USER MOD reduce.3.24.130724 H: found=0, std=0, add=1267, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1267 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 112 THR OG1 : rot 180:sc= -1.48 USER MOD Set 1.2: A 159 GLN : amide:sc= -1.48 X(o=-3,f=-3.3) USER MOD Set 2.1: A 39 MET CE :methyl 160:sc= -0.363 (180deg=-0.374) USER MOD Set 2.2: A 59 ASN : amide:sc= -0.179 K(o=-0.54,f=-7.2!) USER MOD Single : A 1 THR N :NH3+ -140:sc= 0.162 (180deg=0.00661) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0.0954 USER MOD Single : A 7 GLN : amide:sc= -3.7 K(o=-3.7,f=-4.3) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS :FLIP no HD1:sc= -0.947 F(o=-1.7,f=-0.95) USER MOD Single : A 22 HIS : no HE2:sc= -0.434 K(o=-0.43,f=-2.4) USER MOD Single : A 28 HIS : no HD1:sc= -0.146 X(o=-0.15,f=-0.06) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.312 K(o=-0.31,f=-2.3!) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0.00342 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot -100:sc= -0.737 USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot 64:sc= 0.0985 USER MOD Single : A 63 THR OG1 : rot 107:sc= -1.69! USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 65 GLN : amide:sc= -0.0373 X(o=-0.037,f=-0.24) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -0.124 X(o=-0.12,f=-0.009) USER MOD Single : A 71 GLN : amide:sc= -0.0373 K(o=-0.037,f=-1.2) USER MOD Single : A 77 HIS :FLIP no HD1:sc= -0.626 F(o=-2.3!,f=-0.63) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= -0.333 X(o=-0.33,f=-0.33) USER MOD Single : A 89 HIS : no HD1:sc= -0.284 X(o=-0.28,f=0) USER MOD Single : A 92 GLN : amide:sc= -0.543 K(o=-0.54,f=-3.9!) USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 150:sc= -2.45 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 126 THR OG1 : rot -59:sc= 1.15 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 132 ASN : amide:sc= 0 K(o=0,f=-0.89) 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 40:sc= 0.478 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 ASN : amide:sc= -1.14 K(o=-1.1,f=-3.1!) USER MOD Single : A 152 THR OG1 : rot -157:sc= 1.29 USER MOD Single : A 153 HIS : no HD1:sc= 0 X(o=0,f=-0.05) USER MOD Single : A 154 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 TYR OH : rot -123:sc= 1.4 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 ----------------------------------------------------------------- ATOM 1 N THR A 1 -12.048 -4.375 4.099 1.00 1.00 N ATOM 2 CA THR A 1 -10.824 -3.542 4.220 1.00 1.00 C ATOM 3 C THR A 1 -9.599 -4.247 3.631 1.00 1.00 C ATOM 4 O THR A 1 -9.439 -5.456 3.777 1.00 1.00 O ATOM 5 CB THR A 1 -10.571 -3.252 5.699 1.00 1.00 C ATOM 6 OG1 THR A 1 -10.772 -4.430 6.469 1.00 1.00 O ATOM 7 CG2 THR A 1 -11.468 -2.181 6.264 1.00 1.00 C ATOM 0 H1 THR A 1 -12.855 -3.771 3.844 1.00 1.00 H new ATOM 0 H2 THR A 1 -11.907 -5.094 3.361 1.00 1.00 H new ATOM 0 H3 THR A 1 -12.240 -4.844 5.007 1.00 1.00 H new ATOM 0 HA THR A 1 -10.981 -2.618 3.663 1.00 1.00 H new ATOM 0 HB THR A 1 -9.541 -2.901 5.757 1.00 1.00 H new ATOM 0 HG1 THR A 1 -10.606 -4.235 7.415 1.00 1.00 H new ATOM 0 HG21 THR A 1 -11.233 -2.028 7.317 1.00 1.00 H new ATOM 0 HG22 THR A 1 -11.312 -1.250 5.718 1.00 1.00 H new ATOM 0 HG23 THR A 1 -12.509 -2.489 6.166 1.00 1.00 H new ATOM 17 N ALA A 2 -8.737 -3.478 2.965 1.00 1.00 N ATOM 18 CA ALA A 2 -7.526 -4.031 2.372 1.00 1.00 C ATOM 19 C ALA A 2 -6.327 -3.127 2.616 1.00 1.00 C ATOM 20 O ALA A 2 -6.466 -1.904 2.664 1.00 1.00 O ATOM 21 CB ALA A 2 -7.720 -4.263 0.871 1.00 1.00 C ATOM 0 H ALA A 2 -8.857 -2.475 2.825 1.00 1.00 H new ATOM 0 HA ALA A 2 -7.329 -4.989 2.853 1.00 1.00 H new ATOM 0 HB1 ALA A 2 -6.805 -4.676 0.445 1.00 1.00 H new ATOM 0 HB2 ALA A 2 -8.541 -4.962 0.714 1.00 1.00 H new ATOM 0 HB3 ALA A 2 -7.952 -3.316 0.383 1.00 1.00 H new ATOM 27 N PHE A 3 -5.160 -3.724 2.780 1.00 1.00 N ATOM 28 CA PHE A 3 -3.945 -2.949 3.017 1.00 1.00 C ATOM 29 C PHE A 3 -2.994 -3.073 1.838 1.00 1.00 C ATOM 30 O PHE A 3 -2.709 -4.185 1.369 1.00 1.00 O ATOM 31 CB PHE A 3 -3.262 -3.433 4.304 1.00 1.00 C ATOM 32 CG PHE A 3 -3.733 -2.743 5.556 1.00 1.00 C ATOM 33 CD1 PHE A 3 -4.949 -2.079 5.599 1.00 1.00 C ATOM 34 CD2 PHE A 3 -2.957 -2.784 6.704 1.00 1.00 C ATOM 35 CE1 PHE A 3 -5.383 -1.471 6.760 1.00 1.00 C ATOM 36 CE2 PHE A 3 -3.385 -2.177 7.869 1.00 1.00 C ATOM 37 CZ PHE A 3 -4.599 -1.519 7.897 1.00 1.00 C ATOM 0 H PHE A 3 -5.023 -4.734 2.755 1.00 1.00 H new ATOM 0 HA PHE A 3 -4.215 -1.899 3.130 1.00 1.00 H new ATOM 0 HB2 PHE A 3 -3.431 -4.505 4.409 1.00 1.00 H new ATOM 0 HB3 PHE A 3 -2.186 -3.288 4.207 1.00 1.00 H new ATOM 0 HD1 PHE A 3 -5.565 -2.037 4.713 1.00 1.00 H new ATOM 0 HD2 PHE A 3 -2.007 -3.297 6.687 1.00 1.00 H new ATOM 0 HE1 PHE A 3 -6.334 -0.959 6.780 1.00 1.00 H new ATOM 0 HE2 PHE A 3 -2.771 -2.217 8.757 1.00 1.00 H new ATOM 0 HZ PHE A 3 -4.935 -1.043 8.806 1.00 1.00 H new ATOM 47 N LEU A 4 -2.501 -1.936 1.354 1.00 1.00 N ATOM 48 CA LEU A 4 -1.585 -1.933 0.215 1.00 1.00 C ATOM 49 C LEU A 4 -0.183 -1.475 0.625 1.00 1.00 C ATOM 50 O LEU A 4 -0.016 -0.386 1.177 1.00 1.00 O ATOM 51 CB LEU A 4 -2.130 -1.034 -0.892 1.00 1.00 C ATOM 52 CG LEU A 4 -3.414 -1.525 -1.559 1.00 1.00 C ATOM 53 CD1 LEU A 4 -3.860 -0.558 -2.647 1.00 1.00 C ATOM 54 CD2 LEU A 4 -3.221 -2.923 -2.128 1.00 1.00 C ATOM 0 H LEU A 4 -2.717 -1.012 1.728 1.00 1.00 H new ATOM 0 HA LEU A 4 -1.507 -2.955 -0.156 1.00 1.00 H new ATOM 0 HB2 LEU A 4 -2.312 -0.043 -0.476 1.00 1.00 H new ATOM 0 HB3 LEU A 4 -1.362 -0.922 -1.658 1.00 1.00 H new ATOM 0 HG LEU A 4 -4.197 -1.569 -0.802 1.00 1.00 H new ATOM 0 HD11 LEU A 4 -4.776 -0.927 -3.109 1.00 1.00 H new ATOM 0 HD12 LEU A 4 -4.044 0.423 -2.209 1.00 1.00 H new ATOM 0 HD13 LEU A 4 -3.080 -0.477 -3.404 1.00 1.00 H new ATOM 0 HD21 LEU A 4 -4.146 -3.255 -2.599 1.00 1.00 H new ATOM 0 HD22 LEU A 4 -2.422 -2.907 -2.869 1.00 1.00 H new ATOM 0 HD23 LEU A 4 -2.956 -3.610 -1.324 1.00 1.00 H new ATOM 66 N TRP A 5 0.820 -2.302 0.347 1.00 1.00 N ATOM 67 CA TRP A 5 2.187 -1.966 0.683 1.00 1.00 C ATOM 68 C TRP A 5 3.171 -2.604 -0.286 1.00 1.00 C ATOM 69 O TRP A 5 2.846 -3.602 -0.957 1.00 1.00 O ATOM 70 CB TRP A 5 2.490 -2.393 2.119 1.00 1.00 C ATOM 71 CG TRP A 5 3.078 -3.761 2.229 1.00 1.00 C ATOM 72 CD1 TRP A 5 4.369 -4.126 1.976 1.00 1.00 C ATOM 73 CD2 TRP A 5 2.397 -4.954 2.636 1.00 1.00 C ATOM 74 NE1 TRP A 5 4.531 -5.470 2.199 1.00 1.00 N ATOM 75 CE2 TRP A 5 3.337 -6.001 2.604 1.00 1.00 C ATOM 76 CE3 TRP A 5 1.084 -5.239 3.026 1.00 1.00 C ATOM 77 CZ2 TRP A 5 3.008 -7.308 2.946 1.00 1.00 C ATOM 78 CZ3 TRP A 5 0.758 -6.540 3.365 1.00 1.00 C ATOM 79 CH2 TRP A 5 1.717 -7.559 3.322 1.00 1.00 C ATOM 0 H TRP A 5 0.706 -3.207 -0.110 1.00 1.00 H new ATOM 0 HA TRP A 5 2.303 -0.885 0.601 1.00 1.00 H new ATOM 0 HB2 TRP A 5 3.178 -1.675 2.564 1.00 1.00 H new ATOM 0 HB3 TRP A 5 1.569 -2.355 2.701 1.00 1.00 H new ATOM 0 HD1 TRP A 5 5.149 -3.455 1.648 1.00 1.00 H new ATOM 0 HE1 TRP A 5 5.401 -5.989 2.082 1.00 1.00 H new ATOM 0 HE3 TRP A 5 0.339 -4.458 3.062 1.00 1.00 H new ATOM 0 HZ2 TRP A 5 3.745 -8.097 2.916 1.00 1.00 H new ATOM 0 HZ3 TRP A 5 -0.252 -6.773 3.668 1.00 1.00 H new ATOM 0 HH2 TRP A 5 1.431 -8.565 3.592 1.00 1.00 H new ATOM 90 N ALA A 6 4.373 -2.038 -0.349 1.00 1.00 N ATOM 91 CA ALA A 6 5.414 -2.549 -1.208 1.00 1.00 C ATOM 92 C ALA A 6 6.716 -2.677 -0.437 1.00 1.00 C ATOM 93 O ALA A 6 7.036 -1.831 0.393 1.00 1.00 O ATOM 94 CB ALA A 6 5.589 -1.622 -2.416 1.00 1.00 C ATOM 0 H ALA A 6 4.643 -1.218 0.194 1.00 1.00 H new ATOM 0 HA ALA A 6 5.131 -3.539 -1.564 1.00 1.00 H new ATOM 0 HB1 ALA A 6 6.376 -2.011 -3.062 1.00 1.00 H new ATOM 0 HB2 ALA A 6 4.654 -1.570 -2.974 1.00 1.00 H new ATOM 0 HB3 ALA A 6 5.862 -0.624 -2.072 1.00 1.00 H new ATOM 100 N GLN A 7 7.469 -3.732 -0.703 1.00 1.00 N ATOM 101 CA GLN A 7 8.730 -3.948 -0.010 1.00 1.00 C ATOM 102 C GLN A 7 9.812 -4.487 -0.953 1.00 1.00 C ATOM 103 O GLN A 7 9.521 -5.184 -1.924 1.00 1.00 O ATOM 104 CB GLN A 7 8.494 -4.932 1.144 1.00 1.00 C ATOM 105 CG GLN A 7 9.751 -5.457 1.832 1.00 1.00 C ATOM 106 CD GLN A 7 9.967 -6.949 1.612 1.00 1.00 C ATOM 107 OE1 GLN A 7 10.434 -7.653 2.506 1.00 1.00 O ATOM 108 NE2 GLN A 7 9.635 -7.431 0.420 1.00 1.00 N ATOM 0 H GLN A 7 7.232 -4.448 -1.389 1.00 1.00 H new ATOM 0 HA GLN A 7 9.086 -2.992 0.374 1.00 1.00 H new ATOM 0 HB2 GLN A 7 7.869 -4.444 1.892 1.00 1.00 H new ATOM 0 HB3 GLN A 7 7.928 -5.782 0.763 1.00 1.00 H new ATOM 0 HG2 GLN A 7 10.618 -4.911 1.460 1.00 1.00 H new ATOM 0 HG3 GLN A 7 9.684 -5.258 2.902 1.00 1.00 H new ATOM 0 HE21 GLN A 7 9.251 -6.810 -0.292 1.00 1.00 H new ATOM 0 HE22 GLN A 7 9.764 -8.422 0.217 1.00 1.00 H new ATOM 117 N ASP A 8 11.068 -4.186 -0.632 1.00 1.00 N ATOM 118 CA ASP A 8 12.194 -4.661 -1.430 1.00 1.00 C ATOM 119 C ASP A 8 12.421 -6.137 -1.163 1.00 1.00 C ATOM 120 O ASP A 8 12.067 -6.644 -0.098 1.00 1.00 O ATOM 121 CB ASP A 8 13.457 -3.861 -1.104 1.00 1.00 C ATOM 122 CG ASP A 8 13.355 -2.408 -1.511 1.00 1.00 C ATOM 123 OD1 ASP A 8 13.596 -2.105 -2.700 1.00 1.00 O ATOM 124 OD2 ASP A 8 13.035 -1.570 -0.643 1.00 1.00 O ATOM 0 H ASP A 8 11.331 -3.617 0.173 1.00 1.00 H new ATOM 0 HA ASP A 8 11.964 -4.520 -2.486 1.00 1.00 H new ATOM 0 HB2 ASP A 8 13.652 -3.920 -0.033 1.00 1.00 H new ATOM 0 HB3 ASP A 8 14.309 -4.316 -1.609 1.00 1.00 H new ATOM 129 N ARG A 9 13.011 -6.831 -2.137 1.00 1.00 N ATOM 130 CA ARG A 9 13.270 -8.260 -1.999 1.00 1.00 C ATOM 131 C ARG A 9 14.191 -8.524 -0.814 1.00 1.00 C ATOM 132 O ARG A 9 13.970 -9.462 -0.053 1.00 1.00 O ATOM 133 CB ARG A 9 13.885 -8.837 -3.271 1.00 1.00 C ATOM 134 CG ARG A 9 15.092 -8.068 -3.779 1.00 1.00 C ATOM 135 CD ARG A 9 15.814 -8.807 -4.901 1.00 1.00 C ATOM 136 NE ARG A 9 14.894 -9.448 -5.823 1.00 1.00 N ATOM 137 CZ ARG A 9 15.240 -10.380 -6.709 1.00 1.00 C ATOM 138 NH1 ARG A 9 16.504 -10.776 -6.814 1.00 1.00 N ATOM 139 NH2 ARG A 9 14.319 -10.923 -7.492 1.00 1.00 N ATOM 0 H ARG A 9 13.316 -6.428 -3.023 1.00 1.00 H new ATOM 0 HA ARG A 9 12.314 -8.754 -1.826 1.00 1.00 H new ATOM 0 HB2 ARG A 9 14.178 -9.870 -3.084 1.00 1.00 H new ATOM 0 HB3 ARG A 9 13.125 -8.858 -4.052 1.00 1.00 H new ATOM 0 HG2 ARG A 9 14.773 -7.089 -4.137 1.00 1.00 H new ATOM 0 HG3 ARG A 9 15.784 -7.896 -2.955 1.00 1.00 H new ATOM 0 HD2 ARG A 9 16.443 -8.105 -5.449 1.00 1.00 H new ATOM 0 HD3 ARG A 9 16.475 -9.559 -4.470 1.00 1.00 H new ATOM 0 HE ARG A 9 13.915 -9.165 -5.790 1.00 1.00 H new ATOM 0 HH11 ARG A 9 17.219 -10.366 -6.213 1.00 1.00 H new ATOM 0 HH12 ARG A 9 16.760 -11.491 -7.496 1.00 1.00 H new ATOM 0 HH21 ARG A 9 13.346 -10.627 -7.416 1.00 1.00 H new ATOM 0 HH22 ARG A 9 14.583 -11.637 -8.171 1.00 1.00 H new ATOM 153 N ASP A 10 15.225 -7.691 -0.662 1.00 1.00 N ATOM 154 CA ASP A 10 16.177 -7.848 0.437 1.00 1.00 C ATOM 155 C ASP A 10 15.461 -7.753 1.786 1.00 1.00 C ATOM 156 O ASP A 10 15.828 -8.440 2.737 1.00 1.00 O ATOM 157 CB ASP A 10 17.278 -6.790 0.357 1.00 1.00 C ATOM 158 CG ASP A 10 18.461 -7.097 1.267 1.00 1.00 C ATOM 159 OD1 ASP A 10 18.420 -6.703 2.451 1.00 1.00 O ATOM 160 OD2 ASP A 10 19.436 -7.709 0.783 1.00 1.00 O ATOM 0 H ASP A 10 15.422 -6.906 -1.283 1.00 1.00 H new ATOM 0 HA ASP A 10 16.633 -8.834 0.348 1.00 1.00 H new ATOM 0 HB2 ASP A 10 17.628 -6.714 -0.672 1.00 1.00 H new ATOM 0 HB3 ASP A 10 16.862 -5.819 0.625 1.00 1.00 H new ATOM 165 N GLY A 11 14.435 -6.899 1.861 1.00 1.00 N ATOM 166 CA GLY A 11 13.679 -6.757 3.104 1.00 1.00 C ATOM 167 C GLY A 11 13.680 -5.322 3.603 1.00 1.00 C ATOM 168 O GLY A 11 13.803 -5.084 4.799 1.00 1.00 O ATOM 0 H GLY A 11 14.116 -6.309 1.093 1.00 1.00 H new ATOM 0 HA2 GLY A 11 12.652 -7.086 2.945 1.00 1.00 H new ATOM 0 HA3 GLY A 11 14.107 -7.407 3.867 1.00 1.00 H new ATOM 172 N LEU A 12 13.538 -4.391 2.680 1.00 1.00 N ATOM 173 CA LEU A 12 13.522 -2.975 3.008 1.00 1.00 C ATOM 174 C LEU A 12 12.235 -2.315 2.518 1.00 