USER MOD reduce.3.24.130724 H: found=0, std=0, add=1177, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1177 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 110 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 19 CYS SG : rot -124:sc= -0.755 USER MOD Set 2.2: A 80 TYR OH : rot 154:sc= 1.18 USER MOD Set 2.3: A 89 GLN : amide:sc= -2.09 K(o=-1.7,f=-13!) USER MOD Single : A 9 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 10 MET CE :methyl -117:sc= -2.14 (180deg=-5.53!) USER MOD Single : A 20 TYR OH : rot 30:sc= -3.7! USER MOD Single : A 21 CYS SG : rot 180:sc= 0.0885 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= -0.174 K(o=-0.17,f=-1.1) USER MOD Single : A 29 GLN :FLIP amide:sc= -1.59 F(o=-2.8,f=-1.6) USER MOD Single : A 31 MET CE :methyl -141:sc= -5.28! (180deg=-10.5!) USER MOD Single : A 34 GLN : amide:sc= -0.414 X(o=-0.41,f=0) USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 THR OG1 : rot 83:sc= 0.137 USER MOD Single : A 39 ASN : amide:sc= -1.25 X(o=-1.3,f=-1.6) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 CYS SG : rot 138:sc= -0.449 USER MOD Single : A 47 SER OG : rot -28:sc= 0.598 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 CYS SG : rot 180:sc= -2.4! USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 CYS SG : rot -130:sc= -0.855 USER MOD Single : A 72 MET CE :methyl -112:sc= -0.148 (180deg=-3.27!) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 152:sc= -0.0614 (180deg=-0.427) USER MOD Single : A 86 CYS SG : rot 96:sc= 1.11 USER MOD Single : A 90 THR OG1 : rot 96:sc= 1.14 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot -60:sc= 0.541 USER MOD Single : A 97 SER OG : rot 180:sc= -1.03 USER MOD Single : A 101 HIS : no HD1:sc= -2.86 X(o=-2.9,f=-2.8!) USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ -175:sc= -0.0812 (180deg=-0.114) USER MOD Single : A 113 MET CE :methyl -118:sc= -3.97! (180deg=-9.49!) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ -152:sc= -0.0835 (180deg=-2.56!) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 CYS SG : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 THR OG1 : rot 180:sc= -1.85 USER MOD Single : A 131 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 133 CYS SG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 140 THR OG1 : rot 82:sc= 0.137 USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 SER OG : rot -68:sc= 0.00421 USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 9 -8.882 -9.433 -15.194 1.00 0.00 N ATOM 2 CA HIS A 9 -7.743 -10.305 -14.928 1.00 0.00 C ATOM 3 C HIS A 9 -7.471 -10.400 -13.429 1.00 0.00 C ATOM 4 O HIS A 9 -7.879 -9.534 -12.657 1.00 0.00 O ATOM 5 CB HIS A 9 -6.498 -9.789 -15.658 1.00 0.00 C ATOM 6 CG HIS A 9 -5.938 -10.764 -16.644 1.00 0.00 C ATOM 7 ND1 HIS A 9 -6.205 -10.704 -17.995 1.00 0.00 N ATOM 8 CD2 HIS A 9 -5.118 -11.828 -16.472 1.00 0.00 C ATOM 9 CE1 HIS A 9 -5.575 -11.691 -18.611 1.00 0.00 C ATOM 10 NE2 HIS A 9 -4.908 -12.387 -17.708 1.00 0.00 N ATOM 0 HA HIS A 9 -7.983 -11.302 -15.298 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -6.748 -8.863 -16.176 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -5.730 -9.546 -14.923 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -4.705 -12.173 -15.535 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -5.602 -11.893 -19.672 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -4.331 -13.206 -17.898 1.00 0.00 H new ATOM 19 N MET A 10 -6.779 -11.461 -13.026 1.00 0.00 N ATOM 20 CA MET A 10 -6.453 -11.672 -11.620 1.00 0.00 C ATOM 21 C MET A 10 -5.579 -12.913 -11.443 1.00 0.00 C ATOM 22 O MET A 10 -6.091 -14.029 -11.343 1.00 0.00 O ATOM 23 CB MET A 10 -7.733 -11.813 -10.795 1.00 0.00 C ATOM 24 CG MET A 10 -7.497 -11.790 -9.295 1.00 0.00 C ATOM 25 SD MET A 10 -8.933 -12.345 -8.356 1.00 0.00 S ATOM 26 CE MET A 10 -9.776 -10.789 -8.076 1.00 0.00 C ATOM 0 H MET A 10 -6.433 -12.188 -13.653 1.00 0.00 H new ATOM 0 HA MET A 10 -5.895 -10.804 -11.268 1.00 0.00 H new ATOM 0 HB2 MET A 10 -8.416 -11.006 -11.059 1.00 0.00 H new ATOM 0 HB3 MET A 10 -8.226 -12.748 -11.062 1.00 0.00 H new ATOM 0 HG2 MET A 10 -6.644 -12.425 -9.056 1.00 0.00 H new ATOM 0 HG3 MET A 10 -7.236 -10.777 -8.988 1.00 0.00 H new ATOM 0 HE1 MET A 10 -9.817 -10.585 -7.006 1.00 0.00 H new ATOM 0 HE2 MET A 10 -9.235 -9.987 -8.578 1.00 0.00 H new ATOM 0 HE3 MET A 10 -10.789 -10.848 -8.473 1.00 0.00 H new ATOM 36 N PRO A 11 -4.246 -12.739 -11.403 1.00 0.00 N ATOM 37 CA PRO A 11 -3.311 -13.857 -11.237 1.00 0.00 C ATOM 38 C PRO A 11 -3.473 -14.555 -9.892 1.00 0.00 C ATOM 39 O PRO A 11 -4.276 -14.139 -9.058 1.00 0.00 O ATOM 40 CB PRO A 11 -1.931 -13.196 -11.333 1.00 0.00 C ATOM 41 CG PRO A 11 -2.167 -11.760 -11.010 1.00 0.00 C ATOM 42 CD PRO A 11 -3.546 -11.446 -11.514 1.00 0.00 C ATOM 0 HA PRO A 11 -3.476 -14.634 -11.984 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -1.228 -13.647 -10.633 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -1.507 -13.312 -12.330 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -2.094 -11.584 -9.937 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -1.422 -11.124 -11.489 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -4.028 -10.674 -10.914 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -3.527 -11.085 -12.542 1.00 0.00 H new ATOM 50 N GLU A 12 -2.707 -15.623 -9.689 1.00 0.00 N ATOM 51 CA GLU A 12 -2.767 -16.382 -8.445 1.00 0.00 C ATOM 52 C GLU A 12 -1.779 -15.837 -7.417 1.00 0.00 C ATOM 53 O GLU A 12 -1.960 -16.021 -6.213 1.00 0.00 O ATOM 54 CB GLU A 12 -2.477 -17.859 -8.713 1.00 0.00 C ATOM 55 CG GLU A 12 -3.597 -18.575 -9.452 1.00 0.00 C ATOM 56 CD GLU A 12 -4.114 -19.785 -8.699 1.00 0.00 C ATOM 57 OE1 GLU A 12 -3.289 -20.631 -8.297 1.00 0.00 O ATOM 58 OE2 GLU A 12 -5.345 -19.886 -8.513 1.00 0.00 O ATOM 0 H GLU A 12 -2.038 -15.982 -10.370 1.00 0.00 H new ATOM 0 HA GLU A 12 -3.773 -16.280 -8.038 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -1.559 -17.941 -9.295 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -2.299 -18.364 -7.764 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -4.419 -17.879 -9.621 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -3.238 -18.888 -10.432 1.00 0.00 H new ATOM 65 N ARG A 13 -0.734 -15.169 -7.896 1.00 0.00 N ATOM 66 CA ARG A 13 0.279 -14.601 -7.013 1.00 0.00 C ATOM 67 C ARG A 13 0.455 -13.110 -7.273 1.00 0.00 C ATOM 68 O ARG A 13 0.651 -12.686 -8.412 1.00 0.00 O ATOM 69 CB ARG A 13 1.613 -15.324 -7.202 1.00 0.00 C ATOM 70 CG ARG A 13 1.519 -16.830 -7.033 1.00 0.00 C ATOM 71 CD ARG A 13 1.275 -17.212 -5.581 1.00 0.00 C ATOM 72 NE ARG A 13 1.680 -18.588 -5.302 1.00 0.00 N ATOM 73 CZ ARG A 13 2.942 -19.011 -5.329 1.00 0.00 C ATOM 74 NH1 ARG A 13 3.924 -18.167 -5.622 1.00 0.00 N ATOM 75 NH2 ARG A 13 3.221 -20.278 -5.063 1.00 0.00 N ATOM 0 H ARG A 13 -0.567 -15.008 -8.889 1.00 0.00 H new ATOM 0 HA ARG A 13 -0.057 -14.734 -5.985 1.00 0.00 H new ATOM 0 HB2 ARG A 13 1.999 -15.102 -8.197 1.00 0.00 H new ATOM 0 HB3 ARG A 13 2.334 -14.931 -6.485 1.00 0.00 H new ATOM 0 HG2 ARG A 13 0.711 -17.217 -7.653 1.00 0.00 H new ATOM 0 HG3 ARG A 13 2.441 -17.295 -7.383 1.00 0.00 H new ATOM 0 HD2 ARG A 13 1.825 -16.533 -4.930 1.00 0.00 H new ATOM 0 HD3 ARG A 13 0.217 -17.091 -5.347 1.00 0.00 H new ATOM 0 HE ARG A 13 0.952 -19.265 -5.073 1.00 0.00 H new ATOM 0 HH11 ARG A 13 3.713 -17.190 -5.827 1.00 0.00 H new ATOM 0 HH12 ARG A 13 4.890 -18.495 -5.642 1.00 0.00 H new ATOM 0 HH21 ARG A 13 2.469 -20.929 -4.838 1.00 0.00 H new ATOM 0 HH22 ARG A 13 4.188 -20.603 -5.084 1.00 0.00 H new ATOM 89 N PHE A 14 0.386 -12.317 -6.208 1.00 0.00 N ATOM 90 CA PHE A 14 0.539 -10.872 -6.322 1.00 0.00 C ATOM 91 C PHE A 14 1.733 -10.390 -5.508 1.00 0.00 C ATOM 92 O PHE A 14 2.375 -11.173 -4.809 1.00 0.00 O ATOM 93 CB PHE A 14 -0.735 -10.165 -5.856 1.00 0.00 C ATOM 94 CG PHE A 14 -1.995 -10.816 -6.353 1.00 0.00 C ATOM 95 CD1 PHE A 14 -2.583 -11.848 -5.639 1.00 0.00 C ATOM 96 CD2 PHE A 14 -2.588 -10.400 -7.533 1.00 0.00 C ATOM 97 CE1 PHE A 14 -3.739 -12.452 -6.093 1.00 0.00 C ATOM 98 CE2 PHE A 14 -3.745 -10.999 -7.993 1.00 0.00 C ATOM 99 CZ PHE A 14 -4.322 -12.026 -7.272 1.00 0.00 C ATOM 0 H PHE A 14 0.225 -12.651 -5.258 1.00 0.00 H new ATOM 0 HA PHE A 14 0.715 -10.629 -7.370 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -0.752 -10.143 -4.766 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -0.712 -9.129 -6.195 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -2.132 -12.184 -4.717 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -2.141 -9.598 -8.101 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -4.187 -13.256 -5.528 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -4.197 -10.665 -8.915 1.00 0.00 H new ATOM 0 HZ PHE A 14 -5.227 -12.495 -7.629 1.00 0.00 H new ATOM 109 N ASP A 15 2.032 -9.100 -5.610 1.00 0.00 N ATOM 110 CA ASP A 15 3.155 -8.521 -4.886 1.00 0.00 C ATOM 111 C ASP A 15 2.682 -7.765 -3.649 1.00 0.00 C ATOM 112 O ASP A 15 3.016 -8.130 -2.520 1.00 0.00 O ATOM 113 CB ASP A 15 3.947 -7.584 -5.799 1.00 0.00 C ATOM 114 CG ASP A 15 5.414 -7.516 -5.425 1.00 0.00 C ATOM 115 OD1 ASP A 15 5.722 -7.548 -4.215 1.00 0.00 O ATOM 116 OD2 ASP A 15 6.258 -7.432 -6.344 1.00 0.00 O ATOM 0 H ASP A 15 1.513 -8.437 -6.186 1.00 0.00 H new ATOM 0 HA ASP A 15 3.801 -9.336 -4.561 1.00 0.00 H new ATOM 0 HB2 ASP A 15 3.853 -7.922 -6.831 1.00 0.00 H new ATOM 0 HB3 ASP A 15 3.516 -6.584 -5.751 1.00 0.00 H new ATOM 121 N ALA A 16 1.909 -6.704 -3.864 1.00 0.00 N ATOM 122 CA ALA A 16 1.405 -5.898 -2.759 1.00 0.00 C ATOM 123 C ALA A 16 -0.023 -5.425 -3.007 1.00 0.00 C ATOM 124 O ALA A 16 -0.584 -5.633 -4.082 1.00 0.00 O ATOM 125 CB ALA A 16 2.320 -4.705 -2.522 1.00 0.00 C ATOM 0 H ALA A 16 1.620 -6.385 -4.789 1.00 0.00 H new ATOM 0 HA ALA A 16 1.393 -6.527 -1.869 1.00 0.00 H new ATOM 0 HB1 ALA A 16 1.934 -4.109 -1.694 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.322 -5.058 -2.279 1.00 0.00 H new ATOM 0 HB3 ALA A 16 2.359 -4.092 -3.423 1.00 0.00 H new ATOM 131 N PHE A 17 -0.604 -4.778 -2.000 1.00 0.00 N ATOM 132 CA PHE A 17 -1.965 -4.261 -2.102 1.00 0.00 C ATOM 133 C PHE A 17 -1.986 -2.751 -1.877 1.00 0.00 C ATOM 134 O PHE A 17 -1.109 -2.201 -1.211 1.00 0.00 O ATOM 135 CB PHE A 17 -2.880 -4.958 -1.093 1.00 0.00 C ATOM 136 CG PHE A 17 -4.277 -4.408 -1.074 1.00 0.00 C ATOM 137 CD1 PHE A 17 -4.572 -3.257 -0.362 1.00 0.00 C ATOM 138 CD2 PHE A 17 -5.294 -5.040 -1.770 1.00 0.00 C ATOM 139 CE1 PHE A 17 -5.855 -2.745 -0.344 1.00 0.00 C ATOM 140 CE2 PHE A 17 -6.580 -4.534 -1.756 1.00 0.00 C ATOM 141 CZ PHE A 17 -6.860 -3.385 -1.043 1.00 0.00 C ATOM 0 H PHE A 17 -0.152 -4.599 -1.103 1.00 0.00 H new ATOM 0 HA PHE A 17 -2.333 -4.466 -3.107 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -2.920 -6.022 -1.325 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -2.447 -4.865 -0.097 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -3.789 -2.754 0.186 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -5.080 -5.938 -2.330 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -6.072 -1.847 0.215 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -7.365 -5.036 -2.302 1.00 0.00 H new ATOM 0 HZ PHE A 17 -7.864 -2.987 -1.032 1.00 0.00 H new ATOM 151 N ILE A 18 -2.988 -2.083 -2.444 1.00 0.00 N ATOM 152 CA ILE A 18 -3.112 -0.636 -2.311 1.00 0.00 C ATOM 153 C ILE A 18 -4.297 -0.245 -1.435 1.00 0.00 C ATOM 154 O ILE A 18 -5.453 -0.459 -1.801 1.00 0.00 O ATOM 155 CB ILE A 18 -3.271 0.046 -3.686 1.00 0.00 C ATOM 156 CG1 ILE A 18 -2.100 -0.311 -4.597 1.00 0.00 C ATOM 157 CG2 ILE A 18 -3.380 1.558 -3.527 1.00 0.00 C ATOM 158 CD1 ILE A 18 -0.786 0.299 -4.154 1.00 0.00 C ATOM 0 H ILE A 18 -3.724 -2.521 -2.999 1.00 0.00 H new ATOM 0 HA ILE A 18 -2.191 -0.296 -1.839 1.00 0.00 H new ATOM 0 HB ILE A 18 -4.191 -0.318 -4.145 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -1.995 -1.395 -4.633 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -2.323 0.022 -5.611 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -3.491 2.020 -4.508 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -4.248 1.798 -2.912 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -2.479 1.939 -3.047 1.00 0.00 H new ATOM 0 HD11 ILE A 18 0.003 0.005 -4.846 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -0.874 1.385 -4.145 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -0.541 -0.054 -3.152 1.00 0.00 H new ATOM 170 N CYS A 19 -4.003 0.359 -0.289 1.00 0.00 N ATOM 171 CA CYS A 19 -5.041 0.816 0.624 1.00 0.00 C ATOM 172 C CYS A 19 -5.191 2.329 0.509 1.00 0.00 C ATOM 173 O CYS A 19 -4.431 3.085 1.117 1.00 0.00 O ATOM 174 CB CYS A 19 -4.697 0.425 2.064 1.00 0.00 C ATOM 175 SG CYS A 19 -5.642 -0.983 2.693 1.00 0.00 S ATOM 0 H CYS A 19 -3.052 0.543 0.029 1.00 0.00 H new ATOM 0 HA CYS A 19 -5.985 0.340 0.357 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -3.634 0.190 2.121 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -4.869 1.283 2.713 1.00 0.00 H new ATOM 0 HG CYS A 19 -6.250 -0.642 3.790 1.00 0.00 H new ATOM 181 N TYR A 20 -6.156 2.769 -0.292 1.00 0.00 N ATOM 182 CA TYR A 20 -6.377 4.196 -0.505 1.00 0.00 C ATOM 183 C TYR A 20 -7.815 4.599 -0.190 1.00 0.00 C ATOM 184 O TYR A 20 -8.667 3.756 0.091 1.00 0.00 O ATOM 185 CB TYR A 20 -6.034 4.573 -1.948 1.00 0.00 C ATOM 186 CG TYR A 20 -6.533 3.586 -2.986 1.00 0.00 C ATOM 187 CD1 TYR A 20 -7.782 2.985 -2.868 1.00 0.00 C ATOM 188 CD2 TYR A 20 -5.752 3.259 -4.087 1.00 0.00 C ATOM 189 CE1 TYR A 20 -8.235 2.087 -3.818 1.00 0.00 C ATOM 190 CE2 TYR A 20 -6.198 2.364 -5.040 1.00 0.00 C ATOM 191 CZ TYR A 20 -7.439 1.781 -4.901 1.00 0.00 C ATOM 192 OH TYR A 20 -7.888 0.888 -5.849 1.00 0.00 O ATOM 0 H TYR A 20 -6.796 2.161 -0.803 1.00 0.00 H new ATOM 0 HA TYR A 20 -5.722 4.736 0.178 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -6.455 5.555 -2.165 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -4.952 4.663 -2.040 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -8.408 3.223 -2.021 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -4.778 3.713 -4.200 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -9.207 1.628 -3.712 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -5.577 2.122 -5.890 1.00 0.00 H new ATOM 0 HH TYR A 20 -8.866 0.931 -5.902 1.00 0.00 H new ATOM 202 N CYS A 21 -8.072 5.904 -0.250 1.00 0.00 N ATOM 203 CA CYS A 21 -9.401 6.439 0.017 1.00 0.00 C ATOM 204 C CYS A 21 -10.012 7.014 -1.259 1.00 0.00 C ATOM 205 O CYS A 21 -9.293 7.449 -2.158 1.00 0.00 O ATOM 206 CB CYS A 21 -9.333 7.521 1.095 1.00 0.00 C ATOM 207 SG CYS A 21 -8.279 8.925 0.662 1.00 0.00 S ATOM 0 H CYS A 21 -7.374 6.610 -0.482 1.00 0.00 H new ATOM 0 HA CYS A 21 -10.032 5.625 0.373 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -10.341 7.884 1.295 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -8.966 7.076 2.020 1.00 0.00 H new ATOM 0 HG CYS A 21 -8.286 9.789 1.633 1.00 0.00 H new ATOM 213 N PRO A 22 -11.353 7.023 -1.358 1.00 0.00 N ATOM 214 CA PRO A 22 -12.055 7.547 -2.535 1.00 0.00 C ATOM 215 C PRO A 22 -11.942 9.065 -2.664 1.00 0.00 C ATOM 216 O PRO A 22 -12.333 9.638 -3.680 1.00 0.00 O ATOM 217 CB PRO A 22 -13.509 7.139 -2.292 1.00 0.00 C ATOM 218 CG PRO A 22 -13.625 7.015 -0.812 1.00 0.00 C ATOM 219 CD PRO A 22 -12.287 6.522 -0.332 1.00 0.00 C ATOM 0 HA PRO A 22 -11.634 7.156 -3.461 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -14.200 7.886 -2.682 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -13.744 6.197 -2.788 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -13.873 7.974 -0.358 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -14.418 6.319 -0.540 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -12.046 6.912 0.657 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -12.261 5.435 -0.261 1.00 0.00 H new ATOM 227 N SER A 23 -11.401 9.713 -1.635 1.00 0.00 N ATOM 228 CA SER A 23 -11.239 11.162 -1.648 1.00 0.00 C ATOM 229 C SER A 23 -9.991 11.548 -2.429 1.00 0.00 C ATOM 230 O SER A 23 -9.978 12.546 -3.151 1.00 0.00 O ATOM 231 CB SER A 23 -11.151 11.700 -0.217 1.00 0.00 C ATOM 232 OG SER A 23 -12.398 12.222 0.209 1.00 0.00 O ATOM 0 H SER A 23 -11.069 9.258 -0.785 1.00 0.00 H new ATOM 0 HA SER A 23 -12.108 11.603 -2.136 1.00 0.00 H new ATOM 0 HB2 SER A 23 -10.838 10.902 0.456 1.00 0.00 H new ATOM 0 HB3 SER A 23 -10.390 12.479 -0.164 1.00 0.00 H new ATOM 0 HG SER A 23 -12.316 12.558 1.126 1.00 0.00 H new ATOM 238 N ASP A 24 -8.943 10.744 -2.284 1.00 0.00 N ATOM 239 CA ASP A 24 -7.687 10.991 -2.980 1.00 0.00 C ATOM 240 C ASP A 24 -7.273 9.765 -3.789 1.00 0.00 C ATOM 241 O ASP A 24 -6.086 9.523 -4.006 1.00 0.00 O ATOM 242 CB ASP A 24 -6.589 11.356 -1.981 1.00 0.00 C ATOM 243 CG ASP A 24 -5.537 12.265 -2.585 1.00 0.00 C ATOM 244 OD1 ASP A 24 -5.914 13.309 -3.158 1.00 0.00 O ATOM 245 OD2 ASP A 24 -4.337 11.934 -2.485 1.00 0.00 O ATOM 0 H ASP A 24 -8.939 9.915 -1.690 1.00 0.00 H new ATOM 0 HA ASP A 24 -7.832 11.827 -3.664 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -7.036 11.847 -1.117 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -6.113 10.445 -1.619 1.00 0.00 H new ATOM 250 N ILE A 25 -8.263 8.995 -4.226 1.00 0.00 N ATOM 251 CA ILE A 25 -8.015 7.790 -5.008 1.00 0.00 C ATOM 252 C ILE A 25 -7.343 8.119 -6.337 1.00 0.00 C ATOM 253 O ILE A 25 -6.375 7.470 -6.730 1.00 0.00 O ATOM 254 CB ILE A 25 -9.325 7.015 -5.274 1.00 0.00 C ATOM 255 CG1 ILE A 25 -9.064 5.756 -6.109 1.00 0.00 C ATOM 256 CG2 ILE A 25 -10.336 7.913 -5.972 1.00 0.00 C ATOM 257 CD1 ILE A 25 -7.841 4.972 -5.684 1.00 0.00 C ATOM 0 H ILE A 25 -9.250 9.185 -4.051 1.00 0.00 H new ATOM 0 HA ILE A 25 -7.345 7.163 -4.420 1.00 0.00 H new ATOM 0 HB ILE A 25 -9.734 6.702 -4.313 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -9.937 5.106 -6.049 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -8.952 6.044 -7.154 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -11.254 7.355 -6.154 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -10.554 8.775 -5.341 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -9.925 8.254 -6.922 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -7.728 4.098 -6.325 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -6.956 5.602 -5.771 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -7.956 4.651 -4.649 1.00 0.00 H new ATOM 269 N GLN A 26 -7.860 9.130 -7.028 1.00 0.00 N ATOM 270 CA GLN A 26 -7.309 9.542 -8.316 1.00 0.00 C ATOM 271 C GLN A 26 -5.790 9.678 -8.250 1.00 0.00 C ATOM 272 O GLN A 26 -5.069 9.193 -9.124 1.00 0.00 O ATOM 273 CB GLN A 26 -7.930 10.868 -8.757 1.00 0.00 C ATOM 274 CG GLN A 26 -9.218 10.704 -9.547 1.00 0.00 C ATOM 275 CD GLN A 26 -9.035 10.981 -11.027 1.00 0.00 C ATOM 276 OE1 GLN A 26 -7.923 10.911 -11.550 1.00 0.00 O ATOM 277 NE2 GLN A 26 -10.130 11.296 -11.709 1.00 0.00 N ATOM 0 H GLN A 26 -8.661 9.680 -6.718 1.00 0.00 H new ATOM 0 HA GLN A 26 -7.552 8.770 -9.046 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -8.129 11.477 -7.875 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -7.208 11.413 -9.365 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -9.594 9.689 -9.415 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -9.974 11.379 -9.146 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -11.031 11.342 -11.234 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -10.070 11.492 -12.708 1.00 0.00 H new ATOM 286 N PHE A 27 -5.315 10.338 -7.202 1.00 0.00 N ATOM 287 CA PHE A 27 -3.884 10.547 -7.011 1.00 0.00 C ATOM 288 C PHE A 27 -3.150 9.216 -6.890 1.00 0.00 C ATOM 289 O PHE A 27 -2.233 8.930 -7.659 1.00 0.00 O ATOM 290 CB PHE A 27 -3.634 11.396 -5.763 1.00 0.00 C ATOM 291 CG PHE A 27 -2.325 12.134 -5.793 1.00 0.00 C ATOM 292 CD1 PHE A 27 -2.222 13.362 -6.423 1.00 0.00 C ATOM 293 CD2 PHE A 27 -1.199 11.598 -5.189 1.00 0.00 C ATOM 294 CE1 PHE A 27 -1.020 14.044 -6.452 1.00 0.00 C ATOM 295 CE2 PHE A 27 0.006 12.273 -5.215 1.00 0.00 C ATOM 296 CZ PHE A 27 0.095 13.498 -5.847 1.00 0.00 C ATOM 0 H PHE A 27 -5.900 10.739 -6.469 1.00 0.00 H new ATOM 0 HA PHE A 27 -3.500 11.074 -7.884 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -4.445 12.116 -5.654 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -3.659 10.752 -4.884 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -3.091 13.793 -6.898 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -1.264 10.641 -4.692 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -0.953 15.002 -6.947 1.00 0.00 H new ATOM 0 HE2 PHE A 27 0.877 11.844 -4.742 1.00 0.00 H new ATOM 0 HZ PHE A 27 1.036 14.028 -5.868 1.00 0.00 H new ATOM 306 N VAL A 28 -3.559 8.408 -5.918 1.00 0.00 N ATOM 307 CA VAL A 28 -2.939 7.108 -5.695 1.00 0.00 C ATOM 308 C VAL A 28 -2.999 6.248 -6.953 1.00 0.00 C ATOM 309 O VAL A 28 -1.970 5.820 -7.472 1.00 0.00 O ATOM 310 CB VAL A 28 -3.615 6.352 -4.534 1.00 0.00 C ATOM 311 CG1 VAL A 28 -2.780 5.150 -4.121 1.00 0.00 C ATOM 312 CG2 VAL A 28 -3.850 7.281 -3.350 1.00 0.00 C ATOM 0 H VAL A 28 -4.317 8.631 -5.273 1.00 0.00 H new ATOM 0 HA VAL A 28 -1.897 7.295 -5.436 1.00 0.00 H new ATOM 0 HB VAL A 28 -4.584 5.991 -4.878 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -3.273 4.629 -3.300 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.673 4.473 -4.968 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -1.795 5.485 -3.798 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -4.328 6.727 -2.542 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -2.896 7.677 -3.003 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -4.495 8.105 -3.656 1.00 0.00 H new ATOM 322 N GLN A 29 -4.207 5.997 -7.443 1.00 0.00 N ATOM 323 CA GLN A 29 -4.392 5.185 -8.639 1.00 0.00 C ATOM 324 C GLN A 29 -3.464 5.638 -9.766 1.00 0.00 C ATOM 325 O GLN A 29 -3.081 4.840 -10.622 1.00 0.00 O ATOM 326 CB GLN A 29 -5.851 5.250 -9.095 1.00 0.00 C ATOM 327 CG GLN A 29 -6.245 6.581 -9.718 1.00 0.00 C ATOM 328 CD GLN A 29 -7.579 6.517 -10.435 1.00 0.00 C ATOM 329 OE1 GLN A 29 -8.654 6.826 -9.717 1.00 0.00 O flip ATOM 330 NE2 GLN A 29 -7.644 6.191 -11.620 1.00 0.00 N flip ATOM 0 H GLN A 29 -5.073 6.344 -7.031 1.00 0.00 H new ATOM 0 HA GLN A 29 -4.139 4.154 -8.392 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -6.031 4.454 -9.818 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -6.498 5.055 -8.239 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.291 7.343 -8.940 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -5.473 6.891 -10.422 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -6.793 5.962 -12.133 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -8.549 6.150 -12.089 1.00 0.00 H new ATOM 339 N GLU A 30 -3.109 6.919 -9.762 1.00 0.00 N ATOM 340 CA GLU A 30 -2.230 7.472 -10.788 1.00 0.00 C ATOM 341 C GLU A 30 -0.791 6.991 -10.608 1.00 0.00 C ATOM 342 O GLU A 30 -0.174 6.480 -11.544 1.00 0.00 O ATOM 343 CB GLU A 30 -2.274 9.001 -10.756 1.00 0.00 C ATOM 344 CG GLU A 30 -1.995 9.644 -12.104 1.00 0.00 C ATOM 345 CD GLU A 30 -1.623 11.110 -11.984 1.00 0.00 C ATOM 346 OE1 GLU A 30 -0.439 11.403 -11.714 1.00 0.00 O ATOM 347 OE2 GLU A 30 -2.516 11.965 -12.161 1.00 0.00 O ATOM 0 H GLU A 30 -3.416 7.593 -9.061 1.00 0.00 H new ATOM 0 HA GLU A 30 -2.588 7.120 -11.756 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -3.255 9.321 -10.406 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -1.544 9.362 -10.032 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -1.186 9.107 -12.598 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -2.876 9.547 -12.738 1.00 0.00 H new ATOM 354 N MET A 31 -0.256 7.161 -9.404 1.00 0.00 N ATOM 355 CA MET A 31 1.115 6.743 -9.119 1.00 0.00 C ATOM 356 C MET A 31 1.228 5.222 -9.091 1.00 0.00 C ATOM 357 O MET A 31 2.153 4.652 -9.669 1.00 0.00 O ATOM 358 CB MET A 31 1.612 7.336 -7.794 1.00 0.00 C ATOM 359 CG MET A 31 0.533 7.489 -6.735 1.00 0.00 C ATOM 360 SD MET A 31 1.207 7.600 -5.068 1.00 0.00 S ATOM 361 CE MET A 31 0.726 6.003 -4.418 1.00 0.00 C ATOM 0 H MET A 31 -0.745 7.582 -8.614 1.00 0.00 H new ATOM 0 HA MET A 31 1.747 7.123 -9.922 1.00 0.00 H new ATOM 0 HB2 MET A 31 2.405 6.700 -7.399 1.00 0.00 H new ATOM 0 HB3 MET A 31 2.054 8.313 -7.990 1.00 0.00 H new ATOM 0 HG2 MET A 31 -0.053 8.383 -6.946 1.00 0.00 H new ATOM 0 HG3 MET A 31 -0.149 6.640 -6.791 1.00 0.00 H new ATOM 0 HE1 MET A 31 0.414 6.112 -3.379 1.00 0.00 H new ATOM 0 HE2 MET A 31 -0.101 5.605 -5.006 1.00 0.00 H new ATOM 0 HE3 MET A 31 1.572 5.318 -4.473 1.00 0.00 H new ATOM 371 N ILE A 32 0.284 4.568 -8.423 1.00 0.00 N ATOM 372 CA ILE A 32 0.287 3.112 -8.333 1.00 0.00 C ATOM 373 C ILE A 32 0.299 2.474 -9.718 1.00 0.00 C ATOM 374 O ILE A 32 1.188 1.686 -10.038 1.00 0.00 O ATOM 375 CB ILE A 32 -0.936 2.591 -7.542 1.00 0.00 C ATOM 376 CG1 ILE A 32 -0.982 3.215 -6.144 1.00 0.00 C ATOM 377 CG2 ILE A 32 -0.905 1.071 -7.441 1.00 0.00 C ATOM 378 CD1 ILE A 32 0.351 3.208 -5.426 1.00 0.00 C ATOM 0 H ILE A 32 -0.490 5.021 -7.937 1.00 0.00 H new ATOM 0 HA ILE A 32 1.196 2.831 -7.802 1.00 0.00 H new ATOM 0 HB ILE A 32 -1.837 2.883 -8.082 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -1.334 4.243 -6.227 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.712 2.676 -5.540 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.774 0.726 -6.881 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -0.923 0.639 -8.442 1.00 0.00 H new ATOM 0 HG23 ILE A 32 0.005 0.759 -6.928 1.00 0.00 H new ATOM 0 HD11 ILE A 32 0.237 3.666 -4.444 1.00 0.00 H new ATOM 0 HD12 ILE A 32 0.696 2.181 -5.310 1.00 0.00 H new ATOM 0 HD13 ILE A 32 1.080 3.772 -6.007 1.00 0.00 H new ATOM 390 N ARG A 33 -0.691 2.816 -10.536 1.00 0.00 N ATOM 391 CA ARG A 33 -0.786 2.270 -11.880 1.00 0.00 C ATOM 392 C ARG A 33 0.474 2.580 -12.684 1.00 0.00 C ATOM 393 O ARG A 33 0.896 1.786 -13.524 1.00 0.00 O ATOM 394 CB ARG A 33 -2.022 2.824 -12.590 1.00 0.00 C ATOM 395 CG ARG A 33 -1.901 4.286 -12.991 1.00 0.00 C ATOM 396 CD ARG A 33 -1.430 4.435 -14.428 1.00 0.00 C ATOM 397 NE ARG A 33 -1.394 5.835 -14.846 1.00 0.00 N ATOM 398 CZ ARG A 33 -0.661 6.288 -15.861 1.00 0.00 C ATOM 399 NH1 ARG A 33 0.092 5.456 -16.570 1.00 0.00 N ATOM 400 NH2 ARG A 33 -0.681 7.578 -16.169 1.00 0.00 N ATOM 0 H ARG A 33 -1.436 3.468 -10.290 1.00 0.00 H new ATOM 0 HA ARG A 33 -0.881 1.187 -11.803 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -2.214 2.228 -13.482 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -2.887 2.707 -11.937 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -2.866 4.778 -12.871 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -1.201 4.790 -12.324 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -0.436 3.999 -14.532 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -2.094 3.876 -15.088 1.00 0.00 H new ATOM 0 HE ARG A 33 -1.964 6.505 -14.330 1.00 0.00 H new ATOM 0 HH11 ARG A 33 0.112 4.463 -16.339 1.00 0.00 H new ATOM 0 HH12 ARG A 33 0.651 5.810 -17.346 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -1.258 8.223 -15.628 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -0.120 7.925 -16.946 1.00 0.00 H new ATOM 414 N GLN A 34 1.077 3.735 -12.416 1.00 0.00 N ATOM 415 CA GLN A 34 2.290 4.136 -13.114 1.00 0.00 C ATOM 416 C GLN A 34 3.504 3.420 -12.536 1.00 0.00 C ATOM 417 O GLN A 34 4.499 3.205 -13.228 1.00 0.00 O ATOM 418 CB GLN A 34 2.482 5.651 -13.026 1.00 0.00 C ATOM 419 CG GLN A 34 3.685 6.160 -13.803 1.00 0.00 C ATOM 420 CD GLN A 34 3.398 6.323 -15.282 1.00 0.00 C ATOM 421 OE1 GLN A 34 3.210 7.437 -15.771 1.00 0.00 O ATOM 422 NE2 GLN A 34 3.360 5.209 -16.005 1.00 0.00 N ATOM 0 H GLN A 34 0.745 4.406 -11.723 1.00 0.00 H new ATOM 0 HA GLN A 34 2.188 3.856 -14.162 1.00 0.00 H new ATOM 0 HB2 GLN A 34 1.584 6.144 -13.399 1.00 0.00 H new ATOM 0 HB3 GLN A 34 2.590 5.935 -11.979 1.00 0.00 H new ATOM 0 HG2 GLN A 34 4.000 7.118 -13.390 1.00 0.00 H new ATOM 0 HG3 GLN A 34 4.517 5.468 -13.672 1.00 0.00 H new ATOM 0 HE21 GLN A 34 3.522 4.306 -15.559 1.00 0.00 H new ATOM 0 HE22 GLN A 34 3.169 5.257 -17.006 1.00 0.00 H new ATOM 431 N LEU A 35 3.414 3.050 -11.263 1.00 0.00 N ATOM 432 CA LEU A 35 4.500 2.355 -10.590 1.00 0.00 C ATOM 433 C LEU A 35 4.624 0.926 -11.106 1.00 0.00 C ATOM 434 O LEU A 35 5.722 0.455 -11.406 1.00 0.00 O ATOM 435 CB LEU A 35 4.265 2.345 -9.079 1.00 0.00 C ATOM 436 CG LEU A 35 4.675 3.625 -8.353 1.00 0.00 C ATOM 437 CD1 LEU A 35 4.318 3.536 -6.877 1.00 0.00 C ATOM 438 CD2 LEU A 35 6.163 3.884 -8.529 1.00 0.00 C ATOM 0 H LEU A 35 2.597 3.221 -10.677 1.00 0.00 H new ATOM 0 HA LEU A 35 5.429 2.884 -10.802 1.00 0.00 H new ATOM 0 HB2 LEU A 35 3.207 2.162 -8.892 1.00 0.00 H new ATOM 0 HB3 LEU A 35 4.814 1.508 -8.647 1.00 0.00 H new ATOM 0 HG LEU A 35 4.128 4.461 -8.789 1.00 0.00 H new ATOM 0 HD11 LEU A 35 4.617 4.456 -6.374 1.00 0.00 H new ATOM 0 HD12 LEU A 35 3.242 3.397 -6.771 1.00 0.00 H new ATOM 0 HD13 LEU A 35 4.839 2.691 -6.427 1.00 0.00 H new ATOM 0 HD21 LEU A 35 6.437 4.800 -8.005 1.00 0.00 H new ATOM 0 HD22 LEU A 35 6.729 3.048 -8.119 1.00 0.00 H new ATOM 0 HD23 LEU A 35 6.391 3.990 -9.590 1.00 0.00 H new ATOM 450 N GLU A 36 3.490 0.241 -11.209 1.00 0.00 N ATOM 451 CA GLU A 36 3.470 -1.134 -11.691 1.00 0.00 C ATOM 452 C GLU A 36 3.883 -1.203 -13.157 1.00 0.00 C ATOM 453 O GLU A 36 4.672 -2.060 -13.549 1.00 0.00 O ATOM 454 CB GLU A 36 2.079 -1.746 -11.505 1.00 0.00 C ATOM 455 CG GLU A 36 0.969 -0.959 -12.182 1.00 0.00 C ATOM 456 CD GLU A 36 -0.393 -1.233 -11.572 1.00 0.00 C ATOM 457 OE1 GLU A 36 -0.441 -1.708 -10.419 1.00 0.00 O ATOM 458 OE2 GLU A 36 -1.409 -0.973 -12.250 1.00 0.00 O ATOM 0 H GLU A 36 2.573 0.616 -10.965 1.00 0.00 H new ATOM 0 HA GLU A 36 4.188 -1.708 -11.105 1.00 0.00 H new ATOM 0 HB2 GLU A 36 2.084 -2.762 -11.899 1.00 0.00 H new ATOM 0 HB3 GLU A 36 1.863 -1.818 -10.439 1.00 0.00 H new ATOM 0 HG2 GLU A 36 1.188 0.106 -12.111 1.00 0.00 H new ATOM 0 HG3 GLU A 36 0.945 -1.209 -13.243 1.00 0.00 H new ATOM 465 N GLN A 37 3.346 -0.290 -13.959 1.00 0.00 N ATOM 466 CA GLN A 37 3.660 -0.244 -15.377 1.00 0.00 C ATOM 467 C GLN A 37 5.151 -0.009 -15.598 1.00 0.00 C ATOM 468 O GLN A 37 5.752 -0.582 -16.507 1.00 0.00 O ATOM 469 CB GLN A 37 2.854 0.864 -16.053 1.00 0.00 C ATOM 470 CG GLN A 37 1.375 0.544 -16.182 1.00 0.00 C ATOM 471 CD GLN A 37 0.892 0.574 -17.619 1.00 0.00 C ATOM 472 OE1 GLN A 37 0.974 -0.424 -18.335 1.00 0.00 O ATOM 473 NE2 GLN A 37 0.386 1.725 -18.049 1.00 0.00 N ATOM 0 H GLN A 37 2.691 0.427 -13.648 1.00 0.00 H new ATOM 0 HA GLN A 37 3.395 -1.205 -15.818 1.00 0.00 H new ATOM 0 HB2 GLN A 37 2.970 1.786 -15.483 1.00 0.00 H new ATOM 0 HB3 GLN A 37 3.266 1.048 -17.045 1.00 0.00 H new ATOM 0 HG2 GLN A 37 1.183 -0.442 -15.759 1.00 0.00 H new ATOM 0 HG3 GLN A 37 0.800 1.260 -15.595 1.00 0.00 H new ATOM 0 HE21 GLN A 37 0.337 2.527 -17.421 1.00 0.00 H new ATOM 0 HE22 GLN A 37 0.046 1.806 -19.007 1.00 0.00 H new ATOM 482 N THR A 38 5.740 0.842 -14.764 1.00 0.00 N ATOM 483 CA THR A 38 7.161 1.155 -14.869 1.00 0.00 C ATOM 484 C THR A 38 7.946 0.519 -13.727 1.00 0.00 C ATOM 485 O THR A 38 8.134 1.128 -12.674 1.00 0.00 O ATOM 486 CB THR A 38 7.369 2.671 -14.864 1.00 0.00 C ATOM 487 OG1 THR A 38 6.387 3.315 -15.657 1.00 0.00 O ATOM 488 CG2 THR A 38 8.727 3.090 -15.386 1.00 0.00 C ATOM 0 H THR A 38 5.256 1.327 -14.008 1.00 0.00 H new ATOM 0 HA THR A 38 7.530 0.745 -15.809 1.00 0.00 H new ATOM 0 HB THR A 38 7.291 2.970 -13.819 1.00 0.00 H new ATOM 0 HG1 THR A 38 5.566 3.429 -15.133 1.00 0.00 H new ATOM 0 HG21 THR A 38 8.809 4.176 -15.356 1.00 0.00 H new ATOM 0 HG22 THR A 38 9.507 2.650 -14.765 1.00 0.00 H new ATOM 0 HG23 THR A 38 8.844 2.746 -16.414 1.00 0.00 H new ATOM 496 N ASN A 39 8.402 -0.711 -13.944 1.00 0.00 N ATOM 497 CA ASN A 39 9.168 -1.431 -12.934 1.00 0.00 C ATOM 498 C ASN A 39 9.615 -2.792 -13.461 1.00 0.00 C ATOM 499 O ASN A 39 9.242 -3.196 -14.561 1.00 0.00 O ATOM 500 CB ASN A 39 8.335 -1.608 -11.661 1.00 0.00 C ATOM 501 CG ASN A 39 9.077 -1.156 -10.417 1.00 0.00 C ATOM 502 OD1 ASN A 39 9.595 -0.041 -10.362 1.00 0.00 O ATOM 503 ND2 ASN A 39 9.131 -2.024 -9.414 1.00 0.00 N ATOM 0 H ASN A 39 8.254 -1.229 -14.810 1.00 0.00 H new ATOM 0 HA ASN A 39 10.056 -0.844 -12.697 1.00 0.00 H new ATOM 0 HB2 ASN A 39 7.409 -1.041 -11.754 1.00 0.00 H new ATOM 0 HB3 ASN A 39 8.058 -2.657 -11.554 1.00 0.00 H new ATOM 0 HD21 ASN A 39 9.617 -1.777 -8.552 1.00 0.00 H new ATOM 0 HD22 ASN A 39 8.686 -2.937 -9.506 1.00 0.00 H new ATOM 510 N TYR A 40 10.418 -3.494 -12.666 1.00 0.00 N ATOM 511 CA TYR A 40 10.916 -4.809 -13.052 1.00 0.00 C ATOM 512 C TYR A 40 9.782 -5.827 -13.099 1.00 0.00 C ATOM 513 O TYR A 40 9.544 -6.458 -14.129 1.00 0.00 O ATOM 514 CB TYR A 40 11.994 -5.276 -12.073 1.00 0.00 C ATOM 515 CG TYR A 40 13.030 -4.220 -11.760 1.00 0.00 C ATOM 516 CD1 TYR A 40 13.927 -3.791 -12.730 1.00 0.00 C ATOM 517 CD2 TYR A 40 13.111 -3.652 -10.494 1.00 0.00 C ATOM 518 CE1 TYR A 40 14.876 -2.827 -12.448 1.00 0.00 C ATOM 519 CE2 TYR A 40 14.057 -2.688 -10.205 1.00 0.00 C ATOM 520 CZ TYR A 40 14.938 -2.278 -11.184 1.00 0.00 C ATOM 521 OH TYR A 40 15.881 -1.320 -10.899 1.00 0.00 O ATOM 0 H TYR A 40 10.737 -3.174 -11.752 1.00 0.00 H new ATOM 0 HA TYR A 40 11.350 -4.728 -14.049 1.00 0.00 H new ATOM 0 HB2 TYR A 40 11.517 -5.591 -11.145 1.00 0.00 H new ATOM 0 HB3 TYR A 40 12.494 -6.151 -12.488 1.00 0.00 H new ATOM 0 HD1 TYR A 40 13.882 -4.218 -13.721 1.00 0.00 H new ATOM 0 HD2 TYR A 40 12.423 -3.969 -9.724 1.00 0.00 H new ATOM 0 HE1 TYR A 40 15.566 -2.505 -13.214 1.00 0.00 H new ATOM 0 HE2 TYR A 40 14.107 -2.257 -9.216 1.00 0.00 H new ATOM 0 HH TYR A 40 15.788 -1.037 -9.965 1.00 0.00 H new ATOM 531 N ARG A 41 9.085 -5.981 -11.977 1.00 0.00 N ATOM 532 CA ARG A 41 7.975 -6.923 -11.889 1.00 0.00 C ATOM 533 C ARG A 41 7.114 -6.633 -10.664 1.00 0.00 C ATOM 534 O ARG A 41 7.067 -7.425 -9.722 1.00 0.00 O ATOM 535 CB ARG A 41 8.503 -8.358 -11.833 1.00 0.00 C ATOM 536 CG ARG A 41 9.515 -8.591 -10.725 1.00 0.00 C ATOM 537 CD ARG A 41 10.578 -9.594 -11.144 1.00 0.00 C ATOM 538 NE ARG A 41 11.523 -9.872 -10.065 1.00 0.00 N ATOM 539 CZ ARG A 41 12.471 -9.023 -9.674 1.00 0.00 C ATOM 540 NH1 ARG A 41 12.601 -7.843 -10.268 1.00 0.00 N ATOM 541 NH2 ARG A 41 13.290 -9.354 -8.685 1.00 0.00 N ATOM 0 H ARG A 41 9.270 -5.465 -11.116 1.00 0.00 H new ATOM 0 HA ARG A 41 7.357 -6.807 -12.779 1.00 0.00 H new ATOM 0 HB2 ARG A 41 7.664 -9.040 -11.696 1.00 0.00 H new ATOM 0 HB3 ARG A 41 8.962 -8.605 -12.790 1.00 0.00 H new ATOM 0 HG2 ARG A 41 9.989 -7.646 -10.459 1.00 0.00 H new ATOM 0 HG3 ARG A 41 9.003 -8.953 -9.833 1.00 0.00 H new ATOM 0 HD2 ARG A 41 10.098 -10.522 -11.454 1.00 0.00 H new ATOM 0 HD3 ARG A 41 11.118 -9.210 -12.009 1.00 0.00 H new ATOM 0 HE ARG A 41 11.452 -10.768 -9.583 1.00 0.00 H new ATOM 0 HH11 ARG A 41 11.973 -7.583 -11.028 1.00 0.00 H new ATOM 0 HH12 ARG A 41 13.329 -7.197 -9.964 1.00 0.00 H new ATOM 0 HH21 ARG A 41 13.194 -10.259 -8.224 1.00 0.00 H new ATOM 0 HH22 ARG A 41 14.016 -8.704 -8.385 1.00 0.00 H new ATOM 555 N LEU A 42 6.436 -5.491 -10.683 1.00 0.00 N ATOM 556 CA LEU A 42 5.576 -5.094 -9.574 1.00 0.00 C ATOM 557 C LEU A 42 4.120 -5.447 -9.860 1.00 0.00 C ATOM 558 O LEU A 42 3.562 -5.046 -10.882 1.00 0.00 O ATOM 559 CB LEU A 42 5.708 -3.593 -9.310 1.00 0.00 C ATOM 560 CG LEU A 42 5.220 -3.132 -7.936 1.00 0.00 C ATOM 561 CD1 LEU A 42 6.360 -3.147 -6.930 1.00 0.00 C ATOM 562 CD2 LEU A 42 4.608 -1.741 -8.028 1.00 0.00 C ATOM 0 H LEU A 42 6.465 -4.824 -11.454 1.00 0.00 H new ATOM 0 HA LEU A 42 5.895 -5.641 -8.687 1.00 0.00 H new ATOM 0 HB2 LEU A 42 6.755 -3.311 -9.420 1.00 0.00 H new ATOM 0 HB3 LEU A 42 5.150 -3.054 -10.076 1.00 0.00 H new ATOM 0 HG LEU A 42 4.452 -3.826 -7.594 1.00 0.00 H new ATOM 0 HD11 LEU A 42 5.993 -2.816 -5.959 1.00 0.00 H new ATOM 0 HD12 LEU A 42 6.755 -4.159 -6.843 1.00 0.00 H new ATOM 0 HD13 LEU A 42 7.151 -2.477 -7.266 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.266 -1.428 -7.042 1.00 0.00 H new ATOM 0 HD22 LEU A 42 5.357 -1.038 -8.392 1.00 0.00 H new ATOM 0 HD23 LEU A 42 3.763 -1.760 -8.716 1.00 0.00 H new ATOM 574 N LYS A 43 3.510 -6.199 -8.950 1.00 0.00 N ATOM 575 CA LYS A 43 2.118 -6.609 -9.101 1.00 0.00 C ATOM 576 C LYS A 43 1.296 -6.183 -7.889 1.00 0.00 C ATOM 577 O LYS A 43 1.214 -6.905 -6.896 1.00 0.00 O ATOM 578 CB LYS A 43 2.030 -8.125 -9.286 1.00 0.00 C ATOM 579 CG LYS A 43 3.046 -8.679 -10.274 1.00 0.00 C ATOM 580 CD LYS A 43 2.575 -8.515 -11.712 1.00 0.00 C ATOM 581 CE LYS A 43 3.379 -7.454 -12.448 1.00 0.00 C ATOM 582 NZ LYS A 43 3.679 -7.860 -13.850 1.00 0.00 N ATOM 0 H LYS A 43 3.958 -6.538 -8.099 1.00 0.00 H new ATOM 0 HA LYS A 43 1.711 -6.119 -9.985 1.00 0.00 H new ATOM 0 HB2 LYS A 43 2.174 -8.609 -8.320 1.00 0.00 H new ATOM 0 HB3 LYS A 43 1.027 -8.383 -9.626 1.00 0.00 H new ATOM 0 HG2 LYS A 43 3.999 -8.167 -10.142 1.00 0.00 H new ATOM 0 HG3 LYS A 43 3.219 -9.735 -10.065 1.00 0.00 H new ATOM 0 HD2 LYS A 43 2.664 -9.467 -12.235 1.00 0.00 H new ATOM 0 HD3 LYS A 43 1.519 -8.243 -11.721 1.00 0.00 H new ATOM 0 HE2 LYS A 43 2.824 -6.516 -12.452 1.00 0.00 H new ATOM 0 HE3 LYS A 43 4.312 -7.270 -11.