897 -35.585 1.00 0.00 H new ATOM 0 HG SER A 67 29.532 17.656 -35.391 1.00 0.00 H new ATOM 1002 N GLY A 68 26.106 20.559 -35.561 1.00 0.00 N ATOM 1003 CA GLY A 68 24.659 20.314 -35.679 1.00 0.00 C ATOM 1004 C GLY A 68 24.274 18.854 -35.977 1.00 0.00 C ATOM 1005 O GLY A 68 25.101 17.939 -35.927 1.00 0.00 O ATOM 0 H GLY A 68 26.510 20.956 -36.409 1.00 0.00 H new ATOM 0 HA2 GLY A 68 24.176 20.620 -34.751 1.00 0.00 H new ATOM 0 HA3 GLY A 68 24.261 20.949 -36.470 1.00 0.00 H new ATOM 1009 N GLY A 69 22.995 18.641 -36.317 1.00 0.00 N ATOM 1010 CA GLY A 69 22.441 17.337 -36.724 1.00 0.00 C ATOM 1011 C GLY A 69 21.975 16.426 -35.577 1.00 0.00 C ATOM 1012 O GLY A 69 21.585 15.285 -35.824 1.00 0.00 O ATOM 0 H GLY A 69 22.299 19.386 -36.317 1.00 0.00 H new ATOM 0 HA2 GLY A 69 21.596 17.513 -37.390 1.00 0.00 H new ATOM 0 HA3 GLY A 69 23.197 16.806 -37.302 1.00 0.00 H new ATOM 1016 N SER A 70 21.965 16.913 -34.330 1.00 0.00 N ATOM 1017 CA SER A 70 21.649 16.127 -33.119 1.00 0.00 C ATOM 1018 C SER A 70 20.213 15.571 -33.063 1.00 0.00 C ATOM 1019 O SER A 70 19.941 14.644 -32.297 1.00 0.00 O ATOM 1020 CB SER A 70 21.892 16.987 -31.870 1.00 0.00 C ATOM 1021 OG SER A 70 23.205 17.533 -31.881 1.00 0.00 O ATOM 0 H SER A 70 22.181 17.888 -34.124 1.00 0.00 H new ATOM 0 HA SER A 70 22.311 15.262 -33.155 1.00 0.00 H new ATOM 0 HB2 SER A 70 21.159 17.792 -31.829 1.00 0.00 H new ATOM 0 HB3 SER A 70 21.752 16.383 -30.974 1.00 0.00 H new ATOM 0 HG SER A 70 23.339 18.079 -31.078 1.00 0.00 H new ATOM 1027 N ARG A 71 19.291 16.107 -33.881 1.00 0.00 N ATOM 1028 CA ARG A 71 17.871 15.697 -33.965 1.00 0.00 C ATOM 1029 C ARG A 71 17.613 14.482 -34.880 1.00 0.00 C ATOM 1030 O ARG A 71 16.460 14.068 -35.026 1.00 0.00 O ATOM 1031 CB ARG A 71 17.005 16.909 -34.371 1.00 0.00 C ATOM 1032 CG ARG A 71 17.039 18.043 -33.328 1.00 0.00 C ATOM 1033 CD ARG A 71 16.153 19.231 -33.727 1.00 0.00 C ATOM 1034 NE ARG A 71 14.714 18.892 -33.698 1.00 0.00 N ATOM 1035 CZ ARG A 71 13.715 19.656 -34.109 1.00 0.00 C ATOM 1036 NH1 ARG A 71 13.909 20.848 -34.602 1.00 0.00 N ATOM 1037 NH2 ARG A 71 12.486 19.230 -34.030 1.00 0.00 N ATOM 0 H ARG A 71 19.518 16.864 -34.526 1.00 0.00 H new ATOM 0 HA ARG A 71 17.584 15.356 -32.971 1.00 0.00 H new ATOM 0 HB2 ARG A 71 17.352 17.293 -35.330 1.00 0.00 H new ATOM 0 HB3 ARG A 71 15.975 16.583 -34.513 1.00 0.00 H new ATOM 0 HG2 ARG A 71 16.710 17.656 -32.363 1.00 0.00 H new ATOM 0 HG3 ARG A 71 18.066 18.386 -33.201 1.00 0.00 H new ATOM 0 HD2 ARG A 71 16.341 20.065 -33.051 1.00 0.00 H new ATOM 0 HD3 ARG A 71 16.425 19.565 -34.728 1.00 0.00 H new ATOM 0 HE ARG A 71 14.466 17.976 -33.323 1.00 0.00 H new ATOM 0 HH11 ARG A 71 14.856 21.219 -34.681 1.00 0.00 H new ATOM 0 HH12 ARG A 71 13.114 21.409 -34.909 1.00 0.00 H new ATOM 0 HH21 ARG A 71 12.291 18.304 -33.650 1.00 0.00 H new ATOM 0 HH22 ARG A 71 11.719 19.823 -34.348 1.00 0.00 H new ATOM 1051 N LYS A 72 18.657 13.912 -35.500 1.00 0.00 N ATOM 1052 CA LYS A 72 18.570 12.746 -36.405 1.00 0.00 C ATOM 1053 C LYS A 72 18.050 11.470 -35.719 1.00 0.00 C ATOM 1054 O LYS A 72 18.111 11.328 -34.495 1.00 0.00 O ATOM 1055 CB LYS A 72 19.925 12.517 -37.103 1.00 0.00 C ATOM 1056 CG LYS A 72 21.031 11.987 -36.171 1.00 0.00 C ATOM 1057 CD LYS A 72 22.373 11.921 -36.913 1.00 0.00 C ATOM 1058 CE LYS A 72 23.477 11.390 -35.988 1.00 0.00 C ATOM 1059 NZ LYS A 72 24.794 11.326 -36.685 1.00 0.00 N ATOM 0 H LYS A 72 19.611 14.254 -35.386 1.00 0.00 H new ATOM 0 HA LYS A 72 17.821 12.982 -37.160 1.00 0.00 H new ATOM 0 HB2 LYS A 72 19.785 11.811 -37.921 1.00 0.00 H new ATOM 0 HB3 LYS A 72 20.257 13.456 -37.546 1.00 0.00 H new ATOM 0 HG2 LYS A 72 21.122 12.635 -35.300 1.00 0.00 H new ATOM 0 HG3 LYS A 72 20.762 10.996 -35.805 1.00 0.00 H new ATOM 0 HD2 LYS A 72 22.281 11.275 -37.786 1.00 0.00 H new ATOM 0 HD3 LYS A 72 22.642 12.912 -37.277 1.00 0.00 H new ATOM 0 HE2 LYS A 72 23.559 12.034 -35.112 1.00 0.00 H new ATOM 0 HE3 LYS A 72 23.206 10.397 -35.