USER MOD reduce.3.24.130724 H: found=0, std=0, add=936, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 931 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 89 HIS : no HD1:sc= 1.1 K(o=2.5,f=-4.4!) USER MOD Set 1.2: A 119 THR OG1 : rot 94:sc= 1.37 USER MOD Set 2.1: A 82 GLN : amide:sc= 1.14 K(o=3.1,f=-5.3) USER MOD Set 2.2: A 86 LYS NZ :NH3+ 150:sc= 1.93 (180deg=-0.895!) USER MOD Set 3.1: A 28 HIS : no HD1:sc= 1 K(o=2.3,f=-5.4!) USER MOD Set 3.2: A 40 SER OG : rot -122:sc= 1.3 USER MOD Set 4.1: A 22 TYR OH : rot -70:sc= 0.964 USER MOD Set 4.2: A 102 HIS : no HE2:sc= -0.12 X(o=2,f=1.7) USER MOD Set 4.3: A 105 SER OG : rot 165:sc= 1.12 USER MOD Set 5.1: A 21 LYS NZ :NH3+ -159:sc= 1.55 (180deg=1.09) USER MOD Set 5.2: A 125 TYR OH : rot 180:sc= 0.42 USER MOD Single : A 1 MET CE :methyl -177:sc= 0 (180deg=-0.00614) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot -67:sc= 1.11 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -160:sc= 2.01 (180deg=1.47) USER MOD Single : A 47 TYR OH : rot -9:sc= 1.29 USER MOD Single : A 48 LYS NZ :NH3+ -168:sc= 2.5 (180deg=2.34) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 HIS : no HD1:sc= -2 K(o=-2,f=-2.8) USER MOD Single : A 57 TYR OH : rot -15:sc= 0.704 USER MOD Single : A 59 LYS NZ :NH3+ 163:sc= 2.04 (180deg=1.35) USER MOD Single : A 61 SER OG : rot 89:sc= 1.28 USER MOD Single : A 64 MET CE :methyl -170:sc= -0.0126 (180deg=-0.297) USER MOD Single : A 65 GLN : amide:sc= 0.899 K(o=0.9,f=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= 0.726 K(o=0.73,f=-0.011) USER MOD Single : A 69 CYS SG : rot 11:sc= -0.723 USER MOD Single : A 71 CYS SG : rot 150:sc= -1.4 USER MOD Single : A 73 CYS SG : rot -175:sc= 0.696 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 HIS : no HE2:sc= 0.917 K(o=0.92,f=-3.3!) USER MOD Single : A 83 SER OG : rot 180:sc= 0.0421 USER MOD Single : A 84 GLN : amide:sc= 0.451 K(o=0.45,f=-0.085) USER MOD Single : A 87 LYS NZ :NH3+ 147:sc= 2.49 (180deg=2.1) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot -77:sc= 1.88 USER MOD Single : A 95 MET CE :methyl 179:sc= 0 (180deg=-0.00168) USER MOD Single : A 97 TYR OH : rot -116:sc= 0.251 USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 THR OG1 : rot 17:sc= -0.0522 USER MOD Single : A 108 LYS NZ :NH3+ -167:sc= 1.23 (180deg=1) USER MOD Single : A 110 LYS NZ :NH3+ 172:sc= 1.33 (180deg=1.2) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 ASN : amide:sc= -0.311 X(o=-0.31,f=-0.55) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -0.458 -9.825 2.700 1.00 10.00 N ATOM 2 CA MET A 1 -1.031 -8.658 1.993 1.00 10.00 C ATOM 3 C MET A 1 -0.057 -8.162 0.920 1.00 10.00 C ATOM 4 O MET A 1 -0.163 -8.613 -0.213 1.00 10.00 O ATOM 5 CB MET A 1 -1.520 -7.573 2.975 1.00 10.00 C ATOM 6 CG MET A 1 -2.527 -6.598 2.343 1.00 10.00 C ATOM 7 SD MET A 1 -1.878 -5.376 1.172 1.00 10.00 S ATOM 8 CE MET A 1 -1.018 -4.243 2.306 1.00 10.00 C ATOM 0 H1 MET A 1 -1.126 -10.154 3.426 1.00 10.00 H new ATOM 0 H2 MET A 1 -0.282 -10.591 2.019 1.00 10.00 H new ATOM 0 H3 MET A 1 0.437 -9.551 3.153 1.00 10.00 H new ATOM 0 HA MET A 1 -1.934 -8.963 1.464 1.00 10.00 H new ATOM 0 HB2 MET A 1 -1.981 -8.053 3.838 1.00 10.00 H new ATOM 0 HB3 MET A 1 -0.662 -7.011 3.344 1.00 10.00 H new ATOM 0 HG2 MET A 1 -3.289 -7.185 1.830 1.00 10.00 H new ATOM 0 HG3 MET A 1 -3.027 -6.061 3.149 1.00 10.00 H new ATOM 0 HE1 MET A 1 -0.609 -3.405 1.742 1.00 10.00 H new ATOM 0 HE2 MET A 1 -1.721 -3.871 3.051 1.00 10.00 H new ATOM 0 HE3 MET A 1 -0.208 -4.774 2.805 1.00 10.00 H new ATOM 20 N ALA A 2 0.933 -7.338 1.269 1.00 10.00 N ATOM 21 CA ALA A 2 1.937 -6.788 0.359 1.00 10.00 C ATOM 22 C ALA A 2 3.178 -6.403 1.173 1.00 10.00 C ATOM 23 O ALA A 2 3.257 -6.722 2.363 1.00 10.00 O ATOM 24 CB ALA A 2 1.367 -5.568 -0.378 1.00 10.00 C ATOM 0 H ALA A 2 1.061 -7.024 2.231 1.00 10.00 H new ATOM 0 HA ALA A 2 2.213 -7.532 -0.388 1.00 10.00 H new ATOM 0 HB1 ALA A 2 2.122 -5.165 -1.053 1.00 10.00 H new ATOM 0 HB2 ALA A 2 0.489 -5.867 -0.951 1.00 10.00 H new ATOM 0 HB3 ALA A 2 1.084 -4.804 0.347 1.00 10.00 H new ATOM 30 N VAL A 3 4.172 -5.800 0.518 1.00 10.00 N ATOM 31 CA VAL A 3 5.299 -5.175 1.191 1.00 10.00 C ATOM 32 C VAL A 3 4.818 -3.992 2.050 1.00 10.00 C ATOM 33 O VAL A 3 3.779 -3.392 1.779 1.00 10.00 O ATOM 34 CB VAL A 3 6.372 -4.763 0.157 1.00 10.00 C ATOM 35 CG1 VAL A 3 7.033 -6.009 -0.460 1.00 10.00 C ATOM 36 CG2 VAL A 3 5.837 -3.869 -0.978 1.00 10.00 C ATOM 0 H VAL A 3 4.213 -5.734 -0.499 1.00 10.00 H new ATOM 0 HA VAL A 3 5.764 -5.890 1.869 1.00 10.00 H new ATOM 0 HB VAL A 3 7.100 -4.174 0.714 1.00 10.00 H new ATOM 0 HG11 VAL A 3 7.786 -5.700 -1.185 1.00 10.00 H new ATOM 0 HG12 VAL A 3 7.507 -6.597 0.326 1.00 10.00 H new ATOM 0 HG13 VAL A 3 6.275 -6.614 -0.958 1.00 10.00 H new ATOM 0 HG21 VAL A 3 6.650 -3.623 -1.661 1.00 10.00 H new ATOM 0 HG22 VAL A 3 5.054 -4.399 -1.521 1.00 10.00 H new ATOM 0 HG23 VAL A 3 5.428 -2.951 -0.556 1.00 10.00 H new ATOM 46 N ALA A 4 5.612 -3.668 3.068 1.00 10.00 N ATOM 47 CA ALA A 4 5.449 -2.562 4.003 1.00 10.00 C ATOM 48 C ALA A 4 6.835 -2.278 4.601 1.00 10.00 C ATOM 49 O ALA A 4 7.787 -3.010 4.320 1.00 10.00 O ATOM 50 CB ALA A 4 4.449 -2.947 5.107 1.00 10.00 C ATOM 0 H ALA A 4 6.448 -4.214 3.274 1.00 10.00 H new ATOM 0 HA ALA A 4 5.058 -1.676 3.503 1.00 10.00 H new ATOM 0 HB1 ALA A 4 4.334 -2.114 5.801 1.00 10.00 H new ATOM 0 HB2 ALA A 4 3.484 -3.181 4.658 1.00 10.00 H new ATOM 0 HB3 ALA A 4 4.820 -3.819 5.646 1.00 10.00 H new ATOM 56 N ASP A 5 6.939 -1.259 5.452 1.00 10.00 N ATOM 57 CA ASP A 5 8.147 -0.936 6.211 1.00 10.00 C ATOM 58 C ASP A 5 7.713 -0.278 7.519 1.00 10.00 C ATOM 59 O ASP A 5 6.640 0.335 7.578 1.00 10.00 O ATOM 60 CB ASP A 5 9.051 0.012 5.409 1.00 10.00 C ATOM 61 CG ASP A 5 10.346 0.317 6.170 1.00 10.00 C ATOM 62 OD1 ASP A 5 10.325 1.293 6.957 1.00 10.00 O ATOM 63 OD2 ASP A 5 11.295 -0.485 6.047 1.00 10.00 O ATOM 0 H ASP A 5 6.167 -0.619 5.638 1.00 10.00 H new ATOM 0 HA ASP A 5 8.718 -1.842 6.413 1.00 10.00 H new ATOM 0 HB2 ASP A 5 9.290 -0.437 4.445 1.00 10.00 H new ATOM 0 HB3 ASP A 5 8.518 0.941 5.205 1.00 10.00 H new ATOM 68 N LEU A 6 8.498 -0.428 8.590 1.00 10.00 N ATOM 69 CA LEU A 6 8.169 0.115 9.905 1.00 10.00 C ATOM 70 C LEU A 6 7.998 1.636 9.895 1.00 10.00 C ATOM 71 O LEU A 6 7.324 2.154 10.792 1.00 10.00 O ATOM 72 CB LEU A 6 9.236 -0.272 10.941 1.00 10.00 C ATOM 73 CG LEU A 6 9.333 -1.772 11.272 1.00 10.00 C ATOM 74 CD1 LEU A 6 10.424 -1.966 12.326 1.00 10.00 C ATOM 75 CD2 LEU A 6 8.016 -2.353 11.807 1.00 10.00 C ATOM 0 H LEU A 6 9.384 -0.933 8.566 1.00 10.00 H new ATOM 0 HA LEU A 6 7.210 -0.324 10.181 1.00 10.00 H new ATOM 0 HB2 LEU A 6 10.207 0.065 10.578 1.00 10.00 H new ATOM 0 HB3 LEU A 6 9.034 0.272 11.864 1.00 10.00 H new ATOM 0 HG LEU A 6 9.566 -2.300 10.347 1.00 10.00 H new ATOM 0 HD11 LEU A 6 10.507 -3.024 12.573 1.00 10.00 H new ATOM 0 HD12 LEU A 6 11.376 -1.609 11.934 1.00 10.00 H new ATOM 0 HD13 LEU A 6 10.167 -1.403 13.223 1.00 10.00 H new ATOM 0 HD21 LEU A 6 8.147 -3.413 12.022 1.00 10.00 H new ATOM 0 HD22 LEU A 6 7.732 -1.830 12.720 1.00 10.00 H new ATOM 0 HD23 LEU A 6 7.233 -2.229 11.059 1.00 10.00 H new ATOM 87 N ALA A 7 8.586 2.357 8.937 1.00 10.00 N ATOM 88 CA ALA A 7 8.395 3.797 8.791 1.00 10.00 C ATOM 89 C ALA A 7 6.932 4.170 8.522 1.00 10.00 C ATOM 90 O ALA A 7 6.525 5.282 8.852 1.00 10.00 O ATOM 91 CB ALA A 7 9.277 4.322 7.656 1.00 10.00 C ATOM 0 H ALA A 7 9.211 1.954 8.239 1.00 10.00 H new ATOM 0 HA ALA A 7 8.680 4.260 9.736 1.00 10.00 H new ATOM 0 HB1 ALA A 7 9.132 5.397 7.550 1.00 10.00 H new ATOM 0 HB2 ALA A 7 10.323 4.118 7.884 1.00 10.00 H new ATOM 0 HB3 ALA A 7 9.005 3.826 6.725 1.00 10.00 H new ATOM 97 N LEU A 8 6.144 3.261 7.932 1.00 10.00 N ATOM 98 CA LEU A 8 4.742 3.514 7.600 1.00 10.00 C ATOM 99 C LEU A 8 3.868 3.500 8.859 1.00 10.00 C ATOM 100 O LEU A 8 2.797 4.100 8.879 1.00 10.00 O ATOM 101 CB LEU A 8 4.228 2.454 6.605 1.00 10.00 C ATOM 102 CG LEU A 8 5.009 2.354 5.277 1.00 10.00 C ATOM 103 CD1 LEU A 8 4.395 1.247 4.408 1.00 10.00 C ATOM 104 CD2 LEU A 8 5.013 3.675 4.493 1.00 10.00 C ATOM 0 H LEU A 8 6.465 2.328 7.672 1.00 10.00 H new ATOM 0 HA LEU A 8 4.680 4.501 7.142 1.00 10.00 H new ATOM 0 HB2 LEU A 8 4.252 1.480 7.094 1.00 10.00 H new ATOM 0 HB3 LEU A 8 3.184 2.671 6.377 1.00 10.00 H new ATOM 0 HG LEU A 8 6.044 2.120 5.525 1.00 10.00 H new ATOM 0 HD11 LEU A 8 4.945 1.174 3.470 1.00 10.00 H new ATOM 0 HD12 LEU A 8 4.452 0.296 4.937 1.00 10.00 H new ATOM 0 HD13 LEU A 8 3.352 1.484 4.200 1.00 10.00 H new ATOM 0 HD21 LEU A 8 5.576 3.548 3.568 1.00 10.00 H new ATOM 0 HD22 LEU A 8 3.988 3.961 4.257 1.00 10.00 H new ATOM 0 HD23 LEU A 8 5.478 4.455 5.096 1.00 10.00 H new ATOM 116 N ILE A 9 4.297 2.779 9.898 1.00 10.00 N ATOM 117 CA ILE A 9 3.532 2.579 11.119 1.00 10.00 C ATOM 118 C ILE A 9 3.843 3.771 12.036 1.00 10.00 C ATOM 119 O ILE A 9 5.026 4.008 12.315 1.00 10.00 O ATOM 120 CB ILE A 9 3.927 1.210 11.722 1.00 10.00 C ATOM 121 CG1 ILE A 9 3.431 0.074 10.795 1.00 10.00 C ATOM 122 CG2 ILE A 9 3.371 1.020 13.149 1.00 10.00 C ATOM 123 CD1 ILE A 9 4.199 -1.236 10.977 1.00 10.00 C ATOM 0 H ILE A 9 5.204 2.312 9.909 1.00 10.00 H new ATOM 0 HA ILE A 9 2.455 2.547 10.957 1.00 10.00 H new ATOM 0 HB ILE A 9 5.014 1.178 11.796 1.00 10.00 H new ATOM 0 HG12 ILE A 9 2.373 -0.104 10.985 1.00 10.00 H new ATOM 0 HG13 ILE A 9 3.519 0.397 9.758 1.00 10.00 H new ATOM 0 HG21 ILE A 9 3.674 0.045 13.531 1.00 10.00 H new ATOM 0 HG22 ILE A 9 3.763 1.802 13.799 1.00 10.00 H new ATOM 0 HG23 ILE A 9 2.283 1.079 13.126 1.00 10.00 H new ATOM 0 HD11 ILE A 9 3.800 -1.989 10.297 1.00 10.00 H new ATOM 0 HD12 ILE A 9 5.254 -1.072 10.759 1.00 10.00 H new ATOM 0 HD13 ILE A 9 4.091 -1.582 12.005 1.00 10.00 H new ATOM 135 N PRO A 10 2.837 4.498 12.560 1.00 10.00 N ATOM 136 CA PRO A 10 3.076 5.638 13.433 1.00 10.00 C ATOM 137 C PRO A 10 3.672 5.167 14.761 1.00 10.00 C ATOM 138 O PRO A 10 3.384 4.060 15.227 1.00 10.00 O ATOM 139 CB PRO A 10 1.715 6.319 13.609 1.00 10.00 C ATOM 140 CG PRO A 10 0.709 5.191 13.387 1.00 10.00 C ATOM 141 CD PRO A 10 1.406 4.297 12.361 1.00 10.00 C ATOM 0 HA PRO A 10 3.797 6.341 13.016 1.00 10.00 H new ATOM 0 HB2 PRO A 10 1.612 6.756 14.602 1.00 10.00 H new ATOM 0 HB3 PRO A 10 1.576 7.126 12.890 1.00 10.00 H new ATOM 0 HG2 PRO A 10 0.497 4.653 14.311 1.00 10.00 H new ATOM 0 HG3 PRO A 10 -0.242 5.568 13.012 1.00 10.00 H new ATOM 0 HD2 PRO A 10 1.135 3.251 12.506 1.00 10.00 H new ATOM 0 HD3 PRO A 10 1.112 4.565 11.346 1.00 10.00 H new ATOM 149 N ASP A 11 4.503 6.008 15.378 1.00 10.00 N ATOM 150 CA ASP A 11 5.202 5.713 16.640 1.00 10.00 C ATOM 151 C ASP A 11 4.263 5.806 17.852 1.00 10.00 C ATOM 152 O ASP A 11 4.299 4.980 18.760 1.00 10.00 O ATOM 153 CB ASP A 11 6.359 6.705 16.805 1.00 10.00 C ATOM 154 CG ASP A 11 7.190 6.417 18.062 1.00 10.00 C ATOM 155 OD1 ASP A 11 7.708 5.278 18.156 1.00 10.00 O ATOM 156 OD2 ASP A 11 7.385 7.353 18.865 1.00 10.00 O ATOM 0 H ASP A 11 4.717 6.935 15.010 1.00 10.00 H new ATOM 0 HA ASP A 11 5.575 4.690 16.595 1.00 10.00 H new ATOM 0 HB2 ASP A 11 7.003 6.660 15.927 1.00 10.00 H new ATOM 0 HB3 ASP A 11 5.962 7.719 16.857 1.00 10.00 H new ATOM 161 N VAL A 12 3.300 6.723 17.779 1.00 10.00 N ATOM 162 CA VAL A 12 2.253 6.946 18.765 1.00 10.00 C ATOM 163 C VAL A 12 0.985 7.143 17.949 1.00 10.00 C ATOM 164 O VAL A 12 1.015 7.857 16.944 1.00 10.00 O ATOM 165 CB VAL A 12 2.567 8.191 19.620 1.00 10.00 C ATOM 166 CG1 VAL A 12 1.514 8.428 20.718 1.00 10.00 C ATOM 167 CG2 VAL A 12 3.942 8.081 20.283 1.00 10.00 C ATOM 0 H VAL A 12 3.228 7.362 16.987 1.00 10.00 H new ATOM 0 HA VAL A 12 2.159 6.115 19.465 1.00 10.00 H new ATOM 0 HB VAL A 12 2.554 9.035 18.931 1.00 10.00 H new ATOM 0 HG11 VAL A 12 1.780 9.316 21.292 1.00 10.00 H new ATOM 0 HG12 VAL A 12 0.536 8.573 20.259 1.00 10.00 H new ATOM 0 HG13 VAL A 12 1.479 7.564 21.381 1.00 10.00 H new ATOM 0 HG21 VAL A 12 4.132 8.975 20.878 1.00 10.00 H new ATOM 0 HG22 VAL A 12 3.965 7.203 20.929 1.00 10.00 H new ATOM 0 HG23 VAL A 12 4.710 7.987 19.515 1.00 10.00 H new ATOM 177 N ASP A 13 -0.102 6.503 18.364 1.00 10.00 N ATOM 178 CA ASP A 13 -1.424 6.736 17.790 1.00 10.00 C ATOM 179 C ASP A 13 -2.418 6.462 18.901 1.00 10.00 C ATOM 180 O ASP A 13 -2.402 5.371 19.484 1.00 10.00 O ATOM 181 CB ASP A 13 -1.684 5.838 16.578 1.00 10.00 C ATOM 182 CG ASP A 13 -3.086 6.066 16.005 1.00 10.00 C ATOM 183 OD1 ASP A 13 -3.470 7.243 15.846 1.00 10.00 O ATOM 184 OD2 ASP A 13 -3.762 5.039 15.759 1.00 10.00 O ATOM 0 H ASP A 13 -0.093 5.807 19.109 1.00 10.00 H new ATOM 0 HA ASP A 13 -1.512 7.758 17.421 1.00 10.00 H new ATOM 0 HB2 ASP A 13 -0.938 6.037 15.809 1.00 10.00 H new ATOM 0 HB3 ASP A 13 -1.573 4.793 16.867 1.00 10.00 H new ATOM 189 N ILE A 14 -3.179 7.484 19.282 1.00 10.00 N ATOM 190 CA ILE A 14 -4.031 7.478 20.460 1.00 10.00 C ATOM 191 C ILE A 14 -5.341 8.216 20.171 1.00 10.00 C ATOM 192 O ILE A 14 -5.378 9.082 19.301 1.00 10.00 O ATOM 193 CB ILE A 14 -3.279 8.067 21.688 1.00 10.00 C ATOM 194 CG1 ILE A 14 -2.680 9.474 21.423 1.00 10.00 C ATOM 195 CG2 ILE A 14 -2.193 7.090 22.185 1.00 10.00 C ATOM 196 CD1 ILE A 14 -1.940 10.103 22.616 1.00 10.00 C ATOM 0 H ILE A 14 -3.219 8.362 18.764 1.00 10.00 H new ATOM 0 HA ILE A 14 -4.286 6.448 20.710 1.00 10.00 H new ATOM 0 HB ILE A 14 -4.025 8.196 22.472 1.00 10.00 H new ATOM 0 HG12 ILE A 14 -1.990 9.406 20.582 1.00 10.00 H new ATOM 0 HG13 ILE A 14 -3.485 10.144 21.121 1.00 10.00 H new ATOM 0 HG21 ILE A 14 -1.680 7.523 23.044 1.00 10.00 H new ATOM 0 HG22 ILE A 14 -2.657 6.148 22.476 1.00 10.00 H new ATOM 0 HG23 ILE A 14 -1.474 6.909 21.386 1.00 10.00 H new ATOM 0 HD11 ILE A 14 -1.558 11.084 22.331 1.00 10.00 H new ATOM 0 HD12 ILE A 14 -2.628 10.211 23.455 1.00 10.00 H new ATOM 0 HD13 ILE A 14 -1.109 9.461 22.908 1.00 10.00 H new ATOM 208 N ASP A 15 -6.391 7.933 20.945 1.00 10.00 N ATOM 