USER MOD reduce.3.24.130724 H: found=0, std=0, add=1312, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1305 hydrogens (45 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 153 HIS : no HE2:sc= -5.17! C(o=-4!,f=-13!) USER MOD Set 1.2: A 155 TYR OH : rot 109:sc= 1.15 USER MOD Set 2.1: A 143 THR OG1 : rot 180:sc= -0.449 USER MOD Set 2.2: A 154 THR OG1 : rot -171:sc= -5.05! USER MOD Set 3.1: A 85 TYR OH : rot -68:sc= 0.703 USER MOD Set 3.2: A 89 HIS : no HE2:sc= -0.978 K(o=-0.28,f=-5.2!) USER MOD Set 4.1: A 63 THR OG1 : rot 42:sc= -0.11 USER MOD Set 4.2: A 65 GLN :FLIP amide:sc= -1.59 F(o=-2.7,f=-1.7) USER MOD Set 5.1: A 58 THR OG1 : rot -90:sc= 0.122 USER MOD Set 5.2: A 92 GLN :FLIP amide:sc= -1.67! C(o=-4.3!,f=-1.5!) USER MOD Set 6.1: A 48 SER OG : rot -45:sc= 1.2 USER MOD Set 6.2: A 168 NDP O3D : rot 180:sc= -0.254 USER MOD Set 7.1: A 39 MET CE :methyl 168:sc= -7.23! (180deg=-8.88!) USER MOD Set 7.2: A 59 ASN : amide:sc= -3.94! C(o=-11!,f=-18!) USER MOD Set 8.1: A 29 TYR OH : rot -127:sc= 1.06 USER MOD Set 8.2: A 33 GLN : amide:sc= -3.15! C(o=-2.1!,f=-10!) USER MOD Single : A 1 THR N :NH3+ -173:sc= -0.0064 (180deg=-0.102) USER MOD Single : A 1 THR OG1 : rot 80:sc= -1.19 USER MOD Single : A 7 GLN : amide:sc= -2.12 X(o=-2.1,f=-2.4) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS : no HE2:sc= -0.126 K(o=-0.13,f=-2) USER MOD Single : A 22 HIS : no HD1:sc= -0.0905 X(o=-0.091,f=-0.0018) USER MOD Single : A 28 HIS : no HD1:sc= 0.00918 K(o=0.0092,f=-1.1) USER MOD Single : A 34 THR OG1 : rot -77:sc= 1.3 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot 150:sc= -3.4! USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -0.0973 X(o=-0.097,f=-0.12) USER MOD Single : A 71 GLN : amide:sc= -0.0717 X(o=-0.072,f=0) USER MOD Single : A 77 HIS : no HD1:sc= -5.95! C(o=-6!,f=-8.1!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=-0.0097) USER MOD Single : A 104 THR OG1 : rot 68:sc= -0.383 USER MOD Single : A 107 LYS NZ :NH3+ 152:sc= -0.127 (180deg=-0.635) USER MOD Single : A 112 THR OG1 : rot 180:sc= -0.0134 USER MOD Single : A 116 THR OG1 : rot -90:sc= 0.0314 USER MOD Single : A 121 SER OG : rot 46:sc= 0.253 USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl -142:sc= -4! (180deg=-6.31!) USER MOD Single : A 132 ASN : amide:sc= -0.0484 X(o=-0.048,f=0) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 50:sc= 0.364 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.0182 USER MOD Single : A 148 ASN : amide:sc= -0.174 K(o=-0.17,f=-3.1!) USER MOD Single : A 152 THR OG1 : rot 97:sc= 0.0973 USER MOD Single : A 159 GLN : amide:sc= -1.59! C(o=-1.6!,f=-4.7!) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 NDP O2D : rot -101:sc= 0.663 USER MOD Single : A 168 NDP O3B : rot 68:sc= 0.765 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -5.665 10.566 3.310 1.00 0.00 N ATOM 2 CA THR A 1 -5.251 9.419 2.454 1.00 0.00 C ATOM 3 C THR A 1 -3.748 9.186 2.605 1.00 0.00 C ATOM 4 O THR A 1 -2.957 10.105 2.536 1.00 0.00 O ATOM 5 CB THR A 1 -5.572 9.729 0.992 1.00 0.00 C ATOM 6 OG1 THR A 1 -6.944 10.081 0.874 1.00 0.00 O ATOM 7 CG2 THR A 1 -5.280 8.498 0.130 1.00 0.00 C ATOM 0 H1 THR A 1 -6.702 10.650 3.300 1.00 0.00 H new ATOM 0 H2 THR A 1 -5.340 10.407 4.285 1.00 0.00 H new ATOM 0 H3 THR A 1 -5.243 11.443 2.943 1.00 0.00 H new ATOM 0 HA THR A 1 -5.792 8.524 2.763 1.00 0.00 H new ATOM 0 HB THR A 1 -4.954 10.560 0.652 1.00 0.00 H new ATOM 0 HG1 THR A 1 -7.067 11.015 1.145 1.00 0.00 H new ATOM 0 HG21 THR A 1 -5.509 8.721 -0.912 1.00 0.00 H new ATOM 0 HG22 THR A 1 -4.227 8.232 0.221 1.00 0.00 H new ATOM 0 HG23 THR A 1 -5.895 7.664 0.467 1.00 0.00 H new ATOM 17 N ALA A 2 -3.345 7.962 2.809 1.00 0.00 N ATOM 18 CA ALA A 2 -1.893 7.676 2.966 1.00 0.00 C ATOM 19 C ALA A 2 -1.471 6.582 1.985 1.00 0.00 C ATOM 20 O ALA A 2 -2.251 5.728 1.620 1.00 0.00 O ATOM 21 CB ALA A 2 -1.624 7.205 4.397 1.00 0.00 C ATOM 0 H ALA A 2 -3.958 7.149 2.874 1.00 0.00 H new ATOM 0 HA ALA A 2 -1.322 8.582 2.761 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -0.561 6.994 4.517 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.921 7.985 5.099 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -2.198 6.300 4.596 1.00 0.00 H new ATOM 27 N PHE A 3 -0.233 6.589 1.578 1.00 0.00 N ATOM 28 CA PHE A 3 0.254 5.538 0.641 1.00 0.00 C ATOM 29 C PHE A 3 1.075 4.530 1.442 1.00 0.00 C ATOM 30 O PHE A 3 1.926 4.901 2.225 1.00 0.00 O ATOM 31 CB PHE A 3 1.148 6.173 -0.433 1.00 0.00 C ATOM 32 CG PHE A 3 0.333 6.725 -1.593 1.00 0.00 C ATOM 33 CD1 PHE A 3 -1.062 6.561 -1.659 1.00 0.00 C ATOM 34 CD2 PHE A 3 0.996 7.406 -2.620 1.00 0.00 C ATOM 35 CE1 PHE A 3 -1.777 7.078 -2.747 1.00 0.00 C ATOM 36 CE2 PHE A 3 0.278 7.922 -3.703 1.00 0.00 C ATOM 37 CZ PHE A 3 -1.107 7.757 -3.767 1.00 0.00 C ATOM 0 H PHE A 3 0.465 7.279 1.855 1.00 0.00 H new ATOM 0 HA PHE A 3 -0.591 5.049 0.157 1.00 0.00 H new ATOM 0 HB2 PHE A 3 1.737 6.975 0.012 1.00 0.00 H new ATOM 0 HB3 PHE A 3 1.853 5.430 -0.805 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -1.582 6.037 -0.871 1.00 0.00 H new ATOM 0 HD2 PHE A 3 2.068 7.534 -2.576 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -2.848 6.951 -2.797 1.00 0.00 H new ATOM 0 HE2 PHE A 3 0.795 8.449 -4.491 1.00 0.00 H new ATOM 0 HZ PHE A 3 -1.660 8.154 -4.605 1.00 0.00 H new ATOM 47 N LEU A 4 0.833 3.259 1.262 1.00 0.00 N ATOM 48 CA LEU A 4 1.610 2.244 2.026 1.00 0.00 C ATOM 49 C LEU A 4 2.084 1.153 1.064 1.00 0.00 C ATOM 50 O LEU A 4 1.342 0.259 0.718 1.00 0.00 O ATOM 51 CB LEU A 4 0.707 1.636 3.114 1.00 0.00 C ATOM 52 CG LEU A 4 1.306 0.329 3.656 1.00 0.00 C ATOM 53 CD1 LEU A 4 2.744 0.570 4.129 1.00 0.00 C ATOM 54 CD2 LEU A 4 0.462 -0.159 4.839 1.00 0.00 C ATOM 0 H LEU A 4 0.134 2.882 0.622 1.00 0.00 H new ATOM 0 HA LEU A 4 2.477 2.707 2.498 1.00 0.00 H new ATOM 0 HB2 LEU A 4 0.582 2.349 3.929 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -0.284 1.444 2.704 1.00 0.00 H new ATOM 0 HG LEU A 4 1.309 -0.421 2.865 1.00 0.00 H new ATOM 0 HD11 LEU A 4 3.162 -0.361 4.512 1.00 0.00 H new ATOM 0 HD12 LEU A 4 3.348 0.922 3.293 1.00 0.00 H new ATOM 0 HD13 LEU A 4 2.746 1.321 4.919 1.00 0.00 H new ATOM 0 HD21 LEU A 4 0.882 -1.086 5.228 1.00 0.00 H new ATOM 0 HD22 LEU A 4 0.464 0.597 5.624 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -0.561 -0.335 4.508 1.00 0.00 H new ATOM 66 N TRP A 5 3.313 1.219 0.626 1.00 0.00 N ATOM 67 CA TRP A 5 3.820 0.176 -0.308 1.00 0.00 C ATOM 68 C TRP A 5 5.271 -0.168 0.034 1.00 0.00 C ATOM 69 O TRP A 5 5.863 0.395 0.935 1.00 0.00 O ATOM 70 CB TRP A 5 3.721 0.677 -1.756 1.00 0.00 C ATOM 71 CG TRP A 5 4.748 1.736 -2.021 1.00 0.00 C ATOM 72 CD1 TRP A 5 5.845 1.573 -2.798 1.00 0.00 C ATOM 73 CD2 TRP A 5 4.789 3.110 -1.538 1.00 0.00 C ATOM 74 NE1 TRP A 5 6.555 2.760 -2.823 1.00 0.00 N ATOM 75 CE2 TRP A 5 5.945 3.737 -2.061 1.00 0.00 C ATOM 76 CE3 TRP A 5 3.944 3.866 -0.706 1.00 0.00 C ATOM 77 CZ2 TRP A 5 6.252 5.067 -1.769 1.00 0.00 C ATOM 78 CZ3 TRP A 5 4.250 5.204 -0.410 1.00 0.00 C ATOM 79 CH2 TRP A 5 5.401 5.803 -0.941 1.00 0.00 C ATOM 0 H TRP A 5 3.984 1.947 0.874 1.00 0.00 H new ATOM 0 HA TRP A 5 3.211 -0.722 -0.205 1.00 0.00 H new ATOM 0 HB2 TRP A 5 3.864 -0.156 -2.445 1.00 0.00 H new ATOM 0 HB3 TRP A 5 2.724 1.076 -1.941 1.00 0.00 H new ATOM 0 HD1 TRP A 5 6.121 0.665 -3.314 1.00 0.00 H new ATOM 0 HE1 TRP A 5 7.423 2.897 -3.341 1.00 0.00 H new ATOM 0 HE3 TRP A 5 3.054 3.415 -0.292 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 7.140 5.523 -2.180 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 3.595 5.775 0.231 1.00 0.00 H new ATOM 0 HH2 TRP A 5 5.630 6.833 -0.710 1.00 0.00 H new ATOM 90 N ALA A 6 5.845 -1.087 -0.690 1.00 0.00 N ATOM 91 CA ALA A 6 7.258 -1.475 -0.433 1.00 0.00 C ATOM 92 C ALA A 6 7.999 -1.509 -1.766 1.00 0.00 C ATOM 93 O ALA A 6 7.474 -1.965 -2.763 1.00 0.00 O ATOM 94 CB ALA A 6 7.303 -2.860 0.215 1.00 0.00 C ATOM 0 H ALA A 6 5.392 -1.589 -1.454 1.00 0.00 H new ATOM 0 HA ALA A 6 7.727 -0.756 0.239 1.00 0.00 H new ATOM 0 HB1 ALA A 6 8.340 -3.141 0.402 1.00 0.00 H new ATOM 0 HB2 ALA A 6 6.757 -2.838 1.158 1.00 0.00 H new ATOM 0 HB3 ALA A 6 6.844 -3.589 -0.453 1.00 0.00 H new ATOM 100 N GLN A 7 9.203 -1.011 -1.803 1.00 0.00 N ATOM 101 CA GLN A 7 9.952 -1.009 -3.089 1.00 0.00 C ATOM 102 C GLN A 7 11.434 -1.278 -2.841 1.00 0.00 C ATOM 103 O GLN A 7 11.951 -1.037 -1.769 1.00 0.00 O ATOM 104 CB GLN A 7 9.785 0.347 -3.776 1.00 0.00 C ATOM 105 CG GLN A 7 10.153 1.469 -2.801 1.00 0.00 C ATOM 106 CD GLN A 7 11.100 2.457 -3.486 1.00 0.00 C ATOM 107 OE1 GLN A 7 12.251 2.572 -3.113 1.00 0.00 O ATOM 108 NE2 GLN A 7 10.661 3.181 -4.479 1.00 0.00 N ATOM 0 H GLN A 7 9.697 -0.609 -1.006 1.00 0.00 H new ATOM 0 HA GLN A 7 9.554 -1.796 -3.730 1.00 0.00 H new ATOM 0 HB2 GLN A 7 10.420 0.398 -4.660 1.00 0.00 H new ATOM 0 HB3 GLN A 7 8.756 0.470 -4.115 1.00 0.00 H new ATOM 0 HG2 GLN A 7 9.252 1.985 -2.468 1.00 0.00 H new ATOM 0 HG3 GLN A 7 10.628 1.051 -1.913 1.00 0.00 H new ATOM 0 HE21 GLN A 7 9.695 3.085 -4.792 1.00 0.00 H new ATOM 0 HE22 GLN A 7 11.284 3.843 -4.942 1.00 0.00 H new ATOM 117 N ASP A 8 12.117 -1.782 -3.833 1.00 0.00 N ATOM 118 CA ASP A 8 13.565 -2.076 -3.669 1.00 0.00 C ATOM 119 C ASP A 8 14.384 -0.824 -3.989 1.00 0.00 C ATOM 120 O ASP A 8 13.859 0.269 -4.077 1.00 0.00 O ATOM 121 CB ASP A 8 13.965 -3.218 -4.610 1.00 0.00 C ATOM 122 CG ASP A 8 13.631 -2.847 -6.057 1.00 0.00 C ATOM 123 OD1 ASP A 8 13.939 -1.735 -6.453 1.00 0.00 O ATOM 124 OD2 ASP A 8 13.075 -3.685 -6.747 1.00 0.00 O ATOM 0 H ASP A 8 11.731 -2.003 -4.751 1.00 0.00 H new ATOM 0 HA ASP A 8 13.761 -2.375 -2.639 1.00 0.00 H new ATOM 0 HB2 ASP A 8 15.032 -3.421 -4.515 1.00 0.00 H new ATOM 0 HB3 ASP A 8 13.440 -4.131 -4.330 1.00 0.00 H new ATOM 129 N ARG A 9 15.668 -0.978 -4.152 1.00 0.00 N ATOM 130 CA ARG A 9 16.534 0.197 -4.454 1.00 0.00 C ATOM 131 C ARG A 9 16.068 0.885 -5.744 1.00 0.00 C ATOM 132 O ARG A 9 16.012 2.097 -5.819 1.00 0.00 O ATOM 133 CB ARG A 9 17.985 -0.265 -4.610 1.00 0.00 C ATOM 134 CG ARG A 9 18.065 -1.401 -5.633 1.00 0.00 C ATOM 135 CD ARG A 9 18.555 -0.847 -6.973 1.00 0.00 C ATOM 136 NE ARG A 9 19.946 -0.325 -6.807 1.00 0.00 N ATOM 137 CZ ARG A 9 20.955 -0.844 -7.470 1.00 0.00 C ATOM 138 NH1 ARG A 9 20.780 -1.839 -8.304 1.00 0.00 N ATOM 139 NH2 ARG A 9 22.154 -0.360 -7.293 1.00 0.00 N ATOM 0 H ARG A 9 16.158 -1.871 -4.089 1.00 0.00 H new ATOM 0 HA ARG A 9 16.464 0.910 -3.632 1.00 0.00 H new ATOM 0 HB2 ARG A 9 18.609 0.569 -4.931 1.00 0.00 H new ATOM 0 HB3 ARG A 9 18.374 -0.602 -3.649 1.00 0.00 H new ATOM 0 HG2 ARG A 9 18.743 -2.177 -5.278 1.00 0.00 H new ATOM 0 HG3 ARG A 9 17.086 -1.865 -5.755 1.00 0.00 H new ATOM 0 HD2 ARG A 9 18.535 -1.628 -7.733 1.00 0.00 H new ATOM 0 HD3 ARG A 9 17.893 -0.052 -7.316 1.00 0.00 H new ATOM 0 HE ARG A 9 20.115 0.450 -6.166 1.00 0.00 H new ATOM 0 HH11 ARG A 9 19.847 -2.225 -8.449 1.00 0.00 H new ATOM 0 HH12 ARG A 9 21.577 -2.227 -8.809 1.00 0.00 H new ATOM 0 HH21 ARG A 9 22.301 0.414 -6.645 1.00 0.00 H new ATOM 0 HH22 ARG A 9 22.944 -0.756 -7.803 1.00 0.00 H new ATOM 153 N ASP A 10 15.745 0.131 -6.765 1.00 0.00 N ATOM 154 CA ASP A 10 15.300 0.757 -8.046 1.00 0.00 C ATOM 155 C ASP A 10 13.906 1.364 -7.874 1.00 0.00 C ATOM 156 O ASP A 10 13.570 2.354 -8.495 1.00 0.00 O ATOM 157 CB ASP A 10 15.261 -0.307 -9.145 1.00 0.00 C ATOM 158 CG ASP A 10 16.551 -0.244 -9.965 1.00 0.00 C ATOM 159 OD1 ASP A 10 16.622 0.585 -10.857 1.00 0.00 O ATOM 160 OD2 ASP A 10 17.446 -1.025 -9.686 1.00 0.00 O ATOM 0 H ASP A 10 15.770 -0.889 -6.766 1.00 0.00 H new ATOM 0 HA ASP A 10 16.001 1.545 -8.322 1.00 0.00 H new ATOM 0 HB2 ASP A 10 15.147 -1.297 -8.703 1.00 0.00 H new ATOM 0 HB3 ASP A 10 14.399 -0.145 -9.792 1.00 0.00 H new ATOM 165 N GLY A 11 13.097 0.786 -7.031 1.00 0.00 N ATOM 166 CA GLY A 11 11.726 1.341 -6.813 1.00 0.00 C ATOM 167 C GLY A 11 10.674 0.415 -7.433 1.00 0.00 C ATOM 168 O GLY A 11 9.708 0.865 -8.022 1.00 0.00 O ATOM 0 H GLY A 11 13.322 -0.045 -6.483 1.00 0.00 H new ATOM 0 HA2 GLY A 11 11.537 1.454 -5.745 1.00 0.00 H new ATOM 0 HA3 GLY A 11 11.653 2.334 -7.256 1.00 0.00 H new ATOM 172 N LEU A 12 10.843 -0.872 -7.294 1.00 0.00 N ATOM 173 CA LEU A 12 9.846 -1.827 -7.862 1.00 0.00 C ATOM 174 C LEU A 12 8.800 -2.145 -6.795 1.00 0.00 C ATOM 175 O LEU A 12 9.060 -2.024 -5.618 1.00 0.00 O ATOM 176 CB LEU A 12 10.565 -3.114 -8.275 1.00 0.00 C ATOM 177 CG LEU A 12 9.571 -4.088 -8.909 1.00 0.00 C ATOM 178 CD1 LEU A 12 9.148 -3.572 -10.284 1.00 0.00 C ATOM 179 CD2 LEU A 12 10.231 -5.461 -9.056 1.00 0.00 C ATOM 0 H LEU A 12 11.630 -1.305 -6.811 1.00 0.00 H new ATOM 0 HA LEU A 12 9.359 -1.387 -8.732 1.00 0.00 H new ATOM 0 HB2 LEU A 12 11.362 -2.884 -8.982 1.00 0.00 H new ATOM 0 HB3 LEU A 12 11.033 -3.574 -7.405 1.00 0.00 H new ATOM 0 HG LEU A 12 8.690 -4.173 -8.273 1.00 0.00 H new ATOM 0 HD11 LEU A 12 8.440 -4.269 -10.732 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.677 -2.595 -10.177 1.00 0.00 H new ATOM 0 HD13 LEU A 12 10.025 -3.484 -10.925 1.00 0.00 H new ATOM 0 HD21 LEU A 12 9.525 -6.158 -9.508 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.112 -5.375 -9.691 1.00 0.00 H new ATOM 0 HD23 LEU A 12 10.526 -5.830 -8.074 1.00 0.00 H new ATOM 191 N ILE A 13 7.622 -2.558 -7.185 1.00 0.00 N ATOM 192 CA ILE A 13 6.581 -2.889 -6.168 1.00 0.00 C ATOM 193 C ILE A 13 6.124 -4.336 -6.352 1.00 0.00 C ATOM 194 O ILE A 13 6.333 -5.167 -5.490 1.00 0.00 O ATOM 195 CB ILE A 13 5.372 -1.948 -6.285 1.00 0.00 C ATOM 196 CG1 ILE A 13 5.200 -1.463 -7.728 1.00 0.00 C ATOM 197 CG2 ILE A 13 5.578 -0.745 -5.365 1.00 0.00 C ATOM 198 CD1 ILE A 13 3.708 -1.386 -8.064 1.00 0.00 C ATOM 0 H ILE A 13 7.337 -2.680 -8.157 1.00 0.00 H new ATOM 0 HA ILE A 13 7.019 -2.762 -5.178 1.00 0.00 H new ATOM 0 HB ILE A 13 4.474 -2.493 -5.992 1.00 0.00 H new ATOM 0 HG12 ILE A 13 5.663 -0.484 -7.852 1.00 0.00 H new ATOM 0 HG13 ILE A 13 5.704 -2.143 -8.415 1.00 0.00 H new ATOM 0 HG21 ILE A 13 4.722 -0.075 -5.445 1.00 0.00 H new ATOM 0 HG22 ILE A 13 5.676 -1.087 -4.335 1.00 0.00 H new ATOM 0 HG23 ILE A 13 6.484 -0.214 -5.658 1.00 0.00 H new ATOM 0 HD11 ILE A 13 3.584 -1.041 -9.090 1.00 0.00 H new ATOM 0 HD12 ILE A 13 3.259 -2.373 -7.956 1.00 0.00 H new ATOM 0 HD13 ILE A 13 3.218 -0.689 -7.385 1.00 0.00 H new ATOM 210 N GLY A 14 5.489 -4.650 -7.452 1.00 0.00 N ATOM 211 CA GLY A 14 5.017 -6.055 -7.648 1.00 0.00 C ATOM 212 C GLY A 14 5.207 -6.468 -9.103 1.00 0.00 C ATOM 213 O GLY A 14 4.867 -5.739 -10.014 1.00 0.00 O ATOM 0 H GLY A 14 5.279 -4.005 -8.214 1.00 0.00 H new ATOM 0 HA2 GLY A 14 5.571 -6.729 -6.994 1.00 0.00 H new ATOM 0 HA3 GLY A 14 3.966 -6.137 -7.372 1.00 0.00 H new ATOM 217 N LYS A 15 5.764 -7.627 -9.331 1.00 0.00 N ATOM 218 CA LYS A 15 5.993 -8.081 -10.728 1.00 0.00 C ATOM 219 C LYS A 15 5.191 -9.354 -10.989 1.00 0.00 C ATOM 220 O LYS A 15 5.300 -10.328 -10.269 1.00 0.00 O ATOM 221 CB LYS A 15 7.484 -8.368 -10.921 1.00 0.00 C ATOM 222 CG LYS A 15 7.762 -8.687 -12.391 1.00 0.00 C ATOM 223 CD LYS A 15 9.119 -9.385 -12.512 1.00 0.00 C ATOM 224 CE LYS A 15 8.918 -10.901 -12.519 1.00 0.00 C ATOM 225 NZ LYS A 15 10.033 -11.546 -13.269 1.00 0.00 N ATOM 0 H LYS A 15 6.070 -8.278 -8.608 1.00 0.00 H new ATOM 0 HA LYS A 15 5.674 -7.306 -11.424 1.00 0.00 H new ATOM 0 HB2 LYS A 15 8.073 -7.506 -10.608 1.00 0.00 H new ATOM 0 HB3 LYS A 15 7.787 -9.206 -10.293 1.00 0.00 H new ATOM 0 HG2 LYS A 15 6.975 -9.326 -12.791 1.00 0.00 H new ATOM 0 HG3 LYS A 15 7.758 -7.770 -12.981 1.00 0.00 H new ATOM 0 HD2 LYS A 15 9.621 -9.070 -13.427 1.00 0.00 H new ATOM 0 HD3 LYS A 15 9.763 -9.097 -11.681 1.00 0.00 H new ATOM 0 HE2 LYS A 15 8.886 -11.279 -11.497 1.00 0.00 H new ATOM 0 HE3 LYS A 15 7.963 -11.150 -12.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 9.897 -12.577 -13.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 10.043 -11.193 -14.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 10.938 -11.318 -12.809 1.00 0.00 H new ATOM 239 N ASP A 16 4.396 -9.359 -12.023 1.00 0.00 N ATOM 240 CA ASP A 16 3.594 -10.570 -12.354 1.00 0.00 C ATOM 241 C ASP A 16 2.779 -11.037 -11.141 1.00 0.00 C ATOM 242 O ASP A 16 2.783 -12.205 -10.801 1.00 0.00 O ATOM 243 CB ASP A 16 4.538 -11.692 -12.795 1.00 0.00 C ATOM 244 CG ASP A 16 5.087 -11.381 -14.188 1.00 0.00 C ATOM 245 OD1 ASP A 16 4.457 -11.777 -15.154 1.00 0.00 O ATOM 246 OD2 ASP A 16 6.129 -10.751 -14.265 1.00 0.00 O ATOM 0 H ASP A 16 4.267 -8.571 -12.657 1.00 0.00 H new ATOM 0 HA ASP A 16 2.902 -10.321 -13.158 1.00 0.00 H new ATOM 0 HB2 ASP A 16 5.358 -11.792 -12.084 1.00 0.00 H new ATOM 0 HB3 ASP A 16 4.008 -12.644 -12.806 1.00 0.00 H new ATOM 251 N GLY A 17 2.051 -10.155 -10.502 1.00 0.00 N ATOM 252 CA GLY A 17 1.212 -10.580 -9.342 1.00 0.00 C ATOM 253 C GLY A 17 2.053 -10.756 -8.072 1.00 0.00 C ATOM 254 O GLY A 17 2.076 -9.903 -7.207 1.00 0.00 O ATOM 0 H GLY A 17 2.002 -9.163 -10.733 1.00 0.00 H new ATOM 0 HA2 GLY A 17 0.434 -9.838 -9.164 1.00 0.00 H new ATOM 0 HA3 GLY A 17 0.710 -11.518 -9.580 1.00 0.00 H new ATOM 258 N HIS A 18 2.711 -11.875 -7.940 1.00 0.00 N ATOM 259 CA HIS A 18 3.518 -12.143 -6.713 1.00 0.00 C ATOM 260 C HIS A 18 4.558 -11.043 -6.491 1.00 0.00 C ATOM 261 O HIS A 18 4.531 -10.005 -7.123 1.00 0.00 O ATOM 262 CB HIS A 18 4.222 -13.495 -6.861 1.00 0.00 C ATOM 263 CG HIS A 18 5.058 -13.494 -8.111 1.00 0.00 C ATOM 264 ND1 HIS A 18 6.345 -12.980 -8.139 1.00 0.00 N ATOM 265 CD2 HIS A 18 4.806 -13.943 -9.384 1.00 0.00 C ATOM 266 CE1 HIS A 18 6.814 -13.130 -9.391 1.00 0.00 C ATOM 267 NE2 HIS A 18 5.916 -13.712 -10.190 1.00 0.00 N ATOM 0 H HIS A 18 2.725 -12.622 -8.635 1.00 0.00 H new ATOM 0 HA HIS A 18 2.851 -12.160 -5.851 1.00 0.00 H new ATOM 0 HB2 HIS A 18 4.850 -13.686 -5.991 1.00 0.00 H new ATOM 0 HB3 HIS A 18 3.485 -14.297 -6.905 1.00 0.00 H new ATOM 0 HD1 HIS A 18 6.845 -12.564 -7.354 1.00 0.00 H new ATOM 0 HD2 HIS A 18 3.886 -14.405 -9.710 1.00 0.00 H new ATOM 0 HE1 HIS A 18 7.797 -12.818 -9.711 1.00 0.00 H new ATOM 275 N LEU A 19 5.483 -11.277 -5.599 1.00 0.00 N ATOM 276 CA LEU A 19 6.544 -10.271 -5.323 1.00 0.00 C ATOM 277 C LEU A 19 7.901 -10.894 -5.657 1.00 0.00 C ATOM 278 O LEU A 19 8.030 -12.102 -5.677 1.00 0.00 O ATOM 279 CB LEU A 19 6.512 -9.884 -3.842 1.00 0.00 C ATOM 280 CG LEU A 19 5.533 -8.728 -3.634 1.00 0.00 C ATOM 281 CD1 LEU A 19 5.055 -8.719 -2.181 1.00 0.00 C ATOM 282 CD2 LEU A 19 6.235 -7.406 -3.946 1.00 0.00 C ATOM 0 H LEU A 19 5.548 -12.131 -5.045 1.00 0.00 H new ATOM 0 HA LEU A 19 6.380 -9.379 -5.928 1.00 0.00 H new ATOM 0 HB2 LEU A 19 6.212 -10.741 -3.238 1.00 0.00 H new ATOM 0 HB3 LEU A 19 7.509 -9.594 -3.510 1.00 0.00 H new ATOM 0 HG LEU A 19 4.677 -8.853 -4.297 1.00 0.00 H new ATOM 0 HD11 LEU A 19 4.357 -7.895 -2.033 1.00 0.00 H new ATOM 0 HD12 LEU A 19 4.556 -9.662 -1.956 1.00 0.00 H new ATOM 0 HD13 LEU A 19 5.911 -8.594 -1.517 1.00 0.00 H new ATOM 0 HD21 LEU A 19 5.539 -6.581 -3.798 1.00 0.00 H new ATOM 0 HD22 LEU A 19 7.090 -7.283 -3.282 1.00 0.00 H new ATOM 0 HD23 LEU A 19 6.577 -7.411 -4.981 1.00 0.00 H new ATOM 294 N PRO A 20 8.874 -10.061 -5.916 1.00 0.00 N ATOM 295 CA PRO A 20 10.277 -10.456 -6.273 1.00 0.00 C ATOM 296 C PRO A 20 11.046 -10.857 -5.014 1.00 0.00 C ATOM 297 O PRO A 20 11.824 -11.791 -5.022 1.00 0.00 O ATOM 298 CB PRO A 20 10.921 -9.231 -6.920 1.00 0.00 C ATOM 299 CG PRO A 20 9.922 -8.096 -6.830 1.00 0.00 C ATOM 300 CD PRO A 20 8.803 -8.559 -5.907 1.00 0.00 C ATOM 0 HA PRO A 20 10.288 -11.309 -6.951 1.00 0.00 H new ATOM 0 HB2 PRO A 20 11.847 -8.969 -6.409 1.00 0.00 H new ATOM 0 HB3 PRO A 20 11.177 -9.436 -7.959 1.00 0.00 H new ATOM 0 HG2 PRO A 20 10.396 -7.195 -6.440 1.00 0.00 H new ATOM 0 HG3 PRO A 20 9.530 -7.848 -7.817 1.00 0.00 H new ATOM 0 HD2 PRO A 20 8.937 -8.165 -4.899 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.833 -8.209 -6.260 1.00 0.00 H new ATOM 308 N TRP A 21 10.845 -10.149 -3.937 1.00 0.00 N ATOM 309 CA TRP A 21 11.575 -10.477 -2.681 1.00 0.00 C ATOM 310 C TRP A 21 10.623 -11.100 -1.656 1.00 0.00 C ATOM 311 O TRP A 21 9.571 -10.567 -1.364 1.00 0.00 O ATOM 312 CB