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 25.516 10.963 -36.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 24.722 10.692 -37.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 25.064 12.278 -37.005 1.00 0.00 H new ATOM 1073 N ASP A 73 17.554 10.529 -36.523 1.00 0.00 N ATOM 1074 CA ASP A 73 17.060 9.224 -36.059 1.00 0.00 C ATOM 1075 C ASP A 73 18.191 8.339 -35.494 1.00 0.00 C ATOM 1076 O ASP A 73 19.274 8.251 -36.082 1.00 0.00 O ATOM 1077 CB ASP A 73 16.334 8.526 -37.216 1.00 0.00 C ATOM 1078 CG ASP A 73 15.724 7.186 -36.779 1.00 0.00 C ATOM 1079 OD1 ASP A 73 14.811 7.193 -35.919 1.00 0.00 O ATOM 1080 OD2 ASP A 73 16.141 6.121 -37.293 1.00 0.00 O ATOM 0 H ASP A 73 17.481 10.650 -37.533 1.00 0.00 H new ATOM 0 HA ASP A 73 16.364 9.389 -35.237 1.00 0.00 H new ATOM 0 HB2 ASP A 73 15.547 9.177 -37.597 1.00 0.00 H new ATOM 0 HB3 ASP A 73 17.033 8.358 -38.035 1.00 0.00 H new ATOM 1085 N LEU A 74 17.936 7.676 -34.356 1.00 0.00 N ATOM 1086 CA LEU A 74 18.896 6.828 -33.630 1.00 0.00 C ATOM 1087 C LEU A 74 18.229 5.552 -33.084 1.00 0.00 C ATOM 1088 O LEU A 74 17.071 5.570 -32.661 1.00 0.00 O ATOM 1089 CB LEU A 74 19.522 7.629 -32.466 1.00 0.00 C ATOM 1090 CG LEU A 74 20.441 8.802 -32.867 1.00 0.00 C ATOM 1091 CD1 LEU A 74 20.838 9.589 -31.616 1.00 0.00 C ATOM 1092 CD2 LEU A 74 21.730 8.327 -33.541 1.00 0.00 C ATOM 0 H LEU A 74 17.025 7.716 -33.899 1.00 0.00 H new ATOM 0 HA LEU A 74 19.673 6.525 -34.332 1.00 0.00 H new ATOM 0 HB2 LEU A 74 18.715 8.021 -31.846 1.00 0.00 H new ATOM 0 HB3 LEU A 74 20.095 6.941 -31.845 1.00 0.00 H new ATOM 0 HG LEU A 74 19.881 9.417 -33.571 1.00 0.00 H new ATOM 0 HD11 LEU A 74 21.487 10.418 -31.898 1.00 0.00 H new ATOM 0 HD12 LEU A 74 19.942 9.978 -31.132 1.00 0.00 H new ATOM 0 HD13 LEU A 74 21.367 8.932 -30.926 1.00 0.00 H new ATOM 0 HD21 LEU A 74 22.342 9.190 -33.804 1.00 0.00 H new ATOM 0 HD22 LEU A 74 22.283 7.684 -32.856 1.00 0.00 H new ATOM 0 HD23 LEU A 74 21.484 7.768 -34.444 1.00 0.00 H new ATOM 1104 N SER A 75 18.992 4.456 -33.014 1.00 0.00 N ATOM 1105 CA SER A 75 18.516 3.124 -32.580 1.00 0.00 C ATOM 1106 C SER A 75 18.204 3.013 -31.075 1.00 0.00 C ATOM 1107 O SER A 75 17.611 2.026 -30.638 1.00 0.00 O ATOM 1108 CB SER A 75 19.548 2.052 -32.964 1.00 0.00 C ATOM 1109 OG SER A 75 19.866 2.128 -34.350 1.00 0.00 O ATOM 0 H SER A 75 19.981 4.463 -33.262 1.00 0.00 H new ATOM 0 HA SER A 75 17.570 2.968 -33.098 1.00 0.00 H new ATOM 0 HB2 SER A 75 20.453 2.184 -32.371 1.00 0.00 H new ATOM 0 HB3 SER A 75 19.155 1.063 -32.730 1.00 0.00 H new ATOM 0 HG SER A 75 20.526 1.438 -34.573 1.00 0.00 H new ATOM 1115 N VAL A 76 18.580 4.020 -30.273 1.00 0.00 N ATOM 1116 CA VAL A 76 18.364 4.071 -28.809 1.00 0.00 C ATOM 1117 C VAL A 76 16.891 4.305 -28.412 1.00 0.00 C ATOM 1118 O VAL A 76 16.519 4.092 -27.254 1.00 0.00 O ATOM 1119 CB VAL A 76 19.320 5.117 -28.187 1.00 0.00 C ATOM 1120 CG1 VAL A 76 18.895 6.566 -28.469 1.00 0.00 C ATOM 1121 CG2 VAL A 76 19.519 4.938 -26.679 1.00 0.00 C ATOM 0 H VAL A 76 19.057 4.848 -30.630 1.00 0.00 H new ATOM 0 HA VAL A 76 18.600 3.088 -28.401 1.00 0.00 H new ATOM 0 HB VAL A 76 20.272 4.930 -28.684 1.00 0.00 H new ATOM 0 HG11 VAL A 76 19.606 7.250 -28.006 1.00 0.00 H new ATOM 0 HG12 VAL A 76 18.875 6.736 -29.545 1.00 0.00 H new ATOM 0 HG13 VAL A 76 17.902 6.741 -28.056 1.00 0.00 H new ATOM 0 HG21 VAL A 76 20.200 5.704 -26.308 1.00 0.00 H new ATOM 0 HG22 VAL A 76 18.559 5.030 -26.172 1.00 0.00 H new ATOM 0 HG23 VAL A 76 19.940 3.952 -26.482 1.00 0.00 H new ATOM 1131 N LYS A 77 16.037 4.730 -29.358 1.00 0.00 N ATOM 1132 CA LYS A 77 14.610 5.032 -29.138 1.00 0.00 C ATOM 1133 C LYS A 77 13.786 3.817 -28.661 1.00 0.00 C ATOM 1134 O LYS A 77 14.109 2.665 -28.966 1.00 0.00 O ATOM 1135 CB LYS A 77 14.013 5.677 -30.406 1.00 0.00 C ATOM 1136 CG LYS A 77 13.899 4.710 -31.599 1.00 0.00 C ATOM 1137 CD LYS A 77 13.460 5.449 -32.868 1.00 0.00 C ATOM 1138 CE LYS A 77 13.386 4.471 -34.048 1.00 