209 CA ASP A 15 -7.683 8.627 20.890 1.00 10.00 C ATOM 210 C ASP A 15 -8.248 8.724 22.304 1.00 10.00 C ATOM 211 O ASP A 15 -8.318 7.720 23.021 1.00 10.00 O ATOM 212 CB ASP A 15 -8.689 7.885 19.996 1.00 10.00 C ATOM 213 CG ASP A 15 -10.050 8.594 20.001 1.00 10.00 C ATOM 214 OD1 ASP A 15 -10.124 9.757 19.559 1.00 10.00 O ATOM 215 OD2 ASP A 15 -11.037 8.016 20.525 1.00 10.00 O ATOM 0 H ASP A 15 -6.367 7.194 21.648 1.00 10.00 H new ATOM 0 HA ASP A 15 -7.522 9.618 20.465 1.00 10.00 H new ATOM 0 HB2 ASP A 15 -8.306 7.831 18.977 1.00 10.00 H new ATOM 0 HB3 ASP A 15 -8.807 6.860 20.347 1.00 10.00 H new ATOM 220 N SER A 16 -8.650 9.929 22.710 1.00 10.00 N ATOM 221 CA SER A 16 -8.946 10.284 24.091 1.00 10.00 C ATOM 222 C SER A 16 -10.291 11.012 24.230 1.00 10.00 C ATOM 223 O SER A 16 -10.998 11.237 23.243 1.00 10.00 O ATOM 224 CB SER A 16 -7.772 11.136 24.593 1.00 10.00 C ATOM 225 OG SER A 16 -7.550 12.266 23.763 1.00 10.00 O ATOM 0 H SER A 16 -8.781 10.707 22.063 1.00 10.00 H new ATOM 0 HA SER A 16 -9.052 9.385 24.698 1.00 10.00 H new ATOM 0 HB2 SER A 16 -7.972 11.467 25.612 1.00 10.00 H new ATOM 0 HB3 SER A 16 -6.869 10.527 24.627 1.00 10.00 H new ATOM 0 HG SER A 16 -6.797 12.786 24.113 1.00 10.00 H new ATOM 231 N ASP A 17 -10.658 11.325 25.476 1.00 10.00 N ATOM 232 CA ASP A 17 -11.778 12.208 25.864 1.00 10.00 C ATOM 233 C ASP A 17 -11.603 12.613 27.334 1.00 10.00 C ATOM 234 O ASP A 17 -11.790 13.765 27.709 1.00 10.00 O ATOM 235 CB ASP A 17 -13.133 11.506 25.718 1.00 10.00 C ATOM 236 CG ASP A 17 -14.273 12.371 26.274 1.00 10.00 C ATOM 237 OD1 ASP A 17 -14.651 13.335 25.572 1.00 10.00 O ATOM 238 OD2 ASP A 17 -14.787 11.994 27.349 1.00 10.00 O ATOM 0 H ASP A 17 -10.162 10.955 26.287 1.00 10.00 H new ATOM 0 HA ASP A 17 -11.765 13.077 25.206 1.00 10.00 H new ATOM 0 HB2 ASP A 17 -13.320 11.287 24.667 1.00 10.00 H new ATOM 0 HB3 ASP A 17 -13.109 10.551 26.243 1.00 10.00 H new ATOM 243 N GLY A 18 -11.082 11.677 28.135 1.00 10.00 N ATOM 244 CA GLY A 18 -10.639 11.859 29.506 1.00 10.00 C ATOM 245 C GLY A 18 -9.557 10.812 29.748 1.00 10.00 C ATOM 246 O GLY A 18 -8.620 10.719 28.951 1.00 10.00 O ATOM 0 H GLY A 18 -10.954 10.717 27.816 1.00 10.00 H new ATOM 0 HA2 GLY A 18 -10.248 12.865 29.658 1.00 10.00 H new ATOM 0 HA3 GLY A 18 -11.467 11.731 30.203 1.00 10.00 H new ATOM 250 N VAL A 19 -9.657 10.033 30.827 1.00 10.00 N ATOM 251 CA VAL A 19 -8.818 8.850 31.011 1.00 10.00 C ATOM 252 C VAL A 19 -9.143 7.829 29.905 1.00 10.00 C ATOM 253 O VAL A 19 -10.307 7.680 29.533 1.00 10.00 O ATOM 254 CB VAL A 19 -9.045 8.256 32.420 1.00 10.00 C ATOM 255 CG1 VAL A 19 -8.049 7.123 32.711 1.00 10.00 C ATOM 256 CG2 VAL A 19 -8.924 9.318 33.530 1.00 10.00 C ATOM 0 H VAL A 19 -10.314 10.202 31.589 1.00 10.00 H new ATOM 0 HA VAL A 19 -7.765 9.119 30.935 1.00 10.00 H new ATOM 0 HB VAL A 19 -10.062 7.865 32.422 1.00 10.00 H new ATOM 0 HG11 VAL A 19 -8.233 6.725 33.709 1.00 10.00 H new ATOM 0 HG12 VAL A 19 -8.175 6.329 31.974 1.00 10.00 H new ATOM 0 HG13 VAL A 19 -7.032 7.510 32.656 1.00 10.00 H new ATOM 0 HG21 VAL A 19 -9.092 8.851 34.500 1.00 10.00 H new ATOM 0 HG22 VAL A 19 -7.927 9.757 33.506 1.00 10.00 H new ATOM 0 HG23 VAL A 19 -9.668 10.098 33.370 1.00 10.00 H new ATOM 266 N PHE A 20 -8.145 7.085 29.419 1.00 10.00 N ATOM 267 CA PHE A 20 -8.310 5.973 28.487 1.00 10.00 C ATOM 268 C PHE A 20 -7.188 4.959 28.714 1.00 10.00 C ATOM 269 O PHE A 20 -6.096 5.326 29.148 1.00 10.00 O ATOM 270 CB PHE A 20 -8.332 6.469 27.030 1.00 10.00 C ATOM 271 CG PHE A 20 -7.087 7.182 26.521 1.00 10.00 C ATOM 272 CD1 PHE A 20 -6.820 8.512 26.899 1.00 10.00 C ATOM 273 CD2 PHE A 20 -6.220 6.537 25.620 1.00 10.00 C ATOM 274 CE1 PHE A 20 -5.703 9.191 26.384 1.00 10.00 C ATOM 275 CE2 PHE A 20 -5.110 7.218 25.090 1.00 10.00 C ATOM 276 CZ PHE A 20 -4.860 8.551 25.459 1.00 10.00 C ATOM 0 H PHE A 20 -7.171 7.248 29.673 1.00 10.00 H new ATOM 0 HA PHE A 20 -9.269 5.488 28.671 1.00 10.00 H new ATOM 0 HB2 PHE A 20 -8.519 5.611 26.384 1.00 10.00 H new ATOM 0 HB3 PHE A 20 -9.179 7.145 26.916 1.00 10.00 H new ATOM 0 HD1 PHE A 20 -7.480 9.015 27.591 1.00 10.00 H new ATOM 0 HD2 PHE A 20 -6.408 5.513 25.334 1.00 10.00 H new ATOM 0 HE1 PHE A 20 -5.492 10.203 26.698 1.00 10.00 H new ATOM 0 HE2 PHE A 20 -4.449 6.716 24.399 1.00 10.00 H new ATOM 0 HZ PHE A 20 -4.022 9.082 25.033 1.00 10.00 H new ATOM 286 N LYS A 21 -7.465 3.665 28.504 1.00 10.00 N ATOM 287 CA LYS A 21 -6.433 2.629 28.578 1.00 10.00 C ATOM 288 C LYS A 21 -5.444 2.801 27.418 1.00 10.00 C ATOM 289 O LYS A 21 -5.825 3.245 26.334 1.00 10.00 O ATOM 290 CB LYS A 21 -7.066 1.224 28.555 1.00 10.00 C ATOM 291 CG LYS A 21 -7.815 0.906 29.862 1.00 10.00 C ATOM 292 CD LYS A 21 -8.279 -0.559 29.890 1.00 10.00 C ATOM 293 CE LYS A 21 -8.838 -0.978 31.260 1.00 10.00 C ATOM 294 NZ LYS A 21 -10.199 -0.464 31.531 1.00 10.00 N ATOM 0 H LYS A 21 -8.396 3.313 28.282 1.00 10.00 H new ATOM 0 HA LYS A 21 -5.894 2.734 29.519 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -7.757 1.152 27.715 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -6.288 0.478 28.393 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -7.165 1.101 30.715 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -8.677 1.566 29.961 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -9.045 -0.708 29.129 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -7.441 -1.206 29.631 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -8.852 -2.066 31.319 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -8.164 -0.625 32.041 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -10.373 -0.467 32.556 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -10.282 0.507 31.168 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -10.900 -1.071 31.059 1.00 10.00 H new ATOM 308 N TYR A 22 -4.211 2.334 27.614 1.00 10.00 N ATOM 309 CA TYR A 22 -3.204 2.230 26.567 1.00 10.00 C ATOM 310 C TYR A 22 -2.377 0.962 26.783 1.00 10.00 C ATOM 311 O TYR A 22 -2.416 0.344 27.852 1.00 10.00 O ATOM 312 CB TYR A 22 -2.339 3.505 26.502 1.00 10.00 C ATOM 313 CG TYR A 22 -0.956 3.409 27.123 1.00 10.00 C ATOM 314 CD1 TYR A 22 -0.794 3.576 28.505 1.00 10.00 C ATOM 315 CD2 TYR A 22 0.168 3.145 26.315 1.00 10.00 C ATOM 316 CE1 TYR A 22 0.482 3.497 29.084 1.00 10.00 C ATOM 317 CE2 TYR A 22 1.451 3.065 26.884 1.00 10.00 C ATOM 318 CZ TYR A 22 1.615 3.268 28.271 1.00 10.00 C ATOM 319 OH TYR A 22 2.862 3.273 28.812 1.00 10.00 O ATOM 0 H TYR A 22 -3.881 2.012 28.524 1.00 10.00 H new ATOM 0 HA TYR A 22 -3.691 2.148 25.595 1.00 10.00 H new ATOM 0 HB2 TYR A 22 -2.226 3.789 25.456 1.00 10.00 H new ATOM 0 HB3 TYR A 22 -2.881 4.312 26.995 1.00 10.00 H new ATOM 0 HD1 TYR A 22 -1.656 3.766 29.128 1.00 10.00 H new ATOM 0 HD2 TYR A 22 0.043 3.003 25.252 1.00 10.00 H new ATOM 0 HE1 TYR A 22 0.598 3.611 30.152 1.00 10.00 H new ATOM 0 HE2 TYR A 22 2.307 2.849 26.262 1.00 10.00 H new ATOM 0 HH TYR A 22 3.102 4.187 29.073 1.00 10.00 H new ATOM 329 N VAL A 23 -1.625 0.577 25.756 1.00 10.00 N ATOM 330 CA VAL A 23 -0.753 -0.583 25.740 1.00 10.00 C ATOM 331 C VAL A 23 0.539 -0.185 25.011 1.00 10.00 C ATOM 332 O VAL A 23 0.526 0.656 24.106 1.00 10.00 O ATOM 333 CB VAL A 23 -1.535 -1.771 25.131 1.00 10.00 C ATOM 334 CG1 VAL A 23 -1.954 -1.507 23.680 1.00 10.00 C ATOM 335 CG2 VAL A 23 -0.794 -3.109 25.235 1.00 10.00 C ATOM 0 H VAL A 23 -1.609 1.091 24.875 1.00 10.00 H new ATOM 0 HA VAL A 23 -0.447 -0.919 26.731 1.00 10.00 H new ATOM 0 HB VAL A 23 -2.435 -1.856 25.741 1.00 10.00 H new ATOM 0 HG11 VAL A 23 -2.500 -2.369 23.296 1.00 10.00 H new ATOM 0 HG12 VAL A 23 -2.594 -0.626 23.641 1.00 10.00 H new ATOM 0 HG13 VAL A 23 -1.067 -1.338 23.070 1.00 10.00 H new ATOM 0 HG21 VAL A 23 -1.401 -3.897 24.788 1.00 10.00 H new ATOM 0 HG22 VAL A 23 0.157 -3.040 24.707 1.00 10.00 H new ATOM 0 HG23 VAL A 23 -0.611 -3.343 26.284 1.00 10.00 H new ATOM 345 N LEU A 24 1.659 -0.776 25.424 1.00 10.00 N ATOM 346 CA LEU A 24 2.973 -0.587 24.837 1.00 10.00 C ATOM 347 C LEU A 24 3.276 -1.904 24.129 1.00 10.00 C ATOM 348 O LEU A 24 3.221 -2.962 24.766 1.00 10.00 O ATOM 349 CB LEU A 24 3.973 -0.265 25.964 1.00 10.00 C ATOM 350 CG LEU A 24 5.245 0.460 25.486 1.00 10.00 C ATOM 351 CD1 LEU A 24 6.178 0.675 26.683 1.00 10.00 C ATOM 352 CD2 LEU A 24 6.009 -0.266 24.381 1.00 10.00 C ATOM 0 H LEU A 24 1.670 -1.426 26.210 1.00 10.00 H new ATOM 0 HA LEU A 24 3.034 0.240 24.129 1.00 10.00 H new ATOM 0 HB2 LEU A 24 3.475 0.352 26.712 1.00 10.00 H new ATOM 0 HB3 LEU A 24 4.260 -1.194 26.457 1.00 10.00 H new ATOM 0 HG LEU A 24 4.913 1.405 25.055 1.00 10.00 H new ATOM 0 HD11 LEU A 24 7.081 1.188 26.353 1.00 10.00 H new ATOM 0 HD12 LEU A 24 5.672 1.280 27.435 1.00 10.00 H new ATOM 0 HD13 LEU A 24 6.446 -0.290 27.114 1.00 10.00 H new ATOM 0 HD21 LEU A 24 6.889 0.315 24.106 1.00 10.00 H new ATOM 0 HD22 LEU A 24 6.319 -1.248 24.738 1.00 10.00 H new ATOM 0 HD23 LEU A 24 5.365 -0.383 23.510 1.00 10.00 H new ATOM 364 N ILE A 25 3.508 -1.866 22.821 1.00 10.00 N ATOM 365 CA ILE A 25 3.603 -3.064 21.996 1.00 10.00 C ATOM 366 C ILE A 25 4.904 -2.958 21.205 1.00 10.00 C ATOM 367 O ILE A 25 5.258 -1.869 20.749 1.00 10.00 O ATOM 368 CB ILE A 25 2.348 -3.174 21.091 1.00 10.00 C ATOM 369 CG1 ILE A 25 1.036 -3.226 21.912 1.00 10.00 C ATOM 370 CG2 ILE A 25 2.425 -4.423 20.198 1.00 10.00 C ATOM 371 CD1 ILE A 25 -0.247 -3.222 21.065 1.00 10.00 C ATOM 0 H ILE A 25 3.636 -0.998 22.301 1.00 10.00 H new ATOM 0 HA ILE A 25 3.627 -3.976 22.592 1.00 10.00 H new ATOM 0 HB ILE A 25 2.334 -2.276 20.474 1.00 10.00 H new ATOM 0 HG12 ILE A 25 1.045 -4.123 22.531 1.00 10.00 H new ATOM 0 HG13 ILE A 25 1.012 -2.372 22.589 1.00 10.00 H new ATOM 0 HG21 ILE A 25 1.534 -4.479 19.573 1.00 10.00 H new ATOM 0 HG22 ILE A 25 3.310 -4.363 19.564 1.00 10.00 H new ATOM 0 HG23 ILE A 25 2.486 -5.314 20.823 1.00 10.00 H new ATOM 0 HD11 ILE A 25 -1.116 -3.260 21.721 1.00 10.00 H new ATOM 0 HD12 ILE A 25 -0.284 -2.312 20.466 1.00 10.00 H new ATOM 0 HD13 ILE A 25 -0.251 -4.091 20.407 1.00 10.00 H new ATOM 383 N ARG A 26 5.615 -4.073 21.047 1.00 10.00 N ATOM 384 CA ARG A 26 6.711 -4.178 20.102 1.00 10.00 C ATOM 385 C ARG A 26 6.123 -4.763 18.834 1.00 10.00 C ATOM 386 O ARG A 26 5.403 -5.757 18.896 1.00 10.00 O ATOM 387 CB ARG A 26 7.827 -5.054 20.680 1.00 10.00 C ATOM 388 CG ARG A 26 8.971 -5.257 19.671 1.00 10.00 C ATOM 389 CD ARG A 26 10.123 -6.057 20.278 1.00 10.00 C ATOM 390 NE ARG A 26 10.757 -5.312 21.373 1.00 10.00 N ATOM 391 CZ ARG A 26 11.047 -5.743 22.602 1.00 10.00 C ATOM 392 NH1 ARG A 26 10.772 -6.982 23.017 1.00 10.00 N ATOM 393 NH2 ARG A 26 11.657 -4.878 23.406 1.00 10.00 N ATOM 0 H ARG A 26 5.442 -4.928 21.575 1.00 10.00 H new ATOM 0 HA ARG A 26 7.165 -3.209 19.892 1.00 10.00 H new ATOM 0 HB2 ARG A 26 8.219 -4.593 21.587 1.00 10.00 H new ATOM 0 HB3 ARG A 26 7.418 -6.023 20.966 1.00 10.00 H new ATOM 0 HG2 ARG A 26 8.592 -5.775 18.790 1.00 10.00 H new ATOM 0 HG3 ARG A 26 9.338 -4.287 19.336 1.00 10.00 H new ATOM 0 HD2 ARG A 26 9.752 -7.012 20.649 1.00 10.00 H new ATOM 0 HD3 ARG A 26 10.862 -6.280 19.508 1.00 10.00 H new ATOM 0 HE ARG A 26 11.007 -4.344 21.169 1.00 10.00 H new ATOM 0 HH11 ARG A 26 10.322 -7.643 22.385 1.00 10.00 H new ATOM 0 HH12 ARG A 26 11.012 -7.267 23.966 1.00 10.00 H new ATOM 0 HH21 ARG A 26 11.879 -3.940 23.072 1.00 10.00 H new ATOM 0 HH22 ARG A 26 11.903 -5.152 24.357 1.00 10.00 H new ATOM 407 N VAL A 27 6.415 -4.146 17.699 1.00 10.00 N ATOM 408 CA VAL A 27 5.976 -4.590 16.392 1.00 10.00 C ATOM 409 C VAL A 27 7.219 -5.081 15.650 1.00 10.00 C ATOM 410 O VAL A 27 8.303 -4.509 15.804 1.00 10.00 O ATOM 411 CB VAL A 27 5.197 -3.449 15.702 1.00 10.00 C ATOM 412 CG1 VAL A 27 5.983 -2.130 15.570 1.00 10.00 C ATOM 413 CG2 VAL A 27 4.691 -3.873 14.320 1.00 10.00 C ATOM 0 H VAL A 27 6.981 -3.298 17.665 1.00 10.00 H new ATOM 0 HA VAL A 27 5.273 -5.422 16.426 1.00 10.00 H new ATOM 0 HB VAL A 27 4.356 -3.253 16.367 1.00 10.00 H new ATOM 0 HG11 VAL A 27 5.361 -1.384 15.075 1.00 10.00 H new ATOM 0 HG12 VAL A 27 6.260 -1.771 16.561 1.00 10.00 H new ATOM 0 HG13 VAL A 27 6.884 -2.301 14.981 1.00 10.00 H new ATOM 0 HG21 VAL A 27 4.147 -3.047 13.862 1.00 10.00 H new ATOM 0 HG22 VAL A 27 5.538 -4.143 13.690 1.00 10.00 H new ATOM 0 HG23 VAL A 27 4.027 -4.731 14.423 1.00 10.00 H new ATOM 423 N HIS A 28 7.062 -6.135 14.862 1.00 10.00 N ATOM 424 CA HIS A 28 8.104 -6.825 14.127 1.00 10.00 C ATOM 425 C HIS A 28 7.672 -6.797 12.668 1.00 10.00 C ATOM 426 O HIS A 28 6.521 -7.118 12.368 1.00 10.00 O ATOM 427 CB HIS A 28 8.204 -8.285 14.595 1.00 10.00 C ATOM 428 CG HIS A 28 8.344 -8.481 16.082 1.00 10.00 C ATOM 429 ND1 HIS A 28 9.486 -8.292 16.824 1.00 10.00 N ATOM 430 CD2 HIS A 28 7.382 -8.958 16.933 1.00 10.00 C ATOM 431 CE1 HIS A 28 9.226 -8.668 18.086 1.00 10.00 C ATOM 432 NE2 HIS A 28 7.950 -9.053 18.206 1.00 10.00 N ATOM 0 H HIS A 28 6.145 -6.555 14.712 1.00 10.00 H new ATOM 0 HA HIS A 28 9.075 -6.353 14.279 1.00 10.00 H new ATOM 0 HB2 HIS A 28 7.315 -8.818 14.258 1.00 10.00 H new ATOM 0 HB3 HIS A 28 9.059 -8.748 14.103 1.00 10.00 H new ATOM 0 HD2 HIS A 28 6.367 -9.214 16.668 1.00 10.00 H new ATOM 0 HE1 HIS A 28 9.945 -8.661 18.891 1.00 10.00 H new ATOM 0 HE2 HIS A 28 7.483 -9.357 19.060 1.00 10.00 H new ATOM 440 N SER A 29 8.562 -6.385 11.768 1.00 10.00 N ATOM 441 CA SER A 29 8.279 -6.409 10.343 1.00 10.00 C ATOM 442 C SER A 29 8.287 -7.851 9.822 1.00 10.00 C ATOM 443 O SER A 29 9.100 -8.664 10.258 1.00 10.00 O ATOM 444 CB SER A 29 9.246 -5.487 9.590 1.00 10.00 C ATOM 445 OG SER A 29 10.606 -5.750 9.864 1.00 10.00 O ATOM 0 H SER A 29 9.488 -6.030 12.006 1.00 10.00 H new ATOM 0 HA SER A 29 7.277 -6.020 10.162 1.00 10.00 H new ATOM 0 HB2 SER A 29 9.073 -5.590 8.519 1.00 10.00 H new ATOM 0 HB3 SER A 29 9.025 -4.452 9.850 1.00 10.00 H new ATOM 0 HG SER A 29 10.803 -5.517 10.795 1.00 10.00 H new ATOM 451 N ALA A 30 7.387 -8.148 