1.00 C ATOM 175 O LEU A 12 11.688 -2.680 1.473 1.00 1.00 O ATOM 176 CB LEU A 12 14.731 -2.283 2.384 1.00 1.00 C ATOM 177 CG LEU A 12 15.474 -1.310 3.316 1.00 1.00 C ATOM 178 CD1 LEU A 12 16.789 -1.925 3.778 1.00 1.00 C ATOM 179 CD2 LEU A 12 15.704 0.018 2.613 1.00 1.00 C ATOM 0 H LEU A 12 13.431 -4.591 1.686 1.00 1.00 H new ATOM 0 HA LEU A 12 13.567 -2.874 4.092 1.00 1.00 H new ATOM 0 HB2 LEU A 12 15.433 -3.045 2.045 1.00 1.00 H new ATOM 0 HB3 LEU A 12 14.402 -1.737 1.500 1.00 1.00 H new ATOM 0 HG LEU A 12 14.861 -1.123 4.198 1.00 1.00 H new ATOM 0 HD11 LEU A 12 17.306 -1.227 4.437 1.00 1.00 H new ATOM 0 HD12 LEU A 12 16.588 -2.851 4.316 1.00 1.00 H new ATOM 0 HD13 LEU A 12 17.416 -2.137 2.912 1.00 1.00 H new ATOM 0 HD21 LEU A 12 16.231 0.698 3.283 1.00 1.00 H new ATOM 0 HD22 LEU A 12 16.302 -0.144 1.716 1.00 1.00 H new ATOM 0 HD23 LEU A 12 14.744 0.454 2.335 1.00 1.00 H new ATOM 191 N ILE A 13 11.759 -1.337 3.286 1.00 1.00 N ATOM 192 CA ILE A 13 10.548 -0.610 2.943 1.00 1.00 C ATOM 193 C ILE A 13 10.851 0.847 2.609 1.00 1.00 C ATOM 194 O ILE A 13 10.140 1.479 1.822 1.00 1.00 O ATOM 195 CB ILE A 13 9.512 -0.655 4.081 1.00 1.00 C ATOM 196 CG1 ILE A 13 10.079 -0.068 5.373 1.00 1.00 C ATOM 197 CG2 ILE A 13 9.027 -2.067 4.312 1.00 1.00 C ATOM 198 CD1 ILE A 13 9.041 0.153 6.455 1.00 1.00 C ATOM 0 H ILE A 13 12.200 -1.032 4.154 1.00 1.00 H new ATOM 0 HA ILE A 13 10.131 -1.104 2.065 1.00 1.00 H new ATOM 0 HB ILE A 13 8.663 -0.043 3.777 1.00 1.00 H new ATOM 0 HG12 ILE A 13 10.851 -0.735 5.755 1.00 1.00 H new ATOM 0 HG13 ILE A 13 10.562 0.883 5.147 1.00 1.00 H new ATOM 0 HG21 ILE A 13 8.296 -2.073 5.121 1.00 1.00 H new ATOM 0 HG22 ILE A 13 8.564 -2.446 3.401 1.00 1.00 H new ATOM 0 HG23 ILE A 13 9.871 -2.702 4.581 1.00 1.00 H new ATOM 0 HD11 ILE A 13 9.521 0.571 7.340 1.00 1.00 H new ATOM 0 HD12 ILE A 13 8.280 0.845 6.094 1.00 1.00 H new ATOM 0 HD13 ILE A 13 8.574 -0.798 6.711 1.00 1.00 H new ATOM 210 N GLY A 14 11.899 1.387 3.224 1.00 1.00 N ATOM 211 CA GLY A 14 12.255 2.767 2.983 1.00 1.00 C ATOM 212 C GLY A 14 13.388 3.242 3.880 1.00 1.00 C ATOM 213 O GLY A 14 14.055 2.430 4.536 1.00 1.00 O ATOM 0 H GLY A 14 12.503 0.894 3.881 1.00 1.00 H new ATOM 0 HA2 GLY A 14 12.547 2.886 1.940 1.00 1.00 H new ATOM 0 HA3 GLY A 14 11.380 3.398 3.143 1.00 1.00 H new ATOM 217 N LYS A 15 13.619 4.551 3.913 1.00 1.00 N ATOM 218 CA LYS A 15 14.698 5.112 4.728 1.00 1.00 C ATOM 219 C LYS A 15 14.387 6.551 5.138 1.00 1.00 C ATOM 220 O LYS A 15 14.131 7.407 4.288 1.00 1.00 O ATOM 221 CB LYS A 15 16.024 5.069 3.954 1.00 1.00 C ATOM 222 CG LYS A 15 15.938 5.680 2.573 1.00 1.00 C ATOM 223 CD LYS A 15 16.811 6.919 2.440 1.00 1.00 C ATOM 224 CE LYS A 15 18.287 6.561 2.397 1.00 1.00 C ATOM 225 NZ LYS A 15 19.094 7.390 3.342 1.00 1.00 N ATOM 0 H LYS A 15 13.080 5.241 3.390 1.00 1.00 H new ATOM 0 HA LYS A 15 14.786 4.508 5.631 1.00 1.00 H new ATOM 0 HB2 LYS A 15 16.787 5.594 4.528 1.00 1.00 H new ATOM 0 HB3 LYS A 15 16.349 4.033 3.864 1.00 1.00 H new ATOM 0 HG2 LYS A 15 16.242 4.942 1.831 1.00 1.00 H new ATOM 0 HG3 LYS A 15 14.902 5.942 2.357 1.00 1.00 H new ATOM 0 HD2 LYS A 15 16.541 7.460 1.533 1.00 1.00 H new ATOM 0 HD3 LYS A 15 16.623 7.589 3.279 1.00 1.00 H new ATOM 0 HE2 LYS A 15 18.411 5.507 2.644 1.00 1.00 H new ATOM 0 HE3 LYS A 15 18.663 6.698 1.383 1.00 1.00 H new ATOM 0 HZ1 LYS A 15 20.094 7.113 3.280 1.00 1.00 H new ATOM 0 HZ2 LYS A 15 18.997 8.395 3.092 1.00 1.00 H new ATOM 0 HZ3 LYS A 15 18.753 7.241 4.313 1.00 1.00 H new ATOM 239 N ASP A 16 14.411 6.810 6.450 1.00 1.00 N ATOM 240 CA ASP A 16 14.137 8.143 6.967 1.00 1.00 C ATOM 241 C ASP A 16 12.810 8.685 6.417 1.00 1.00 C ATOM 242 O ASP A 16 12.617 9.898 6.324 1.00 1.00 O ATOM 243 CB ASP A 16 15.285 9.098 6.608 1.00 1.00 C ATOM 244 CG ASP A 16 16.099 9.527 7.819 1.00 1.00 C ATOM 245 OD1 ASP A 16 15.641 10.428 8.553 1.00 1.00 O ATOM 246 OD2 ASP A 16 17.191 8.958 8.034 1.00 1.00 O ATOM 0 H ASP A 16 14.617 6.113 7.166 1.00 1.00 H new ATOM 0 HA ASP A 16 14.055 8.075 8.052 1.00 1.00 H new ATOM 0 HB2 ASP A 16 15.943 8.612 5.888 1.00 1.00 H new ATOM 0 HB3 ASP A 16 14.876 9.982 6.120 1.00 1.00 H new ATOM 251 N GLY A 17 11.896 7.770 6.072 1.00 1.00 N ATOM 252 CA GLY A 17 10.603 8.155 5.541 1.00 1.00 C ATOM 253 C GLY A 17 10.712 8.744 4.155 1.00 1.00 C ATOM 254 O GLY A 17 10.589 9.963 3.986 1.00 1.00 O ATOM 0 H GLY A 17 12.037 6.763 6.154 1.00 1.00 H new ATOM 0 HA2 GLY A 17 9.948 7.284 5.514 1.00 1.00 H new ATOM 0 HA3 GLY A 17 10.139 8.882 6.208 1.00 1.00 H new ATOM 258 N HIS A 18 10.953 7.885 3.157 1.00 1.00 N ATOM 259 CA HIS A 18 11.082 8.318 1.775 1.00 1.00 C ATOM 260 C HIS A 18 11.169 7.118 0.841 1.00 1.00 C ATOM 261 O HIS A 18 11.462 6.004 1.274 1.00 1.00 O ATOM 262 CB HIS A 18 12.309 9.210 1.598 1.00 1.00 C ATOM 263 CG HIS A 18 12.380 9.863 0.239 1.00 1.00 C ATOM 264 ND1 HIS A 18 12.913 9.428 -0.921 1.00 1.00 N flip ATOM 265 CD2 HIS A 18 11.860 11.112 -0.021 1.00 1.00 C flip ATOM 266 CE1 HIS A 18 12.709 10.410 -1.859 1.00 1.00 C flip ATOM 267 NE2 HIS A 18 12.070 11.417 -1.291 1.00 1.00 N flip ATOM 0 H HIS A 18 11.062 6.880 3.291 1.00 1.00 H new ATOM 0 HA HIS A 18 10.193 8.896 1.520 1.00 1.00 H new ATOM 0 HB2 HIS A 18 12.301 9.984 2.366 1.00 1.00 H new ATOM 0 HB3 HIS A 18 13.208 8.615 1.755 1.00 1.00 H new ATOM 0 HD2 HIS A 18 11.360 11.743 0.699 1.00 1.00 H new ATOM 0 HE1 HIS A 18 13.020 10.366 -2.892 1.00 1.00 H new ATOM 0 HE2 HIS A 18 11.787 12.281 -1.753 1.00 1.00 H new ATOM 276 N LEU A 19 10.928 7.357 -0.434 1.00 1.00 N ATOM 277 CA LEU A 19 10.984 6.302 -1.440 1.00 1.00 C ATOM 278 C LEU A 19 12.316 6.313 -2.182 1.00 1.00 C ATOM 279 O LEU A 19 12.547 7.170 -3.031 1.00 1.00 O ATOM 280 CB LEU A 19 9.838 6.475 -2.437 1.00 1.00 C ATOM 281 CG LEU A 19 8.488 5.934 -1.985 1.00 1.00 C ATOM 282 CD1 LEU A 19 7.375 6.931 -2.276 1.00 1.00 C ATOM 283 CD2 LEU A 19 8.190 4.596 -2.644 1.00 1.00 C ATOM 0 H LEU A 