0.00 C ATOM 1139 NZ LYS A 77 13.016 5.166 -35.308 1.00 0.00 N ATOM 0 H LYS A 77 16.327 4.878 -30.325 1.00 0.00 H new ATOM 0 HA LYS A 77 14.552 5.745 -28.315 1.00 0.00 H new ATOM 0 HB2 LYS A 77 13.023 6.069 -30.172 1.00 0.00 H new ATOM 0 HB3 LYS A 77 14.631 6.526 -30.696 1.00 0.00 H new ATOM 0 HG2 LYS A 77 14.860 4.225 -31.771 1.00 0.00 H new ATOM 0 HG3 LYS A 77 13.182 3.923 -31.366 1.00 0.00 H new ATOM 0 HD2 LYS A 77 12.487 5.914 -32.709 1.00 0.00 H new ATOM 0 HD3 LYS A 77 14.163 6.251 -33.093 1.00 0.00 H new ATOM 0 HE2 LYS A 77 14.349 3.977 -34.173 1.00 0.00 H new ATOM 0 HE3 LYS A 77 12.654 3.693 -33.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 13.090 4.502 -36.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 12.039 5.515 -35.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 13.660 5.968 -35.464 1.00 0.00 H new ATOM 1153 N GLY A 78 12.701 4.089 -27.934 1.00 0.00 N ATOM 1154 CA GLY A 78 11.785 3.083 -27.381 1.00 0.00 C ATOM 1155 C GLY A 78 10.744 3.676 -26.422 1.00 0.00 C ATOM 1156 O GLY A 78 10.642 4.897 -26.273 1.00 0.00 O ATOM 0 H GLY A 78 12.425 5.044 -27.705 1.00 0.00 H new ATOM 0 HA2 GLY A 78 11.270 2.580 -28.200 1.00 0.00 H new ATOM 0 HA3 GLY A 78 12.364 2.324 -26.855 1.00 0.00 H new ATOM 1160 N MET A 79 9.976 2.806 -25.755 1.00 0.00 N ATOM 1161 CA MET A 79 8.994 3.200 -24.730 1.00 0.00 C ATOM 1162 C MET A 79 9.680 3.670 -23.433 1.00 0.00 C ATOM 1163 O MET A 79 10.749 3.172 -23.068 1.00 0.00 O ATOM 1164 CB MET A 79 8.023 2.043 -24.442 1.00 0.00 C ATOM 1165 CG MET A 79 7.151 1.700 -25.657 1.00 0.00 C ATOM 1166 SD MET A 79 5.952 0.375 -25.345 1.00 0.00 S ATOM 1167 CE MET A 79 5.151 0.301 -26.970 1.00 0.00 C ATOM 0 H MET A 79 10.017 1.799 -25.911 1.00 0.00 H new ATOM 0 HA MET A 79 8.427 4.044 -25.123 1.00 0.00 H new ATOM 0 HB2 MET A 79 8.590 1.161 -24.144 1.00 0.00 H new ATOM 0 HB3 MET A 79 7.383 2.310 -23.601 1.00 0.00 H new ATOM 0 HG2 MET A 79 6.615 2.595 -25.973 1.00 0.00 H new ATOM 0 HG3 MET A 79 7.796 1.406 -26.485 1.00 0.00 H new ATOM 0 HE1 MET A 79 4.379 -0.468 -26.960 1.00 0.00 H new ATOM 0 HE2 MET A 79 4.699 1.266 -27.197 1.00 0.00 H new ATOM 0 HE3 MET A 79 5.893 0.060 -27.731 1.00 0.00 H new ATOM 1177 N LEU A 80 9.049 4.620 -22.728 1.00 0.00 N ATOM 1178 CA LEU A 80 9.557 5.251 -21.497 1.00 0.00 C ATOM 1179 C LEU A 80 8.468 5.347 -20.407 1.00 0.00 C ATOM 1180 O LEU A 80 7.267 5.301 -20.695 1.00 0.00 O ATOM 1181 CB LEU A 80 10.110 6.655 -21.829 1.00 0.00 C ATOM 1182 CG LEU A 80 11.354 6.686 -22.740 1.00 0.00 C ATOM 1183 CD1 LEU A 80 11.691 8.134 -23.099 1.00 0.00 C ATOM 1184 CD2 LEU A 80 12.585 6.072 -22.063 1.00 0.00 C ATOM 0 H LEU A 80 8.138 4.984 -23.008 1.00 0.00 H new ATOM 0 HA LEU A 80 10.356 4.625 -21.100 1.00 0.00 H new ATOM 0 HB2 LEU A 80 9.319 7.233 -22.306 1.00 0.00 H new ATOM 0 HB3 LEU A 80 10.354 7.159 -20.894 1.00 0.00 H new ATOM 0 HG LEU A 80 11.113 6.101 -23.627 1.00 0.00 H new ATOM 0 HD11 LEU A 80 12.570 8.154 -23.743 1.00 0.00 H new ATOM 0 HD12 LEU A 80 10.848 8.585 -23.622 1.00 0.00 H new ATOM 0 HD13 LEU A 80 11.895 8.697 -22.188 1.00 0.00 H new ATOM 0 HD21 LEU A 80 13.435 6.117 -22.744 1.00 0.00 H new ATOM 0 HD22 LEU A 80 12.817 6.629 -21.155 1.00 0.00 H new ATOM 0 HD23 LEU A 80 12.379 5.032 -21.808 1.00 0.00 H new ATOM 1196 N TYR A 81 8.901 5.505 -19.152 1.00 0.00 N ATOM 1197 CA TYR A 81 8.024 5.701 -17.987 1.00 0.00 C ATOM 1198 C TYR A 81 7.394 7.112 -17.939 1.00 0.00 C ATOM 1199 O TYR A 81 7.846 8.039 -18.618 1.00 0.00 O ATOM 1200 CB TYR A 81 8.810 5.398 -16.699 1.00 0.00 C ATOM 1201 CG TYR A 81 9.393 3.996 -16.635 1.00 0.00 C ATOM 1202 CD1 TYR A 81 8.541 2.890 -16.433 1.00 0.00 C ATOM 1203 CD2 TYR A 81 10.780 3.794 -16.785 1.00 0.00 C ATOM 1204 CE1 TYR A 81 9.072 1.586 -16.385 1.00 0.00 C ATOM 1205 CE2 TYR A 81 11.313 2.491 -16.738 1.00 0.00 C ATOM 1206 CZ TYR A 81 10.462 1.384 -16.538 1.00 0.00 C ATOM 1207 OH TYR A 81 10.990 0.127 -16.499 1.00 0.00 O ATOM 0 H TYR A 81 9.892 5.500 -18.910 