8.885 1.00 10.00 N ATOM 452 CA ALA A 30 7.376 -9.366 8.083 1.00 10.00 C ATOM 453 C ALA A 30 6.729 -9.041 6.723 1.00 10.00 C ATOM 454 O ALA A 30 5.663 -9.569 6.379 1.00 10.00 O ATOM 455 CB ALA A 30 6.643 -10.474 8.837 1.00 10.00 C ATOM 0 H ALA A 30 6.616 -7.520 8.657 1.00 10.00 H new ATOM 0 HA ALA A 30 8.387 -9.730 7.901 1.00 10.00 H new ATOM 0 HB1 ALA A 30 6.637 -11.382 8.234 1.00 10.00 H new ATOM 0 HB2 ALA A 30 7.151 -10.669 9.782 1.00 10.00 H new ATOM 0 HB3 ALA A 30 5.617 -10.163 9.034 1.00 10.00 H new ATOM 461 N PRO A 31 7.315 -8.092 5.966 1.00 10.00 N ATOM 462 CA PRO A 31 6.711 -7.560 4.752 1.00 10.00 C ATOM 463 C PRO A 31 6.465 -8.691 3.754 1.00 10.00 C ATOM 464 O PRO A 31 7.285 -9.604 3.622 1.00 10.00 O ATOM 465 CB PRO A 31 7.696 -6.519 4.205 1.00 10.00 C ATOM 466 CG PRO A 31 8.737 -6.323 5.307 1.00 10.00 C ATOM 467 CD PRO A 31 8.682 -7.622 6.101 1.00 10.00 C ATOM 0 HA PRO A 31 5.742 -7.099 4.943 1.00 10.00 H new ATOM 0 HB2 PRO A 31 8.162 -6.866 3.283 1.00 10.00 H new ATOM 0 HB3 PRO A 31 7.189 -5.582 3.973 1.00 10.00 H new ATOM 0 HG2 PRO A 31 9.730 -6.151 4.892 1.00 10.00 H new ATOM 0 HG3 PRO A 31 8.499 -5.463 5.932 1.00 10.00 H new ATOM 0 HD2 PRO A 31 9.390 -8.353 5.710 1.00 10.00 H new ATOM 0 HD3 PRO A 31 8.940 -7.456 7.147 1.00 10.00 H new ATOM 475 N ARG A 32 5.335 -8.651 3.031 1.00 10.00 N ATOM 476 CA ARG A 32 4.922 -9.690 2.073 1.00 10.00 C ATOM 477 C ARG A 32 4.930 -11.110 2.680 1.00 10.00 C ATOM 478 O ARG A 32 4.807 -12.077 1.927 1.00 10.00 O ATOM 479 CB ARG A 32 5.759 -9.504 0.778 1.00 10.00 C ATOM 480 CG ARG A 32 5.513 -10.449 -0.412 1.00 10.00 C ATOM 481 CD ARG A 32 4.032 -10.620 -0.782 1.00 10.00 C ATOM 482 NE ARG A 32 3.844 -11.645 -1.824 1.00 10.00 N ATOM 483 CZ ARG A 32 3.841 -12.974 -1.630 1.00 10.00 C ATOM 484 NH1 ARG A 32 4.060 -13.496 -0.422 1.00 10.00 N ATOM 485 NH2 ARG A 32 3.593 -13.783 -2.657 1.00 10.00 N ATOM 0 H ARG A 32 4.669 -7.881 3.097 1.00 10.00 H new ATOM 0 HA ARG A 32 3.872 -9.570 1.806 1.00 10.00 H new ATOM 0 HB2 ARG A 32 5.600 -8.484 0.427 1.00 10.00 H new ATOM 0 HB3 ARG A 32 6.811 -9.586 1.051 1.00 10.00 H new ATOM 0 HG2 ARG A 32 6.052 -10.070 -1.280 1.00 10.00 H new ATOM 0 HG3 ARG A 32 5.933 -11.427 -0.178 1.00 10.00 H new ATOM 0 HD2 ARG A 32 3.465 -10.897 0.107 1.00 10.00 H new ATOM 0 HD3 ARG A 32 3.632 -9.668 -1.132 1.00 10.00 H new ATOM 0 HE ARG A 32 3.703 -11.315 -2.779 1.00 10.00 H new ATOM 0 HH11 ARG A 32 4.234 -12.883 0.375 1.00 10.00 H new ATOM 0 HH12 ARG A 32 4.054 -14.508 -0.295 1.00 10.00 H new ATOM 0 HH21 ARG A 32 3.408 -13.392 -3.581 1.00 10.00 H new ATOM 0 HH22 ARG A 32 3.588 -14.794 -2.520 1.00 10.00 H new ATOM 499 N SER A 33 4.957 -11.245 4.011 1.00 10.00 N ATOM 500 CA SER A 33 5.185 -12.508 4.712 1.00 10.00 C ATOM 501 C SER A 33 6.401 -13.288 4.165 1.00 10.00 C ATOM 502 O SER A 33 6.383 -14.516 4.163 1.00 10.00 O ATOM 503 CB SER A 33 3.882 -13.326 4.735 1.00 10.00 C ATOM 504 OG SER A 33 2.798 -12.542 5.216 1.00 10.00 O ATOM 0 H SER A 33 4.817 -10.457 4.644 1.00 10.00 H new ATOM 0 HA SER A 33 5.457 -12.290 5.745 1.00 10.00 H new ATOM 0 HB2 SER A 33 3.657 -13.687 3.731 1.00 10.00 H new ATOM 0 HB3 SER A 33 4.010 -14.204 5.369 1.00 10.00 H new ATOM 0 HG SER A 33 1.980 -13.082 5.220 1.00 10.00 H new ATOM 510 N GLY A 34 7.437 -12.598 3.664 1.00 10.00 N ATOM 511 CA GLY A 34 8.600 -13.267 3.086 1.00 10.00 C ATOM 512 C GLY A 34 9.726 -12.352 2.600 1.00 10.00 C ATOM 513 O GLY A 34 10.721 -12.866 2.098 1.00 10.00 O ATOM 0 H GLY A 34 7.488 -11.579 3.650 1.00 10.00 H new ATOM 0 HA2 GLY A 34 9.009 -13.950 3.831 1.00 10.00 H new ATOM 0 HA3 GLY A 34 8.265 -13.875 2.246 1.00 10.00 H new ATOM 517 N ALA A 35 9.595 -11.023 2.686 1.00 10.00 N ATOM 518 CA ALA A 35 10.684 -10.110 2.353 1.00 10.00 C ATOM 519 C ALA A 35 11.880 -10.329 3.302 1.00 10.00 C ATOM 520 O ALA A 35 11.674 -10.708 4.456 1.00 10.00 O ATOM 521 CB ALA A 35 10.181 -8.664 2.444 1.00 10.00 C ATOM 0 H ALA A 35 8.738 -10.558 2.986 1.00 10.00 H new ATOM 0 HA ALA A 35 11.021 -10.308 1.335 1.00 10.00 H new ATOM 0 HB1 ALA A 35 10.993 -7.980 2.196 1.00 10.00 H new ATOM 0 HB2 ALA A 35 9.358 -8.520 1.744 1.00 10.00 H new ATOM 0 HB3 ALA A 35 9.834 -8.463 3.457 1.00 10.00 H new ATOM 527 N PRO A 36 13.119 -10.023 2.874 1.00 10.00 N ATOM 528 CA PRO A 36 14.331 -10.185 3.677 1.00 10.00 C ATOM 529 C PRO A 36 14.490 -9.051 4.713 1.00 10.00 C ATOM 530 O PRO A 36 15.502 -8.353 4.726 1.00 10.00 O ATOM 531 CB PRO A 36 15.467 -10.265 2.644 1.00 10.00 C ATOM 532 CG PRO A 36 14.980 -9.337 1.533 1.00 10.00 C ATOM 533 CD PRO A 36 13.474 -9.599 1.523 1.00 10.00 C ATOM 0 HA PRO A 36 14.316 -11.081 4.298 1.00 10.00 H new ATOM 0 HB2 PRO A 36 16.417 -9.932 3.061 1.00 10.00 H new ATOM 0 HB3 PRO A 36 15.616 -11.283 2.284 1.00 10.00 H new ATOM 0 HG2 PRO A 36 15.209 -8.293 1.746 1.00 10.00 H new ATOM 0 HG3 PRO A 36 15.440 -9.575 0.574 1.00 10.00 H new ATOM 0 HD2 PRO A 36 12.926 -8.700 1.242 1.00 10.00 H new ATOM 0 HD3 PRO A 36 13.219 -10.369 0.795 1.00 10.00 H new ATOM 541 N ALA A 37 13.484 -8.837 5.562 1.00 10.00 N ATOM 542 CA ALA A 37 13.490 -7.853 6.633 1.00 10.00 C ATOM 543 C ALA A 37 12.758 -8.439 7.839 1.00 10.00 C ATOM 544 O ALA A 37 11.726 -9.088 7.678 1.00 10.00 O ATOM 545 CB ALA A 37 12.800 -6.572 6.152 1.00 10.00 C ATOM 0 H ALA A 37 12.613 -9.366 5.517 1.00 10.00 H new ATOM 0 HA ALA A 37 14.513 -7.607 6.919 1.00 10.00 H new ATOM 0 HB1 ALA A 37 12.804 -5.834 6.954 1.00 10.00 H new ATOM 0 HB2 ALA A 37 13.333 -6.173 5.289 1.00 10.00 H new ATOM 0 HB3 ALA A 37 11.771 -6.797 5.870 1.00 10.00 H new ATOM 551 N ALA A 38 13.297 -8.189 9.033 1.00 10.00 N ATOM 552 CA ALA A 38 12.763 -8.653 10.312 1.00 10.00 C ATOM 553 C ALA A 38 13.135 -7.656 11.424 1.00 10.00 C ATOM 554 O ALA A 38 13.342 -8.035 12.578 1.00 10.00 O ATOM 555 CB ALA A 38 13.288 -10.067 10.602 1.00 10.00 C ATOM 0 H ALA A 38 14.149 -7.638 9.139 1.00 10.00 H new ATOM 0 HA ALA A 38 11.675 -8.704 10.270 1.00 10.00 H new ATOM 0 HB1 ALA A 38 12.890 -10.414 11.556 1.00 10.00 H new ATOM 0 HB2 ALA A 38 12.970 -10.743 9.808 1.00 10.00 H new ATOM 0 HB3 ALA A 38 14.377 -10.049 10.648 1.00 10.00 H new ATOM 561 N GLU A 39 13.266 -6.375 11.071 1.00 10.00 N ATOM 562 CA GLU A 39 13.507 -5.293 12.023 1.00 10.00 C ATOM 563 C GLU A 39 12.272 -5.142 12.918 1.00 10.00 C ATOM 564 O GLU A 39 11.167 -5.517 12.515 1.00 10.00 O ATOM 565 CB GLU A 39 13.786 -3.979 11.272 1.00 10.00 C ATOM 566 CG GLU A 39 15.034 -4.022 10.370 1.00 10.00 C ATOM 567 CD GLU A 39 16.331 -4.328 11.134 1.00 10.00 C ATOM 568 OE1 GLU A 39 16.757 -3.444 11.907 1.00 10.00 O ATOM 569 OE2 GLU A 39 16.856 -5.449 10.960 1.00 10.00 O ATOM 0 H GLU A 39 13.207 -6.058 10.103 1.00 10.00 H new ATOM 0 HA GLU A 39 14.378 -5.527 12.636 1.00 10.00 H new ATOM 0 HB2 GLU A 39 12.918 -3.731 10.661 1.00 10.00 H new ATOM 0 HB3 GLU A 39 13.904 -3.176 11.999 1.00 10.00 H new ATOM 0 HG2 GLU A 39 14.889 -4.778 9.598 1.00 10.00 H new ATOM 0 HG3 GLU A 39 15.138 -3.064 9.862 1.00 10.00 H new ATOM 576 N SER A 40 12.426 -4.544 14.103 1.00 10.00 N ATOM 577 CA SER A 40 11.344 -4.335 15.063 1.00 10.00 C ATOM 578 C SER A 40 11.474 -2.956 15.720 1.00 10.00 C ATOM 579 O SER A 40 12.557 -2.380 15.726 1.00 10.00 O ATOM 580 CB SER A 40 11.395 -5.423 16.145 1.00 10.00 C ATOM 581 OG SER A 40 11.522 -6.731 15.605 1.00 10.00 O ATOM 0 H SER A 40 13.325 -4.186 14.426 1.00 10.00 H new ATOM 0 HA SER A 40 10.392 -4.388 14.535 1.00 10.00 H new ATOM 0 HB2 SER A 40 12.235 -5.227 16.812 1.00 10.00 H new ATOM 0 HB3 SER A 40 10.489 -5.371 16.749 1.00 10.00 H new ATOM 0 HG SER A 40 10.773 -7.285 15.909 1.00 10.00 H new ATOM 587 N LYS A 41 10.392 -2.434 16.302 1.00 10.00 N ATOM 588 CA LYS A 41 10.404 -1.217 17.120 1.00 10.00 C ATOM 589 C LYS A 41 9.303 -1.297 18.175 1.00 10.00 C ATOM 590 O LYS A 41 8.418 -2.139 18.052 1.00 10.00 O ATOM 591 CB LYS A 41 10.269 0.045 16.238 1.00 10.00 C ATOM 592 CG LYS A 41 8.880 0.268 15.608 1.00 10.00 C ATOM 593 CD LYS A 41 8.862 1.557 14.769 1.00 10.00 C ATOM 594 CE LYS A 41 7.437 1.902 14.307 1.00 10.00 C ATOM 595 NZ LYS A 41 7.406 3.087 13.420 1.00 10.00 N ATOM 0 H LYS A 41 9.466 -2.852 16.217 1.00 10.00 H new ATOM 0 HA LYS A 41 11.362 -1.140 17.634 1.00 10.00 H new ATOM 0 HB2 LYS A 41 10.519 0.917 16.842 1.00 10.00 H new ATOM 0 HB3 LYS A 41 11.007 -0.011 15.438 1.00 10.00 H new ATOM 0 HG2 LYS A 41 8.619 -0.584 14.980 1.00 10.00 H new ATOM 0 HG3 LYS A 41 8.125 0.328 16.392 1.00 10.00 H new ATOM 0 HD2 LYS A 41 9.266 2.382 15.356 1.00 10.00 H new ATOM 0 HD3 LYS A 41 9.509 1.437 13.900 1.00 10.00 H new ATOM 0 HE2 LYS A 41 7.010 1.047 13.783 1.00 10.00 H new ATOM 0 HE3 LYS A 41 6.809 2.087 15.179 1.00 10.00 H new ATOM 0 HZ1 LYS A 41 6.445 3.485 13.406 1.00 10.00 H new ATOM 0 HZ2 LYS A 41 8.072 3.803 13.774 1.00 10.00 H new ATOM 0 HZ3 LYS A 41 7.678 2.806 12.456 1.00 10.00 H new ATOM 609 N GLU A 42 9.287 -0.389 19.143 1.00 10.00 N ATOM 610 CA GLU A 42 8.203 -0.256 20.108 1.00 10.00 C ATOM 611 C GLU A 42 7.278 0.874 19.647 1.00 10.00 C ATOM 612 O GLU A 42 7.752 1.849 19.059 1.00 10.00 O ATOM 613 CB GLU A 42 8.764 0.045 21.507 1.00 10.00 C ATOM 614 CG GLU A 42 9.485 -1.144 22.175 1.00 10.00 C ATOM 615 CD GLU A 42 10.909 -1.449 21.674 1.00 10.00 C ATOM 616 OE1 GLU A 42 11.610 -0.507 21.247 1.00 10.00 O ATOM 617 OE2 GLU A 42 11.299 -2.642 21.756 1.00 10.00 O ATOM 0 H GLU A 42 10.039 0.286 19.282 1.00 10.00 H new ATOM 0 HA GLU A 42 7.644 -1.190 20.167 1.00 10.00 H new ATOM 0 HB2 GLU A 42 9.460 0.881 21.434 1.00 10.00 H new ATOM 0 HB3 GLU A 42 7.946 0.366 22.152 1.00 10.00 H new ATOM 0 HG2 GLU A 42 9.533 -0.956 23.248 1.00 10.00 H new ATOM 0 HG3 GLU A 42 8.875 -2.036 22.035 1.00 10.00 H new ATOM 624 N ILE A 43 5.985 0.769 19.959 1.00 10.00 N ATOM 625 CA ILE A 43 4.938 1.728 19.618 1.00 10.00 C ATOM 626 C ILE A 43 3.986 1.908 20.808 1.00 10.00 C ATOM 627 O ILE A 43 3.833 0.997 21.629 1.00 10.00 O ATOM 628 CB ILE A 43 4.169 1.274 18.348 1.00 10.00 C ATOM 629 CG1 ILE A 43 3.633 -0.178 18.425 1.00 10.00 C ATOM 630 CG2 ILE A 43 5.046 1.470 17.100 1.00 10.00 C ATOM 631 CD1 ILE A 43 2.643 -0.563 17.315 1.00 10.00 C ATOM 0 H ILE A 43 5.624 -0.028 20.483 1.00 10.00 H new ATOM 0 HA ILE A 43 5.399 2.691 19.397 1.00 10.00 H new ATOM 0 HB ILE A 43 3.286 1.909 18.279 1.00 10.00 H new ATOM 0 HG12 ILE A 43 4.479 -0.864 18.391 1.00 10.00 H new ATOM 0 HG13 ILE A 43 3.147 -0.319 19.390 1.00 10.00 H new ATOM 0 HG21 ILE A 43 4.497 1.148 16.215 1.00 10.00 H new ATOM 0 HG22 ILE A 43 5.308 2.523 17.001 1.00 10.00 H new ATOM 0 HG23 ILE A 43 5.956 0.877 17.198 1.00 10.00 H new ATOM 0 HD11 ILE A 43 2.325 -1.596 17.454 1.00 10.00 H new ATOM 0 HD12 ILE A 43 1.774 0.094 17.359 1.00 10.00 H new ATOM 0 HD13 ILE A 43 3.127 -0.460 16.344 1.00 10.00 H new ATOM 643 N VAL A 44 3.329 3.065 20.883 1.00 10.00 N ATOM 644 CA VAL A 44 2.336 3.387 21.908 1.00 10.00 C ATOM 645 C VAL A 44 0.970 3.406 21.217 1.00 10.00 C ATOM 646 O VAL A 44 0.808 4.080 20.192 1.00 10.00 O ATOM 647 CB VAL A 44 2.657 4.761 22.532 1.00 10.00 C ATOM 648 CG1 VAL A 44 1.767 5.068 23.744 1.00 10.00 C ATOM 649 CG2 VAL A 44 4.115 4.880 23.004 1.00 10.00 C ATOM 0 H VAL A 44 3.476 3.823 20.217 1.00 10.00 H new ATOM 0 HA VAL A 44 2.342 2.652 22.713 1.00 10.00 H new ATOM 0 HB VAL A 44 2.471 5.473 21.728 1.00 10.00 H new ATOM 0 HG11 VAL A 44 2.029 6.045 24.150 1.00 10.00 H new ATOM 0 HG12 VAL A 44 0.721 5.072 23.436 1.00 10.00 H new ATOM 0 HG13 VAL A 44 1.917 4.305 24.508 1.00 10.00 H new ATOM 0 HG21 VAL A 44 4.279 5.868 23.433 1.00 10.00 H new ATOM 0 HG22 VAL A 44 4.317 4.119 23.758 1.00 10.00 H new ATOM 0 HG23 VAL A 44 4.785 4.737 22.156 1.00 10.00 H new ATOM 659 N ARG A 45 -0.013 2.684 21.762 1.00 10.00 N ATOM 660 CA ARG A 45 -1.364 2.561 21.210 1.00 10.00 C ATOM 661 C ARG A 45 -2.335 2.736 22.373 1.00 10.00 C ATOM 662 O ARG A 45 -2.084 2.183 23.444 1.00 10.00 O ATOM 663 CB ARG A 45 -1.551 1.159 20.597 1.00 10.00 C ATOM 664 CG ARG A 45 -0.611 0.759 19.445 1.00 10.00 C ATOM 665 CD ARG A 45 -0.916 1.446 18.107 1.00 10.00 C ATOM 666 NE ARG A 45 -0.153 2.691 17.996 1.00 10.00 N ATOM 667 CZ ARG A 45 0.793 2.967 17.099 1.00 10.00 C ATOM 668 NH1 ARG A 45 0.901 2.321 15.939 1.00 10.00 N ATOM 669 NH2 ARG A 45 1.690 3.889 17.404 1.00 10.00 N ATOM 0 H ARG A 45 0.113 2.154 22.624 1.00 10.00 H new ATOM 0 HA ARG A 45 -1.536 3.306 20.433 1.00 10.00 H new ATOM 0 HB2 ARG A 45 -1.438 0.425 21.395 1.00 10.00 H new ATOM 0 HB3 ARG A 45 -2.577 1.083 20.237 1.00 10.00 H new ATOM 0 HG2 ARG A 45 0.415 0.991 19.733 1.00 10.00 H new ATOM 0 HG3 ARG A 45 -0.667 -0.321 19.306 1.00 10.00 H new ATOM 0 HD2 ARG A 45 -0.663 0.781 17.282 1.00 10.00 H new ATOM 0 HD3 ARG A 45 -1.983 1.656 18.032 1.00 10.00 H new ATOM 0 HE ARG A 45 -0.368 3.422 18.675 1.00 10.00 H new ATOM 0 HH11 ARG A 45 0.242 1.579 15.705 1.00 10.00 H new ATOM 0 HH12 ARG A 45 1.643 2.569 15.284 1.00 10.00 H new ATOM 0 HH21 ARG A 45 1.645 4.366 18.304 1.00 10.00 H new ATOM 0 HH22 ARG A 45 2.427 4.123 16.739 1.00 10.00 H new ATOM 683 N GLY A 46 -3.434 3.466 22.210 1.00 10.00 N ATOM 684 CA GLY A 46 -4.379 3.638 23.303 1.00 10.00 C ATOM 685 C GLY A 46 -5.606 4.386 22.844 1.00 10.00 C ATOM 686 O GLY A 46 -5.495 5.507 22.364 1.00 10.00 O ATOM 0 H GLY A 46 -3.688 3.941 21.344 1.00 10.00 H new ATOM 0 HA2 GLY A 46 -4.669 2.663 23.695 1.00 10.00 H new ATOM 0 HA3 GLY A 46 -3.902 4.181 24.119 1.00 10.00 H new ATOM 690 N TYR A 47 -6.777 3.783 23.013 1.00 10.00 N ATOM 691 CA TYR A 47 -8.006 4.341 22.468 1.00 10.00 C ATOM 692 C TYR A 47 -9.136 4.097 23.450 1.00 10.00 C ATOM 693 O TYR A 47 -9.289 2.975 23.937 1.00 10.00 O ATOM 694 CB TYR A 47 -8.330 3.679 21.126 1.00 10.00 C ATOM 695 CG TYR A 47 -7.174 3.552 20.149 1.00 10.00 C ATOM 696 CD1 TYR A 47 -6.898 4.571 19.218 1.00 10.00 C ATOM 697 CD2 TYR A 47 -6.383 2.388 20.161 1.00 10.00 C ATOM 698 CE1 TYR A 47 -5.843 4.429 18.300 1.00 10.00 C ATOM 699 CE2 TYR A 47 -5.336 2.234 19.238 