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 4.228 -7.111 -14.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 4.230 -8.742 -13.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 2.789 -8.011 -14.366 1.00 0.00 H new ATOM 596 N LEU A 44 0.690 -5.003 -7.978 1.00 0.00 N ATOM 597 CA LEU A 44 -0.125 -4.480 -6.888 1.00 0.00 C ATOM 598 C LEU A 44 -1.601 -4.783 -7.118 1.00 0.00 C ATOM 599 O LEU A 44 -2.007 -5.131 -8.228 1.00 0.00 O ATOM 600 CB LEU A 44 0.087 -2.973 -6.745 1.00 0.00 C ATOM 601 CG LEU A 44 1.252 -2.571 -5.838 1.00 0.00 C ATOM 602 CD1 LEU A 44 1.913 -1.301 -6.350 1.00 0.00 C ATOM 603 CD2 LEU A 44 0.771 -2.381 -4.409 1.00 0.00 C ATOM 0 H LEU A 44 0.748 -4.392 -8.793 1.00 0.00 H new ATOM 0 HA LEU A 44 0.185 -4.971 -5.966 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.253 -2.548 -7.735 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.828 -2.527 -6.356 1.00 0.00 H new ATOM 0 HG LEU A 44 1.991 -3.372 -5.850 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.739 -1.030 -5.693 1.00 0.00 H new ATOM 0 HD12 LEU A 44 2.292 -1.469 -7.358 1.00 0.00 H new ATOM 0 HD13 LEU A 44 1.183 -0.492 -6.367 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.612 -2.095 -3.777 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.014 -1.598 -4.381 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.342 -3.314 -4.042 1.00 0.00 H new ATOM 615 N CYS A 45 -2.402 -4.652 -6.065 1.00 0.00 N ATOM 616 CA CYS A 45 -3.836 -4.916 -6.160 1.00 0.00 C ATOM 617 C CYS A 45 -4.631 -3.976 -5.262 1.00 0.00 C ATOM 618 O CYS A 45 -4.068 -3.306 -4.399 1.00 0.00 O ATOM 619 CB CYS A 45 -4.131 -6.369 -5.790 1.00 0.00 C ATOM 620 SG CYS A 45 -3.896 -7.545 -7.161 1.00 0.00 S ATOM 0 H CYS A 45 -2.085 -4.366 -5.139 1.00 0.00 H new ATOM 0 HA CYS A 45 -4.143 -4.740 -7.191 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -3.486 -6.660 -4.961 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -5.159 -6.441 -5.435 1.00 0.00 H new ATOM 0 HG CYS A 45 -3.307 -8.616 -6.718 1.00 0.00 H new ATOM 625 N VAL A 46 -5.945 -3.928 -5.471 1.00 0.00 N ATOM 626 CA VAL A 46 -6.813 -3.066 -4.678 1.00 0.00 C ATOM 627 C VAL A 46 -8.111 -3.778 -4.302 1.00 0.00 C ATOM 628 O VAL A 46 -8.481 -4.780 -4.915 1.00 0.00 O ATOM 629 CB VAL A 46 -7.142 -1.756 -5.430 1.00 0.00 C ATOM 630 CG1 VAL A 46 -5.860 -1.069 -5.884 1.00 0.00 C ATOM 631 CG2 VAL A 46 -8.060 -2.022 -6.619 1.00 0.00 C ATOM 0 H VAL A 46 -6.430 -4.476 -6.182 1.00 0.00 H new ATOM 0 HA VAL A 46 -6.269 -2.822 -3.765 1.00 0.00 H new ATOM 0 HB VAL A 46 -7.668 -1.093 -4.743 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -6.108 -0.148 -6.412 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -5.245 -0.835 -5.015 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -5.308 -1.732 -6.550 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -8.275 -1.083 -7.130 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -7.570 -2.707 -7.311 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -8.992 -2.466 -6.267 1.00 0.00 H new ATOM 641 N SER A 47 -8.801 -3.255 -3.290 1.00 0.00 N ATOM 642 CA SER A 47 -10.056 -3.840 -2.834 1.00 0.00 C ATOM 643 C SER A 47 -10.984 -2.770 -2.266 1.00 0.00 C ATOM 644 O SER A 47 -10.592 -1.999 -1.390 1.00 0.00 O ATOM 645 CB SER A 47 -9.792 -4.913 -1.775 1.00 0.00 C ATOM 646 OG SER A 47 -9.306 -6.106 -2.364 1.00 0.00 O ATOM 0 H SER A 47 -8.510 -2.426 -2.771 1.00 0.00 H new ATOM 0 HA SER A 47 -10.543 -4.300 -3.694 1.00 0.00 H new ATOM 0 HB2 SER A 47 -9.068 -4.541 -1.050 1.00 0.00 H new ATOM 0 HB3 SER A 47 -10.712 -5.123 -1.229 1.00 0.00 H new ATOM 0 HG SER A 47 -9.648 -6.182 -3.279 1.00 0.00 H new ATOM 652 N ASP A 48 -12.213 -2.730 -2.769 1.00 0.00 N ATOM 653 CA ASP A 48 -13.198 -1.755 -2.309 1.00 0.00 C ATOM 654 C ASP A 48 -14.514 -1.912 -3.066 1.00 0.00 C ATOM 655 O ASP A 48 -14.597 -2.664 -4.037 1.00 0.00 O ATOM 656 CB ASP A 48 -12.662 -0.332 -2.485 1.00 0.00 C ATOM 657 CG ASP A 48 -12.141 0.254 -1.186 1.00 0.00 C ATOM 658 OD1 ASP A 48 -12.815 0.087 -0.148 1.00 0.00 O ATOM 659 OD2 ASP A 48 -11.060 0.878 -1.208 1.00 0.00 O ATOM 0 H ASP A 48 -12.552 -3.361 -3.495 1.00 0.00 H new ATOM 0 HA ASP A 48 -13.384 -1.937 -1.250 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -11.862 -0.337 -3.225 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -13.454 0.306 -2.876 1.00 0.00 H new ATOM 664 N ARG A 49 -15.538 -1.197 -2.613 1.00 0.00 N ATOM 665 CA ARG A 49 -16.851 -1.254 -3.248 1.00 0.00 C ATOM 666 C ARG A 49 -17.029 -0.103 -4.233 1.00 0.00 C ATOM 667 O ARG A 49 -17.396 1.006 -3.845 1.00 0.00 O ATOM 668 CB ARG A 49 -17.955 -1.211 -2.190 1.00 0.00 C ATOM 669 CG ARG A 49 -17.876 0.003 -1.277 1.00 0.00 C ATOM 670 CD ARG A 49 -17.796 -0.400 0.187 1.00 0.00 C ATOM 671 NE ARG A 49 -19.104 -0.367 0.837 1.00 0.00 N ATOM 672 CZ ARG A 49 -19.287 -0.540 2.144 1.00 0.00 C ATOM 673 NH1 ARG A 49 -18.251 -0.757 2.944 1.00 0.00 N ATOM 674 NH2 ARG A 49 -20.511 -0.494 2.653 1.00 0.00 N ATOM 0 H ARG A 49 -15.485 -0.571 -1.809 1.00 0.00 H new ATOM 0 HA ARG A 49 -16.921 -2.193 -3.797 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -18.925 -1.218 -2.688 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -17.901 -2.115 -1.584 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -17.002 0.599 -1.539 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -18.751 0.634 -1.434 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -17.378 -1.404 0.264 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -17.114 0.270 0.711 1.00 0.00 H new ATOM 0 HE ARG A 49 -19.925 -0.202 0.255 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -17.307 -0.792 2.558 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -18.398 -0.889 3.945 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -21.311 -0.326 2.043 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -20.652 -0.626 3.654 1.00 0.00 H new ATOM 688 N ASP A 50 -16.761 -0.373 -5.506 1.00 0.00 N ATOM 689 CA ASP A 50 -16.889 0.641 -6.547 1.00 0.00 C ATOM 690 C ASP A 50 -15.975 1.827 -6.262 1.00 0.00 C ATOM 691 O ASP A 50 -16.240 2.629 -5.364 1.00 0.00 O ATOM 692 CB ASP A 50 -18.341 1.115 -6.650 1.00 0.00 C ATOM 693 CG ASP A 50 -18.767 1.363 -8.085 1.00 0.00 C ATOM 694 OD1 ASP A 50 -18.556 0.467 -8.929 1.00 0.00 O ATOM 695 OD2 ASP A 50 -19.308 2.453 -8.363 1.00 0.00 O ATOM 0 H ASP A 50 -16.454 -1.286 -5.842 1.00 0.00 H new ATOM 0 HA ASP A 50 -16.592 0.194 -7.496 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -18.997 0.368 -6.203 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -18.463 2.032 -6.074 1.00 0.00 H new ATOM 700 N VAL A 51 -14.894 1.935 -7.030 1.00 0.00 N ATOM 701 CA VAL A 51 -13.940 3.025 -6.856 1.00 0.00 C ATOM 702 C VAL A 51 -13.238 3.365 -8.168 1.00 0.00 C ATOM 703 O VAL A 51 -13.072 4.537 -8.505 1.00 0.00 O ATOM 704 CB VAL A 51 -12.879 2.680 -5.794 1.00 0.00 C ATOM 705 CG1 VAL A 51 -12.023 3.897 -5.481 1.00 0.00 C ATOM 706 CG2 VAL A 51 -13.541 2.144 -4.533 1.00 0.00 C ATOM 0 H VAL A 51 -14.658 1.282 -7.777 1.00 0.00 H new ATOM 0 HA VAL A 51 -14.512 3.890 -6.521 1.00 0.00 H new ATOM 0 HB VAL A 51 -12.229 1.901 -6.194 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -11.279 3.635 -4.729 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -11.520 4.231 -6.388 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -12.656 4.699 -5.101 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -12.776 1.906 -3.794 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -14.215 2.898 -4.127 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -14.106 1.244 -4.773 1.00 0.00 H new ATOM 716 N LEU A 52 -12.825 2.335 -8.901 1.00 0.00 N ATOM 717 CA LEU A 52 -12.140 2.535 -10.173 1.00 0.00 C ATOM 718 C LEU A 52 -12.883 1.851 -11.324 1.00 0.00 C ATOM 719 O LEU A 52 -12.278 1.141 -12.127 1.00 0.00 O ATOM 720 CB LEU A 52 -10.708 1.997 -10.090 1.00 0.00 C ATOM 721 CG LEU A 52 -9.686 2.968 -9.491 1.00 0.00 C ATOM 722 CD1 LEU A 52 -9.070 2.387 -8.226 1.00 0.00 C ATOM 723 CD2 LEU A 52 -8.601 3.297 -10.509 1.00 0.00 C ATOM 0 H LEU A 52 -12.952 1.358 -8.637 1.00 0.00 H new ATOM 0 HA LEU A 52 -12.117 3.606 -10.373 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -10.713 1.084 -9.494 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -10.381 1.721 -11.092 1.00 0.00 H new ATOM 0 HG LEU A 52 -10.204 3.890 -9.228 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -8.347 3.092 -7.816 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -9.854 2.203 -7.491 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -8.568 1.449 -8.463 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -7.884 3.988 -10.066 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -8.088 2.381 -10.803 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -9.054 3.757 -11.387 1.00 0.00 H new ATOM 735 N PRO A 53 -14.211 2.056 -11.425 1.00 0.00 N ATOM 736 CA PRO A 53 -15.020 1.454 -12.489 1.00 0.00 C ATOM 737 C PRO A 53 -14.888 2.200 -13.813 1.00 0.00 C ATOM 738 O PRO A 53 -15.704 3.064 -14.133 1.00 0.00 O ATOM 739 CB PRO A 53 -16.440 1.584 -11.949 1.00 0.00 C ATOM 740 CG PRO A 53 -16.407 2.827 -11.129 1.00 0.00 C ATOM 741 CD PRO A 53 -15.030 2.886 -10.518 1.00 0.00 C ATOM 0 HA PRO A 53 -14.716 0.431 -12.709 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -17.168 1.659 -12.757 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -16.719 0.718 -11.348 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -16.598 3.706 -11.745 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -17.176 2.805 -10.357 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -14.658 3.909 -10.466 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -15.025 2.493 -9.501 1.00 0.00 H new ATOM 749 N GLY A 54 -13.856 1.862 -14.578 1.00 0.00 N ATOM 750 CA GLY A 54 -13.645 2.515 -15.857 1.00 0.00 C ATOM 751 C GLY A 54 -12.304 2.174 -16.480 1.00 0.00 C ATOM 752 O GLY A 54 -11.339 1.881 -15.775 1.00 0.00 O ATOM 0 H GLY A 54 -13.165 1.151 -14.337 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -14.442 2.227 -16.542 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -13.714 3.595 -15.724 1.00 0.00 H new ATOM 756 N THR A 55 -12.249 2.213 -17.809 1.00 0.00 N ATOM 757 CA THR A 55 -11.024 1.908 -18.539 1.00 0.00 C ATOM 758 C THR A 55 -10.483 0.527 -18.159 1.00 0.00 C ATOM 759 O THR A 55 -10.827 -0.473 -18.789 1.00 0.00 O ATOM 760 CB THR A 55 -9.971 2.993 -18.283 1.00 0.00 C ATOM 761 OG1 THR A 55 -10.408 4.243 -18.787 1.00 0.00 O ATOM 762 CG2 THR A 55 -8.626 2.692 -18.911 1.00 0.00 C ATOM 0 H THR A 55 -13.042 2.454 -18.403 1.00 0.00 H new ATOM 0 HA THR A 55 -11.257 1.891 -19.604 1.00 0.00 H new ATOM 0 HB THR A 55 -9.847 3.021 -17.200 1.00 0.00 H new ATOM 0 HG1 THR A 55 -9.724 4.923 -18.613 1.00 0.00 H new ATOM 0 HG21 THR A 55 -7.931 3.502 -18.689 1.00 0.00 H new ATOM 0 HG22 THR A 55 -8.236 1.758 -18.506 1.00 0.00 H new ATOM 0 HG23 THR A 55 -8.741 2.599 -19.991 1.00 0.00 H new ATOM 770 N CYS A 56 -9.639 0.474 -17.128 1.00 0.00 N ATOM 771 CA CYS A 56 -9.059 -0.787 -16.673 1.00 0.00 C ATOM 772 C CYS A 56 -7.953 -0.535 -15.654 1.00 0.00 C ATOM 773 O CYS A 56 -7.132 0.366 -15.823 1.00 0.00 O ATOM 774 CB CYS A 56 -8.498 -1.583 -17.856 1.00 0.00 C ATOM 775 SG CYS A 56 -7.570 -0.588 -19.047 1.00 0.00 S ATOM 0 H CYS A 56 -9.343 1.290 -16.593 1.00 0.00 H new ATOM 0 HA CYS A 56 -9.851 -1.367 -16.199 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -7.849 -2.371 -17.474 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -9.323 -2.073 -18.374 1.00 0.00 H new ATOM 0 HG CYS A 56 -7.137 -1.351 -20.006 1.00 0.00 H new ATOM 781 N VAL A 57 -7.935 -1.340 -14.596 1.00 0.00 N ATOM 782 CA VAL A 57 -6.929 -1.204 -13.551 1.00 0.00 C ATOM 783 C VAL A 57 -6.739 -2.514 -12.796 1.00 0.00 C ATOM 784 O VAL A 57 -7.485 -3.472 -12.997 1.00 0.00 O ATOM 785 CB VAL A 57 -7.303 -0.097 -12.546 1.00 0.00 C ATOM 786 CG1 VAL A 57 -7.035 1.278 -13.139 1.00 0.00 C ATOM 787 CG2 VAL A 57 -8.758 -0.229 -12.122 1.00 0.00 C ATOM 0 H VAL A 57 -8.606 -2.093 -14.441 1.00 0.00 H new ATOM 0 HA VAL A 57 -5.997 -0.933 -14.047 1.00 0.00 H new ATOM 0 HB VAL A 57 -6.679 -0.212 -11.660 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -7.305 2.046 -12.414 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -5.977 1.368 -13.385 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -7.630 1.407 -14.043 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -9.003 0.561 -11.412 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -9.401 -0.143 -12.998 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -8.913 -1.200 -11.652 1.00 0.00 H new ATOM 797 N TRP A 58 -5.737 -2.546 -11.924 1.00 0.00 N ATOM 798 CA TRP A 58 -5.444 -3.729 -11.133 1.00 0.00 C ATOM 799 C TRP A 58 -6.363 -3.804 -9.919 1.00 0.00 C ATOM 800 O TRP A 58 -6.323 -2.938 -9.046 1.00 0.00 O ATOM 801 CB TRP A 58 -3.981 -3.704 -10.690 1.00 0.00 C ATOM 802 CG TRP A 58 -3.279 -5.006 -10.895 1.00 0.00 C ATOM 803 CD1 TRP A 58 -3.668 -6.219 -10.418 1.00 0.00 C ATOM 804 CD2 TRP A 58 -2.071 -5.228 -11.630 1.00 0.00 C ATOM 805 NE1 TRP A 58 -2.773 -7.189 -10.805 1.00 0.00 N ATOM 806 CE2 TRP A 58 -1.784 -6.604 -11.551 1.00 0.00 C ATOM 807 CE3 TRP A 58 -1.204 -4.400 -12.347 1.00 0.00 C ATOM 808 CZ2 TRP A 58 -0.668 -7.169 -12.163 1.00 0.00 C ATOM 809 CZ3 TRP A 58 -0.096 -4.961 -12.953 1.00 0.00 C ATOM 810 CH2 TRP A 58 0.164 -6.334 -12.859 1.00 0.00 C ATOM 0 H TRP A 58 -5.112 -1.759 -11.749 1.00 0.00 H new ATOM 0 HA TRP A 58 -5.617 -4.613 -11.746 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -3.455 -2.925 -11.242 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -3.933 -3.435 -9.635 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -4.551 -6.395 -9.822 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -2.835 -8.181 -10.575 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -1.396 -3.340 -12.426 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -0.466 -8.228 -12.091 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 0.581 -4.330 -13.509 1.00 0.00 H new ATOM 0 HH2 TRP A 58 1.038 -6.742 -13.345 1.00 0.00 H new ATOM 821 N SER A 59 -7.197 -4.839 -9.871 1.00 0.00 N ATOM 822 CA SER A 59 -8.129 -5.015 -8.763 1.00 0.00 C ATOM 823 C SER A 59 -8.083 -6.442 -8.221 1.00 0.00 C ATOM 824 O SER A 59 -7.611 -7.358 -8.893 1.00 0.00 O ATOM 825 CB SER A 59 -9.552 -4.671 -9.209 1.00 0.00 C ATOM 826 OG SER A 59 -10.203 -3.853 -8.252 1.00 0.00 O ATOM 0 H SER A 59 -7.246 -5.566 -10.585 1.00 0.00 H new ATOM 0 HA SER A 59 -7.829 -4.338 -7.963 1.00 0.00 H new ATOM 0 HB2 SER A 59 -9.521 -4.158 -10.170 1.00 0.00 H new ATOM 0 HB3 SER A 59 -10.122 -5.588 -9.356 1.00 0.00 H new ATOM 0 HG SER A 59 -11.110 -3.646 -8.561 1.00 0.00 H new ATOM 832 N ILE A 60 -8.578 -6.615 -7.000 1.00 0.00 N ATOM 833 CA ILE A 60 -8.598 -7.925 -6.357 1.00 0.00 C ATOM 834 C ILE A 60 -9.537 -7.924 -5.152 1.00 0.00 C ATOM 835 O ILE A 60 -9.882 -6.867 -4.626 1.00 0.00 O ATOM 836 CB ILE A 60 -7.178 -8.347 -5.906 1.00 0.00 C ATOM 837 CG1 ILE A 60 -7.005 -9.866 -6.044 1.00 0.00 C ATOM 838 CG2 ILE A 60 -6.901 -7.892 -4.475 1.00 0.00 C ATOM 839 CD1 ILE A 60 -5.899 -10.443 -5.183 1.00 0.00 C ATOM 0 H ILE A 60 -8.972 -5.863 -6.434 1.00 0.00 H new ATOM 0 HA ILE A 60 -8.961 -8.644 -7.092 1.00 0.00 H new ATOM 0 HB ILE A 60 -6.451 -7.858 -6.555 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -7.945 -10.353 -5.784 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -6.800 -10.104 -7.088 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -5.897 -8.201 -4.183 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.978 -6.806 -4.417 