1.00 0.00 H new ATOM 0 HA TYR A 81 7.189 5.006 -18.078 1.00 0.00 H new ATOM 0 HB2 TYR A 81 9.621 6.120 -16.604 1.00 0.00 H new ATOM 0 HB3 TYR A 81 8.151 5.544 -15.843 1.00 0.00 H new ATOM 0 HD1 TYR A 81 7.478 3.043 -16.315 1.00 0.00 H new ATOM 0 HD2 TYR A 81 11.435 4.639 -16.936 1.00 0.00 H new ATOM 0 HE1 TYR A 81 8.417 0.741 -16.231 1.00 0.00 H new ATOM 0 HE2 TYR A 81 12.376 2.339 -16.855 1.00 0.00 H new ATOM 0 HH TYR A 81 11.961 0.176 -16.623 1.00 0.00 H new ATOM 1217 N ASP A 82 6.346 7.272 -17.125 1.00 0.00 N ATOM 1218 CA ASP A 82 5.641 8.543 -16.898 1.00 0.00 C ATOM 1219 C ASP A 82 5.332 8.763 -15.400 1.00 0.00 C ATOM 1220 O ASP A 82 5.332 7.814 -14.611 1.00 0.00 O ATOM 1221 CB ASP A 82 4.370 8.572 -17.765 1.00 0.00 C ATOM 1222 CG ASP A 82 3.673 9.946 -17.795 1.00 0.00 C ATOM 1223 OD1 ASP A 82 4.358 10.989 -17.663 1.00 0.00 O ATOM 1224 OD2 ASP A 82 2.431 9.983 -17.979 1.00 0.00 O ATOM 0 H ASP A 82 5.951 6.499 -16.589 1.00 0.00 H new ATOM 0 HA ASP A 82 6.285 9.371 -17.194 1.00 0.00 H new ATOM 0 HB2 ASP A 82 4.629 8.283 -18.784 1.00 0.00 H new ATOM 0 HB3 ASP A 82 3.668 7.826 -17.391 1.00 0.00 H new ATOM 1229 N SER A 83 5.084 10.018 -15.007 1.00 0.00 N ATOM 1230 CA SER A 83 4.842 10.511 -13.631 1.00 0.00 C ATOM 1231 C SER A 83 5.961 10.276 -12.595 1.00 0.00 C ATOM 1232 O SER A 83 5.950 10.899 -11.534 1.00 0.00 O ATOM 1233 CB SER A 83 3.494 10.013 -13.082 1.00 0.00 C ATOM 1234 OG SER A 83 2.422 10.374 -13.945 1.00 0.00 O ATOM 0 H SER A 83 5.043 10.777 -15.687 1.00 0.00 H new ATOM 0 HA SER A 83 4.826 11.593 -13.764 1.00 0.00 H new ATOM 0 HB2 SER A 83 3.523 8.929 -12.967 1.00 0.00 H new ATOM 0 HB3 SER A 83 3.324 10.434 -12.091 1.00 0.00 H new ATOM 0 HG SER A 83 1.577 10.044 -13.573 1.00 0.00 H new ATOM 1240 N ASP A 84 6.966 9.450 -12.887 1.00 0.00 N ATOM 1241 CA ASP A 84 8.116 9.187 -12.012 1.00 0.00 C ATOM 1242 C ASP A 84 8.943 10.455 -11.727 1.00 0.00 C ATOM 1243 O ASP A 84 9.392 10.653 -10.600 1.00 0.00 O ATOM 1244 CB ASP A 84 8.978 8.067 -12.614 1.00 0.00 C ATOM 1245 CG ASP A 84 9.745 8.508 -13.874 1.00 0.00 C ATOM 1246 OD1 ASP A 84 9.106 8.716 -14.933 1.00 0.00 O ATOM 1247 OD2 ASP A 84 10.991 8.647 -13.800 1.00 0.00 O ATOM 0 H ASP A 84 7.007 8.929 -13.763 1.00 0.00 H new ATOM 0 HA ASP A 84 7.736 8.858 -11.045 1.00 0.00 H new ATOM 0 HB2 ASP A 84 9.690 7.722 -11.864 1.00 0.00 H new ATOM 0 HB3 ASP A 84 8.340 7.219 -12.862 1.00 0.00 H new ATOM 1252 N SER A 85 9.043 11.364 -12.700 1.00 0.00 N ATOM 1253 CA SER A 85 9.623 12.707 -12.548 1.00 0.00 C ATOM 1254 C SER A 85 8.958 13.500 -11.416 1.00 0.00 C ATOM 1255 O SER A 85 9.637 14.038 -10.540 1.00 0.00 O ATOM 1256 CB SER A 85 9.471 13.462 -13.879 1.00 0.00 C ATOM 1257 OG SER A 85 8.133 13.362 -14.356 1.00 0.00 O ATOM 0 H SER A 85 8.712 11.183 -13.648 1.00 0.00 H new ATOM 0 HA SER A 85 10.676 12.599 -12.286 1.00 0.00 H new ATOM 0 HB2 SER A 85 9.738 14.510 -13.743 1.00 0.00 H new ATOM 0 HB3 SER A 85 10.159 13.051 -14.618 1.00 0.00 H new ATOM 0 HG SER A 85 8.050 13.848 -15.203 1.00 0.00 H new ATOM 1263 N GLN A 86 7.621 13.498 -11.374 1.00 0.00 N ATOM 1264 CA GLN A 86 6.839 14.154 -10.322 1.00 0.00 C ATOM 1265 C GLN A 86 6.957 13.414 -8.980 1.00 0.00 C ATOM 1266 O GLN A 86 7.013 14.059 -7.936 1.00 0.00 O ATOM 1267 CB GLN A 86 5.369 14.289 -10.760 1.00 0.00 C ATOM 1268 CG GLN A 86 5.199 15.167 -12.011 1.00 0.00 C ATOM 1269 CD GLN A 86 3.725 15.325 -12.398 1.00 0.00 C ATOM 1270 OE1 GLN A 86 3.210 14.652 -13.281 1.00 0.00 O ATOM 1271 NE2 GLN A 86 2.986 16.204 -11.749 1.00 0.00 N ATOM 0 H GLN A 86 7.046 13.035 -12.078 1.00 0.00 H new ATOM 0 HA GLN A 86 7.248 15.153 -10.169 1.00 0.00 H new ATOM 0 HB2 GLN A 86 4.961 13.298 -10.959 1.00 0.00 H new ATOM 0 HB3 GLN A 86 4.788 14.714 -9.941 1.00 0.00 H new ATOM 0 HG2 GLN A 86 5.634 16.149 -11.828 1.00 0.00 H new ATOM 0 HG3 GLN A 86 5.748 14.725 -12.843 1.00 0.00 H new ATOM 0 HE21 GLN A 86 3.400 16.772 -11.010 1.00 0.00 H new ATOM 0 HE22 GLN A 86 2.000 16.315 -11.986 1.00 0.00 H new ATOM 1280 N GLN A 87 7.074 12.082 -8.989 1.00 0.00 N ATOM 1281 CA GLN A 87 7.249 11.275 -7.771 1.00 0.00 C ATOM 1282 C GLN A 87 8.607 11.550 -7.094 1.00 0.00 C ATOM 1283 O GLN A 87 8.643 11.857 -5.900 1.00 0.00 O ATOM 1284 CB GLN A 87 7.028 9.792 -8.135 1.00 0.00 C ATOM 1285 CG GLN A 87 6.681 8.872 -6.948 1.00 0.00 C ATOM 1286 CD GLN A 87 7.848 8.568 -6.012 1.00 0.00 C ATOM 1287 OE1 GLN A 87 7.849 8.931 -4.844 1.00 0.00 O ATOM 1288 NE2 GLN A 87 8.868 7.879 -6.474 1.00 0.00 N ATOM 0 H GLN A 87 7.050 11.528 -9.845 1.00 0.00 H new ATOM 0 HA GLN A 87 6.508 11.556 -7.023 1.00 0.00 H new ATOM 0 HB2 GLN A 87 6.225 9.730 -8.869 1.00 0.00 H new ATOM 0 HB3 GLN A 87 7.930 9.414 -8.616 1.00 0.00 H new ATOM 0 HG2 GLN A 87 5.881 9.334 -6.370 1.00 0.00 H new ATOM 0 HG3 GLN A 87 6.291 7.931 -7.337 1.00 0.00 H new ATOM 0 HE21 GLN A 87 8.877 7.571 -7.446 1.00 0.00 H new ATOM 0 HE22 GLN A 87 9.650 7.652 -5.860 1.00 0.00 H new ATOM 1297 N ILE A 88 9.713 11.543 -7.851 1.00 0.00 N ATOM 1298 CA ILE A 88 11.042 11.910 -7.324 1.00 0.00 C ATOM 1299 C ILE A 88 11.061 13.379 -6.889 1.00 0.00 C ATOM 1300 O ILE A 88 11.543 13.673 -5.797 1.00 0.00 O ATOM 1301 CB ILE A 88 12.177 11.612 -8.336 1.00 0.00 C ATOM 1302 CG1 ILE A 88 12.243 10.137 -8.796 1.00 0.00 C ATOM 1303 CG2 ILE A 88 13.544 12.017 -7.742 1.00 0.00 C ATOM 1304 CD1 ILE A 88 12.399 9.090 -7.687 1.00 0.00 C ATOM 0 H ILE A 88 9.716 11.286 -8.838 1.00 0.00 H new ATOM 0 HA ILE A 88 11.229 11.287 -6.450 1.00 0.00 H new ATOM 0 HB ILE A 88 11.944 12.207 -9.219 1.00 0.00 H new ATOM 0 HG12 ILE A 88 11.335 9.911 -9.355 1.00 0.00 H new ATOM 0 HG13 ILE A 88 13.078 10.031 -9.488 1.00 0.00 H new ATOM 0 HG21 ILE A 88 14.332 11.802 -8.464 1.00 0.00 H new ATOM 0 HG22 ILE A 88 13.541 13.083 -7.515 1.00 0.00 H new ATOM 0 HG23 ILE A 88 13.725 11.452 -6.828 1.00 0.00 H new ATOM 0 HD11 ILE A 88 12.434 8.094 -8.129 1.00 0.00 H new ATOM 0 HD12 ILE A 88 13.322 9.276 -7.139 1.00 0.00 H new ATOM 0 HD13 ILE A 88 11.552 9.155 -7.004 1.00 0.00 H new ATOM 1316 N LEU A 89 10.492 14.297 -7.682 1.00 0.00 N ATOM 1317 CA LEU A 89 10.415 15.719 -7.314 1.00 0.00 C ATOM 1318 C LEU A 89 9.643 15.927 -6.000 1.00 0.00 C ATOM 1319 O LEU A 89 10.119 16.648 -5.131 1.00 0.00 O ATOM 1320 CB LEU A 89 9.784 16.501 -8.487 1.00 0.00 C ATOM 1321 CG LEU A 89 9.661 18.026 -8.287 1.00 0.00 C ATOM 1322 CD1 LEU A 89 11.027 18.707 -8.246 1.00 0.00 C ATOM 1323 CD2 LEU A 89 8.875 18.631 -9.450 1.00 0.00 C ATOM 0 H LEU A 89 10.076 14.079 -8.587 1.00 0.00 H new ATOM 0 HA LEU A 89 11.420 16.100 -7.132 1.00 0.00 H new ATOM 0 HB2 LEU A 89 10.378 16.318 -9.383 1.00 0.00 H new ATOM 0 HB3 LEU A 89 8.789 16.097 -8.675 1.00 0.00 H new ATOM 0 HG LEU A 89 9.154 18.187 -7.336 1.00 0.00 H new ATOM 0 HD11 LEU A 89 10.895 19.780 -8.104 1.00 0.00 H new ATOM 0 HD12 LEU A 89 11.611 18.301 -7.420 1.00 0.00 H new ATOM 0 HD13 LEU A 89 11.551 18.527 -9.185 1.00 0.00 H new ATOM 0 HD21 LEU A 89 8.788 19.708 -9.309 1.00 0.00 H new ATOM 0 HD22 LEU A 89 9.396 18.428 -10.386 1.00 0.00 H new ATOM 0 HD23 LEU A 89 7.880 18.188 -9.486 1.00 0.00 H new ATOM 1335 N ASN A 90 8.508 15.249 -5.810 1.00 0.00 N ATOM 1336 CA ASN A 90 7.744 15.284 -4.558 1.00 0.00 C ATOM 1337 C ASN A 90 8.567 14.741 -3.374 1.00 0.00 C ATOM 1338 O ASN A 90 8.657 15.406 -2.343 1.00 0.00 O ATOM 1339 CB ASN A 90 6.424 14.515 -4.771 1.00 0.00 C ATOM 1340 CG ASN A 90 5.558 14.451 -3.524 1.00 0.00 C ATOM 1341 OD1 ASN A 90 5.556 13.470 -2.797 1.00 0.00 O ATOM 1342 ND2 ASN A 90 4.814 15.491 -3.222 1.00 0.00 N ATOM 0 H ASN A 90 8.089 14.655 -6.526 1.00 0.00 H new ATOM 0 HA ASN A 90 7.509 16.315 -4.295 1.00 0.00 H new ATOM 0 HB2 ASN A 90 5.860 14.991 -5.573 1.00 0.00 H new ATOM 0 HB3 ASN A 90 6.651 13.501 -5.100 1.00 0.00 H new ATOM 0 HD21 ASN A 90 4.236 15.478 -2.382 1.00 0.00 H new ATOM 0 HD22 ASN A 90 4.814 16.311 -3.828 1.00 0.00 H new ATOM 1349 N ARG A 91 9.255 13.598 -3.528 1.00 0.00 N ATOM 1350 CA ARG A 91 10.094 