TRP A 21 12.170 -9.191 -2.101 1.00 0.00 C ATOM 313 CG TRP A 21 11.079 -8.190 -1.888 1.00 0.00 C ATOM 314 CD1 TRP A 21 10.289 -8.125 -0.790 1.00 0.00 C ATOM 315 CD2 TRP A 21 10.641 -7.115 -2.771 1.00 0.00 C ATOM 316 NE1 TRP A 21 9.390 -7.086 -0.946 1.00 0.00 N ATOM 317 CE2 TRP A 21 9.568 -6.432 -2.149 1.00 0.00 C ATOM 318 CE3 TRP A 21 11.064 -6.671 -4.039 1.00 0.00 C ATOM 319 CZ2 TRP A 21 8.936 -5.348 -2.761 1.00 0.00 C ATOM 320 CZ3 TRP A 21 10.429 -5.578 -4.657 1.00 0.00 C ATOM 321 CH2 TRP A 21 9.368 -4.920 -4.019 1.00 0.00 C ATOM 0 H TRP A 21 10.206 -9.357 -3.873 1.00 0.00 H new ATOM 0 HA TRP A 21 12.367 -11.192 -2.905 1.00 0.00 H new ATOM 0 HB2 TRP A 21 12.673 -9.403 -1.158 1.00 0.00 H new ATOM 0 HB3 TRP A 21 12.922 -8.787 -2.779 1.00 0.00 H new ATOM 0 HD1 TRP A 21 10.351 -8.778 0.068 1.00 0.00 H new ATOM 0 HE1 TRP A 21 8.682 -6.834 -0.257 1.00 0.00 H new ATOM 0 HE3 TRP A 21 11.880 -7.172 -4.539 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 8.119 -4.844 -2.266 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 10.761 -5.244 -5.629 1.00 0.00 H new ATOM 0 HH2 TRP A 21 8.885 -4.082 -4.500 1.00 0.00 H new ATOM 332 N HIS A 22 10.993 -12.220 -1.097 1.00 0.00 N ATOM 333 CA HIS A 22 10.124 -12.865 -0.074 1.00 0.00 C ATOM 334 C HIS A 22 10.540 -12.338 1.301 1.00 0.00 C ATOM 335 O HIS A 22 11.505 -12.795 1.879 1.00 0.00 O ATOM 336 CB HIS A 22 10.307 -14.384 -0.122 1.00 0.00 C ATOM 337 CG HIS A 22 9.148 -15.050 0.567 1.00 0.00 C ATOM 338 ND1 HIS A 22 8.238 -15.843 -0.115 1.00 0.00 N ATOM 339 CD2 HIS A 22 8.736 -15.050 1.877 1.00 0.00 C ATOM 340 CE1 HIS A 22 7.334 -16.283 0.779 1.00 0.00 C ATOM 341 NE2 HIS A 22 7.591 -15.829 2.008 1.00 0.00 N ATOM 0 H HIS A 22 11.860 -12.716 -1.305 1.00 0.00 H new ATOM 0 HA HIS A 22 9.076 -12.634 -0.268 1.00 0.00 H new ATOM 0 HB2 HIS A 22 10.371 -14.721 -1.157 1.00 0.00 H new ATOM 0 HB3 HIS A 22 11.242 -14.664 0.363 1.00 0.00 H new ATOM 0 HD2 HIS A 22 9.227 -14.525 2.683 1.00 0.00 H new ATOM 0 HE1 HIS A 22 6.502 -16.925 0.532 1.00 0.00 H new ATOM 0 HE2 HIS A 22 7.061 -16.014 2.860 1.00 0.00 H new ATOM 349 N LEU A 23 9.827 -11.375 1.823 1.00 0.00 N ATOM 350 CA LEU A 23 10.190 -10.808 3.156 1.00 0.00 C ATOM 351 C LEU A 23 8.965 -10.854 4.080 1.00 0.00 C ATOM 352 O LEU A 23 8.040 -10.086 3.910 1.00 0.00 O ATOM 353 CB LEU A 23 10.643 -9.353 2.975 1.00 0.00 C ATOM 354 CG LEU A 23 11.136 -8.785 4.312 1.00 0.00 C ATOM 355 CD1 LEU A 23 12.397 -9.530 4.760 1.00 0.00 C ATOM 356 CD2 LEU A 23 11.455 -7.292 4.145 1.00 0.00 C ATOM 0 H LEU A 23 9.008 -10.956 1.383 1.00 0.00 H new ATOM 0 HA LEU A 23 10.998 -11.391 3.598 1.00 0.00 H new ATOM 0 HB2 LEU A 23 11.440 -9.302 2.233 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.817 -8.751 2.598 1.00 0.00 H new ATOM 0 HG LEU A 23 10.359 -8.911 5.065 1.00 0.00 H new ATOM 0 HD11 LEU A 23 12.742 -9.122 5.710 1.00 0.00 H new ATOM 0 HD12 LEU A 23 12.170 -10.589 4.881 1.00 0.00 H new ATOM 0 HD13 LEU A 23 13.177 -9.409 4.008 1.00 0.00 H new ATOM 0 HD21 LEU A 23 11.806 -6.886 5.094 1.00 0.00 H new ATOM 0 HD22 LEU A 23 12.230 -7.168 3.389 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.556 -6.760 3.833 1.00 0.00 H new ATOM 368 N PRO A 24 8.995 -11.756 5.032 1.00 0.00 N ATOM 369 CA PRO A 24 7.905 -11.978 6.046 1.00 0.00 C ATOM 370 C PRO A 24 7.836 -10.789 7.009 1.00 0.00 C ATOM 371 O PRO A 24 6.773 -10.399 7.452 1.00 0.00 O ATOM 372 CB PRO A 24 8.249 -13.255 6.808 1.00 0.00 C ATOM 373 CG PRO A 24 9.597 -13.738 6.320 1.00 0.00 C ATOM 374 CD PRO A 24 10.110 -12.733 5.295 1.00 0.00 C ATOM 0 HA PRO A 24 6.935 -12.072 5.559 1.00 0.00 H new ATOM 0 HB2 PRO A 24 8.278 -13.063 7.881 1.00 0.00 H new ATOM 0 HB3 PRO A 24 7.487 -14.016 6.640 1.00 0.00 H new ATOM 0 HG2 PRO A 24 10.296 -13.825 7.152 1.00 0.00 H new ATOM 0 HG3 PRO A 24 9.509 -14.728 5.873 1.00 0.00 H new ATOM 0 HD2 PRO A 24 10.993 -12.217 5.671 1.00 0.00 H new ATOM 0 HD3 PRO A 24 10.404 -13.238 4.375 1.00 0.00 H new ATOM 382 N ASP A 25 8.960 -10.208 7.329 1.00 0.00 N ATOM 383 CA ASP A 25 8.961 -9.041 8.258 1.00 0.00 C ATOM 384 C ASP A 25 8.273 -7.850 7.583 1.00 0.00 C ATOM 385 O ASP A 25 7.760 -6.962 8.239 1.00 0.00 O ATOM 386 CB ASP A 25 10.404 -8.667 8.604 1.00 0.00 C ATOM 387 CG ASP A 25 10.425 -7.845 9.894 1.00 0.00 C ATOM 388 OD1 ASP A 25 9.923 -8.335 10.893 1.00 0.00 O ATOM 389 OD2 ASP A 25 10.943 -6.740 9.860 1.00 0.00 O ATOM 0 H ASP A 25 9.879 -10.491 6.987 1.00 0.00 H new ATOM 0 HA ASP A 25 8.424 -9.302 9.170 1.00 0.00 H new ATOM 0 HB2 ASP A 25 11.005 -9.568 8.725 1.00 0.00 H new ATOM 0 HB3 ASP A 25 10.848 -8.095 7.789 1.00 0.00 H new ATOM 394 N ASP A 26 8.259 -7.824 6.277 1.00 0.00 N ATOM 395 CA ASP A 26 7.608 -6.695 5.559 1.00 0.00 C ATOM 396 C ASP A 26 6.091 -6.894 5.585 1.00 0.00 C ATOM 397 O ASP A 26 5.343 -5.974 5.850 1.00 0.00 O ATOM 398 CB ASP A 26 8.112 -6.656 4.113 1.00 0.00 C ATOM 399 CG ASP A 26 7.357 -5.586 3.323 1.00 0.00 C ATOM 400 OD1 ASP A 26 7.409 -4.429 3.717 1.00 0.00 O ATOM 401 OD2 ASP A 26 6.730 -5.947 2.343 1.00 0.00 O ATOM 0 H ASP A 26 8.672 -8.538 5.677 1.00 0.00 H new ATOM 0 HA ASP A 26 7.854 -5.751 6.045 1.00 0.00 H new ATOM 0 HB2 ASP A 26 9.181 -6.444 4.098 1.00 0.00 H new ATOM 0 HB3 ASP A 26 7.974 -7.631 3.645 1.00 0.00 H new ATOM 406 N LEU A 27 5.630 -8.091 5.323 1.00 0.00 N ATOM 407 CA LEU A 27 4.160 -8.346 5.346 1.00 0.00 C ATOM 408 C LEU A 27 3.598 -7.902 6.699 1.00 0.00 C ATOM 409 O LEU A 27 2.588 -7.231 6.774 1.00 0.00 O ATOM 410 CB LEU A 27 3.894 -9.840 5.149 1.00 0.00 C ATOM 411 CG LEU A 27 4.327 -10.256 3.741 1.00 0.00 C ATOM 412 CD1 LEU A 27 4.576 -11.767 3.706 1.00 0.00 C ATOM 413 CD2 LEU A 27 3.222 -9.896 2.743 1.00 0.00 C ATOM 0 H LEU A 27 6.208 -8.900 5.095 1.00 0.00 H new ATOM 0 HA LEU A 27 3.678 -7.787 4.544 1.00 0.00 H new ATOM 0 HB2 LEU A 27 4.440 -10.418 5.894 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.835 -10.053 5.293 1.00 0.00 H new ATOM 0 HG LEU A 27 5.245 -9.733 3.473 1.00 0.00 H new ATOM 0 HD11 LEU A 27 4.884 -12.062 2.703 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.362 -12.023 4.417 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.660 -12.293 3.973 1.00 0.00 H new ATOM 0 HD21 LEU A 27 3.528 -10.191 1.739 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.305 -10.420 3.011 1.00 0.00 H new ATOM 0 HD23 LEU A 27 3.046 -8.821 2.767 1.00 0.00 H new ATOM 425 N HIS A 28 4.261 -8.260 7.770 1.00 0.00 N ATOM 426 CA HIS A 28 3.781 -7.848 9.120 1.00 0.00 C ATOM 427 C HIS A 28 3.715 -6.322 9.177 1.00 0.00 C ATOM 428 O HIS A 28 2.805 -5.749 9.744 1.00 0.00 O ATOM 429 CB HIS A 28 4.752 -8.358 10.188 1.00 0.00 C ATOM 430 CG HIS A 28 4.818 -9.860 10.132 1.00 0.00 C ATOM 431 ND1 HIS A 28 3.738 -10.633 9.738 1.00 0.00 N ATOM 432 CD2 HIS A 28 5.828 -10.745 10.419 1.00 0.00 C ATOM 433 CE1 HIS A 28 4.119 -11.922 9.798 1.00 0.00 C ATOM 434 NE2 HIS A 28 5.384 -12.047 10.208 1.00 0.00 N ATOM 0 H HIS A 28 5.114 -8.820 7.766 1.00 0.00 H new ATOM 0 HA HIS A 28 2.793 -8.269 9.305 1.00 0.00 H new ATOM 0 HB2 HIS A 28 5.743 -7.934 10.026 1.00 0.00 H new ATOM 0 HB3 HIS A 28 4.425 -8.035 11.176 1.00 0.00 H new ATOM 0 HD2 HIS A 28 6.817 -10.472 10.757 1.00 0.00 H new ATOM 0 HE1 HIS A 28 3.479 -12.755 9.545 1.00 0.00 H new ATOM 0 HE2 HIS A 28 5.911 -12.911 10.338 1.00 0.00 H new ATOM 442 N TYR A 29 4.670 -5.660 8.578 1.00 0.00 N ATOM 443 CA TYR A 29 4.658 -4.169 8.575 1.00 0.00 C ATOM 444 C TYR A 29 3.411 -3.688 7.831 1.00 0.00 C ATOM 445 O TYR A 29 2.819 -2.681 8.169 1.00 0.00 O ATOM 446 CB TYR A 29 5.910 -3.649 7.866 1.00 0.00 C ATOM 447 CG TYR A 29 6.033 -2.161 8.088 1.00 0.00 C ATOM 448 CD1 TYR A 29 6.311 -1.666 9.367 1.00 0.00 C ATOM 449 CD2 TYR A 29 5.868 -1.277 7.015 1.00 0.00 C ATOM 450 CE1 TYR A 29 6.425 -0.286 9.574 1.00 0.00 C ATOM 451 CE2 TYR A 29 5.982 0.103 7.222 1.00 0.00 C ATOM 452 CZ TYR A 29 6.261 0.598 8.501 1.00 0.00 C ATOM 453 OH TYR A 29 6.373 1.959 8.705 1.00 0.00 O ATOM 0 H TYR A 29 5.457 -6.088 8.091 1.00 0.00 H new ATOM 0 HA TYR A 29 4.646 -3.796 9.599 1.00 0.00 H new ATOM 0 HB2 TYR A 29 6.795 -4.159 8.247 1.00 0.00 H new ATOM 0 HB3 TYR A 29 5.853 -3.865 6.799 1.00 0.00 H new ATOM 0 HD1 TYR A 29 6.438 -2.348 10.194 1.00 0.00 H new ATOM 0 HD2 TYR A 29 5.653 -1.659 6.028 1.00 0.00 H new ATOM 0 HE1 TYR A 29 6.639 0.096 10.561 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.855 0.785 6.395 1.00 0.00 H new ATOM 0 HH TYR A 29 5.576 2.409 8.354 1.00 0.00 H new ATOM 463 N PHE A 30 3.010 -4.412 6.820 1.00 0.00 N ATOM 464 CA PHE A 30 1.800 -4.020 6.043 1.00 0.00 C ATOM 465 C PHE A 30 0.562 -4.174 6.928 1.00 0.00 C ATOM 466 O PHE A 30 -0.264 -3.287 7.017 1.00 0.00 O ATOM 467 CB PHE A 30 1.668 -4.927 4.816 1.00 0.00 C ATOM 468 CG PHE A 30 0.401 -4.592 4.061 1.00 0.00 C ATOM 469 CD1 PHE A 30 0.157 -3.276 3.649 1.00 0.00 C ATOM 470 CD2 PHE A 30 -0.526 -5.600 3.771 1.00 0.00 C ATOM 471 CE1 PHE A 30 -1.015 -2.969 2.946 1.00 0.00 C ATOM 472 CE2 PHE A 30 -1.698 -5.293 3.069 1.00 0.00 C ATOM 473 CZ PHE A 30 -1.941 -3.977 2.655 1.00 0.00 C ATOM 0 H PHE A 30 3.472 -5.263 6.498 1.00 0.00 H new ATOM 0 HA PHE A 30 1.891 -2.983 5.719 1.00 0.00 H new ATOM 0 HB2 PHE A 30 2.533 -4.801 4.165 1.00 0.00 H new ATOM 0 HB3 PHE A 30 1.651 -5.972 5.126 1.00 0.00 H new ATOM 0 HD1 PHE A 30 0.872 -2.498 3.873 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -0.337 -6.615 4.089 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -1.204 -1.954 2.629 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -2.414 -6.070 2.847 1.00 0.00 H new ATOM 0 HZ PHE A 30 -2.843 -3.740 2.111 1.00 0.00 H new ATOM 483 N ARG A 31 0.430 -5.291 7.589 1.00 0.00 N ATOM 484 CA ARG A 31 -0.751 -5.502 8.470 1.00 0.00 C ATOM 485 C ARG A 31 -0.737 -4.460 9.589 1.00 0.00 C ATOM 486 O ARG A 31 -1.628 -3.641 9.699 1.00 0.00 O ATOM 487 CB ARG A 31 -0.683 -6.908 9.075 1.00 0.00 C ATOM 488 CG ARG A 31 -2.080 -7.529 9.086 1.00 0.00 C ATOM 489 CD ARG A 31 -2.190 -8.533 10.235 1.00 0.00 C ATOM 490 NE ARG A 31 -1.261 -9.677 9.991 1.00 0.00 N ATOM 491 CZ ARG A 31 -0.110 -9.763 10.616 1.00 0.00 C ATOM 492 NH1 ARG A 31 0.273 -8.839 11.462 1.00 0.00 N ATOM 493 NH2 ARG A 31 0.671 -10.783 10.384 1.00 0.00 N ATOM 0 H ARG A 31 1.091 -6.067 7.556 1.00 0.00 H new ATOM 0 HA ARG A 31 -1.669 -5.400 7.891 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -0.001 -7.531 8.496 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -0.287 -6.860 10.090 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -2.834 -6.750 9.198 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.275 -8.027 8.136 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -1.945 -8.048 11.180 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -3.215 -8.895 10.318 1.00 0.00 H new ATOM 0 HE ARG A 31 -1.526 -10.404 9.327 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -0.327 -8.035 11.645 1.00 0.00 H new ATOM 0 HH12 ARG A 31 1.171 -8.924 11.938 1.00 0.00 H new ATOM 0 HH21 ARG A 31 0.385 -11.504 9.722 1.00 0.00 H new ATOM 0 HH22 ARG A 31 1.567 -10.859 10.865 1.00 0.00 H new ATOM 507 N ALA A 32 0.270 -4.494 10.421 1.00 0.00 N ATOM 508 CA ALA A 32 0.361 -3.517 11.548 1.00 0.00 C ATOM 509 C ALA A 32 0.120 -2.090 11.037 1.00 0.00 C ATOM 510 O ALA A 32 -0.506 -1.284 11.698 1.00 0.00 O ATOM 511 CB ALA A 32 1.754 -3.604 12.178 1.00 0.00 C ATOM 0 H ALA A 32 1.040 -5.161 10.369 1.00 0.00 H new ATOM 0 HA ALA A 32 -0.399 -3.758 12.291 1.00 0.00 H new ATOM 0 HB1 ALA A 32 1.826 -2.893 13.001 1.00 0.00 H new ATOM 0 HB2 ALA A 32 1.921 -4.613 12.555 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.508 -3.368 11.427 1.00 0.00 H new ATOM 517 N GLN A 33 0.620 -1.767 9.873 1.00 0.00 N ATOM 518 CA GLN A 33 0.427 -0.389 9.331 1.00 0.00 C ATOM 519 C GLN A 33 -1.032 -0.178 8.909 1.00 0.00 C ATOM 520 O GLN A 33 -1.470 0.939 8.714 1.00 0.00 O ATOM 521 CB GLN A 33 1.338 -0.194 8.117 1.00 0.00 C ATOM 522 CG GLN A 33 2.769 0.082 8.587 1.00 0.00 C ATOM 523 CD GLN A 33 3.055 1.583 8.506 1.00 0.00 C ATOM 524 OE1 GLN A 33 3.999 1.999 7.863 1.00 0.00 O ATOM 525 NE2 GLN A 33 2.276 2.418 9.138 1.00 0.00 N ATOM 0 H GLN A 33 1.153 -2.397 9.274 1.00 0.00 H new ATOM 0 HA GLN A 33 0.677 0.335 10.107 1.00 0.00 H new ATOM 0 HB2 GLN A 33 1.317 -1.083 7.487 1.00 0.00 H new ATOM 0 HB3 GLN A 33 0.978 0.636 7.509 1.00 0.00 H new ATOM 0 HG2 GLN A 33 2.900 -0.269 9.611 1.00 0.00 H new ATOM 0 HG3 GLN A 33 3.478 -0.468 7.968 1.00 0.00 H new ATOM 0 HE21 GLN A 33 1.484 2.068 9.677 1.00 0.00 H new ATOM 0 HE22 GLN A 33 2.459 3.420 9.093 1.00 0.00 H new ATOM 534 N THR A 34 -1.787 -1.234 8.753 1.00 0.00 N ATOM 535 CA THR A 34 -3.211 -1.071 8.330 1.00 0.00 C ATOM 536 C THR A 34 -4.152 -1.631 9.400 1.00 0.00 C ATOM 537 O THR A 34 -5.251 -2.060 9.103 1.00 0.00 O ATOM 538 CB THR A 34 -3.443 -1.813 7.008 1.00 0.00 C ATOM 539 OG1 THR A 34 -2.954 -3.148 7.104 1.00 0.00 O ATOM 540 CG2 THR A 34 -2.714 -1.083 5.880 1.00 0.00 C ATOM 0 H THR A 34 -1.483 -2.197 8.899 1.00 0.00 H new ATOM 0 HA THR A 34 -3.418 -0.009 8.197 1.00 0.00 H new ATOM 0 HB THR A 34 -4.512 -1.840 6.797 1.00 0.00 H new ATOM 0 HG1 THR A 34 -1.978 -3.146 7.018 1.00 0.00 H new ATOM 0 HG21 THR A 34 -2.878 -1.610 4.940 1.00 0.00 H new ATOM 0 HG22 THR A 34 -3.097 -0.066 5.798 1.00 0.00 H new ATOM 0 HG23 THR A 34 -1.646 -1.052 6.097 1.00 0.00 H new ATOM 548 N VAL A 35 -3.744 -1.620 10.640 1.00 0.00 N ATOM 549 CA VAL A 35 -4.633 -2.144 11.718 1.00 0.00 C ATOM 550 C VAL A 35 -5.709 -1.103 12.040 1.00 0.00 C ATOM 551 O VAL A 35 -5.420 -0.041 12.555 1.00 0.00 O ATOM 552 CB VAL A 35 -3.814 -2.425 12.981 1.00 0.00 C ATOM 553 CG1 VAL A 35 -2.837 -3.572 12.715 1.00 0.00 C ATOM 554 CG2 VAL A 35 -3.034 -1.168 13.381 1.00 0.00 C ATOM 0 H VAL A 35 -2.838 -1.273 10.953 1.00 0.00 H new ATOM 0 HA VAL A 35 -5.100 -3.068 11.377 1.00 0.00 H new ATOM 0 HB VAL A 35 -4.487 -2.704 13.791 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -2.255 -3.770 13.615 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -3.394 -4.467 12.438 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -2.165 -3.297 11.902 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.452 -1.371 14.280 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -2.362 -0.883 12.571 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -3.732 -0.354 13.577 1.00 0.00 H new ATOM 564 N GLY A 36 -6.948 -1.402 11.751 1.00 0.00 N ATOM 565 CA GLY A 36 -8.043 -0.433 12.053 1.00 0.00 C ATOM 566 C GLY A 36 -8.034 0.722 11.046 1.00 0.00 C ATOM 567 O GLY A 36 -8.652 1.743 11.270 1.00 0.00 O ATOM 0 H GLY A 36 -7.249 -2.275 11.319 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -9.006 -0.943 12.021 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.922 -0.043 13.063 1.00 0.00 H new ATOM 571 N LYS A 37 -7.339 0.581 9.946 1.00 0.00 N ATOM 572 CA LYS A 37 -7.300 1.689 8.944 1.00 0.00 C ATOM 573 C LYS A 37 -7.902 1.216 7.614 1.00 0.00 C ATOM 574 O LYS A 37 -7.975 0.034 7.342 1.00 0.00 O ATOM 575 CB LYS A 37 -5.848 2.121 8.726 1.00 0.00 C ATOM 576 CG LYS A 37 -5.365 2.908 9.946 1.00 0.00 C ATOM 577 CD LYS A 37 -4.081 3.663 9.595 1.00 0.00 C ATOM 578 CE LYS A 37 -3.576 4.411 10.830 1.00 0.00 C ATOM 579 NZ LYS A 37 -2.394 5.240 10.460 1.00 0.00 N ATOM 0 H LYS A 37 -6.800 -0.249 9.699 1.00 0.00 H new ATOM 0 HA LYS A 37 -7.882 2.532 9.316 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -5.216 1.247 8.570 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -5.770 2.735 7.829 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -6.135 3.610 10.267 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -5.184 2.230 10.780 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -3.321 2.966 9.243 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -4.270 4.365 8.783 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -4.366 5.045 11.233 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -3.306 3.702 11.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -2.050 5.749 11.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -1.639 4.625 10.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -2.667 5.926 9.727 1.00 0.00 H new ATOM 593 N ILE A 38 -8.339 2.135 6.787 1.00 0.00 N ATOM 594 CA ILE A 38 -8.940 1.744 5.476 1.00 0.00 C ATOM 595 C ILE A 38 -7.834 1.264 4.529 1.00 0.00 C ATOM 596 O ILE A 38 -6.949 2.011 4.176 1.00 0.00 O ATOM 597 CB ILE A 38 -9.642 2.960 4.863 1.00 0.00 C ATOM 598 CG1 ILE A 38 -10.756 3.428 5.802 1.00 0.00 C ATOM 599 CG2 ILE A 38 -10.240 2.590 3.503 1.00 0.00 C ATOM 600 CD1 ILE A 38 -11.371 4.723 5.267 1.00 0.00 C ATOM 0 H ILE A 38 -8.305 3.139 6.965 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.660 0.940 5.628 1.00 0.00 H new ATOM 0 HB ILE A 38 -8.916 3.762 4.725 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -11.522 2.657 5.885 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -10.357 3.590 6.803 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -10.737 3.461 3.075 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -9.445 2.260 2.834 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -10.964 1.785 3.631 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -12.164 5.054 5.938 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -10.602 5.493 5.207 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -11.786 4.546 4.275 1.00 0.00 H new ATOM 612 N MET A 39 -7.878 0.023 4.117 1.00 0.00 N ATOM 613 CA MET A 39 -6.824 -0.497 3.195 1.00 0.00 C ATOM 614 C MET A 39 -7.385 -0.616 1.773 1.00 0.00 C ATOM 615 O MET A 39 -8.249 -1.429 1.504 1.00 0.00 O ATOM 616 CB MET A 39 -6.363 -1.874 3.683 1.00 0.00 C ATOM 617 CG MET A 39 -5.213 -2.373 2.804 1.00 0.00 C ATOM 618 SD MET A 39 -5.381 -4.156 2.540 1.00 0.00 S ATOM 619 CE MET A 39 -6.896 -4.092 1.555 1.00 0.00 C ATOM 0 H MET A 39 -8.597 -0.652 4.379 1.00 0.00 H new ATOM 0 HA MET A 39 -5.979 0.192 3.186 1.00 0.00 H new ATOM 0 HB2 MET A 39 -6.040 -1.813 4.722 1.00 0.00 H new ATOM 0 HB3 MET A 39 -7.193 -2.580 3.648 1.00 0.00 H new ATOM 0 HG2 MET A 39 -5.220 -1.851 1.847 1.00 0.00 H new ATOM 0 HG3 MET A 39 -4.257 -2.154 3.279 1.00 0.00 H new ATOM 0 HE1 MET A 39 -7.074 -5.065 1.098 1.00 0.00 H new ATOM 0 HE2 MET A 39 -7.737 -3.833 2.198 1.00 0.00 H new ATOM 0 HE3 MET A 39 -6.791 -3.339 0.774 1.00 0.00 H new ATOM 629 N VAL A 40 -6.904 0.192 0.861 1.00 0.00 N ATOM 630 CA VAL A 40 -7.412 0.133 -0.545 1.00 0.00 C ATOM 631 C VAL A 40 -6.475 -0.721 -1.412 1.00 0.00 C ATOM 632 O VAL A 40 -5.302 -0.421 -1.563 1.00 0.00 O ATOM 633 CB VAL A 40 -7.482 1.550 -1.123 1.00 0.00 C ATOM 634 CG1 VAL A 40 -8.318 1.541 -2.406 1.00 0.00 C ATOM 635 CG2 VAL A 40 -8.128 2.488 -0.099 1.00 0.00 C ATOM 0 H VAL A 40 -6.180 0.891 1.029 1.00 0.00 H new ATOM 0 HA VAL A 40 -8.405 -0.316 -0.543 1.00 0.00 H new ATOM 0 HB VAL A 40 -6.474 1.898 -1.350 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -8.367 2.550 -2.816 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -7.858 0.875 -3.136 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.326 1.192 -2.181 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.178 3.496 -0.510 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.135 2.139 0.130 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.531 2.497 0.813 1.00 0.00 H new ATOM 645 N VAL A 41 -6.992 -1.781 -1.987 1.00 0.00 N ATOM 646 CA VAL A 41 -6.150 -2.662 -2.853 1.00 0.00 C ATOM 647 C VAL A 41 -6.866 -2.916 -4.184 1.00 0.00 C ATOM 648 O VAL A 41 -8.031 -3.256 -4.215 1.00 0.00 O ATOM 649 CB VAL A 41 -5.916 -4.006 -2.155 1.00 0.00 C ATOM 650 CG1 VAL A 41 -5.000 -3.813 -0.946 1.00 0.00 C ATOM 651 CG2 VAL A 41 -7.255 -4.580 -1.690 1.00 0.00 C ATOM 0 H VAL A 41 -7.965 -2.074 -1.892 1.00 0.00 H new ATOM 0 HA VAL A 41 -5.195 -2.169 -3.034 1.00 0.00 H new ATOM 0 HB VAL A 41 -5.445 -4.695 -2.856 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -4.838 -4.773 -0.455 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.043 -3.408 -1.275 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -5.465 -3.120 -0.244 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -7.088 -5.536 -1.194 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -7.726 -3.887 -0.993 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -7.907 -4.727 -2.551 1.00 0.00 H new ATOM 661 N GLY A 42 -6.183 -2.749 -5.287 1.00 0.00 N ATOM 662 CA GLY A 42 -6.828 -2.979 -6.616 1.00 0.00 C ATOM 663 C GLY A 42 -7.427 -4.389 -6.673 1.00 0.00 C ATOM 664 O GLY A 42 -6.867 -5.335 -6.157 1.00 0.00 O ATOM 0 H GLY A 42 -5.205 -2.463 -5.325 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -7.608 -2.237 -6.784 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.094 -2.855 -7.412 1.00 0.00 H new ATOM 668 N ARG A 43 -8.575 -4.528 -7.285 1.00 0.00 N ATOM 669 CA ARG A 43 -9.243 -5.863 -7.373 1.00 0.00 C ATOM 670 C ARG A 43 -8.289 -6.930 -7.924 1.00 0.00 C ATOM 671 O ARG A 43 -8.511 -8.110 -7.737 1.00 0.00 O ATOM 672 CB ARG A 43 -10.455 -5.757 -8.308 1.00 0.00 C ATOM 673 CG ARG A 43 -11.286 -7.041 -8.232 1.00 0.00 C ATOM 674 CD ARG A 43 -10.907 -7.978 -9.384 1.00 0.00 C ATOM 675 NE ARG A 43 -11.405 -7.426 -10.680 1.00 0.00 N ATOM 676 CZ ARG A 43 -11.360 -8.153 -11.772 1.00 0.00 C ATOM 677 NH1 ARG A 43 -10.894 -9.376 -11.740 1.00 0.00 N ATOM 678 NH2 ARG A 43 -11.786 -7.658 -12.902 1.00 0.00 N ATOM 0 H ARG A 43 -9.084 -3.766 -7.732 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.551 -6.157 -6.369 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -11.068 -4.900 -8.028 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -10.122 -5.589 -9.332 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -11.116 -7.538 -7.277 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -12.348 -6.800 -8.282 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -9.824 -8.099 -9.423 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -11.332 -8.967 -9.214 1.00 0.00 H new ATOM 0 HE ARG A 43 -11.782 -6.479 -10.716 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -10.562 -9.772 -10.861 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -10.863 -9.933 -12.594 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -12.153 -6.707 -12.936 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -11.751 -8.222 -13.751 1.00 0.00 H new ATOM 692 N ARG A 44 -7.236 -6.546 -8.600 1.00 0.00 N ATOM 693 CA ARG A 44 -6.308 -7.582 -9.142 1.00 0.00 C ATOM 694 C ARG A 44 -5.317 -7.994 -8.055 1.00 0.00 C ATOM 695 O ARG A 44 -5.056 -9.166 -7.855 1.00 0.00 O ATOM 696 CB ARG A 44 -5.572 -7.032 -10.361 1.00 0.00 C ATOM 697 CG ARG A 44 -6.180 -7.623 -11.638 1.00 0.00 C ATOM 698 CD ARG A 44 -5.070 -7.920 -12.650 1.00 0.00 C ATOM 699 NE ARG A 44 -5.067 -6.867 -13.707 1.00 0.00 N ATOM 700 CZ ARG A 44 -4.417 -7.050 -14.832 1.00 0.00 C ATOM 701 NH1 ARG A 44 -3.757 -8.159 -15.052 1.00 0.00 N ATOM 702 NH2 ARG A 44 -4.430 -6.116 -15.743 1.00 0.00 N ATOM 0 H ARG A 44 -6.982 -5.578 -8.797 1.00 0.00 H new ATOM 0 HA ARG A 44 -6.877 -8.459 -9.451 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -5.643 -5.945 -10.382 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.512 -7.281 -10.302 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -6.725 -8.537 -11.403 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -6.899 -6.925 -12.067 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -4.103 -7.949 -12.148 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -5.225 -8.901 -13.099 1.00 0.00 H new ATOM 0 HE ARG A 44 -5.575 -5.996 -13.554 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -3.744 -8.894 -14.344 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -3.256 -8.288 -15.931 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -4.943 -5.250 -15.578 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -3.927 -6.252 -16.620 1.00 0.00 H new ATOM 716 N THR A 45 -4.786 -7.048 -7.326 1.00 0.00 N ATOM 717 CA THR A 45 -3.842 -7.408 -6.231 1.00 0.00 C ATOM 718 C THR A 45 -4.638 -8.107 -5.128 1.00 0.00 C ATOM 719 O THR A 45 -4.229 -9.125 -4.605 1.00 0.00 O ATOM 720 CB THR A 45 -3.185 -6.146 -5.666 1.00 0.00 C ATOM 721 OG1 THR A 45 -2.781 -5.295 -6.734 1.00 0.00 O ATOM 722 CG2 THR A 45 -1.965 -6.540 -4.829 1.00 0.00 C ATOM 0 H THR A 45 -4.964 -6.050 -7.441 1.00 0.00 H new ATOM 0 HA THR A 45 -3.061 -8.064 -6.614 1.00 0.00 H new ATOM 0 HB THR A 45 -3.900 -5.615 -5.038 1.00 0.00 H new ATOM 0 HG1 THR A 45 -2.818 -4.361 -6.440 1.00 0.00 H new ATOM 0 HG21 THR A 45 -1.495 -5.643 -4.426 1.00 0.00 H new ATOM 0 HG22 THR A 45 -2.280 -7.185 -4.009 1.00 0.00 H new ATOM 0 HG23 THR A 45 -1.250 -7.073 -5.456 1.00 0.00 H new ATOM 730 N TYR A 46 -5.786 -7.577 -4.787 1.00 0.00 N ATOM 731 CA TYR A 46 -6.625 -8.221 -3.732 1.00 0.00 C ATOM 732 C TYR A 46 -6.885 -9.677 -4.133 1.00 0.00 C ATOM 733 O TYR A 46 -6.824 -10.577 -3.318 1.00 0.00 O ATOM 734 CB TYR A 46 -7.959 -7.477 -3.598 1.00 0.00 C ATOM 735 CG TYR A 46 -8.819 -8.167 -2.562 1.00 0.00 C ATOM 736 CD1 TYR A 46 -8.637 -7.894 -1.201 1.00 0.00 C ATOM 737 CD2 TYR A 46 -9.795 -9.087 -2.965 1.00 0.00 C ATOM 738 CE1 TYR A 46 -9.429 -8.539 -0.244 1.00 0.00 C ATOM 739 CE2 TYR A 46 -10.587 -9.733 -2.008 1.00 0.00 C ATOM 740 CZ TYR A 46 -10.404 -9.459 -0.646 1.00 0.00 C ATOM 741 OH TYR A 46 -11.184 -10.094 0.301 1.00 0.00 O ATOM 0 H TYR A 46 -6.178 -6.727 -5.193 1.00 0.00 H new ATOM 0 HA TYR A 46 -6.105 -8.184 -2.775 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -7.782 -6.441 -3.308 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -8.474 -7.456 -4.558 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -7.885 -7.185 -0.889 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -9.937 -9.298 -4.015 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -9.288 -8.327 0.805 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -11.339 -10.443 -2.320 1.00 0.00 H new ATOM 0 HH TYR A 46 -11.812 -10.700 -0.145 1.00 0.00 H new ATOM 751 N GLU A 47 -7.158 -9.912 -5.390 1.00 0.00 N ATOM 752 CA GLU A 47 -7.406 -11.307 -5.857 1.00 0.00 C ATOM 753 C GLU A 47 -6.085 -12.085 -5.855 1.00 0.00 C ATOM 754 O GLU A 47 -6.068 -13.298 -5.931 1.00 0.00 O ATOM 755 CB GLU A 47 -7.981 -11.275 -7.275 1.00 0.00 C ATOM 756 CG GLU A 47 -9.483 -10.989 -7.211 1.00 0.00 C ATOM 757 CD GLU A 47 -10.143 -11.427 -8.519 1.00 0.00 C ATOM 758 OE1 GLU A 47 -9.706 -10.970 -9.562 1.00 0.00 O ATOM 759 OE2 GLU A 47 -11.075 -12.212 -8.455 1.00 0.00 O ATOM 0 H GLU A 47 -7.220 -9.196 -6.114 1.00 0.00 H new ATOM 0 HA GLU A 47 -8.116 -11.796 -5.190 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -7.479 -10.508 -7.865 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -7.802 -12.228 -7.773 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -9.929 -11.520 -6.371 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -9.654 -9.926 -7.043 1.00 0.00 H new ATOM 766 N SER A 48 -4.979 -11.393 -5.757 1.00 0.00 N ATOM 767 CA SER A 48 -3.658 -12.084 -5.734 1.00 0.00 C ATOM 768 C SER A 48 -3.178 -12.205 -4.282 1.00 0.00 C ATOM 769 O SER A 48 -2.358 -13.042 -3.961 1.00 0.00 O ATOM 770 CB SER A 48 -2.643 -11.281 -6.553 1.00 0.00 C ATOM 771 OG SER A 48 -2.102 -10.238 -5.751 1.00 0.00 O ATOM 0 H SER A 48 -4.935 -10.376 -5.692 1.00 0.00 H new ATOM 0 HA SER A 48 -3.756 -13.079 -6.168 1.00 0.00 H new ATOM 0 HB2 SER A 48 -1.845 -11.935 -6.904 1.00 0.00 H new ATOM 0 HB3 SER A 48 -3.124 -10.862 -7.437 1.00 0.00 H new ATOM 0 HG SER A 48 -2.826 -9.791 -5.264 1.00 0.00 H new ATOM 777 N PHE A 49 -3.684 -11.366 -3.406 1.00 0.00 N ATOM 778 CA PHE A 49 -3.273 -11.414 -1.965 1.00 0.00 C ATOM 779 C PHE A 49 -3.216 -12.873 -1.485 1.00 0.00 C ATOM 780 O PHE A 49 -3.821 -13.740 -2.083 1.00 0.00 O ATOM 781 CB PHE A 49 -4.313 -10.667 -1.124 1.00 0.00 C ATOM 782 CG PHE A 49 -3.781 -9.325 -0.672 1.00 0.00 C ATOM 783 CD1 PHE A 49 -3.838 -8.220 -1.528 1.00 0.00 C ATOM 784 CD2 PHE A 49 -3.253 -9.184 0.617 1.00 0.00 C ATOM 785 CE1 PHE A 49 -3.366 -6.975 -1.096 1.00 0.00 C ATOM 786 CE2 PHE A 49 -2.778 -7.941 1.047 1.00 0.00 C ATOM 787 CZ PHE A 49 -2.836 -6.836 0.192 1.00 0.00 C ATOM 0 H PHE A 49 -4.369 -10.645 -3.630 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.291 -10.953 -1.858 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -5.223 -10.524 -1.707 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -4.582 -11.267 -0.255 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -4.246 -8.327 -2.522 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -3.213 -10.036 1.280 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -3.411 -6.122 -1.757 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -2.366 -7.834 2.040 1.00 0.00 H new ATOM 0 HZ PHE A 49 -2.472 -5.875 0.525 1.00 0.00 H new ATOM 797 N PRO A 50 -2.499 -13.097 -0.412 1.00 0.00 N ATOM 798 CA PRO A 50 -2.309 -14.433 0.244 1.00 0.00 C ATOM 799 C PRO A 50 -3.520 -14.760 1.126 1.00 0.00 C ATOM 800 O PRO A 50 -4.226 -15.721 0.890 1.00 0.00 O ATOM 801 CB PRO A 50 -1.048 -14.319 1.098 1.00 0.00 C ATOM 802 CG PRO A 50 -0.673 -12.852 1.162 1.00 0.00 C ATOM 803 CD PRO A 50 -1.725 -12.078 0.375 1.00 0.00 C ATOM 0 HA PRO A 50 -2.213 -15.229 -0.494 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -1.225 -14.713 2.099 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -0.237 -14.904 0.664 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -0.638 -12.509 2.196 1.00 0.00 H new ATOM 0 HG3 PRO A 50 0.319 -12.690 0.739 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -2.382 -11.524 1.045 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -1.257 -11.349 -0.287 1.00 0.00 H new ATOM 811 N LYS A 51 -3.760 -13.975 2.145 1.00 0.00 N ATOM 812 CA LYS A 51 -4.919 -14.252 3.045 1.00 0.00 C ATOM 813 C LYS A 51 -5.877 -13.056 3.063 1.00 0.00 C ATOM 814 O LYS A 51 -5.598 -12.035 3.660 1.00 0.00 O ATOM 815 CB LYS A 51 -4.408 -14.503 4.465 1.00 0.00 C ATOM 816 CG LYS A 51 -3.616 -15.811 4.504 1.00 0.00 C ATOM 817 CD LYS A 51 -3.941 -16.570 5.794 1.00 0.00 C ATOM 818 CE LYS A 51 -4.889 -17.732 5.484 1.00 0.00 C ATOM 819 NZ LYS A 51 -4.152 -19.022 5.609 1.00 0.00 N ATOM 0 H LYS A 51 -3.205 -13.156 2.392 1.00 0.00 H new ATOM 0 HA LYS A 51 -5.450 -15.130 2.676 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -3.777 -13.675 4.786 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -5.246 -14.553 5.160 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -3.864 -16.424 3.637 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -2.547 -15.603 4.452 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -3.024 -16.947 6.246 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -4.400 -15.897 6.518 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -5.736 -17.717 6.170 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -5.292 -17.627 4.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -4.796 -19.811 5.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -3.358 -19.034 4.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -3.788 -19.121 6.578 1.00 0.00 H new ATOM 833 N ARG A 52 -7.007 -13.176 2.415 1.00 0.00 N ATOM 834 CA ARG A 52 -7.984 -12.047 2.401 1.00 0.00 C ATOM 835 C ARG A 52 -9.324 -12.522 2.976 1.00 0.00 C ATOM 836 O ARG A 52 -9.765 -13.615 2.682 1.00 0.00 O ATOM 837 CB ARG A 52 -8.204 -11.561 0.964 1.00 0.00 C ATOM 838 CG ARG A 52 -6.876 -11.558 0.206 1.00 0.00 C ATOM 839 CD ARG A 52 -6.809 -12.777 -0.717 1.00 0.00 C ATOM 840 NE ARG A 52 -7.883 -12.677 -1.749 1.00 0.00 N ATOM 841 CZ ARG A 52 -7.986 -13.578 -2.696 1.00 0.00 C ATOM 842 NH1 ARG A 52 -7.149 -14.583 -2.757 1.00 0.00 N ATOM 843 NH2 ARG A 52 -8.932 -13.471 -3.588 1.00 0.00 N ATOM 0 H ARG A 52 -7.295 -14.006 1.896 1.00 0.00 H new ATOM 0 HA ARG A 52 -7.588 -11.230 3.004 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -8.920 -12.208 0.458 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -8.631 -10.558 0.971 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -6.781 -10.642 -0.377 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -6.044 -11.576 0.910 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -5.832 -12.830 -1.197 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -6.930 -13.693 -0.138 1.00 0.00 H new ATOM 0 HE ARG A 52 -8.543 -11.900 -1.717 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -6.407 -14.671 -2.063 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -7.239 -15.278 -3.498 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -9.586 -12.690 -3.546 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -9.017 -14.169 -4.327 1.00 0.00 H new ATOM 857 N PRO A 53 -9.943 -11.679 3.768 1.00 0.00 N ATOM 858 CA PRO A 53 -9.469 -10.314 4.181 1.00 0.00 C ATOM 859 C PRO A 53 -8.594 -10.420 5.435 1.00 0.00 C ATOM 860 O PRO A 53 -8.454 -11.479 6.016 1.00 0.00 O ATOM 861 CB PRO A 53 -10.732 -9.516 4.492 1.00 0.00 C ATOM 862 CG PRO A 53 -11.856 -10.519 4.684 1.00 0.00 C ATOM 863 CD PRO A 53 -11.275 -11.907 4.418 1.00 0.00 C ATOM 0 HA PRO A 53 -8.872 -9.840 3.402 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -10.596 -8.913 5.390 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -10.964 -8.828 3.679 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -12.257 -10.458 5.696 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -12.679 -10.309 4.001 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -11.166 -12.469 5.346 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -11.932 -12.487 3.770 1.00 0.00 H new ATOM 871 N LEU A 54 -8.010 -9.331 5.856 1.00 0.00 N ATOM 872 CA LEU A 54 -7.149 -9.369 7.074 1.00 0.00 C ATOM 873 C LEU A 54 -8.040 -9.429 8.322 1.00 0.00 C ATOM 874 O LEU A 54 -9.153 -8.941 8.307 1.00 0.00 O ATOM 875 CB LEU A 54 -6.268 -8.118 7.121 1.00 0.00 C ATOM 876 CG LEU A 54 -5.253 -8.169 5.976 1.00 0.00 C ATOM 877 CD1 LEU A 54 -4.770 -6.752 5.646 1.00 0.00 C ATOM 878 CD2 LEU A 54 -4.057 -9.034 6.390 1.00 0.00 C ATOM 0 H LEU A 54 -8.091 -8.417 5.410 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.510 -10.251 7.044 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -6.884 -7.223 7.037 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -5.750 -8.060 8.078 1.00 0.00 H new ATOM 0 HG LEU A 54 -5.728 -8.601 5.095 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.048 -6.794 4.831 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.620 -6.138 5.347 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.298 -6.314 6.526 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.335 -9.070 5.575 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.586 -8.604 7.274 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -4.399 -10.044 6.616 1.00 0.00 H new ATOM 890 N PRO A 55 -7.527 -10.034 9.367 1.00 0.00 N ATOM 891 CA PRO A 55 -8.219 -10.223 10.691 1.00 0.00 C ATOM 892 C PRO A 55 -8.252 -8.908 11.475 1.00 0.00 C ATOM 893 O PRO A 55 -7.267 -8.204 11.569 1.00 0.00 O ATOM 894 CB PRO A 55 -7.421 -11.272 11.461 1.00 0.00 C ATOM 895 CG PRO A 55 -6.137 -11.525 10.700 1.00 0.00 C ATOM 896 CD PRO A 55 -6.157 -10.652 9.450 1.00 0.00 C ATOM 0 HA PRO A 55 -9.251 -10.542 10.544 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -7.205 -10.923 12.471 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -7.995 -12.193 11.559 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -5.272 -11.286 11.319 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -6.054 -12.578 10.430 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -5.389 -9.881 9.506 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -5.948 -11.247 8.561 1.00 0.00 H new ATOM 904 N GLU A 56 -9.380 -8.585 12.056 1.00 0.00 N ATOM 905 CA GLU A 56 -9.495 -7.327 12.857 1.00 0.00 C ATOM 906 C GLU A 56 -8.926 -6.140 12.071 1.00 0.00 C ATOM 907 O GLU A 56 -8.286 -5.268 12.626 1.00 0.00 O ATOM 908 CB GLU A 56 -8.719 -7.489 14.166 1.00 0.00 C ATOM 909 CG GLU A 56 -9.541 -8.328 15.149 1.00 0.00 C ATOM 910 CD GLU A 56 -8.634 -9.354 15.832 1.00 0.00 C ATOM 911 OE1 GLU A 56 -8.265 -10.316 15.180 1.00 0.00 O ATOM 912 OE2 GLU A 56 -8.325 -9.159 16.996 1.00 0.00 O ATOM 0 H GLU A 56 -10.233 -9.143 12.010 1.00 0.00 H new ATOM 0 HA GLU A 56 -10.547 -7.137 13.069 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -7.760 -7.970 13.975 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -8.505 -6.511 14.597 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -10.003 -7.682 15.896 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -10.349 -8.836 14.622 1.00 0.00 H new ATOM 919 N ARG A 57 -9.152 -6.102 10.786 1.00 0.00 N ATOM 920 CA ARG A 57 -8.619 -4.972 9.971 1.00 0.00 C ATOM 921 C ARG A 57 -9.644 -4.567 8.910 1.00 0.00 C ATOM 922 O ARG A 57 -10.236 -5.402 8.254 1.00 0.00 O ATOM 923 CB ARG A 57 -7.318 -5.405 9.290 1.00 0.00 C ATOM 924 CG ARG A 57 -6.122 -4.973 10.148 1.00 0.00 C ATOM 925 CD ARG A 57 -5.365 -6.207 10.650 1.00 0.00 C ATOM 926 NE ARG A 57 -5.295 -6.174 12.142 1.00 0.00 N ATOM 927 CZ ARG A 57 -5.008 -7.257 12.825 1.00 0.00 C ATOM 928 NH1 ARG A 57 -4.787 -8.395 12.218 1.00 0.00 N ATOM 929 NH2 ARG A 57 -4.946 -7.199 14.128 1.00 0.00 N ATOM 0 H ARG A 57 -9.681 -6.802 10.266 1.00 0.00 H new ATOM 0 HA ARG A 57 -8.424 -4.120 10.622 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.309 -6.486 9.153 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -7.248 -4.958 8.298 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -5.455 -4.339 9.564 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -6.467 -4.378 10.994 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -5.868 -7.115 10.319 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -4.360 -6.227 10.228 1.00 0.00 H new ATOM 0 HE ARG A 57 -5.472 -5.299 12.636 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -4.837 -8.448 11.201 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.565 -9.229 12.762 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -5.120 -6.316 14.608 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -4.723 -8.037 14.666 1.00 0.00 H new ATOM 943 N THR A 58 -9.854 -3.288 8.738 1.00 0.00 N ATOM 944 CA THR A 58 -10.838 -2.821 7.719 1.00 0.00 C ATOM 945 C THR A 58 -10.165 -2.778 6.347 1.00 0.00 C ATOM 946 O THR A 58 -9.159 -2.120 6.158 1.00 0.00 O ATOM 947 CB THR A 58 -11.331 -1.419 8.087 1.00 0.00 C ATOM 948 OG1 THR A 58 -11.705 -1.396 9.458 1.00 0.00 O ATOM 949 CG2 THR A 58 -12.538 -1.056 7.220 1.00 0.00 C ATOM 0 H THR A 58 -9.386 -2.547 9.260 1.00 0.00 H new ATOM 0 HA THR A 58 -11.684 -3.507 7.691 1.00 0.00 H new ATOM 0 HB THR A 58 -10.534 -0.696 7.915 1.00 0.00 H new ATOM 0 HG1 THR A 58 -12.653 -1.631 9.543 1.00 0.00 H new ATOM 0 HG21 THR A 58 -12.888 -0.058 7.483 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.250 -1.074 6.169 1.00 0.00 H new ATOM 0 HG23 THR A 58 -13.338 -1.777 7.389 1.00 0.00 H new ATOM 957 N ASN A 59 -10.706 -3.482 5.391 1.00 0.00 N ATOM 958 CA ASN A 59 -10.091 -3.493 4.036 1.00 0.00 C ATOM 959 C ASN A 59 -11.134 -3.109 2.986 1.00 0.00 C ATOM 960 O ASN A 59 -12.286 -3.488 3.072 1.00 0.00 O ATOM 961 CB ASN A 59 -9.557 -4.895 3.747 1.00 0.00 C ATOM 962 CG ASN A 59 -8.460 -5.223 4.758 1.00 0.00 C ATOM 963 OD1 ASN A 59 -7.289 -5.102 4.461 1.00 0.00 O ATOM 964 ND2 ASN A 59 -8.793 -5.624 5.954 1.00 0.00 N ATOM 0 H ASN A 59 -11.547 -4.050 5.491 1.00 0.00 H new ATOM 0 HA ASN A 59 -9.275 -2.772 3.998 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -10.362 -5.627 3.814 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -9.162 -4.947 2.732 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -8.069 -5.836 6.641 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -9.777 -5.725 6.202 1.00 0.00 H new ATOM 971 N VAL A 60 -10.736 -2.352 1.999 1.00 0.00 N ATOM 972 CA VAL A 60 -11.691 -1.933 0.935 1.00 0.00 C ATOM 973 C VAL A 60 -11.143 -2.380 -0.421 1.00 0.00 C ATOM 974 O VAL A 60 -9.974 -2.212 -0.708 1.00 0.00 O ATOM 975 CB VAL A 60 -11.830 -0.407 0.949 1.00 0.00 C ATOM 976 CG1 VAL A 60 -12.836 0.029 -0.118 1.00 0.00 C ATOM 977 CG2 VAL A 60 -12.317 0.051 2.327 1.00 0.00 C ATOM 0 H VAL A 60 -9.784 -2.004 1.884 1.00 0.00 H new ATOM 0 HA VAL A 60 -12.667 -2.386 1.110 1.00 0.00 H new ATOM 0 HB VAL A 60 -10.861 0.044 0.737 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -12.932 1.115 -0.105 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -12.488 -0.293 -1.099 