1.00 10.00 C ATOM 700 CZ TYR A 47 -5.063 3.253 18.298 1.00 10.00 C ATOM 701 OH TYR A 47 -4.065 3.064 17.396 1.00 10.00 O ATOM 0 H TYR A 47 -6.900 2.908 23.523 1.00 10.00 H new ATOM 0 HA TYR A 47 -7.883 5.412 22.309 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -8.726 2.682 21.321 1.00 10.00 H new ATOM 0 HB3 TYR A 47 -9.125 4.249 20.645 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -7.500 5.467 19.209 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -6.582 1.610 20.883 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -5.629 5.220 17.596 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -4.738 1.335 19.247 1.00 10.00 H new ATOM 0 HH TYR A 47 -4.096 3.774 16.721 1.00 10.00 H new ATOM 711 N LYS A 48 -9.944 5.127 23.715 1.00 10.00 N ATOM 712 CA LYS A 48 -11.019 5.064 24.707 1.00 10.00 C ATOM 713 C LYS A 48 -12.074 3.989 24.433 1.00 10.00 C ATOM 714 O LYS A 48 -12.776 3.634 25.370 1.00 10.00 O ATOM 715 CB LYS A 48 -11.661 6.449 24.912 1.00 10.00 C ATOM 716 CG LYS A 48 -12.358 7.014 23.663 1.00 10.00 C ATOM 717 CD LYS A 48 -13.073 8.328 24.005 1.00 10.00 C ATOM 718 CE LYS A 48 -13.773 8.973 22.799 1.00 10.00 C ATOM 719 NZ LYS A 48 -12.825 9.595 21.844 1.00 10.00 N ATOM 0 H LYS A 48 -9.870 6.030 23.246 1.00 10.00 H new ATOM 0 HA LYS A 48 -10.541 4.755 25.637 1.00 10.00 H new ATOM 0 HB2 LYS A 48 -12.388 6.383 25.721 1.00 10.00 H new ATOM 0 HB3 LYS A 48 -10.890 7.150 25.232 1.00 10.00 H new ATOM 0 HG2 LYS A 48 -11.625 7.185 22.874 1.00 10.00 H new ATOM 0 HG3 LYS A 48 -13.076 6.290 23.279 1.00 10.00 H new ATOM 0 HD2 LYS A 48 -13.810 8.140 24.786 1.00 10.00 H new ATOM 0 HD3 LYS A 48 -12.348 9.032 24.414 1.00 10.00 H new ATOM 0 HE2 LYS A 48 -14.360 8.216 22.279 1.00 10.00 H new ATOM 0 HE3 LYS A 48 -14.472 9.730 23.154 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 -13.351 10.183 21.167 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 -12.147 10.188 22.364 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 -12.311 8.851 21.330 1.00 10.00 H new ATOM 733 N TRP A 49 -12.237 3.500 23.198 1.00 10.00 N ATOM 734 CA TRP A 49 -13.204 2.444 22.913 1.00 10.00 C ATOM 735 C TRP A 49 -12.843 1.124 23.603 1.00 10.00 C ATOM 736 O TRP A 49 -13.737 0.315 23.831 1.00 10.00 O ATOM 737 CB TRP A 49 -13.417 2.267 21.397 1.00 10.00 C ATOM 738 CG TRP A 49 -12.209 2.204 20.501 1.00 10.00 C ATOM 739 CD1 TRP A 49 -11.858 3.166 19.617 1.00 10.00 C ATOM 740 CD2 TRP A 49 -11.197 1.152 20.356 1.00 10.00 C ATOM 741 NE1 TRP A 49 -10.714 2.794 18.946 1.00 10.00 N ATOM 742 CE2 TRP A 49 -10.237 1.583 19.392 1.00 10.00 C ATOM 743 CE3 TRP A 49 -10.965 -0.112 20.943 1.00 10.00 C ATOM 744 CZ2 TRP A 49 -9.081 0.850 19.092 1.00 10.00 C ATOM 745 CZ3 TRP A 49 -9.785 -0.838 20.682 1.00 10.00 C ATOM 746 CH2 TRP A 49 -8.836 -0.353 19.769 1.00 10.00 C ATOM 0 H TRP A 49 -11.711 3.820 22.385 1.00 10.00 H new ATOM 0 HA TRP A 49 -14.157 2.761 23.337 1.00 10.00 H new ATOM 0 HB2 TRP A 49 -13.988 1.350 21.248 1.00 10.00 H new ATOM 0 HB3 TRP A 49 -14.042 3.091 21.052 1.00 10.00 H new ATOM 0 HD1 TRP A 49 -12.396 4.090 19.460 1.00 10.00 H new ATOM 0 HE1 TRP A 49 -10.275 3.347 18.210 1.00 10.00 H new ATOM 0 HE3 TRP A 49 -11.708 -0.531 21.606 1.00 10.00 H new ATOM 0 HZ2 TRP A 49 -8.386 1.208 18.347 1.00 10.00 H new ATOM 0 HZ3 TRP A 49 -9.610 -1.775 21.189 1.00 10.00 H new ATOM 0 HH2 TRP A 49 -7.924 -0.902 19.589 1.00 10.00 H new ATOM 757 N ALA A 50 -11.570 0.865 23.920 1.00 10.00 N ATOM 758 CA ALA A 50 -11.159 -0.383 24.541 1.00 10.00 C ATOM 759 C ALA A 50 -11.627 -0.433 25.996 1.00 10.00 C ATOM 760 O ALA A 50 -11.129 0.329 26.830 1.00 10.00 O ATOM 761 CB ALA A 50 -9.638 -0.519 24.453 1.00 10.00 C ATOM 0 H ALA A 50 -10.804 1.517 23.751 1.00 10.00 H new ATOM 0 HA ALA A 50 -11.618 -1.218 24.012 1.00 10.00 H new ATOM 0 HB1 ALA A 50 -9.329 -1.455 24.919 1.00 10.00 H new ATOM 0 HB2 ALA A 50 -9.332 -0.516 23.407 1.00 10.00 H new ATOM 0 HB3 ALA A 50 -9.167 0.317 24.971 1.00 10.00 H new ATOM 767 N GLU A 51 -12.509 -1.380 26.320 1.00 10.00 N ATOM 768 CA GLU A 51 -12.950 -1.633 27.695 1.00 10.00 C ATOM 769 C GLU A 51 -11.819 -2.289 28.508 1.00 10.00 C ATOM 770 O GLU A 51 -11.655 -2.027 29.706 1.00 10.00 O ATOM 771 CB GLU A 51 -14.225 -2.497 27.659 1.00 10.00 C ATOM 772 CG GLU A 51 -14.873 -2.671 29.043 1.00 10.00 C ATOM 773 CD GLU A 51 -16.280 -3.296 28.956 1.00 10.00 C ATOM 774 OE1 GLU A 51 -16.365 -4.496 28.605 1.00 10.00 O ATOM 775 OE2 GLU A 51 -17.251 -2.556 29.238 1.00 10.00 O ATOM 0 H GLU A 51 -12.941 -1.997 25.632 1.00 10.00 H new ATOM 0 HA GLU A 51 -13.190 -0.694 28.194 1.00 10.00 H new ATOM 0 HB2 GLU A 51 -14.947 -2.042 26.981 1.00 10.00 H new ATOM 0 HB3 GLU A 51 -13.981 -3.478 27.252 1.00 10.00 H new ATOM 0 HG2 GLU A 51 -14.236 -3.301 29.663 1.00 10.00 H new ATOM 0 HG3 GLU A 51 -14.939 -1.701 29.536 1.00 10.00 H new ATOM 782 N TYR A 52 -10.953 -3.059 27.839 1.00 10.00 N ATOM 783 CA TYR A 52 -9.798 -3.737 28.411 1.00 10.00 C ATOM 784 C TYR A 52 -8.630 -3.531 27.457 1.00 10.00 C ATOM 785 O TYR A 52 -8.811 -3.487 26.246 1.00 10.00 O ATOM 786 CB TYR A 52 -10.083 -5.235 28.588 1.00 10.00 C ATOM 787 CG TYR A 52 -11.195 -5.552 29.569 1.00 10.00 C ATOM 788 CD1 TYR A 52 -10.937 -5.539 30.954 1.00 10.00 C ATOM 789 CD2 TYR A 52 -12.487 -5.861 29.102 1.00 10.00 C ATOM 790 CE1 TYR A 52 -11.967 -5.823 31.870 1.00 10.00 C ATOM 791 CE2 TYR A 52 -13.519 -6.153 30.011 1.00 10.00 C ATOM 792 CZ TYR A 52 -13.267 -6.129 31.400 1.00 10.00 C ATOM 793 OH TYR A 52 -14.266 -6.421 32.278 1.00 10.00 O ATOM 0 H TYR A 52 -11.048 -3.230 26.838 1.00 10.00 H new ATOM 0 HA TYR A 52 -9.568 -3.329 29.395 1.00 10.00 H new ATOM 0 HB2 TYR A 52 -10.340 -5.660 27.618 1.00 10.00 H new ATOM 0 HB3 TYR A 52 -9.170 -5.729 28.921 1.00 10.00 H new ATOM 0 HD1 TYR A 52 -9.945 -5.310 31.314 1.00 10.00 H new ATOM 0 HD2 TYR A 52 -12.686 -5.874 28.041 1.00 10.00 H new ATOM 0 HE1 TYR A 52 -11.766 -5.808 32.931 1.00 10.00 H new ATOM 0 HE2 TYR A 52 -14.506 -6.396 29.646 1.00 10.00 H new ATOM 0 HH TYR A 52 -15.092 -6.605 31.784 1.00 10.00 H new ATOM 803 N HIS A 53 -7.411 -3.427 27.986 1.00 10.00 N ATOM 804 CA HIS A 53 -6.209 -3.121 27.207 1.00 10.00 C ATOM 805 C HIS A 53 -5.940 -4.185 26.135 1.00 10.00 C ATOM 806 O HIS A 53 -5.422 -3.868 25.065 1.00 10.00 O ATOM 807 CB HIS A 53 -5.011 -2.998 28.164 1.00 10.00 C ATOM 808 CG HIS A 53 -4.697 -4.317 28.824 1.00 10.00 C ATOM 809 ND1 HIS A 53 -5.462 -4.942 29.818 1.00 10.00 N ATOM 810 CD2 HIS A 53 -3.762 -5.192 28.365 1.00 10.00 C ATOM 811 CE1 HIS A 53 -4.971 -6.192 29.908 1.00 10.00 C ATOM 812 NE2 HIS A 53 -3.939 -6.364 29.060 1.00 10.00 N ATOM 0 H HIS A 53 -7.227 -3.554 28.981 1.00 10.00 H new ATOM 0 HA HIS A 53 -6.362 -2.177 26.684 1.00 10.00 H new ATOM 0 HB2 HIS A 53 -4.138 -2.648 27.613 1.00 10.00 H new ATOM 0 HB3 HIS A 53 -5.228 -2.250 28.927 1.00 10.00 H new ATOM 0 HD2 HIS A 53 -3.023 -5.002 27.601 1.00 10.00 H new ATOM 0 HE1 HIS A 53 -5.353 -6.954 30.571 1.00 10.00 H new ATOM 0 HE2 HIS A 53 -3.386 -7.214 28.953 1.00 10.00 H new ATOM 820 N ALA A 54 -6.304 -5.443 26.408 1.00 10.00 N ATOM 821 CA ALA A 54 -6.149 -6.543 25.467 1.00 10.00 C ATOM 822 C ALA A 54 -6.948 -6.318 24.177 1.00 10.00 C ATOM 823 O ALA A 54 -6.537 -6.815 23.135 1.00 10.00 O ATOM 824 CB ALA A 54 -6.565 -7.854 26.141 1.00 10.00 C ATOM 0 H ALA A 54 -6.717 -5.722 27.298 1.00 10.00 H new ATOM 0 HA ALA A 54 -5.099 -6.597 25.180 1.00 10.00 H new ATOM 0 HB1 ALA A 54 -6.449 -8.678 25.437 1.00 10.00 H new ATOM 0 HB2 ALA A 54 -5.935 -8.031 27.013 1.00 10.00 H new ATOM 0 HB3 ALA A 54 -7.607 -7.788 26.454 1.00 10.00 H new ATOM 830 N ASP A 55 -8.038 -5.540 24.232 1.00 10.00 N ATOM 831 CA ASP A 55 -8.826 -5.214 23.039 1.00 10.00 C ATOM 832 C ASP A 55 -8.012 -4.342 22.079 1.00 10.00 C ATOM 833 O ASP A 55 -8.142 -4.439 20.860 1.00 10.00 O ATOM 834 CB ASP A 55 -10.117 -4.473 23.424 1.00 10.00 C ATOM 835 CG ASP A 55 -11.124 -4.479 22.267 1.00 10.00 C ATOM 836 OD1 ASP A 55 -11.564 -5.574 21.878 1.00 10.00 O ATOM 837 OD2 ASP A 55 -11.457 -3.386 21.751 1.00 10.00 O ATOM 0 H ASP A 55 -8.393 -5.125 25.093 1.00 10.00 H new ATOM 0 HA ASP A 55 -9.085 -6.151 22.545 1.00 10.00 H new ATOM 0 HB2 ASP A 55 -10.563 -4.944 24.300 1.00 10.00 H new ATOM 0 HB3 ASP A 55 -9.881 -3.445 23.700 1.00 10.00 H new ATOM 842 N ILE A 56 -7.134 -3.489 22.628 1.00 10.00 N ATOM 843 CA ILE A 56 -6.220 -2.679 21.837 1.00 10.00 C ATOM 844 C ILE A 56 -5.215 -3.618 21.170 1.00 10.00 C ATOM 845 O ILE A 56 -5.015 -3.522 19.960 1.00 10.00 O ATOM 846 CB ILE A 56 -5.486 -1.609 22.687 1.00 10.00 C ATOM 847 CG1 ILE A 56 -6.408 -0.797 23.623 1.00 10.00 C ATOM 848 CG2 ILE A 56 -4.727 -0.668 21.730 1.00 10.00 C ATOM 849 CD1 ILE A 56 -5.645 -0.052 24.726 1.00 10.00 C ATOM 0 H ILE A 56 -7.044 -3.348 23.634 1.00 10.00 H new ATOM 0 HA ILE A 56 -6.793 -2.130 21.090 1.00 10.00 H new ATOM 0 HB ILE A 56 -4.803 -2.137 23.352 1.00 10.00 H new ATOM 0 HG12 ILE A 56 -6.973 -0.077 23.031 1.00 10.00 H new ATOM 0 HG13 ILE A 56 -7.132 -1.470 24.082 1.00 10.00 H new ATOM 0 HG21 ILE A 56 -4.203 0.093 22.308 1.00 10.00 H new ATOM 0 HG22 ILE A 56 -4.006 -1.244 21.150 1.00 10.00 H new ATOM 0 HG23 ILE A 56 -5.435 -0.188 21.055 1.00 10.00 H new ATOM 0 HD11 ILE A 56 -6.351 0.499 25.348 1.00 10.00 H new ATOM 0 HD12 ILE A 56 -5.102 -0.770 25.341 1.00 10.00 H new ATOM 0 HD13 ILE A 56 -4.940 0.645 24.273 1.00 10.00 H new ATOM 861 N TYR A 57 -4.566 -4.497 21.948 1.00 10.00 N ATOM 862 CA TYR A 57 -3.571 -5.423 21.415 1.00 10.00 C ATOM 863 C TYR A 57 -4.157 -6.272 20.283 1.00 10.00 C ATOM 864 O TYR A 57 -3.492 -6.422 19.257 1.00 10.00 O ATOM 865 CB TYR A 57 -2.983 -6.296 22.533 1.00 10.00 C ATOM 866 CG TYR A 57 -2.048 -7.385 22.030 1.00 10.00 C ATOM 867 CD1 TYR A 57 -0.745 -7.067 21.595 1.00 10.00 C ATOM 868 CD2 TYR A 57 -2.505 -8.714 21.947 1.00 10.00 C ATOM 869 CE1 TYR A 57 0.091 -8.063 21.056 1.00 10.00 C ATOM 870 CE2 TYR A 57 -1.671 -9.716 21.421 1.00 10.00 C ATOM 871 CZ TYR A 57 -0.377 -9.393 20.953 1.00 10.00 C ATOM 872 OH TYR A 57 0.404 -10.379 20.432 1.00 10.00 O ATOM 0 H TYR A 57 -4.718 -4.581 22.953 1.00 10.00 H new ATOM 0 HA TYR A 57 -2.755 -4.838 20.991 1.00 10.00 H new ATOM 0 HB2 TYR A 57 -2.442 -5.659 23.233 1.00 10.00 H new ATOM 0 HB3 TYR A 57 -3.799 -6.758 23.088 1.00 10.00 H new ATOM 0 HD1 TYR A 57 -0.386 -6.052 21.676 1.00 10.00 H new ATOM 0 HD2 TYR A 57 -3.499 -8.964 22.288 1.00 10.00 H new ATOM 0 HE1 TYR A 57 1.087 -7.812 20.722 1.00 10.00 H new ATOM 0 HE2 TYR A 57 -2.020 -10.737 21.374 1.00 10.00 H new ATOM 0 HH TYR A 57 1.164 -9.979 19.960 1.00 10.00 H new ATOM 882 N ASP A 58 -5.392 -6.758 20.431 1.00 10.00 N ATOM 883 CA ASP A 58 -6.079 -7.529 19.389 1.00 10.00 C ATOM 884 C ASP A 58 -6.278 -6.699 18.117 1.00 10.00 C ATOM 885 O ASP A 58 -5.882 -7.118 17.028 1.00 10.00 O ATOM 886 CB ASP A 58 -7.433 -8.040 19.899 1.00 10.00 C ATOM 887 CG ASP A 58 -8.187 -8.795 18.794 1.00 10.00 C ATOM 888 OD1 ASP A 58 -7.780 -9.944 18.513 1.00 10.00 O ATOM 889 OD2 ASP A 58 -9.108 -8.183 18.206 1.00 10.00 O ATOM 0 H ASP A 58 -5.946 -6.628 21.278 1.00 10.00 H new ATOM 0 HA ASP A 58 -5.447 -8.382 19.142 1.00 10.00 H new ATOM 0 HB2 ASP A 58 -7.279 -8.698 20.754 1.00 10.00 H new ATOM 0 HB3 ASP A 58 -8.035 -7.201 20.247 1.00 10.00 H new ATOM 894 N LYS A 59 -6.793 -5.466 18.246 1.00 10.00 N ATOM 895 CA LYS A 59 -7.024 -4.597 17.088 1.00 10.00 C ATOM 896 C LYS A 59 -5.707 -4.294 16.382 1.00 10.00 C ATOM 897 O LYS A 59 -5.633 -4.391 15.158 1.00 10.00 O ATOM 898 CB LYS A 59 -7.749 -3.298 17.507 1.00 10.00 C ATOM 899 CG LYS A 59 -9.101 -3.094 16.798 1.00 10.00 C ATOM 900 CD LYS A 59 -10.174 -4.152 17.118 1.00 10.00 C ATOM 901 CE LYS A 59 -10.567 -4.212 18.601 1.00 10.00 C ATOM 902 NZ LYS A 59 -11.330 -3.027 19.056 1.00 10.00 N ATOM 0 H LYS A 59 -7.056 -5.052 19.140 1.00 10.00 H new ATOM 0 HA LYS A 59 -7.672 -5.121 16.386 1.00 10.00 H new ATOM 0 HB2 LYS A 59 -7.911 -3.313 18.585 1.00 10.00 H new ATOM 0 HB3 LYS A 59 -7.104 -2.446 17.294 1.00 10.00 H new ATOM 0 HG2 LYS A 59 -9.490 -2.112 17.067 1.00 10.00 H new ATOM 0 HG3 LYS A 59 -8.931 -3.086 15.721 1.00 10.00 H new ATOM 0 HD2 LYS A 59 -11.064 -3.943 16.525 1.00 10.00 H new ATOM 0 HD3 LYS A 59 -9.808 -5.131 16.810 1.00 10.00 H new ATOM 0 HE2 LYS A 59 -11.163 -5.108 18.775 1.00 10.00 H new ATOM 0 HE3 LYS A 59 -9.665 -4.308 19.205 1.00 10.00 H new ATOM 0 HZ1 LYS A 59 -11.806 -3.245 19.954 1.00 10.00 H new ATOM 0 HZ2 LYS A 59 -10.680 -2.227 19.194 1.00 10.00 H new ATOM 0 HZ3 LYS A 59 -12.041 -2.776 18.340 1.00 10.00 H new ATOM 916 N VAL A 60 -4.680 -3.921 17.146 1.00 10.00 N ATOM 917 CA VAL A 60 -3.382 -3.553 16.600 1.00 10.00 C ATOM 918 C VAL A 60 -2.751 -4.769 15.921 1.00 10.00 C ATOM 919 O VAL A 60 -2.217 -4.631 14.827 1.00 10.00 O ATOM 920 CB VAL A 60 -2.510 -2.956 17.724 1.00 10.00 C ATOM 921 CG1 VAL A 60 -1.064 -2.681 17.272 1.00 10.00 C ATOM 922 CG2 VAL A 60 -3.115 -1.628 18.218 1.00 10.00 C ATOM 0 H VAL A 60 -4.729 -3.867 18.163 1.00 10.00 H new ATOM 0 HA VAL A 60 -3.482 -2.785 15.833 1.00 10.00 H new ATOM 0 HB VAL A 60 -2.489 -3.699 18.521 1.00 10.00 H new ATOM 0 HG11 VAL A 60 -0.497 -2.262 18.103 1.00 10.00 H new ATOM 0 HG12 VAL A 60 -0.600 -3.613 16.949 1.00 10.00 H new ATOM 0 HG13 VAL A 60 -1.070 -1.973 16.443 1.00 10.00 H new ATOM 0 HG21 VAL A 60 -2.491 -1.217 19.011 1.00 10.00 H new ATOM 0 HG22 VAL A 60 -3.164 -0.920 17.390 1.00 10.00 H new ATOM 0 HG23 VAL A 60 -4.119 -1.806 18.602 1.00 10.00 H new ATOM 932 N SER A 61 -2.801 -5.958 16.525 1.00 10.00 N ATOM 933 CA SER A 61 -2.229 -7.158 15.918 1.00 10.00 C ATOM 934 C SER A 61 -2.941 -7.503 14.604 1.00 10.00 C ATOM 935 O SER A 61 -2.285 -7.933 13.655 1.00 10.00 O ATOM 936 CB SER A 61 -2.290 -8.329 16.904 1.00 10.00 C ATOM 937 OG SER A 61 -1.627 -7.968 18.101 1.00 10.00 O ATOM 0 H SER A 61 -3.233 -6.114 17.436 1.00 10.00 H new ATOM 0 HA SER A 61 -1.183 -6.962 15.682 1.00 10.00 H new