13.042 -2.447 1.00 0.00 C ATOM 1351 C ARG A 91 11.290 13.940 -2.117 1.00 0.00 C ATOM 1352 O ARG A 91 11.605 14.111 -0.945 1.00 0.00 O ATOM 1353 CB ARG A 91 10.532 11.603 -2.794 1.00 0.00 C ATOM 1354 CG ARG A 91 10.810 10.728 -1.549 1.00 0.00 C ATOM 1355 CD ARG A 91 9.579 10.462 -0.662 1.00 0.00 C ATOM 1356 NE ARG A 91 8.417 10.035 -1.474 1.00 0.00 N ATOM 1357 CZ ARG A 91 7.348 10.755 -1.763 1.00 0.00 C ATOM 1358 NH1 ARG A 91 6.984 11.781 -1.054 1.00 0.00 N ATOM 1359 NH2 ARG A 91 6.644 10.479 -2.817 1.00 0.00 N ATOM 0 H ARG A 91 9.249 13.042 -4.383 1.00 0.00 H new ATOM 0 HA ARG A 91 9.488 13.005 -1.542 1.00 0.00 H new ATOM 0 HB2 ARG A 91 9.756 11.130 -3.395 1.00 0.00 H new ATOM 0 HB3 ARG A 91 11.431 11.643 -3.409 1.00 0.00 H new ATOM 0 HG2 ARG A 91 11.218 9.772 -1.877 1.00 0.00 H new ATOM 0 HG3 ARG A 91 11.578 11.212 -0.946 1.00 0.00 H new ATOM 0 HD2 ARG A 91 9.816 9.692 0.072 1.00 0.00 H new ATOM 0 HD3 ARG A 91 9.326 11.365 -0.106 1.00 0.00 H new ATOM 0 HE ARG A 91 8.445 9.087 -1.849 1.00 0.00 H new ATOM 0 HH11 ARG A 91 7.531 12.058 -0.239 1.00 0.00 H new ATOM 0 HH12 ARG A 91 6.151 12.310 -1.312 1.00 0.00 H new ATOM 0 HH21 ARG A 91 6.916 9.705 -3.424 1.00 0.00 H new ATOM 0 HH22 ARG A 91 5.819 11.036 -3.039 1.00 0.00 H new ATOM 1373 N LEU A 92 11.899 14.576 -3.117 1.00 0.00 N ATOM 1374 CA LEU A 92 12.990 15.536 -2.909 1.00 0.00 C ATOM 1375 C LEU A 92 12.499 16.838 -2.255 1.00 0.00 C ATOM 1376 O LEU A 92 13.163 17.337 -1.350 1.00 0.00 O ATOM 1377 CB LEU A 92 13.696 15.782 -4.258 1.00 0.00 C ATOM 1378 CG LEU A 92 15.033 16.540 -4.145 1.00 0.00 C ATOM 1379 CD1 LEU A 92 16.119 15.722 -3.448 1.00 0.00 C ATOM 1380 CD2 LEU A 92 15.546 16.850 -5.547 1.00 0.00 C ATOM 0 H LEU A 92 11.652 14.442 -4.097 1.00 0.00 H new ATOM 0 HA LEU A 92 13.710 15.117 -2.206 1.00 0.00 H new ATOM 0 HB2 LEU A 92 13.876 14.822 -4.741 1.00 0.00 H new ATOM 0 HB3 LEU A 92 13.026 16.345 -4.908 1.00 0.00 H new ATOM 0 HG LEU A 92 14.837 17.438 -3.560 1.00 0.00 H new ATOM 0 HD11 LEU A 92 17.038 16.306 -3.397 1.00 0.00 H new ATOM 0 HD12 LEU A 92 15.793 15.469 -2.439 1.00 0.00 H new ATOM 0 HD13 LEU A 92 16.302 14.806 -4.010 1.00 0.00 H new ATOM 0 HD21 LEU A 92 16.492 17.387 -5.478 1.00 0.00 H new ATOM 0 HD22 LEU A 92 15.696 15.919 -6.094 1.00 0.00 H new ATOM 0 HD23 LEU A 92 14.817 17.466 -6.073 1.00 0.00 H new ATOM 1392 N ARG A 93 11.318 17.354 -2.628 1.00 0.00 N ATOM 1393 CA ARG A 93 10.702 18.519 -1.958 1.00 0.00 C ATOM 1394 C ARG A 93 10.449 18.229 -0.477 1.00 0.00 C ATOM 1395 O ARG A 93 10.817 19.029 0.376 1.00 0.00 O ATOM 1396 CB ARG A 93 9.393 18.919 -2.667 1.00 0.00 C ATOM 1397 CG ARG A 93 9.632 19.702 -3.971 1.00 0.00 C ATOM 1398 CD ARG A 93 8.302 19.940 -4.700 1.00 0.00 C ATOM 1399 NE ARG A 93 8.491 20.810 -5.872 1.00 0.00 N ATOM 1400 CZ ARG A 93 7.589 21.258 -6.719 1.00 0.00 C ATOM 1401 NH1 ARG A 93 6.333 20.908 -6.662 1.00 0.00 N ATOM 1402 NH2 ARG A 93 7.956 22.083 -7.653 1.00 0.00 N ATOM 0 H ARG A 93 10.762 16.981 -3.398 1.00 0.00 H new ATOM 0 HA ARG A 93 11.398 19.355 -2.022 1.00 0.00 H new ATOM 0 HB2 ARG A 93 8.817 18.021 -2.889 1.00 0.00 H new ATOM 0 HB3 ARG A 93 8.790 19.525 -1.991 1.00 0.00 H new ATOM 0 HG2 ARG A 93 10.108 20.657 -3.748 1.00 0.00 H new ATOM 0 HG3 ARG A 93 10.314 19.148 -4.616 1.00 0.00 H new ATOM 0 HD2 ARG A 93 7.880 18.986 -5.015 1.00 0.00 H new ATOM 0 HD3 ARG A 93 7.585 20.395 -4.017 1.00 0.00 H new ATOM 0 HE ARG A 93 9.451 21.106 -6.052 1.00 0.00 H new ATOM 0 HH11 ARG A 93 6.016 20.262 -5.939 1.00 0.00 H new ATOM 0 HH12 ARG A 93 5.668 21.281 -7.340 1.00 0.00 H new ATOM 0 HH21 ARG A 93 8.931 22.374 -7.722 1.00 0.00 H new ATOM 0 HH22 ARG A 93 7.269 22.439 -8.317 1.00 0.00 H new ATOM 1416 N GLU A 94 9.921 17.047 -0.159 1.00 0.00 N ATOM 1417 CA GLU A 94 9.731 16.616 1.234 1.00 0.00 C ATOM 1418 C GLU A 94 11.072 16.475 1.980 1.00 0.00 C ATOM 1419 O GLU A 94 11.243 17.076 3.043 1.00 0.00 O ATOM 1420 CB GLU A 94 8.931 15.303 1.272 1.00 0.00 C ATOM 1421 