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -13.806 -0.424 0.089 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -12.415 1.137 2.336 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -13.285 -0.403 2.540 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -11.598 -0.254 3.087 1.00 0.00 H new ATOM 987 N VAL A 61 -11.966 -2.958 -1.253 1.00 0.00 N ATOM 988 CA VAL A 61 -11.473 -3.418 -2.581 1.00 0.00 C ATOM 989 C VAL A 61 -11.904 -2.421 -3.659 1.00 0.00 C ATOM 990 O VAL A 61 -12.915 -1.760 -3.540 1.00 0.00 O ATOM 991 CB VAL A 61 -12.061 -4.795 -2.899 1.00 0.00 C ATOM 992 CG1 VAL A 61 -11.360 -5.378 -4.128 1.00 0.00 C ATOM 993 CG2 VAL A 61 -11.854 -5.733 -1.706 1.00 0.00 C ATOM 0 H VAL A 61 -12.955 -3.131 -1.071 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.385 -3.484 -2.559 1.00 0.00 H new ATOM 0 HB VAL A 61 -13.128 -4.693 -3.099 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -11.779 -6.359 -4.355 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -11.508 -4.715 -4.980 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -10.293 -5.477 -3.926 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -12.274 -6.712 -1.936 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -10.788 -5.834 -1.503 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.353 -5.321 -0.829 1.00 0.00 H new ATOM 1003 N LEU A 62 -11.141 -2.315 -4.710 1.00 0.00 N ATOM 1004 CA LEU A 62 -11.492 -1.370 -5.807 1.00 0.00 C ATOM 1005 C LEU A 62 -11.712 -2.177 -7.085 1.00 0.00 C ATOM 1006 O LEU A 62 -10.823 -2.866 -7.547 1.00 0.00 O ATOM 1007 CB LEU A 62 -10.335 -0.379 -6.005 1.00 0.00 C ATOM 1008 CG LEU A 62 -10.872 1.017 -6.349 1.00 0.00 C ATOM 1009 CD1 LEU A 62 -11.886 1.469 -5.292 1.00 0.00 C ATOM 1010 CD2 LEU A 62 -9.705 2.009 -6.380 1.00 0.00 C ATOM 0 H LEU A 62 -10.283 -2.846 -4.858 1.00 0.00 H new ATOM 0 HA LEU A 62 -12.397 -0.815 -5.561 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -9.732 -0.329 -5.098 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -9.681 -0.730 -6.803 1.00 0.00 H new ATOM 0 HG LEU A 62 -11.362 0.981 -7.322 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -12.260 2.461 -5.547 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -12.717 0.765 -5.261 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -11.403 1.503 -4.316 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -10.079 3.003 -6.624 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -9.222 2.033 -5.403 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -8.983 1.698 -7.135 1.00 0.00 H new ATOM 1022 N THR A 63 -12.886 -2.112 -7.658 1.00 0.00 N ATOM 1023 CA THR A 63 -13.145 -2.902 -8.897 1.00 0.00 C ATOM 1024 C THR A 63 -14.076 -2.129 -9.835 1.00 0.00 C ATOM 1025 O THR A 63 -14.774 -1.222 -9.430 1.00 0.00 O ATOM 1026 CB THR A 63 -13.804 -4.231 -8.517 1.00 0.00 C ATOM 1027 OG1 THR A 63 -14.094 -4.967 -9.695 1.00 0.00 O ATOM 1028 CG2 THR A 63 -15.103 -3.959 -7.755 1.00 0.00 C ATOM 0 H THR A 63 -13.670 -1.551 -7.325 1.00 0.00 H new ATOM 0 HA THR A 63 -12.199 -3.084 -9.407 1.00 0.00 H new ATOM 0 HB THR A 63 -13.126 -4.805 -7.885 1.00 0.00 H new ATOM 0 HG1 THR A 63 -13.344 -4.892 -10.321 1.00 0.00 H new ATOM 0 HG21 THR A 63 -15.571 -4.905 -7.485 1.00 0.00 H new ATOM 0 HG22 THR A 63 -14.882 -3.392 -6.850 1.00 0.00 H new ATOM 0 HG23 THR A 63 -15.782 -3.385 -8.386 1.00 0.00 H new ATOM 1036 N HIS A 64 -14.086 -2.493 -11.090 1.00 0.00 N ATOM 1037 CA HIS A 64 -14.964 -1.794 -12.070 1.00 0.00 C ATOM 1038 C HIS A 64 -16.288 -2.554 -12.222 1.00 0.00 C ATOM 1039 O HIS A 64 -17.108 -2.217 -13.053 1.00 0.00 O ATOM 1040 CB HIS A 64 -14.258 -1.733 -13.427 1.00 0.00 C ATOM 1041 CG HIS A 64 -13.573 -0.403 -13.582 1.00 0.00 C ATOM 1042 ND1 HIS A 64 -14.272 0.760 -13.861 1.00 0.00 N ATOM 1043 CD2 HIS A 64 -12.253 -0.037 -13.502 1.00 0.00 C ATOM 1044 CE1 HIS A 64 -13.378 1.762 -13.938 1.00 0.00 C ATOM 1045 NE2 HIS A 64 -12.131 1.331 -13.728 1.00 0.00 N ATOM 0 H HIS A 64 -13.521 -3.248 -11.479 1.00 0.00 H new ATOM 0 HA HIS A 64 -15.169 -0.785 -11.712 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -13.529 -2.540 -13.505 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -14.980 -1.877 -14.231 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -11.433 -0.709 -13.295 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -13.637 2.790 -14.144 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -11.274 1.885 -13.732 1.00 0.00 H new ATOM 1053 N GLN A 65 -16.507 -3.576 -11.433 1.00 0.00 N ATOM 1054 CA GLN A 65 -17.780 -4.345 -11.546 1.00 0.00 C ATOM 1055 C GLN A 65 -18.876 -3.634 -10.750 1.00 0.00 C ATOM 1056 O GLN A 65 -18.640 -2.620 -10.123 1.00 0.00 O ATOM 1057 CB GLN A 65 -17.578 -5.756 -10.990 1.00 0.00 C ATOM 1058 CG GLN A 65 -16.957 -6.646 -12.069 1.00 0.00 C ATOM 1059 CD GLN A 65 -15.523 -6.192 -12.341 1.00 0.00 C ATOM 1060 OE1 GLN A 65 -14.557 -6.635 -11.584 1.00 0.00 O flip ATOM 1061 NE2 GLN A 65 -15.277 -5.427 -13.253 1.00 0.00 N flip ATOM 0 H GLN A 65 -15.860 -3.909 -10.718 1.00 0.00 H new ATOM 0 HA GLN A 65 -18.074 -4.408 -12.594 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -16.931 -5.724 -10.113 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -18.533 -6.171 -10.666 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -16.965 -7.687 -11.746 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -17.547 -6.592 -12.984 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -16.032 -5.080 -13.845 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -14.316 -5.132 -13.426 1.00 0.00 H new ATOM 1070 N GLU A 66 -20.073 -4.155 -10.774 1.00 0.00 N ATOM 1071 CA GLU A 66 -21.185 -3.504 -10.023 1.00 0.00 C ATOM 1072 C GLU A 66 -21.766 -4.476 -8.989 1.00 0.00 C ATOM 1073 O GLU A 66 -22.408 -4.067 -8.041 1.00 0.00 O ATOM 1074 CB GLU A 66 -22.285 -3.091 -11.008 1.00 0.00 C ATOM 1075 CG GLU A 66 -22.415 -1.566 -11.025 1.00 0.00 C ATOM 1076 CD GLU A 66 -23.315 -1.117 -9.873 1.00 0.00 C ATOM 1077 OE1 GLU A 66 -24.508 -1.360 -9.951 1.00 0.00 O ATOM 1078 OE2 GLU A 66 -22.796 -0.538 -8.933 1.00 0.00 O ATOM 0 H GLU A 66 -20.329 -5.002 -11.281 1.00 0.00 H new ATOM 0 HA GLU A 66 -20.800 -2.625 -9.506 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -22.048 -3.457 -12.007 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -23.234 -3.543 -10.720 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -21.431 -1.106 -10.932 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -22.833 -1.237 -11.976 1.00 0.00 H new ATOM 1085 N ASP A 67 -21.562 -5.756 -9.164 1.00 0.00 N ATOM 1086 CA ASP A 67 -22.123 -6.736 -8.189 1.00 0.00 C ATOM 1087 C ASP A 67 -20.997 -7.413 -7.403 1.00 0.00 C ATOM 1088 O ASP A 67 -21.095 -8.570 -7.043 1.00 0.00 O ATOM 1089 CB ASP A 67 -22.926 -7.799 -8.943 1.00 0.00 C ATOM 1090 CG ASP A 67 -24.184 -8.151 -8.146 1.00 0.00 C ATOM 1091 OD1 ASP A 67 -25.024 -7.281 -7.988 1.00 0.00 O ATOM 1092 OD2 ASP A 67 -24.284 -9.285 -7.706 1.00 0.00 O ATOM 0 H ASP A 67 -21.034 -6.163 -9.936 1.00 0.00 H new ATOM 0 HA ASP A 67 -22.771 -6.206 -7.491 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -23.200 -7.429 -9.931 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -22.317 -8.690 -9.094 1.00 0.00 H new ATOM 1097 N TYR A 68 -19.933 -6.706 -7.120 1.00 0.00 N ATOM 1098 CA TYR A 68 -18.817 -7.323 -6.343 1.00 0.00 C ATOM 1099 C TYR A 68 -19.352 -7.772 -4.980 1.00 0.00 C ATOM 1100 O TYR A 68 -19.831 -6.973 -4.200 1.00 0.00 O ATOM 1101 CB TYR A 68 -17.697 -6.299 -6.143 1.00 0.00 C ATOM 1102 CG TYR A 68 -16.389 -7.019 -5.915 1.00 0.00 C ATOM 1103 CD1 TYR A 68 -15.650 -7.488 -7.007 1.00 0.00 C ATOM 1104 CD2 TYR A 68 -15.916 -7.220 -4.612 1.00 0.00 C ATOM 1105 CE1 TYR A 68 -14.438 -8.156 -6.797 1.00 0.00 C ATOM 1106 CE2 TYR A 68 -14.704 -7.888 -4.403 1.00 0.00 C ATOM 1107 CZ TYR A 68 -13.965 -8.356 -5.495 1.00 0.00 C ATOM 1108 OH TYR A 68 -12.770 -9.015 -5.289 1.00 0.00 O ATOM 0 H TYR A 68 -19.789 -5.733 -7.392 1.00 0.00 H new ATOM 0 HA TYR A 68 -18.420 -8.180 -6.887 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -17.621 -5.653 -7.017 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -17.924 -5.658 -5.291 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -16.015 -7.335 -8.012 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.486 -6.860 -3.769 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -13.868 -8.517 -7.640 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -14.339 -8.042 -3.398 1.00 0.00 H new ATOM 0 HH TYR A 68 -12.587 -9.068 -4.328 1.00 0.00 H new ATOM 1118 N GLN A 69 -19.278 -9.044 -4.689 1.00 0.00 N ATOM 1119 CA GLN A 69 -19.787 -9.538 -3.378 1.00 0.00 C ATOM 1120 C GLN A 69 -18.612 -9.843 -2.447 1.00 0.00 C ATOM 1121 O GLN A 69 -17.864 -10.777 -2.661 1.00 0.00 O ATOM 1122 CB GLN A 69 -20.610 -10.809 -3.597 1.00 0.00 C ATOM 1123 CG GLN A 69 -22.041 -10.428 -3.985 1.00 0.00 C ATOM 1124 CD GLN A 69 -22.820 -10.023 -2.732 1.00 0.00 C ATOM 1125 OE1 GLN A 69 -23.031 -10.829 -1.847 1.00 0.00 O ATOM 1126 NE2 GLN A 69 -23.260 -8.800 -2.618 1.00 0.00 N ATOM 0 H GLN A 69 -18.888 -9.760 -5.302 1.00 0.00 H new ATOM 0 HA GLN A 69 -20.414 -8.771 -2.924 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -20.159 -11.417 -4.381 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -20.616 -11.412 -2.689 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -22.028 -9.605 -4.700 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -22.532 -11.269 -4.475 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -23.083 -8.123 -3.360 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -23.781 -8.521 -1.787 1.00 0.00 H new ATOM 1135 N ALA A 70 -18.451 -9.067 -1.410 1.00 0.00 N ATOM 1136 CA ALA A 70 -17.331 -9.311 -0.458 1.00 0.00 C ATOM 1137 C ALA A 70 -17.840 -9.139 0.974 1.00 0.00 C ATOM 1138 O ALA A 70 -17.679 -8.096 1.579 1.00 0.00 O ATOM 1139 CB ALA A 70 -16.204 -8.312 -0.726 1.00 0.00 C ATOM 0 H ALA A 70 -19.048 -8.273 -1.181 1.00 0.00 H new ATOM 0 HA ALA A 70 -16.952 -10.324 -0.591 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -15.385 -8.491 -0.029 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -15.844 -8.435 -1.748 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -16.578 -7.297 -0.593 1.00 0.00 H new ATOM 1145 N GLN A 71 -18.458 -10.153 1.517 1.00 0.00 N ATOM 1146 CA GLN A 71 -18.984 -10.052 2.908 1.00 0.00 C ATOM 1147 C GLN A 71 -17.818 -9.973 3.892 1.00 0.00 C ATOM 1148 O GLN A 71 -16.968 -10.841 3.935 1.00 0.00 O ATOM 1149 CB GLN A 71 -19.832 -11.284 3.227 1.00 0.00 C ATOM 1150 CG GLN A 71 -21.292 -11.013 2.853 1.00 0.00 C ATOM 1151 CD GLN A 71 -22.088 -10.671 4.115 1.00 0.00 C ATOM 1152 OE1 GLN A 71 -22.965 -11.412 4.513 1.00 0.00 O ATOM 1153 NE2 GLN A 71 -21.816 -9.573 4.765 1.00 0.00 N ATOM 0 H GLN A 71 -18.621 -11.048 1.056 1.00 0.00 H new ATOM 0 HA GLN A 71 -19.597 -9.155 2.996 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -19.459 -12.147 2.676 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -19.756 -11.526 4.287 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -21.349 -10.190 2.140 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -21.722 -11.888 2.365 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -21.080 -8.951 4.430 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -22.340 -9.336 5.608 1.00 0.00 H new ATOM 1162 N GLY A 72 -17.776 -8.941 4.690 1.00 0.00 N ATOM 1163 CA GLY A 72 -16.671 -8.809 5.679 1.00 0.00 C ATOM 1164 C GLY A 72 -15.734 -7.674 5.266 1.00 0.00 C ATOM 1165 O GLY A 72 -15.214 -6.959 6.101 1.00 0.00 O ATOM 0 H GLY A 72 -18.460 -8.184 4.699 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -17.080 -8.612 6.670 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -16.116 -9.745 5.744 1.00 0.00 H new ATOM 1169 N ALA A 73 -15.499 -7.504 3.990 1.00 0.00 N ATOM 1170 CA ALA A 73 -14.579 -6.420 3.546 1.00 0.00 C ATOM 1171 C ALA A 73 -15.357 -5.338 2.790 1.00 0.00 C ATOM 1172 O ALA A 73 -16.259 -5.617 2.025 1.00 0.00 O ATOM 1173 CB ALA A 73 -13.506 -7.012 2.629 1.00 0.00 C ATOM 0 H ALA A 73 -15.903 -8.067 3.242 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.111 -5.970 4.422 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -12.831 -6.222 2.302 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -12.941 -7.770 3.172 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.981 -7.466 1.759 1.00 0.00 H new ATOM 1179 N VAL A 74 -14.985 -4.104 2.994 1.00 0.00 N ATOM 1180 CA VAL A 74 -15.670 -2.978 2.292 1.00 0.00 C ATOM 1181 C VAL A 74 -15.517 -3.170 0.780 1.00 0.00 C ATOM 1182 O VAL A 74 -14.676 -3.924 0.332 1.00 0.00 O ATOM 1183 CB VAL A 74 -15.025 -1.655 2.706 1.00 0.00 C ATOM 1184 CG1 VAL A 74 -15.836 -0.486 2.144 1.00 0.00 C ATOM 1185 CG2 VAL A 74 -14.988 -1.563 4.234 1.00 0.00 C ATOM 0 H VAL A 74 -14.231 -3.824 3.621 1.00 0.00 H new ATOM 0 HA VAL A 74 -16.727 -2.963 2.557 1.00 0.00 H new ATOM 0 HB VAL A 74 -14.010 -1.610 2.312 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -15.373 0.455 2.442 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -15.861 -0.550 1.056 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -16.853 -0.528 2.533 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -14.528 -0.620 4.531 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -16.004 -1.611 4.626 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -14.405 -2.393 4.634 1.00 0.00 H new ATOM 1195 N VAL A 75 -16.313 -2.497 -0.014 1.00 0.00 N ATOM 1196 CA VAL A 75 -16.197 -2.652 -1.494 1.00 0.00 C ATOM 1197 C VAL A 75 -16.634 -1.347 -2.170 1.00 0.00 C ATOM 1198 O VAL A 75 -17.675 -0.800 -1.860 1.00 0.00 O ATOM 1199 CB VAL A 75 -17.105 -3.796 -1.961 1.00 0.00 C ATOM 1200 CG1 VAL A 75 -17.020 -3.937 -3.484 1.00 0.00 C ATOM 1201 CG2 VAL A 75 -16.656 -5.103 -1.305 1.00 0.00 C ATOM 0 H VAL A 75 -17.036 -1.849 0.299 1.00 0.00 H new ATOM 0 HA VAL A 75 -15.164 -2.878 -1.760 1.00 0.00 H new ATOM 0 HB VAL A 75 -18.134 -3.577 -1.676 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -17.667 -4.751 -3.811 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -17.341 -3.007 -3.954 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -15.991 -4.153 -3.773 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -17.301 -5.917 -1.636 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -15.626 -5.318 -1.589 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -16.721 -5.007 -0.221 1.00 0.00 H new ATOM 1211 N VAL A 76 -15.852 -0.843 -3.090 1.00 0.00 N ATOM 1212 CA VAL A 76 -16.232 0.426 -3.777 1.00 0.00 C ATOM 1213 C VAL A 76 -15.773 0.384 -5.239 1.00 0.00 C ATOM 1214 O VAL A 76 -14.954 -0.432 -5.624 1.00 0.00 O ATOM 1215 CB VAL A 76 -15.566 1.609 -3.070 1.00 0.00 C ATOM 1216 CG1 VAL A 76 -16.153 1.765 -1.665 1.00 0.00 C ATOM 1217 CG2 VAL A 76 -14.057 1.364 -2.970 1.00 0.00 C ATOM 0 H VAL A 76 -14.970 -1.254 -3.394 1.00 0.00 H new ATOM 0 HA VAL A 76 -17.315 0.541 -3.743 1.00 0.00 H new ATOM 0 HB VAL A 76 -15.748 2.519 -3.641 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -15.677 2.608 -1.163 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -17.226 1.944 -1.737 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -15.974 0.855 -1.093 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -13.584 2.207 -2.466 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -13.873 0.452 -2.402 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -13.638 1.258 -3.971 1.00 0.00 H new ATOM 1227 N HIS A 77 -16.302 1.256 -6.057 1.00 0.00 N ATOM 1228 CA HIS A 77 -15.907 1.274 -7.496 1.00 0.00 C ATOM 1229 C HIS A 77 -15.763 2.723 -7.959 1.00 0.00 C ATOM 1230 O HIS A 77 -15.964 3.036 -9.116 1.00 0.00 O ATOM 1231 CB HIS A 77 -16.985 0.589 -8.345 1.00 0.00 C ATOM 1232 CG HIS A 77 -17.564 -0.582 -7.600 1.00 0.00 C ATOM 1233 ND1 HIS A 77 -17.225 -1.889 -7.905 1.00 0.00 N ATOM 1234 CD2 HIS A 77 -18.458 -0.658 -6.562 1.00 0.00 C ATOM 1235 CE1 HIS A 77 -17.904 -2.690 -7.066 1.00 0.00 C ATOM 1236 NE2 HIS A 77 -18.672 -1.991 -6.225 1.00 0.00 N ATOM 0 H HIS A 77 -16.992 1.958 -5.790 1.00 0.00 H new ATOM 0 HA HIS A 77 -14.962 0.744 -7.613 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -17.774 1.301 -8.588 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -16.556 0.253 -9.289 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -18.925 0.188 -6.080 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -17.837 -3.768 -7.071 1.00 0.00 H new ATOM 0 HE2 HIS A 77 -19.283 -2.356 -5.494 1.00 0.00 H new ATOM 1244 N ASP A 78 -15.415 3.612 -7.067 1.00 0.00 N ATOM 1245 CA ASP A 78 -15.258 5.039 -7.462 1.00 0.00 C ATOM 1246 C ASP A 78 -14.525 5.802 -6.357 1.00 0.00 C ATOM 1247 O ASP A 78 -15.046 5.996 -5.276 1.00 0.00 O ATOM 1248 CB ASP A 78 -16.639 5.662 -7.687 1.00 0.00 C ATOM 1249 CG ASP A 78 -16.882 5.843 -9.187 1.00 0.00 C ATOM 1250 OD1 ASP A 78 -16.238 6.699 -9.772 1.00 0.00 O ATOM 1251 OD2 ASP A 78 -17.706 5.123 -9.725 1.00 0.00 O ATOM 0 H ASP A 78 -15.233 3.411 -6.084 1.00 0.00 H new ATOM 0 HA ASP A 78 -14.679 5.097 -8.384 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -17.411 5.024 -7.258 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -16.702 6.624 -7.179 1.00 0.00 H new ATOM 1256 N VAL A 79 -13.311 6.218 -6.618 1.00 0.00 N ATOM 1257 CA VAL A 79 -12.516 6.964 -5.592 1.00 0.00 C ATOM 1258 C VAL A 79 -13.411 7.953 -4.831 1.00 0.00 C ATOM 1259 O VAL A 79 -13.210 8.208 -3.660 1.00 0.00 O ATOM 1260 CB VAL A 79 -11.395 7.734 -6.296 1.00 0.00 C ATOM 1261 CG1 VAL A 79 -10.634 8.585 -5.278 1.00 0.00 C ATOM 1262 CG2 VAL A 79 -10.431 6.743 -6.952 1.00 0.00 C ATOM 0 H VAL A 79 -12.831 6.072 -7.506 1.00 0.00 H new ATOM 0 HA VAL A 79 -12.097 6.253 -4.880 1.00 0.00 H new ATOM 0 HB VAL A 79 -11.827 8.383 -7.057 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -9.837 9.131 -5.783 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -11.319 9.292 -4.811 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -10.203 7.939 -4.514 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -9.633 7.290 -7.454 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -10.002 6.093 -6.189 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -10.971 6.139 -7.681 1.00 0.00 H new ATOM 1272 N ALA A 80 -14.394 8.509 -5.487 1.00 0.00 N ATOM 1273 CA ALA A 80 -15.298 9.478 -4.800 1.00 0.00 C ATOM 1274 C ALA A 80 -15.937 8.809 -3.578 1.00 0.00 C ATOM 1275 O ALA A 80 -16.028 9.393 -2.515 1.00 0.00 O ATOM 1276 CB ALA A 80 -16.393 9.927 -5.771 1.00 0.00 C ATOM 0 H ALA A 80 -14.611 8.335 -6.468 1.00 0.00 H new ATOM 0 HA ALA A 80 -14.722 10.344 -4.475 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -17.054 10.635 -5.271 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -15.937 10.406 -6.637 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -16.968 9.060 -6.097 1.00 0.00 H new ATOM 1282 N ALA A 81 -16.379 7.589 -3.724 1.00 0.00 N ATOM 1283 CA ALA A 81 -17.014 6.878 -2.579 1.00 0.00 C ATOM 1284 C ALA A 81 -15.975 6.610 -1.488 1.00 0.00 C ATOM 1285 O ALA A 81 -16.219 6.843 -0.320 1.00 0.00 O ATOM 1286 CB ALA A 81 -17.593 5.547 -3.065 1.00 0.00 C ATOM 0 H ALA A 81 -16.327 7.053 -4.590 1.00 0.00 H new ATOM 0 HA ALA A 81 -17.810 7.500 -2.170 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -18.058 5.025 -2.228 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -18.340 5.735 -3.836 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -16.794 4.931 -3.477 1.00 0.00 H new ATOM 1292 N VAL A 82 -14.823 6.107 -1.851 1.00 0.00 N ATOM 1293 CA VAL A 82 -13.777 5.810 -0.824 1.00 0.00 C ATOM 1294 C VAL A 82 -13.501 7.057 0.021 1.00 0.00 C ATOM 1295 O VAL A 82 -13.363 6.981 1.226 1.00 0.00 O ATOM 1296 CB VAL A 82 -12.482 5.376 -1.516 1.00 0.00 C ATOM 1297 CG1 VAL A 82 -11.457 4.948 -0.461 1.00 0.00 C ATOM 1298 CG2 VAL A 82 -12.767 4.198 -2.451 1.00 0.00 C ATOM 0 H VAL A 82 -14.561 5.889 -2.812 1.00 0.00 H new ATOM 0 HA VAL A 82 -14.136 5.008 -0.179 1.00 0.00 H new ATOM 0 HB VAL A 82 -12.086 6.211 -2.094 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -10.535 4.639 -0.954 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.249 