ATOM 0 HB2 SER A 61 -3.328 -8.589 17.114 1.00 10.00 H new ATOM 0 HB3 SER A 61 -1.822 -9.211 16.468 1.00 10.00 H new ATOM 0 HG SER A 61 -2.263 -7.537 18.710 1.00 10.00 H new ATOM 943 N GLY A 62 -4.256 -7.291 14.511 1.00 10.00 N ATOM 944 CA GLY A 62 -4.982 -7.461 13.265 1.00 10.00 C ATOM 945 C GLY A 62 -4.505 -6.445 12.230 1.00 10.00 C ATOM 946 O GLY A 62 -4.142 -6.824 11.118 1.00 10.00 O ATOM 0 H GLY A 62 -4.838 -6.999 15.296 1.00 10.00 H new ATOM 0 HA2 GLY A 62 -4.835 -8.472 12.886 1.00 10.00 H new ATOM 0 HA3 GLY A 62 -6.051 -7.338 13.439 1.00 10.00 H new ATOM 950 N ASP A 63 -4.472 -5.161 12.591 1.00 10.00 N ATOM 951 CA ASP A 63 -4.086 -4.078 11.681 1.00 10.00 C ATOM 952 C ASP A 63 -2.654 -4.247 11.178 1.00 10.00 C ATOM 953 O ASP A 63 -2.398 -4.084 9.986 1.00 10.00 O ATOM 954 CB ASP A 63 -4.235 -2.714 12.364 1.00 10.00 C ATOM 955 CG ASP A 63 -3.915 -1.576 11.384 1.00 10.00 C ATOM 956 OD1 ASP A 63 -4.762 -1.360 10.485 1.00 10.00 O ATOM 957 OD2 ASP A 63 -2.811 -1.005 11.517 1.00 10.00 O ATOM 0 H ASP A 63 -4.714 -4.840 13.529 1.00 10.00 H new ATOM 0 HA ASP A 63 -4.758 -4.125 10.824 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -5.251 -2.600 12.741 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -3.568 -2.658 13.224 1.00 10.00 H new ATOM 962 N MET A 64 -1.737 -4.672 12.050 1.00 10.00 N ATOM 963 CA MET A 64 -0.349 -4.897 11.686 1.00 10.00 C ATOM 964 C MET A 64 -0.223 -6.038 10.689 1.00 10.00 C ATOM 965 O MET A 64 0.561 -5.917 9.747 1.00 10.00 O ATOM 966 CB MET A 64 0.514 -5.168 12.925 1.00 10.00 C ATOM 967 CG MET A 64 0.804 -3.878 13.699 1.00 10.00 C ATOM 968 SD MET A 64 1.569 -2.552 12.734 1.00 10.00 S ATOM 969 CE MET A 64 0.410 -1.224 13.135 1.00 10.00 C ATOM 0 H MET A 64 -1.943 -4.868 13.029 1.00 10.00 H new ATOM 0 HA MET A 64 0.017 -3.986 11.211 1.00 10.00 H new ATOM 0 HB2 MET A 64 0.005 -5.878 13.577 1.00 10.00 H new ATOM 0 HB3 MET A 64 1.453 -5.631 12.622 1.00 10.00 H new ATOM 0 HG2 MET A 64 -0.132 -3.507 14.118 1.00 10.00 H new ATOM 0 HG3 MET A 64 1.457 -4.117 14.539 1.00 10.00 H new ATOM 0 HE1 MET A 64 0.607 -0.364 12.495 1.00 10.00 H new ATOM 0 HE2 MET A 64 -0.611 -1.571 12.973 1.00 10.00 H new ATOM 0 HE3 MET A 64 0.534 -0.936 14.179 1.00 10.00 H new ATOM 979 N GLN A 65 -1.000 -7.116 10.834 1.00 10.00 N ATOM 980 CA GLN A 65 -0.985 -8.206 9.866 1.00 10.00 C ATOM 981 C GLN A 65 -1.500 -7.724 8.506 1.00 10.00 C ATOM 982 O GLN A 65 -0.989 -8.165 7.474 1.00 10.00 O ATOM 983 CB GLN A 65 -1.796 -9.392 10.404 1.00 10.00 C ATOM 984 CG GLN A 65 -1.006 -10.148 11.485 1.00 10.00 C ATOM 985 CD GLN A 65 -1.879 -11.184 12.190 1.00 10.00 C ATOM 986 OE1 GLN A 65 -1.908 -12.360 11.844 1.00 10.00 O ATOM 987 NE2 GLN A 65 -2.658 -10.744 13.165 1.00 10.00 N ATOM 0 H GLN A 65 -1.645 -7.253 11.613 1.00 10.00 H new ATOM 0 HA GLN A 65 0.040 -8.545 9.717 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -2.739 -9.035 10.819 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -2.043 -10.070 9.587 1.00 10.00 H new ATOM 0 HG2 GLN A 65 -0.147 -10.642 11.031 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -0.617 -9.439 12.216 1.00 10.00 H new ATOM 0 HE21 GLN A 65 -2.623 -9.763 13.442 1.00 10.00 H new ATOM 0 HE22 GLN A 65 -3.293 -11.386 13.639 1.00 10.00 H new ATOM 996 N LYS A 66 -2.474 -6.802 8.472 1.00 10.00 N ATOM 997 CA LYS A 66 -2.893 -6.176 7.215 1.00 10.00 C ATOM 998 C LYS A 66 -1.753 -5.377 6.575 1.00 10.00 C ATOM 999 O LYS A 66 -1.702 -5.350 5.347 1.00 10.00 O ATOM 1000 CB LYS A 66 -4.139 -5.291 7.391 1.00 10.00 C ATOM 1001 CG LYS A 66 -5.367 -6.087 7.851 1.00 10.00 C ATOM 1002 CD LYS A 66 -6.592 -5.173 7.987 1.00 10.00 C ATOM 1003 CE LYS A 66 -7.792 -5.998 8.465 1.00 10.00 C ATOM 1004 NZ LYS A 66 -9.022 -5.180 8.600 1.00 10.00 N ATOM 0 H LYS A 66 -2.981 -6.477 9.295 1.00 10.00 H new ATOM 0 HA LYS A 66 -3.160 -6.990 6.541 1.00 10.00 H new ATOM 0 HB2 LYS A 66 -3.924 -4.508 8.119 1.00 10.00 H new ATOM 0 HB3 LYS A 66 -4.365 -4.795 6.447 1.00 10.00 H new ATOM 0 HG2 LYS A 66 -5.579 -6.882 7.136 1.00 10.00 H new ATOM 0 HG3 LYS A 66 -5.158 -6.566 8.807 1.00 10.00 H new ATOM 0 HD2 LYS A 66 -6.384 -4.370 8.694 1.00 10.00 H new ATOM 0 HD3 LYS A 66 -6.818 -4.704 7.029 1.00 10.00 H new ATOM 0 HE2 LYS A 66 -7.974 -6.810 7.762 1.00 10.00 H new ATOM 0 HE3 LYS A 66 -7.556 -6.455 9.426 1.00 10.00 H new ATOM 0 HZ1 LYS A 66 -9.805 -5.782 8.926 1.00 10.00 H new ATOM 0 HZ2 LYS A 66 -8.859 -4.420 9.291 1.00 10.00 H new ATOM 0 HZ3 LYS A 66 -9.265 -4.764 7.678 1.00 10.00 H new ATOM 1018 N GLN A 67 -0.846 -4.782 7.356 1.00 10.00 N ATOM 1019 CA GLN A 67 0.306 -4.078 6.800 1.00 10.00 C ATOM 1020 C GLN A 67 1.312 -5.104 6.277 1.00 10.00 C ATOM 1021 O GLN A 67 1.690 -5.078 5.109 1.00 10.00 O ATOM 1022 CB GLN A 67 0.987 -3.138 7.822 1.00 10.00 C ATOM 1023 CG GLN A 67 0.059 -2.201 8.613 1.00 10.00 C ATOM 1024 CD GLN A 67 -1.046 -1.562 7.772 1.00 10.00 C ATOM 1025 OE1 GLN A 67 -0.788 -0.762 6.881 1.00 10.00 O ATOM 1026 NE2 GLN A 67 -2.289 -1.953 7.998 1.00 10.00 N ATOM 0 H GLN A 67 -0.890 -4.776 8.375 1.00 10.00 H new ATOM 0 HA GLN A 67 -0.053 -3.445 5.988 1.00 10.00 H new ATOM 0 HB2 GLN A 67 1.541 -3.751 8.533 1.00 10.00 H new ATOM 0 HB3 GLN A 67 1.717 -2.527 7.291 1.00 10.00 H new ATOM 0 HG2 GLN A 67 -0.398 -2.763 9.428 1.00 10.00 H new ATOM 0 HG3 GLN A 67 0.658 -1.412 9.067 1.00 10.00 H new ATOM 0 HE21 GLN A 67 -2.486 -2.620 8.744 1.00 10.00 H new ATOM 0 HE22 GLN A 67 -3.051 -1.588 7.426 1.00 10.00 H new ATOM 1035 N GLY A 68 1.718 -6.037 7.139 1.00 10.00 N ATOM 1036 CA GLY A 68 2.809 -6.974 6.915 1.00 10.00 C ATOM 1037 C GLY A 68 3.733 -6.997 8.133 1.00 10.00 C ATOM 1038 O GLY A 68 4.949 -6.896 7.972 1.00 10.00 O ATOM 0 H GLY A 68 1.274 -6.162 8.049 1.00 10.00 H new ATOM 0 HA2 GLY A 68 2.411 -7.972 6.731 1.00 10.00 H new ATOM 0 HA3 GLY A 68 3.371 -6.686 6.027 1.00 10.00 H new ATOM 1042 N CYS A 69 3.180 -7.036 9.347 1.00 10.00 N ATOM 1043 CA CYS A 69 3.904 -7.003 10.611 1.00 10.00 C ATOM 1044 C CYS A 69 3.188 -7.902 11.630 1.00 10.00 C ATOM 1045 O CYS A 69 2.051 -8.308 11.400 1.00 10.00 O ATOM 1046 CB CYS A 69 3.949 -5.547 11.104 1.00 10.00 C ATOM 1047 SG CYS A 69 5.062 -4.537 10.084 1.00 10.00 S ATOM 0 H CYS A 69 2.170 -7.094 9.477 1.00 10.00 H new ATOM 0 HA CYS A 69 4.922 -7.372 10.484 1.00 10.00 H new ATOM 0 HB2 CYS A 69 2.946 -5.122 11.081 1.00 10.00 H new ATOM 0 HB3 CYS A 69 4.281 -5.523 12.142 1.00 10.00 H new ATOM 0 HG CYS A 69 5.400 -5.203 9.020 1.00 10.00 H new ATOM 1053 N ASP A 70 3.826 -8.157 12.770 1.00 10.00 N ATOM 1054 CA ASP A 70 3.322 -8.969 13.889 1.00 10.00 C ATOM 1055 C ASP A 70 3.722 -8.285 15.202 1.00 10.00 C ATOM 1056 O ASP A 70 4.587 -7.405 15.176 1.00 10.00 O ATOM 1057 CB ASP A 70 3.914 -10.387 13.810 1.00 10.00 C ATOM 1058 CG ASP A 70 3.459 -11.296 14.964 1.00 10.00 C ATOM 1059 OD1 ASP A 70 2.264 -11.201 15.332 1.00 10.00 O ATOM 1060 OD2 ASP A 70 4.311 -12.055 15.473 1.00 10.00 O ATOM 0 H ASP A 70 4.758 -7.786 12.954 1.00 10.00 H new ATOM 0 HA ASP A 70 2.236 -9.053 13.840 1.00 10.00 H new ATOM 0 HB2 ASP A 70 3.627 -10.842 12.862 1.00 10.00 H new ATOM 0 HB3 ASP A 70 5.002 -10.321 13.815 1.00 10.00 H new ATOM 1065 N CYS A 71 3.113 -8.632 16.342 1.00 10.00 N ATOM 1066 CA CYS A 71 3.232 -7.875 17.585 1.00 10.00 C ATOM 1067 C CYS A 71 3.376 -8.753 18.832 1.00 10.00 C ATOM 1068 O CYS A 71 2.798 -9.830 18.929 1.00 10.00 O ATOM 1069 CB CYS A 71 1.964 -7.030 17.767 1.00 10.00 C ATOM 1070 SG CYS A 71 1.874 -5.686 16.557 1.00 10.00 S ATOM 0 H CYS A 71 2.518 -9.456 16.424 1.00 10.00 H new ATOM 0 HA CYS A 71 4.137 -7.274 17.495 1.00 10.00 H new ATOM 0 HB2 CYS A 71 1.085 -7.667 17.669 1.00 10.00 H new ATOM 0 HB3 CYS A 71 1.945 -6.614 18.774 1.00 10.00 H new ATOM 0 HG CYS A 71 0.629 -5.419 16.297 1.00 10.00 H new ATOM 1076 N GLU A 72 3.961 -8.176 19.881 1.00 10.00 N ATOM 1077 CA GLU A 72 4.000 -8.709 21.238 1.00 10.00 C ATOM 1078 C GLU A 72 3.791 -7.526 22.188 1.00 10.00 C ATOM 1079 O GLU A 72 4.392 -6.464 22.010 1.00 10.00 O ATOM 1080 CB GLU A 72 5.307 -9.495 21.504 1.00 10.00 C ATOM 1081 CG GLU A 72 6.610 -8.668 21.490 1.00 10.00 C ATOM 1082 CD GLU A 72 7.910 -9.467 21.729 1.00 10.00 C ATOM 1083 OE1 GLU A 72 7.888 -10.717 21.729 1.00 10.00 O ATOM 1084 OE2 GLU A 72 8.949 -8.795 21.984 1.00 10.00 O ATOM 0 H GLU A 72 4.443 -7.281 19.801 1.00 10.00 H new ATOM 0 HA GLU A 72 3.209 -9.441 21.399 1.00 10.00 H new ATOM 0 HB2 GLU A 72 5.222 -9.985 22.474 1.00 10.00 H new ATOM 0 HB3 GLU A 72 5.392 -10.283 20.755 1.00 10.00 H new ATOM 0 HG2 GLU A 72 6.688 -8.162 20.528 1.00 10.00 H new ATOM 0 HG3 GLU A 72 6.536 -7.893 22.253 1.00 10.00 H new ATOM 1091 N CYS A 73 2.873 -7.637 23.145 1.00 10.00 N ATOM 1092 CA CYS A 73 2.720 -6.626 24.178 1.00 10.00 C ATOM 1093 C CYS A 73 3.941 -6.653 25.104 1.00 10.00 C ATOM 1094 O CYS A 73 4.455 -7.718 25.442 1.00 10.00 O ATOM 1095 CB CYS A 73 1.407 -6.857 24.938 1.00 10.00 C ATOM 1096 SG CYS A 73 1.189 -8.596 25.421 1.00 10.00 S ATOM 0 H CYS A 73 2.224 -8.420 23.223 1.00 10.00 H new ATOM 0 HA CYS A 73 2.667 -5.633 23.731 1.00 10.00 H new ATOM 0 HB2 CYS A 73 1.390 -6.229 25.829 1.00 10.00 H new ATOM 0 HB3 CYS A 73 0.569 -6.547 24.314 1.00 10.00 H new ATOM 0 HG CYS A 73 0.019 -8.751 25.967 1.00 10.00 H new ATOM 1102 N LEU A 74 4.366 -5.473 25.563 1.00 10.00 N ATOM 1103 CA LEU A 74 5.392 -5.331 26.601 1.00 10.00 C ATOM 1104 C LEU A 74 4.763 -4.932 27.941 1.00 10.00 C ATOM 1105 O LEU A 74 5.388 -5.086 28.983 1.00 10.00 O ATOM 1106 CB LEU A 74 6.462 -4.301 26.188 1.00 10.00 C ATOM 1107 CG LEU A 74 7.168 -4.568 24.841 1.00 10.00 C ATOM 1108 CD1 LEU A 74 8.350 -3.604 24.682 1.00 10.00 C ATOM 1109 CD2 LEU A 74 7.697 -5.999 24.697 1.00 10.00 C ATOM 0 H LEU A 74 4.005 -4.582 25.222 1.00 10.00 H new ATOM 0 HA LEU A 74 5.877 -6.300 26.720 1.00 10.00 H new ATOM 0 HB2 LEU A 74 5.994 -3.318 26.143 1.00 10.00 H new ATOM 0 HB3 LEU A 74 7.219 -4.258 26.971 1.00 10.00 H new ATOM 0 HG LEU A 74 6.414 -4.417 24.069 1.00 10.00 H new ATOM 0 HD11 LEU A 74 8.848 -3.793 23.731 1.00 10.00 H new ATOM 0 HD12 LEU A 74 7.987 -2.576 24.704 1.00 10.00 H new ATOM 0 HD13 LEU A 74 9.056 -3.757 25.498 1.00 10.00 H new ATOM 0 HD21 LEU A 74 8.180 -6.112 23.727 1.00 10.00 H new ATOM 0 HD22 LEU A 74 8.419 -6.201 25.488 1.00 10.00 H new ATOM 0 HD23 LEU A 74 6.868 -6.703 24.774 1.00 10.00 H new ATOM 1121 N GLY A 75 3.529 -4.419 27.925 1.00 10.00 N ATOM 1122 CA GLY A 75 2.779 -4.021 29.110 1.00 10.00 C ATOM 1123 C GLY A 75 1.702 -3.016 28.723 1.00 10.00 C ATOM 1124 O GLY A 75 1.502 -2.742 27.540 1.00 10.00 O ATOM 0 H GLY A 75 3.013 -4.266 27.059 1.00 10.00 H new ATOM 0 HA2 GLY A 75 2.324 -4.896 29.575 1.00 10.00 H new ATOM 0 HA3 GLY A 75 3.451 -3.582 29.847 1.00 10.00 H new ATOM 1128 N GLY A 76 0.994 -2.444 29.693 1.00 10.00 N ATOM 1129 CA GLY A 76 0.053 -1.357 29.439 1.00 10.00 C ATOM 1130 C GLY A 76 -0.235 -0.545 30.697 1.00 10.00 C ATOM 1131 O GLY A 76 0.351 -0.793 31.754 1.00 10.00 O ATOM 0 H GLY A 76 1.056 -2.719 30.673 1.00 10.00 H new ATOM 0 HA2 GLY A 76 0.457 -0.700 28.668 1.00 10.00 H new ATOM 0 HA3 GLY A 76 -0.879 -1.768 29.051 1.00 10.00 H new ATOM 1135 N GLY A 77 -1.167 0.394 30.585 1.00 10.00 N ATOM 1136 CA GLY A 77 -1.495 1.356 31.619 1.00 10.00 C ATOM 1137 C GLY A 77 -2.653 2.221 31.140 1.00 10.00 C ATOM 1138 O GLY A 77 -3.523 1.773 30.384 1.00 10.00 O ATOM 0 H GLY A 77 -1.731 0.507 29.743 1.00 10.00 H new ATOM 0 HA2 GLY A 77 -1.766 0.841 32.541 1.00 10.00 H new ATOM 0 HA3 GLY A 77 -0.628 1.978 31.844 1.00 10.00 H new ATOM 1142 N ARG A 78 -2.702 3.472 31.586 1.00 10.00 N ATOM 1143 CA ARG A 78 -3.718 4.449 31.207 1.00 10.00 C ATOM 1144 C ARG A 78 -3.034 5.760 30.861 1.00 10.00 C ATOM 1145 O ARG A 78 -1.958 6.050 31.379 1.00 10.00 O ATOM 1146 CB ARG A 78 -4.708 4.685 32.356 1.00 10.00 C ATOM 1147 CG ARG A 78 -5.529 3.443 32.730 1.00 10.00 C ATOM 1148 CD ARG A 78 -6.544 3.751 33.837 1.00 10.00 C ATOM 1149 NE ARG A 78 -5.882 4.181 35.084 1.00 10.00 N ATOM 1150 CZ ARG A 78 -6.133 3.720 36.318 1.00 10.00 C ATOM 1151 NH1 ARG A 78 -7.105 2.845 36.548 1.00 10.00 N ATOM 1152 NH2 ARG A 78 -5.398 4.115 37.347 1.00 10.00 N ATOM 0 H ARG A 78 -2.015 3.846 32.241 1.00 10.00 H new ATOM 0 HA ARG A 78 -4.270 4.066 30.348 1.00 10.00 H new ATOM 0 HB2 ARG A 78 -4.158 5.023 33.234 1.00 10.00 H new ATOM 0 HB3 ARG A 78 -5.389 5.489 32.077 1.00 10.00 H new ATOM 0 HG2 ARG A 78 -6.052 3.073 31.848 1.00 10.00 H new ATOM 0 HG3 ARG A 78 -4.859 2.649 33.060 1.00 10.00 H new ATOM 0 HD2 ARG A 78 -7.225 4.532 33.499 1.00 10.00 H new ATOM 0 HD3 ARG A 78 -7.148 2.865 34.033 1.00 10.00 H new ATOM 0 HE ARG A 78 -5.163 4.899 34.999 1.00 10.00 H new ATOM 0 HH11 ARG A 78 -7.681 2.508 35.777 1.00 10.00 H new ATOM 0 HH12 ARG A 78 -7.276 2.510 37.496 1.00 10.00 H new ATOM 0 HH21 ARG A 78 -4.634 4.775 37.204 1.00 10.00 H new ATOM 0 HH22 ARG A 78 -5.596 3.759 38.282 1.00 10.00 H new ATOM 1166 N ILE A 79 -3.677 6.566 30.030 1.00 10.00 N ATOM 1167 CA ILE A 79 -3.265 7.916 29.680 1.00 10.00 C ATOM 1168 C ILE A 79 -4.479 8.795 29.995 1.00 10.00 C ATOM 1169 O ILE A 79 -5.620 8.330 29.944 1.00 10.00 O ATOM 1170 CB ILE A 79 -2.810 7.983 28.197 1.00 10.00 C ATOM 1171 CG1 ILE A 79 -1.635 7.018 27.912 1.00 10.00 C ATOM 1172 CG2 ILE A 79 -2.416 9.415 27.775 1.00 10.00 C ATOM 1173 CD1 ILE A 79 -1.215 6.918 26.439 1.00 10.00 C ATOM 0 H ILE A 79 -4.538 6.284 29.561 1.00 10.00 H new ATOM 0 HA ILE A 79 -2.398 8.261 30.243 1.00 10.00 H new ATOM 0 HB ILE A 79 -3.670 7.673 27.604 1.00 10.00 H new ATOM 0 HG12 ILE A 79 -0.773 7.337 28.498 1.00 10.00 H new ATOM 0 HG13 ILE A 79 -1.909 6.023 28.264 1.00 10.00 H new ATOM 0 HG21 ILE A 79 -2.105 9.414 26.730 1.00 10.00 H new ATOM 0 HG22 ILE A 79 -3.272 10.079 27.898 1.00 10.00 H new ATOM 0 HG23 ILE A 79 -1.593 9.765 28.399 1.00 10.00 H new ATOM 0 HD11 ILE A 79 -0.385 6.218 26.344 1.00 10.00 H new ATOM 0 HD12 ILE A 79 -2.057 6.566 25.844 1.00 10.00 H new ATOM 0 