CG GLU A 94 7.481 15.463 0.794 1.00 0.00 C ATOM 1422 CD GLU A 94 6.625 16.235 1.816 1.00 0.00 C ATOM 1423 OE1 GLU A 94 6.110 15.615 2.778 1.00 0.00 O ATOM 1424 OE2 GLU A 94 6.452 17.469 1.665 1.00 0.00 O ATOM 0 H GLU A 94 9.614 16.363 -0.851 1.00 0.00 H new ATOM 0 HA GLU A 94 9.163 17.388 1.753 1.00 0.00 H new ATOM 0 HB2 GLU A 94 9.432 14.562 0.649 1.00 0.00 H new ATOM 0 HB3 GLU A 94 8.930 14.915 2.291 1.00 0.00 H new ATOM 0 HG2 GLU A 94 7.469 15.988 -0.161 1.00 0.00 H new ATOM 0 HG3 GLU A 94 7.044 14.479 0.623 1.00 0.00 H new ATOM 1431 N ARG A 95 12.054 15.763 1.397 1.00 0.00 N ATOM 1432 CA ARG A 95 13.371 15.522 2.022 1.00 0.00 C ATOM 1433 C ARG A 95 14.143 16.815 2.311 1.00 0.00 C ATOM 1434 O ARG A 95 14.741 16.943 3.380 1.00 0.00 O ATOM 1435 CB ARG A 95 14.200 14.593 1.114 1.00 0.00 C ATOM 1436 CG ARG A 95 15.421 13.982 1.826 1.00 0.00 C ATOM 1437 CD ARG A 95 16.280 13.185 0.835 1.00 0.00 C ATOM 1438 NE ARG A 95 17.014 12.094 1.498 1.00 0.00 N ATOM 1439 CZ ARG A 95 18.310 11.870 1.534 1.00 0.00 C ATOM 1440 NH1 ARG A 95 19.218 12.727 1.178 1.00 0.00 N ATOM 1441 NH2 ARG A 95 18.763 10.731 1.946 1.00 0.00 N ATOM 0 H ARG A 95 11.957 15.336 0.476 1.00 0.00 H new ATOM 0 HA ARG A 95 13.195 15.049 2.988 1.00 0.00 H new ATOM 0 HB2 ARG A 95 13.561 13.789 0.747 1.00 0.00 H new ATOM 0 HB3 ARG A 95 14.538 15.154 0.243 1.00 0.00 H new ATOM 0 HG2 ARG A 95 16.018 14.773 2.279 1.00 0.00 H new ATOM 0 HG3 ARG A 95 15.089 13.330 2.634 1.00 0.00 H new ATOM 0 HD2 ARG A 95 15.643 12.771 0.053 1.00 0.00 H new ATOM 0 HD3 ARG A 95 16.988 13.855 0.348 1.00 0.00 H new ATOM 0 HE ARG A 95 16.437 11.418 1.999 1.00 0.00 H new ATOM 0 HH11 ARG A 95 18.944 13.650 0.841 1.00 0.00 H new ATOM 0 HH12 ARG A 95 20.205 12.477 1.235 1.00 0.00 H new ATOM 0 HH21 ARG A 95 18.115 10.002 2.245 1.00 0.00 H new ATOM 0 HH22 ARG A 95 19.768 10.561 1.972 1.00 0.00 H new ATOM 1455 N VAL A 96 14.132 17.760 1.367 1.00 0.00 N ATOM 1456 CA VAL A 96 14.962 18.978 1.432 1.00 0.00 C ATOM 1457 C VAL A 96 14.243 20.147 2.120 1.00 0.00 C ATOM 1458 O VAL A 96 14.881 20.877 2.885 1.00 0.00 O ATOM 1459 CB VAL A 96 15.494 19.356 0.032 1.00 0.00 C ATOM 1460 CG1 VAL A 96 16.474 20.536 0.092 1.00 0.00 C ATOM 1461 CG2 VAL A 96 16.248 18.166 -0.588 1.00 0.00 C ATOM 0 H VAL A 96 13.548 17.707 0.532 1.00 0.00 H new ATOM 0 HA VAL A 96 15.823 18.752 2.062 1.00 0.00 H new ATOM 0 HB VAL A 96 14.627 19.632 -0.568 1.00 0.00 H new ATOM 0 HG11 VAL A 96 16.824 20.770 -0.913 1.00 0.00 H new ATOM 0 HG12 VAL A 96 15.970 21.406 0.512 1.00 0.00 H new ATOM 0 HG13 VAL A 96 17.325 20.271 0.720 1.00 0.00 H new ATOM 0 HG21 VAL A 96 16.618 18.444 -1.575 1.00 0.00 H new ATOM 0 HG22 VAL A 96 17.088 17.894 0.052 1.00 0.00 H new ATOM 0 HG23 VAL A 96 15.572 17.316 -0.681 1.00 0.00 H new ATOM 1471 N SER A 97 12.930 20.311 1.914 1.00 0.00 N ATOM 1472 CA SER A 97 12.160 21.456 2.438 1.00 0.00 C ATOM 1473 C SER A 97 11.263 21.123 3.643 1.00 0.00 C ATOM 1474 O SER A 97 10.837 22.044 4.346 1.00 0.00 O ATOM 1475 CB SER A 97 11.339 22.115 1.321 1.00 0.00 C ATOM 1476 OG SER A 97 12.169 22.461 0.217 1.00 0.00 O ATOM 0 H SER A 97 12.366 19.652 1.377 1.00 0.00 H new ATOM 0 HA SER A 97 12.904 22.159 2.812 1.00 0.00 H new ATOM 0 HB2 SER A 97 10.554 21.435 0.992 1.00 0.00 H new ATOM 0 HB3 SER A 97 10.846 23.008 1.705 1.00 0.00 H new ATOM 0 HG SER A 97 11.625 22.878 -0.483 1.00 0.00 H new ATOM 1482 N GLY A 98 10.996 19.841 3.942 1.00 0.00 N ATOM 1483 CA GLY A 98 10.136 19.429 5.069 1.00 0.00 C ATOM 1484 C GLY A 98 10.670 19.796 6.461 1.00 0.00 C ATOM 1485 O GLY A 98 9.891 19.903 7.411 1.00 0.00 O ATOM 0 H GLY A 98 11.371 19.057 3.408 1.00 0.00 H new ATOM 0 HA2 GLY A 98 9.154 19.884 4.942 1.00 0.00 H new ATOM 0 HA3 GLY A 98 9.996 18.349 5.023 1.00 0.00 H new ATOM 1489 N SER A 99 11.972 20.081 6.580 1.00 0.00 N ATOM 1490 CA SER A 99 12.653 20.493 7.823 1.00 0.00 C ATOM 1491 C SER A 99 12.144 21.817 8.427 1.00 0.00 C ATOM 1492 O SER A 99 12.487 22.143 9.567 