5.785 0.205 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -11.856 4.115 0.117 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -11.843 3.891 -2.942 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -13.165 3.364 -1.874 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -13.495 4.499 -3.204 1.00 0.00 H new ATOM 1308 N PHE A 83 -13.407 8.201 -0.601 1.00 0.00 N ATOM 1309 CA PHE A 83 -13.127 9.449 0.166 1.00 0.00 C ATOM 1310 C PHE A 83 -14.236 9.690 1.194 1.00 0.00 C ATOM 1311 O PHE A 83 -13.982 10.123 2.301 1.00 0.00 O ATOM 1312 CB PHE A 83 -13.060 10.633 -0.800 1.00 0.00 C ATOM 1313 CG PHE A 83 -11.655 10.763 -1.339 1.00 0.00 C ATOM 1314 CD1 PHE A 83 -10.586 10.978 -0.462 1.00 0.00 C ATOM 1315 CD2 PHE A 83 -11.422 10.668 -2.716 1.00 0.00 C ATOM 1316 CE1 PHE A 83 -9.284 11.099 -0.962 1.00 0.00 C ATOM 1317 CE2 PHE A 83 -10.121 10.789 -3.215 1.00 0.00 C ATOM 1318 CZ PHE A 83 -9.052 11.004 -2.339 1.00 0.00 C ATOM 0 H PHE A 83 -13.512 8.326 -1.608 1.00 0.00 H new ATOM 0 HA PHE A 83 -12.175 9.345 0.686 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -13.764 10.488 -1.620 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -13.351 11.550 -0.289 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -10.765 11.051 0.601 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -12.247 10.501 -3.393 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -8.459 11.266 -0.285 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -9.942 10.716 -4.278 1.00 0.00 H new ATOM 0 HZ PHE A 83 -8.048 11.097 -2.725 1.00 0.00 H new ATOM 1328 N ALA A 84 -15.463 9.414 0.838 1.00 0.00 N ATOM 1329 CA ALA A 84 -16.588 9.631 1.797 1.00 0.00 C ATOM 1330 C ALA A 84 -16.338 8.835 3.083 1.00 0.00 C ATOM 1331 O ALA A 84 -16.279 9.390 4.163 1.00 0.00 O ATOM 1332 CB ALA A 84 -17.900 9.168 1.158 1.00 0.00 C ATOM 0 H ALA A 84 -15.735 9.048 -0.074 1.00 0.00 H new ATOM 0 HA ALA A 84 -16.653 10.692 2.039 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -18.721 9.326 1.857 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -18.083 9.740 0.248 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -17.831 8.108 0.913 1.00 0.00 H new ATOM 1338 N TYR A 85 -16.216 7.536 2.975 1.00 0.00 N ATOM 1339 CA TYR A 85 -15.992 6.679 4.183 1.00 0.00 C ATOM 1340 C TYR A 85 -14.943 7.302 5.113 1.00 0.00 C ATOM 1341 O TYR A 85 -15.203 7.549 6.274 1.00 0.00 O ATOM 1342 CB TYR A 85 -15.507 5.300 3.733 1.00 0.00 C ATOM 1343 CG TYR A 85 -15.802 4.283 4.809 1.00 0.00 C ATOM 1344 CD1 TYR A 85 -17.122 3.888 5.056 1.00 0.00 C ATOM 1345 CD2 TYR A 85 -14.754 3.733 5.558 1.00 0.00 C ATOM 1346 CE1 TYR A 85 -17.394 2.943 6.053 1.00 0.00 C ATOM 1347 CE2 TYR A 85 -15.027 2.789 6.554 1.00 0.00 C ATOM 1348 CZ TYR A 85 -16.347 2.394 6.802 1.00 0.00 C ATOM 1349 OH TYR A 85 -16.615 1.462 7.784 1.00 0.00 O ATOM 0 H TYR A 85 -16.262 7.026 2.093 1.00 0.00 H new ATOM 0 HA TYR A 85 -16.932 6.594 4.729 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -16.001 5.015 2.804 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -14.437 5.329 3.529 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -17.930 4.312 4.478 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -13.736 4.037 5.367 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -18.412 2.638 6.244 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -14.219 2.365 7.132 1.00 0.00 H new ATOM 0 HH TYR A 85 -17.098 1.892 8.520 1.00 0.00 H new ATOM 1359 N ALA A 86 -13.762 7.556 4.615 1.00 0.00 N ATOM 1360 CA ALA A 86 -12.697 8.158 5.473 1.00 0.00 C ATOM 1361 C ALA A 86 -13.214 9.443 6.124 1.00 0.00 C ATOM 1362 O ALA A 86 -13.052 9.659 7.310 1.00 0.00 O ATOM 1363 CB ALA A 86 -11.477 8.483 4.611 1.00 0.00 C ATOM 0 H ALA A 86 -13.488 7.373 3.650 1.00 0.00 H new ATOM 0 HA ALA A 86 -12.421 7.448 6.252 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -10.698 8.922 5.234 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -11.102 7.568 4.152 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -11.760 9.190 3.832 1.00 0.00 H new ATOM 1369 N LYS A 87 -13.839 10.293 5.358 1.00 0.00 N ATOM 1370 CA LYS A 87 -14.372 11.565 5.924 1.00 0.00 C ATOM 1371 C LYS A 87 -15.453 11.254 6.964 1.00 0.00 C ATOM 1372 O LYS A 87 -15.721 12.043 7.849 1.00 0.00 O ATOM 1373 CB LYS A 87 -14.983 12.402 4.795 1.00 0.00 C ATOM 1374 CG LYS A 87 -14.069 13.590 4.475 1.00 0.00 C ATOM 1375 CD LYS A 87 -14.729 14.891 4.944 1.00 0.00 C ATOM 1376 CE LYS A 87 -14.577 15.962 3.862 1.00 0.00 C ATOM 1377 NZ LYS A 87 -13.366 16.783 4.142 1.00 0.00 N ATOM 0 H LYS A 87 -14.005 10.161 4.360 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.562 12.118 6.399 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -15.119 11.786 3.906 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -15.970 12.760 5.088 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -13.105 13.462 4.967 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -13.876 13.635 3.403 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -15.785 14.720 5.155 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -14.269 15.230 5.872 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -14.493 15.494 2.881 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -15.462 16.597 3.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -13.263 17.511 3.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -13.464 17.241 5.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -12.525 16.171 4.144 1.00 0.00 H new ATOM 1391 N GLN A 88 -16.095 10.123 6.846 1.00 0.00 N ATOM 1392 CA GLN A 88 -17.181 9.776 7.807 1.00 0.00 C ATOM 1393 C GLN A 88 -16.620 9.053 9.038 1.00 0.00 C ATOM 1394 O GLN A 88 -17.194 9.122 10.107 1.00 0.00 O ATOM 1395 CB GLN A 88 -18.205 8.874 7.109 1.00 0.00 C ATOM 1396 CG GLN A 88 -19.533 9.623 6.961 1.00 0.00 C ATOM 1397 CD GLN A 88 -20.149 9.311 5.596 1.00 0.00 C ATOM 1398 OE1 GLN A 88 -20.977 8.429 5.478 1.00 0.00 O ATOM 1399 NE2 GLN A 88 -19.779 10.002 4.553 1.00 0.00 N ATOM 0 H GLN A 88 -15.914 9.424 6.125 1.00 0.00 H new ATOM 0 HA GLN A 88 -17.656 10.699 8.139 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -17.833 8.575 6.129 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -18.353 7.961 7.686 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -20.218 9.329 7.756 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -19.370 10.696 7.061 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -19.084 10.742 4.652 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -20.185 9.802 3.639 1.00 0.00 H new ATOM 1408 N HIS A 89 -15.525 8.346 8.912 1.00 0.00 N ATOM 1409 CA HIS A 89 -14.976 7.617 10.095 1.00 0.00 C ATOM 1410 C HIS A 89 -14.000 8.512 10.874 1.00 0.00 C ATOM 1411 O HIS A 89 -12.960 8.877 10.361 1.00 0.00 O ATOM 1412 CB HIS A 89 -14.232 6.370 9.611 1.00 0.00 C ATOM 1413 CG HIS A 89 -15.156 5.183 9.649 1.00 0.00 C ATOM 1414 ND1 HIS A 89 -14.882 4.059 10.411 1.00 0.00 N ATOM 1415 CD2 HIS A 89 -16.352 4.931 9.025 1.00 0.00 C ATOM 1416 CE1 HIS A 89 -15.893 3.189 10.228 1.00 0.00 C ATOM 1417 NE2 HIS A 89 -16.816 3.672 9.391 1.00 0.00 N ATOM 0 H HIS A 89 -14.992 8.243 8.049 1.00 0.00 H new ATOM 0 HA HIS A 89 -15.800 7.338 10.752 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -13.864 6.525 8.597 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -13.362 6.186 10.241 1.00 0.00 H new ATOM 0 HD1 HIS A 89 -14.064 3.917 11.003 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -16.857 5.608 8.352 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -15.951 2.219 10.700 1.00 0.00 H new ATOM 1425 N PRO A 90 -14.353 8.825 12.102 1.00 0.00 N ATOM 1426 CA PRO A 90 -13.551 9.666 13.057 1.00 0.00 C ATOM 1427 C PRO A 90 -12.513 8.794 13.781 1.00 0.00 C ATOM 1428 O PRO A 90 -11.771 9.264 14.621 1.00 0.00 O ATOM 1429 CB PRO A 90 -14.548 10.234 14.061 1.00 0.00 C ATOM 1430 CG PRO A 90 -15.818 9.415 13.945 1.00 0.00 C ATOM 1431 CD PRO A 90 -15.620 8.419 12.804 1.00 0.00 C ATOM 0 HA PRO A 90 -13.013 10.459 12.537 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -14.147 10.181 15.073 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -14.748 11.285 13.852 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -16.023 8.892 14.879 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -16.674 10.060 13.746 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -15.543 7.401 13.186 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -16.468 8.440 12.119 1.00 0.00 H new ATOM 1439 N ASP A 91 -12.456 7.529 13.454 1.00 0.00 N ATOM 1440 CA ASP A 91 -11.469 6.620 14.109 1.00 0.00 C ATOM 1441 C ASP A 91 -10.820 5.726 13.047 1.00 0.00 C ATOM 1442 O ASP A 91 -10.131 4.774 13.358 1.00 0.00 O ATOM 1443 CB ASP A 91 -12.187 5.748 15.143 1.00 0.00 C ATOM 1444 CG ASP A 91 -11.868 6.254 16.551 1.00 0.00 C ATOM 1445 OD1 ASP A 91 -12.345 7.321 16.899 1.00 0.00 O ATOM 1446 OD2 ASP A 91 -11.150 5.565 17.258 1.00 0.00 O ATOM 0 H ASP A 91 -13.054 7.084 12.758 1.00 0.00 H new ATOM 0 HA ASP A 91 -10.700 7.212 14.606 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -13.263 5.774 14.971 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -11.873 4.709 15.039 1.00 0.00 H new ATOM 1451 N GLN A 92 -11.033 6.033 11.796 1.00 0.00 N ATOM 1452 CA GLN A 92 -10.435 5.223 10.701 1.00 0.00 C ATOM 1453 C GLN A 92 -10.158 6.153 9.522 1.00 0.00 C ATOM 1454 O GLN A 92 -11.073 6.670 8.911 1.00 0.00 O ATOM 1455 CB GLN A 92 -11.426 4.136 10.280 1.00 0.00 C ATOM 1456 CG GLN A 92 -10.686 3.033 9.526 1.00 0.00 C ATOM 1457 CD GLN A 92 -11.359 1.688 9.799 1.00 0.00 C ATOM 1458 OE1 GLN A 92 -12.335 1.294 9.027 1.00 0.00 O flip ATOM 1459 NE2 GLN A 92 -10.996 0.989 10.724 1.00 0.00 N flip ATOM 0 H GLN A 92 -11.603 6.820 11.485 1.00 0.00 H new ATOM 0 HA GLN A 92 -9.510 4.751 11.032 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -11.921 3.721 11.158 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -12.204 4.564 9.648 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -10.690 3.243 8.456 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -9.643 3.000 9.840 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -10.233 1.297 11.327 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -11.454 0.094 10.897 1.00 0.00 H new ATOM 1468 N GLU A 93 -8.915 6.391 9.196 1.00 0.00 N ATOM 1469 CA GLU A 93 -8.613 7.310 8.064 1.00 0.00 C ATOM 1470 C GLU A 93 -8.579 6.536 6.745 1.00 0.00 C ATOM 1471 O GLU A 93 -8.961 5.382 6.671 1.00 0.00 O ATOM 1472 CB GLU A 93 -7.251 7.969 8.305 1.00 0.00 C ATOM 1473 CG GLU A 93 -7.381 9.024 9.407 1.00 0.00 C ATOM 1474 CD GLU A 93 -6.153 8.966 10.318 1.00 0.00 C ATOM 1475 OE1 GLU A 93 -5.832 7.882 10.779 1.00 0.00 O ATOM 1476 OE2 GLU A 93 -5.554 10.006 10.538 1.00 0.00 O ATOM 0 H GLU A 93 -8.101 5.991 9.663 1.00 0.00 H new ATOM 0 HA GLU A 93 -9.391 8.071 8.003 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -6.517 7.216 8.592 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -6.891 8.431 7.386 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -7.473 10.016 8.966 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -8.286 8.848 9.988 1.00 0.00 H new ATOM 1483 N LEU A 94 -8.100 7.171 5.709 1.00 0.00 N ATOM 1484 CA LEU A 94 -8.007 6.501 4.384 1.00 0.00 C ATOM 1485 C LEU A 94 -6.560 6.056 4.158 1.00 0.00 C ATOM 1486 O LEU A 94 -5.657 6.867 4.110 1.00 0.00 O ATOM 1487 CB LEU A 94 -8.424 7.482 3.285 1.00 0.00 C ATOM 1488 CG LEU A 94 -8.871 6.709 2.043 1.00 0.00 C ATOM 1489 CD1 LEU A 94 -10.244 6.079 2.293 1.00 0.00 C ATOM 1490 CD2 LEU A 94 -8.962 7.668 0.854 1.00 0.00 C ATOM 0 H LEU A 94 -7.766 8.135 5.727 1.00 0.00 H new ATOM 0 HA LEU A 94 -8.668 5.635 4.357 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -9.235 8.117 3.641 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -7.591 8.139 3.036 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.147 5.923 1.827 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -10.559 5.529 1.406 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -10.182 5.396 3.140 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -10.970 6.863 2.511 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.280 7.119 -0.032 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.685 8.453 1.074 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -7.985 8.116 0.672 1.00 0.00 H new ATOM 1502 N VAL A 95 -6.330 4.778 4.017 1.00 0.00 N ATOM 1503 CA VAL A 95 -4.938 4.297 3.787 1.00 0.00 C ATOM 1504 C VAL A 95 -4.892 3.529 2.468 1.00 0.00 C ATOM 1505 O VAL A 95 -5.698 2.657 2.213 1.00 0.00 O ATOM 1506 CB VAL A 95 -4.492 3.390 4.940 1.00 0.00 C ATOM 1507 CG1 VAL A 95 -3.064 2.901 4.686 1.00 0.00 C ATOM 1508 CG2 VAL A 95 -4.526 4.180 6.249 1.00 0.00 C ATOM 0 H VAL A 95 -7.043 4.049 4.051 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.261 5.150 3.740 1.00 0.00 H new ATOM 0 HB VAL A 95 -5.164 2.535 5.007 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.749 2.257 5.507 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -3.032 2.341 3.752 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -2.393 3.757 4.619 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -4.209 3.537 7.070 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -3.853 5.034 6.176 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -5.540 4.533 6.435 1.00 0.00 H new ATOM 1518 N ILE A 96 -3.972 3.872 1.614 1.00 0.00 N ATOM 1519 CA ILE A 96 -3.880 3.190 0.296 1.00 0.00 C ATOM 1520 C ILE A 96 -2.949 1.983 0.396 1.00 0.00 C ATOM 1521 O ILE A 96 -1.995 1.976 1.152 1.00 0.00 O ATOM 1522 CB ILE A 96 -3.324 4.172 -0.737 1.00 0.00 C ATOM 1523 CG1 ILE A 96 -4.101 5.492 -0.659 1.00 0.00 C ATOM 1524 CG2 ILE A 96 -3.456 3.576 -2.141 1.00 0.00 C ATOM 1525 CD1 ILE A 96 -5.575 5.250 -0.992 1.00 0.00 C ATOM 0 H ILE A 96 -3.275 4.600 1.773 1.00 0.00 H new ATOM 0 HA ILE A 96 -4.872 2.852 -0.005 1.00 0.00 H new ATOM 0 HB ILE A 96 -2.271 4.360 -0.527 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -4.010 5.919 0.340 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.676 6.216 -1.355 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.059 4.279 -2.873 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -2.897 2.642 -2.194 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.507 3.382 -2.357 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.120 6.192 -0.935 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.658 4.843 -2.000 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.998 4.542 -0.279 1.00 0.00 H new ATOM 1537 N ALA A 97 -3.200 0.978 -0.396 1.00 0.00 N ATOM 1538 CA ALA A 97 -2.323 -0.226 -0.396 1.00 0.00 C ATOM 1539 C ALA A 97 -1.935 -0.558 -1.842 1.00 0.00 C ATOM 1540 O ALA A 97 -1.209 -1.497 -2.102 1.00 0.00 O ATOM 1541 CB ALA A 97 -3.071 -1.407 0.222 1.00 0.00 C ATOM 0 H ALA A 97 -3.982 0.939 -1.049 1.00 0.00 H new ATOM 0 HA ALA A 97 -1.425 -0.029 0.190 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -2.427 -2.286 0.221 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -3.351 -1.164 1.247 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -3.969 -1.614 -0.360 1.00 0.00 H new ATOM 1547 N GLY A 98 -2.389 0.236 -2.780 1.00 0.00 N ATOM 1548 CA GLY A 98 -2.027 0.003 -4.205 1.00 0.00 C ATOM 1549 C GLY A 98 -3.110 -0.823 -4.916 1.00 0.00 C ATOM 1550 O GLY A 98 -4.258 -0.825 -4.518 1.00 0.00 O ATOM 0 H GLY A 98 -2.997 1.038 -2.615 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -1.900 0.959 -4.713 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.071 -0.517 -4.261 1.00 0.00 H new ATOM 1554 N GLY A 99 -2.759 -1.513 -5.980 1.00 0.00 N ATOM 1555 CA GLY A 99 -1.338 -1.504 -6.461 1.00 0.00 C ATOM 1556 C GLY A 99 -0.952 -0.143 -7.059 1.00 0.00 C ATOM 1557 O GLY A 99 -1.374 0.901 -6.604 1.00 0.00 O ATOM 0 H GLY A 99 -3.397 -2.082 -6.536 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -0.671 -1.740 -5.632 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -1.202 -2.283 -7.211 1.00 0.00 H new ATOM 1561 N ALA A 100 -0.156 -0.158 -8.095 1.00 0.00 N ATOM 1562 CA ALA A 100 0.275 1.120 -8.733 1.00 0.00 C ATOM 1563 C ALA A 100 -0.943 1.863 -9.273 1.00 0.00 C ATOM 1564 O ALA A 100 -1.008 3.077 -9.234 1.00 0.00 O ATOM 1565 CB ALA A 100 1.236 0.815 -9.885 1.00 0.00 C ATOM 0 H ALA A 100 0.215 -1.003 -8.528 1.00 0.00 H new ATOM 0 HA ALA A 100 0.777 1.741 -7.991 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.552 1.748 -10.352 1.00 0.00 H new ATOM 0 HB2 ALA A 100 2.109 0.288 -9.501 1.00 0.00 H new ATOM 0 HB3 ALA A 100 0.732 0.192 -10.624 1.00 0.00 H new ATOM 1571 N GLN A 101 -1.899 1.149 -9.792 1.00 0.00 N ATOM 1572 CA GLN A 101 -3.102 1.803 -10.349 1.00 0.00 C ATOM 1573 C GLN A 101 -3.800 2.628 -9.264 1.00 0.00 C ATOM 1574 O GLN A 101 -4.271 3.722 -9.520 1.00 0.00 O ATOM 1575 CB GLN A 101 -4.049 0.723 -10.866 1.00 0.00 C ATOM 1576 CG GLN A 101 -3.285 -0.242 -11.780 1.00 0.00 C ATOM 1577 CD GLN A 101 -4.032 -0.397 -13.107 1.00 0.00 C ATOM 1578 OE1 GLN A 101 -4.130 0.539 -13.876 1.00 0.00 O ATOM 1579 NE2 GLN A 101 -4.566 -1.549 -13.410 1.00 0.00 N ATOM 0 H GLN A 101 -1.894 0.131 -9.853 1.00 0.00 H new ATOM 0 HA GLN A 101 -2.816 2.469 -11.163 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -4.485 0.178 -10.029 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -4.874 1.181 -11.413 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -2.278 0.134 -11.960 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -3.181 -1.212 -11.295 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -4.484 -2.335 -12.765 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -5.065 -1.663 -14.292 1.00 0.00 H new ATOM 1588 N ILE A 102 -3.900 2.118 -8.061 1.00 0.00 N ATOM 1589 CA ILE A 102 -4.601 2.884 -6.992 1.00 0.00 C ATOM 1590 C ILE A 102 -3.703 4.003 -6.463 1.00 0.00 C ATOM 1591 O ILE A 102 -4.180 4.997 -5.957 1.00 0.00 O ATOM 1592 CB ILE A 102 -4.967 1.935 -5.845 1.00 0.00 C ATOM 1593 CG1 ILE A 102 -5.657 0.683 -6.405 1.00 0.00 C ATOM 1594 CG2 ILE A 102 -5.916 2.643 -4.876 1.00 0.00 C ATOM 1595 CD1 ILE A 102 -6.860 1.090 -7.261 1.00 0.00 C ATOM 0 H ILE A 102 -3.529 1.211 -7.777 1.00 0.00 H new ATOM 0 HA ILE A 102 -5.506 3.327 -7.408 1.00 0.00 H new ATOM 0 HB ILE A 102 -4.057 1.643 -5.320 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -4.952 0.106 -7.004 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.982 0.040 -5.587 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -6.175 1.967 -4.061 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -5.428 3.529 -4.471 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -6.822 2.938 -5.405 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -7.345 0.197 -7.655 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -7.569 1.648 -6.650 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -6.523 1.715 -8.088 1.00 0.00 H new ATOM 1607 N PHE A 103 -2.410 3.868 -6.576 1.00 0.00 N ATOM 1608 CA PHE A 103 -1.516 4.950 -6.076 1.00 0.00 C ATOM 1609 C PHE A 103 -1.607 6.154 -7.017 1.00 0.00 C ATOM 1610 O PHE A 103 -1.315 7.273 -6.640 1.00 0.00 O ATOM 1611 CB PHE A 103 -0.069 4.449 -6.034 1.00 0.00 C ATOM 1612 CG PHE A 103 0.131 3.538 -4.844 1.00 0.00 C ATOM 1613 CD1 PHE A 103 -0.352 3.908 -3.582 1.00 0.00 C ATOM 1614 CD2 PHE A 103 0.804 2.320 -5.005 1.00 0.00 C ATOM 1615 CE1 PHE A 103 -0.163 3.061 -2.483 1.00 0.00 C ATOM 1616 CE2 PHE A 103 0.993 1.474 -3.906 1.00 0.00 C ATOM 1617 CZ PHE A 103 0.509 1.845 -2.645 1.00 0.00 C ATOM 0 H PHE A 103 -1.938 3.064 -6.989 1.00 0.00 H new ATOM 0 HA PHE A 103 -1.826 5.240 -5.072 1.00 0.00 H new ATOM 0 HB2 PHE A 103 0.166 3.915 -6.954 1.00 0.00 H new ATOM 0 HB3 PHE A 103 0.615 5.295 -5.973 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.870 4.847 -3.457 1.00 0.00 H new ATOM 0 HD2 PHE A 103 1.177 2.034 -5.977 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -0.536 3.347 -1.511 1.00 0.00 H new ATOM 0 HE2 PHE A 103 1.512 0.535 -4.030 1.00 0.00 H new ATOM 0 HZ PHE A 103 0.655 1.192 -1.797 1.00 0.00 H new ATOM 1627 N THR A 104 -2.011 5.932 -8.240 1.00 0.00 N ATOM 1628 CA THR A 104 -2.118 