19 10.690 8.277 -0.804 1.00 1.00 H new ATOM 0 HA LEU A 19 10.887 5.344 -0.930 1.00 1.00 H new ATOM 0 HB2 LEU A 19 9.729 7.537 -2.658 1.00 1.00 H new ATOM 0 HB3 LEU A 19 10.113 5.982 -3.369 1.00 1.00 H new ATOM 0 HG LEU A 19 8.536 5.781 -0.907 1.00 1.00 H new ATOM 0 HD11 LEU A 19 6.422 6.520 -1.943 1.00 1.00 H new ATOM 0 HD12 LEU A 19 7.573 7.862 -1.746 1.00 1.00 H new ATOM 0 HD13 LEU A 19 7.332 7.126 -3.348 1.00 1.00 H new ATOM 0 HD21 LEU A 19 7.221 4.231 -2.305 1.00 1.00 H new ATOM 0 HD22 LEU A 19 8.172 4.720 -3.727 1.00 1.00 H new ATOM 0 HD23 LEU A 19 8.963 3.877 -2.373 1.00 1.00 H new ATOM 295 N PRO A 20 13.221 5.366 -1.879 1.00 1.00 N ATOM 296 CA PRO A 20 14.523 5.299 -2.539 1.00 1.00 C ATOM 297 C PRO A 20 14.418 4.785 -3.967 1.00 1.00 C ATOM 298 O PRO A 20 15.162 5.216 -4.833 1.00 1.00 O ATOM 299 CB PRO A 20 15.317 4.322 -1.676 1.00 1.00 C ATOM 300 CG PRO A 20 14.283 3.447 -1.045 1.00 1.00 C ATOM 301 CD PRO A 20 13.047 4.292 -0.877 1.00 1.00 C ATOM 0 HA PRO A 20 14.987 6.282 -2.622 1.00 1.00 H new ATOM 0 HB2 PRO A 20 16.015 3.740 -2.277 1.00 1.00 H new ATOM 0 HB3 PRO A 20 15.905 4.846 -0.923 1.00 1.00 H new ATOM 0 HG2 PRO A 20 14.076 2.579 -1.671 1.00 1.00 H new ATOM 0 HG3 PRO A 20 14.629 3.071 -0.082 1.00 1.00 H new ATOM 0 HD2 PRO A 20 12.140 3.716 -1.060 1.00 1.00 H new ATOM 0 HD3 PRO A 20 12.971 4.695 0.133 1.00 1.00 H new ATOM 309 N TRP A 21 13.490 3.871 -4.188 1.00 1.00 N ATOM 310 CA TRP A 21 13.283 3.304 -5.517 1.00 1.00 C ATOM 311 C TRP A 21 12.124 3.989 -6.231 1.00 1.00 C ATOM 312 O TRP A 21 11.274 4.614 -5.600 1.00 1.00 O ATOM 313 CB TRP A 21 13.017 1.802 -5.390 1.00 1.00 C ATOM 314 CG TRP A 21 11.580 1.467 -5.113 1.00 1.00 C ATOM 315 CD1 TRP A 21 10.551 1.459 -6.011 1.00 1.00 C ATOM 316 CD2 TRP A 21 11.018 1.088 -3.855 1.00 1.00 C ATOM 317 NE1 TRP A 21 9.381 1.103 -5.385 1.00 1.00 N ATOM 318 CE2 TRP A 21 9.643 0.870 -4.060 1.00 1.00 C ATOM 319 CE3 TRP A 21 11.546 0.914 -2.576 1.00 1.00 C ATOM 320 CZ2 TRP A 21 8.791 0.486 -3.029 1.00 1.00 C ATOM 321 CZ3 TRP A 21 10.700 0.535 -1.553 1.00 1.00 C ATOM 322 CH2 TRP A 21 9.336 0.324 -1.785 1.00 1.00 C ATOM 0 H TRP A 21 12.867 3.503 -3.469 1.00 1.00 H new ATOM 0 HA TRP A 21 14.182 3.467 -6.112 1.00 1.00 H new ATOM 0 HB2 TRP A 21 13.325 1.308 -6.311 1.00 1.00 H new ATOM 0 HB3 TRP A 21 13.636 1.398 -4.589 1.00 1.00 H new ATOM 0 HD1 TRP A 21 10.644 1.698 -7.060 1.00 1.00 H new ATOM 0 HE1 TRP A 21 8.468 1.025 -5.833 1.00 1.00 H new ATOM 0 HE3 TRP A 21 12.598 1.073 -2.389 1.00 1.00 H new ATOM 0 HZ2 TRP A 21 7.738 0.322 -3.205 1.00 1.00 H new ATOM 0 HZ3 TRP A 21 11.097 0.399 -0.558 1.00 1.00 H new ATOM 0 HH2 TRP A 21 8.700 0.027 -0.964 1.00 1.00 H new ATOM 333 N HIS A 22 12.087 3.851 -7.553 1.00 1.00 N ATOM 334 CA HIS A 22 11.020 4.444 -8.348 1.00 1.00 C ATOM 335 C HIS A 22 10.418 3.412 -9.290 1.00 1.00 C ATOM 336 O HIS A 22 11.074 2.954 -10.233 1.00 1.00 O ATOM 337 CB HIS A 22 11.539 5.638 -9.137 1.00 1.00 C ATOM 338 CG HIS A 22 12.393 6.558 -8.333 1.00 1.00 C ATOM 339 ND1 HIS A 22 12.104 6.913 -7.032 1.00 1.00 N ATOM 340 CD2 HIS A 22 13.539 7.206 -8.652 1.00 1.00 C ATOM 341 CE1 HIS A 22 13.033 7.739 -6.586 1.00 1.00 C ATOM 342 NE2 HIS A 22 13.915 7.932 -7.549 1.00 1.00 N ATOM 0 H HIS A 22 12.782 3.335 -8.094 1.00 1.00 H new ATOM 0 HA HIS A 22 10.241 4.790 -7.668 1.00 1.00 H new ATOM 0 HB2 HIS A 22 12.112 5.277 -9.991 1.00 1.00 H new ATOM 0 HB3 HIS A 22 10.692 6.197 -9.534 1.00 1.00 H new ATOM 0 HD1 HIS A 22 11.298 6.588 -6.498 1.00 1.00 H new ATOM 0 HD2 HIS A 22 14.060 7.160 -9.597 1.00 1.00 H new ATOM 0 HE1 HIS A 22 13.066 8.181 -5.601 1.00 1.00 H new ATOM 351 N LEU A 23 9.157 3.057 -9.044 1.00 1.00 N ATOM 352 CA LEU A 23 8.472 2.088 -9.868 1.00 1.00 C ATOM 353 C LEU A 23 7.190 2.682 -10.464 1.00 1.00 C ATOM 354 O LEU A 23 6.089 2.475 -9.943 1.00 1.00 O ATOM 355 CB LEU A 23 8.137 0.839 -9.052 1.00 1.00 C ATOM 356 CG LEU A 23 8.429 -0.482 -9.769 1.00 1.00 C ATOM 357 CD1 LEU A 23 9.880 -0.524 -10.246 1.00 1.00 C ATOM 358 CD2 LEU A 23 8.129 -1.658 -8.840 1.00 1.00 C ATOM 0 H LEU A 23 8.597 3.432 -8.278 1.00 1.00 H new ATOM 0 HA LEU A 23 9.137 1.812 -10.687 1.00 1.00 H new ATOM 0 HB2 LEU A 23 8.703 0.866 -8.121 1.00 1.00 H new ATOM 0 HB3 LEU A 23 7.081 0.867 -8.784 1.00 1.00 H new ATOM 0 HG LEU A 23 7.784 -0.557 -10.645 1.00 1.00 H new ATOM 0 HD11 LEU A 23 10.069 -1.470 -10.753 1.00 1.00 H new ATOM 0 HD12 LEU A 23 10.060 0.300 -10.936 1.00 1.00 H new ATOM 0 HD13 LEU A 23 10.547 -0.432 -9.389 1.00 1.00 H new ATOM 0 HD21 LEU A 23 8.339 -2.594 -9.358 1.00 1.00 H new ATOM 0 HD22 LEU A 23 8.754 -1.587 -7.950 1.00 1.00 H new ATOM 0 HD23 LEU A 23 7.079 -1.633 -8.549 1.00 1.00 H new ATOM 370 N PRO A 24 7.329 3.431 -11.568 1.00 1.00 N ATOM 371 CA PRO A 24 6.190 4.059 -12.245 1.00 1.00 C ATOM 372 C PRO A 24 5.059 3.075 -12.516 1.00 1.00 C ATOM 373 O PRO A 24 3.892 3.438 -12.476 1.00 1.00 O ATOM 374 CB PRO A 24 6.797 4.561 -13.565 1.00 1.00 C ATOM 375 CG PRO A 24 8.237 4.789 -13.255 1.00 1.00 C ATOM 376 CD PRO A 24 8.613 3.726 -12.243 1.00 1.00 C ATOM 0 HA PRO A 24 5.738 4.845 -11.640 1.00 1.00 H new ATOM 0 HB2 PRO A 24 6.675 3.827 -14.362 1.00 1.00 H new ATOM 0 HB3 PRO A 24 6.314 5.479 -13.900 1.00 1.00 H new ATOM 0 HG2 PRO A 24 8.848 4.707 -14.154 1.00 1.00 H new ATOM 0 HG3 PRO A 24 8.397 5.788 -12.850 1.00 1.00 H new ATOM 0 HD2 PRO A 24 9.027 2.840 -12.725 1.00 1.00 H new ATOM 0 HD3 PRO A 24 9.364 4.087 -11.540 1.00 1.00 H new ATOM 384 N ASP A 25 5.429 1.828 -12.794 1.00 1.00 N ATOM 385 CA ASP A 25 4.452 0.786 -13.074 1.00 1.00 C ATOM 386 C ASP A 25 3.562 0.524 -11.869 1.00 1.00 C ATOM 387 O ASP A 25 2.330 0.579 -11.963 1.00 1.00 O ATOM 388 CB ASP A 25 5.161 -0.511 -13.475 1.00 1.00 C ATOM 389 CG ASP A 25 5.846 -0.400 -14.811 1.00 1.00 C ATOM 390 OD1 ASP A 25 5.144 -0.153 -15.815 1.00 1.00 O ATOM 391 OD2 ASP A 25 7.083 -0.560 -14.863 1.00 1.00 O ATOM 0 H ASP A 25 6.400 1.517 -12.831 1.00 1.00 H new ATOM 0 HA ASP A 25 3.827 1.131 -13.897 1.00 1.00 H new ATOM 0 HB2 ASP A 25 5.896 -0.771 -12.713 1.00 1.00 H new ATOM 0 HB3 ASP A 25 4.435 -1.324 -13.508 1.00 1.00 H new ATOM 396 N ASP A 26 4.188 0.244 -10.733 1.00 1.00 N ATOM 397 CA ASP A 26 3.445 -0.025 -9.505 1.00 1.00 C ATOM 398 C ASP A 26 2.681 1.215 -9.056 1.00 1.00 C ATOM 399 O ASP A 26 1.579 1.111 -8.528 1.00 1.00 O ATOM 400 CB ASP A 26 4.393 -0.479 -8.390 1.00 1.00 C ATOM 401 CG ASP A 26 3.660 -1.245 -7.300 1.00 1.00 C ATOM 402 OD1 ASP A 26 2.420 -1.360 -7.393 1.00 1.00 O ATOM 403 OD2 ASP A 26 4.324 -1.733 -6.361 1.00 1.00 O ATOM 0 H ASP A 26 5.202 0.197 -10.635 1.00 1.00 H new ATOM 0 HA ASP A 26 2.732 -0.823 -9.711 1.00 1.00 H new ATOM 0 HB2 ASP A 26 5.176 -1.109 -8.813 1.00 1.00 H new ATOM 0 HB3 ASP A 26 4.885 0.391 -7.955 1.00 1.00 H new ATOM 408 N LEU A 27 3.270 2.384 -9.287 1.00 1.00 N ATOM 409 CA LEU A 27 2.646 3.640 -8.908 1.00 1.00 C ATOM 410 C LEU A 27 1.331 3.851 -9.660 1.00 1.00 C ATOM 411 O LEU A 27 0.345 4.283 -9.077 1.00 1.00 O ATOM 412 CB LEU A 27 3.605 4.803 -9.184 1.00 1.00 C ATOM 413 CG LEU A 27 4.392 5.305 -7.961 1.00 1.00 C ATOM 414 CD1 LEU A 27 3.478 5.986 -6.961 1.00 1.00 C ATOM 415 CD2 LEU A 27 5.123 4.147 -7.299 1.00 1.00 C ATOM 0 H LEU A 27 4.180 2.484 -9.736 1.00 1.00 H new ATOM 0 HA LEU A 27 2.422 3.603 -7.842 1.00 1.00 H new ATOM 0 HB2 LEU A 27 4.315 4.494 -9.951 1.00 1.00 H new ATOM 0 HB3 LEU A 27 3.033 5.635 -9.595 1.00 1.00 H new ATOM 0 HG LEU A 27 5.120 6.039 -8.306 1.00 1.00 H new ATOM 0 HD11 LEU A 27 4.063 6.330 -6.108 1.00 1.00 H new ATOM 0 HD12 LEU A 27 2.992 6.839 -7.435 1.00 1.00 H new ATOM 0 HD13 LEU A 27 2.721 5.280 -6.620 1.00 1.00 H new ATOM 0 HD21 LEU A 27 5.677 4.513 -6.435 1.00 1.00 H new ATOM 0 HD22 LEU A 27 4.400 3.397 -6.976 1.00 1.00 H new ATOM 0 HD23 LEU A 27 5.816 3.700 -8.011 1.00 1.00 H new ATOM 427 N HIS A 28 1.326 3.542 -10.953 1.00 1.00 N ATOM 428 CA HIS A 28 0.111 3.703 -11.761 1.00 1.00 C ATOM 429 C HIS A 28 -1.020 2.869 -11.177 1.00 1.00 C ATOM 430 O HIS A 28 -2.159 3.333 -11.067 1.00 1.00 O ATOM 431 CB HIS A 28 0.370 3.306 -13.211 1.00 1.00 C ATOM 432 CG HIS A 28 0.951 4.411 -14.031 1.00 1.00 C ATOM 433 ND1 HIS A 28 1.270 4.277 -15.366 1.00 1.00 N ATOM 434 CD2 HIS A 28 1.272 5.683 -13.695 1.00 1.00 C ATOM 435 CE1 HIS A 28 1.762 5.418 -15.816 1.00 1.00 C ATOM 436 NE2 HIS A 28 1.774 6.286 -14.822 1.00 1.00 N ATOM 0 H HIS A 28 2.134 3.184 -11.462 1.00 1.00 H new ATOM 0 HA HIS A 28 -0.180 4.753 -11.742 1.00 1.00 H new ATOM 0 HB2 HIS A 28 1.048 2.453 -13.231 1.00 1.00 H new ATOM 0 HB3 HIS A 28 -0.566 2.980 -13.664 1.00 1.00 H new ATOM 0 HD2 HIS A 28 1.155 6.138 -12.723 1.00 1.00 H new ATOM 0 HE1 HIS A 28 2.097 5.608 -16.825 1.00 1.00 H new ATOM 0 HE2 HIS A 28 2.103 7.250 -14.881 1.00 1.00 H new ATOM 445 N TYR A 29 -0.687 1.650 -10.771 1.00 1.00 N ATOM 446 CA TYR A 29 -1.654 0.753 -10.160 1.00 1.00 C ATOM 447 C TYR A 29 -2.201 1.378 -8.877 1.00 1.00 C ATOM 448 O TYR A 29 -3.409 1.373 -8.625 1.00 1.00 O ATOM 449 CB TYR A 29 -1.013 -0.602 -9.866 1.00 1.00 C ATOM 450 CG TYR A 29 -1.848 -1.481 -8.961 1.00 1.00 C ATOM 451 CD1 TYR A 29 -1.778 -1.348 -7.580 1.00 1.00 C ATOM 452 CD2 TYR A 29 -2.714 -2.433 -9.485 1.00 1.00 C ATOM 453 CE1 TYR A 29 -2.546 -2.141 -6.747 1.00 1.00 C ATOM 454 CE2 TYR A 29 -3.485 -3.229 -8.658 1.00 1.00 C ATOM 455 CZ TYR A 29 -3.397 -3.079 -7.291 1.00 1.00 C ATOM 456 OH TYR A 29 -4.160 -3.862 -6.456 1.00 1.00 O ATOM 0 H TYR A 29 0.252 1.260 -10.856 1.00 1.00 H new ATOM 0 HA TYR A 29 -2.479 0.595 -10.854 1.00 1.00 H new ATOM 0 HB2 TYR A 29 -0.839 -1.124 -10.807 1.00 1.00 H new ATOM 0 HB3 TYR A 29 -0.038 -0.442 -9.405 1.00 1.00 H new ATOM 0 HD1 TYR A 29 -1.113 -0.614 -7.150 1.00 1.00 H new ATOM 0 HD2 TYR A 29 -2.786 -2.553 -10.556 1.00 1.00 H new ATOM 0 HE1 TYR A 29 -2.479 -2.026 -5.675 1.00 1.00 H new ATOM 0 HE2 TYR A 29 -4.153 -3.965 -9.081 1.00 1.00 H new ATOM 0 HH TYR A 29 -4.708 -4.473 -6.991 1.00 1.00 H new ATOM 466 N PHE A 30 -1.293 1.922 -8.069 1.00 1.00 N ATOM 467 CA PHE A 30 -1.663 2.549 -6.798 1.00 1.00 C ATOM 468 C PHE A 30 -2.607 3.722 -7.040 1.00 1.00 C ATOM 469 O PHE A 30 -3.611 3.864 -6.345 1.00 1.00 O ATOM 470 CB PHE A 30 -0.417 3.027 -6.059 1.00 1.00 C ATOM 471 CG PHE A 30 -0.698 3.585 -4.691 1.00 1.00 C ATOM 472 CD1 PHE A 30 -0.892 2.739 -3.613 1.00 1.00 C ATOM 473 CD2 PHE A 30 -0.775 4.954 -4.489 1.00 1.00 C ATOM 474 CE1 PHE A 30 -1.157 3.246 -2.356 1.00 1.00 C ATOM 475 CE2 PHE A 30 -1.041 5.467 -3.232 1.00 1.00 C ATOM 476 CZ PHE A 30 -1.232 4.612 -2.164 1.00 1.00 C ATOM 0 H PHE A 30 -0.293 1.942 -8.271 1.00 1.00 H new ATOM 0 HA PHE A 30 -2.173 1.807 -6.184 1.00 1.00 H new ATOM 0 HB2 PHE A 30 0.280 2.194 -5.965 1.00 1.00 H new ATOM 0 HB3 PHE A 30 0.078 3.791 -6.658 1.00 1.00 H new ATOM 0 HD1 PHE A 30 -0.836 1.670 -3.756 1.00 1.00 H new ATOM 0 HD2 PHE A 30 -0.626 5.627 -5.321 1.00 1.00 H new ATOM 0 HE1 PHE A 30 -1.306 2.575 -1.523 1.00 1.00 H new ATOM 0 HE2 PHE A 30 -1.099 6.535 -3.086 1.00 1.00 H new ATOM 0 HZ PHE A 30 -1.439 5.010 -1.182 1.00 1.00 H new ATOM 486 N ARG A 31 -2.279 4.567 -8.014 1.00 1.00 N ATOM 487 CA ARG A 31 -3.115 5.727 -8.321 1.00 1.00 C ATOM 488 C ARG A 31 -4.508 5.282 -8.759 1.00 1.00 C ATOM 489 O ARG A 31 -5.506 5.851 -8.328 1.00 1.00 O ATOM 490 CB ARG A 31 -2.462 6.555 -9.433 1.00 1.00 C ATOM 491 CG ARG A 31 -3.061 7.949 -9.591 1.00 1.00 C ATOM 492 CD ARG A 31 -2.142 8.857 -10.381 1.00 1.00 C ATOM 493 NE ARG A 31 -1.875 8.318 -11.717 1.00 1.00 N ATOM 494 CZ ARG A 31 -1.407 9.041 -12.733 1.00 1.00 C ATOM 495 NH1 ARG A 31 -1.176 10.341 -12.586 1.00 1.00 N ATOM 496 NH2 ARG A 31 -1.171 8.465 -13.903 1.00 1.00 N ATOM 0 H ARG A 31 -1.449 4.473 -8.600 1.00 1.00 H new ATOM 0 HA ARG A 31 -3.210 6.337 -7.422 1.00 1.00 H new ATOM 0 HB2 ARG A 31 -1.396 6.648 -9.226 1.00 1.00 H new ATOM 0 HB3 ARG A 31 -2.558 6.019 -10.377 1.00 1.00 H new ATOM 