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -7.630 -8.344 -3.802 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -5.842 -11.520 -5.338 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -4.948 -9.986 -5.457 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -6.111 -10.238 -4.134 1.00 0.00 H new ATOM 851 N ALA A 61 -9.931 -9.112 -4.709 1.00 0.00 N ATOM 852 CA ALA A 61 -10.809 -9.238 -3.555 1.00 0.00 C ATOM 853 C ALA A 61 -10.017 -9.049 -2.265 1.00 0.00 C ATOM 854 O ALA A 61 -8.886 -9.519 -2.150 1.00 0.00 O ATOM 855 CB ALA A 61 -11.508 -10.590 -3.564 1.00 0.00 C ATOM 0 H ALA A 61 -9.657 -9.999 -5.131 1.00 0.00 H new ATOM 0 HA ALA A 61 -11.570 -8.460 -3.609 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -12.161 -10.668 -2.694 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -12.102 -10.687 -4.473 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.763 -11.385 -3.531 1.00 0.00 H new ATOM 861 N SER A 62 -10.610 -8.351 -1.305 1.00 0.00 N ATOM 862 CA SER A 62 -9.948 -8.092 -0.031 1.00 0.00 C ATOM 863 C SER A 62 -9.633 -9.387 0.718 1.00 0.00 C ATOM 864 O SER A 62 -8.838 -9.387 1.658 1.00 0.00 O ATOM 865 CB SER A 62 -10.818 -7.184 0.842 1.00 0.00 C ATOM 866 OG SER A 62 -10.033 -6.475 1.783 1.00 0.00 O ATOM 0 H SER A 62 -11.546 -7.954 -1.383 1.00 0.00 H new ATOM 0 HA SER A 62 -9.004 -7.593 -0.247 1.00 0.00 H new ATOM 0 HB2 SER A 62 -11.360 -6.479 0.211 1.00 0.00 H new ATOM 0 HB3 SER A 62 -11.564 -7.783 1.364 1.00 0.00 H new ATOM 0 HG SER A 62 -10.613 -5.902 2.327 1.00 0.00 H new ATOM 872 N GLU A 63 -10.260 -10.484 0.307 1.00 0.00 N ATOM 873 CA GLU A 63 -10.039 -11.773 0.951 1.00 0.00 C ATOM 874 C GLU A 63 -8.824 -12.489 0.362 1.00 0.00 C ATOM 875 O GLU A 63 -8.314 -13.445 0.947 1.00 0.00 O ATOM 876 CB GLU A 63 -11.280 -12.655 0.807 1.00 0.00 C ATOM 877 CG GLU A 63 -11.813 -12.728 -0.614 1.00 0.00 C ATOM 878 CD GLU A 63 -12.299 -14.116 -0.984 1.00 0.00 C ATOM 879 OE1 GLU A 63 -11.478 -15.057 -0.964 1.00 0.00 O ATOM 880 OE2 GLU A 63 -13.501 -14.261 -1.294 1.00 0.00 O ATOM 0 H GLU A 63 -10.924 -10.506 -0.467 1.00 0.00 H new ATOM 0 HA GLU A 63 -9.846 -11.588 2.008 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -11.041 -13.662 1.149 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.064 -12.274 1.461 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -12.632 -12.018 -0.728 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -11.029 -12.424 -1.308 1.00 0.00 H new ATOM 887 N LEU A 64 -8.368 -12.032 -0.802 1.00 0.00 N ATOM 888 CA LEU A 64 -7.229 -12.636 -1.464 1.00 0.00 C ATOM 889 C LEU A 64 -5.932 -11.898 -1.134 1.00 0.00 C ATOM 890 O LEU A 64 -4.855 -12.298 -1.575 1.00 0.00 O ATOM 891 CB LEU A 64 -7.450 -12.645 -2.975 1.00 0.00 C ATOM 892 CG LEU A 64 -8.911 -12.699 -3.420 1.00 0.00 C ATOM 893 CD1 LEU A 64 -9.005 -12.780 -4.937 1.00 0.00 C ATOM 894 CD2 LEU A 64 -9.617 -13.881 -2.778 1.00 0.00 C ATOM 0 H LEU A 64 -8.776 -11.242 -1.303 1.00 0.00 H new ATOM 0 HA LEU A 64 -7.135 -13.660 -1.101 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -6.991 -11.752 -3.398 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -6.927 -13.503 -3.397 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.405 -11.783 -3.095 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -10.053 -12.818 -5.235 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -8.534 -11.902 -5.378 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -8.496 -13.679 -5.286 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -10.657 -13.905 -3.105 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -9.122 -14.806 -3.074 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -9.580 -13.781 -1.693 1.00 0.00 H new ATOM 906 N ILE A 65 -6.038 -10.817 -0.365 1.00 0.00 N ATOM 907 CA ILE A 65 -4.868 -10.034 0.007 1.00 0.00 C ATOM 908 C ILE A 65 -3.979 -10.795 0.985 1.00 0.00 C ATOM 909 O ILE A 65 -2.854 -11.169 0.656 1.00 0.00 O ATOM 910 CB ILE A 65 -5.267 -8.686 0.643 1.00 0.00 C ATOM 911 CG1 ILE A 65 -6.304 -7.970 -0.224 1.00 0.00 C ATOM 912 CG2 ILE A 65 -4.040 -7.810 0.840 1.00 0.00 C ATOM 913 CD1 ILE A 65 -6.789 -6.667 0.370 1.00 0.00 C ATOM 0 H ILE A 65 -6.919 -10.466 0.010 1.00 0.00 H new ATOM 0 HA ILE A 65 -4.315 -9.846 -0.913 1.00 0.00 H new ATOM 0 HB ILE A 65 -5.712 -8.882 1.618 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -5.873 -7.775 -1.206 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -7.157 -8.631 -0.376 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -4.338 -6.863 1.289 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -3.333 -8.317 1.497 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -3.569 -7.622 -0.125 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -7.522 -6.214 -0.297 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -7.250 -6.858 1.339 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -5.945 -5.989 0.497 1.00 0.00 H new ATOM 925 N GLU A 66 -4.491 -11.013 2.190 1.00 0.00 N ATOM 926 CA GLU A 66 -3.748 -11.719 3.225 1.00 0.00 C ATOM 927 C GLU A 66 -3.464 -13.166 2.822 1.00 0.00 C ATOM 928 O GLU A 66 -2.612 -13.826 3.416 1.00 0.00 O ATOM 929 CB GLU A 66 -4.530 -11.690 4.537 1.00 0.00 C ATOM 930 CG GLU A 66 -6.004 -12.025 4.377 1.00 0.00 C ATOM 931 CD GLU A 66 -6.650 -12.451 5.681 1.00 0.00 C ATOM 932 OE1 GLU A 66 -6.365 -11.819 6.720 1.00 0.00 O ATOM 933 OE2 GLU A 66 -7.442 -13.418 5.663 1.00 0.00 O ATOM 0 H GLU A 66 -5.422 -10.709 2.475 1.00 0.00 H new ATOM 0 HA GLU A 66 -2.792 -11.213 3.357 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -4.079 -12.397 5.234 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -4.438 -10.700 4.983 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.530 -11.155 3.982 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -6.114 -12.824 3.643 1.00 0.00 H new ATOM 940 N LYS A 67 -4.187 -13.660 1.821 1.00 0.00 N ATOM 941 CA LYS A 67 -4.009 -15.033 1.360 1.00 0.00 C ATOM 942 C LYS A 67 -3.062 -15.103 0.164 1.00 0.00 C ATOM 943 O LYS A 67 -2.371 -16.103 -0.030 1.00 0.00 O ATOM 944 CB LYS A 67 -5.361 -15.646 0.989 1.00 0.00 C ATOM 945 CG LYS A 67 -6.328 -15.740 2.158 1.00 0.00 C ATOM 946 CD LYS A 67 -6.770 -17.174 2.407 1.00 0.00 C ATOM 947 CE LYS A 67 -7.702 -17.667 1.310 1.00 0.00 C ATOM 948 NZ LYS A 67 -9.124 -17.334 1.597 1.00 0.00 N ATOM 0 H LYS A 67 -4.899 -13.133 1.315 1.00 0.00 H new ATOM 0 HA LYS A 67 -3.565 -15.602 2.177 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -5.816 -15.049 0.199 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -5.199 -16.644 0.582 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -5.853 -15.344 3.056 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -7.201 -15.119 1.959 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -5.895 -17.822 2.461 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -7.274 -17.238 3.371 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -7.410 -17.222 0.359 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -7.597 -18.747 1.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -9.726 -17.687 0.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -9.411 -17.779 2.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -9.230 -16.302 1.674 1.00 0.00 H new ATOM 962 N ARG A 68 -3.040 -14.046 -0.642 1.00 0.00 N ATOM 963 CA ARG A 68 -2.178 -14.009 -1.820 1.00 0.00 C ATOM 964 C ARG A 68 -1.132 -12.903 -1.717 1.00 0.00 C ATOM 965 O ARG A 68 0.068 -13.165 -1.788 1.00 0.00 O ATOM 966 CB ARG A 68 -3.018 -13.815 -3.084 1.00 0.00 C ATOM 967 CG ARG A 68 -4.242 -14.716 -3.142 1.00 0.00 C ATOM 968 CD ARG A 68 -4.181 -15.668 -4.326 1.00 0.00 C ATOM 969 NE ARG A 68 -3.417 -16.875 -4.018 1.00 0.00 N ATOM 970 CZ ARG A 68 -3.798 -17.784 -3.124 1.00 0.00 C ATOM 971 NH1 ARG A 68 -4.933 -17.632 -2.454 1.00 0.00 N ATOM 972 NH2 ARG A 68 -3.041 -18.849 -2.899 1.00 0.00 N ATOM 0 H ARG A 68 -3.605 -13.208 -0.503 1.00 0.00 H new ATOM 0 HA ARG A 68 -1.654 -14.963 -1.876 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -3.339 -12.775 -3.142 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -2.395 -14.005 -3.958 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -4.317 -15.289 -2.218 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -5.142 -14.105 -3.212 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -5.193 -15.945 -4.621 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -3.728 -15.160 -5.177 1.00 0.00 H new ATOM 0 HE ARG A 68 -2.541 -17.030 -4.517 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -5.519 -16.815 -2.623 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -5.219 -18.333 -1.770 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -2.167 -18.971 -3.411 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -3.332 -19.546 -2.214 1.00 0.00 H new ATOM 986 N CYS A 69 -1.590 -11.665 -1.553 1.00 0.00 N ATOM 987 CA CYS A 69 -0.683 -10.525 -1.445 1.00 0.00 C ATOM 988 C CYS A 69 0.315 -10.730 -0.310 1.00 0.00 C ATOM 989 O CYS A 69 -0.039 -11.223 0.760 1.00 0.00 O ATOM 990 CB CYS A 69 -1.472 -9.234 -1.222 1.00 0.00 C ATOM 991 SG CYS A 69 -2.540 -8.773 -2.608 1.00 0.00 S ATOM 0 H CYS A 69 -2.580 -11.426 -1.492 1.00 0.00 H new ATOM 0 HA CYS A 69 -0.130 -10.444 -2.381 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -2.084 -9.345 -0.327 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -0.772 -8.421 -1.031 1.00 0.00 H new ATOM 0 HG CYS A 69 -2.332 -7.528 -2.921 1.00 0.00 H new ATOM 997 N ARG A 70 1.566 -10.352 -0.554 1.00 0.00 N ATOM 998 CA ARG A 70 2.616 -10.503 0.448 1.00 0.00 C ATOM 999 C ARG A 70 2.758 -9.239 1.293 1.00 0.00 C ATOM 1000 O ARG A 70 2.901 -9.313 2.513 1.00 0.00 O ATOM 1001 CB ARG A 70 3.950 -10.833 -0.227 1.00 0.00 C ATOM 1002 CG ARG A 70 4.361 -12.290 -0.078 1.00 0.00 C ATOM 1003 CD ARG A 70 5.511 -12.448 0.905 1.00 0.00 C ATOM 1004 NE ARG A 70 5.845 -13.852 1.136 1.00 0.00 N ATOM 1005 CZ ARG A 70 6.543 -14.286 2.182 1.00 0.00 C ATOM 1006 NH1 ARG A 70 6.984 -13.429 3.097 1.00 0.00 N ATOM 1007 NH2 ARG A 70 6.802 -15.579 2.316 1.00 0.00 N ATOM 0 H ARG A 70 1.877 -9.940 -1.434 1.00 0.00 H new ATOM 0 HA ARG A 70 2.335 -11.324 1.107 1.00 0.00 H new ATOM 0 HB2 ARG A 70 3.882 -10.590 -1.287 1.00 0.00 H new ATOM 0 HB3 ARG A 70 4.729 -10.199 0.196 1.00 0.00 H new ATOM 0 HG2 ARG A 70 3.508 -12.877 0.262 1.00 0.00 H new ATOM 0 HG3 ARG A 70 4.655 -12.687 -1.050 1.00 0.00 H new ATOM 0 HD2 ARG A 70 6.388 -11.925 0.524 1.00 0.00 H new ATOM 0 HD3 ARG A 70 5.246 -11.978 1.852 1.00 0.00 H new ATOM 0 HE ARG A 70 5.524 -14.540 0.455 1.00 0.00 H new ATOM 0 HH11 ARG A 70 6.788 -12.433 2.999 1.00 0.00 H new ATOM 0 HH12 ARG A 70 7.519 -13.767 3.897 1.00 0.00 H new ATOM 0 HH21 ARG A 70 6.466 -16.242 1.617 1.00 0.00 H new ATOM 0 HH22 ARG A 70 7.337 -15.911 3.118 1.00 0.00 H new ATOM 1021 N ARG A 71 2.723 -8.082 0.640 1.00 0.00 N ATOM 1022 CA ARG A 71 2.855 -6.809 1.344 1.00 0.00 C ATOM 1023 C ARG A 71 1.671 -5.887 1.057 1.00 0.00 C ATOM 1024 O ARG A 71 0.865 -6.149 0.163 1.00 0.00 O ATOM 1025 CB ARG A 71 4.165 -6.114 0.957 1.00 0.00 C ATOM 1026 CG ARG A 71 4.591 -6.359 -0.482 1.00 0.00 C ATOM 1027 CD ARG A 71 5.651 -7.445 -0.574 1.00 0.00 C ATOM 1028 NE ARG A 71 6.778 -7.187 0.317 1.00 0.00 N ATOM 1029 CZ ARG A 71 7.796 -8.030 0.487 1.00 0.00 C ATOM 1030 NH1 ARG A 71 7.830 -9.180 -0.174 1.00 0.00 N ATOM 1031 NH2 ARG A 71 8.782 -7.719 1.318 1.00 0.00 N ATOM 0 H ARG A 71 2.605 -7.998 -0.370 1.00 0.00 H new ATOM 0 HA ARG A 71 2.867 -7.024 2.413 1.00 0.00 H new ATOM 0 HB2 ARG A 71 4.056 -5.041 1.116 1.00 0.00 H new ATOM 0 HB3 ARG A 71 4.957 -6.456 1.623 1.00 0.00 H new ATOM 0 HG2 ARG A 71 3.723 -6.646 -1.075 1.00 0.00 H new ATOM 0 HG3 ARG A 71 4.978 -5.434 -0.910 1.00 0.00 H new ATOM 0 HD2 ARG A 71 5.206 -8.408 -0.325 1.00 0.00 H new ATOM 0 HD3 ARG A 71 6.010 -7.515 -1.601 1.00 0.00 H new ATOM 0 HE ARG A 71 6.787 -6.311 0.840 1.00 0.00 H new ATOM 0 HH11 ARG A 71 7.075 -9.422 -0.816 1.00 0.00 H new ATOM 0 HH12 ARG A 71 8.611 -9.822 -0.041 1.00 0.00 H new ATOM 0 HH21 ARG A 71 8.761 -6.835 1.826 1.00 0.00 H new ATOM 0 HH22 ARG A 71 9.561 -8.364 1.449 1.00 0.00 H new ATOM 1045 N MET A 72 1.571 -4.810 1.827 1.00 0.00 N ATOM 1046 CA MET A 72 0.486 -3.850 1.665 1.00 0.00 C ATOM 1047 C MET A 72 1.021 -2.425 1.574 1.00 0.00 C ATOM 1048 O MET A 72 2.073 -2.108 2.127 1.00 0.00 O ATOM 1049 CB MET A 72 -0.502 -3.966 2.828 1.00 0.00 C ATOM 1050 CG MET A 72 -1.855 -4.526 2.424 1.00 0.00 C ATOM 1051 SD MET A 72 -2.879 -4.962 3.843 1.00 0.00 S ATOM 1052 CE MET A 72 -2.697 -6.742 3.859 1.00 0.00 C ATOM 0 H MET A 72 2.229 -4.579 2.571 1.00 0.00 H new ATOM 0 HA MET A 72 -0.030 -4.080 0.733 1.00 0.00 H new ATOM 0 HB2 MET A 72 -0.070 -4.604 3.599 1.00 0.00 H new ATOM 0 HB3 MET A 72 -0.644 -2.981 3.273 1.00 0.00 H new ATOM 0 HG2 MET A 72 -2.380 -3.791 1.814 1.00 0.00 H new ATOM 0 HG3 MET A 72 -1.707 -5.409 1.803 1.00 0.00 H new ATOM 0 HE1 MET A 72 -3.648 -7.207 3.598 1.00 0.00 H new ATOM 0 HE2 MET A 72 -1.938 -7.037 3.135 1.00 0.00 H new ATOM 0 HE3 MET A 72 -2.395 -7.068 4.854 1.00 0.00 H new ATOM 1062 N VAL A 73 0.281 -1.572 0.880 1.00 0.00 N ATOM 1063 CA VAL A 73 0.665 -0.177 0.722 1.00 0.00 C ATOM 1064 C VAL A 73 -0.489 0.729 1.128 1.00 0.00 C ATOM 1065 O VAL A 73 -1.390 0.996 0.335 1.00 0.00 O ATOM 1066 CB VAL A 73 1.079 0.134 -0.729 1.00 0.00 C ATOM 1067 CG1 VAL A 73 1.542 1.578 -0.863 1.00 0.00 C ATOM 1068 CG2 VAL A 73 2.165 -0.826 -1.191 1.00 0.00 C ATOM 0 H VAL A 73 -0.592 -1.823 0.416 1.00 0.00 H new ATOM 0 HA VAL A 73 1.524 0.007 1.368 1.00 0.00 H new ATOM 0 HB VAL A 73 0.207 -0.001 -1.369 1.00 0.00 H new ATOM 0 HG11 VAL A 73 1.829 1.774 -1.896 1.00 0.00 H new ATOM 0 HG12 VAL A 73 0.731 2.248 -0.579 1.00 0.00 H new ATOM 0 HG13 VAL A 73 2.398 1.748 -0.210 1.00 0.00 H new ATOM 0 HG21 VAL A 73 2.445 -0.592 -2.218 1.00 0.00 H new ATOM 0 HG22 VAL A 73 3.037 -0.726 -0.545 1.00 0.00 H new ATOM 0 HG23 VAL A 73 1.792 -1.849 -1.141 1.00 0.00 H new ATOM 1078 N VAL A 74 -0.465 1.180 2.375 1.00 0.00 N ATOM 1079 CA VAL A 74 -1.521 2.036 2.899 1.00 0.00 C ATOM 1080 C VAL A 74 -1.229 3.507 2.637 1.00 0.00 C ATOM 1081 O VAL A 74 -0.081 3.945 2.690 1.00 0.00 O ATOM 1082 CB VAL A 74 -1.717 1.823 4.412 1.00 0.00 C ATOM 1083 CG1 VAL A 74 -3.056 2.382 4.861 1.00 0.00 C ATOM 1084 CG2 VAL A 74 -1.601 0.345 4.766 1.00 0.00 C ATOM 0 H VAL A 74 0.275 0.967 3.043 1.00 0.00 H new ATOM 0 HA VAL A 74 -2.436 1.757 2.377 1.00 0.00 H new ATOM 0 HB VAL A 74 -0.929 2.361 4.940 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -3.176 2.222 5.932 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -3.095 3.450 4.647 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -3.859 1.876 4.326 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -1.742 0.216 5.839 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -2.364 -0.219 4.229 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -0.614 -0.020 4.484 1.00 0.00 H new ATOM 1094 N VAL A 75 -2.283 4.264 2.353 1.00 0.00 N ATOM 1095 CA VAL A 75 -2.153 5.688 2.081 1.00 0.00 C ATOM 1096 C VAL A 75 -2.785 6.515 3.197 1.00 0.00 C ATOM 1097 O VAL A 75 -3.983 6.795 3.173 1.00 0.00 O ATOM 1098 CB VAL A 75 -2.812 6.062 0.738 1.00 0.00 C ATOM 1099 CG1 VAL A 75 -2.586 7.533 0.420 1.00 0.00 C ATOM 1100 CG2 VAL A 75 -2.278 5.179 -0.379 1.00 0.00 C ATOM 0 H VAL A 75 -3.239 3.912 2.305 1.00 0.00 H new ATOM 0 HA VAL A 75 -1.087 5.910 2.027 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.886 5.896 0.822 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -3.059 7.776 -0.531 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -3.021 8.147 1.209 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -1.516 7.731 0.355 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -2.753 5.456 -1.320 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -1.200 5.312 -0.464 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -2.498 4.135 -0.155 1.00 0.00 H new ATOM 1110 N VAL A 76 -1.972 6.900 4.177 1.00 0.00 N ATOM 1111 CA VAL A 76 -2.457 7.689 5.304 1.00 0.00 C ATOM 1112 C VAL A 76 -2.580 9.164 4.937 1.00 0.00 C ATOM 1113 O VAL A 76 -1.593 9.901 4.937 1.00 0.00 O ATOM 1114 CB VAL A 76 -1.536 7.545 6.533 1.00 0.00 C ATOM 1115 CG1 VAL A 76 -0.130 8.029 6.213 1.00 0.00 C ATOM 1116 CG2 VAL A 76 -2.113 8.301 7.722 1.00 0.00 C ATOM 0 H VAL A 76 -0.977 6.679 4.213 1.00 0.00 H new ATOM 0 HA VAL A 76 -3.444 7.302 5.556 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.476 6.489 6.796 1.00 0.00 H new ATOM 0 HG11 VAL A 76 0.502 7.918 7.094 1.00 0.00 H new ATOM 0 HG12 VAL A 76 0.281 7.438 5.395 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -0.164 9.079 5.921 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -1.451 8.189 8.581 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.206 9.358 7.471 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -3.096 7.898 7.967 1.00 0.00 H new ATOM 1126 N SER A 77 -3.798 9.589 4.630 1.00 0.00 N ATOM 1127 CA SER A 77 -4.054 10.976 4.266 1.00 0.00 C ATOM 1128 C SER A 77 -5.213 11.547 5.077 1.00 0.00 C ATOM 1129 O SER A 77 -6.107 10.815 5.501 1.00 0.00 O ATOM 1130 CB SER A 77 -4.360 11.086 2.772 1.00 0.00 C ATOM 1131 OG SER A 77 -3.179 10.960 1.998 1.00 0.00 O ATOM 0 H SER A 77 -4.625 8.992 4.626 1.00 0.00 H new ATOM 0 HA SER A 77 -3.158 11.554 4.490 1.00 0.00 H new ATOM 0 HB2 SER A 77 -5.071 10.311 2.485 1.00 0.00 H new ATOM 0 HB3 SER A 77 -4.834 12.045 2.564 1.00 0.00 H new ATOM 0 HG SER A 77 -3.402 11.032 1.046 1.00 0.00 H new ATOM 1137 N ASP A 78 -5.190 12.862 5.283 1.00 0.00 N ATOM 1138 CA ASP A 78 -6.237 13.554 