7.058 -9.210 1.00 0.00 C ATOM 1629 C THR A 104 -3.422 7.825 -8.980 1.00 0.00 C ATOM 1630 O THR A 104 -3.428 9.037 -8.908 1.00 0.00 O ATOM 1631 CB THR A 104 -2.097 6.506 -10.637 1.00 0.00 C ATOM 1632 OG1 THR A 104 -1.141 5.458 -10.723 1.00 0.00 O ATOM 1633 CG2 THR A 104 -1.722 7.623 -11.611 1.00 0.00 C ATOM 0 H THR A 104 -2.272 5.017 -8.608 1.00 0.00 H new ATOM 0 HA THR A 104 -1.275 7.734 -9.066 1.00 0.00 H new ATOM 0 HB THR A 104 -3.084 6.120 -10.893 1.00 0.00 H new ATOM 0 HG1 THR A 104 -1.445 4.694 -10.190 1.00 0.00 H new ATOM 0 HG21 THR A 104 -1.707 7.230 -12.627 1.00 0.00 H new ATOM 0 HG22 THR A 104 -2.456 8.426 -11.543 1.00 0.00 H new ATOM 0 HG23 THR A 104 -0.735 8.011 -11.358 1.00 0.00 H new ATOM 1641 N ALA A 105 -4.528 7.136 -8.872 1.00 0.00 N ATOM 1642 CA ALA A 105 -5.827 7.843 -8.657 1.00 0.00 C ATOM 1643 C ALA A 105 -5.799 8.606 -7.330 1.00 0.00 C ATOM 1644 O ALA A 105 -6.400 9.654 -7.196 1.00 0.00 O ATOM 1645 CB ALA A 105 -6.965 6.821 -8.628 1.00 0.00 C ATOM 0 H ALA A 105 -4.589 6.119 -8.923 1.00 0.00 H new ATOM 0 HA ALA A 105 -5.985 8.549 -9.472 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -7.913 7.336 -8.471 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -6.996 6.284 -9.576 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -6.798 6.113 -7.816 1.00 0.00 H new ATOM 1651 N PHE A 106 -5.122 8.083 -6.343 1.00 0.00 N ATOM 1652 CA PHE A 106 -5.071 8.775 -5.021 1.00 0.00 C ATOM 1653 C PHE A 106 -3.809 9.645 -4.925 1.00 0.00 C ATOM 1654 O PHE A 106 -3.602 10.341 -3.950 1.00 0.00 O ATOM 1655 CB PHE A 106 -5.046 7.728 -3.906 1.00 0.00 C ATOM 1656 CG PHE A 106 -6.399 7.067 -3.795 1.00 0.00 C ATOM 1657 CD1 PHE A 106 -6.727 5.994 -4.633 1.00 0.00 C ATOM 1658 CD2 PHE A 106 -7.323 7.520 -2.848 1.00 0.00 C ATOM 1659 CE1 PHE A 106 -7.977 5.377 -4.524 1.00 0.00 C ATOM 1660 CE2 PHE A 106 -8.572 6.901 -2.738 1.00 0.00 C ATOM 1661 CZ PHE A 106 -8.899 5.829 -3.576 1.00 0.00 C ATOM 0 H PHE A 106 -4.602 7.207 -6.394 1.00 0.00 H new ATOM 0 HA PHE A 106 -5.950 9.411 -4.918 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -4.281 6.980 -4.114 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -4.782 8.198 -2.959 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -6.014 5.643 -5.364 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -7.072 8.348 -2.202 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -8.230 4.551 -5.172 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -9.285 7.250 -2.006 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.864 5.351 -3.490 1.00 0.00 H new ATOM 1671 N LYS A 107 -2.955 9.596 -5.915 1.00 0.00 N ATOM 1672 CA LYS A 107 -1.701 10.406 -5.865 1.00 0.00 C ATOM 1673 C LYS A 107 -2.012 11.880 -5.550 1.00 0.00 C ATOM 1674 O LYS A 107 -1.305 12.515 -4.798 1.00 0.00 O ATOM 1675 CB LYS A 107 -0.965 10.299 -7.210 1.00 0.00 C ATOM 1676 CG LYS A 107 -1.594 11.242 -8.243 1.00 0.00 C ATOM 1677 CD LYS A 107 -0.890 11.064 -9.591 1.00 0.00 C ATOM 1678 CE LYS A 107 -0.632 12.437 -10.220 1.00 0.00 C ATOM 1679 NZ LYS A 107 0.350 13.195 -9.389 1.00 0.00 N ATOM 0 H LYS A 107 -3.072 9.030 -6.756 1.00 0.00 H new ATOM 0 HA LYS A 107 -1.066 10.015 -5.070 1.00 0.00 H new ATOM 0 HB2 LYS A 107 0.088 10.547 -7.076 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -1.007 9.272 -7.573 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -2.658 11.029 -8.345 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -1.507 12.276 -7.909 1.00 0.00 H new ATOM 0 HD2 LYS A 107 0.052 10.533 -9.454 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -1.504 10.457 -10.256 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -0.249 12.317 -11.234 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -1.566 12.994 -10.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 0.875 13.860 -9.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -0.156 13.723 -8.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 1.016 12.530 -8.946 1.00 0.00 H new ATOM 1693 N ASP A 108 -3.055 12.433 -6.114 1.00 0.00 N ATOM 1694 CA ASP A 108 -3.382 13.867 -5.839 1.00 0.00 C ATOM 1695 C ASP A 108 -3.750 14.061 -4.364 1.00 0.00 C ATOM 1696 O ASP A 108 -3.433 15.071 -3.766 1.00 0.00 O ATOM 1697 CB ASP A 108 -4.564 14.289 -6.713 1.00 0.00 C ATOM 1698 CG ASP A 108 -4.456 15.781 -7.035 1.00 0.00 C ATOM 1699 OD1 ASP A 108 -3.430 16.181 -7.560 1.00 0.00 O ATOM 1700 OD2 ASP A 108 -5.402 16.497 -6.752 1.00 0.00 O ATOM 0 H ASP A 108 -3.693 11.957 -6.751 1.00 0.00 H new ATOM 0 HA ASP A 108 -2.509 14.478 -6.067 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -4.574 13.707 -7.635 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.502 14.085 -6.197 1.00 0.00 H new ATOM 1705 N ASP A 109 -4.429 13.114 -3.778 1.00 0.00 N ATOM 1706 CA ASP A 109 -4.835 13.248 -2.347 1.00 0.00 C ATOM 1707 C ASP A 109 -3.884 12.434 -1.467 1.00 0.00 C ATOM 1708 O ASP A 109 -4.132 11.280 -1.179 1.00 0.00 O ATOM 1709 CB ASP A 109 -6.267 12.731 -2.173 1.00 0.00 C ATOM 1710 CG ASP A 109 -7.057 13.695 -1.285 1.00 0.00 C ATOM 1711 OD1 ASP A 109 -7.566 14.671 -1.810 1.00 0.00 O ATOM 1712 OD2 ASP A 109 -7.139 13.440 -0.094 1.00 0.00 O ATOM 0 H ASP A 109 -4.722 12.248 -4.230 1.00 0.00 H new ATOM 0 HA ASP A 109 -4.790 14.296 -2.052 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.751 12.637 -3.145 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.254 11.737 -1.726 1.00 0.00 H new ATOM 1717 N VAL A 110 -2.796 13.024 -1.037 1.00 0.00 N ATOM 1718 CA VAL A 110 -1.836 12.277 -0.171 1.00 0.00 C ATOM 1719 C VAL A 110 -1.694 12.986 1.179 1.00 0.00 C ATOM 1720 O VAL A 110 -1.609 14.197 1.249 1.00 0.00 O ATOM 1721 CB VAL A 110 -0.461 12.227 -0.838 1.00 0.00 C ATOM 1722 CG1 VAL A 110 0.437 11.265 -0.062 1.00 0.00 C ATOM 1723 CG2 VAL A 110 -0.598 11.747 -2.285 1.00 0.00 C ATOM 0 H VAL A 110 -2.533 13.987 -1.248 1.00 0.00 H new ATOM 0 HA VAL A 110 -2.215 11.266 -0.025 1.00 0.00 H new ATOM 0 HB VAL A 110 -0.022 13.225 -0.837 1.00 0.00 H new ATOM 0 HG11 VAL A 110 1.419 11.225 -0.533 1.00 0.00 H new ATOM 0 HG12 VAL A 110 0.541 11.613 0.966 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.008 10.270 -0.065 1.00 0.00 H new ATOM 0 HG21 VAL A 110 0.386 11.714 -2.752 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.039 10.750 -2.297 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.239 12.434 -2.837 1.00 0.00 H new ATOM 1733 N ASP A 111 -1.663 12.239 2.250 1.00 0.00 N ATOM 1734 CA ASP A 111 -1.516 12.859 3.598 1.00 0.00 C ATOM 1735 C ASP A 111 -0.360 12.181 4.342 1.00 0.00 C ATOM 1736 O ASP A 111 0.371 12.813 5.080 1.00 0.00 O ATOM 1737 CB ASP A 111 -2.813 12.676 4.391 1.00 0.00 C ATOM 1738 CG ASP A 111 -3.641 13.961 4.321 1.00 0.00 C ATOM 1739 OD1 ASP A 111 -4.354 14.131 3.346 1.00 0.00 O ATOM 1740 OD2 ASP A 111 -3.548 14.753 5.244 1.00 0.00 O ATOM 0 H ASP A 111 -1.734 11.221 2.249 1.00 0.00 H new ATOM 0 HA ASP A 111 -1.308 13.923 3.490 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -3.384 11.841 3.986 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -2.586 12.434 5.429 1.00 0.00 H new ATOM 1745 N THR A 112 -0.190 10.896 4.152 1.00 0.00 N ATOM 1746 CA THR A 112 0.918 10.172 4.843 1.00 0.00 C ATOM 1747 C THR A 112 1.507 9.124 3.893 1.00 0.00 C ATOM 1748 O THR A 112 0.796 8.315 3.329 1.00 0.00 O ATOM 1749 CB THR A 112 0.372 9.479 6.096 1.00 0.00 C ATOM 1750 OG1 THR A 112 -0.416 10.400 6.837 1.00 0.00 O ATOM 1751 CG2 THR A 112 1.532 8.985 6.963 1.00 0.00 C ATOM 0 H THR A 112 -0.773 10.317 3.547 1.00 0.00 H new ATOM 0 HA THR A 112 1.695 10.880 5.131 1.00 0.00 H new ATOM 0 HB THR A 112 -0.241 8.628 5.800 1.00 0.00 H new ATOM 0 HG1 THR A 112 -0.768 9.959 7.638 1.00 0.00 H new ATOM 0 HG21 THR A 112 1.138 8.493 7.852 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.136 8.277 6.394 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.150 9.832 7.261 1.00 0.00 H new ATOM 1759 N LEU A 113 2.800 9.139 3.699 1.00 0.00 N ATOM 1760 CA LEU A 113 3.428 8.150 2.771 1.00 0.00 C ATOM 1761 C LEU A 113 4.247 7.126 3.562 1.00 0.00 C ATOM 1762 O LEU A 113 5.067 7.476 4.388 1.00 0.00 O ATOM 1763 CB LEU A 113 4.351 8.883 1.793 1.00 0.00 C ATOM 1764 CG LEU A 113 3.553 9.938 1.026 1.00 0.00 C ATOM 1765 CD1 LEU A 113 4.484 11.076 0.603 1.00 0.00 C ATOM 1766 CD2 LEU A 113 2.933 9.298 -0.218 1.00 0.00 C ATOM 0 H LEU A 113 3.447 9.791 4.141 1.00 0.00 H new ATOM 0 HA LEU A 113 2.641 7.632 2.223 1.00 0.00 H new ATOM 0 HB2 LEU A 113 5.170 9.355 2.335 1.00 0.00 H new ATOM 0 HB3 LEU A 113 4.797 8.173 1.097 1.00 0.00 H new ATOM 0 HG LEU A 113 2.764 10.334 1.665 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.915 11.828 0.056 1.00 0.00 H new ATOM 0 HD12 LEU A 113 4.929 11.530 1.488 1.00 0.00 H new ATOM 0 HD13 LEU A 113 5.273 10.682 -0.037 1.00 0.00 H new ATOM 0 HD21 LEU A 113 2.363 10.048 -0.767 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.723 8.903 -0.856 1.00 0.00 H new ATOM 0 HD23 LEU A 113 2.270 8.487 0.082 1.00 0.00 H new ATOM 1778 N LEU A 114 4.041 5.860 3.299 1.00 0.00 N ATOM 1779 CA LEU A 114 4.812 4.802 4.015 1.00 0.00 C ATOM 1780 C LEU A 114 5.510 3.919 2.975 1.00 0.00 C ATOM 1781 O LEU A 114 4.882 3.148 2.276 1.00 0.00 O ATOM 1782 CB LEU A 114 3.858 3.955 4.861 1.00 0.00 C ATOM 1783 CG LEU A 114 3.016 4.868 5.755 1.00 0.00 C ATOM 1784 CD1 LEU A 114 1.662 4.211 6.027 1.00 0.00 C ATOM 1785 CD2 LEU A 114 3.745 5.098 7.081 1.00 0.00 C ATOM 0 H LEU A 114 3.368 5.514 2.615 1.00 0.00 H new ATOM 0 HA LEU A 114 5.554 5.258 4.671 1.00 0.00 H new ATOM 0 HB2 LEU A 114 3.210 3.364 4.214 1.00 0.00 H new ATOM 0 HB3 LEU A 114 4.424 3.252 5.472 1.00 0.00 H new ATOM 0 HG LEU A 114 2.862 5.823 5.253 1.00 0.00 H new ATOM 0 HD11 LEU A 114 1.063 4.862 6.664 1.00 0.00 H new ATOM 0 HD12 LEU A 114 1.141 4.047 5.084 1.00 0.00 H new ATOM 0 HD13 LEU A 114 1.815 3.255 6.528 1.00 0.00 H new ATOM 0 HD21 LEU A 114 3.145 5.748 7.718 1.00 0.00 H new ATOM 0 HD22 LEU A 114 3.900 4.142 7.582 1.00 0.00 H new ATOM 0 HD23 LEU A 114 4.710 5.567 6.889 1.00 0.00 H new ATOM 1797 N VAL A 115 6.801 4.056 2.851 1.00 0.00 N ATOM 1798 CA VAL A 115 7.538 3.252 1.829 1.00 0.00 C ATOM 1799 C VAL A 115 8.640 2.399 2.467 1.00 0.00 C ATOM 1800 O VAL A 115 9.362 2.839 3.340 1.00 0.00 O ATOM 1801 CB VAL A 115 8.154 4.197 0.792 1.00 0.00 C ATOM 1802 CG1 VAL A 115 9.264 5.031 1.437 1.00 0.00 C ATOM 1803 CG2 VAL A 115 8.736 3.373 -0.358 1.00 0.00 C ATOM 0 H VAL A 115 7.378 4.686 3.409 1.00 0.00 H new ATOM 0 HA VAL A 115 6.829 2.576 1.351 1.00 0.00 H new ATOM 0 HB VAL A 115 7.382 4.867 0.412 1.00 0.00 H new ATOM 0 HG11 VAL A 115 9.696 5.700 0.692 1.00 0.00 H new ATOM 0 HG12 VAL A 115 8.848 5.619 2.255 1.00 0.00 H new ATOM 0 HG13 VAL A 115 10.039 4.369 1.823 1.00 0.00 H new ATOM 0 HG21 VAL A 115 9.175 4.041 -1.098 1.00 0.00 H new ATOM 0 HG22 VAL A 115 9.504 2.703 0.027 1.00 0.00 H new ATOM 0 HG23 VAL A 115 7.943 2.787 -0.823 1.00 0.00 H new ATOM 1813 N THR A 116 8.783 1.183 2.001 1.00 0.00 N ATOM 1814 CA THR A 116 9.848 0.284 2.532 1.00 0.00 C ATOM 1815 C THR A 116 10.923 0.124 1.453 1.00 0.00 C ATOM 1816 O THR A 116 10.675 -0.436 0.403 1.00 0.00 O ATOM 1817 CB THR A 116 9.260 -1.093 2.862 1.00 0.00 C ATOM 1818 OG1 THR A 116 7.958 -0.944 3.410 1.00 0.00 O ATOM 1819 CG2 THR A 116 10.161 -1.803 3.872 1.00 0.00 C ATOM 0 H THR A 116 8.202 0.774 1.270 1.00 0.00 H new ATOM 0 HA THR A 116 10.273 0.713 3.439 1.00 0.00 H new ATOM 0 HB THR A 116 9.198 -1.685 1.949 1.00 0.00 H new ATOM 0 HG1 THR A 116 8.020 -0.865 4.385 1.00 0.00 H new ATOM 0 HG21 THR A 116 9.743 -2.782 4.107 1.00 0.00 H new ATOM 0 HG22 THR A 116 11.157 -1.926 3.447 1.00 0.00 H new ATOM 0 HG23 THR A 116 10.226 -1.208 4.783 1.00 0.00 H new ATOM 1827 N ARG A 117 12.106 0.622 1.691 1.00 0.00 N ATOM 1828 CA ARG A 117 13.181 0.507 0.663 1.00 0.00 C ATOM 1829 C ARG A 117 14.083 -0.690 0.973 1.00 0.00 C ATOM 1830 O ARG A 117 14.755 -0.726 1.983 1.00 0.00 O ATOM 1831 CB ARG A 117 14.018 1.787 0.660 1.00 0.00 C ATOM 1832 CG ARG A 117 13.144 2.967 0.229 1.00 0.00 C ATOM 1833 CD ARG A 117 14.038 4.126 -0.212 1.00 0.00 C ATOM 1834 NE ARG A 117 14.371 4.972 0.972 1.00 0.00 N ATOM 1835 CZ ARG A 117 15.532 5.580 1.064 1.00 0.00 C ATOM 1836 NH1 ARG A 117 16.423 5.481 0.109 1.00 0.00 N ATOM 1837 NH2 ARG A 117 15.796 6.304 2.116 1.00 0.00 N ATOM 0 H ARG A 117 12.375 1.102 2.550 1.00 0.00 H new ATOM 0 HA ARG A 117 12.723 0.362 -0.316 1.00 0.00 H new ATOM 0 HB2 ARG A 117 14.428 1.968 1.653 1.00 0.00 H new ATOM 0 HB3 ARG A 117 14.864 1.680 -0.019 1.00 0.00 H new ATOM 0 HG2 ARG A 117 12.487 2.668 -0.588 1.00 0.00 H new ATOM 0 HG3 ARG A 117 12.504 3.280 1.054 1.00 0.00 H new ATOM 0 HD2 ARG A 117 14.951 3.743 -0.668 1.00 0.00 H new ATOM 0 HD3 ARG A 117 13.531 4.724 -0.969 1.00 0.00 H new ATOM 0 HE ARG A 117 13.687 5.080 1.721 1.00 0.00 H new ATOM 0 HH11 ARG A 117 16.220 4.925 -0.722 1.00 0.00 H new ATOM 0 HH12 ARG A 117 17.320 5.960 0.196 1.00 0.00 H new ATOM 0 HH21 ARG A 117 15.104 6.395 2.859 1.00 0.00 H new ATOM 0 HH22 ARG A 117 16.695 6.779 2.195 1.00 0.00 H new ATOM 1851 N LEU A 118 14.109 -1.666 0.101 1.00 0.00 N ATOM 1852 CA LEU A 118 14.975 -2.858 0.334 1.00 0.00 C ATOM 1853 C LEU A 118 16.392 -2.547 -0.156 1.00 0.00 C ATOM 1854 O LEU A 118 16.586 -1.734 -1.038 1.00 0.00 O ATOM 1855 CB LEU A 118 14.426 -4.061 -0.441 1.00 0.00 C ATOM 1856 CG LEU A 118 13.251 -4.678 0.321 1.00 0.00 C ATOM 1857 CD1 LEU A 118 12.034 -3.753 0.229 1.00 0.00 C ATOM 1858 CD2 LEU A 118 12.906 -6.040 -0.293 1.00 0.00 C ATOM 0 H LEU A 118 13.567 -1.687 -0.763 1.00 0.00 H new ATOM 0 HA LEU A 118 14.989 -3.094 1.398 1.00 0.00 H new ATOM 0 HB2 LEU A 118 14.103 -3.748 -1.434 1.00 0.00 H new ATOM 0 HB3 LEU A 118 15.211 -4.804 -0.580 1.00 0.00 H new ATOM 0 HG LEU A 118 13.526 -4.808 1.368 1.00 0.00 H new ATOM 0 HD11 LEU A 118 11.199 -4.195 0.773 1.00 0.00 H new ATOM 0 HD12 LEU A 118 12.279 -2.785 0.665 1.00 0.00 H new ATOM 0 HD13 LEU A 118 11.756 -3.620 -0.817 1.00 0.00 H new ATOM 0 HD21 LEU A 118 12.069 -6.482 0.248 1.00 0.00 H new ATOM 0 HD22 LEU A 118 12.632 -5.908 -1.340 1.00 0.00 H new ATOM 0 HD23 LEU A 118 13.771 -6.700 -0.224 1.00 0.00 H new ATOM 1870 N ALA A 119 17.382 -3.185 0.408 1.00 0.00 N ATOM 1871 CA ALA A 119 18.783 -2.920 -0.028 1.00 0.00 C ATOM 1872 C ALA A 119 19.090 -3.721 -1.296 1.00 0.00 C ATOM 1873 O ALA A 119 19.942 -3.352 -2.080 1.00 0.00 O ATOM 1874 CB ALA A 119 19.752 -3.330 1.083 1.00 0.00 C ATOM 0 H ALA A 119 17.281 -3.877 1.151 1.00 0.00 H new ATOM 0 HA ALA A 119 18.899 -1.857 -0.237 1.00 0.00 H new ATOM 0 HB1 ALA A 119 20.776 -3.136 0.763 1.00 0.00 H new ATOM 0 HB2 ALA A 119 19.538 -2.754 1.983 1.00 0.00 H new ATOM 0 HB3 ALA A 119 19.634 -4.393 1.295 1.00 0.00 H new ATOM 1880 N GLY A 120 18.405 -4.816 -1.505 1.00 0.00 N ATOM 1881 CA GLY A 120 18.664 -5.637 -2.724 1.00 0.00 C ATOM 1882 C GLY A 120 18.054 -4.946 -3.946 1.00 0.00 C ATOM 1883 O GLY A 120 17.310 -3.991 -3.824 1.00 0.00 O ATOM 0 H GLY A 120 17.679 -5.176 -0.885 1.00 0.00 H new ATOM 0 HA2 GLY A 120 19.737 -5.768 -2.865 1.00 0.00 H new ATOM 0 HA3 GLY A 120 18.234 -6.631 -2.603 1.00 0.00 H new ATOM 1887 N SER A 121 18.361 -5.422 -5.124 1.00 0.00 N ATOM 1888 CA SER A 121 17.800 -4.797 -6.358 1.00 0.00 C ATOM 1889 C SER A 121 17.044 -5.852 -7.164 1.00 0.00 C ATOM 1890 O SER A 121 17.612 -6.829 -7.613 1.00 0.00 O ATOM 1891 CB SER A 121 18.941 -4.234 -7.206 1.00 0.00 C ATOM 1892 OG SER A 121 19.973 -5.211 -7.317 1.00 0.00 O ATOM 0 H SER A 121 18.977 -6.218 -5.285 1.00 0.00 H new ATOM 0 HA SER A 121 17.119 -3.992 -6.081 1.00 0.00 H new ATOM 0 HB2 SER A 121 18.574 -3.962 -8.196 1.00 0.00 H new ATOM 0 HB3 SER A 121 19.333 -3.325 -6.751 1.00 0.00 H new ATOM 0 HG SER A 121 19.578 -6.082 -7.532 1.00 0.00 H new ATOM 1898 N PHE A 122 15.762 -5.671 -7.347 1.00 0.00 N ATOM 1899 CA PHE A 122 14.965 -6.668 -8.117 1.00 0.00 C ATOM 1900 C PHE A 122 14.482 -6.041 -9.428 1.00 0.00 C ATOM 1901 O PHE A 122 14.468 -4.835 -9.583 1.00 0.00 O ATOM 1902 CB PHE A 122 13.763 -7.110 -7.282 1.00 0.00 C ATOM 1903 CG PHE A 122 14.250 -7.639 -5.955 1.00 0.00 C ATOM 1904 CD1 PHE A 122 14.474 -6.757 -4.891 1.00 0.00 C ATOM 1905 CD2 PHE A 122 14.485 -9.009 -5.791 1.00 0.00 C ATOM 1906 CE1 PHE A 122 14.930 -7.246 -3.661 1.00 0.00 C ATOM 1907 CE2 PHE A 122 14.942 -9.498 -4.561 1.00 0.00 C ATOM 1908 CZ PHE A 122 15.165 -8.616 -3.496 1.00 0.00 C ATOM 0 H PHE A 122 15.233 -4.873 -6.995 1.00 0.00 H new ATOM 0 HA PHE A 122 15.587 -7.534 -8.344 1.00 0.00 H new ATOM 0 HB2 PHE A 122 13.085 -6.271 -7.126 1.00 0.00 H new ATOM 0 HB3 PHE A 122 13.201 -7.880 -7.810 1.00 0.00 H new ATOM 0 HD1 PHE A 122 14.295 -5.700 -5.019 1.00 0.00 H new ATOM 0 HD2 PHE A 122 14.314 -9.689 -6.613 1.00 0.00 H new ATOM 0 HE1 PHE A 122 15.100 -6.566 -2.839 1.00 0.00 H new ATOM 0 HE2 PHE A 122 15.123 -10.555 -4.434 1.00 0.00 H new ATOM 0 HZ PHE A 122 15.518 -8.993 -2.548 1.00 0.00 H new ATOM 1918 N GLU A 123 14.079 -6.854 -10.368 1.00 0.00 N ATOM 1919 CA GLU A 123 13.588 -6.311 -11.668 1.00 0.00 C ATOM 1920 C GLU A 123 12.087 -6.585 -11.803 1.00 0.00 C ATOM 1921 O GLU A 123 11.544 -7.451 -11.146 1.00 0.00 O ATOM 1922 CB GLU A 123 14.339 -6.978 -12.824 1.00 0.00 C ATOM 1923 CG GLU A 123 14.236 -8.499 -12.698 1.00 0.00 C ATOM 1924 CD GLU A 123 14.975 -9.156 -13.864 1.00 0.00 C ATOM 1925 OE1 GLU A 123 14.488 -9.059 -14.979 1.00 0.00 O ATOM 1926 OE2 GLU A 123 16.017 -9.745 -13.624 1.00 0.00 O ATOM 0 H GLU A 123 14.069 -7.871 -10.292 1.00 0.00 H new ATOM 0 HA GLU A 123 13.764 -5.236 -11.699 1.00 0.00 H new ATOM 0 HB2 GLU A 123 13.921 -6.653 -13.777 1.00 0.00 H new ATOM 0 HB3 GLU A 123 15.385 -6.673 -12.814 1.00 0.00 H new ATOM 0 HG2 GLU A 123 14.664 -8.826 -11.751 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.190 -8.805 -12.697 1.00 0.00 H new ATOM 1933 N GLY A 124 11.415 -5.850 -12.650 1.00 0.00 N ATOM 1934 CA GLY A 124 9.948 -6.059 -12.835 1.00 0.00 C ATOM 1935 C GLY A 124 9.446 -5.124 -13.936 1.00 0.00 C ATOM 1936 O GLY A 124 10.214 -4.659 -14.756 1.00 0.00 O ATOM 0 H GLY A 124 11.821 -5.111 -13.224 1.00 0.00 H new ATOM 0 HA2 GLY A 124 9.746 -7.097 -13.101 1.00 0.00 H new ATOM 0 HA3 GLY A 124 9.419 -5.861 -11.903 1.00 0.00 H new ATOM 1940 N ASP A 125 8.170 -4.833 -13.966 1.00 0.00 N ATOM 1941 CA ASP A 125 7.634 -3.914 -15.011 1.00 0.00 C ATOM 1942 C ASP A 125 6.629 -2.947 -14.362 1.00 0.00 C ATOM 1943 O ASP A 125 6.282 -1.927 -14.926 1.00 0.00 O ATOM 1944 CB ASP A 125 6.930 -4.732 -16.100 1.00 0.00 C ATOM 1945 CG ASP A 125 7.721 -4.636 -17.406 1.00 0.00 C ATOM 1946 OD1 ASP A 125 8.845 -5.110 -17.432 1.00 0.00 O ATOM 1947 OD2 ASP A 125 7.190 -4.089 -18.359 1.00 0.00 O ATOM 0 H ASP A 125 7.477 -5.194 -13.310 1.00 0.00 H new ATOM 0 HA ASP A 125 8.451 -3.348 -15.459 1.00 0.00 H new ATOM 0 HB2 ASP A 125 6.846 -5.773 -15.790 1.00 0.00 H new ATOM 0 HB3 ASP A 125 5.916 -4.361 -16.249 1.00 0.00 H new ATOM 1952 N THR A 126 6.166 -3.260 -13.174 1.00 0.00 N ATOM 1953 CA THR A 126 5.197 -2.368 -12.476 1.00 0.00 C ATOM 1954 C THR A 126 5.901 -1.728 -11.279 1.00 0.00 C ATOM 1955 O THR A 126 6.398 -2.413 -10.401 1.00 0.00 O ATOM 1956 CB THR A 126 3.998 -3.186 -11.992 1.00 0.00 C ATOM 1957 OG1 THR A 126 3.569 -4.055 -13.031 1.00 0.00 O ATOM 1958 CG2 THR A 126 2.855 -2.242 -11.610 1.00 0.00 C ATOM 0 H THR A 126 6.422 -4.102 -12.658 1.00 0.00 H new ATOM 0 HA THR A 126 4.843 -1.595 -13.158 1.00 0.00 H new ATOM 0 HB THR A 126 4.287 -3.775 -11.121 1.00 0.00 H new ATOM 0 HG1 THR A 126 2.802 -4.581 -12.722 1.00 0.00 H new ATOM 0 HG21 THR A 126 2.001 -2.825 -11.265 1.00 0.00 H new ATOM 0 HG22 THR A 126 3.185 -1.575 -10.813 1.00 0.00 H new ATOM 0 HG23 THR A 126 2.564 -1.652 -12.479 1.00 0.00 H new ATOM 1966 N LYS A 127 5.949 -0.422 -11.240 1.00 0.00 N ATOM 1967 CA LYS A 127 6.631 0.269 -10.110 1.00 0.00 C ATOM 1968 C LYS A 127 5.699 1.314 -9.496 1.00 0.00 C ATOM 1969 O LYS A 127 4.686 1.672 -10.065 1.00 0.00 O ATOM 1970 CB LYS A 127 7.895 0.958 -10.627 1.00 0.00 C ATOM 1971 CG LYS A 127 8.882 -0.097 -11.130 1.00 0.00 C ATOM 1972 CD LYS A 127 9.738 0.492 -12.253 1.00 0.00 C ATOM 1973 CE LYS A 127 11.141 -0.115 -12.194 1.00 0.00 C ATOM 1974 NZ LYS A 127 11.979 0.462 -13.282 1.00 0.00 N ATOM 0 H LYS A 127 5.544 0.195 -11.944 1.00 0.00 H new ATOM 0 HA LYS A 127 6.895 -0.465 -9.349 1.00 0.00 H new ATOM 0 HB2 LYS A 127 7.642 1.648 -11.432 1.00 0.00 H new ATOM 0 HB3 LYS A 127 8.351 1.548 -9.832 1.00 0.00 H new ATOM 0 HG2 LYS A 127 9.519 -0.432 -10.312 1.00 0.00 H new ATOM 0 HG3 LYS A 127 8.341 -0.971 -11.492 1.00 0.00 H new ATOM 0 HD2 LYS A 127 9.281 0.285 -13.221 1.00 0.00 H new ATOM 0 HD3 LYS A 127 9.794 1.576 -12.152 1.00 0.00 H new ATOM 0 HE2 LYS A 127 11.596 0.087 -11.224 1.00 0.00 H new ATOM 0 HE3 LYS A 127 11.085 -1.198 -12.