0 HG2 ARG A 31 -4.025 7.878 -10.094 1.00 1.00 H new ATOM 0 HG3 ARG A 31 -3.245 8.381 -8.608 1.00 1.00 H new ATOM 0 HD2 ARG A 31 -2.593 9.845 -10.469 1.00 1.00 H new ATOM 0 HD3 ARG A 31 -1.202 8.982 -9.843 1.00 1.00 H new ATOM 0 HE ARG A 31 -2.059 7.328 -11.879 1.00 1.00 H new ATOM 0 HH11 ARG A 31 -1.357 10.793 -11.690 1.00 1.00 H new ATOM 0 HH12 ARG A 31 -0.818 10.887 -13.369 1.00 1.00 H new ATOM 0 HH21 ARG A 31 -1.348 7.468 -14.025 1.00 1.00 H new ATOM 0 HH22 ARG A 31 -0.813 9.019 -14.681 1.00 1.00 H new ATOM 510 N ALA A 32 -4.556 4.254 -9.602 1.00 1.00 N ATOM 511 CA ALA A 32 -5.816 3.707 -10.100 1.00 1.00 C ATOM 512 C ALA A 32 -6.664 3.116 -8.978 1.00 1.00 C ATOM 513 O ALA A 32 -7.892 3.237 -8.987 1.00 1.00 O ATOM 514 CB ALA A 32 -5.550 2.669 -11.185 1.00 1.00 C ATOM 0 H ALA A 32 -3.727 3.778 -9.958 1.00 1.00 H new ATOM 0 HA ALA A 32 -6.386 4.529 -10.532 1.00 1.00 H new ATOM 0 HB1 ALA A 32 -6.498 2.270 -11.547 1.00 1.00 H new ATOM 0 HB2 ALA A 32 -5.014 3.136 -12.011 1.00 1.00 H new ATOM 0 HB3 ALA A 32 -4.948 1.859 -10.774 1.00 1.00 H new ATOM 520 N GLN A 33 -6.011 2.480 -8.020 1.00 1.00 N ATOM 521 CA GLN A 33 -6.698 1.864 -6.889 1.00 1.00 C ATOM 522 C GLN A 33 -7.394 2.917 -6.038 1.00 1.00 C ATOM 523 O GLN A 33 -8.503 2.712 -5.565 1.00 1.00 O ATOM 524 CB GLN A 33 -5.703 1.070 -6.033 1.00 1.00 C ATOM 525 CG GLN A 33 -5.736 -0.419 -6.310 1.00 1.00 C ATOM 526 CD GLN A 33 -6.951 -1.101 -5.715 1.00 1.00 C ATOM 527 OE1 GLN A 33 -8.083 -0.868 -6.140 1.00 1.00 O ATOM 528 NE2 GLN A 33 -6.717 -1.970 -4.739 1.00 1.00 N ATOM 0 H GLN A 33 -4.997 2.374 -8.000 1.00 1.00 H new ATOM 0 HA GLN A 33 -7.454 1.183 -7.280 1.00 1.00 H new ATOM 0 HB2 GLN A 33 -4.696 1.445 -6.215 1.00 1.00 H new ATOM 0 HB3 GLN A 33 -5.921 1.242 -4.979 1.00 1.00 H new ATOM 0 HG2 GLN A 33 -5.724 -0.584 -7.387 1.00 1.00 H new ATOM 0 HG3 GLN A 33 -4.834 -0.879 -5.907 1.00 1.00 H new ATOM 0 HE21 GLN A 33 -5.762 -2.132 -4.418 1.00 1.00 H new ATOM 0 HE22 GLN A 33 -7.492 -2.476 -4.310 1.00 1.00 H new ATOM 537 N THR A 34 -6.736 4.055 -5.844 1.00 1.00 N ATOM 538 CA THR A 34 -7.293 5.131 -5.025 1.00 1.00 C ATOM 539 C THR A 34 -8.374 5.941 -5.754 1.00 1.00 C ATOM 540 O THR A 34 -8.907 6.895 -5.186 1.00 1.00 O ATOM 541 CB THR A 34 -6.182 6.064 -4.557 1.00 1.00 C ATOM 542 OG1 THR A 34 -4.989 5.348 -4.333 1.00 1.00 O ATOM 543 CG2 THR A 34 -6.530 6.800 -3.279 1.00 1.00 C ATOM 0 H THR A 34 -5.818 4.258 -6.241 1.00 1.00 H new ATOM 0 HA THR A 34 -7.770 4.655 -4.168 1.00 1.00 H new ATOM 0 HB THR A 34 -6.053 6.793 -5.357 1.00 1.00 H new ATOM 0 HG1 THR A 34 -4.288 5.965 -4.035 1.00 1.00 H new ATOM 0 HG21 THR A 34 -5.701 7.449 -2.995 1.00 1.00 H new ATOM 0 HG22 THR A 34 -7.424 7.402 -3.438 1.00 1.00 H new ATOM 0 HG23 THR A 34 -6.715 6.079 -2.483 1.00 1.00 H new ATOM 551 N VAL A 35 -8.705 5.557 -6.982 1.00 1.00 N ATOM 552 CA VAL A 35 -9.732 6.274 -7.725 1.00 1.00 C ATOM 553 C VAL A 35 -11.084 5.599 -7.503 1.00 1.00 C ATOM 554 O VAL A 35 -11.240 4.407 -7.762 1.00 1.00 O ATOM 555 CB VAL A 35 -9.436 6.326 -9.234 1.00 1.00 C ATOM 556 CG1 VAL A 35 -10.097 7.536 -9.861 1.00 1.00 C ATOM 557 CG2 VAL A 35 -7.938 6.364 -9.477 1.00 1.00 C ATOM 0 H VAL A 35 -8.286 4.769 -7.476 1.00 1.00 H new ATOM 0 HA VAL A 35 -9.746 7.299 -7.355 1.00 1.00 H new ATOM 0 HB VAL A 35 -9.843 5.427 -9.697 1.00 1.00 H new ATOM 0 HG11 VAL A 35 -9.878 7.558 -10.929 1.00 1.00 H new ATOM 0 HG12 VAL A 35 -11.175 7.479 -9.713 1.00 1.00 H new ATOM 0 HG13 VAL A 35 -9.714 8.443 -9.393 1.00 1.00 H new ATOM 0 HG21 VAL A 35 -7.744 6.401 -10.549 1.00 1.00 H new ATOM 0 HG22 VAL A 35 -7.515 7.249 -9.001 1.00 1.00 H new ATOM 0 HG23 VAL A 35 -7.478 5.470 -9.055 1.00 1.00 H new ATOM 567 N GLY A 36 -12.029 6.369 -6.979 1.00 1.00 N ATOM 568 CA GLY A 36 -13.336 5.825 -6.675 1.00 1.00 C ATOM 569 C GLY A 36 -13.339 5.073 -5.352 1.00 1.00 C ATOM 570 O GLY A 36 -14.270 4.312 -5.062 1.00 1.00 O ATOM 0 H GLY A 36 -11.913 7.358 -6.760 1.00 1.00 H new ATOM 0 HA2 GLY A 36 -14.066 6.633 -6.636 1.00 1.00 H new ATOM 0 HA3 GLY A 36 -13.646 5.154 -7.476 1.00 1.00 H new ATOM 574 N LYS A 37 -12.291 5.281 -4.549 1.00 1.00 N ATOM 575 CA LYS A 37 -12.168 4.619 -3.260 1.00 1.00 C ATOM 576 C LYS A 37 -11.561 5.556 -2.232 1.00 1.00 C ATOM 577 O LYS A 37 -10.875 6.522 -2.577 1.00 1.00 O ATOM 578 CB LYS A 37 -11.318 3.367 -3.392 1.00 1.00 C ATOM 579 CG LYS A 37 -11.614 2.559 -4.650 1.00 1.00 C ATOM 580 CD LYS A 37 -11.221 1.106 -4.478 1.00 1.00 C ATOM 581 CE LYS A 37 -12.414 0.182 -4.641 1.00 1.00 C ATOM 582 NZ LYS A 37 -11.997 -1.187 -5.049 1.00 1.00 N ATOM 0 H LYS A 37 -11.517 5.906 -4.776 1.00 1.00 H new ATOM 0 HA LYS A 37 -13.165 4.336 -2.923 1.00 1.00 H new ATOM 0 HB2 LYS A 37 -10.266 3.651 -3.392 1.00 1.00 H new ATOM 0 HB3 LYS A 37 -11.478 2.735 -2.518 1.00 1.00 H new ATOM 0 HG2 LYS A 37 -12.676 2.625 -4.885 1.00 1.00 H new ATOM 0 HG3 LYS A 37 -11.073 2.986 -5.495 1.00 1.00 H new ATOM 0 HD2 LYS A 37 -10.456 0.846 -5.210 1.00 1.00 H new ATOM 0 HD3 LYS A 37 -10.780 0.962 -3.491 1.00 1.00 H new ATOM 0 HE2 LYS A 37 -12.965 0.130 -3.702 1.00 1.00 H new ATOM 0 HE3 LYS A 37 -13.094 0.593 -5.387 1.00 1.00 H new ATOM 0 HZ1 LYS A 37 -12.838 -1.790 -5.151 1.00 1.00 H new ATOM 0 HZ2 LYS A 37 -11.493 -1.140 -5.957 1.00 1.00 H new ATOM 0 HZ3 LYS A 37 -11.368 -1.589 -4.324 1.00 1.00 H new ATOM 596 N ILE A 38 -11.805 5.264 -0.963 1.00 1.00 N ATOM 597 CA ILE A 38 -11.274 6.083 0.123 1.00 1.00 C ATOM 598 C ILE A 38 -10.088 5.392 0.791 1.00 1.00 C ATOM 599 O ILE A 38 -10.162 4.233 1.173 1.00 1.00 O ATOM 600 CB ILE A 38 -12.356 6.368 1.186 1.00 1.00 C ATOM 601 CG1 ILE A 38 -13.519 7.133 0.556 1.00 1.00 C ATOM 602 CG2 ILE A 38 -11.776 7.142 2.368 1.00 1.00 C ATOM 603 CD1 ILE A 38 -14.809 6.333 0.503 1.00 1.00 C ATOM 0 H ILE A 38 -12.366 4.468 -0.658 1.00 1.00 H new ATOM 0 HA ILE A 38 -10.946 7.027 -0.313 1.00 1.00 H new ATOM 0 HB ILE A 38 -12.726 5.415 1.565 1.00 1.00 H new