1.00 0.00 O ATOM 1493 CB SER A 99 14.163 20.601 7.576 1.00 0.00 C ATOM 1494 OG SER A 99 14.676 19.401 7.010 1.00 0.00 O ATOM 0 H SER A 99 12.609 20.030 5.785 1.00 0.00 H new ATOM 0 HA SER A 99 12.423 19.717 8.553 1.00 0.00 H new ATOM 0 HB2 SER A 99 14.366 21.438 6.908 1.00 0.00 H new ATOM 0 HB3 SER A 99 14.674 20.811 8.515 1.00 0.00 H new ATOM 0 HG SER A 99 15.640 19.496 6.861 1.00 0.00 H new ATOM 1500 N THR A 100 11.312 22.577 7.699 1.00 0.00 N ATOM 1501 CA THR A 100 10.622 23.777 8.214 1.00 0.00 C ATOM 1502 C THR A 100 9.556 23.451 9.282 1.00 0.00 C ATOM 1503 O THR A 100 9.235 24.301 10.117 1.00 0.00 O ATOM 1504 CB THR A 100 10.016 24.574 7.037 1.00 0.00 C ATOM 1505 OG1 THR A 100 9.658 25.883 7.439 1.00 0.00 O ATOM 1506 CG2 THR A 100 8.767 23.933 6.420 1.00 0.00 C ATOM 0 H THR A 100 11.094 22.376 6.723 1.00 0.00 H new ATOM 0 HA THR A 100 11.367 24.391 8.720 1.00 0.00 H new ATOM 0 HB THR A 100 10.805 24.584 6.285 1.00 0.00 H new ATOM 0 HG1 THR A 100 9.279 26.367 6.676 1.00 0.00 H new ATOM 0 HG21 THR A 100 8.405 24.555 5.601 1.00 0.00 H new ATOM 0 HG22 THR A 100 9.016 22.942 6.040 1.00 0.00 H new ATOM 0 HG23 THR A 100 7.990 23.845 7.180 1.00 0.00 H new ATOM 1514 N ALA A 101 9.030 22.219 9.296 1.00 0.00 N ATOM 1515 CA ALA A 101 8.029 21.762 10.263 1.00 0.00 C ATOM 1516 C ALA A 101 8.621 21.492 11.665 1.00 0.00 C ATOM 1517 O ALA A 101 9.794 21.132 11.806 1.00 0.00 O ATOM 1518 CB ALA A 101 7.332 20.518 9.696 1.00 0.00 C ATOM 0 H ALA A 101 9.295 21.500 8.622 1.00 0.00 H new ATOM 0 HA ALA A 101 7.302 22.561 10.408 1.00 0.00 H new ATOM 0 HB1 ALA A 101 6.583 20.165 10.405 1.00 0.00 H new ATOM 0 HB2 ALA A 101 6.848 20.770 8.753 1.00 0.00 H new ATOM 0 HB3 ALA A 101 8.069 19.733 9.527 1.00 0.00 H new ATOM 1524 N GLN A 102 7.791 21.629 12.708 1.00 0.00 N ATOM 1525 CA GLN A 102 8.187 21.405 14.108 1.00 0.00 C ATOM 1526 C GLN A 102 8.277 19.905 14.475 1.00 0.00 C ATOM 1527 O GLN A 102 9.048 19.526 15.361 1.00 0.00 O ATOM 1528 CB GLN A 102 7.199 22.170 15.007 1.00 0.00 C ATOM 1529 CG GLN A 102 7.632 22.231 16.484 1.00 0.00 C ATOM 1530 CD GLN A 102 6.712 23.083 17.364 1.00 0.00 C ATOM 1531 OE1 GLN A 102 5.691 23.621 16.949 1.00 0.00 O ATOM 1532 NE2 GLN A 102 7.037 23.242 18.632 1.00 0.00 N ATOM 0 H GLN A 102 6.814 21.902 12.604 1.00 0.00 H new ATOM 0 HA GLN A 102 9.197 21.785 14.262 1.00 0.00 H new ATOM 0 HB2 GLN A 102 7.086 23.186 14.627 1.00 0.00 H new ATOM 0 HB3 GLN A 102 6.220 21.695 14.943 1.00 0.00 H new ATOM 0 HG2 GLN A 102 7.666 21.218 16.885 1.00 0.00 H new ATOM 0 HG3 GLN A 102 8.645 22.631 16.540 1.00 0.00 H new ATOM 0 HE21 GLN A 102 7.881 22.804 19.001 1.00 0.00 H new ATOM 0 HE22 GLN A 102 6.444 23.802 19.244 1.00 0.00 H new ATOM 1541 N SER A 103 7.508 19.047 13.794 1.00 0.00 N ATOM 1542 CA SER A 103 7.449 17.594 14.044 1.00 0.00 C ATOM 1543 C SER A 103 8.754 16.862 13.685 1.00 0.00 C ATOM 1544 O SER A 103 9.461 17.249 12.747 1.00 0.00 O ATOM 1545 CB SER A 103 6.287 16.965 13.261 1.00 0.00 C ATOM 1546 OG SER A 103 5.058 17.605 13.590 1.00 0.00 O ATOM 0 H SER A 103 6.894 19.346 13.036 1.00 0.00 H new ATOM 0 HA SER A 103 7.294 17.477 15.117 1.00 0.00 H new ATOM 0 HB2 SER A 103 6.473 17.051 12.191 1.00 0.00 H new ATOM 0 HB3 SER A 103 6.222 15.901 13.488 1.00 0.00 H new ATOM 0 HG SER A 103 4.328 17.193 13.081 1.00 0.00 H new ATOM 1552 N ALA A 104 9.046 15.773 14.411 1.00 0.00 N ATOM 1553 CA ALA A 104 10.210 14.895 14.222 1.00 0.00 C ATOM 1554 C ALA A 104 9.866 13.411 14.484 1.00 0.00 C ATOM 1555 O ALA A 104 10.288 12.549 13.677 1.00 0.00 O ATOM 1556 CB ALA A 104 11.353 15.389 15.124 1.00 0.00 C ATOM 1557 OXT ALA A 104 9.168 13.109 15.482 1.00 0.00 O ATOM 0 H ALA A 104 8.451 15.467 15.180 1.00 0.00 H new ATOM 0 HA ALA A 104 10.529 14.944 13.181 1.00 0.00 H new ATOM 0 HB1 ALA A 104 12.223 14.746 14.993 1.00 0.00 H new ATOM 0 HB2 ALA A 104 11.614 16.412 14.853 1.00 0.00 H new ATOM 0 HB3 ALA A 104 11.033 15.360 16.166 1.00 0.00 H new TER 1563 ALA A 104