6.037 1.00 0.00 C ATOM 1139 C ASP A 78 -7.624 13.013 5.694 1.00 0.00 C ATOM 1140 O ASP A 78 -8.343 12.506 6.557 1.00 0.00 O ATOM 1141 CB ASP A 78 -6.189 15.053 5.728 1.00 0.00 C ATOM 1142 CG ASP A 78 -6.035 15.901 6.972 1.00 0.00 C ATOM 1143 OD1 ASP A 78 -4.882 16.146 7.382 1.00 0.00 O ATOM 1144 OD2 ASP A 78 -7.067 16.323 7.535 1.00 0.00 O ATOM 0 H ASP A 78 -4.452 13.475 4.936 1.00 0.00 H new ATOM 0 HA ASP A 78 -6.055 13.382 7.098 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -5.359 15.254 5.051 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -7.102 15.342 5.207 1.00 0.00 H new ATOM 1149 N ASP A 79 -7.987 13.142 4.426 1.00 0.00 N ATOM 1150 CA ASP A 79 -9.288 12.690 3.934 1.00 0.00 C ATOM 1151 C ASP A 79 -9.510 11.196 4.172 1.00 0.00 C ATOM 1152 O ASP A 79 -10.643 10.718 4.117 1.00 0.00 O ATOM 1153 CB ASP A 79 -9.419 12.998 2.441 1.00 0.00 C ATOM 1154 CG ASP A 79 -10.022 14.364 2.185 1.00 0.00 C ATOM 1155 OD1 ASP A 79 -11.187 14.584 2.579 1.00 0.00 O ATOM 1156 OD2 ASP A 79 -9.330 15.216 1.588 1.00 0.00 O ATOM 0 H ASP A 79 -7.394 13.560 3.709 1.00 0.00 H new ATOM 0 HA ASP A 79 -10.051 13.231 4.494 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -8.436 12.944 1.974 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -10.038 12.236 1.968 1.00 0.00 H new ATOM 1161 N TYR A 80 -8.436 10.458 4.441 1.00 0.00 N ATOM 1162 CA TYR A 80 -8.545 9.026 4.686 1.00 0.00 C ATOM 1163 C TYR A 80 -8.875 8.764 6.147 1.00 0.00 C ATOM 1164 O TYR A 80 -9.539 7.785 6.483 1.00 0.00 O ATOM 1165 CB TYR A 80 -7.241 8.318 4.309 1.00 0.00 C ATOM 1166 CG TYR A 80 -7.289 6.814 4.473 1.00 0.00 C ATOM 1167 CD1 TYR A 80 -8.455 6.101 4.219 1.00 0.00 C ATOM 1168 CD2 TYR A 80 -6.165 6.107 4.881 1.00 0.00 C ATOM 1169 CE1 TYR A 80 -8.499 4.727 4.369 1.00 0.00 C ATOM 1170 CE2 TYR A 80 -6.200 4.733 5.033 1.00 0.00 C ATOM 1171 CZ TYR A 80 -7.368 4.049 4.775 1.00 0.00 C ATOM 1172 OH TYR A 80 -7.408 2.682 4.924 1.00 0.00 O ATOM 0 H TYR A 80 -7.486 10.827 4.494 1.00 0.00 H new ATOM 0 HA TYR A 80 -9.350 8.631 4.066 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.998 8.553 3.273 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -6.433 8.715 4.924 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -9.341 6.629 3.899 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -5.248 6.640 5.083 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -9.413 4.188 4.170 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -5.317 4.199 5.352 1.00 0.00 H new ATOM 0 HH TYR A 80 -6.508 2.313 4.803 1.00 0.00 H new ATOM 1182 N LEU A 81 -8.407 9.656 7.011 1.00 0.00 N ATOM 1183 CA LEU A 81 -8.645 9.542 8.435 1.00 0.00 C ATOM 1184 C LEU A 81 -10.040 10.038 8.790 1.00 0.00 C ATOM 1185 O LEU A 81 -10.705 9.484 9.666 1.00 0.00 O ATOM 1186 CB LEU A 81 -7.598 10.351 9.190 1.00 0.00 C ATOM 1187 CG LEU A 81 -6.168 9.852 9.047 1.00 0.00 C ATOM 1188 CD1 LEU A 81 -5.170 10.953 9.360 1.00 0.00 C ATOM 1189 CD2 LEU A 81 -5.948 8.674 9.960 1.00 0.00 C ATOM 0 H LEU A 81 -7.856 10.471 6.742 1.00 0.00 H new ATOM 0 HA LEU A 81 -8.573 8.493 8.720 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -7.642 11.384 8.845 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.860 10.357 10.248 1.00 0.00 H new ATOM 0 HG LEU A 81 -6.012 9.543 8.013 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -4.156 10.567 9.250 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -5.319 11.785 8.672 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.318 11.298 10.383 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.923 8.319 9.855 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -6.124 8.976 10.992 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.638 7.873 9.694 1.00 0.00 H new ATOM 1201 N GLN A 82 -10.478 11.085 8.100 1.00 0.00 N ATOM 1202 CA GLN A 82 -11.789 11.661 8.333 1.00 0.00 C ATOM 1203 C GLN A 82 -12.894 10.636 8.082 1.00 0.00 C ATOM 1204 O GLN A 82 -14.027 10.812 8.528 1.00 0.00 O ATOM 1205 CB GLN A 82 -11.991 12.876 7.429 1.00 0.00 C ATOM 1206 CG GLN A 82 -10.850 13.877 7.492 1.00 0.00 C ATOM 1207 CD GLN A 82 -11.335 15.314 7.483 1.00 0.00 C ATOM 1208 OE1 GLN A 82 -11.558 15.913 8.535 1.00 0.00 O ATOM 1209 NE2 GLN A 82 -11.501 15.876 6.291 1.00 0.00 N ATOM 0 H GLN A 82 -9.938 11.552 7.371 1.00 0.00 H new ATOM 0 HA GLN A 82 -11.844 11.971 9.376 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -12.110 12.537 6.400 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -12.918 13.376 7.709 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -10.266 13.700 8.395 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -10.184 13.717 6.644 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -11.304 15.343 5.444 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -11.825 16.841 6.223 1.00 0.00 H new ATOM 1218 N SER A 83 -12.559 9.565 7.364 1.00 0.00 N ATOM 1219 CA SER A 83 -13.528 8.523 7.059 1.00 0.00 C ATOM 1220 C SER A 83 -13.390 7.351 8.024 1.00 0.00 C ATOM 1221 O SER A 83 -12.300 7.064 8.518 1.00 0.00 O ATOM 1222 CB SER A 83 -13.349 8.039 5.621 1.00 0.00 C ATOM 1223 OG SER A 83 -14.094 8.835 4.716 1.00 0.00 O ATOM 0 H SER A 83 -11.626 9.400 6.985 1.00 0.00 H new ATOM 0 HA SER A 83 -14.526 8.945 7.172 1.00 0.00 H new ATOM 0 HB2 SER A 83 -12.293 8.070 5.353 1.00 0.00 H new ATOM 0 HB3 SER A 83 -13.667 6.999 5.542 1.00 0.00 H new ATOM 0 HG SER A 83 -13.960 8.505 3.803 1.00 0.00 H new ATOM 1229 N LYS A 84 -14.504 6.677 8.289 1.00 0.00 N ATOM 1230 CA LYS A 84 -14.514 5.539 9.193 1.00 0.00 C ATOM 1231 C LYS A 84 -13.907 4.304 8.533 1.00 0.00 C ATOM 1232 O LYS A 84 -13.531 3.350 9.214 1.00 0.00 O ATOM 1233 CB LYS A 84 -15.946 5.245 9.635 1.00 0.00 C ATOM 1234 CG LYS A 84 -16.617 6.411 10.342 1.00 0.00 C ATOM 1235 CD LYS A 84 -15.809 6.879 11.542 1.00 0.00 C ATOM 1236 CE LYS A 84 -15.268 8.285 11.338 1.00 0.00 C ATOM 1237 NZ LYS A 84 -16.361 9.283 11.171 1.00 0.00 N ATOM 0 H LYS A 84 -15.414 6.903 7.887 1.00 0.00 H new ATOM 0 HA LYS A 84 -13.907 5.788 10.064 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -16.538 4.972 8.761 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -15.942 4.382 10.300 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -16.743 7.238 9.643 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -17.614 6.115 10.667 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -16.435 6.855 12.434 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -14.981 6.191 11.715 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -14.650 8.563 12.192 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -14.624 8.302 10.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -16.035 10.214 11.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -16.624 9.345 10.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -17.188 8.989 11.728 1.00 0.00 H new ATOM 1251 N GLU A 85 -13.807 4.326 7.206 1.00 0.00 N ATOM 1252 CA GLU A 85 -13.235 3.201 6.475 1.00 0.00 C ATOM 1253 C GLU A 85 -11.791 2.973 6.901 1.00 0.00 C ATOM 1254 O GLU A 85 -11.297 1.845 6.885 1.00 0.00 O ATOM 1255 CB GLU A 85 -13.310 3.439 4.964 1.00 0.00 C ATOM 1256 CG GLU A 85 -12.947 4.854 4.546 1.00 0.00 C ATOM 1257 CD GLU A 85 -12.201 4.896 3.227 1.00 0.00 C ATOM 1258 OE1 GLU A 85 -12.766 4.443 2.210 1.00 0.00 O ATOM 1259 OE2 GLU A 85 -11.051 5.386 3.211 1.00 0.00 O ATOM 0 H GLU A 85 -14.112 5.103 6.620 1.00 0.00 H new ATOM 0 HA GLU A 85 -13.817 2.310 6.711 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -12.642 2.739 4.462 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -14.320 3.217 4.621 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -13.856 5.450 4.465 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -12.333 5.312 5.322 1.00 0.00 H new ATOM 1266 N CYS A 86 -11.121 4.053 7.295 1.00 0.00 N ATOM 1267 CA CYS A 86 -9.739 3.971 7.739 1.00 0.00 C ATOM 1268 C CYS A 86 -9.675 3.463 9.174 1.00 0.00 C ATOM 1269 O CYS A 86 -8.738 2.763 9.555 1.00 0.00 O ATOM 1270 CB CYS A 86 -9.061 5.338 7.635 1.00 0.00 C ATOM 1271 SG CYS A 86 -7.343 5.358 8.195 1.00 0.00 S ATOM 0 H CYS A 86 -11.516 4.993 7.315 1.00 0.00 H new ATOM 0 HA CYS A 86 -9.210 3.270 7.093 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -9.097 5.671 6.598 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -9.631 6.059 8.221 1.00 0.00 H new ATOM 0 HG CYS A 86 -6.552 5.221 7.173 1.00 0.00 H new ATOM 1277 N ASP A 87 -10.686 3.813 9.965 1.00 0.00 N ATOM 1278 CA ASP A 87 -10.746 3.381 11.354 1.00 0.00 C ATOM 1279 C ASP A 87 -10.802 1.861 11.430 1.00 0.00 C ATOM 1280 O ASP A 87 -10.149 1.245 12.272 1.00 0.00 O ATOM 1281 CB ASP A 87 -11.963 3.991 12.054 1.00 0.00 C ATOM 1282 CG ASP A 87 -11.624 4.544 13.426 1.00 0.00 C ATOM 1283 OD1 ASP A 87 -11.078 5.665 13.494 1.00 0.00 O ATOM 1284 OD2 ASP A 87 -11.906 3.855 14.429 1.00 0.00 O ATOM 0 H ASP A 87 -11.471 4.392 9.667 1.00 0.00 H new ATOM 0 HA ASP A 87 -9.846 3.726 11.863 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -12.373 4.789 11.435 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -12.740 3.233 12.153 1.00 0.00 H new ATOM 1289 N PHE A 88 -11.575 1.264 10.530 1.00 0.00 N ATOM 1290 CA PHE A 88 -11.704 -0.184 10.476 1.00 0.00 C ATOM 1291 C PHE A 88 -10.408 -0.799 9.966 1.00 0.00 C ATOM 1292 O PHE A 88 -9.917 -1.789 10.507 1.00 0.00 O ATOM 1293 CB PHE A 88 -12.870 -0.582 9.570 1.00 0.00 C ATOM 1294 CG PHE A 88 -13.251 -2.030 9.682 1.00 0.00 C ATOM 1295 CD1 PHE A 88 -13.652 -2.562 10.896 1.00 0.00 C ATOM 1296 CD2 PHE A 88 -13.211 -2.859 8.572 1.00 0.00 C ATOM 1297 CE1 PHE A 88 -14.005 -3.894 11.003 1.00 0.00 C ATOM 1298 CE2 PHE A 88 -13.563 -4.192 8.672 1.00 0.00 C ATOM 1299 CZ PHE A 88 -13.961 -4.710 9.890 1.00 0.00 C ATOM 0 H PHE A 88 -12.122 1.763 9.828 1.00 0.00 H new ATOM 0 HA PHE A 88 -11.904 -0.558 11.480 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -13.736 0.033 9.815 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -12.606 -0.363 8.535 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -13.689 -1.928 11.770 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -12.901 -2.459 7.618 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -14.315 -4.296 11.956 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -13.527 -4.828 7.800 1.00 0.00 H new ATOM 0 HZ PHE A 88 -14.237 -5.751 9.971 1.00 0.00 H new ATOM 1309 N GLN A 89 -9.848 -0.185 8.925 1.00 0.00 N ATOM 1310 CA GLN A 89 -8.596 -0.652 8.347 1.00 0.00 C ATOM 1311 C GLN A 89 -7.493 -0.595 9.392 1.00 0.00 C ATOM 1312 O GLN A 89 -6.632 -1.468 9.453 1.00 0.00 O ATOM 1313 CB GLN A 89 -8.216 0.199 7.133 1.00 0.00 C ATOM 1314 CG GLN A 89 -7.245 -0.488 6.188 1.00 0.00 C ATOM 1315 CD GLN A 89 -5.925 0.246 6.067 1.00 0.00 C ATOM 1316 OE1 GLN A 89 -5.603 0.802 5.017 1.00 0.00 O ATOM 1317 NE2 GLN A 89 -5.151 0.254 7.147 1.00 0.00 N ATOM 0 H GLN A 89 -10.244 0.636 8.467 1.00 0.00 H new ATOM 0 HA GLN A 89 -8.724 -1.683 8.019 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -9.121 0.459 6.584 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -7.774 1.133 7.479 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -7.060 -1.503 6.539 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -7.702 -0.570 5.202 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -5.457 -0.220 7.997 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -4.251 0.734 7.126 1.00 0.00 H new ATOM 1326 N THR A 90 -7.541 0.440 10.226 1.00 0.00 N ATOM 1327 CA THR A 90 -6.567 0.621 11.289 1.00 0.00 C ATOM 1328 C THR A 90 -6.617 -0.532 12.267 1.00 0.00 C ATOM 1329 O THR A 90 -5.663 -1.286 12.376 1.00 0.00 O ATOM 1330 CB THR A 90 -6.824 1.941 12.017 1.00 0.00 C ATOM 1331 OG1 THR A 90 -6.831 3.025 11.105 1.00 0.00 O ATOM 1332 CG2 THR A 90 -5.795 2.244 13.079 1.00 0.00 C ATOM 0 H THR A 90 -8.252 1.170 10.182 1.00 0.00 H new ATOM 0 HA THR A 90 -5.573 0.648 10.843 1.00 0.00 H new ATOM 0 HB THR A 90 -7.796 1.823 12.496 1.00 0.00 H new ATOM 0 HG1 THR A 90 -7.753 3.225 10.841 1.00 0.00 H new ATOM 0 HG21 THR A 90 -6.035 3.194 13.558 1.00 0.00 H new ATOM 0 HG22 THR A 90 -5.798 1.450 13.826 1.00 0.00 H new ATOM 0 HG23 THR A 90 -4.808 2.307 12.621 1.00 0.00 H new ATOM 1340 N LYS A 91 -7.725 -0.669 12.978 1.00 0.00 N ATOM 1341 CA LYS A 91 -7.867 -1.743 13.957 1.00 0.00 C ATOM 1342 C LYS A 91 -7.440 -3.087 13.380 1.00 0.00 C ATOM 1343 O LYS A 91 -6.968 -3.961 14.106 1.00 0.00 O ATOM 1344 CB LYS A 91 -9.306 -1.819 14.469 1.00 0.00 C ATOM 1345 CG LYS A 91 -9.543 -1.019 15.738 1.00 0.00 C ATOM 1346 CD LYS A 91 -9.537 0.479 15.466 1.00 0.00 C ATOM 1347 CE LYS A 91 -8.330 1.161 16.094 1.00 0.00 C ATOM 1348 NZ LYS A 91 -8.731 2.176 17.107 1.00 0.00 N ATOM 0 H LYS A 91 -8.536 -0.056 12.899 1.00 0.00 H new ATOM 0 HA LYS A 91 -7.207 -1.513 14.794 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -9.979 -1.458 13.691 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -9.562 -2.862 14.654 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -10.499 -1.306 16.176 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -8.772 -1.260 16.470 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -9.534 0.653 14.390 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -10.451 0.924 15.859 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -7.693 0.411 16.563 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -7.737 1.640 15.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -7.881 2.618 17.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -9.318 2.905 16.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -9.275 1.715 17.864 1.00 0.00 H new ATOM 1362 N PHE A 92 -7.592 -3.244 12.072 1.00 0.00 N ATOM 1363 CA PHE A 92 -7.202 -4.482 11.416 1.00 0.00 C ATOM 1364 C PHE A 92 -5.768 -4.387 10.904 1.00 0.00 C ATOM 1365 O PHE A 92 -5.092 -5.401 10.725 1.00 0.00 O ATOM 1366 CB PHE A 92 -8.155 -4.800 10.262 1.00 0.00 C ATOM 1367 CG PHE A 92 -8.042 -6.213 9.763 1.00 0.00 C ATOM 1368 CD1 PHE A 92 -8.671 -7.249 10.432 1.00 0.00 C ATOM 1369 CD2 PHE A 92 -7.309 -6.501 8.624 1.00 0.00 C ATOM 1370 CE1 PHE A 92 -8.569 -8.551 9.975 1.00 0.00 C ATOM 1371 CE2 PHE A 92 -7.203 -7.800 8.162 1.00 0.00 C ATOM 1372 CZ PHE A 92 -7.834 -8.825 8.839 1.00 0.00 C ATOM 0 H PHE A 92 -7.980 -2.535 11.449 1.00 0.00 H new ATOM 0 HA PHE A 92 -7.258 -5.289 12.147 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -9.180 -4.619 10.587 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -7.956 -4.115 9.438 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -9.248 -7.039 11.321 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -6.815 -5.702 8.091 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -9.063 -9.351 10.506 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -6.628 -8.013 7.273 1.00 0.00 H new ATOM 0 HZ PHE A 92 -7.753 -9.840 8.480 1.00 0.00 H new ATOM 1382 N ALA A 93 -5.312 -3.161 10.670 1.00 0.00 N ATOM 1383 CA ALA A 93 -3.960 -2.923 10.181 1.00 0.00 C ATOM 1384 C ALA A 93 -2.980 -2.714 11.330 1.00 0.00 C ATOM 1385 O ALA A 93 -1.788 -2.993 11.201 1.00 0.00 O ATOM 1386 CB ALA A 93 -3.942 -1.722 9.253 1.00 0.00 C ATOM 0 H ALA A 93 -5.862 -2.314 10.812 1.00 0.00 H new ATOM 0 HA ALA A 93 -3.644 -3.808 9.628 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -2.926 -1.554 8.894 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -4.600 -1.908 8.404 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -4.286 -0.840 9.793 1.00 0.00 H new ATOM 1392 N LEU A 94 -3.487 -2.224 12.457 1.00 0.00 N ATOM 1393 CA LEU A 94 -2.661 -1.977 13.623 1.00 0.00 C ATOM 1394 C LEU A 94 -2.506 -3.252 14.423 1.00 0.00 C ATOM 1395 O LEU A 94 -1.409 -3.624 14.843 1.00 0.00 O ATOM 1396 CB LEU A 94 -3.299 -0.888 14.479 1.00 0.00 C ATOM 1397 CG LEU A 94 -4.746 -1.130 14.928 1.00 0.00 C ATOM 1398 CD1 LEU A 94 -4.796 -1.998 16.161 1.00 0.00 C ATOM 1399 CD2 LEU A 94 -5.448 0.196 15.188 1.00 0.00 C ATOM 0 H LEU A 94 -4.472 -1.991 12.583 1.00 0.00 H new ATOM 0 HA LEU A 94 -1.673 -1.644 13.304 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.684 -0.749 15.369 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -3.267 0.048 13.921 1.00 0.00 H new ATOM 0 HG LEU A 94 -5.265 -1.653 14.125 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -5.834 -2.152 16.456 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -4.333 -2.961 15.947 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.257 -1.509 16.973 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -6.474 0.009 15.506 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.919 0.740 15.971 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -5.454 0.790 14.274 1.00 0.00 H new ATOM 1411 N SER A 95 -3.628 -3.909 14.618 1.00 0.00 N ATOM 1412 CA SER A 95 -3.676 -5.161 15.363 1.00 0.00 C ATOM 1413 C SER A 95 -3.976 -6.331 14.432 1.00 0.00 C ATOM 1414 O SER A 95 -4.932 -7.079 14.641 1.00 0.00 O ATOM 1415 CB SER A 95 -4.730 -5.088 16.469 1.00 0.00 C ATOM 1416 OG SER A 95 -4.788 -6.299 17.202 1.00 0.00 O ATOM 0 H SER A 95 -4.534 -3.597 14.268 1.00 0.00 H new ATOM 0 HA SER A 95 -2.699 -5.321 15.819 1.00 0.00 H new ATOM 0 HB2 SER A 95 -4.498 -4.263 17.142 1.00 0.00 H new ATOM 0 HB3 SER A 95 -5.706 -4.877 16.032 1.00 0.00 H new ATOM 0 HG SER A 95 -5.022 -7.035 16.599 1.00 0.00 H new ATOM 1422 N LEU A 96 -3.150 -6.483 13.402 1.00 0.00 N ATOM 1423 CA LEU A 96 -3.326 -7.566 12.438 1.00 0.00 C ATOM 1424 C LEU A 96 -2.737 -8.867 12.977 1.00 0.00 C ATOM 1425 O LEU A 96 -3.459 -9.734 13.468 1.00 0.00 O ATOM 1426 CB LEU A 96 -2.689 -7.230 11.078 1.00 0.00 C ATOM 1427 CG LEU A 96 -1.960 -5.887 10.987 1.00 0.00 C ATOM 1428 CD1 LEU