HD13 ILE A 79 -0.904 7.900 26.082 1.00 10.00 H new ATOM 1185 N SER A 80 -4.247 10.061 30.318 1.00 10.00 N ATOM 1186 CA SER A 80 -5.266 11.019 30.709 1.00 10.00 C ATOM 1187 C SER A 80 -4.899 12.389 30.141 1.00 10.00 C ATOM 1188 O SER A 80 -3.721 12.682 29.923 1.00 10.00 O ATOM 1189 CB SER A 80 -5.335 11.088 32.244 1.00 10.00 C ATOM 1190 OG SER A 80 -5.420 9.809 32.843 1.00 10.00 O ATOM 0 H SER A 80 -3.309 10.461 30.314 1.00 10.00 H new ATOM 0 HA SER A 80 -6.238 10.713 30.322 1.00 10.00 H new ATOM 0 HB2 SER A 80 -4.452 11.604 32.621 1.00 10.00 H new ATOM 0 HB3 SER A 80 -6.200 11.681 32.539 1.00 10.00 H new ATOM 0 HG SER A 80 -5.460 9.906 33.817 1.00 10.00 H new ATOM 1196 N HIS A 81 -5.901 13.245 29.954 1.00 10.00 N ATOM 1197 CA HIS A 81 -5.753 14.646 29.587 1.00 10.00 C ATOM 1198 C HIS A 81 -7.046 15.342 29.996 1.00 10.00 C ATOM 1199 O HIS A 81 -8.116 14.735 29.912 1.00 10.00 O ATOM 1200 CB HIS A 81 -5.544 14.753 28.068 1.00 10.00 C ATOM 1201 CG HIS A 81 -5.448 16.157 27.517 1.00 10.00 C ATOM 1202 ND1 HIS A 81 -4.842 17.251 28.100 1.00 10.00 N ATOM 1203 CD2 HIS A 81 -5.902 16.563 26.289 1.00 10.00 C ATOM 1204 CE1 HIS A 81 -4.939 18.283 27.246 1.00 10.00 C ATOM 1205 NE2 HIS A 81 -5.566 17.908 26.122 1.00 10.00 N ATOM 0 H HIS A 81 -6.877 12.967 30.059 1.00 10.00 H new ATOM 0 HA HIS A 81 -4.896 15.105 30.080 1.00 10.00 H new ATOM 0 HB2 HIS A 81 -4.632 14.217 27.807 1.00 10.00 H new ATOM 0 HB3 HIS A 81 -6.368 14.242 27.570 1.00 10.00 H new ATOM 0 HD1 HIS A 81 -4.398 17.272 29.018 1.00 10.00 H new ATOM 0 HD2 HIS A 81 -6.429 15.949 25.574 1.00 10.00 H new ATOM 0 HE1 HIS A 81 -4.564 19.277 27.438 1.00 10.00 H new ATOM 1213 N GLN A 82 -6.962 16.591 30.448 1.00 10.00 N ATOM 1214 CA GLN A 82 -8.098 17.474 30.664 1.00 10.00 C ATOM 1215 C GLN A 82 -7.663 18.828 30.113 1.00 10.00 C ATOM 1216 O GLN A 82 -6.735 19.436 30.645 1.00 10.00 O ATOM 1217 CB GLN A 82 -8.472 17.576 32.157 1.00 10.00 C ATOM 1218 CG GLN A 82 -9.258 16.376 32.713 1.00 10.00 C ATOM 1219 CD GLN A 82 -8.382 15.277 33.319 1.00 10.00 C ATOM 1220 OE1 GLN A 82 -7.800 15.415 34.394 1.00 10.00 O ATOM 1221 NE2 GLN A 82 -8.270 14.136 32.659 1.00 10.00 N ATOM 0 H GLN A 82 -6.070 17.028 30.681 1.00 10.00 H new ATOM 0 HA GLN A 82 -8.992 17.097 30.167 1.00 10.00 H new ATOM 0 HB2 GLN A 82 -7.557 17.693 32.738 1.00 10.00 H new ATOM 0 HB3 GLN A 82 -9.063 18.480 32.307 1.00 10.00 H new ATOM 0 HG2 GLN A 82 -9.952 16.732 33.474 1.00 10.00 H new ATOM 0 HG3 GLN A 82 -9.858 15.946 31.911 1.00 10.00 H new ATOM 0 HE21 GLN A 82 -8.749 14.014 31.767 1.00 10.00 H new ATOM 0 HE22 GLN A 82 -7.704 13.379 33.042 1.00 10.00 H new ATOM 1230 N SER A 83 -8.324 19.290 29.053 1.00 10.00 N ATOM 1231 CA SER A 83 -7.940 20.428 28.214 1.00 10.00 C ATOM 1232 C SER A 83 -7.723 21.765 28.945 1.00 10.00 C ATOM 1233 O SER A 83 -7.165 22.682 28.354 1.00 10.00 O ATOM 1234 CB SER A 83 -9.014 20.596 27.127 1.00 10.00 C ATOM 1235 OG SER A 83 -9.420 19.334 26.617 1.00 10.00 O ATOM 0 H SER A 83 -9.192 18.857 28.737 1.00 10.00 H new ATOM 0 HA SER A 83 -6.958 20.187 27.806 1.00 10.00 H new ATOM 0 HB2 SER A 83 -9.876 21.120 27.540 1.00 10.00 H new ATOM 0 HB3 SER A 83 -8.624 21.212 26.317 1.00 10.00 H new ATOM 0 HG SER A 83 -10.105 19.464 25.928 1.00 10.00 H new ATOM 1241 N GLN A 84 -8.151 21.888 30.205 1.00 10.00 N ATOM 1242 CA GLN A 84 -8.064 23.112 30.999 1.00 10.00 C ATOM 1243 C GLN A 84 -7.471 22.835 32.396 1.00 10.00 C ATOM 1244 O GLN A 84 -7.484 23.728 33.238 1.00 10.00 O ATOM 1245 CB GLN A 84 -9.476 23.744 31.011 1.00 10.00 C ATOM 1246 CG GLN A 84 -9.643 25.127 31.670 1.00 10.00 C ATOM 1247 CD GLN A 84 -8.630 26.166 31.188 1.00 10.00 C ATOM 1248 OE1 GLN A 84 -8.865 26.895 30.233 1.00 10.00 O ATOM 1249 NE2 GLN A 84 -7.481 26.241 31.843 1.00 10.00 N ATOM 0 H GLN A 84 -8.580 21.115 30.713 1.00 10.00 H new ATOM 0 HA GLN A 84 -7.370 23.830 30.562 1.00 10.00 H new ATOM 0 HB2 GLN A 84 -9.816 23.823 29.978 1.00 10.00 H new ATOM 0 HB3 GLN A 84 -10.148 23.050 31.516 1.00 10.00 H new ATOM 0 HG2 GLN A 84 -10.650 25.495 31.471 1.00 10.00 H new ATOM 0 HG3 GLN A 84 -9.551 25.018 32.751 1.00 10.00 H new ATOM 0 HE21 GLN A 84 -7.305 25.624 32.636 1.00 10.00 H new ATOM 0 HE22 GLN A 84 -6.772 26.915 31.554 1.00 10.00 H new ATOM 1258 N ASP A 85 -6.943 21.627 32.651 1.00 10.00 N ATOM 1259 CA ASP A 85 -6.490 21.222 33.997 1.00 10.00 C ATOM 1260 C ASP A 85 -5.254 20.314 34.001 1.00 10.00 C ATOM 1261 O ASP A 85 -4.427 20.413 34.904 1.00 10.00 O ATOM 1262 CB ASP A 85 -7.631 20.506 34.735 1.00 10.00 C ATOM 1263 CG ASP A 85 -7.185 19.959 36.105 1.00 10.00 C ATOM 1264 OD1 ASP A 85 -7.180 20.739 37.079 1.00 10.00 O ATOM 1265 OD2 ASP A 85 -6.897 18.733 36.169 1.00 10.00 O ATOM 0 H ASP A 85 -6.818 20.907 31.939 1.00 10.00 H new ATOM 0 HA ASP A 85 -6.203 22.145 34.501 1.00 10.00 H new ATOM 0 HB2 ASP A 85 -8.462 21.198 34.875 1.00 10.00 H new ATOM 0 HB3 ASP A 85 -8.000 19.685 34.120 1.00 10.00 H new ATOM 1270 N LYS A 86 -5.064 19.443 33.000 1.00 10.00 N ATOM 1271 CA LYS A 86 -4.052 18.392 33.081 1.00 10.00 C ATOM 1272 C LYS A 86 -3.477 18.106 31.703 1.00 10.00 C ATOM 1273 O LYS A 86 -4.209 17.765 30.768 1.00 10.00 O ATOM 1274 CB LYS A 86 -4.696 17.147 33.717 1.00 10.00 C ATOM 1275 CG LYS A 86 -3.665 16.186 34.325 1.00 10.00 C ATOM 1276 CD LYS A 86 -4.310 15.035 35.118 1.00 10.00 C ATOM 1277 CE LYS A 86 -4.837 15.413 36.519 1.00 10.00 C ATOM 1278 NZ LYS A 86 -6.157 16.097 36.528 1.00 10.00 N ATOM 0 H LYS A 86 -5.597 19.449 32.131 1.00 10.00 H new ATOM 0 HA LYS A 86 -3.217 18.708 33.706 1.00 10.00 H new ATOM 0 HB2 LYS A 86 -5.394 17.461 34.493 1.00 10.00 H new ATOM 0 HB3 LYS A 86 -5.277 16.618 32.961 1.00 10.00 H new ATOM 0 HG2 LYS A 86 -3.050 15.770 33.527 1.00 10.00 H new ATOM 0 HG3 LYS A 86 -2.999 16.745 34.983 1.00 10.00 H new ATOM 0 HD2 LYS A 86 -5.137 14.632 34.533 1.00 10.00 H new ATOM 0 HD3 LYS A 86 -3.577 14.236 35.227 1.00 10.00 H new ATOM 0 HE2 LYS A 86 -4.910 14.507 37.120 1.00 10.00 H new ATOM 0 HE3 LYS A 86 -4.106 16.060 37.004 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 -6.660 15.870 37.410 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 -6.016 17.125 36.465 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 -6.721 15.775 35.716 1.00 10.00 H new ATOM 1292 N LYS A 87 -2.149 18.207 31.586 1.00 10.00 N ATOM 1293 CA LYS A 87 -1.395 17.806 30.399 1.00 10.00 C ATOM 1294 C LYS A 87 -1.573 16.315 30.106 1.00 10.00 C ATOM 1295 O LYS A 87 -2.158 15.590 30.907 1.00 10.00 O ATOM 1296 CB LYS A 87 0.091 18.206 30.577 1.00 10.00 C ATOM 1297 CG LYS A 87 0.412 19.463 29.761 1.00 10.00 C ATOM 1298 CD LYS A 87 0.642 19.048 28.300 1.00 10.00 C ATOM 1299 CE LYS A 87 0.852 20.210 27.317 1.00 10.00 C ATOM 1300 NZ LYS A 87 1.666 21.330 27.846 1.00 10.00 N ATOM 0 H LYS A 87 -1.558 18.578 32.330 1.00 10.00 H new ATOM 0 HA LYS A 87 -1.784 18.331 29.526 1.00 10.00 H new ATOM 0 HB2 LYS A 87 0.301 18.387 31.631 1.00 10.00 H new ATOM 0 HB3 LYS A 87 0.735 17.386 30.260 1.00 10.00 H new ATOM 0 HG2 LYS A 87 -0.408 20.178 29.827 1.00 10.00 H new ATOM 0 HG3 LYS A 87 1.298 19.957 30.159 1.00 10.00 H new ATOM 0 HD2 LYS A 87 1.513 18.395 28.257 1.00 10.00 H new ATOM 0 HD3 LYS A 87 -0.214 18.461 27.967 1.00 10.00 H new ATOM 0 HE2 LYS A 87 1.331 19.824 26.417 1.00 10.00 H new ATOM 0 HE3 LYS A 87 -0.123 20.596 27.019 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 2.215 21.756 27.072 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 1.039 22.048 28.262 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 2.315 20.973 28.576 1.00 10.00 H new ATOM 1314 N ILE A 88 -1.059 15.868 28.956 1.00 10.00 N ATOM 1315 CA ILE A 88 -1.000 14.448 28.636 1.00 10.00 C ATOM 1316 C ILE A 88 -0.216 13.785 29.771 1.00 10.00 C ATOM 1317 O ILE A 88 0.904 14.206 30.079 1.00 10.00 O ATOM 1318 CB ILE A 88 -0.366 14.182 27.247 1.00 10.00 C ATOM 1319 CG1 ILE A 88 -0.864 15.114 26.117 1.00 10.00 C ATOM 1320 CG2 ILE A 88 -0.623 12.715 26.860 1.00 10.00 C ATOM 1321 CD1 ILE A 88 -2.383 15.121 25.908 1.00 10.00 C ATOM 0 H ILE A 88 -0.678 16.476 28.232 1.00 10.00 H new ATOM 0 HA ILE A 88 -2.003 14.027 28.562 1.00 10.00 H new ATOM 0 HB ILE A 88 0.698 14.394 27.349 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -0.537 16.131 26.334 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -0.385 14.818 25.184 1.00 10.00 H new ATOM 0 HG21 ILE A 88 -0.182 12.514 25.884 1.00 10.00 H new ATOM 0 HG22 ILE A 88 -0.173 12.058 27.604 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -1.697 12.533 26.818 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -2.635 15.803 25.096 1.00 10.00 H new ATOM 0 HD12 ILE A 88 -2.720 14.116 25.656 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -2.875 15.449 26.824 1.00 10.00 H new ATOM 1333 N HIS A 89 -0.814 12.797 30.421 1.00 10.00 N ATOM 1334 CA HIS A 89 -0.324 12.225 31.661 1.00 10.00 C ATOM 1335 C HIS A 89 -0.547 10.719 31.612 1.00 10.00 C ATOM 1336 O HIS A 89 -1.498 10.287 30.970 1.00 10.00 O ATOM 1337 CB HIS A 89 -1.081 12.888 32.817 1.00 10.00 C ATOM 1338 CG HIS A 89 -0.609 12.435 34.171 1.00 10.00 C ATOM 1339 ND1 HIS A 89 0.462 12.955 34.852 1.00 10.00 N ATOM 1340 CD2 HIS A 89 -1.131 11.429 34.939 1.00 10.00 C ATOM 1341 CE1 HIS A 89 0.589 12.283 36.007 1.00 10.00 C ATOM 1342 NE2 HIS A 89 -0.371 11.350 36.109 1.00 10.00 N ATOM 0 H HIS A 89 -1.675 12.362 30.090 1.00 10.00 H new ATOM 0 HA HIS A 89 0.742 12.401 31.806 1.00 10.00 H new ATOM 0 HB2 HIS A 89 -0.969 13.970 32.743 1.00 10.00 H new ATOM 0 HB3 HIS A 89 -2.145 12.670 32.719 1.00 10.00 H new ATOM 0 HD2 HIS A 89 -1.978 10.808 34.686 1.00 10.00 H new ATOM 0 HE1 HIS A 89 1.353 12.466 36.748 1.00 10.00 H new ATOM 0 HE2 HIS A 89 -0.517 10.709 36.889 1.00 10.00 H new ATOM 1350 N VAL A 90 0.291 9.916 32.262 1.00 10.00 N ATOM 1351 CA VAL A 90 0.281 8.455 32.137 1.00 10.00 C ATOM 1352 C VAL A 90 0.397 7.846 33.542 1.00 10.00 C ATOM 1353 O VAL A 90 1.153 8.352 34.370 1.00 10.00 O ATOM 1354 CB VAL A 90 1.425 8.004 31.191 1.00 10.00 C ATOM 1355 CG1 VAL A 90 1.322 6.518 30.828 1.00 10.00 C ATOM 1356 CG2 VAL A 90 1.481 8.814 29.879 1.00 10.00 C ATOM 0 H VAL A 90 1.007 10.263 32.900 1.00 10.00 H new ATOM 0 HA VAL A 90 -0.651 8.104 31.693 1.00 10.00 H new ATOM 0 HB VAL A 90 2.338 8.186 31.758 1.00 10.00 H new ATOM 0 HG11 VAL A 90 2.143 6.248 30.164 1.00 10.00 H new ATOM 0 HG12 VAL A 90 1.376 5.917 31.736 1.00 10.00 H new ATOM 0 HG13 VAL A 90 0.373 6.331 30.325 1.00 10.00 H new ATOM 0 HG21 VAL A 90 2.302 8.450 29.261 1.00 10.00 H new ATOM 0 HG22 VAL A 90 0.541 8.697 29.339 1.00 10.00 H new ATOM 0 HG23 VAL A 90 1.639 9.868 30.108 1.00 10.00 H new ATOM 1366 N TYR A 91 -0.344 6.778 33.831 1.00 10.00 N ATOM 1367 CA TYR A 91 -0.369 6.115 35.138 1.00 10.00 C ATOM 1368 C TYR A 91 -1.029 4.736 35.006 1.00 10.00 C ATOM 1369 O TYR A 91 -1.445 4.351 33.909 1.00 10.00 O ATOM 1370 CB TYR A 91 -1.088 6.990 36.195 1.00 10.00 C ATOM 1371 CG TYR A 91 -2.615 7.057 36.172 1.00 10.00 C ATOM 1372 CD1 TYR A 91 -3.339 7.227 34.971 1.00 10.00 C ATOM 1373 CD2 TYR A 91 -3.318 7.010 37.393 1.00 10.00 C ATOM 1374 CE1 TYR A 91 -4.741 7.337 34.997 1.00 10.00 C ATOM 1375 CE2 TYR A 91 -4.716 7.146 37.429 1.00 10.00 C ATOM 1376 CZ TYR A 91 -5.436 7.307 36.226 1.00 10.00 C ATOM 1377 OH TYR A 91 -6.792 7.417 36.235 1.00 10.00 O ATOM 0 H TYR A 91 -0.960 6.337 33.148 1.00 10.00 H new ATOM 0 HA TYR A 91 0.656 5.977 35.483 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -0.787 6.634 37.180 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -0.710 8.008 36.095 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -2.814 7.273 34.029 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -2.774 6.867 38.315 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -5.289 7.445 34.072 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -5.238 7.127 38.374 1.00 10.00 H new ATOM 0 HH TYR A 91 -7.117 7.377 37.159 1.00 10.00 H new ATOM 1387 N GLY A 92 -1.213 4.019 36.115 1.00 10.00 N ATOM 1388 CA GLY A 92 -1.920 2.749 36.128 1.00 10.00 C ATOM 1389 C GLY A 92 -1.013 1.590 35.729 1.00 10.00 C ATOM 1390 O GLY A 92 0.205 1.727 35.646 1.00 10.00 O ATOM 0 H GLY A 92 -0.872 4.309 37.032 1.00 10.00 H new ATOM 0 HA2 GLY A 92 -2.323 2.568 37.124 1.00 10.00 H new ATOM 0 HA3 GLY A 92 -2.768 2.798 35.445 1.00 10.00 H new ATOM 1394 N TYR A 93 -1.628 0.440 35.462 1.00 10.00 N ATOM 1395 CA TYR A 93 -1.002 -0.730 34.862 1.00 10.00 C ATOM 1396 C TYR A 93 -2.097 -1.490 34.115 1.00 10.00 C ATOM 1397 O TYR A 93 -3.281 -1.293 34.393 1.00 10.00 O ATOM 1398 CB TYR A 93 -0.307 -1.597 35.927 1.00 10.00 C ATOM 1399 CG TYR A 93 -1.079 -1.884 37.208 1.00 10.00 C ATOM 1400 CD1 TYR A 93 -2.182 -2.760 37.197 1.00 10.00 C ATOM 1401 CD2 TYR A 93 -0.661 -1.313 38.428 1.00 10.00 C ATOM 1402 CE1 TYR A 93 -2.871 -3.057 38.386 1.00 10.00 C ATOM 1403 CE2 TYR A 93 -1.339 -1.614 39.624 1.00 10.00 C ATOM 1404 CZ TYR A 93 -2.453 -2.486 39.608 1.00 10.00 C ATOM 1405 OH TYR A 93 -3.112 -2.795 40.757 1.00 10.00 O ATOM 0 H TYR A 93 -2.617 0.295 35.667 1.00 10.00 H new ATOM 0 HA TYR A 93 -0.215 -0.439 34.166 1.00 10.00 H new ATOM 0 HB2 TYR A 93 -0.048 -2.551 35.468 1.00 10.00 H new ATOM 0 HB3 TYR A 93 0.629 -1.110 36.200 1.00 10.00 H new ATOM 0 HD1 TYR A 93 -2.501 -3.207 36.267 1.00 10.00 H new ATOM 0 HD2 TYR A 93 0.184 -0.641 38.445 1.00 10.00 H new ATOM 0 HE1 TYR A 93 -3.721 -3.723 38.365 1.00 10.00 H new ATOM 0 HE2 TYR A 93 -1.008 -1.179 40.555 1.00 10.00 H new ATOM 0 HH TYR A 93 -2.699 -2.320 41.509 1.00 10.00 H new ATOM 1415 N SER A 94 -1.736 -2.327 33.136 1.00 10.00 N ATOM 1416 CA SER A 94 -2.725 -3.121 32.411 1.00 10.00 C ATOM 1417 C SER A 94 -3.325 -4.193 33.320 1.00 10.00 C ATOM 1418 O SER A 94 -2.699 -4.623 34.285 1.00 10.00 O ATOM 1419 CB SER A 94 -2.130 -3.740 31.145 1.00 10.00 C ATOM 1420 OG SER A 94 -0.995 -4.535 31.390 1.00 10.00 O ATOM 0 H SER A 94 -0.773 -2.469 32.832 1.00 