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 12.933 0.049 -13.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 11.547 0.247 -14.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 12.043 1.493 -13.161 1.00 0.00 H new ATOM 1988 N MET A 128 6.042 1.808 -8.337 1.00 0.00 N ATOM 1989 CA MET A 128 5.186 2.831 -7.672 1.00 0.00 C ATOM 1990 C MET A 128 5.154 4.108 -8.516 1.00 0.00 C ATOM 1991 O MET A 128 6.039 4.361 -9.310 1.00 0.00 O ATOM 1992 CB MET A 128 5.758 3.150 -6.289 1.00 0.00 C ATOM 1993 CG MET A 128 4.623 3.564 -5.350 1.00 0.00 C ATOM 1994 SD MET A 128 4.475 5.368 -5.336 1.00 0.00 S ATOM 1995 CE MET A 128 3.014 5.463 -4.275 1.00 0.00 C ATOM 0 H MET A 128 6.882 1.546 -7.821 1.00 0.00 H new ATOM 0 HA MET A 128 4.173 2.442 -7.570 1.00 0.00 H new ATOM 0 HB2 MET A 128 6.276 2.279 -5.888 1.00 0.00 H new ATOM 0 HB3 MET A 128 6.493 3.951 -6.364 1.00 0.00 H new ATOM 0 HG2 MET A 128 3.685 3.115 -5.676 1.00 0.00 H new ATOM 0 HG3 MET A 128 4.819 3.197 -4.342 1.00 0.00 H new ATOM 0 HE1 MET A 128 2.362 6.263 -4.625 1.00 0.00 H new ATOM 0 HE2 MET A 128 2.477 4.515 -4.310 1.00 0.00 H new ATOM 0 HE3 MET A 128 3.322 5.668 -3.250 1.00 0.00 H new ATOM 2005 N ILE A 129 4.139 4.913 -8.347 1.00 0.00 N ATOM 2006 CA ILE A 129 4.039 6.176 -9.133 1.00 0.00 C ATOM 2007 C ILE A 129 5.069 7.185 -8.605 1.00 0.00 C ATOM 2008 O ILE A 129 5.669 6.965 -7.572 1.00 0.00 O ATOM 2009 CB ILE A 129 2.625 6.748 -8.983 1.00 0.00 C ATOM 2010 CG1 ILE A 129 2.325 7.002 -7.502 1.00 0.00 C ATOM 2011 CG2 ILE A 129 1.610 5.747 -9.539 1.00 0.00 C ATOM 2012 CD1 ILE A 129 1.325 8.154 -7.373 1.00 0.00 C ATOM 0 H ILE A 129 3.372 4.749 -7.695 1.00 0.00 H new ATOM 0 HA ILE A 129 4.240 5.977 -10.186 1.00 0.00 H new ATOM 0 HB ILE A 129 2.556 7.686 -9.533 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.919 6.101 -7.043 1.00 0.00 H new ATOM 0 HG13 ILE A 129 3.245 7.244 -6.970 1.00 0.00 H new ATOM 0 HG21 ILE A 129 0.604 6.152 -9.433 1.00 0.00 H new ATOM 0 HG22 ILE A 129 1.819 5.565 -10.593 1.00 0.00 H new ATOM 0 HG23 ILE A 129 1.684 4.810 -8.987 1.00 0.00 H new ATOM 0 HD11 ILE A 129 1.112 8.334 -6.319 1.00 0.00 H new ATOM 0 HD12 ILE A 129 1.749 9.055 -7.817 1.00 0.00 H new ATOM 0 HD13 ILE A 129 0.402 7.894 -7.891 1.00 0.00 H new ATOM 2024 N PRO A 130 5.249 8.260 -9.334 1.00 0.00 N ATOM 2025 CA PRO A 130 6.209 9.373 -9.014 1.00 0.00 C ATOM 2026 C PRO A 130 5.668 10.219 -7.858 1.00 0.00 C ATOM 2027 O PRO A 130 4.795 11.046 -8.036 1.00 0.00 O ATOM 2028 CB PRO A 130 6.340 10.224 -10.275 1.00 0.00 C ATOM 2029 CG PRO A 130 5.352 9.694 -11.293 1.00 0.00 C ATOM 2030 CD PRO A 130 4.542 8.593 -10.619 1.00 0.00 C ATOM 0 HA PRO A 130 7.178 8.977 -8.710 1.00 0.00 H new ATOM 0 HB2 PRO A 130 6.135 11.271 -10.053 1.00 0.00 H new ATOM 0 HB3 PRO A 130 7.356 10.174 -10.666 1.00 0.00 H new ATOM 0 HG2 PRO A 130 4.697 10.492 -11.642 1.00 0.00 H new ATOM 0 HG3 PRO A 130 5.874 9.305 -12.167 1.00 0.00 H new ATOM 0 HD2 PRO A 130 3.523 8.927 -10.424 1.00 0.00 H new ATOM 0 HD3 PRO A 130 4.473 7.715 -11.261 1.00 0.00 H new ATOM 2038 N LEU A 131 6.180 10.014 -6.673 1.00 0.00 N ATOM 2039 CA LEU A 131 5.699 10.801 -5.501 1.00 0.00 C ATOM 2040 C LEU A 131 6.534 12.076 -5.364 1.00 0.00 C ATOM 2041 O LEU A 131 7.678 12.127 -5.773 1.00 0.00 O ATOM 2042 CB LEU A 131 5.843 9.962 -4.230 1.00 0.00 C ATOM 2043 CG LEU A 131 4.610 9.075 -4.059 1.00 0.00 C ATOM 2044 CD1 LEU A 131 4.910 7.982 -3.031 1.00 0.00 C ATOM 2045 CD2 LEU A 131 3.435 9.927 -3.572 1.00 0.00 C ATOM 0 H LEU A 131 6.912 9.334 -6.467 1.00 0.00 H new ATOM 0 HA LEU A 131 4.652 11.065 -5.647 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.741 9.347 -4.288 1.00 0.00 H new ATOM 0 HB3 LEU A 131 5.958 10.613 -3.363 1.00 0.00 H new ATOM 0 HG LEU A 131 4.354 8.616 -5.014 1.00 0.00 H new ATOM 0 HD11 LEU A 131 4.032 7.348 -2.907 1.00 0.00 H new ATOM 0 HD12 LEU A 131 5.748 7.377 -3.377 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.164 8.441 -2.075 1.00 0.00 H new ATOM 0 HD21 LEU A 131 2.554 9.296 -3.449 1.00 0.00 H new ATOM 0 HD22 LEU A 131 3.689 10.385 -2.616 1.00 0.00 H new ATOM 0 HD23 LEU A 131 3.224 10.707 -4.303 1.00 0.00 H new ATOM 2057 N ASN A 132 5.968 13.107 -4.796 1.00 0.00 N ATOM 2058 CA ASN A 132 6.723 14.383 -4.637 1.00 0.00 C ATOM 2059 C ASN A 132 7.381 14.425 -3.254 1.00 0.00 C ATOM 2060 O ASN A 132 7.019 15.218 -2.409 1.00 0.00 O ATOM 2061 CB ASN A 132 5.761 15.564 -4.785 1.00 0.00 C ATOM 2062 CG ASN A 132 6.471 16.716 -5.499 1.00 0.00 C ATOM 2063 OD1 ASN A 132 6.044 17.150 -6.551 1.00 0.00 O ATOM 2064 ND2 ASN A 132 7.545 17.233 -4.968 1.00 0.00 N ATOM 0 H ASN A 132 5.014 13.120 -4.435 1.00 0.00 H new ATOM 0 HA ASN A 132 7.496 14.445 -5.403 1.00 0.00 H new ATOM 0 HB2 ASN A 132 4.880 15.260 -5.350 1.00 0.00 H new ATOM 0 HB3 ASN A 132 5.414 15.889 -3.804 1.00 0.00 H new ATOM 0 HD21 ASN A 132 8.026 18.001 -5.436 1.00 0.00 H new ATOM 0 HD22 ASN A 132 7.903 16.869 -4.085 1.00 0.00 H new ATOM 2071 N TRP A 133 8.342 13.570 -3.017 1.00 0.00 N ATOM 2072 CA TRP A 133 9.025 13.549 -1.686 1.00 0.00 C ATOM 2073 C TRP A 133 9.494 14.961 -1.314 1.00 0.00 C ATOM 2074 O TRP A 133 9.603 15.302 -0.152 1.00 0.00 O ATOM 2075 CB TRP A 133 10.238 12.616 -1.751 1.00 0.00 C ATOM 2076 CG TRP A 133 9.812 11.273 -2.251 1.00 0.00 C ATOM 2077 CD1 TRP A 133 9.922 10.851 -3.532 1.00 0.00 C ATOM 2078 CD2 TRP A 133 9.214 10.173 -1.507 1.00 0.00 C ATOM 2079 NE1 TRP A 133 9.425 9.564 -3.622 1.00 0.00 N ATOM 2080 CE2 TRP A 133 8.978 9.102 -2.400 1.00 0.00 C ATOM 2081 CE3 TRP A 133 8.856 10.002 -0.158 1.00 0.00 C ATOM 2082 CZ2 TRP A 133 8.406 7.904 -1.971 1.00 0.00 C ATOM 2083 CZ3 TRP A 133 8.281 8.797 0.277 1.00 0.00 C ATOM 2084 CH2 TRP A 133 8.057 7.751 -0.627 1.00 0.00 C ATOM 0 H TRP A 133 8.685 12.883 -3.689 1.00 0.00 H new ATOM 0 HA TRP A 133 8.323 13.193 -0.932 1.00 0.00 H new ATOM 0 HB2 TRP A 133 10.998 13.036 -2.410 1.00 0.00 H new ATOM 0 HB3 TRP A 133 10.690 12.521 -0.764 1.00 0.00 H new ATOM 0 HD1 TRP A 133 10.331 11.425 -4.350 1.00 0.00 H new ATOM 0 HE1 TRP A 133 9.393 9.022 -4.486 1.00 0.00 H new ATOM 0 HE3 TRP A 133 9.024 10.802 0.548 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 8.234 7.101 -2.673 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 8.010 8.676 1.315 1.00 0.00 H new ATOM 0 HH2 TRP A 133 7.615 6.827 -0.285 1.00 0.00 H new ATOM 2095 N ASP A 134 9.774 15.781 -2.291 1.00 0.00 N ATOM 2096 CA ASP A 134 10.237 17.168 -1.998 1.00 0.00 C ATOM 2097 C ASP A 134 9.130 17.949 -1.280 1.00 0.00 C ATOM 2098 O ASP A 134 9.396 18.862 -0.523 1.00 0.00 O ATOM 2099 CB ASP A 134 10.592 17.875 -3.308 1.00 0.00 C ATOM 2100 CG ASP A 134 11.677 18.921 -3.045 1.00 0.00 C ATOM 2101 OD1 ASP A 134 11.352 19.954 -2.482 1.00 0.00 O ATOM 2102 OD2 ASP A 134 12.814 18.671 -3.411 1.00 0.00 O ATOM 0 H ASP A 134 9.702 15.549 -3.282 1.00 0.00 H new ATOM 0 HA ASP A 134 11.117 17.123 -1.356 1.00 0.00 H new ATOM 0 HB2 ASP A 134 10.942 17.149 -4.042 1.00 0.00 H new ATOM 0 HB3 ASP A 134 9.706 18.352 -3.728 1.00 0.00 H new ATOM 2107 N ASP A 135 7.892 17.603 -1.516 1.00 0.00 N ATOM 2108 CA ASP A 135 6.768 18.331 -0.853 1.00 0.00 C ATOM 2109 C ASP A 135 6.413 17.655 0.478 1.00 0.00 C ATOM 2110 O ASP A 135 5.613 18.160 1.242 1.00 0.00 O ATOM 2111 CB ASP A 135 5.544 18.313 -1.775 1.00 0.00 C ATOM 2112 CG ASP A 135 5.239 19.734 -2.255 1.00 0.00 C ATOM 2113 OD1 ASP A 135 4.578 20.455 -1.527 1.00 0.00 O ATOM 2114 OD2 ASP A 135 5.673 20.076 -3.343 1.00 0.00 O ATOM 0 H ASP A 135 7.609 16.847 -2.140 1.00 0.00 H new ATOM 0 HA ASP A 135 7.072 19.359 -0.658 1.00 0.00 H new ATOM 0 HB2 ASP A 135 5.730 17.662 -2.629 1.00 0.00 H new ATOM 0 HB3 ASP A 135 4.683 17.905 -1.245 1.00 0.00 H new ATOM 2119 N PHE A 136 6.999 16.522 0.764 1.00 0.00 N ATOM 2120 CA PHE A 136 6.690 15.824 2.045 1.00 0.00 C ATOM 2121 C PHE A 136 7.958 15.735 2.895 1.00 0.00 C ATOM 2122 O PHE A 136 9.053 15.968 2.421 1.00 0.00 O ATOM 2123 CB PHE A 136 6.190 14.406 1.758 1.00 0.00 C ATOM 2124 CG PHE A 136 4.865 14.453 1.034 1.00 0.00 C ATOM 2125 CD1 PHE A 136 4.786 14.996 -0.253 1.00 0.00 C ATOM 2126 CD2 PHE A 136 3.717 13.935 1.647 1.00 0.00 C ATOM 2127 CE1 PHE A 136 3.560 15.022 -0.929 1.00 0.00 C ATOM 2128 CE2 PHE A 136 2.491 13.962 0.971 1.00 0.00 C ATOM 2129 CZ PHE A 136 2.413 14.505 -0.316 1.00 0.00 C ATOM 0 H PHE A 136 7.678 16.051 0.166 1.00 0.00 H new ATOM 0 HA PHE A 136 5.921 16.384 2.577 1.00 0.00 H new ATOM 0 HB2 PHE A 136 6.923 13.870 1.155 1.00 0.00 H new ATOM 0 HB3 PHE A 136 6.082 13.855 2.692 1.00 0.00 H new ATOM 0 HD1 PHE A 136 5.671 15.395 -0.725 1.00 0.00 H new ATOM 0 HD2 PHE A 136 3.777 13.515 2.640 1.00 0.00 H new ATOM 0 HE1 PHE A 136 3.500 15.441 -1.923 1.00 0.00 H new ATOM 0 HE2 PHE A 136 1.605 13.563 1.443 1.00 0.00 H new ATOM 0 HZ PHE A 136 1.467 14.525 -0.837 1.00 0.00 H new ATOM 2139 N THR A 137 7.819 15.384 4.146 1.00 0.00 N ATOM 2140 CA THR A 137 9.014 15.259 5.029 1.00 0.00 C ATOM 2141 C THR A 137 8.896 13.975 5.854 1.00 0.00 C ATOM 2142 O THR A 137 7.866 13.699 6.439 1.00 0.00 O ATOM 2143 CB THR A 137 9.089 16.466 5.968 1.00 0.00 C ATOM 2144 OG1 THR A 137 8.770 17.646 5.244 1.00 0.00 O ATOM 2145 CG2 THR A 137 10.503 16.584 6.543 1.00 0.00 C ATOM 0 H THR A 137 6.927 15.178 4.595 1.00 0.00 H new ATOM 0 HA THR A 137 9.917 15.223 4.419 1.00 0.00 H new ATOM 0 HB THR A 137 8.379 16.336 6.785 1.00 0.00 H new ATOM 0 HG1 THR A 137 8.816 18.420 5.843 1.00 0.00 H new ATOM 0 HG21 THR A 137 10.554 17.444 7.211 1.00 0.00 H new ATOM 0 HG22 THR A 137 10.747 15.678 7.098 1.00 0.00 H new ATOM 0 HG23 THR A 137 11.217 16.714 5.730 1.00 0.00 H new ATOM 2153 N LYS A 138 9.934 13.183 5.899 1.00 0.00 N ATOM 2154 CA LYS A 138 9.872 11.911 6.676 1.00 0.00 C ATOM 2155 C LYS A 138 9.849 12.227 8.174 1.00 0.00 C ATOM 2156 O LYS A 138 10.737 12.871 8.697 1.00 0.00 O ATOM 2157 CB LYS A 138 11.103 11.064 6.347 1.00 0.00 C ATOM 2158 CG LYS A 138 10.974 9.687 7.002 1.00 0.00 C ATOM 2159 CD LYS A 138 11.764 9.667 8.312 1.00 0.00 C ATOM 2160 CE LYS A 138 13.263 9.659 8.007 1.00 0.00 C ATOM 2161 NZ LYS A 138 14.022 10.093 9.216 1.00 0.00 N ATOM 0 H LYS A 138 10.822 13.362 5.431 1.00 0.00 H new ATOM 0 HA LYS A 138 8.968 11.361 6.412 1.00 0.00 H new ATOM 0 HB2 LYS A 138 11.203 10.955 5.267 1.00 0.00 H new ATOM 0 HB3 LYS A 138 12.005 11.563 6.702 1.00 0.00 H new ATOM 0 HG2 LYS A 138 9.925 9.461 7.194 1.00 0.00 H new ATOM 0 HG3 LYS A 138 11.348 8.916 6.328 1.00 0.00 H new ATOM 0 HD2 LYS A 138 11.510 10.539 8.915 1.00 0.00 H new ATOM 0 HD3 LYS A 138 11.497 8.786 8.896 1.00 0.00 H new ATOM 0 HE2 LYS A 138 13.578 8.660 7.707 1.00 0.00 H new ATOM 0 HE3 LYS A 138 13.478 10.325 7.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 15.041 10.087 9.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 13.729 11.054 9.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 13.826 9.440 10.002 1.00 0.00 H new ATOM 2175 N VAL A 139 8.824 11.792 8.864 1.00 0.00 N ATOM 2176 CA VAL A 139 8.723 12.081 10.325 1.00 0.00 C ATOM 2177 C VAL A 139 9.213 10.883 11.148 1.00 0.00 C ATOM 2178 O VAL A 139 9.647 11.037 12.273 1.00 0.00 O ATOM 2179 CB VAL A 139 7.263 12.376 10.679 1.00 0.00 C ATOM 2180 CG1 VAL A 139 6.800 13.630 9.934 1.00 0.00 C ATOM 2181 CG2 VAL A 139 6.384 11.186 10.272 1.00 0.00 C ATOM 0 H VAL A 139 8.053 11.249 8.477 1.00 0.00 H new ATOM 0 HA VAL A 139 9.348 12.943 10.558 1.00 0.00 H new ATOM 0 HB VAL A 139 7.178 12.539 11.753 1.00 0.00 H new ATOM 0 HG11 VAL A 139 5.761 13.840 10.186 1.00 0.00 H new ATOM 0 HG12 VAL A 139 7.422 14.476 10.225 1.00 0.00 H new ATOM 0 HG13 VAL A 139 6.887 13.468 8.860 1.00 0.00 H new ATOM 0 HG21 VAL A 139 5.345 11.398 10.525 1.00 0.00 H new ATOM 0 HG22 VAL A 139 6.470 11.021 9.198 1.00 0.00 H new ATOM 0 HG23 VAL A 139 6.712 10.293 10.804 1.00 0.00 H new ATOM 2191 N SER A 140 9.140 9.693 10.611 1.00 0.00 N ATOM 2192 CA SER A 140 9.596 8.501 11.387 1.00 0.00 C ATOM 2193 C SER A 140 10.214 7.471 10.440 1.00 0.00 C ATOM 2194 O SER A 140 9.714 7.227 9.359 1.00 0.00 O ATOM 2195 CB SER A 140 8.400 7.879 12.111 1.00 0.00 C ATOM 2196 OG SER A 140 8.516 8.127 13.506 1.00 0.00 O ATOM 0 H SER A 140 8.787 9.495 9.675 1.00 0.00 H new ATOM 0 HA SER A 140 10.345 8.810 12.117 1.00 0.00 H new ATOM 0 HB2 SER A 140 7.470 8.301 11.731 1.00 0.00 H new ATOM 0 HB3 SER A 140 8.363 6.806 11.922 1.00 0.00 H new ATOM 0 HG SER A 140 7.751 7.732 13.973 1.00 0.00 H new ATOM 2202 N SER A 141 11.296 6.858 10.845 1.00 0.00 N ATOM 2203 CA SER A 141 11.944 5.837 9.976 1.00 0.00 C ATOM 2204 C SER A 141 12.715 4.828 10.832 1.00 0.00 C ATOM 2205 O SER A 141 13.376 5.188 11.786 1.00 0.00 O ATOM 2206 CB SER A 141 12.907 6.525 9.008 1.00 0.00 C ATOM 2207 OG SER A 141 13.666 5.538 8.322 1.00 0.00 O ATOM 0 H SER A 141 11.757 7.022 11.740 1.00 0.00 H new ATOM 0 HA SER A 141 11.173 5.311 9.413 1.00 0.00 H new ATOM 0 HB2 SER A 141 12.351 7.134 8.295 1.00 0.00 H new ATOM 0 HB3 SER A 141 13.570 7.197 9.552 1.00 0.00 H new ATOM 0 HG SER A 141 13.063 4.858 7.956 1.00 0.00 H new ATOM 2213 N ARG A 142 12.643 3.569 10.490 1.00 0.00 N ATOM 2214 CA ARG A 142 13.380 2.530 11.267 1.00 0.00 C ATOM 2215 C ARG A 142 14.103 1.612 10.279 1.00 0.00 C ATOM 2216 O ARG A 142 13.536 1.202 9.285 1.00 0.00 O ATOM 2217 CB ARG A 142 12.388 1.711 12.095 1.00 0.00 C ATOM 2218 CG ARG A 142 13.153 0.770 13.026 1.00 0.00 C ATOM 2219 CD ARG A 142 13.638 1.547 14.251 1.00 0.00 C ATOM 2220 NE ARG A 142 13.961 0.591 15.351 1.00 0.00 N ATOM 2221 CZ ARG A 142 15.047 -0.142 15.303 1.00 0.00 C ATOM 2222 NH1 ARG A 142 15.872 -0.052 14.291 1.00 0.00 N ATOM 2223 NH2 ARG A 142 15.309 -0.970 16.277 1.00 0.00 N ATOM 0 H ARG A 142 12.102 3.214 9.701 1.00 0.00 H new ATOM 0 HA ARG A 142 14.099 3.001 11.938 1.00 0.00 H new ATOM 0 HB2 ARG A 142 11.749 2.375 12.677 1.00 0.00 H new ATOM 0 HB3 ARG A 142 11.736 1.137 11.437 1.00 0.00 H new ATOM 0 HG2 ARG A 142 12.510 -0.054 13.336 1.00 0.00 H new ATOM 0 HG3 ARG A 142 14.002 0.332 12.501 1.00 0.00 H new ATOM 0 HD2 ARG A 142 14.519 2.136 13.996 1.00 0.00 H new ATOM 0 HD3 ARG A 142 12.870 2.248 14.578 1.00 0.00 H new ATOM 0 HE ARG A 142 13.330 0.507 16.148 1.00 0.00 H new ATOM 0 HH11 ARG A 142 15.674 0.594 13.527 1.00 0.00 H new ATOM 0 HH12 ARG A 142 16.713 -0.628 14.266 1.00 0.00 H new ATOM 0 HH21 ARG A 142 14.671 -1.044 17.069 1.00 0.00 H new ATOM 0 HH22 ARG A 142 16.152 -1.543 16.246 1.00 0.00 H new ATOM 2237 N THR A 143 15.347 1.290 10.527 1.00 0.00 N ATOM 2238 CA THR A 143 16.088 0.407 9.578 1.00 0.00 C ATOM 2239 C THR A 143 16.354 -0.953 10.227 1.00 0.00 C ATOM 2240 O THR A 143 16.782 -1.037 11.361 1.00 0.00 O ATOM 2241 CB THR A 143 17.425 1.059 9.212 1.00 0.00 C ATOM 2242 OG1 THR A 143 17.230 2.454 9.001 1.00 0.00 O ATOM 2243 CG2 THR A 143 17.983 0.411 7.940 1.00 0.00 C ATOM 0 H THR A 143 15.879 1.599 11.341 1.00 0.00 H new ATOM 0 HA THR A 143 15.486 0.267 8.680 1.00 0.00 H new ATOM 0 HB THR A 143 18.136 0.915 10.026 1.00 0.00 H new ATOM 0 HG1 THR A 143 18.085 2.872 8.768 1.00 0.00 H new ATOM 0 HG21 THR A 143 18.934 0.877 7.682 1.00 0.00 H new ATOM 0 HG22 THR A 143 18.135 -0.655 8.111 1.00 0.00 H new ATOM 0 HG23 THR A 143 17.277 0.550 7.121 1.00 0.00 H new ATOM 2251 N VAL A 144 16.115 -2.017 9.508 1.00 0.00 N ATOM 2252 CA VAL A 144 16.364 -3.375 10.070 1.00 0.00 C ATOM 2253 C VAL A 144 17.214 -4.180 9.078 1.00 0.00 C ATOM 2254 O VAL A 144 16.911 -4.250 7.903 1.00 0.00 O ATOM 2255 CB VAL A 144 15.024 -4.082 10.309 1.00 0.00 C ATOM 2256 CG1 VAL A 144 14.233 -4.151 9.001 1.00 0.00 C ATOM 2257 CG2 VAL A 144 15.274 -5.501 10.829 1.00 0.00 C ATOM 0 H VAL A 144 15.757 -2.003 8.553 1.00 0.00 H new ATOM 0 HA VAL A 144 16.896 -3.294 11.018 1.00 0.00 H new ATOM 0 HB VAL A 144 14.452 -3.520 11.047 1.00 0.00 H new ATOM 0 HG11 VAL A 144 13.282 -4.654 9.177 1.00 0.00 H new ATOM 0 HG12 VAL A 144 14.047 -3.141 8.635 1.00 0.00 H new ATOM 0 HG13 VAL A 144 14.806 -4.707 8.258 1.00 0.00 H new ATOM 0 HG21 VAL A 144 14.320 -6.000 10.998 1.00 0.00 H new ATOM 0 HG22 VAL A 144 15.852 -6.061 10.094 1.00 0.00 H new ATOM 0 HG23 VAL A 144 15.829 -5.453 11.766 1.00 0.00 H new ATOM 2267 N GLU A 145 18.280 -4.782 9.539 1.00 0.00 N ATOM 2268 CA GLU A 145 19.146 -5.574 8.618 1.00 0.00 C ATOM 2269 C GLU A 145 18.840 -7.062 8.773 1.00 0.00 C ATOM 2270 O GLU A 145 19.118 -7.660 9.795 1.00 0.00 O ATOM 2271 CB GLU A 145 20.616 -5.330 8.953 1.00 0.00 C ATOM 2272 CG GLU A 145 20.904 -3.825 8.963 1.00 0.00 C ATOM 2273 CD GLU A 145 21.576 -3.439 10.283 1.00 0.00 C ATOM 2274 OE1 GLU A 145 22.587 -4.040 10.609 1.00 0.00 O ATOM 2275 OE2 GLU A 145 21.069 -2.548 10.945 1.00 0.00 O ATOM 0 H GLU A 145 18.587 -4.759 10.511 1.00 0.00 H new ATOM 0 HA GLU A 145 18.947 -5.264 7.592 1.00 0.00 H new ATOM 0 HB2 GLU A 145 20.853 -5.761 9.926 1.00 0.00 H new ATOM 0 HB3 GLU A 145 21.253 -5.826 8.220 1.00 0.00 H new ATOM 0 HG2 GLU A 145 21.549 -3.563 8.125 1.00 0.00 H new ATOM 0 HG3 GLU A 145 19.976 -3.266 8.839 1.00 0.00 H new ATOM 2282 N ASP A 146 18.230 -7.653 7.784 1.00 0.00 N ATOM 2283 CA ASP A 146 17.852 -9.091 7.888 1.00 0.00 C ATOM 2284 C ASP A 146 19.008 -9.994 7.446 1.00 0.00 C ATOM 2285 O ASP A 146 19.998 -9.548 6.900 1.00 0.00 O ATOM 2286 CB ASP A 146 16.640 -9.346 6.984 1.00 0.00 C ATOM 2287 CG ASP A 146 15.619 -10.216 7.720 1.00 0.00 C ATOM 2288 OD1 ASP A 146 14.904 -9.680 8.551 1.00 0.00 O ATOM 2289 OD2 ASP A 146 15.568 -11.402 7.438 1.00 0.00 O ATOM 0 H ASP A 146 17.976 -7.201 6.905 1.00 0.00 H new ATOM 0 HA ASP A 146 17.613 -9.320 8.927 1.00 0.00 H new ATOM 0 HB2 ASP A 146 16.184 -8.399 6.696 1.00 0.00 H new ATOM 0 HB3 ASP A 146 16.957 -9.840 6.065 1.00 0.00 H new ATOM 2294 N THR A 147 18.877 -11.269 7.705 1.00 0.00 N ATOM 2295 CA THR A 147 19.948 -12.244 7.340 1.00 0.00 C ATOM 2296 C THR A 147 20.158 -12.276 5.822 1.00 0.00 C ATOM 2297 O THR A 147 21.155 -12.779 5.341 1.00 0.00 O ATOM 2298 CB THR A 147 19.541 -13.637 7.824 1.00 0.00 C ATOM 2299 OG1 THR A 147 18.173 -13.863 7.514 1.00 0.00 O ATOM 2300 CG2 THR A 147 19.744 -13.732 9.337 1.00 0.00 C ATOM 0 H THR A 147 18.063 -11.681 8.160 1.00 0.00 H new ATOM 0 HA THR A 147 20.881 -11.937 7.813 1.00 0.00 H new ATOM 0 HB THR A 147 20.156 -14.388 7.328 1.00 0.00 H new ATOM 0 HG1 THR A 147 17.911 -14.756 7.822 1.00 0.00 H new ATOM 0 HG21 THR A 147 19.454 -14.725 9.681 1.00 0.00 H new ATOM 0 HG22 THR A 147 20.793 -13.558 9.575 1.00 0.00 H new ATOM 0 HG23 THR A 147 19.130 -12.981 9.834 1.00 0.00 H new ATOM 2308 N ASN A 148 19.237 -11.745 5.063 1.00 0.00 N ATOM 2309 CA ASN A 148 19.410 -11.754 3.582 1.00 0.00 C ATOM 2310 C ASN A 148 19.747 -10.339 3.098 1.00 0.00 C ATOM 2311 O ASN A 148 19.017 -9.407 3.370 1.00 0.00 O ATOM 2312 CB ASN A 148 18.122 -12.232 2.911 1.00 0.00 C ATOM 2313 CG ASN A 148 18.457 -12.836 1.546 1.00 0.00 C ATOM 2314 OD1 ASN A 148 19.023 -12.175 0.698 1.00 0.00 O ATOM 2315 ND2 ASN A 148 18.133 -14.075 1.296 1.00 0.00 N ATOM 0 H ASN A 148 18.379 -11.309 5.401 1.00 0.00 H new ATOM 0 HA ASN A 148 20.222 -12.432 3.320 1.00 0.00 H new ATOM 0 HB2 ASN A 148 17.625 -12.973 3.537 1.00 0.00 H new ATOM 0 HB3 ASN A 148 17.429 -11.399 2.793 1.00 0.00 H new ATOM 0 HD21 ASN A 148 18.355 -14.487 0.390 1.00 0.00 H new ATOM 0 HD22 ASN A 148 17.658 -14.631 2.007 1.00 0.00 H new ATOM 2322 N PRO A 149 20.849 -10.218 2.395 1.00 0.00 N ATOM 2323 CA PRO A 149 21.374 -8.931 1.823 1.00 0.00 C ATOM 2324 C PRO A 149 20.244 -8.173 1.125 1.00 0.00 C ATOM 2325 O PRO A 149 20.111 -6.973 1.262 