A 96 -0.565 -5.990 11.588 1.00 0.00 C ATOM 1429 CD2 LEU A 96 -1.883 -5.428 9.540 1.00 0.00 C ATOM 0 H LEU A 96 -2.355 -5.873 13.213 1.00 0.00 H new ATOM 0 HA LEU A 96 -4.398 -7.691 12.287 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -1.983 -8.021 10.826 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -3.472 -7.247 10.319 1.00 0.00 H new ATOM 0 HG LEU A 96 -2.523 -5.149 11.558 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -0.064 -5.025 11.513 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -0.641 -6.279 12.636 1.00 0.00 H new ATOM 0 HD13 LEU A 96 0.010 -6.740 11.046 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -1.362 -4.472 9.489 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -1.341 -6.168 8.952 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -2.891 -5.314 9.140 1.00 0.00 H new ATOM 1441 N SER A 97 -1.418 -8.989 12.882 1.00 0.00 N ATOM 1442 CA SER A 97 -0.717 -10.175 13.358 1.00 0.00 C ATOM 1443 C SER A 97 0.449 -9.785 14.263 1.00 0.00 C ATOM 1444 O SER A 97 1.012 -8.698 14.128 1.00 0.00 O ATOM 1445 CB SER A 97 -0.211 -11.001 12.173 1.00 0.00 C ATOM 1446 OG SER A 97 0.872 -11.834 12.553 1.00 0.00 O ATOM 0 H SER A 97 -0.810 -8.277 12.477 1.00 0.00 H new ATOM 0 HA SER A 97 -1.416 -10.778 13.937 1.00 0.00 H new ATOM 0 HB2 SER A 97 -1.023 -11.613 11.780 1.00 0.00 H new ATOM 0 HB3 SER A 97 0.104 -10.335 11.370 1.00 0.00 H new ATOM 0 HG SER A 97 1.174 -12.352 11.778 1.00 0.00 H new ATOM 1452 N PRO A 98 0.827 -10.667 15.203 1.00 0.00 N ATOM 1453 CA PRO A 98 1.931 -10.406 16.133 1.00 0.00 C ATOM 1454 C PRO A 98 3.268 -10.237 15.417 1.00 0.00 C ATOM 1455 O PRO A 98 4.085 -11.158 15.381 1.00 0.00 O ATOM 1456 CB PRO A 98 1.956 -11.649 17.030 1.00 0.00 C ATOM 1457 CG PRO A 98 1.247 -12.703 16.250 1.00 0.00 C ATOM 1458 CD PRO A 98 0.212 -11.985 15.436 1.00 0.00 C ATOM 0 HA PRO A 98 1.783 -9.476 16.682 1.00 0.00 H new ATOM 0 HB2 PRO A 98 2.978 -11.949 17.260 1.00 0.00 H new ATOM 0 HB3 PRO A 98 1.458 -11.460 17.981 1.00 0.00 H new ATOM 0 HG2 PRO A 98 1.940 -13.247 15.608 1.00 0.00 H new ATOM 0 HG3 PRO A 98 0.785 -13.435 16.912 1.00 0.00 H new ATOM 0 HD2 PRO A 98 0.004 -12.504 14.500 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -0.734 -11.900 15.971 1.00 0.00 H new ATOM 1466 N GLY A 99 3.486 -9.054 14.849 1.00 0.00 N ATOM 1467 CA GLY A 99 4.727 -8.786 14.145 1.00 0.00 C ATOM 1468 C GLY A 99 4.511 -8.462 12.680 1.00 0.00 C ATOM 1469 O GLY A 99 5.317 -8.837 11.829 1.00 0.00 O ATOM 0 H GLY A 99 2.825 -8.277 14.864 1.00 0.00 H new ATOM 0 HA2 GLY A 99 5.240 -7.953 14.625 1.00 0.00 H new ATOM 0 HA3 GLY A 99 5.382 -9.654 14.228 1.00 0.00 H new ATOM 1473 N ALA A 100 3.422 -7.760 12.386 1.00 0.00 N ATOM 1474 CA ALA A 100 3.103 -7.381 11.015 1.00 0.00 C ATOM 1475 C ALA A 100 2.533 -5.967 10.962 1.00 0.00 C ATOM 1476 O ALA A 100 1.710 -5.651 10.104 1.00 0.00 O ATOM 1477 CB ALA A 100 2.125 -8.377 10.406 1.00 0.00 C ATOM 0 H ALA A 100 2.745 -7.442 13.080 1.00 0.00 H new ATOM 0 HA ALA A 100 4.023 -7.396 10.431 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.895 -8.082 9.382 1.00 0.00 H new ATOM 0 HB2 ALA A 100 2.571 -9.371 10.406 1.00 0.00 H new ATOM 0 HB3 ALA A 100 1.207 -8.392 10.994 1.00 0.00 H new ATOM 1483 N HIS A 101 2.978 -5.125 11.886 1.00 0.00 N ATOM 1484 CA HIS A 101 2.512 -3.745 11.951 1.00 0.00 C ATOM 1485 C HIS A 101 3.284 -2.862 10.975 1.00 0.00 C ATOM 1486 O HIS A 101 2.772 -1.844 10.508 1.00 0.00 O ATOM 1487 CB HIS A 101 2.651 -3.204 13.376 1.00 0.00 C ATOM 1488 CG HIS A 101 3.987 -3.470 13.998 1.00 0.00 C ATOM 1489 ND1 HIS A 101 5.038 -2.578 13.936 1.00 0.00 N ATOM 1490 CD2 HIS A 101 4.440 -4.533 14.704 1.00 0.00 C ATOM 1491 CE1 HIS A 101 6.078 -3.083 14.577 1.00 0.00 C ATOM 1492 NE2 HIS A 101 5.741 -4.268 15.051 1.00 0.00 N ATOM 0 H HIS A 101 3.661 -5.373 12.601 1.00 0.00 H new ATOM 0 HA HIS A 101 1.460 -3.729 11.668 1.00 0.00 H new ATOM 0 HB2 HIS A 101 2.474 -2.129 13.365 1.00 0.00 H new ATOM 0 HB3 HIS A 101 1.876 -3.648 14.000 1.00 0.00 H new ATOM 0 HD2 HIS A 101 3.881 -5.424 14.949 1.00 0.00 H new ATOM 0 HE1 HIS A 101 7.040 -2.607 14.693 1.00 0.00 H new ATOM 0 HE2 HIS A 101 6.349 -4.886 15.588 1.00 0.00 H new ATOM 1501 N GLN A 102 4.516 -3.257 10.669 1.00 0.00 N ATOM 1502 CA GLN A 102 5.351 -2.499 9.746 1.00 0.00 C ATOM 1503 C GLN A 102 6.352 -3.412 9.043 1.00 0.00 C ATOM 1504 O GLN A 102 7.471 -3.002 8.733 1.00 0.00 O ATOM 1505 CB GLN A 102 6.091 -1.381 10.487 1.00 0.00 C ATOM 1506 CG GLN A 102 7.160 -1.885 11.442 1.00 0.00 C ATOM 1507 CD GLN A 102 8.038 -0.771 11.975 1.00 0.00 C ATOM 1508 OE1 GLN A 102 7.913 -0.363 13.130 1.00 0.00 O ATOM 1509 NE2 GLN A 102 8.934 -0.269 11.133 1.00 0.00 N ATOM 0 H GLN A 102 4.957 -4.096 11.046 1.00 0.00 H new ATOM 0 HA GLN A 102 4.702 -2.053 8.993 1.00 0.00 H new ATOM 0 HB2 GLN A 102 6.553 -0.717 9.757 1.00 0.00 H new ATOM 0 HB3 GLN A 102 5.368 -0.787 11.046 1.00 0.00 H new ATOM 0 HG2 GLN A 102 6.683 -2.398 12.277 1.00 0.00 H new ATOM 0 HG3 GLN A 102 7.782 -2.619 10.930 1.00 0.00 H new ATOM 0 HE21 GLN A 102 9.004 -0.637 10.184 1.00 0.00 H new ATOM 0 HE22 GLN A 102 9.552 0.484 11.435 1.00 0.00 H new ATOM 1518 N LYS A 103 5.941 -4.652 8.799 1.00 0.00 N ATOM 1519 CA LYS A 103 6.801 -5.625 8.137 1.00 0.00 C ATOM 1520 C LYS A 103 6.300 -5.928 6.730 1.00 0.00 C ATOM 1521 O LYS A 103 7.086 -6.242 5.834 1.00 0.00 O ATOM 1522 CB LYS A 103 6.868 -6.914 8.957 1.00 0.00 C ATOM 1523 CG LYS A 103 8.037 -6.959 9.927 1.00 0.00 C ATOM 1524 CD LYS A 103 7.621 -6.518 11.321 1.00 0.00 C ATOM 1525 CE LYS A 103 8.269 -7.378 12.395 1.00 0.00 C ATOM 1526 NZ LYS A 103 8.348 -6.668 13.702 1.00 0.00 N ATOM 0 H LYS A 103 5.018 -5.006 9.050 1.00 0.00 H new ATOM 0 HA LYS A 103 7.801 -5.197 8.060 1.00 0.00 H new ATOM 0 HB2 LYS A 103 5.939 -7.028 9.516 1.00 0.00 H new ATOM 0 HB3 LYS A 103 6.938 -7.764 8.278 1.00 0.00 H new ATOM 0 HG2 LYS A 103 8.438 -7.972 9.969 1.00 0.00 H new ATOM 0 HG3 LYS A 103 8.838 -6.314 9.564 1.00 0.00 H new ATOM 0 HD2 LYS A 103 7.899 -5.475 11.472 1.00 0.00 H new ATOM 0 HD3 LYS A 103 6.536 -6.575 11.413 1.00 0.00 H new ATOM 0 HE2 LYS A 103 7.699 -8.299 12.516 1.00 0.00 H new ATOM 0 HE3 LYS A 103 9.271 -7.664 12.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 8.796 -7.288 14.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 8.914 -5.802 13.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 7.390 -6.418 14.020 1.00 0.00 H new ATOM 1540 N ARG A 104 4.988 -5.837 6.538 1.00 0.00 N ATOM 1541 CA ARG A 104 4.386 -6.106 5.237 1.00 0.00 C ATOM 1542 C ARG A 104 3.680 -4.869 4.692 1.00 0.00 C ATOM 1543 O ARG A 104 3.747 -4.580 3.498 1.00 0.00 O ATOM 1544 CB ARG A 104 3.396 -7.266 5.342 1.00 0.00 C ATOM 1545 CG ARG A 104 3.965 -8.491 6.040 1.00 0.00 C ATOM 1546 CD ARG A 104 2.883 -9.516 6.338 1.00 0.00 C ATOM 1547 NE ARG A 104 2.721 -10.475 5.248 1.00 0.00 N ATOM 1548 CZ ARG A 104 2.077 -11.633 5.369 1.00 0.00 C ATOM 1549 NH1 ARG A 104 1.534 -11.981 6.529 1.00 0.00 N ATOM 1550 NH2 ARG A 104 1.975 -12.447 4.327 1.00 0.00 N ATOM 0 H ARG A 104 4.322 -5.579 7.266 1.00 0.00 H new ATOM 0 HA ARG A 104 5.185 -6.377 4.547 1.00 0.00 H new ATOM 0 HB2 ARG A 104 2.511 -6.929 5.881 1.00 0.00 H new ATOM 0 HB3 ARG A 104 3.071 -7.547 4.340 1.00 0.00 H new ATOM 0 HG2 ARG A 104 4.734 -8.944 5.414 1.00 0.00 H new ATOM 0 HG3 ARG A 104 4.448 -8.190 6.970 1.00 0.00 H new ATOM 0 HD2 ARG A 104 3.132 -10.049 7.256 1.00 0.00 H new ATOM 0 HD3 ARG A 104 1.937 -9.004 6.513 1.00 0.00 H new ATOM 0 HE ARG A 104 3.125 -10.243 4.341 1.00 0.00 H new ATOM 0 HH11 ARG A 104 1.609 -11.359 7.334 1.00 0.00 H new ATOM 0 HH12 ARG A 104 1.042 -12.870 6.615 1.00 0.00 H new ATOM 0 HH21 ARG A 104 2.390 -12.185 3.433 1.00 0.00 H new ATOM 0 HH22 ARG A 104 1.481 -13.335 4.420 1.00 0.00 H new ATOM 1564 N LEU A 105 2.999 -4.141 5.572 1.00 0.00 N ATOM 1565 CA LEU A 105 2.279 -2.937 5.174 1.00 0.00 C ATOM 1566 C LEU A 105 3.090 -1.684 5.487 1.00 0.00 C ATOM 1567 O LEU A 105 3.809 -1.632 6.486 1.00 0.00 O ATOM 1568 CB LEU A 105 0.919 -2.867 5.877 1.00 0.00 C ATOM 1569 CG LEU A 105 0.872 -3.478 7.279 1.00 0.00 C ATOM 1570 CD1 LEU A 105 -0.144 -2.748 8.144 1.00 0.00 C ATOM 1571 CD2 LEU A 105 0.542 -4.961 7.203 1.00 0.00 C ATOM 0 H LEU A 105 2.931 -4.364 6.565 1.00 0.00 H new ATOM 0 HA LEU A 105 2.120 -2.985 4.097 1.00 0.00 H new ATOM 0 HB2 LEU A 105 0.617 -1.822 5.944 1.00 0.00 H new ATOM 0 HB3 LEU A 105 0.181 -3.372 5.254 1.00 0.00 H new ATOM 0 HG LEU A 105 1.855 -3.368 7.737 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -0.164 -3.196 9.138 1.00 0.00 H new ATOM 0 HD12 LEU A 105 0.135 -1.697 8.225 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -1.132 -2.827 7.690 1.00 0.00 H new ATOM 0 HD21 LEU A 105 0.513 -5.379 8.209 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -0.429 -5.094 6.726 1.00 0.00 H new ATOM 0 HD23 LEU A 105 1.306 -5.474 6.619 1.00 0.00 H new ATOM 1583 N ILE A 106 2.969 -0.675 4.628 1.00 0.00 N ATOM 1584 CA ILE A 106 3.690 0.579 4.818 1.00 0.00 C ATOM 1585 C ILE A 106 2.827 1.777 4.416 1.00 0.00 C ATOM 1586 O ILE A 106 2.264 1.807 3.322 1.00 0.00 O ATOM 1587 CB ILE A 106 4.997 0.610 4.002 1.00 0.00 C ATOM 1588 CG1 ILE A 106 4.739 0.173 2.553 1.00 0.00 C ATOM 1589 CG2 ILE A 106 6.055 -0.266 4.660 1.00 0.00 C ATOM 1590 CD1 ILE A 106 4.768 -1.327 2.343 1.00 0.00 C ATOM 0 H ILE A 106 2.380 -0.702 3.796 1.00 0.00 H new ATOM 0 HA ILE A 106 3.932 0.644 5.879 1.00 0.00 H new ATOM 0 HB ILE A 106 5.371 1.634 3.981 1.00 0.00 H new ATOM 0 HG12 ILE A 106 3.768 0.554 2.238 1.00 0.00 H new ATOM 0 HG13 ILE A 106 5.487 0.634 1.908 1.00 0.00 H new ATOM 0 HG21 ILE A 106 6.972 -0.233 4.071 1.00 0.00 H new ATOM 0 HG22 ILE A 106 6.257 0.101 5.666 1.00 0.00 H new ATOM 0 HG23 ILE A 106 5.695 -1.293 4.714 1.00 0.00 H new ATOM 0 HD11 ILE A 106 4.577 -1.551 1.294 1.00 0.00 H new ATOM 0 HD12 ILE A 106 5.747 -1.715 2.624 1.00 0.00 H new ATOM 0 HD13 ILE A 106 4.001 -1.796 2.960 1.00 0.00 H new ATOM 1602 N PRO A 107 2.704 2.783 5.304 1.00 0.00 N ATOM 1603 CA PRO A 107 1.902 3.983 5.039 1.00 0.00 C ATOM 1604 C PRO A 107 2.568 4.935 4.051 1.00 0.00 C ATOM 1605 O PRO A 107 3.793 5.011 3.971 1.00 0.00 O ATOM 1606 CB PRO A 107 1.795 4.639 6.415 1.00 0.00 C ATOM 1607 CG PRO A 107 3.036 4.219 7.122 1.00 0.00 C ATOM 1608 CD PRO A 107 3.329 2.824 6.641 1.00 0.00 C ATOM 0 HA PRO A 107 0.943 3.735 4.584 1.00 0.00 H new ATOM 0 HB2 PRO A 107 1.731 5.724 6.334 1.00 0.00 H new ATOM 0 HB3 PRO A 107 0.903 4.306 6.946 1.00 0.00 H new ATOM 0 HG2 PRO A 107 3.862 4.893 6.895 1.00 0.00 H new ATOM 0 HG3 PRO A 107 2.896 4.239 8.203 1.00 0.00 H new ATOM 0 HD2 PRO A 107 4.401 2.634 6.589 1.00 0.00 H new ATOM 0 HD3 PRO A 107 2.904 2.072 7.306 1.00 0.00 H new ATOM 1616 N ILE A 108 1.744 5.659 3.301 1.00 0.00 N ATOM 1617 CA ILE A 108 2.231 6.613 2.313 1.00 0.00 C ATOM 1618 C ILE A 108 1.241 7.766 2.151 1.00 0.00 C ATOM 1619 O ILE A 108 0.074 7.646 2.523 1.00 0.00 O ATOM 1620 CB ILE A 108 2.464 5.924 0.948 1.00 0.00 C ATOM 1621 CG1 ILE A 108 3.622 4.931 1.051 1.00 0.00 C ATOM 1622 CG2 ILE A 108 2.742 6.947 -0.147 1.00 0.00 C ATOM 1623 CD1 ILE A 108 3.188 3.535 1.440 1.00 0.00 C ATOM 0 H ILE A 108 0.727 5.602 3.360 1.00 0.00 H new ATOM 0 HA ILE A 108 3.182 7.009 2.668 1.00 0.00 H new ATOM 0 HB ILE A 108 1.555 5.386 0.681 1.00 0.00 H new ATOM 0 HG12 ILE A 108 4.139 4.888 0.093 1.00 0.00 H new ATOM 0 HG13 ILE A 108 4.340 5.297 1.785 1.00 0.00 H new ATOM 0 HG21 ILE A 108 2.902 6.432 -1.094 1.00 0.00 H new ATOM 0 HG22 ILE A 108 1.891 7.621 -0.240 1.00 0.00 H new ATOM 0 HG23 ILE A 108 3.633 7.521 0.109 1.00 0.00 H new ATOM 0 HD11 ILE A 108 4.061 2.884 1.494 1.00 0.00 H new ATOM 0 HD12 ILE A 108 2.697 3.564 2.413 1.00 0.00 H new ATOM 0 HD13 ILE A 108 2.493 3.149 0.694 1.00 0.00 H new ATOM 1635 N LYS A 109 1.705 8.882 1.597 1.00 0.00 N ATOM 1636 CA LYS A 109 0.844 10.042 1.397 1.00 0.00 C ATOM 1637 C LYS A 109 1.563 11.137 0.617 1.00 0.00 C ATOM 1638 O LYS A 109 2.780 11.288 0.718 1.00 0.00 O ATOM 1639 CB LYS A 109 0.370 10.587 2.744 1.00 0.00 C ATOM 1640 CG LYS A 109 1.494 11.134 3.611 1.00 0.00 C ATOM 1641 CD LYS A 109 2.089 10.053 4.502 1.00 0.00 C ATOM 1642 CE LYS A 109 2.073 10.463 5.966 1.00 0.00 C ATOM 1643 NZ LYS A 109 3.179 11.408 6.290 1.00 0.00 N ATOM 0 H LYS A 109 2.666 9.007 1.280 1.00 0.00 H new ATOM 0 HA LYS A 109 -0.020 9.721 0.815 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -0.360 11.377 2.570 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -0.143 9.793 3.287 1.00 0.00 H new ATOM 0 HG2 LYS A 109 2.274 11.553 2.975 1.00 0.00 H new ATOM 0 HG3 LYS A 109 1.115 11.948 4.229 1.00 0.00 H new ATOM 0 HD2 LYS A 109 1.527 9.127 4.377 1.00 0.00 H new ATOM 0 HD3 LYS A 109 3.114 9.848 4.192 1.00 0.00 H new ATOM 0 HE2 LYS A 109 1.116 10.929 6.202 1.00 0.00 H new ATOM 0 HE3 LYS A 109 2.159 9.575 6.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 3.186 11.597 7.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 4.088 10.988 6.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 3.036 12.300 5.774 1.00 0.00 H new ATOM 1657 N TYR A 110 0.797 11.901 -0.156 1.00 0.00 N ATOM 1658 CA TYR A 110 1.358 12.988 -0.950 1.00 0.00 C ATOM 1659 C TYR A 110 1.732 14.180 -0.065 1.00 0.00 C ATOM 1660 O TYR A 110 2.371 15.127 -0.525 1.00 0.00 O ATOM 1661 CB TYR A 110 0.372 13.419 -2.041 1.00 0.00 C ATOM 1662 CG TYR A 110 -0.847 14.153 -1.524 1.00 0.00 C ATOM 1663 CD1 TYR A 110 -1.901 13.465 -0.932 1.00 0.00 C ATOM 1664 CD2 TYR A 110 -0.946 15.534 -1.634 1.00 0.00 C ATOM 1665 CE1 TYR A 110 -3.016 14.134 -0.464 1.00 0.00 C ATOM 1666 CE2 TYR A 110 -2.058 16.210 -1.169 1.00 0.00 C ATOM 1667 CZ TYR A 110 -3.090 15.506 -0.585 1.00 0.00 C ATOM 1668 OH TYR A 110 -4.199 16.175 -0.122 1.00 0.00 O ATOM 0 H TYR A 110 -0.212 11.787 -0.249 1.00 0.00 H new ATOM 0 HA TYR A 110 2.268 12.623 -1.427 1.00 0.00 H new ATOM 0 HB2 TYR A 110 0.893 14.060 -2.753 1.00 0.00 H new ATOM 0 HB3 TYR A 110 0.045 12.535 -2.588 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -1.847 12.391 -0.837 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -0.140 16.089 -2.091 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -3.825 13.585 -0.006 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -2.119 17.284 -1.262 1.00 0.00 H new ATOM 0 HH TYR A 110 -4.092 17.136 -0.283 1.00 0.00 H new ATOM 1678 N LYS A 111 1.337 14.122 1.206 1.00 0.00 N ATOM 1679 CA LYS A 111 1.636 15.190 2.154 1.00 0.00 C ATOM 1680 C LYS A 111 1.092 14.847 3.536 1.00 0.00 C ATOM 1681 O LYS A 111 0.063 14.182 3.662 1.00 0.00 O ATOM 1682 CB LYS A 111 1.050 16.517 1.673 1.00 0.00 C ATOM 1683 CG LYS A 111 -0.426 16.440 1.320 1.00 0.00 C ATOM 1684 CD LYS A 111 -1.306 16.642 2.545 1.00 0.00 C ATOM 1685 CE LYS A 111 -2.329 17.745 2.323 1.00 0.00 C ATOM 1686 NZ LYS A 111 -3.557 17.537 3.139 1.00 0.00 N ATOM 0 H LYS A 111 0.808 13.345 1.602 1.00 0.00 H new ATOM 0 HA LYS A 111 2.719 15.292 2.220 1.00 0.00 H new ATOM 0 HB2 LYS A 111 1.190 17.269 2.450 1.00 0.00 H new ATOM 0 HB3 LYS A 111 1.607 16.854 0.799 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -0.662 17.198 0.573 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -0.643 15.471 0.871 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -1.820 15.711 2.782 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -0.683 16.890 3.404 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -1.885 18.708 2.575 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -2.597 17.784 1.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -4.229 18.310 2.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -3.996 16.630 2.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -3.305 17.525 4.148 1.00 0.00 H new ATOM 1700 N ALA A 112 1.792 15.301 4.571 1.00 0.00 N ATOM 1701 CA ALA A 112 1.383 15.037 5.946 1.00 0.00 C ATOM 1702 C ALA A 112 -0.027 15.554 6.218 1.00 0.00 C ATOM 1703 O ALA A 112 -0.486 16.505 5.585 1.00 0.00 O ATOM 1704 CB ALA A 112 2.372 15.665 6.917 1.00 0.00 C ATOM 0 H ALA A 112 2.645 15.853 4.484 1.00 0.00 H new ATOM 0 HA ALA A 112 1.375 13.957 6.092 1.00 0.00 H new ATOM 0 HB1 ALA A 112 2.056 15.461 7.940 1.00 0.00 H new ATOM 0 HB2 ALA A 112 3.363 15.242 6.752 1.00 0.00 H new ATOM 0 HB3 ALA A 112 2.406 16.742 6.755 1.00 0.00 H new ATOM 1710 N MET A 113 -0.706 14.918 7.168 1.00 0.00 N ATOM 1711 CA MET A 113 -2.062 15.305 7.535 1.00 0.00 C ATOM 1712 C MET A 113 -2.050 16.439 8.548 1.00 0.00 C ATOM 1713 O MET A 113 -1.314 16.403 9.533 1.00 0.00 O ATOM 1714 CB MET A 113 -2.815 14.105 8.108 1.00 0.00 C ATOM 1715 CG MET A 113 -2.807 12.893 7.192 1.00 0.00 C ATOM 1716 SD MET A 113 -1.534 11.696 7.636 1.00 0.00 S ATOM 1717 CE MET A 113 -1.913 11.422 9.365 1.00 0.00 C ATOM 0 H MET A 113 -0.336 14.129 7.699 1.00 0.00 H new ATOM 0 HA MET A 113 -2.570 15.653 6.635 1.00 0.00 H new ATOM 0 HB2 MET A 113 -2.371 13.831 9.065 1.00 0.00 H new ATOM 0 HB3 MET A 113 -3.847 14.394 8.306 1.00 0.00 H new ATOM 0 HG2 MET A 113 -3.783 12.409 7.227 1.00 0.00 H new ATOM 0 HG3 MET A 113 -2.650 13.220 6.164 1.00 0.00 H new ATOM 0 HE1 MET A 113 -1.066 11.732 9.977 1.00 0.00 H new ATOM 0 HE2 MET A 113 -2.793 12.003 9.641 1.00 0.00 H new ATOM 0 HE3 MET A 113 -2.111 10.363 9.531 1.00 0.00 H new ATOM 1727 N LYS A 114 -2.882 17.443 8.299 1.00 0.00 N ATOM 1728 CA LYS A 114 -2.983 18.593 9.185 1.00 0.00 C ATOM 1729 C LYS A 114 -3.691 18.221 10.486 1.00 0.00 C ATOM 1730 O LYS A 114 -3.792 19.043 11.399 1.00 0.00 O ATOM 1731 CB LYS A 114 -3.732 19.733 8.491 1.00 0.00 C ATOM 1732 CG LYS A 114 -2.815 20.751 7.835 1.00 0.00 C ATOM 1733 CD LYS A 114 -2.686 20.507 6.338 1.00 0.00 C ATOM 1734 CE LYS A 114 -1.233 20.524 5.893 1.00 0.00 C ATOM 1735 NZ LYS A 114 -0.641 21.887 5.980 1.00 0.00 N ATOM 0 H LYS A 114 -3.498 17.483 7.487 1.00 0.00 H new ATOM 0 HA LYS A 114 -1.973 18.923 9.426 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -4.396 19.314 7.735 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -4.362 20.241 9.221 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -3.202 21.755 8.008 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -1.829 20.705 8.298 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -3.134 19.546 6.085 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -3.243 21.271 5.795 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -0.656 19.837 6.512 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -1.163 20.163 4.