10.00 H new ATOM 0 HA SER A 94 -3.526 -2.452 32.098 1.00 10.00 H new ATOM 0 HB2 SER A 94 -2.891 -4.348 30.655 1.00 10.00 H new ATOM 0 HB3 SER A 94 -1.863 -2.943 30.451 1.00 10.00 H new ATOM 0 HG SER A 94 -0.217 -3.958 31.536 1.00 10.00 H new ATOM 1426 N MET A 95 -4.511 -4.688 32.958 1.00 10.00 N ATOM 1427 CA MET A 95 -5.255 -5.632 33.786 1.00 10.00 C ATOM 1428 C MET A 95 -4.783 -7.085 33.594 1.00 10.00 C ATOM 1429 O MET A 95 -5.415 -7.987 34.133 1.00 10.00 O ATOM 1430 CB MET A 95 -6.762 -5.459 33.517 1.00 10.00 C ATOM 1431 CG MET A 95 -7.239 -4.042 33.884 1.00 10.00 C ATOM 1432 SD MET A 95 -9.012 -3.725 33.642 1.00 10.00 S ATOM 1433 CE MET A 95 -9.697 -4.643 35.052 1.00 10.00 C ATOM 0 H MET A 95 -4.979 -4.445 32.085 1.00 10.00 H new ATOM 0 HA MET A 95 -5.059 -5.409 34.835 1.00 10.00 H new ATOM 0 HB2 MET A 95 -6.970 -5.653 32.465 1.00 10.00 H new ATOM 0 HB3 MET A 95 -7.323 -6.194 34.094 1.00 10.00 H new ATOM 0 HG2 MET A 95 -6.994 -3.855 34.929 1.00 10.00 H new ATOM 0 HG3 MET A 95 -6.675 -3.323 33.290 1.00 10.00 H new ATOM 0 HE1 MET A 95 -10.782 -4.537 35.063 1.00 10.00 H new ATOM 0 HE2 MET A 95 -9.436 -5.697 34.961 1.00 10.00 H new ATOM 0 HE3 MET A 95 -9.285 -4.246 35.980 1.00 10.00 H new ATOM 1443 N ALA A 96 -3.713 -7.336 32.819 1.00 10.00 N ATOM 1444 CA ALA A 96 -3.161 -8.681 32.651 1.00 10.00 C ATOM 1445 C ALA A 96 -1.661 -8.692 32.337 1.00 10.00 C ATOM 1446 O ALA A 96 -0.948 -9.517 32.893 1.00 10.00 O ATOM 1447 CB ALA A 96 -3.914 -9.410 31.527 1.00 10.00 C ATOM 0 H ALA A 96 -3.214 -6.615 32.298 1.00 10.00 H new ATOM 0 HA ALA A 96 -3.291 -9.190 33.606 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -3.502 -10.411 31.403 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -4.971 -9.482 31.784 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -3.804 -8.855 30.596 1.00 10.00 H new ATOM 1453 N TYR A 97 -1.177 -7.837 31.423 1.00 10.00 N ATOM 1454 CA TYR A 97 0.197 -7.963 30.922 1.00 10.00 C ATOM 1455 C TYR A 97 1.211 -7.495 31.974 1.00 10.00 C ATOM 1456 O TYR A 97 2.194 -8.179 32.239 1.00 10.00 O ATOM 1457 CB TYR A 97 0.365 -7.189 29.599 1.00 10.00 C ATOM 1458 CG TYR A 97 -0.596 -7.527 28.464 1.00 10.00 C ATOM 1459 CD1 TYR A 97 -1.203 -8.797 28.359 1.00 10.00 C ATOM 1460 CD2 TYR A 97 -0.855 -6.557 27.475 1.00 10.00 C ATOM 1461 CE1 TYR A 97 -2.070 -9.088 27.291 1.00 10.00 C ATOM 1462 CE2 TYR A 97 -1.703 -6.850 26.391 1.00 10.00 C ATOM 1463 CZ TYR A 97 -2.320 -8.117 26.297 1.00 10.00 C ATOM 1464 OH TYR A 97 -3.159 -8.388 25.263 1.00 10.00 O ATOM 0 H TYR A 97 -1.708 -7.064 31.022 1.00 10.00 H new ATOM 0 HA TYR A 97 0.393 -9.017 30.723 1.00 10.00 H new ATOM 0 HB2 TYR A 97 0.270 -6.125 29.816 1.00 10.00 H new ATOM 0 HB3 TYR A 97 1.381 -7.351 29.240 1.00 10.00 H new ATOM 0 HD1 TYR A 97 -1.000 -9.551 29.105 1.00 10.00 H new ATOM 0 HD2 TYR A 97 -0.399 -5.581 27.550 1.00 10.00 H new ATOM 0 HE1 TYR A 97 -2.545 -10.056 27.231 1.00 10.00 H new ATOM 0 HE2 TYR A 97 -1.882 -6.105 25.630 1.00 10.00 H new ATOM 0 HH TYR A 97 -2.658 -8.366 24.421 1.00 10.00 H new ATOM 1474 N GLY A 98 0.956 -6.331 32.574 1.00 10.00 N ATOM 1475 CA GLY A 98 1.770 -5.713 33.613 1.00 10.00 C ATOM 1476 C GLY A 98 1.879 -4.206 33.378 1.00 10.00 C ATOM 1477 O GLY A 98 1.339 -3.709 32.378 1.00 10.00 O ATOM 0 H GLY A 98 0.138 -5.771 32.335 1.00 10.00 H new ATOM 0 HA2 GLY A 98 1.329 -5.904 34.591 1.00 10.00 H new ATOM 0 HA3 GLY A 98 2.764 -6.160 33.619 1.00 10.00 H new ATOM 1481 N PRO A 99 2.521 -3.452 34.284 1.00 10.00 N ATOM 1482 CA PRO A 99 2.867 -2.059 34.041 1.00 10.00 C ATOM 1483 C PRO A 99 3.667 -1.935 32.746 1.00 10.00 C ATOM 1484 O PRO A 99 4.639 -2.662 32.552 1.00 10.00 O ATOM 1485 CB PRO A 99 3.705 -1.612 35.245 1.00 10.00 C ATOM 1486 CG PRO A 99 3.388 -2.636 36.334 1.00 10.00 C ATOM 1487 CD PRO A 99 3.060 -3.907 35.554 1.00 10.00 C ATOM 0 HA PRO A 99 1.979 -1.436 33.930 1.00 10.00 H new ATOM 0 HB2 PRO A 99 4.769 -1.603 35.007 1.00 10.00 H new ATOM 0 HB3 PRO A 99 3.440 -0.603 35.560 1.00 10.00 H new ATOM 0 HG2 PRO A 99 4.236 -2.785 37.003 1.00 10.00 H new ATOM 0 HG3 PRO A 99 2.548 -2.317 36.951 1.00 10.00 H new ATOM 0 HD2 PRO A 99 3.950 -4.518 35.407 1.00 10.00 H new ATOM 0 HD3 PRO A 99 2.337 -4.521 36.090 1.00 10.00 H new ATOM 1495 N ALA A 100 3.268 -1.023 31.858 1.00 10.00 N ATOM 1496 CA ALA A 100 4.106 -0.640 30.736 1.00 10.00 C ATOM 1497 C ALA A 100 5.379 0.021 31.261 1.00 10.00 C ATOM 1498 O ALA A 100 5.430 0.533 32.381 1.00 10.00 O ATOM 1499 CB ALA A 100 3.345 0.314 29.814 1.00 10.00 C ATOM 0 H ALA A 100 2.370 -0.540 31.899 1.00 10.00 H new ATOM 0 HA ALA A 100 4.376 -1.526 30.162 1.00 10.00 H new ATOM 0 HB1 ALA A 100 3.982 0.595 28.976 1.00 10.00 H new ATOM 0 HB2 ALA A 100 2.449 -0.180 29.439 1.00 10.00 H new ATOM 0 HB3 ALA A 100 3.061 1.208 30.370 1.00 10.00 H new ATOM 1505 N GLN A 101 6.395 0.104 30.403 1.00 10.00 N ATOM 1506 CA GLN A 101 7.592 0.892 30.654 1.00 10.00 C ATOM 1507 C GLN A 101 7.240 2.353 30.356 1.00 10.00 C ATOM 1508 O GLN A 101 7.664 2.901 29.338 1.00 10.00 O ATOM 1509 CB GLN A 101 8.769 0.349 29.825 1.00 10.00 C ATOM 1510 CG GLN A 101 9.157 -1.072 30.268 1.00 10.00 C ATOM 1511 CD GLN A 101 10.350 -1.605 29.479 1.00 10.00 C ATOM 1512 OE1 GLN A 101 10.196 -2.209 28.429 1.00 10.00 O ATOM 1513 NE2 GLN A 101 11.568 -1.365 29.945 1.00 10.00 N ATOM 0 H GLN A 101 6.406 -0.381 29.506 1.00 10.00 H new ATOM 0 HA GLN A 101 7.921 0.824 31.691 1.00 10.00 H new ATOM 0 HB2 GLN A 101 8.500 0.342 28.769 1.00 10.00 H new ATOM 0 HB3 GLN A 101 9.628 1.012 29.931 1.00 10.00 H new ATOM 0 HG2 GLN A 101 9.397 -1.069 31.331 1.00 10.00 H new ATOM 0 HG3 GLN A 101 8.306 -1.740 30.135 1.00 10.00 H new ATOM 0 HE21 GLN A 101 11.688 -0.860 30.823 1.00 10.00 H new ATOM 0 HE22 GLN A 101 12.385 -1.686 29.426 1.00 10.00 H new ATOM 1522 N HIS A 102 6.403 2.950 31.214 1.00 10.00 N ATOM 1523 CA HIS A 102 5.761 4.244 30.998 1.00 10.00 C ATOM 1524 C HIS A 102 6.739 5.338 30.572 1.00 10.00 C ATOM 1525 O HIS A 102 6.379 6.137 29.717 1.00 10.00 O ATOM 1526 CB HIS A 102 5.009 4.681 32.264 1.00 10.00 C ATOM 1527 CG HIS A 102 3.915 3.731 32.682 1.00 10.00 C ATOM 1528 ND1 HIS A 102 3.887 2.945 33.809 1.00 10.00 N ATOM 1529 CD2 HIS A 102 2.754 3.486 32.004 1.00 10.00 C ATOM 1530 CE1 HIS A 102 2.739 2.246 33.798 1.00 10.00 C ATOM 1531 NE2 HIS A 102 2.013 2.530 32.701 1.00 10.00 N ATOM 0 H HIS A 102 6.148 2.527 32.107 1.00 10.00 H new ATOM 0 HA HIS A 102 5.060 4.108 30.174 1.00 10.00 H new ATOM 0 HB2 HIS A 102 5.722 4.781 33.082 1.00 10.00 H new ATOM 0 HB3 HIS A 102 4.576 5.667 32.096 1.00 10.00 H new ATOM 0 HD1 HIS A 102 4.610 2.900 34.527 1.00 10.00 H new ATOM 0 HD2 HIS A 102 2.458 3.956 31.078 1.00 10.00 H new ATOM 0 HE1 HIS A 102 2.439 1.549 34.567 1.00 10.00 H new ATOM 1539 N ALA A 103 7.971 5.349 31.095 1.00 10.00 N ATOM 1540 CA ALA A 103 8.962 6.361 30.734 1.00 10.00 C ATOM 1541 C ALA A 103 9.324 6.324 29.238 1.00 10.00 C ATOM 1542 O ALA A 103 9.605 7.365 28.648 1.00 10.00 O ATOM 1543 CB ALA A 103 10.208 6.203 31.610 1.00 10.00 C ATOM 0 H ALA A 103 8.303 4.663 31.773 1.00 10.00 H new ATOM 0 HA ALA A 103 8.519 7.340 30.916 1.00 10.00 H new ATOM 0 HB1 ALA A 103 10.943 6.960 31.337 1.00 10.00 H new ATOM 0 HB2 ALA A 103 9.934 6.325 32.658 1.00 10.00 H new ATOM 0 HB3 ALA A 103 10.635 5.211 31.460 1.00 10.00 H new ATOM 1549 N ILE A 104 9.309 5.135 28.618 1.00 10.00 N ATOM 1550 CA ILE A 104 9.547 4.996 27.182 1.00 10.00 C ATOM 1551 C ILE A 104 8.344 5.604 26.457 1.00 10.00 C ATOM 1552 O ILE A 104 8.503 6.427 25.558 1.00 10.00 O ATOM 1553 CB ILE A 104 9.779 3.510 26.794 1.00 10.00 C ATOM 1554 CG1 ILE A 104 10.963 2.911 27.591 1.00 10.00 C ATOM 1555 CG2 ILE A 104 10.011 3.379 25.275 1.00 10.00 C ATOM 1556 CD1 ILE A 104 11.289 1.450 27.257 1.00 10.00 C ATOM 0 H ILE A 104 9.133 4.252 29.097 1.00 10.00 H new ATOM 0 HA ILE A 104 10.455 5.523 26.888 1.00 10.00 H new ATOM 0 HB ILE A 104 8.884 2.944 27.051 1.00 10.00 H new ATOM 0 HG12 ILE A 104 11.850 3.518 27.408 1.00 10.00 H new ATOM 0 HG13 ILE A 104 10.741 2.985 28.656 1.00 10.00 H new ATOM 0 HG21 ILE A 104 10.172 2.331 25.021 1.00 10.00 H new ATOM 0 HG22 ILE A 104 9.138 3.752 24.740 1.00 10.00 H new ATOM 0 HG23 ILE A 104 10.888 3.960 24.989 1.00 10.00 H new ATOM 0 HD11 ILE A 104 12.131 1.117 27.864 1.00 10.00 H new ATOM 0 HD12 ILE A 104 10.421 0.826 27.468 1.00 10.00 H new ATOM 0 HD13 ILE A 104 11.547 1.367 26.201 1.00 10.00 H new ATOM 1568 N SER A 105 7.130 5.196 26.845 1.00 10.00 N ATOM 1569 CA SER A 105 5.911 5.713 26.249 1.00 10.00 C ATOM 1570 C SER A 105 5.835 7.238 26.359 1.00 10.00 C ATOM 1571 O SER A 105 5.459 7.872 25.378 1.00 10.00 O ATOM 1572 CB SER A 105 4.691 5.051 26.894 1.00 10.00 C ATOM 1573 OG SER A 105 4.882 3.644 26.998 1.00 10.00 O ATOM 0 H SER A 105 6.974 4.503 27.577 1.00 10.00 H new ATOM 0 HA SER A 105 5.919 5.469 25.187 1.00 10.00 H new ATOM 0 HB2 SER A 105 4.521 5.475 27.884 1.00 10.00 H new ATOM 0 HB3 SER A 105 3.801 5.260 26.301 1.00 10.00 H new ATOM 0 HG SER A 105 4.223 3.269 27.619 1.00 10.00 H new ATOM 1579 N THR A 106 6.204 7.833 27.496 1.00 10.00 N ATOM 1580 CA THR A 106 6.132 9.272 27.639 1.00 10.00 C ATOM 1581 C THR A 106 7.086 9.969 26.677 1.00 10.00 C ATOM 1582 O THR A 106 6.665 10.929 26.042 1.00 10.00 O ATOM 1583 CB THR A 106 6.347 9.711 29.094 1.00 10.00 C ATOM 1584 OG1 THR A 106 7.434 9.081 29.728 1.00 10.00 O ATOM 1585 CG2 THR A 106 5.101 9.438 29.933 1.00 10.00 C ATOM 0 H THR A 106 6.551 7.339 28.318 1.00 10.00 H new ATOM 0 HA THR A 106 5.122 9.582 27.370 1.00 10.00 H new ATOM 0 HB THR A 106 6.562 10.778 29.033 1.00 10.00 H new ATOM 0 HG1 THR A 106 8.020 8.680 29.052 1.00 10.00 H new ATOM 0 HG21 THR A 106 5.277 9.757 30.960 1.00 10.00 H new ATOM 0 HG22 THR A 106 4.257 9.991 29.521 1.00 10.00 H new ATOM 0 HG23 THR A 106 4.879 8.371 29.918 1.00 10.00 H new ATOM 1593 N GLU A 107 8.328 9.506 26.509 1.00 10.00 N ATOM 1594 CA GLU A 107 9.251 10.153 25.573 1.00 10.00 C ATOM 1595 C GLU A 107 8.709 10.091 24.140 1.00 10.00 C ATOM 1596 O GLU A 107 8.793 11.066 23.392 1.00 10.00 O ATOM 1597 CB GLU A 107 10.628 9.481 25.634 1.00 10.00 C ATOM 1598 CG GLU A 107 11.419 9.806 26.912 1.00 10.00 C ATOM 1599 CD GLU A 107 12.001 11.232 26.904 1.00 10.00 C ATOM 1600 OE1 GLU A 107 11.264 12.170 27.314 1.00 10.00 O ATOM 1601 OE2 GLU A 107 13.170 11.401 26.502 1.00 10.00 O ATOM 0 H GLU A 107 8.713 8.699 27.000 1.00 10.00 H new ATOM 0 HA GLU A 107 9.348 11.199 25.864 1.00 10.00 H new ATOM 0 HB2 GLU A 107 10.499 8.401 25.562 1.00 10.00 H new ATOM 0 HB3 GLU A 107 11.212 9.790 24.767 1.00 10.00 H new ATOM 0 HG2 GLU A 107 10.767 9.689 27.778 1.00 10.00 H new ATOM 0 HG3 GLU A 107 12.231 9.087 27.025 1.00 10.00 H new ATOM 1608 N LYS A 108 8.096 8.959 23.778 1.00 10.00 N ATOM 1609 CA LYS A 108 7.472 8.787 22.470 1.00 10.00 C ATOM 1610 C LYS A 108 6.306 9.766 22.307 1.00 10.00 C ATOM 1611 O LYS A 108 6.244 10.492 21.315 1.00 10.00 O ATOM 1612 CB LYS A 108 7.033 7.323 22.313 1.00 10.00 C ATOM 1613 CG LYS A 108 8.219 6.381 22.048 1.00 10.00 C ATOM 1614 CD LYS A 108 7.716 4.950 21.803 1.00 10.00 C ATOM 1615 CE LYS A 108 8.827 3.977 21.392 1.00 10.00 C ATOM 1616 NZ LYS A 108 9.399 4.305 20.068 1.00 10.00 N ATOM 0 H LYS A 108 8.021 8.142 24.384 1.00 10.00 H new ATOM 0 HA LYS A 108 8.186 9.012 21.678 1.00 10.00 H new ATOM 0 HB2 LYS A 108 6.513 7.003 23.216 1.00 10.00 H new ATOM 0 HB3 LYS A 108 6.321 7.246 21.491 1.00 10.00 H new ATOM 0 HG2 LYS A 108 8.783 6.729 21.183 1.00 10.00 H new ATOM 0 HG3 LYS A 108 8.900 6.394 22.899 1.00 10.00 H new ATOM 0 HD2 LYS A 108 7.237 4.581 22.710 1.00 10.00 H new ATOM 0 HD3 LYS A 108 6.953 4.969 21.025 1.00 10.00 H new ATOM 0 HE2 LYS A 108 9.618 3.995 22.142 1.00 10.00 H new ATOM 0 HE3 LYS A 108 8.429 2.962 21.372 1.00 10.00 H new ATOM 0 HZ1 LYS A 108 9.980 3.510 19.734 1.00 10.00 H new ATOM 0 HZ2 LYS A 108 8.629 4.479 19.391 1.00 10.00 H new ATOM 0 HZ3 LYS A 108 9.990 5.157 20.147 1.00 10.00 H new ATOM 1630 N ILE A 109 5.392 9.826 23.282 1.00 10.00 N ATOM 1631 CA ILE A 109 4.260 10.749 23.260 1.00 10.00 C ATOM 1632 C ILE A 109 4.798 12.181 23.151 1.00 10.00 C ATOM 1633 O ILE A 109 4.310 12.937 22.317 1.00 10.00 O ATOM 1634 CB ILE A 109 3.351 10.522 24.495 1.00 10.00 C ATOM 1635 CG1 ILE A 109 2.677 9.125 24.473 1.00 10.00 C ATOM 1636 CG2 ILE A 109 2.235 11.579 24.602 1.00 10.00 C ATOM 1637 CD1 ILE A 109 2.179 8.679 25.858 1.00 10.00 C ATOM 0 H ILE A 109 5.420 9.232 24.110 1.00 10.00 H new ATOM 0 HA ILE A 109 3.627 10.567 22.391 1.00 10.00 H new ATOM 0 HB ILE A 109 4.015 10.601 25.356 1.00 10.00 H new ATOM 0 HG12 ILE A 109 1.837 9.143 23.779 1.00 10.00 H new ATOM 0 HG13 ILE A 109 3.387 8.390 24.094 1.00 10.00 H new ATOM 0 HG21 ILE A 109 1.626 11.377 25.483 1.00 10.00 H new ATOM 0 HG22 ILE A 109 2.680 12.570 24.688 1.00 10.00 H new ATOM 0 HG23 ILE A 109 1.609 11.539 23.711 1.00 10.00 H new ATOM 0 HD11 ILE A 109 1.717 7.695 25.779 1.00 10.00 H new ATOM 0 HD12 ILE A 109 3.021 8.630 26.549 1.00 10.00 H new ATOM 0 HD13 ILE A 109 1.446 9.395 26.229 1.00 10.00 H new ATOM 1649 N LYS A 110 5.799 12.556 23.957 1.00 10.00 N ATOM 1650 CA LYS A 110 6.410 13.885 23.949 1.00 10.00 C ATOM 1651 C LYS A 110 6.892 14.237 22.542 1.00 10.00 C ATOM 1652 O LYS A 110 6.613 15.334 22.075 1.00 10.00 O ATOM 1653 CB LYS A 110 7.567 13.918 24.965 1.00 10.00 C ATOM 1654 CG LYS A 110 8.190 15.314 25.143 1.00 10.00 C ATOM 1655 CD LYS A 110 9.473 15.276 25.989 1.00 10.00 C ATOM 1656 CE LYS A 110 9.209 14.901 27.455 1.00 10.00 C ATOM 1657 NZ LYS A 110 10.463 14.631 28.194 1.00 10.00 N ATOM 0 H LYS A 110 6.213 11.929 24.646 1.00 10.00 H new ATOM 0 HA LYS A 110 5.672 14.632 24.240 1.00 10.00 H new ATOM 0 HB2 LYS A 110 7.202 13.566 25.930 1.00 10.00 H new ATOM 0 HB3 LYS A 110 8.342 13.222 24.644 1.00 10.00 H new ATOM 0 HG2 LYS A 110 8.415 15.737 24.164 1.00 10.00 H new ATOM 0 HG3 LYS A 110 7.465 15.976 25.616 1.00 10.00 H new