ATOM 0 HG12 ILE A 38 -13.691 8.049 1.122 1.00 1.00 H new ATOM 0 HG13 ILE A 38 -13.243 7.431 -0.456 1.00 1.00 H new ATOM 0 HG21 ILE A 38 -12.561 7.329 3.101 1.00 1.00 H new ATOM 0 HG22 ILE A 38 -10.980 6.558 2.830 1.00 1.00 H new ATOM 0 HG23 ILE A 38 -11.373 8.092 2.018 1.00 1.00 H new ATOM 0 HD11 ILE A 38 -15.593 6.936 0.044 1.00 1.00 H new ATOM 0 HD12 ILE A 38 -14.653 5.430 -0.088 1.00 1.00 H new ATOM 0 HD13 ILE A 38 -15.108 6.058 1.514 1.00 1.00 H new ATOM 615 N MET A 39 -8.980 6.113 0.905 1.00 1.00 N ATOM 616 CA MET A 39 -7.766 5.557 1.499 1.00 1.00 C ATOM 617 C MET A 39 -7.232 6.440 2.631 1.00 1.00 C ATOM 618 O MET A 39 -7.395 7.654 2.616 1.00 1.00 O ATOM 619 CB MET A 39 -6.681 5.381 0.432 1.00 1.00 C ATOM 620 CG MET A 39 -5.286 5.758 0.912 1.00 1.00 C ATOM 621 SD MET A 39 -4.014 5.399 -0.317 1.00 1.00 S ATOM 622 CE MET A 39 -3.316 7.026 -0.574 1.00 1.00 C ATOM 0 H MET A 39 -8.894 7.081 0.596 1.00 1.00 H new ATOM 0 HA MET A 39 -8.027 4.586 1.919 1.00 1.00 H new ATOM 0 HB2 MET A 39 -6.674 4.342 0.101 1.00 1.00 H new ATOM 0 HB3 MET A 39 -6.934 5.990 -0.436 1.00 1.00 H new ATOM 0 HG2 MET A 39 -5.263 6.820 1.155 1.00 1.00 H new ATOM 0 HG3 MET A 39 -5.062 5.216 1.831 1.00 1.00 H new ATOM 0 HE1 MET A 39 -2.322 6.931 -1.012 1.00 1.00 H new ATOM 0 HE2 MET A 39 -3.957 7.594 -1.248 1.00 1.00 H new ATOM 0 HE3 MET A 39 -3.243 7.546 0.381 1.00 1.00 H new ATOM 632 N VAL A 40 -6.582 5.818 3.599 1.00 1.00 N ATOM 633 CA VAL A 40 -6.014 6.548 4.728 1.00 1.00 C ATOM 634 C VAL A 40 -4.501 6.355 4.816 1.00 1.00 C ATOM 635 O VAL A 40 -3.997 5.235 4.788 1.00 1.00 O ATOM 636 CB VAL A 40 -6.645 6.106 6.061 1.00 1.00 C ATOM 637 CG1 VAL A 40 -6.368 7.131 7.151 1.00 1.00 C ATOM 638 CG2 VAL A 40 -8.140 5.878 5.902 1.00 1.00 C ATOM 0 H VAL A 40 -6.432 4.810 3.630 1.00 1.00 H new ATOM 0 HA VAL A 40 -6.235 7.601 4.555 1.00 1.00 H new ATOM 0 HB VAL A 40 -6.189 5.161 6.357 1.00 1.00 H new ATOM 0 HG11 VAL A 40 -6.822 6.800 8.085 1.00 1.00 H new ATOM 0 HG12 VAL A 40 -5.292 7.235 7.288 1.00 1.00 H new ATOM 0 HG13 VAL A 40 -6.792 8.093 6.862 1.00 1.00 H new ATOM 0 HG21 VAL A 40 -8.564 5.566 6.857 1.00 1.00 H new ATOM 0 HG22 VAL A 40 -8.617 6.803 5.578 1.00 1.00 H new ATOM 0 HG23 VAL A 40 -8.312 5.101 5.157 1.00 1.00 H new ATOM 648 N VAL A 41 -3.787 7.470 4.922 1.00 1.00 N ATOM 649 CA VAL A 41 -2.331 7.445 5.015 1.00 1.00 C ATOM 650 C VAL A 41 -1.841 8.170 6.258 1.00 1.00 C ATOM 651 O VAL A 41 -2.261 9.293 6.535 1.00 1.00 O ATOM 652 CB VAL A 41 -1.668 8.096 3.791 1.00 1.00 C ATOM 653 CG1 VAL A 41 -1.457 7.071 2.691 1.00 1.00 C ATOM 654 CG2 VAL A 41 -2.508 9.261 3.286 1.00 1.00 C ATOM 0 H VAL A 41 -4.194 8.405 4.946 1.00 1.00 H new ATOM 0 HA VAL A 41 -2.051 6.393 5.064 1.00 1.00 H new ATOM 0 HB VAL A 41 -0.693 8.481 4.091 1.00 1.00 H new ATOM 0 HG11 VAL A 41 -0.987 7.550 1.832 1.00 1.00 H new ATOM 0 HG12 VAL A 41 -0.814 6.271 3.058 1.00 1.00 H new ATOM 0 HG13 VAL A 41 -2.419 6.655 2.392 1.00 1.00 H new ATOM 0 HG21 VAL A 41 -2.023 9.710 2.419 1.00 1.00 H new ATOM 0 HG22 VAL A 41 -3.497 8.901 3.003 1.00 1.00 H new ATOM 0 HG23 VAL A 41 -2.606 10.008 4.074 1.00 1.00 H new ATOM 664 N GLY A 42 -0.946 7.547 7.001 1.00 1.00 N ATOM 665 CA GLY A 42 -0.423 8.188 8.187 1.00 1.00 C ATOM 666 C GLY A 42 0.341 9.455 7.847 1.00 1.00 C ATOM 667 O GLY A 42 0.852 9.594 6.734 1.00 1.00 O ATOM 0 H GLY A 42 -0.574 6.617 6.809 1.00 1.00 H new ATOM 0 HA2 GLY A 42 -1.243 8.428 8.863 1.00 1.00 H new ATOM 0 HA3 GLY A 42 0.234 7.497 8.715 1.00 1.00 H new ATOM 671 N ARG A 43 0.405 10.387 8.788 1.00 1.00 N ATOM 672 CA ARG A 43 1.091 11.656 8.555 1.00 1.00 C ATOM 673 C ARG A 43 2.572 11.445 8.258 1.00 1.00 C ATOM 674 O ARG A 43 3.106 12.025 7.329 1.00 1.00 O ATOM 675 CB ARG A 43 0.915 12.572 9.774 1.00 1.00 C ATOM 676 CG ARG A 43 1.925 13.712 9.819 1.00 1.00 C ATOM 677 CD ARG A 43 1.838 14.574 8.580 1.00 1.00 C ATOM 678 NE ARG A 43 1.176 15.845 8.854 1.00 1.00 N ATOM 679 CZ ARG A 43 1.021 16.813 7.951 1.00 1.00 C ATOM 680 NH1 ARG A 43 1.470 16.654 6.712 1.00 1.00 N ATOM 681 NH2 ARG A 43 0.416 17.945 8.284 1.00 1.00 N ATOM 0 H ARG A 43 -0.007 10.292 9.716 1.00 1.00 H new ATOM 0 HA ARG A 43 0.645 12.129 7.680 1.00 1.00 H new ATOM 0 HB2 ARG A 43 -0.092 12.988 9.765 1.00 1.00 H new ATOM 0 HB3 ARG A 43 1.007 11.978 10.683 1.00 1.00 H new ATOM 0 HG2 ARG A 43 1.746 14.324 10.703 1.00 1.00 H new ATOM 0 HG3 ARG A 43 2.932 13.305 9.911 1.00 1.00 H new ATOM 0 HD2 ARG A 43 2.841 14.761 8.195 1.00 1.00 H new ATOM 0 HD3 ARG A 43 1.293 14.040 7.802 1.00 1.00 H new ATOM 0 HE ARG A 43 0.810 16.002 9.793 1.00 1.00 H new ATOM 0 HH11 ARG A 43 1.937 15.787 6.446 1.00 1.00 H new ATOM 0 HH12 ARG A 43 1.348 17.399 6.026 1.00 1.00 H new ATOM 0 HH21 ARG A 43 0.068 18.077 9.234 1.00 1.00 H new ATOM 0 HH22 ARG A 43 0.299 18.684 7.591 1.00 1.00 H new ATOM 695 N ARG A 44 3.233 10.580 8.990 1.00 1.00 N ATOM 696 CA ARG A 44 4.635 10.348 8.726 1.00 1.00 C ATOM 697 C ARG A 44 4.805 9.834 7.308 1.00 1.00 C ATOM 698 O ARG A 44 5.764 10.168 6.615 1.00 1.00 O ATOM 699 CB ARG A 44 5.205 9.341 9.713 1.00 1.00 C ATOM 700 CG ARG A 44 5.538 9.939 11.070 1.00 1.00 C ATOM 701 CD ARG A 44 6.921 9.512 11.540 1.00 1.00 C ATOM 702 NE ARG A 44 7.542 10.533 12.377 1.00 1.00 N ATOM 703 CZ ARG A 44 8.171 11.604 11.899 1.00 1.00 C ATOM 704 NH1 ARG A 44 8.275 11.791 10.589 1.00 1.00 N ATOM 705 NH2 ARG A 44 8.697 12.490 12.733 1.00 1.00 N ATOM 0 H ARG A 44 2.836 10.036 9.756 1.00 1.00 H new ATOM 0 HA ARG A 44 5.175 11.288 8.841 1.00 1.00 H new ATOM 0 HB2 ARG A 44 4.488 8.532 9.848 1.00 1.00 H new ATOM 0 HB3 ARG A 44 6.107 8.900 9.289 1.00 1.00 H new ATOM 0 HG2 ARG A 44 5.491 11.026 11.012 1.00 1.00 H new ATOM 0 HG3 ARG A 44 4.791 9.627 11.800 1.00 1.00 H new ATOM 0 HD2 ARG A 44 6.844 8.579 12.099 1.00 1.00 H new ATOM 0 HD3 ARG A 44 7.555 9.314 10.676 1.00 1.00 H new ATOM 0 HE ARG A 44 7.491 10.419 13.389 1.00 1.00 H new ATOM 0 HH11 ARG A 44 7.872 