1.00 0.00 O ATOM 2326 CB PRO A 149 22.457 -9.302 0.812 1.00 0.00 C ATOM 2327 CG PRO A 149 22.687 -10.795 0.909 1.00 0.00 C ATOM 2328 CD PRO A 149 21.795 -11.328 2.023 1.00 0.00 C ATOM 0 HA PRO A 149 21.777 -8.290 2.607 1.00 0.00 H new ATOM 0 HB2 PRO A 149 22.148 -9.028 -0.197 1.00 0.00 H new ATOM 0 HB3 PRO A 149 23.378 -8.759 1.022 1.00 0.00 H new ATOM 0 HG2 PRO A 149 22.449 -11.281 -0.037 1.00 0.00 H new ATOM 0 HG3 PRO A 149 23.734 -11.008 1.122 1.00 0.00 H new ATOM 0 HD2 PRO A 149 21.245 -12.208 1.690 1.00 0.00 H new ATOM 0 HD3 PRO A 149 22.391 -11.632 2.883 1.00 0.00 H new ATOM 2336 N ALA A 150 19.443 -8.864 0.361 1.00 0.00 N ATOM 2337 CA ALA A 150 18.334 -8.185 -0.365 1.00 0.00 C ATOM 2338 C ALA A 150 17.154 -7.941 0.579 1.00 0.00 C ATOM 2339 O ALA A 150 16.448 -6.958 0.448 1.00 0.00 O ATOM 2340 CB ALA A 150 17.878 -9.062 -1.533 1.00 0.00 C ATOM 0 H ALA A 150 19.509 -9.870 0.208 1.00 0.00 H new ATOM 0 HA ALA A 150 18.691 -7.226 -0.741 1.00 0.00 H new ATOM 0 HB1 ALA A 150 17.066 -8.566 -2.065 1.00 0.00 H new ATOM 0 HB2 ALA A 150 18.713 -9.224 -2.214 1.00 0.00 H new ATOM 0 HB3 ALA A 150 17.529 -10.022 -1.153 1.00 0.00 H new ATOM 2346 N LEU A 151 16.916 -8.824 1.518 1.00 0.00 N ATOM 2347 CA LEU A 151 15.762 -8.626 2.443 1.00 0.00 C ATOM 2348 C LEU A 151 16.022 -7.444 3.379 1.00 0.00 C ATOM 2349 O LEU A 151 15.144 -7.024 4.105 1.00 0.00 O ATOM 2350 CB LEU A 151 15.537 -9.891 3.274 1.00 0.00 C ATOM 2351 CG LEU A 151 15.013 -11.010 2.369 1.00 0.00 C ATOM 2352 CD1 LEU A 151 14.884 -12.304 3.177 1.00 0.00 C ATOM 2353 CD2 LEU A 151 13.638 -10.620 1.815 1.00 0.00 C ATOM 0 H LEU A 151 17.467 -9.666 1.682 1.00 0.00 H new ATOM 0 HA LEU A 151 14.874 -8.418 1.846 1.00 0.00 H new ATOM 0 HB2 LEU A 151 16.469 -10.198 3.748 1.00 0.00 H new ATOM 0 HB3 LEU A 151 14.824 -9.692 4.074 1.00 0.00 H new ATOM 0 HG LEU A 151 15.709 -11.162 1.544 1.00 0.00 H new ATOM 0 HD11 LEU A 151 14.511 -13.100 2.532 1.00 0.00 H new ATOM 0 HD12 LEU A 151 15.860 -12.585 3.573 1.00 0.00 H new ATOM 0 HD13 LEU A 151 14.189 -12.150 4.002 1.00 0.00 H new ATOM 0 HD21 LEU A 151 13.266 -11.417 1.171 1.00 0.00 H new ATOM 0 HD22 LEU A 151 12.943 -10.466 2.641 1.00 0.00 H new ATOM 0 HD23 LEU A 151 13.726 -9.699 1.239 1.00 0.00 H new ATOM 2365 N THR A 152 17.203 -6.881 3.363 1.00 0.00 N ATOM 2366 CA THR A 152 17.465 -5.710 4.246 1.00 0.00 C ATOM 2367 C THR A 152 16.556 -4.571 3.784 1.00 0.00 C ATOM 2368 O THR A 152 16.329 -4.402 2.601 1.00 0.00 O ATOM 2369 CB THR A 152 18.933 -5.288 4.124 1.00 0.00 C ATOM 2370 OG1 THR A 152 19.766 -6.416 4.348 1.00 0.00 O ATOM 2371 CG2 THR A 152 19.249 -4.205 5.160 1.00 0.00 C ATOM 0 H THR A 152 17.988 -7.179 2.783 1.00 0.00 H new ATOM 0 HA THR A 152 17.265 -5.961 5.288 1.00 0.00 H new ATOM 0 HB THR A 152 19.114 -4.891 3.125 1.00 0.00 H new ATOM 0 HG1 THR A 152 20.030 -6.803 3.488 1.00 0.00 H new ATOM 0 HG21 THR A 152 20.294 -3.908 5.069 1.00 0.00 H new ATOM 0 HG22 THR A 152 18.610 -3.339 4.988 1.00 0.00 H new ATOM 0 HG23 THR A 152 19.069 -4.596 6.161 1.00 0.00 H new ATOM 2379 N HIS A 153 16.020 -3.794 4.687 1.00 0.00 N ATOM 2380 CA HIS A 153 15.120 -2.691 4.245 1.00 0.00 C ATOM 2381 C HIS A 153 14.884 -1.691 5.376 1.00 0.00 C ATOM 2382 O HIS A 153 15.191 -1.941 6.525 1.00 0.00 O ATOM 2383 CB HIS A 153 13.776 -3.282 3.812 1.00 0.00 C ATOM 2384 CG HIS A 153 13.211 -4.124 4.925 1.00 0.00 C ATOM 2385 ND1 HIS A 153 13.828 -5.287 5.359 1.00 0.00 N ATOM 2386 CD2 HIS A 153 12.090 -3.982 5.707 1.00 0.00 C ATOM 2387 CE1 HIS A 153 13.083 -5.795 6.358 1.00 0.00 C ATOM 2388 NE2 HIS A 153 12.011 -5.039 6.610 1.00 0.00 N ATOM 0 H HIS A 153 16.163 -3.873 5.694 1.00 0.00 H new ATOM 0 HA HIS A 153 15.593 -2.170 3.413 1.00 0.00 H new ATOM 0 HB2 HIS A 153 13.080 -2.482 3.559 1.00 0.00 H new ATOM 0 HB3 HIS A 153 13.906 -3.887 2.915 1.00 0.00 H new ATOM 0 HD1 HIS A 153 14.691 -5.686 4.988 1.00 0.00 H new ATOM 0 HD2 HIS A 153 11.378 -3.173 5.633 1.00 0.00 H new ATOM 0 HE1 HIS A 153 13.323 -6.703 6.891 1.00 0.00 H new ATOM 2396 N THR A 154 14.319 -0.563 5.043 1.00 0.00 N ATOM 2397 CA THR A 154 14.030 0.475 6.068 1.00 0.00 C ATOM 2398 C THR A 154 12.592 0.965 5.879 1.00 0.00 C ATOM 2399 O THR A 154 12.030 0.856 4.807 1.00 0.00 O ATOM 2400 CB THR A 154 14.999 1.647 5.889 1.00 0.00 C ATOM 2401 OG1 THR A 154 16.327 1.150 5.797 1.00 0.00 O ATOM 2402 CG2 THR A 154 14.888 2.592 7.084 1.00 0.00 C ATOM 0 H THR A 154 14.043 -0.315 4.093 1.00 0.00 H new ATOM 0 HA THR A 154 14.151 0.058 7.068 1.00 0.00 H new ATOM 0 HB THR A 154 14.749 2.189 4.977 1.00 0.00 H new ATOM 0 HG1 THR A 154 16.959 1.898 5.825 1.00 0.00 H new ATOM 0 HG21 THR A 154 15.579 3.425 6.954 1.00 0.00 H new ATOM 0 HG22 THR A 154 13.869 2.973 7.153 1.00 0.00 H new ATOM 0 HG23 THR A 154 15.137 2.053 7.998 1.00 0.00 H new ATOM 2410 N TYR A 155 11.991 1.501 6.906 1.00 0.00 N ATOM 2411 CA TYR A 155 10.591 1.997 6.776 1.00 0.00 C ATOM 2412 C TYR A 155 10.603 3.524 6.819 1.00 0.00 C ATOM 2413 O TYR A 155 11.142 4.115 7.731 1.00 0.00 O ATOM 2414 CB TYR A 155 9.748 1.469 7.939 1.00 0.00 C ATOM 2415 CG TYR A 155 9.663 -0.036 7.868 1.00 0.00 C ATOM 2416 CD1 TYR A 155 8.862 -0.647 6.897 1.00 0.00 C ATOM 2417 CD2 TYR A 155 10.379 -0.821 8.780 1.00 0.00 C ATOM 2418 CE1 TYR A 155 8.777 -2.043 6.836 1.00 0.00 C ATOM 2419 CE2 TYR A 155 10.295 -2.217 8.719 1.00 0.00 C ATOM 2420 CZ TYR A 155 9.494 -2.828 7.747 1.00 0.00 C ATOM 2421 OH TYR A 155 9.410 -4.204 7.688 1.00 0.00 O ATOM 0 H TYR A 155 12.409 1.617 7.829 1.00 0.00 H new ATOM 0 HA TYR A 155 10.165 1.651 5.834 1.00 0.00 H new ATOM 0 HB2 TYR A 155 10.190 1.773 8.888 1.00 0.00 H new ATOM 0 HB3 TYR A 155 8.748 1.901 7.901 1.00 0.00 H new ATOM 0 HD1 TYR A 155 8.309 -0.041 6.194 1.00 0.00 H new ATOM 0 HD2 TYR A 155 10.996 -0.349 9.531 1.00 0.00 H new ATOM 0 HE1 TYR A 155 8.159 -2.514 6.086 1.00 0.00 H new ATOM 0 HE2 TYR A 155 10.848 -2.823 9.422 1.00 0.00 H new ATOM 0 HH TYR A 155 10.259 -4.570 7.364 1.00 0.00 H new ATOM 2431 N GLU A 156 10.034 4.171 5.838 1.00 0.00 N ATOM 2432 CA GLU A 156 10.039 5.661 5.837 1.00 0.00 C ATOM 2433 C GLU A 156 8.603 6.192 5.881 1.00 0.00 C ATOM 2434 O GLU A 156 7.781 5.858 5.050 1.00 0.00 O ATOM 2435 CB GLU A 156 10.723 6.163 4.565 1.00 0.00 C ATOM 2436 CG GLU A 156 12.239 6.210 4.776 1.00 0.00 C ATOM 2437 CD GLU A 156 12.787 7.540 4.251 1.00 0.00 C ATOM 2438 OE1 GLU A 156 12.759 7.735 3.047 1.00 0.00 O ATOM 2439 OE2 GLU A 156 13.223 8.340 5.062 1.00 0.00 O ATOM 0 H GLU A 156 9.569 3.735 5.042 1.00 0.00 H new ATOM 0 HA GLU A 156 10.579 6.016 6.715 1.00 0.00 H new ATOM 0 HB2 GLU A 156 10.483 5.506 3.729 1.00 0.00 H new ATOM 0 HB3 GLU A 156 10.351 7.155 4.308 1.00 0.00 H new ATOM 0 HG2 GLU A 156 12.473 6.101 5.835 1.00 0.00 H new ATOM 0 HG3 GLU A 156 12.715 5.378 4.257 1.00 0.00 H new ATOM 2446 N VAL A 157 8.301 7.026 6.842 1.00 0.00 N ATOM 2447 CA VAL A 157 6.926 7.595 6.945 1.00 0.00 C ATOM 2448 C VAL A 157 6.994 9.103 6.693 1.00 0.00 C ATOM 2449 O VAL A 157 7.744 9.810 7.337 1.00 0.00 O ATOM 2450 CB VAL A 157 6.371 7.334 8.347 1.00 0.00 C ATOM 2451 CG1 VAL A 157 4.911 7.790 8.415 1.00 0.00 C ATOM 2452 CG2 VAL A 157 6.455 5.836 8.662 1.00 0.00 C ATOM 0 H VAL A 157 8.952 7.338 7.563 1.00 0.00 H new ATOM 0 HA VAL A 157 6.274 7.127 6.208 1.00 0.00 H new ATOM 0 HB VAL A 157 6.958 7.891 9.077 1.00 0.00 H new ATOM 0 HG11 VAL A 157 4.518 7.603 9.414 1.00 0.00 H new ATOM 0 HG12 VAL A 157 4.852 8.856 8.195 1.00 0.00 H new ATOM 0 HG13 VAL A 157 4.322 7.236 7.684 1.00 0.00 H new ATOM 0 HG21 VAL A 157 6.059 5.651 9.661 1.00 0.00 H new ATOM 0 HG22 VAL A 157 5.870 5.277 7.931 1.00 0.00 H new ATOM 0 HG23 VAL A 157 7.495 5.513 8.618 1.00 0.00 H new ATOM 2462 N TRP A 158 6.223 9.606 5.763 1.00 0.00 N ATOM 2463 CA TRP A 158 6.264 11.071 5.477 1.00 0.00 C ATOM 2464 C TRP A 158 4.913 11.720 5.789 1.00 0.00 C ATOM 2465 O TRP A 158 3.905 11.058 5.937 1.00 0.00 O ATOM 2466 CB TRP A 158 6.579 11.301 3.998 1.00 0.00 C ATOM 2467 CG TRP A 158 7.898 10.692 3.645 1.00 0.00 C ATOM 2468 CD1 TRP A 158 8.175 9.369 3.661 1.00 0.00 C ATOM 2469 CD2 TRP A 158 9.119 11.359 3.212 1.00 0.00 C ATOM 2470 NE1 TRP A 158 9.486 9.183 3.261 1.00 0.00 N ATOM 2471 CE2 TRP A 158 10.110 10.380 2.978 1.00 0.00 C ATOM 2472 CE3 TRP A 158 9.457 12.706 3.004 1.00 0.00 C ATOM 2473 CZ2 TRP A 158 11.393 10.725 2.551 1.00 0.00 C ATOM 2474 CZ3 TRP A 158 10.747 13.059 2.574 1.00 0.00 C ATOM 2475 CH2 TRP A 158 11.713 12.070 2.349 1.00 0.00 C ATOM 0 H TRP A 158 5.570 9.069 5.192 1.00 0.00 H new ATOM 0 HA TRP A 158 7.036 11.517 6.104 1.00 0.00 H new ATOM 0 HB2 TRP A 158 5.793 10.866 3.380 1.00 0.00 H new ATOM 0 HB3 TRP A 158 6.596 12.370 3.785 1.00 0.00 H new ATOM 0 HD1 TRP A 158 7.486 8.586 3.940 1.00 0.00 H new ATOM 0 HE1 TRP A 158 9.937 8.271 3.185 1.00 0.00 H new ATOM 0 HE3 TRP A 158 8.720 13.476 3.176 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 12.133 9.958 2.378 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 10.995 14.098 2.416 1.00 0.00 H new ATOM 0 HH2 TRP A 158 12.704 12.347 2.020 1.00 0.00 H new ATOM 2486 N GLN A 159 4.893 13.024 5.847 1.00 0.00 N ATOM 2487 CA GLN A 159 3.625 13.765 6.105 1.00 0.00 C ATOM 2488 C GLN A 159 3.587 14.962 5.153 1.00 0.00 C ATOM 2489 O GLN A 159 4.611 15.552 4.864 1.00 0.00 O ATOM 2490 CB GLN A 159 3.599 14.257 7.555 1.00 0.00 C ATOM 2491 CG GLN A 159 3.299 13.083 8.490 1.00 0.00 C ATOM 2492 CD GLN A 159 2.927 13.615 9.876 1.00 0.00 C ATOM 2493 OE1 GLN A 159 3.700 14.316 10.498 1.00 0.00 O ATOM 2494 NE2 GLN A 159 1.767 13.309 10.389 1.00 0.00 N ATOM 0 H GLN A 159 5.714 13.616 5.725 1.00 0.00 H new ATOM 0 HA GLN A 159 2.763 13.118 5.943 1.00 0.00 H new ATOM 0 HB2 GLN A 159 4.558 14.706 7.815 1.00 0.00 H new ATOM 0 HB3 GLN A 159 2.842 15.032 7.673 1.00 0.00 H new ATOM 0 HG2 GLN A 159 2.482 12.484 8.088 1.00 0.00 H new ATOM 0 HG3 GLN A 159 4.169 12.430 8.561 1.00 0.00 H new ATOM 0 HE21 GLN A 159 1.118 12.720 9.867 1.00 0.00 H new ATOM 0 HE22 GLN A 159 1.509 13.658 11.312 1.00 0.00 H new ATOM 2503 N LYS A 160 2.439 15.331 4.646 1.00 0.00 N ATOM 2504 CA LYS A 160 2.388 16.487 3.704 1.00 0.00 C ATOM 2505 C LYS A 160 2.442 17.803 4.483 1.00 0.00 C ATOM 2506 O LYS A 160 1.714 18.003 5.435 1.00 0.00 O ATOM 2507 CB LYS A 160 1.087 16.429 2.900 1.00 0.00 C ATOM 2508 CG LYS A 160 1.154 17.430 1.741 1.00 0.00 C ATOM 2509 CD LYS A 160 -0.157 18.220 1.662 1.00 0.00 C ATOM 2510 CE LYS A 160 -0.974 17.739 0.461 1.00 0.00 C ATOM 2511 NZ LYS A 160 -1.951 18.795 0.071 1.00 0.00 N ATOM 0 H LYS A 160 1.542 14.886 4.842 1.00 0.00 H new ATOM 0 HA LYS A 160 3.243 16.435 3.030 1.00 0.00 H new ATOM 0 HB2 LYS A 160 0.930 15.421 2.515 1.00 0.00 H new ATOM 0 HB3 LYS A 160 0.239 16.660 3.544 1.00 0.00 H new ATOM 0 HG2 LYS A 160 1.992 18.112 1.885 1.00 0.00 H new ATOM 0 HG3 LYS A 160 1.329 16.903 0.803 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -0.729 18.088 2.580 1.00 0.00 H new ATOM 0 HD3 LYS A 160 0.054 19.285 1.568 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -0.313 17.513 -0.376 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -1.499 16.817 0.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -2.507 18.469 -0.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -2.589 18.989 0.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -1.440 19.664 -0.183 1.00 0.00 H new ATOM 2525 N LYS A 161 3.303 18.700 4.082 1.00 0.00 N ATOM 2526 CA LYS A 161 3.412 20.006 4.793 1.00 0.00 C ATOM 2527 C LYS A 161 2.589 21.065 4.056 1.00 0.00 C ATOM 2528 O LYS A 161 2.037 20.817 3.001 1.00 0.00 O ATOM 2529 CB LYS A 161 4.878 20.443 4.833 1.00 0.00 C ATOM 2530 CG LYS A 161 5.707 19.397 5.586 1.00 0.00 C ATOM 2531 CD LYS A 161 6.055 19.925 6.980 1.00 0.00 C ATOM 2532 CE LYS A 161 4.967 19.506 7.971 1.00 0.00 C ATOM 2533 NZ LYS A 161 5.037 20.372 9.181 1.00 0.00 N ATOM 0 H LYS A 161 3.937 18.584 3.291 1.00 0.00 H new ATOM 0 HA LYS A 161 3.034 19.895 5.809 1.00 0.00 H new ATOM 0 HB2 LYS A 161 5.260 20.563 3.819 1.00 0.00 H new ATOM 0 HB3 LYS A 161 4.966 21.413 5.323 1.00 0.00 H new ATOM 0 HG2 LYS A 161 5.148 18.465 5.668 1.00 0.00 H new ATOM 0 HG3 LYS A 161 6.619 19.174 5.032 1.00 0.00 H new ATOM 0 HD2 LYS A 161 7.021 19.534 7.298 1.00 0.00 H new ATOM 0 HD3 LYS A 161 6.143 21.011 6.958 1.00 0.00 H new ATOM 0 HE2 LYS A 161 3.985 19.591 7.506 1.00 0.00 H new ATOM 0 HE3 LYS A 161 5.098 18.461 8.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 4.298 20.087 9.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 5.971 20.270 9.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 4.892 21.365 8.906 1.00 0.00 H new ATOM 2547 N ALA A 162 2.508 22.246 4.608 1.00 0.00 N ATOM 2548 CA ALA A 162 1.725 23.331 3.949 1.00 0.00 C ATOM 2549 C ALA A 162 2.534 24.630 3.972 1.00 0.00 C ATOM 2550 O ALA A 162 3.673 24.588 4.406 1.00 0.00 O ATOM 2551 CB ALA A 162 0.407 23.538 4.697 1.00 0.00 C ATOM 2552 OXT ALA A 162 2.000 25.644 3.553 1.00 0.00 O ATOM 0 H ALA A 162 2.951 22.507 5.489 1.00 0.00 H new ATOM 0 HA ALA A 162 1.516 23.051 2.917 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -0.164 24.331 4.215 1.00 0.00 H new ATOM 0 HB2 ALA A 162 -0.170 22.613 4.680 1.00 0.00 H new ATOM 0 HB3 ALA A 162 0.615 23.817 5.730 1.00 0.00 H new TER 2558 ALA A 162 HETATM 2559 PA NDP A 168 -3.710 -4.688 -10.878 1.00 0.00 P HETATM 2560 O1A NDP A 168 -3.069 -5.313 -12.052 1.00 0.00 O HETATM 2561 O2A NDP A 168 -3.679 -5.433 -9.602 1.00 0.00 O HETATM 2562 O5B NDP A 168 -5.181 -4.178 -11.218 1.00 0.00 O HETATM 2563 C5B NDP A 168 -5.847 -3.220 -10.375 1.00 0.00 C HETATM 2564 C4B NDP A 168 -7.342 -3.313 -10.564 1.00 0.00 C HETATM 2565 O4B NDP A 168 -8.009 -2.407 -9.646 1.00 0.00 O HETATM 2566 C3B NDP A 168 -7.874 -2.919 -11.932 1.00 0.00 C HETATM 2567 O3B NDP A 168 -7.788 -4.014 -12.849 1.00 0.00 O HETATM 2568 C2B NDP A 168 -9.325 -2.570 -11.620 1.00 0.00 C HETATM 2569 O2B NDP A 168 -10.164 -3.702 -11.523 1.00 0.00 O HETATM 2570 C1B NDP A 168 -9.190 -1.904 -10.248 1.00 0.00 C HETATM 2571 N9A NDP A 168 -9.089 -0.446 -10.312 1.00 0.00 N HETATM 2572 C8A NDP A 168 -7.954 0.318 -10.422 1.00 0.00 C HETATM 2573 N7A NDP A 168 -8.186 1.609 -10.449 1.00 0.00 N HETATM 2574 C5A NDP A 168 -9.567 1.700 -10.352 1.00 0.00 C HETATM 2575 C6A NDP A 168 -10.447 2.800 -10.322 1.00 0.00 C HETATM 2576 N6A NDP A 168 -10.044 4.072 -10.389 1.00 0.00 N HETATM 2577 N1A NDP A 168 -11.772 2.545 -10.221 1.00 0.00 N HETATM 2578 C2A NDP A 168 -12.176 1.269 -10.151 1.00 0.00 C HETATM 2579 N3A NDP A 168 -11.447 0.153 -10.167 1.00 0.00 N HETATM 2580 C4A NDP A 168 -10.137 0.441 -10.269 1.00 0.00 C HETATM 2581 O3 NDP A 168 -3.008 -3.220 -10.622 1.00 0.00 O HETATM 2582 PN NDP A 168 -2.077 -2.576 -9.425 1.00 0.00 P HETATM 2583 O1N NDP A 168 -2.960 -1.829 -8.511 1.00 0.00 O HETATM 2584 O2N NDP A 168 -0.961 -1.844 -10.053 1.00 0.00 O HETATM 2585 O5D NDP A 168 -1.586 -3.951 -8.782 1.00 0.00 O HETATM 2586 C5D NDP A 168 -1.030 -4.982 -9.618 1.00 0.00 C HETATM 2587 C4D NDP A 168 0.136 -5.662 -8.935 1.00 0.00 C HETATM 2588 O4D NDP A 168 1.016 -4.670 -8.341 1.00 0.00 O HETATM 2589 C3D NDP A 168 -0.191 -6.584 -7.773 1.00 0.00 C HETATM 2590 O3D NDP A 168 -0.596 -7.874 -8.243 1.00 0.00 O HETATM 2591 C2D NDP A 168 1.148 -6.662 -7.050 1.00 0.00 C HETATM 2592 O2D NDP A 168 2.064 -7.588 -7.640 1.00 0.00 O HETATM 2593 C1D NDP A 168 1.664 -5.230 -7.208 1.00 0.00 C HETATM 2594 N1N NDP A 168 1.384 -4.398 -6.038 1.00 0.00 N HETATM 2595 C2N NDP A 168 2.222 -3.789 -5.206 1.00 0.00 C HETATM 2596 C3N NDP A 168 1.917 -3.150 -4.121 1.00 0.00 C HETATM 2597 C7N NDP A 168 3.110 -2.687 -3.470 1.00 0.00 C HETATM 2598 O7N NDP A 168 2.667 -2.040 -2.415 1.00 0.00 O HETATM 2599 N7N NDP A 168 4.419 -2.834 -3.798 1.00 0.00 N HETATM 2600 C4N NDP A 168 0.465 -3.066 -3.744 1.00 0.00 C HETATM 2601 C5N NDP A 168 -0.502 -3.699 -4.602 1.00 0.00 C HETATM 2602 C6N NDP A 168 -0.133 -4.379 -5.761 1.00 0.00 C HETATM 2603 P2B NDP A 168 -10.924 -4.531 -12.757 1.00 0.00 P HETATM 2604 O1X NDP A 168 -12.122 -5.112 -11.908 1.00 0.00 O HETATM 2605 O2X NDP A 168 -11.422 -3.363 -13.608 1.00 0.00 O HETATM 2606 O3X NDP A 168 -9.901 -5.637 -13.015 1.00 0.00 O HETATM 0 HO3N NDP A 168 -0.800 -8.452 -7.478 1.00 0.00 H new HETATM 0 HO3A NDP A 168 -8.412 -4.719 -12.576 1.00 0.00 H new HETATM 0 HO2N NDP A 168 2.065 -8.421 -7.124 1.00 0.00 H new HETATM 0 H72N NDP A 168 5.142 -2.428 -3.204 1.00 0.00 H new HETATM 0 H71N NDP A 168 4.679 -3.350 -4.638 1.00 0.00 H new HETATM 0 H62A NDP A 168 -10.730 4.826 -10.363 1.00 0.00 H new HETATM 0 H61A NDP A 168 -9.050 4.289 -10.467 1.00 0.00 H new HETATM 0 H52N NDP A 168 -1.798 -5.718 -9.853 1.00 0.00 H new HETATM 0 H52A NDP A 168 -5.593 -3.404 -9.331 1.00 0.00 H new HETATM 0 H51N NDP A 168 -0.701 -4.551 -10.564 1.00 0.00 H new HETATM 0 H51A NDP A 168 -5.504 -2.213 -10.614 1.00 0.00 H new HETATM 0 H42N NDP A 168 0.355 -3.494 -2.748 1.00 0.00 H new HETATM 0 H41N NDP A 168 0.202 -2.011 -3.669 1.00 0.00 H new HETATM 0 H8A NDP A 168 -6.953 -0.108 -10.481 1.00 0.00 H new HETATM 0 H6N NDP A 168 -0.858 -4.859 -6.419 1.00 0.00 H new HETATM 0 H5N NDP A 168 -1.558 -3.645 -4.336 1.00 0.00 H new HETATM 0 H4D NDP A 168 0.563 -6.252 -9.746 1.00 0.00 H new HETATM 0 H4B NDP A 168 -7.545 -4.372 -10.404 1.00 0.00 H new HETATM 0 H3D NDP A 168 -1.012 -6.234 -7.147 1.00 0.00 H new HETATM 0 H3B NDP A 168 -7.322 -2.107 -12.405 1.00 0.00 H new HETATM 0 H2N NDP A 168 3.280 -3.832 -5.464 1.00 0.00 H new HETATM 0 H2D NDP A 168 1.045 -7.014 -6.023 1.00 0.00 H new HETATM 0 H2B NDP A 168 -9.782 -1.960 -12.399 1.00 0.00 H new HETATM 0 H2A NDP A 168 -13.253 1.123 -10.069 1.00 0.00 H new HETATM 0 H1D NDP A 168 2.747 -5.260 -7.324 1.00 0.00 H new HETATM 0 H1B NDP A 168 -10.090 -2.133 -9.678 1.00 0.00 H new HETATM 2633 N1 TRR A 170 4.235 -4.545 1.528 1.00 0.00 N HETATM 2634 C2 TRR A 170 4.132 -3.282 2.066 1.00 0.00 C HETATM 2635 N2 TRR A 170 5.184 -2.748 2.773 1.00 0.00 N HETATM 2636 N3 TRR A 170 2.976 -2.554 1.898 1.00 0.00 N HETATM 2637 C4 TRR A 170 1.919 -3.083 1.191 1.00 0.00 C HETATM 2638 N4 TRR A 170 0.772 -2.348 1.030 1.00 0.00 N HETATM 2639 C5 TRR A 170 2.016 -4.359 0.646 1.00 0.00 C HETATM 2640 C6 TRR A 170 3.187 -5.087 0.820 1.00 0.00 C HETATM 2641 C7 TRR A 170 0.859 -4.942 -0.129 1.00 0.00 C HETATM 2642 C11 TRR A 170 0.921 -6.443 -0.258 1.00 0.00 C HETATM 2643 C12 TRR A 170 1.318 -7.021 -1.461 1.00 0.00 C HETATM 2644 C13 TRR A 170 1.377 -8.416 -1.585 1.00 0.00 C HETATM 2645 C14 TRR A 170 1.038 -9.223 -0.499 1.00 0.00 C HETATM 2646 C15 TRR A 170 0.640 -8.648 0.707 1.00 0.00 C HETATM 2647 C16 TRR A 170 0.583 -7.251 0.826 1.00 0.00 C HETATM 2648 O13 TRR A 170 1.771 -9.010 -2.782 1.00 0.00 O HETATM 2649 O14 TRR A 170 1.094 -10.596 -0.619 1.00 0.00 O HETATM 2650 O15 TRR A 170 0.308 -9.473 1.781 1.00 0.00 O HETATM 2651 C17 TRR A 170 2.109 -8.192 -3.874 1.00 0.00 C HETATM 2652 C18 TRR A 170 2.300 -11.233 -0.305 1.00 0.00 C HETATM 2653 C19 TRR A 170 -0.082 -8.893 3.000 1.00 0.00 C HETATM 0 H193 TRR A 170 0.726 -8.267 3.380 1.00 0.00 H new HETATM 0 H192 TRR A 170 -0.971 -8.282 2.844 1.00 0.00 H new HETATM 0 H191 TRR A 170 -0.303 -9.679 3.722 1.00 0.00 H new HETATM 0 H183 TRR A 170 3.089 -10.859 -0.957 1.00 0.00 H new HETATM 0 H182 TRR A 170 2.560 -11.028 0.734 1.00 0.00 H new HETATM 0 H181 TRR A 170 2.191 -12.308 -0.447 1.00 0.00 H new HETATM 0 H173 TRR A 170 1.252 -7.576 -4.146 1.00 0.00 H new HETATM 0 H172 TRR A 170 2.946 -7.549 -3.602 1.00 0.00 H new HETATM 0 H171 TRR A 170 2.391 -8.816 -4.722 1.00 0.00 H new HETATM 0 H72 TRR A 170 -0.074 -4.665 0.362 1.00 0.00 H new HETATM 0 H71 TRR A 170 0.839 -4.500 -1.125 1.00 0.00 H new HETATM 0 H6 TRR A 170 3.275 -6.087 0.396 1.00 0.00 H new HETATM 0 H42 TRR A 170 -0.013 -2.736 0.507 1.00 0.00 H new HETATM 0 H41 TRR A 170 0.704 -1.413 1.433 1.00 0.00 H new HETATM 0 H22 TRR A 170 5.108 -1.812 3.172 1.00 0.00 H new HETATM 0 H21 TRR A 170 6.040 -3.288 2.899 1.00 0.00 H new HETATM 0 H16 TRR A 170 0.274 -6.797 1.768 1.00 0.00 H new HETATM 0 H12 TRR A 170 1.583 -6.388 -2.308 1.00 0.00 H new HETATM 0 H1 TRR A 170 5.093 -5.082 1.655 1.00 0.00 H new