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 0.351 21.855 5.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -1.176 22.537 5.369 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -0.684 22.222 6.964 1.00 0.00 H new ATOM 1749 N LYS A 115 -4.184 16.985 10.573 1.00 0.00 N ATOM 1750 CA LYS A 115 -4.878 16.532 11.773 1.00 0.00 C ATOM 1751 C LYS A 115 -4.098 15.417 12.475 1.00 0.00 C ATOM 1752 O LYS A 115 -2.884 15.303 12.302 1.00 0.00 O ATOM 1753 CB LYS A 115 -6.317 16.116 11.451 1.00 0.00 C ATOM 1754 CG LYS A 115 -6.495 15.514 10.077 1.00 0.00 C ATOM 1755 CD LYS A 115 -6.290 14.020 10.121 1.00 0.00 C ATOM 1756 CE LYS A 115 -7.443 13.332 10.838 1.00 0.00 C ATOM 1757 NZ LYS A 115 -7.095 12.978 12.241 1.00 0.00 N ATOM 0 H LYS A 115 -4.115 16.287 9.832 1.00 0.00 H new ATOM 0 HA LYS A 115 -4.934 17.368 12.470 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -6.650 15.395 12.197 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -6.964 16.989 11.540 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -7.494 15.739 9.702 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -5.785 15.964 9.382 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -6.204 13.631 9.106 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -5.353 13.793 10.630 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -8.314 13.987 10.835 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -7.721 12.429 10.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -7.647 12.147 12.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -6.080 12.759 12.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -7.315 13.780 12.866 1.00 0.00 H new ATOM 1771 N GLU A 116 -4.781 14.619 13.292 1.00 0.00 N ATOM 1772 CA GLU A 116 -4.134 13.554 14.039 1.00 0.00 C ATOM 1773 C GLU A 116 -3.825 12.342 13.169 1.00 0.00 C ATOM 1774 O GLU A 116 -4.398 12.164 12.096 1.00 0.00 O ATOM 1775 CB GLU A 116 -5.022 13.137 15.208 1.00 0.00 C ATOM 1776 CG GLU A 116 -5.527 14.307 16.038 1.00 0.00 C ATOM 1777 CD GLU A 116 -6.713 13.935 16.906 1.00 0.00 C ATOM 1778 OE1 GLU A 116 -6.672 12.858 17.538 1.00 0.00 O ATOM 1779 OE2 GLU A 116 -7.683 14.722 16.956 1.00 0.00 O ATOM 0 H GLU A 116 -5.786 14.694 13.451 1.00 0.00 H new ATOM 0 HA GLU A 116 -3.184 13.941 14.407 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -5.876 12.580 14.823 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -4.464 12.459 15.853 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -4.719 14.675 16.671 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -5.809 15.124 15.374 1.00 0.00 H new ATOM 1786 N PHE A 117 -2.915 11.508 13.660 1.00 0.00 N ATOM 1787 CA PHE A 117 -2.517 10.297 12.960 1.00 0.00 C ATOM 1788 C PHE A 117 -3.046 9.067 13.688 1.00 0.00 C ATOM 1789 O PHE A 117 -3.158 9.060 14.915 1.00 0.00 O ATOM 1790 CB PHE A 117 -0.990 10.217 12.842 1.00 0.00 C ATOM 1791 CG PHE A 117 -0.252 10.895 13.963 1.00 0.00 C ATOM 1792 CD1 PHE A 117 -0.200 10.321 15.222 1.00 0.00 C ATOM 1793 CD2 PHE A 117 0.389 12.106 13.755 1.00 0.00 C ATOM 1794 CE1 PHE A 117 0.479 10.941 16.254 1.00 0.00 C ATOM 1795 CE2 PHE A 117 1.069 12.731 14.783 1.00 0.00 C ATOM 1796 CZ PHE A 117 1.114 12.148 16.035 1.00 0.00 C ATOM 0 H PHE A 117 -2.436 11.653 14.549 1.00 0.00 H new ATOM 0 HA PHE A 117 -2.943 10.327 11.957 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -0.693 9.169 12.807 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -0.685 10.666 11.897 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -0.696 9.378 15.400 1.00 0.00 H new ATOM 0 HD2 PHE A 117 0.357 12.566 12.779 1.00 0.00 H new ATOM 0 HE1 PHE A 117 0.513 10.482 17.231 1.00 0.00 H new ATOM 0 HE2 PHE A 117 1.565 13.674 14.608 1.00 0.00 H new ATOM 0 HZ PHE A 117 1.644 12.635 16.840 1.00 0.00 H new ATOM 1806 N PRO A 118 -3.379 8.009 12.939 1.00 0.00 N ATOM 1807 CA PRO A 118 -3.900 6.769 13.507 1.00 0.00 C ATOM 1808 C PRO A 118 -2.796 5.853 14.006 1.00 0.00 C ATOM 1809 O PRO A 118 -1.671 5.910 13.512 1.00 0.00 O ATOM 1810 CB PRO A 118 -4.629 6.142 12.323 1.00 0.00 C ATOM 1811 CG PRO A 118 -3.866 6.597 11.126 1.00 0.00 C ATOM 1812 CD PRO A 118 -3.274 7.939 11.472 1.00 0.00 C ATOM 0 HA PRO A 118 -4.531 6.941 14.379 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -4.640 5.054 12.396 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -5.668 6.469 12.279 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -3.083 5.883 10.872 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -4.520 6.675 10.257 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -2.238 8.015 11.142 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -3.821 8.752 10.994 1.00 0.00 H new ATOM 1820 N SER A 119 -3.126 4.987 14.966 1.00 0.00 N ATOM 1821 CA SER A 119 -2.156 4.033 15.491 1.00 0.00 C ATOM 1822 C SER A 119 -1.835 3.051 14.383 1.00 0.00 C ATOM 1823 O SER A 119 -2.231 1.886 14.419 1.00 0.00 O ATOM 1824 CB SER A 119 -2.714 3.299 16.713 1.00 0.00 C ATOM 1825 OG SER A 119 -2.328 3.944 17.916 1.00 0.00 O ATOM 0 H SER A 119 -4.051 4.929 15.391 1.00 0.00 H new ATOM 0 HA SER A 119 -1.255 4.555 15.814 1.00 0.00 H new ATOM 0 HB2 SER A 119 -3.801 3.258 16.651 1.00 0.00 H new ATOM 0 HB3 SER A 119 -2.356 2.269 16.718 1.00 0.00 H new ATOM 0 HG SER A 119 -2.698 3.457 18.682 1.00 0.00 H new ATOM 1831 N ILE A 120 -1.170 3.568 13.365 1.00 0.00 N ATOM 1832 CA ILE A 120 -0.842 2.807 12.184 1.00 0.00 C ATOM 1833 C ILE A 120 0.478 3.289 11.591 1.00 0.00 C ATOM 1834 O ILE A 120 1.346 2.493 11.234 1.00 0.00 O ATOM 1835 CB ILE A 120 -1.991 2.986 11.167 1.00 0.00 C ATOM 1836 CG1 ILE A 120 -3.149 2.059 11.521 1.00 0.00 C ATOM 1837 CG2 ILE A 120 -1.532 2.760 9.742 1.00 0.00 C ATOM 1838 CD1 ILE A 120 -2.835 0.600 11.314 1.00 0.00 C ATOM 0 H ILE A 120 -0.843 4.534 13.339 1.00 0.00 H new ATOM 0 HA ILE A 120 -0.726 1.753 12.435 1.00 0.00 H new ATOM 0 HB ILE A 120 -2.332 4.020 11.227 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -3.426 2.219 12.563 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -4.016 2.326 10.916 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -2.373 2.897 9.063 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -0.747 3.474 9.495 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -1.145 1.746 9.641 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -3.703 -0.001 11.585 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -2.586 0.426 10.267 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -1.988 0.318 11.940 1.00 0.00 H new ATOM 1850 N LEU A 121 0.614 4.605 11.502 1.00 0.00 N ATOM 1851 CA LEU A 121 1.820 5.225 10.967 1.00 0.00 C ATOM 1852 C LEU A 121 2.459 6.145 12.005 1.00 0.00 C ATOM 1853 O LEU A 121 3.094 7.142 11.662 1.00 0.00 O ATOM 1854 CB LEU A 121 1.509 6.007 9.680 1.00 0.00 C ATOM 1855 CG LEU A 121 0.278 6.932 9.712 1.00 0.00 C ATOM 1856 CD1 LEU A 121 -1.007 6.141 9.513 1.00 0.00 C ATOM 1857 CD2 LEU A 121 0.220 7.734 11.006 1.00 0.00 C ATOM 0 H LEU A 121 -0.102 5.269 11.796 1.00 0.00 H new ATOM 0 HA LEU A 121 2.527 4.432 10.724 1.00 0.00 H new ATOM 0 HB2 LEU A 121 2.381 6.611 9.430 1.00 0.00 H new ATOM 0 HB3 LEU A 121 1.374 5.290 8.870 1.00 0.00 H new ATOM 0 HG LEU A 121 0.376 7.636 8.885 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -1.860 6.819 9.540 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -0.977 5.635 8.548 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -1.106 5.402 10.308 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -0.660 8.377 10.997 1.00 0.00 H new ATOM 0 HD22 LEU A 121 0.162 7.052 11.854 1.00 0.00 H new ATOM 0 HD23 LEU A 121 1.116 8.348 11.094 1.00 0.00 H new ATOM 1869 N ARG A 122 2.275 5.800 13.279 1.00 0.00 N ATOM 1870 CA ARG A 122 2.814 6.587 14.388 1.00 0.00 C ATOM 1871 C ARG A 122 4.240 7.062 14.117 1.00 0.00 C ATOM 1872 O ARG A 122 4.541 8.249 14.244 1.00 0.00 O ATOM 1873 CB ARG A 122 2.775 5.773 15.681 1.00 0.00 C ATOM 1874 CG ARG A 122 3.308 4.358 15.527 1.00 0.00 C ATOM 1875 CD ARG A 122 2.742 3.432 16.592 1.00 0.00 C ATOM 1876 NE ARG A 122 3.653 2.334 16.907 1.00 0.00 N ATOM 1877 CZ ARG A 122 3.275 1.204 17.499 1.00 0.00 C ATOM 1878 NH1 ARG A 122 2.006 1.020 17.844 1.00 0.00 N ATOM 1879 NH2 ARG A 122 4.167 0.256 17.749 1.00 0.00 N ATOM 0 H ARG A 122 1.752 4.974 13.570 1.00 0.00 H new ATOM 0 HA ARG A 122 2.186 7.471 14.492 1.00 0.00 H new ATOM 0 HB2 ARG A 122 3.357 6.290 16.444 1.00 0.00 H new ATOM 0 HB3 ARG A 122 1.747 5.728 16.041 1.00 0.00 H new ATOM 0 HG2 ARG A 122 3.052 3.977 14.538 1.00 0.00 H new ATOM 0 HG3 ARG A 122 4.396 4.368 15.593 1.00 0.00 H new ATOM 0 HD2 ARG A 122 2.538 4.004 17.497 1.00 0.00 H new ATOM 0 HD3 ARG A 122 1.790 3.026 16.250 1.00 0.00 H new ATOM 0 HE ARG A 122 4.637 2.440 16.658 1.00 0.00 H new ATOM 0 HH11 ARG A 122 1.316 1.747 17.655 1.00 0.00 H new ATOM 0 HH12 ARG A 122 1.722 0.152 18.298 1.00 0.00 H new ATOM 0 HH21 ARG A 122 5.143 0.393 17.488 1.00 0.00 H new ATOM 0 HH22 ARG A 122 3.877 -0.610 18.203 1.00 0.00 H new ATOM 1893 N PHE A 123 5.112 6.134 13.753 1.00 0.00 N ATOM 1894 CA PHE A 123 6.504 6.468 13.472 1.00 0.00 C ATOM 1895 C PHE A 123 7.173 5.379 12.643 1.00 0.00 C ATOM 1896 O PHE A 123 8.389 5.197 12.704 1.00 0.00 O ATOM 1897 CB PHE A 123 7.271 6.678 14.781 1.00 0.00 C ATOM 1898 CG PHE A 123 8.081 7.943 14.808 1.00 0.00 C ATOM 1899 CD1 PHE A 123 8.948 8.247 13.771 1.00 0.00 C ATOM 1900 CD2 PHE A 123 7.974 8.827 15.870 1.00 0.00 C ATOM 1901 CE1 PHE A 123 9.693 9.411 13.793 1.00 0.00 C ATOM 1902 CE2 PHE A 123 8.717 9.991 15.898 1.00 0.00 C ATOM 1903 CZ PHE A 123 9.578 10.283 14.857 1.00 0.00 C ATOM 0 H PHE A 123 4.883 5.146 13.645 1.00 0.00 H new ATOM 0 HA PHE A 123 6.520 7.393 12.895 1.00 0.00 H new ATOM 0 HB2 PHE A 123 6.562 6.693 15.609 1.00 0.00 H new ATOM 0 HB3 PHE A 123 7.934 5.828 14.944 1.00 0.00 H new ATOM 0 HD1 PHE A 123 9.043 7.568 12.937 1.00 0.00 H new ATOM 0 HD2 PHE A 123 7.302 8.603 16.685 1.00 0.00 H new ATOM 0 HE1 PHE A 123 10.365 9.638 12.978 1.00 0.00 H new ATOM 0 HE2 PHE A 123 8.625 10.672 16.732 1.00 0.00 H new ATOM 0 HZ PHE A 123 10.160 11.192 14.876 1.00 0.00 H new ATOM 1913 N ILE A 124 6.373 4.655 11.872 1.00 0.00 N ATOM 1914 CA ILE A 124 6.879 3.586 11.036 1.00 0.00 C ATOM 1915 C ILE A 124 7.365 4.123 9.692 1.00 0.00 C ATOM 1916 O ILE A 124 7.440 5.336 9.488 1.00 0.00 O ATOM 1917 CB ILE A 124 5.788 2.522 10.815 1.00 0.00 C ATOM 1918 CG1 ILE A 124 4.708 3.042 9.860 1.00 0.00 C ATOM 1919 CG2 ILE A 124 5.175 2.107 12.146 1.00 0.00 C ATOM 1920 CD1 ILE A 124 3.556 2.079 9.660 1.00 0.00 C ATOM 0 H ILE A 124 5.364 4.794 11.811 1.00 0.00 H new ATOM 0 HA ILE A 124 7.726 3.129 11.548 1.00 0.00 H new ATOM 0 HB ILE A 124 6.249 1.646 10.359 1.00 0.00 H new ATOM 0 HG12 ILE A 124 4.319 3.985 10.245 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.163 3.256 8.893 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.406 1.355 11.973 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.950 1.692 12.790 1.00 0.00 H new ATOM 0 HG23 ILE A 124 4.730 2.977 12.629 1.00 0.00 H new ATOM 0 HD11 ILE A 124 2.832 2.516 8.972 1.00 0.00 H new ATOM 0 HD12 ILE A 124 3.932 1.143 9.246 1.00 0.00 H new ATOM 0 HD13 ILE A 124 3.074 1.884 10.618 1.00 0.00 H new ATOM 1932 N THR A 125 7.698 3.216 8.779 1.00 0.00 N ATOM 1933 CA THR A 125 8.178 3.608 7.457 1.00 0.00 C ATOM 1934 C THR A 125 7.104 4.377 6.693 1.00 0.00 C ATOM 1935 O THR A 125 6.197 3.783 6.114 1.00 0.00 O ATOM 1936 CB THR A 125 8.600 2.376 6.657 1.00 0.00 C ATOM 1937 OG1 THR A 125 9.662 1.696 7.304 1.00 0.00 O ATOM 1938 CG2 THR A 125 9.054 2.705 5.251 1.00 0.00 C ATOM 0 H THR A 125 7.645 2.208 8.929 1.00 0.00 H new ATOM 0 HA THR A 125 9.041 4.259 7.592 1.00 0.00 H new ATOM 0 HB THR A 125 7.710 1.750 6.598 1.00 0.00 H new ATOM 0 HG1 THR A 125 9.916 0.910 6.777 1.00 0.00 H new ATOM 0 HG21 THR A 125 9.340 1.787 4.737 1.00 0.00 H new ATOM 0 HG22 THR A 125 8.240 3.186 4.709 1.00 0.00 H new ATOM 0 HG23 THR A 125 9.910 3.379 5.293 1.00 0.00 H new ATOM 1946 N VAL A 126 7.215 5.701 6.696 1.00 0.00 N ATOM 1947 CA VAL A 126 6.254 6.546 6.005 1.00 0.00 C ATOM 1948 C VAL A 126 6.882 7.221 4.789 1.00 0.00 C ATOM 1949 O VAL A 126 7.998 7.735 4.859 1.00 0.00 O ATOM 1950 CB VAL A 126 5.682 7.620 6.946 1.00 0.00 C ATOM 1951 CG1 VAL A 126 6.770 8.588 7.389 1.00 0.00 C ATOM 1952 CG2 VAL A 126 4.534 8.361 6.279 1.00 0.00 C ATOM 0 H VAL A 126 7.961 6.210 7.170 1.00 0.00 H new ATOM 0 HA VAL A 126 5.444 5.899 5.669 1.00 0.00 H new ATOM 0 HB VAL A 126 5.294 7.122 7.835 1.00 0.00 H new ATOM 0 HG11 VAL A 126 6.341 9.338 8.054 1.00 0.00 H new ATOM 0 HG12 VAL A 126 7.552 8.041 7.916 1.00 0.00 H new ATOM 0 HG13 VAL A 126 7.198 9.080 6.515 1.00 0.00 H new ATOM 0 HG21 VAL A 126 4.143 9.116 6.961 1.00 0.00 H new ATOM 0 HG22 VAL A 126 4.892 8.844 5.370 1.00 0.00 H new ATOM 0 HG23 VAL A 126 3.742 7.655 6.028 1.00 0.00 H new ATOM 1962 N CYS A 127 6.155 7.215 3.675 1.00 0.00 N ATOM 1963 CA CYS A 127 6.639 7.827 2.442 1.00 0.00 C ATOM 1964 C CYS A 127 5.849 9.089 2.111 1.00 0.00 C ATOM 1965 O CYS A 127 4.690 9.019 1.703 1.00 0.00 O ATOM 1966 CB CYS A 127 6.542 6.832 1.284 1.00 0.00 C ATOM 1967 SG CYS A 127 7.555 7.266 -0.149 1.00 0.00 S ATOM 0 H CYS A 127 5.229 6.793 3.601 1.00 0.00 H new ATOM 0 HA CYS A 127 7.683 8.104 2.589 1.00 0.00 H new ATOM 0 HB2 CYS A 127 6.840 5.846 1.641 1.00 0.00 H new ATOM 0 HB3 CYS A 127 5.501 6.757 0.970 1.00 0.00 H new ATOM 0 HG CYS A 127 7.408 6.364 -1.074 1.00 0.00 H new ATOM 1973 N ASP A 128 6.487 10.242 2.285 1.00 0.00 N ATOM 1974 CA ASP A 128 5.847 11.522 2.001 1.00 0.00 C ATOM 1975 C ASP A 128 6.652 12.310 0.973 1.00 0.00 C ATOM 1976 O ASP A 128 7.861 12.119 0.841 1.00 0.00 O ATOM 1977 CB ASP A 128 5.698 12.338 3.286 1.00 0.00 C ATOM 1978 CG ASP A 128 4.604 13.382 3.186 1.00 0.00 C ATOM 1979 OD1 ASP A 128 4.811 14.393 2.481 1.00 0.00 O ATOM 1980 OD2 ASP A 128 3.539 13.191 3.809 1.00 0.00 O ATOM 0 H ASP A 128 7.447 10.316 2.621 1.00 0.00 H new ATOM 0 HA ASP A 128 4.857 11.325 1.590 1.00 0.00 H new ATOM 0 HB2 ASP A 128 5.480 11.666 4.116 1.00 0.00 H new ATOM 0 HB3 ASP A 128 6.645 12.829 3.513 1.00 0.00 H new ATOM 1985 N TYR A 129 5.978 13.198 0.247 1.00 0.00 N ATOM 1986 CA TYR A 129 6.643 14.009 -0.765 1.00 0.00 C ATOM 1987 C TYR A 129 7.483 15.105 -0.120 1.00 0.00 C ATOM 1988 O TYR A 129 7.093 16.273 -0.104 1.00 0.00 O ATOM 1989 CB TYR A 129 5.617 14.633 -1.717 1.00 0.00 C ATOM 1990 CG TYR A 129 5.043 13.657 -2.720 1.00 0.00 C ATOM 1991 CD1 TYR A 129 4.559 12.418 -2.318 1.00 0.00 C ATOM 1992 CD2 TYR A 129 4.985 13.976 -4.070 1.00 0.00 C ATOM 1993 CE1 TYR A 129 4.034 11.526 -3.233 1.00 0.00 C ATOM 1994 CE2 TYR A 129 4.461 13.089 -4.991 1.00 0.00 C ATOM 1995 CZ TYR A 129 3.986 11.866 -4.568 1.00 0.00 C ATOM 1996 OH TYR A 129 3.464 10.980 -5.482 1.00 0.00 O ATOM 0 H TYR A 129 4.977 13.373 0.341 1.00 0.00 H new ATOM 0 HA TYR A 129 7.303 13.355 -1.335 1.00 0.00 H new ATOM 0 HB2 TYR A 129 4.803 15.058 -1.131 1.00 0.00 H new ATOM 0 HB3 TYR A 129 6.087 15.457 -2.254 1.00 0.00 H new ATOM 0 HD1 TYR A 129 4.594 12.148 -1.273 1.00 0.00 H new ATOM 0 HD2 TYR A 129 5.356 14.933 -4.406 1.00 0.00 H new ATOM 0 HE1 TYR A 129 3.663 10.567 -2.904 1.00 0.00 H new ATOM 0 HE2 TYR A 129 4.424 13.353 -6.038 1.00 0.00 H new ATOM 0 HH TYR A 129 3.503 11.374 -6.379 1.00 0.00 H new ATOM 2006 N THR A 130 8.643 14.722 0.400 1.00 0.00 N ATOM 2007 CA THR A 130 9.546 15.674 1.033 1.00 0.00 C ATOM 2008 C THR A 130 10.486 16.269 -0.003 1.00 0.00 C ATOM 2009 O THR A 130 11.583 15.756 -0.229 1.00 0.00 O ATOM 2010 CB THR A 130 10.348 14.995 2.146 1.00 0.00 C ATOM 2011 OG1 THR A 130 10.872 13.757 1.701 1.00 0.00 O ATOM 2012 CG2 THR A 130 9.534 14.727 3.393 1.00 0.00 C ATOM 0 H THR A 130 8.980 13.759 0.396 1.00 0.00 H new ATOM 0 HA THR A 130 8.953 16.475 1.474 1.00 0.00 H new ATOM 0 HB THR A 130 11.145 15.695 2.396 1.00 0.00 H new ATOM 0 HG1 THR A 130 11.383 13.339 2.425 1.00 0.00 H new ATOM 0 HG21 THR A 130 10.163 14.245 4.141 1.00 0.00 H new ATOM 0 HG22 THR A 130 9.155 15.669 3.790 1.00 0.00 H new ATOM 0 HG23 THR A 130 8.697 14.074 3.147 1.00 0.00 H new ATOM 2020 N ASN A 131 10.042 17.342 -0.648 1.00 0.00 N ATOM 2021 CA ASN A 131 10.835 17.993 -1.683 1.00 0.00 C ATOM 2022 C ASN A 131 10.859 17.127 -2.942 1.00 0.00 C ATOM 2023 O ASN A 131 11.925 16.780 -3.452 1.00 0.00 O ATOM 2024 CB ASN A 131 12.261 18.259 -1.187 1.00 0.00 C ATOM 2025 CG ASN A 131 12.696 19.694 -1.421 1.00 0.00 C ATOM 2026 OD1 ASN A 131 12.895 20.114 -2.560 1.00 0.00 O ATOM 2027 ND2 ASN A 131 12.845 20.451 -0.340 1.00 0.00 N ATOM 0 H ASN A 131 9.137 17.779 -0.472 1.00 0.00 H new ATOM 0 HA ASN A 131 10.376 18.952 -1.923 1.00 0.00 H new ATOM 0 HB2 ASN A 131 12.321 18.033 -0.122 1.00 0.00 H new ATOM 0 HB3 ASN