ATOM 0 HD2 LYS A 110 10.168 14.557 25.555 1.00 10.00 H new ATOM 0 HD3 LYS A 110 9.957 16.252 25.950 1.00 10.00 H new ATOM 0 HE2 LYS A 110 8.667 15.711 27.944 1.00 10.00 H new ATOM 0 HE3 LYS A 110 8.569 14.020 27.494 1.00 10.00 H new ATOM 0 HZ1 LYS A 110 10.252 14.515 29.206 1.00 10.00 H new ATOM 0 HZ2 LYS A 110 10.900 13.760 27.830 1.00 10.00 H new ATOM 0 HZ3 LYS A 110 11.120 15.427 28.066 1.00 10.00 H new ATOM 1671 N ALA A 111 7.600 13.321 21.877 1.00 10.00 N ATOM 1672 CA ALA A 111 8.144 13.561 20.552 1.00 10.00 C ATOM 1673 C ALA A 111 7.039 13.856 19.535 1.00 10.00 C ATOM 1674 O ALA A 111 7.242 14.672 18.638 1.00 10.00 O ATOM 1675 CB ALA A 111 8.992 12.357 20.116 1.00 10.00 C ATOM 0 H ALA A 111 7.809 12.394 22.248 1.00 10.00 H new ATOM 0 HA ALA A 111 8.780 14.445 20.594 1.00 10.00 H new ATOM 0 HB1 ALA A 111 9.399 12.540 19.121 1.00 10.00 H new ATOM 0 HB2 ALA A 111 9.810 12.213 20.822 1.00 10.00 H new ATOM 0 HB3 ALA A 111 8.370 11.462 20.095 1.00 10.00 H new ATOM 1681 N LYS A 112 5.900 13.155 19.611 1.00 10.00 N ATOM 1682 CA LYS A 112 4.831 13.291 18.621 1.00 10.00 C ATOM 1683 C LYS A 112 3.847 14.409 18.973 1.00 10.00 C ATOM 1684 O LYS A 112 3.287 15.000 18.051 1.00 10.00 O ATOM 1685 CB LYS A 112 4.105 11.946 18.440 1.00 10.00 C ATOM 1686 CG LYS A 112 5.002 10.807 17.909 1.00 10.00 C ATOM 1687 CD LYS A 112 5.759 11.100 16.599 1.00 10.00 C ATOM 1688 CE LYS A 112 4.814 11.467 15.442 1.00 10.00 C ATOM 1689 NZ LYS A 112 5.544 11.721 14.174 1.00 10.00 N ATOM 0 H LYS A 112 5.698 12.485 20.353 1.00 10.00 H new ATOM 0 HA LYS A 112 5.292 13.574 17.675 1.00 10.00 H new ATOM 0 HB2 LYS A 112 3.682 11.643 19.398 1.00 10.00 H new ATOM 0 HB3 LYS A 112 3.271 12.086 17.753 1.00 10.00 H new ATOM 0 HG2 LYS A 112 5.732 10.557 18.679 1.00 10.00 H new ATOM 0 HG3 LYS A 112 4.382 9.923 17.758 1.00 10.00 H new ATOM 0 HD2 LYS A 112 6.461 11.917 16.764 1.00 10.00 H new ATOM 0 HD3 LYS A 112 6.347 10.226 16.320 1.00 10.00 H new ATOM 0 HE2 LYS A 112 4.098 10.659 15.291 1.00 10.00 H new ATOM 0 HE3 LYS A 112 4.241 12.354 15.712 1.00 10.00 H new ATOM 0 HZ1 LYS A 112 4.865 11.964 13.425 1.00 10.00 H new ATOM 0 HZ2 LYS A 112 6.209 12.510 14.308 1.00 10.00 H new ATOM 0 HZ3 LYS A 112 6.071 10.867 13.900 1.00 10.00 H new ATOM 1703 N TYR A 113 3.583 14.674 20.251 1.00 10.00 N ATOM 1704 CA TYR A 113 2.639 15.704 20.675 1.00 10.00 C ATOM 1705 C TYR A 113 3.185 17.087 20.277 1.00 10.00 C ATOM 1706 O TYR A 113 4.354 17.363 20.543 1.00 10.00 O ATOM 1707 CB TYR A 113 2.393 15.591 22.189 1.00 10.00 C ATOM 1708 CG TYR A 113 1.190 16.377 22.673 1.00 10.00 C ATOM 1709 CD1 TYR A 113 -0.105 15.930 22.344 1.00 10.00 C ATOM 1710 CD2 TYR A 113 1.353 17.551 23.433 1.00 10.00 C ATOM 1711 CE1 TYR A 113 -1.235 16.660 22.748 1.00 10.00 C ATOM 1712 CE2 TYR A 113 0.223 18.280 23.850 1.00 10.00 C ATOM 1713 CZ TYR A 113 -1.074 17.841 23.505 1.00 10.00 C ATOM 1714 OH TYR A 113 -2.157 18.551 23.921 1.00 10.00 O ATOM 0 H TYR A 113 4.021 14.176 21.026 1.00 10.00 H new ATOM 0 HA TYR A 113 1.679 15.567 20.178 1.00 10.00 H new ATOM 0 HB2 TYR A 113 2.258 14.541 22.448 1.00 10.00 H new ATOM 0 HB3 TYR A 113 3.280 15.939 22.719 1.00 10.00 H new ATOM 0 HD1 TYR A 113 -0.230 15.019 21.777 1.00 10.00 H new ATOM 0 HD2 TYR A 113 2.344 17.892 23.696 1.00 10.00 H new ATOM 0 HE1 TYR A 113 -2.224 16.319 22.480 1.00 10.00 H new ATOM 0 HE2 TYR A 113 0.349 19.178 24.436 1.00 10.00 H new ATOM 0 HH TYR A 113 -1.859 19.334 24.430 1.00 10.00 H new ATOM 1724 N PRO A 114 2.376 17.976 19.669 1.00 10.00 N ATOM 1725 CA PRO A 114 2.893 19.206 19.075 1.00 10.00 C ATOM 1726 C PRO A 114 3.453 20.190 20.110 1.00 10.00 C ATOM 1727 O PRO A 114 4.353 20.950 19.772 1.00 10.00 O ATOM 1728 CB PRO A 114 1.728 19.806 18.277 1.00 10.00 C ATOM 1729 CG PRO A 114 0.484 19.214 18.937 1.00 10.00 C ATOM 1730 CD PRO A 114 0.958 17.832 19.382 1.00 10.00 C ATOM 0 HA PRO A 114 3.747 18.989 18.434 1.00 10.00 H new ATOM 0 HB2 PRO A 114 1.728 20.895 18.329 1.00 10.00 H new ATOM 0 HB3 PRO A 114 1.786 19.537 17.222 1.00 10.00 H new ATOM 0 HG2 PRO A 114 0.149 19.817 19.781 1.00 10.00 H new ATOM 0 HG3 PRO A 114 -0.351 19.149 18.240 1.00 10.00 H new ATOM 0 HD2 PRO A 114 0.412 17.496 20.264 1.00 10.00 H new ATOM 0 HD3 PRO A 114 0.790 17.090 18.601 1.00 10.00 H new ATOM 1738 N ASP A 115 2.934 20.195 21.344 1.00 10.00 N ATOM 1739 CA ASP A 115 3.417 21.104 22.396 1.00 10.00 C ATOM 1740 C ASP A 115 4.659 20.557 23.118 1.00 10.00 C ATOM 1741 O ASP A 115 5.218 21.226 23.977 1.00 10.00 O ATOM 1742 CB ASP A 115 2.295 21.411 23.396 1.00 10.00 C ATOM 1743 CG ASP A 115 2.627 22.612 24.295 1.00 10.00 C ATOM 1744 OD1 ASP A 115 2.847 23.708 23.735 1.00 10.00 O ATOM 1745 OD2 ASP A 115 2.500 22.443 25.534 1.00 10.00 O ATOM 0 H ASP A 115 2.177 19.579 21.641 1.00 10.00 H new ATOM 0 HA ASP A 115 3.719 22.031 21.908 1.00 10.00 H new ATOM 0 HB2 ASP A 115 1.372 21.611 22.852 1.00 10.00 H new ATOM 0 HB3 ASP A 115 2.115 20.534 24.017 1.00 10.00 H new ATOM 1750 N TYR A 116 5.114 19.346 22.761 1.00 10.00 N ATOM 1751 CA TYR A 116 6.316 18.708 23.294 1.00 10.00 C ATOM 1752 C TYR A 116 6.322 18.684 24.835 1.00 10.00 C ATOM 1753 O TYR A 116 7.289 19.079 25.487 1.00 10.00 O ATOM 1754 CB TYR A 116 7.573 19.319 22.640 1.00 10.00 C ATOM 1755 CG TYR A 116 8.850 18.500 22.781 1.00 10.00 C ATOM 1756 CD1 TYR A 116 9.091 17.416 21.914 1.00 10.00 C ATOM 1757 CD2 TYR A 116 9.811 18.840 23.754 1.00 10.00 C ATOM 1758 CE1 TYR A 116 10.276 16.664 22.024 1.00 10.00 C ATOM 1759 CE2 TYR A 116 10.998 18.092 23.873 1.00 10.00 C ATOM 1760 CZ TYR A 116 11.237 17.002 23.006 1.00 10.00 C ATOM 1761 OH TYR A 116 12.382 16.275 23.138 1.00 10.00 O ATOM 0 H TYR A 116 4.635 18.769 22.070 1.00 10.00 H new ATOM 0 HA TYR A 116 6.321 17.653 23.021 1.00 10.00 H new ATOM 0 HB2 TYR A 116 7.373 19.468 21.579 1.00 10.00 H new ATOM 0 HB3 TYR A 116 7.744 20.304 23.074 1.00 10.00 H new ATOM 0 HD1 TYR A 116 8.362 17.160 21.160 1.00 10.00 H new ATOM 0 HD2 TYR A 116 9.636 19.679 24.412 1.00 10.00 H new ATOM 0 HE1 TYR A 116 10.451 15.830 21.360 1.00 10.00 H new ATOM 0 HE2 TYR A 116 11.726 18.351 24.627 1.00 10.00 H new ATOM 0 HH TYR A 116 12.926 16.650 23.861 1.00 10.00 H new ATOM 1771 N GLU A 117 5.260 18.135 25.437 1.00 10.00 N ATOM 1772 CA GLU A 117 5.213 17.856 26.869 1.00 10.00 C ATOM 1773 C GLU A 117 4.402 16.584 27.108 1.00 10.00 C ATOM 1774 O GLU A 117 3.613 16.156 26.261 1.00 10.00 O ATOM 1775 CB GLU A 117 4.623 19.035 27.670 1.00 10.00 C ATOM 1776 CG GLU A 117 5.384 19.264 28.988 1.00 10.00 C ATOM 1777 CD GLU A 117 4.927 20.526 29.739 1.00 10.00 C ATOM 1778 OE1 GLU A 117 3.756 20.939 29.526 1.00 10.00 O ATOM 1779 OE2 GLU A 117 5.725 21.029 30.558 1.00 10.00 O ATOM 0 H GLU A 117 4.409 17.873 24.939 1.00 10.00 H new ATOM 0 HA GLU A 117 6.234 17.714 27.223 1.00 10.00 H new ATOM 0 HB2 GLU A 117 4.661 19.941 27.065 1.00 10.00 H new ATOM 0 HB3 GLU A 117 3.573 18.839 27.885 1.00 10.00 H new ATOM 0 HG2 GLU A 117 5.249 18.396 29.633 1.00 10.00 H new ATOM 0 HG3 GLU A 117 6.450 19.341 28.776 1.00 10.00 H new ATOM 1786 N VAL A 118 4.610 15.996 28.284 1.00 10.00 N ATOM 1787 CA VAL A 118 3.958 14.802 28.798 1.00 10.00 C ATOM 1788 C VAL A 118 4.280 14.768 30.305 1.00 10.00 C ATOM 1789 O VAL A 118 5.215 15.440 30.746 1.00 10.00 O ATOM 1790 CB VAL A 118 4.502 13.566 28.041 1.00 10.00 C ATOM 1791 CG1 VAL A 118 5.947 13.262 28.470 1.00 10.00 C ATOM 1792 CG2 VAL A 118 3.596 12.336 28.197 1.00 10.00 C ATOM 0 H VAL A 118 5.288 16.371 28.947 1.00 10.00 H new ATOM 0 HA VAL A 118 2.878 14.801 28.653 1.00 10.00 H new ATOM 0 HB VAL A 118 4.504 13.811 26.979 1.00 10.00 H new ATOM 0 HG11 VAL A 118 6.312 12.390 27.927 1.00 10.00 H new ATOM 0 HG12 VAL A 118 6.581 14.120 28.247 1.00 10.00 H new ATOM 0 HG13 VAL A 118 5.974 13.060 29.541 1.00 10.00 H new ATOM 0 HG21 VAL A 118 4.023 11.497 27.647 1.00 10.00 H new ATOM 0 HG22 VAL A 118 3.516 12.075 29.252 1.00 10.00 H new ATOM 0 HG23 VAL A 118 2.605 12.562 27.803 1.00 10.00 H new ATOM 1802 N THR A 119 3.597 13.932 31.084 1.00 10.00 N ATOM 1803 CA THR A 119 3.934 13.635 32.473 1.00 10.00 C ATOM 1804 C THR A 119 3.590 12.169 32.765 1.00 10.00 C ATOM 1805 O THR A 119 2.888 11.534 31.978 1.00 10.00 O ATOM 1806 CB THR A 119 3.175 14.595 33.408 1.00 10.00 C ATOM 1807 OG1 THR A 119 1.807 14.697 33.052 1.00 10.00 O ATOM 1808 CG2 THR A 119 3.757 16.007 33.433 1.00 10.00 C ATOM 0 H THR A 119 2.772 13.429 30.757 1.00 10.00 H new ATOM 0 HA THR A 119 5.000 13.780 32.646 1.00 10.00 H new ATOM 0 HB THR A 119 3.283 14.156 34.400 1.00 10.00 H new ATOM 0 HG1 THR A 119 1.283 14.058 33.579 1.00 10.00 H new ATOM 0 HG21 THR A 119 3.174 16.629 34.112 1.00 10.00 H new ATOM 0 HG22 THR A 119 4.791 15.968 33.775 1.00 10.00 H new ATOM 0 HG23 THR A 119 3.722 16.433 32.430 1.00 10.00 H new ATOM 1816 N TRP A 120 4.064 11.614 33.882 1.00 10.00 N ATOM 1817 CA TRP A 120 3.584 10.324 34.368 1.00 10.00 C ATOM 1818 C TRP A 120 3.746 10.213 35.879 1.00 10.00 C ATOM 1819 O TRP A 120 4.468 11.006 36.486 1.00 10.00 O ATOM 1820 CB TRP A 120 4.250 9.142 33.632 1.00 10.00 C ATOM 1821 CG TRP A 120 5.689 8.811 33.899 1.00 10.00 C ATOM 1822 CD1 TRP A 120 6.771 9.375 33.316 1.00 10.00 C ATOM 1823 CD2 TRP A 120 6.219 7.761 34.766 1.00 10.00 C ATOM 1824 NE1 TRP A 120 7.922 8.757 33.764 1.00 10.00 N ATOM 1825 CE2 TRP A 120 7.642 7.760 34.674 1.00 10.00 C ATOM 1826 CE3 TRP A 120 5.635 6.791 35.607 1.00 10.00 C ATOM 1827 CZ2 TRP A 120 8.440 6.862 35.401 1.00 10.00 C ATOM 1828 CZ3 TRP A 120 6.423 5.891 36.350 1.00 10.00 C ATOM 1829 CH2 TRP A 120 7.824 5.927 36.252 1.00 10.00 C ATOM 0 H TRP A 120 4.782 12.041 34.467 1.00 10.00 H new ATOM 0 HA TRP A 120 2.519 10.269 34.144 1.00 10.00 H new ATOM 0 HB2 TRP A 120 3.665 8.250 33.854 1.00 10.00 H new ATOM 0 HB3 TRP A 120 4.153 9.329 32.563 1.00 10.00 H new ATOM 0 HD1 TRP A 120 6.740 10.188 32.606 1.00 10.00 H new ATOM 0 HE1 TRP A 120 8.863 9.007 33.459 1.00 10.00 H new ATOM 0 HE3 TRP A 120 4.559 6.737 35.683 1.00 10.00 H new ATOM 0 HZ2 TRP A 120 9.516 6.889 35.308 1.00 10.00 H new ATOM 0 HZ3 TRP A 120 5.948 5.170 36.998 1.00 10.00 H new ATOM 0 HH2 TRP A 120 8.426 5.239 36.828 1.00 10.00 H new ATOM 1840 N ALA A 121 3.080 9.221 36.474 1.00 10.00 N ATOM 1841 CA ALA A 121 3.181 8.855 37.881 1.00 10.00 C ATOM 1842 C ALA A 121 3.025 7.337 38.012 1.00 10.00 C ATOM 1843 O ALA A 121 2.403 6.696 37.169 1.00 10.00 O ATOM 1844 CB ALA A 121 2.096 9.577 38.690 1.00 10.00 C ATOM 0 H ALA A 121 2.428 8.627 35.962 1.00 10.00 H new ATOM 0 HA ALA A 121 4.154 9.153 38.271 1.00 10.00 H new ATOM 0 HB1 ALA A 121 2.179 9.298 39.740 1.00 10.00 H new ATOM 0 HB2 ALA A 121 2.224 10.655 38.590 1.00 10.00 H new ATOM 0 HB3 ALA A 121 1.113 9.292 38.315 1.00 10.00 H new ATOM 1850 N ASN A 122 3.609 6.769 39.071 1.00 10.00 N ATOM 1851 CA ASN A 122 3.685 5.317 39.275 1.00 10.00 C ATOM 1852 C ASN A 122 2.447 4.754 40.002 1.00 10.00 C ATOM 1853 O ASN A 122 2.468 3.613 40.463 1.00 10.00 O ATOM 1854 CB ASN A 122 4.983 4.989 40.041 1.00 10.00 C ATOM 1855 CG ASN A 122 5.303 3.494 40.029 1.00 10.00 C ATOM 1856 OD1 ASN A 122 5.273 2.857 38.985 1.00 10.00 O ATOM 1857 ND2 ASN A 122 5.677 2.923 41.166 1.00 10.00 N ATOM 0 H ASN A 122 4.047 7.308 39.818 1.00 10.00 H new ATOM 0 HA ASN A 122 3.700 4.833 38.299 1.00 10.00 H new ATOM 0 HB2 ASN A 122 5.813 5.539 39.597 1.00 10.00 H new ATOM 0 HB3 ASN A 122 4.890 5.330 41.072 1.00 10.00 H new ATOM 0 HD21 ASN A 122 5.945 1.939 41.178 1.00 10.00 H new ATOM 0 HD22 ASN A 122 5.697 3.468 42.028 1.00 10.00 H new ATOM 1864 N ASP A 123 1.417 5.582 40.214 1.00 10.00 N ATOM 1865 CA ASP A 123 0.165 5.162 40.859 1.00 10.00 C ATOM 1866 C ASP A 123 -0.483 3.998 40.097 1.00 10.00 C ATOM 1867 O ASP A 123 -0.370 3.919 38.870 1.00 10.00 O ATOM 1868 CB ASP A 123 -0.808 6.345 40.974 1.00 10.00 C ATOM 1869 CG ASP A 123 -2.112 5.957 41.690 1.00 10.00 C ATOM 1870 OD1 ASP A 123 -1.999 5.173 42.658 1.00 10.00 O ATOM 1871 OD2 ASP A 123 -3.171 6.471 41.275 1.00 10.00 O ATOM 0 H ASP A 123 1.427 6.565 39.943 1.00 10.00 H new ATOM 0 HA ASP A 123 0.403 4.814 41.864 1.00 10.00 H new ATOM 0 HB2 ASP A 123 -0.326 7.158 41.516 1.00 10.00 H new ATOM 0 HB3 ASP A 123 -1.041 6.720 39.977 1.00 10.00 H new ATOM 1876 N GLY A 124 -1.113 3.080 40.830 1.00 10.00 N ATOM 1877 CA GLY A 124 -1.646 1.836 40.300 1.00 10.00 C ATOM 1878 C GLY A 124 -2.991 2.011 39.595 1.00 10.00 C ATOM 1879 O GLY A 124 -3.537 3.110 39.503 1.00 10.00 O ATOM 0 H GLY A 124 -1.268 3.188 41.832 1.00 10.00 H new ATOM 0 HA2 GLY A 124 -0.928 1.410 39.599 1.00 10.00 H new ATOM 0 HA3 GLY A 124 -1.760 1.121 41.114 1.00 10.00 H new ATOM 1883 N TYR A 125 -3.482 0.909 39.013 1.00 10.00 N ATOM 1884 CA TYR A 125 -4.802 0.874 38.395 1.00 10.00 C ATOM 1885 C TYR A 125 -5.856 1.268 39.433 1.00 10.00 C ATOM 1886 O TYR A 125 -5.909 0.596 40.480 1.00 10.00 O ATOM 1887 CB TYR A 125 -5.086 -0.492 37.750 1.00 10.00 C ATOM 1888 CG TYR A 125 -6.332 -0.498 36.879 1.00 10.00 C ATOM 1889 CD1 TYR A 125 -6.250 -0.110 35.527 1.00 10.00 C ATOM 1890 CD2 TYR A 125 -7.581 -0.854 37.423 1.00 10.00 C ATOM 1891 CE1 TYR A 125 -7.406 -0.066 34.726 1.00 10.00 C ATOM 1892 CE2 TYR A 125 -8.742 -0.819 36.627 1.00 10.00 C ATOM 1893 CZ TYR A 125 -8.660 -0.423 35.272 1.00 10.00 C ATOM 1894 OH TYR A 125 -9.780 -0.365 34.493 1.00 10.00 O ATOM 1895 OXT TYR A 125 -6.614 2.212 39.114 1.00 10.00 O ATOM 0 H TYR A 125 -2.975 0.026 38.960 1.00 10.00 H new ATOM 0 HA TYR A 125 -4.840 1.598 37.581 1.00 10.00 H new ATOM 0 HB2 TYR A 125 -4.228 -0.786 37.146 1.00 10.00 H new ATOM 0 HB3 TYR A 125 -5.196 -1.241 38.535 1.00 10.00 H new ATOM 0 HD1 TYR A 125 -5.293 0.156 35.102 1.00 10.00 H new ATOM 0 HD2 TYR A 125 -7.649 -1.156 38.458 1.00 10.00 H new ATOM 0 HE1 TYR A 125 -7.335 0.241 33.693 1.00 10.00 H new ATOM 0 HE2 TYR A 125 -9.696 -1.095 37.052 1.00 10.00 H new ATOM 0 HH TYR A 125 -10.559 -0.643 35.019 1.00 10.00 H new TER 1905 TYR A 125