A 131 12.951 17.585 -1.695 1.00 0.00 H new ATOM 0 HD21 ASN A 131 13.136 21.424 -0.435 1.00 0.00 H new ATOM 0 HD22 ASN A 131 12.669 20.059 0.585 1.00 0.00 H new ATOM 2034 N PRO A 132 9.671 16.764 -3.458 1.00 0.00 N ATOM 2035 CA PRO A 132 9.544 15.932 -4.658 1.00 0.00 C ATOM 2036 C PRO A 132 10.363 16.470 -5.823 1.00 0.00 C ATOM 2037 O PRO A 132 10.723 15.727 -6.736 1.00 0.00 O ATOM 2038 CB PRO A 132 8.043 15.976 -4.987 1.00 0.00 C ATOM 2039 CG PRO A 132 7.474 17.057 -4.127 1.00 0.00 C ATOM 2040 CD PRO A 132 8.357 17.132 -2.917 1.00 0.00 C ATOM 0 HA PRO A 132 9.918 14.922 -4.487 1.00 0.00 H new ATOM 0 HB2 PRO A 132 7.879 16.189 -6.043 1.00 0.00 H new ATOM 0 HB3 PRO A 132 7.568 15.018 -4.778 1.00 0.00 H new ATOM 0 HG2 PRO A 132 7.457 18.009 -4.657 1.00 0.00 H new ATOM 0 HG3 PRO A 132 6.445 16.831 -3.846 1.00 0.00 H new ATOM 0 HD2 PRO A 132 8.363 18.131 -2.481 1.00 0.00 H new ATOM 0 HD3 PRO A 132 8.033 16.445 -2.135 1.00 0.00 H new ATOM 2048 N CYS A 133 10.660 17.765 -5.785 1.00 0.00 N ATOM 2049 CA CYS A 133 11.445 18.405 -6.837 1.00 0.00 C ATOM 2050 C CYS A 133 12.675 17.570 -7.182 1.00 0.00 C ATOM 2051 O CYS A 133 13.024 17.407 -8.350 1.00 0.00 O ATOM 2052 CB CYS A 133 11.868 19.811 -6.404 1.00 0.00 C ATOM 2053 SG CYS A 133 10.928 21.139 -7.191 1.00 0.00 S ATOM 0 H CYS A 133 10.369 18.393 -5.036 1.00 0.00 H new ATOM 0 HA CYS A 133 10.821 18.482 -7.727 1.00 0.00 H new ATOM 0 HB2 CYS A 133 11.759 19.895 -5.323 1.00 0.00 H new ATOM 0 HB3 CYS A 133 12.926 19.946 -6.629 1.00 0.00 H new ATOM 0 HG CYS A 133 11.356 22.288 -6.760 1.00 0.00 H new ATOM 2059 N THR A 134 13.321 17.038 -6.150 1.00 0.00 N ATOM 2060 CA THR A 134 14.508 16.209 -6.334 1.00 0.00 C ATOM 2061 C THR A 134 14.304 14.817 -5.740 1.00 0.00 C ATOM 2062 O THR A 134 14.918 13.849 -6.184 1.00 0.00 O ATOM 2063 CB THR A 134 15.729 16.877 -5.700 1.00 0.00 C ATOM 2064 OG1 THR A 134 16.915 16.177 -6.037 1.00 0.00 O ATOM 2065 CG2 THR A 134 15.656 16.955 -4.191 1.00 0.00 C ATOM 0 H THR A 134 13.043 17.166 -5.177 1.00 0.00 H new ATOM 0 HA THR A 134 14.679 16.102 -7.405 1.00 0.00 H new ATOM 0 HB THR A 134 15.741 17.891 -6.099 1.00 0.00 H new ATOM 0 HG1 THR A 134 17.685 16.620 -5.624 1.00 0.00 H new ATOM 0 HG21 THR A 134 16.554 17.440 -3.808 1.00 0.00 H new ATOM 0 HG22 THR A 134 14.779 17.532 -3.899 1.00 0.00 H new ATOM 0 HG23 THR A 134 15.583 15.949 -3.778 1.00 0.00 H new ATOM 2073 N LYS A 135 13.430 14.723 -4.744 1.00 0.00 N ATOM 2074 CA LYS A 135 13.135 13.449 -4.101 1.00 0.00 C ATOM 2075 C LYS A 135 12.147 12.633 -4.937 1.00 0.00 C ATOM 2076 O LYS A 135 11.827 11.494 -4.597 1.00 0.00 O ATOM 2077 CB LYS A 135 12.570 13.681 -2.696 1.00 0.00 C ATOM 2078 CG LYS A 135 13.296 12.897 -1.614 1.00 0.00 C ATOM 2079 CD LYS A 135 12.493 12.853 -0.322 1.00 0.00 C ATOM 2080 CE LYS A 135 11.977 11.452 -0.031 1.00 0.00 C ATOM 2081 NZ LYS A 135 12.835 10.734 0.953 1.00 0.00 N ATOM 0 H LYS A 135 12.913 15.516 -4.364 1.00 0.00 H new ATOM 0 HA LYS A 135 14.065 12.885 -4.020 1.00 0.00 H new ATOM 0 HB2 LYS A 135 12.625 14.744 -2.462 1.00 0.00 H new ATOM 0 HB3 LYS A 135 11.515 13.406 -2.687 1.00 0.00 H new ATOM 0 HG2 LYS A 135 13.482 11.881 -1.962 1.00 0.00 H new ATOM 0 HG3 LYS A 135 14.268 13.352 -1.424 1.00 0.00 H new ATOM 0 HD2 LYS A 135 13.116 13.191 0.506 1.00 0.00 H new ATOM 0 HD3 LYS A 135 11.653 13.544 -0.391 1.00 0.00 H new ATOM 0 HE2 LYS A 135 10.959 11.513 0.353 1.00 0.00 H new ATOM 0 HE3 LYS A 135 11.934 10.882 -0.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 12.448 9.784 1.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 13.801 10.652 0.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 12.856 11.264 1.847 1.00 0.00 H new ATOM 2095 N SER A 136 11.662 13.231 -6.027 1.00 0.00 N ATOM 2096 CA SER A 136 10.700 12.579 -6.918 1.00 0.00 C ATOM 2097 C SER A 136 11.028 11.101 -7.155 1.00 0.00 C ATOM 2098 O SER A 136 10.138 10.302 -7.447 1.00 0.00 O ATOM 2099 CB SER A 136 10.643 13.318 -8.257 1.00 0.00 C ATOM 2100 OG SER A 136 9.322 13.728 -8.560 1.00 0.00 O ATOM 0 H SER A 136 11.923 14.174 -6.316 1.00 0.00 H new ATOM 0 HA SER A 136 9.728 12.621 -6.427 1.00 0.00 H new ATOM 0 HB2 SER A 136 11.298 14.189 -8.223 1.00 0.00 H new ATOM 0 HB3 SER A 136 11.016 12.669 -9.050 1.00 0.00 H new ATOM 0 HG SER A 136 9.315 14.199 -9.419 1.00 0.00 H new ATOM 2106 N TRP A 137 12.303 10.743 -7.034 1.00 0.00 N ATOM 2107 CA TRP A 137 12.731 9.362 -7.244 1.00 0.00 C ATOM 2108 C TRP A 137 12.201 8.426 -6.155 1.00 0.00 C ATOM 2109 O TRP A 137 12.419 7.216 -6.217 1.00 0.00 O ATOM 2110 CB TRP A 137 14.258 9.280 -7.292 1.00 0.00 C ATOM 2111 CG TRP A 137 14.872 10.166 -8.332 1.00 0.00 C ATOM 2112 CD1 TRP A 137 15.004 11.523 -8.276 1.00 0.00 C ATOM 2113 CD2 TRP A 137 15.436 9.760 -9.583 1.00 0.00 C ATOM 2114 NE1 TRP A 137 15.617 11.986 -9.414 1.00 0.00 N ATOM 2115 CE2 TRP A 137 15.892 10.922 -10.233 1.00 0.00 C ATOM 2116 CE3 TRP A 137 15.601 8.525 -10.218 1.00 0.00 C ATOM 2117 CZ2 TRP A 137 16.501 10.885 -11.484 1.00 0.00 C ATOM 2118 CZ3 TRP A 137 16.207 8.490 -11.460 1.00 0.00 C ATOM 2119 CH2 TRP A 137 16.651 9.663 -12.082 1.00 0.00 C ATOM 0 H TRP A 137 13.056 11.387 -6.792 1.00 0.00 H new ATOM 0 HA TRP A 137 12.315 9.038 -8.198 1.00 0.00 H new ATOM 0 HB2 TRP A 137 14.659 9.548 -6.315 1.00 0.00 H new ATOM 0 HB3 TRP A 137 14.553 8.248 -7.485 1.00 0.00 H new ATOM 0 HD1 TRP A 137 14.674 12.143 -7.455 1.00 0.00 H new ATOM 0 HE1 TRP A 137 15.832 12.962 -9.617 1.00 0.00 H new ATOM 0 HE3 TRP A 137 15.261 7.615 -9.746 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 16.843 11.789 -11.966 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 16.340 7.542 -11.959 1.00 0.00 H new ATOM 0 HH2 TRP A 137 17.121 9.602 -13.052 1.00 0.00 H new ATOM 2130 N PHE A 138 11.507 8.977 -5.156 1.00 0.00 N ATOM 2131 CA PHE A 138 10.963 8.171 -4.072 1.00 0.00 C ATOM 2132 C PHE A 138 10.168 6.982 -4.609 1.00 0.00 C ATOM 2133 O PHE A 138 10.031 5.961 -3.934 1.00 0.00 O ATOM 2134 CB PHE A 138 10.079 9.029 -3.165 1.00 0.00 C ATOM 2135 CG PHE A 138 9.117 9.916 -3.906 1.00 0.00 C ATOM 2136 CD1 PHE A 138 8.106 9.372 -4.681 1.00 0.00 C ATOM 2137 CD2 PHE A 138 9.224 11.294 -3.822 1.00 0.00 C ATOM 2138 CE1 PHE A 138 7.219 10.186 -5.359 1.00 0.00 C ATOM 2139 CE2 PHE A 138 8.340 12.114 -4.497 1.00 0.00 C ATOM 2140 CZ PHE A 138 7.336 11.559 -5.266 1.00 0.00 C ATOM 0 H PHE A 138 11.312 9.975 -5.080 1.00 0.00 H new ATOM 0 HA PHE A 138 11.800 7.783 -3.491 1.00 0.00 H new ATOM 0 HB2 PHE A 138 9.515 8.374 -2.501 1.00 0.00 H new ATOM 0 HB3 PHE A 138 10.717 9.649 -2.535 1.00 0.00 H new ATOM 0 HD1 PHE A 138 8.010 8.299 -4.756 1.00 0.00 H new ATOM 0 HD2 PHE A 138 10.007 11.733 -3.222 1.00 0.00 H new ATOM 0 HE1 PHE A 138 6.436 9.749 -5.961 1.00 0.00 H new ATOM 0 HE2 PHE A 138 8.434 13.187 -4.423 1.00 0.00 H new ATOM 0 HZ PHE A 138 6.643 12.198 -5.794 1.00 0.00 H new ATOM 2150 N TRP A 139 9.651 7.114 -5.829 1.00 0.00 N ATOM 2151 CA TRP A 139 8.880 6.042 -6.451 1.00 0.00 C ATOM 2152 C TRP A 139 9.675 4.741 -6.458 1.00 0.00 C ATOM 2153 O TRP A 139 9.108 3.652 -6.376 1.00 0.00 O ATOM 2154 CB TRP A 139 8.493 6.424 -7.882 1.00 0.00 C ATOM 2155 CG TRP A 139 7.130 7.038 -7.994 1.00 0.00 C ATOM 2156 CD1 TRP A 139 6.080 6.872 -7.134 1.00 0.00 C ATOM 2157 CD2 TRP A 139 6.669 7.915 -9.027 1.00 0.00 C ATOM 2158 NE1 TRP A 139 4.996 7.594 -7.572 1.00 0.00 N ATOM 2159 CE2 TRP A 139 5.332 8.242 -8.731 1.00 0.00 C ATOM 2160 CE3 TRP A 139 7.256 8.456 -10.175 1.00 0.00 C ATOM 2161 CZ2 TRP A 139 4.575 9.086 -9.540 1.00 0.00 C ATOM 2162 CZ3 TRP A 139 6.503 9.293 -10.976 1.00 0.00 C ATOM 2163 CH2 TRP A 139 5.175 9.602 -10.655 1.00 0.00 C ATOM 0 H TRP A 139 9.752 7.950 -6.404 1.00 0.00 H new ATOM 0 HA TRP A 139 7.972 5.893 -5.866 1.00 0.00 H new ATOM 0 HB2 TRP A 139 9.231 7.124 -8.274 1.00 0.00 H new ATOM 0 HB3 TRP A 139 8.534 5.534 -8.510 1.00 0.00 H new ATOM 0 HD1 TRP A 139 6.100 6.263 -6.242 1.00 0.00 H new ATOM 0 HE1 TRP A 139 4.088 7.640 -7.109 1.00 0.00 H new ATOM 0 HE3 TRP A 139 8.279 8.224 -10.431 1.00 0.00 H new ATOM 0 HZ2 TRP A 139 3.550 9.324 -9.295 1.00 0.00 H new ATOM 0 HZ3 TRP A 139 6.946 9.716 -11.865 1.00 0.00 H new ATOM 0 HH2 TRP A 139 4.614 10.261 -11.301 1.00 0.00 H new ATOM 2174 N THR A 140 10.995 4.866 -6.549 1.00 0.00 N ATOM 2175 CA THR A 140 11.875 3.705 -6.560 1.00 0.00 C ATOM 2176 C THR A 140 11.973 3.093 -5.168 1.00 0.00 C ATOM 2177 O THR A 140 12.066 1.874 -5.018 1.00 0.00 O ATOM 2178 CB THR A 140 13.266 4.099 -7.059 1.00 0.00 C ATOM 2179 OG1 THR A 140 13.172 4.968 -8.173 1.00 0.00 O ATOM 2180 CG2 THR A 140 14.115 2.915 -7.469 1.00 0.00 C ATOM 0 H THR A 140 11.479 5.762 -6.616 1.00 0.00 H new ATOM 0 HA THR A 140 11.454 2.962 -7.237 1.00 0.00 H new ATOM 0 HB THR A 140 13.746 4.592 -6.213 1.00 0.00 H new ATOM 0 HG1 THR A 140 13.015 5.884 -7.861 1.00 0.00 H new ATOM 0 HG21 THR A 140 15.088 3.266 -7.812 1.00 0.00 H new ATOM 0 HG22 THR A 140 14.250 2.251 -6.615 1.00 0.00 H new ATOM 0 HG23 THR A 140 13.620 2.374 -8.275 1.00 0.00 H new ATOM 2188 N ARG A 141 11.948 3.947 -4.150 1.00 0.00 N ATOM 2189 CA ARG A 141 12.028 3.491 -2.767 1.00 0.00 C ATOM 2190 C ARG A 141 10.874 2.547 -2.446 1.00 0.00 C ATOM 2191 O ARG A 141 11.066 1.500 -1.828 1.00 0.00 O ATOM 2192 CB ARG A 141 12.009 4.686 -1.812 1.00 0.00 C ATOM 2193 CG ARG A 141 13.393 5.219 -1.478 1.00 0.00 C ATOM 2194 CD ARG A 141 13.972 4.544 -0.244 1.00 0.00 C ATOM 2195 NE ARG A 141 13.523 5.183 0.992 1.00 0.00 N ATOM 2196 CZ ARG A 141 12.503 4.747 1.731 1.00 0.00 C ATOM 2197 NH1 ARG A 141 11.817 3.669 1.370 1.00 0.00 N ATOM 2198 NH2 ARG A 141 12.167 5.395 2.840 1.00 0.00 N ATOM 0 H ARG A 141 11.873 4.959 -4.257 1.00 0.00 H new ATOM 0 HA ARG A 141 12.966 2.951 -2.638 1.00 0.00 H new ATOM 0 HB2 ARG A 141 11.418 5.487 -2.257 1.00 0.00 H new ATOM 0 HB3 ARG A 141 11.508 4.395 -0.889 1.00 0.00 H new ATOM 0 HG2 ARG A 141 14.059 5.060 -2.326 1.00 0.00 H new ATOM 0 HG3 ARG A 141 13.339 6.295 -1.313 1.00 0.00 H new ATOM 0 HD2 ARG A 141 13.681 3.494 -0.235 1.00 0.00 H new ATOM 0 HD3 ARG A 141 15.061 4.573 -0.292 1.00 0.00 H new ATOM 0 HE ARG A 141 14.022 6.015 1.309 1.00 0.00 H new ATOM 0 HH11 ARG A 141 12.069 3.165 0.519 1.00 0.00 H new ATOM 0 HH12 ARG A 141 11.038 3.344 1.943 1.00 0.00 H new ATOM 0 HH21 ARG A 141 12.689 6.224 3.124 1.00 0.00 H new ATOM 0 HH22 ARG A 141 11.387 5.064 3.408 1.00 0.00 H new ATOM 2212 N LEU A 142 9.675 2.923 -2.879 1.00 0.00 N ATOM 2213 CA LEU A 142 8.489 2.108 -2.646 1.00 0.00 C ATOM 2214 C LEU A 142 8.420 0.962 -3.647 1.00 0.00 C ATOM 2215 O LEU A 142 8.058 -0.162 -3.299 1.00 0.00 O ATOM 2216 CB LEU A 142 7.225 2.965 -2.745 1.00 0.00 C ATOM 2217 CG LEU A 142 5.934 2.266 -2.314 1.00 0.00 C ATOM 2218 CD1 LEU A 142 5.614 2.587 -0.862 1.00 0.00 C ATOM 2219 CD2 LEU A 142 4.780 2.672 -3.218 1.00 0.00 C ATOM 0 H LEU A 142 9.499 3.786 -3.393 1.00 0.00 H new ATOM 0 HA LEU A 142 8.555 1.690 -1.641 1.00 0.00 H new ATOM 0 HB2 LEU A 142 7.360 3.856 -2.132 1.00 0.00 H new ATOM 0 HB3 LEU A 142 7.112 3.301 -3.776 1.00 0.00 H new ATOM 0 HG LEU A 142 6.078 1.189 -2.404 1.00 0.00 H new ATOM 0 HD11 LEU A 142 4.693 2.082 -0.572 1.00 0.00 H new ATOM 0 HD12 LEU A 142 6.431 2.246 -0.226 1.00 0.00 H new ATOM 0 HD13 LEU A 142 5.489 3.664 -0.746 1.00 0.00 H new ATOM 0 HD21 LEU A 142 3.870 2.165 -2.896 1.00 0.00 H new ATOM 0 HD22 LEU A 142 4.634 3.751 -3.160 1.00 0.00 H new ATOM 0 HD23 LEU A 142 5.007 2.392 -4.246 1.00 0.00 H new ATOM 2231 N ALA A 143 8.772 1.258 -4.892 1.00 0.00 N ATOM 2232 CA ALA A 143 8.758 0.256 -5.950 1.00 0.00 C ATOM 2233 C ALA A 143 9.781 -0.840 -5.678 1.00 0.00 C ATOM 2234 O ALA A 143 9.583 -1.996 -6.054 1.00 0.00 O ATOM 2235 CB ALA A 143 9.024 0.910 -7.298 1.00 0.00 C ATOM 0 H ALA A 143 9.071 2.185 -5.194 1.00 0.00 H new ATOM 0 HA ALA A 143 7.770 -0.204 -5.972 1.00 0.00 H new ATOM 0 HB1 ALA A 143 9.011 0.151 -8.080 1.00 0.00 H new ATOM 0 HB2 ALA A 143 8.252 1.653 -7.501 1.00 0.00 H new ATOM 0 HB3 ALA A 143 10.000 1.396 -7.281 1.00 0.00 H new ATOM 2241 N LYS A 144 10.874 -0.470 -5.021 1.00 0.00 N ATOM 2242 CA LYS A 144 11.932 -1.420 -4.692 1.00 0.00 C ATOM 2243 C LYS A 144 11.704 -2.039 -3.315 1.00 0.00 C ATOM 2244 O LYS A 144 12.234 -3.107 -3.009 1.00 0.00 O ATOM 2245 CB LYS A 144 13.297 -0.728 -4.735 1.00 0.00 C ATOM 2246 CG LYS A 144 14.456 -1.640 -4.366 1.00 0.00 C ATOM 2247 CD LYS A 144 15.149 -1.179 -3.091 1.00 0.00 C ATOM 2248 CE LYS A 144 15.422 -2.344 -2.152 1.00 0.00 C ATOM 2249 NZ LYS A 144 16.725 -2.191 -1.445 1.00 0.00 N ATOM 0 H LYS A 144 11.052 0.483 -4.705 1.00 0.00 H new ATOM 0 HA LYS A 144 11.912 -2.218 -5.434 1.00 0.00 H new ATOM 0 HB2 LYS A 144 13.462 -0.332 -5.737 1.00 0.00 H new ATOM 0 HB3 LYS A 144 13.285 0.123 -4.054 1.00 0.00 H new ATOM 0 HG2 LYS A 144 14.090 -2.658 -4.234 1.00 0.00 H new ATOM 0 HG3 LYS A 144 15.176 -1.663 -5.184 1.00 0.00 H new ATOM 0 HD2 LYS A 144 16.088 -0.686 -3.344 1.00 0.00 H new ATOM 0 HD3 LYS A 144 14.528 -0.440 -2.585 1.00 0.00 H new ATOM 0 HE2 LYS A 144 14.618 -2.417 -1.420 1.00 0.00 H new ATOM 0 HE3 LYS A 144 15.423 -3.275 -2.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 16.875 -3.004 -0.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 17.495 -2.147 -2.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 16.715 -1.315 -0.884 1.00 0.00 H new ATOM 2263 N ALA A 145 10.912 -1.364 -2.487 1.00 0.00 N ATOM 2264 CA ALA A 145 10.616 -1.852 -1.145 1.00 0.00 C ATOM 2265 C ALA A 145 9.509 -2.900 -1.171 1.00 0.00 C ATOM 2266 O ALA A 145 9.374 -3.697 -0.242 1.00 0.00 O ATOM 2267 CB ALA A 145 10.227 -0.694 -0.238 1.00 0.00 C ATOM 0 H ALA A 145 10.464 -0.478 -2.722 1.00 0.00 H new ATOM 0 HA ALA A 145 11.516 -2.324 -0.751 1.00 0.00 H new ATOM 0 HB1 ALA A 145 10.008 -1.072 0.761 1.00 0.00 H new ATOM 0 HB2 ALA A 145 11.050 0.019 -0.184 1.00 0.00 H new ATOM 0 HB3 ALA A 145 9.343 -0.198 -0.640 1.00 0.00 H new ATOM 2273 N LEU A 146 8.719 -2.896 -2.240 1.00 0.00 N ATOM 2274 CA LEU A 146 7.625 -3.847 -2.388 1.00 0.00 C ATOM 2275 C LEU A 146 8.133 -5.177 -2.938 1.00 0.00 C ATOM 2276 O LEU A 146 7.531 -6.225 -2.705 1.00 0.00 O ATOM 2277 CB LEU A 146 6.545 -3.272 -3.310 1.00 0.00 C ATOM 2278 CG LEU A 146 5.254 -2.848 -2.609 1.00 0.00 C ATOM 2279 CD1 LEU A 146 5.549 -1.837 -1.511 1.00 0.00 C ATOM 2280 CD2 LEU A 146 4.267 -2.275 -3.614 1.00 0.00 C ATOM 0 H LEU A 146 8.817 -2.243 -3.017 1.00 0.00 H new ATOM 0 HA LEU A 146 7.192 -4.026 -1.404 1.00 0.00 H new ATOM 0 HB2 LEU A 146 6.957 -2.409 -3.833 1.00 0.00 H new ATOM 0 HB3 LEU A 146 6.301 -4.017 -4.068 1.00 0.00 H new ATOM 0 HG LEU A 146 4.805 -3.729 -2.150 1.00 0.00 H new ATOM 0 HD11 LEU A 146 4.618 -1.547 -1.024 1.00 0.00 H new ATOM 0 HD12 LEU A 146 6.220 -2.283 -0.776 1.00 0.00 H new ATOM 0 HD13 LEU A 146 6.021 -0.956 -1.945 1.00 0.00 H new ATOM 0 HD21 LEU A 146 3.354 -1.978 -3.098 1.00 0.00 H new ATOM 0 HD22 LEU A 146 4.708 -1.405 -4.101 1.00 0.00 H new ATOM 0 HD23 LEU A 146 4.031 -3.030 -4.364 1.00 0.00 H new ATOM 2292 N SER A 147 9.242 -5.125 -3.670 1.00 0.00 N ATOM 2293 CA SER A 147 9.828 -6.324 -4.253 1.00 0.00 C ATOM 2294 C SER A 147 11.300 -6.451 -3.875 1.00 0.00 C ATOM 2295 O SER A 147 12.141 -6.775 -4.715 1.00 0.00 O ATOM 2296 CB SER A 147 9.676 -6.301 -5.775 1.00 0.00 C ATOM 2297 OG SER A 147 10.298 -5.157 -6.333 1.00 0.00 O ATOM 0 H SER A 147 9.752 -4.265 -3.873 1.00 0.00 H new ATOM 0 HA SER A 147 9.297 -7.189 -3.856 1.00 0.00 H new ATOM 0 HB2 SER A 147 10.117 -7.202 -6.201 1.00 0.00 H new ATOM 0 HB3 SER A 147 8.618 -6.308 -6.038 1.00 0.00 H new ATOM 0 HG SER A 147 9.802 -4.354 -6.069 1.00 0.00 H new ATOM 2303 N LEU A 148 11.606 -6.206 -2.605 1.00 0.00 N ATOM 2304 CA LEU A 148 12.984 -6.307 -2.123 1.00 0.00 C ATOM 2305 C LEU A 148 13.516 -7.723 -2.327 1.00 0.00 C ATOM 2306 O LEU A 148 14.558 -7.920 -2.951 1.00 0.00 O ATOM 2307 CB LEU A 148 13.098 -5.928 -0.635 1.00 0.00 C ATOM 2308 CG LEU A 148 11.962 -5.071 -0.066 1.00 0.00 C ATOM 2309 CD1 LEU A 148 11.011 -5.920 0.765 1.00 0.00 C ATOM 2310 CD2 LEU A 148 12.522 -3.929 0.769 1.00 0.00 C ATOM 0 H LEU A 148 10.926 -5.938 -1.894 1.00 0.00 H new ATOM 0 HA LEU A 148 13.581 -5.602 -2.702 1.00 0.00 H new ATOM 0 HB2 LEU A 148 13.160 -6.846 -0.051 1.00 0.00 H new ATOM 0 HB3 LEU A 148 14.037 -5.394 -0.489 1.00 0.00 H new ATOM 0 HG LEU A 148 11.403 -4.648 -0.901 1.00 0.00 H new ATOM 0 HD11 LEU A 148 10.212 -5.292 1.159 1.00 0.00 H new ATOM 0 HD12 LEU A 148 10.582 -6.703 0.140 1.00 0.00 H new ATOM 0 HD13 LEU A 148 11.557 -6.374 1.592 1.00 0.00 H new ATOM 0 HD21 LEU A 148 11.701 -3.331 1.165 1.00 0.00 H new ATOM 0 HD22 LEU A 148 13.107 -4.335 1.595 1.00 0.00 H new ATOM 0 HD23 LEU A 148 13.160 -3.302 0.146 1.00 0.00 H new ATOM 2322 N PRO A 149 12.800 -8.731 -1.797 1.00 0.00 N ATOM 2323 CA PRO A 149 13.205 -10.133 -1.922 1.00 0.00 C ATOM 2324 C PRO A 149 12.944 -10.692 -3.317 1.00 0.00 C ATOM 2325 O PRO A 149 13.831 -11.395 -3.846 1.00 0.00 O ATOM 2326 CB PRO A 149 12.327 -10.842 -0.889 1.00 0.00 C ATOM 2327 CG PRO A 149 11.101 -10.002 -0.798 1.00 0.00 C ATOM 2328 CD PRO A 149 11.543 -8.582 -1.034 1.00 0.00 C ATOM 2329 OXT PRO A 149 11.857 -10.422 -3.868 1.00 0.00 O ATOM 0 HA PRO A 149 14.275 -10.266 -1.761 1.00 0.00 H new ATOM 0 HB2 PRO A 149 12.089 -11.858 -1.202 1.00 0.00 H new ATOM 0 HB3 PRO A 149 12.830 -10.915 0.075 1.00 0.00 H new ATOM 0 HG2 PRO A 149 10.364 -10.308 -1.540 1.00 0.00 H new ATOM 0 HG3 PRO A 149 10.631 -10.105 0.180 1.00 0.00 H new ATOM 0 HD2 PRO A 149 10.798 -8.018 -1.595 1.00 0.00 H new ATOM 0 HD3 PRO A 149 11.704 -8.051 -0.096 1.00 0.00 H new TER 2337 PRO A 149