11.112 9.943 1.00 1.00 H new ATOM 0 HH12 ARG A 44 8.758 12.614 10.228 1.00 1.00 H new ATOM 0 HH21 ARG A 44 8.620 12.351 13.740 1.00 1.00 H new ATOM 0 HH22 ARG A 44 9.179 13.311 12.367 1.00 1.00 H new ATOM 719 N THR A 45 3.863 9.013 6.880 1.00 1.00 N ATOM 720 CA THR A 45 3.887 8.443 5.543 1.00 1.00 C ATOM 721 C THR A 45 3.735 9.525 4.480 1.00 1.00 C ATOM 722 O THR A 45 4.456 9.526 3.477 1.00 1.00 O ATOM 723 CB THR A 45 2.805 7.371 5.387 1.00 1.00 C ATOM 724 OG1 THR A 45 3.152 6.217 6.136 1.00 1.00 O ATOM 725 CG2 THR A 45 2.599 6.917 3.957 1.00 1.00 C ATOM 0 H THR A 45 3.064 8.723 7.444 1.00 1.00 H new ATOM 0 HA THR A 45 4.858 7.969 5.401 1.00 1.00 H new ATOM 0 HB THR A 45 1.886 7.837 5.742 1.00 1.00 H new ATOM 0 HG1 THR A 45 3.534 5.541 5.538 1.00 1.00 H new ATOM 0 HG21 THR A 45 1.818 6.157 3.925 1.00 1.00 H new ATOM 0 HG22 THR A 45 2.303 7.768 3.344 1.00 1.00 H new ATOM 0 HG23 THR A 45 3.528 6.498 3.571 1.00 1.00 H new ATOM 733 N TYR A 46 2.800 10.447 4.692 1.00 1.00 N ATOM 734 CA TYR A 46 2.559 11.533 3.739 1.00 1.00 C ATOM 735 C TYR A 46 3.850 12.267 3.416 1.00 1.00 C ATOM 736 O TYR A 46 4.073 12.650 2.274 1.00 1.00 O ATOM 737 CB TYR A 46 1.531 12.515 4.300 1.00 1.00 C ATOM 738 CG TYR A 46 0.408 12.869 3.343 1.00 1.00 C ATOM 739 CD1 TYR A 46 -0.183 11.892 2.553 1.00 1.00 C ATOM 740 CD2 TYR A 46 -0.065 14.170 3.242 1.00 1.00 C ATOM 741 CE1 TYR A 46 -1.217 12.201 1.691 1.00 1.00 C ATOM 742 CE2 TYR A 46 -1.097 14.489 2.381 1.00 1.00 C ATOM 743 CZ TYR A 46 -1.670 13.500 1.609 1.00 1.00 C ATOM 744 OH TYR A 46 -2.700 13.810 0.747 1.00 1.00 O ATOM 0 H TYR A 46 2.196 10.466 5.514 1.00 1.00 H new ATOM 0 HA TYR A 46 2.169 11.095 2.820 1.00 1.00 H new ATOM 0 HB2 TYR A 46 1.098 12.090 5.206 1.00 1.00 H new ATOM 0 HB3 TYR A 46 2.045 13.431 4.592 1.00 1.00 H new ATOM 0 HD1 TYR A 46 0.172 10.874 2.614 1.00 1.00 H new ATOM 0 HD2 TYR A 46 0.381 14.946 3.847 1.00 1.00 H new ATOM 0 HE1 TYR A 46 -1.668 11.429 1.085 1.00 1.00 H new ATOM 0 HE2 TYR A 46 -1.453 15.506 2.313 1.00 1.00 H new ATOM 0 HH TYR A 46 -2.902 14.767 0.809 1.00 1.00 H new ATOM 754 N GLU A 47 4.687 12.468 4.425 1.00 1.00 N ATOM 755 CA GLU A 47 5.961 13.164 4.237 1.00 1.00 C ATOM 756 C GLU A 47 6.768 12.551 3.090 1.00 1.00 C ATOM 757 O GLU A 47 7.527 13.247 2.403 1.00 1.00 O ATOM 758 CB GLU A 47 6.783 13.131 5.517 1.00 1.00 C ATOM 759 CG GLU A 47 6.884 14.489 6.197 1.00 1.00 C ATOM 760 CD GLU A 47 7.887 15.385 5.505 1.00 1.00 C ATOM 761 OE1 GLU A 47 7.660 15.729 4.326 1.00 1.00 O ATOM 762 OE2 GLU A 47 8.913 15.723 6.132 1.00 1.00 O ATOM 0 H GLU A 47 4.511 12.161 5.382 1.00 1.00 H new ATOM 0 HA GLU A 47 5.734 14.199 3.983 1.00 1.00 H new ATOM 0 HB2 GLU A 47 6.337 12.417 6.210 1.00 1.00 H new ATOM 0 HB3 GLU A 47 7.786 12.770 5.288 1.00 1.00 H new ATOM 0 HG2 GLU A 47 5.906 14.970 6.198 1.00 1.00 H new ATOM 0 HG3 GLU A 47 7.174 14.354 7.239 1.00 1.00 H new ATOM 769 N SER A 48 6.621 11.249 2.910 1.00 1.00 N ATOM 770 CA SER A 48 7.348 10.533 1.872 1.00 1.00 C ATOM 771 C SER A 48 6.701 10.704 0.499 1.00 1.00 C ATOM 772 O SER A 48 7.404 10.790 -0.507 1.00 1.00 O ATOM 773 CB SER A 48 7.433 9.056 2.216 1.00 1.00 C ATOM 774 OG SER A 48 7.229 8.254 1.067 1.00 1.00 O ATOM 0 H SER A 48 6.003 10.663 3.471 1.00 1.00 H new ATOM 0 HA SER A 48 8.350 10.959 1.825 1.00 1.00 H new ATOM 0 HB2 SER A 48 8.409 8.836 2.649 1.00 1.00 H new ATOM 0 HB3 SER A 48 6.686 8.812 2.972 1.00 1.00 H new ATOM 0 HG SER A 48 7.290 7.308 1.314 1.00 1.00 H new ATOM 780 N PHE A 49 5.374 10.766 0.476 1.00 1.00 N ATOM 781 CA PHE A 49 4.632 10.927 -0.774 1.00 1.00 C ATOM 782 C PHE A 49 5.261 12.002 -1.671 1.00 1.00 C ATOM 783 O PHE A 49 5.069 13.197 -1.462 1.00 1.00 O ATOM 784 CB PHE A 49 3.180 11.299 -0.473 1.00 1.00 C ATOM 785 CG PHE A 49 2.207 10.174 -0.691 1.00 1.00 C ATOM 786 CD1 PHE A 49 2.420 8.932 -0.111 1.00 1.00 C ATOM 787 CD2 PHE A 49 1.074 10.357 -1.466 1.00 1.00 C ATOM 788 CE1 PHE A 49 1.523 7.898 -0.303 1.00 1.00 C ATOM 789 CE2 PHE A 49 0.174 9.328 -1.660 1.00 1.00 C ATOM 790 CZ PHE A 49 0.399 8.096 -1.079 1.00 1.00 C ATOM 0 H PHE A 49 4.788 10.707 1.309 1.00 1.00 H new ATOM 0 HA PHE A 49 4.669 9.977 -1.307 1.00 1.00 H new ATOM 0 HB2 PHE A 49 3.108 11.634 0.562 1.00 1.00 H new ATOM 0 HB3 PHE A 49 2.893 12.142 -1.102 1.00 1.00 H new ATOM 0 HD1 PHE A 49 3.297 8.771 0.498 1.00 1.00 H new ATOM 0 HD2 PHE A 49 0.892 11.318 -1.925 1.00 1.00 H new ATOM 0 HE1 PHE A 49 1.702 6.936 0.154 1.00 1.00 H new ATOM 0 HE2 PHE A 49 -0.706 9.487 -2.266 1.00 1.00 H new ATOM 0 HZ PHE A 49 -0.303 7.289 -1.231 1.00 1.00 H new ATOM 800 N PRO A 50 6.014 11.587 -2.715 1.00 1.00 N ATOM 801 CA PRO A 50 6.651 12.515 -3.647 1.00 1.00 C ATOM 802 C PRO A 50 5.645 13.151 -4.605 1.00 1.00 C ATOM 803 O PRO A 50 5.916 14.204 -5.183 1.00 1.00 O ATOM 804 CB PRO A 50 7.635 11.639 -4.419 1.00 1.00 C ATOM 805 CG PRO A 50 7.054 10.270 -4.369 1.00 1.00 C ATOM 806 CD PRO A 50 6.296 10.169 -3.065 1.00 1.00 C ATOM 0 HA PRO A 50 7.124 13.348 -3.127 1.00 1.00 H new ATOM 0 HB2 PRO A 50 7.747 11.983 -5.447 1.00 1.00 H new ATOM 0 HB3 PRO A 50 8.626 11.664 -3.965 1.00 1.00 H new ATOM 0 HG2 PRO A 50 6.391 10.100 -5.217 1.00 1.00 H new ATOM 0 HG3 PRO A 50 7.838 9.514 -4.421 1.00 1.00 H new ATOM 0 HD2 PRO A 50 5.377 9.594 -3.179 1.00 1.00 H new ATOM 0 HD3 PRO A 50 6.888 9.676 -2.294 1.00 1.00 H new ATOM 814 N LYS A 51 4.489 12.518 -4.754 1.00 1.00 N ATOM 815 CA LYS A 51 3.449 13.032 -5.634 1.00 1.00 C ATOM 816 C LYS A 51 2.256 13.546 -4.834 1.00 1.00 C ATOM 817 O LYS A 51 1.202 12.910 -4.786 1.00 1.00 O ATOM 818 CB LYS A 51 3.004 11.940 -6.619 1.00 1.00 C ATOM 819 CG LYS A 51 4.004 11.676 -7.737 1.00 1.00 C ATOM 820 CD LYS A 51 3.314 11.463 -9.078 1.00 1.00 C ATOM 821 CE LYS A 51 3.332 12.737 -9.913 1.00 1.00 C ATOM 822 NZ LYS A 51 4.568 12.838 -10.742 1.00 1.00 N ATOM 0 H LYS A 51 4.248 11.649 -4.277 1.00 1.00 H new ATOM 0 HA LYS A 51 3.861 13.870 -6.196 1.00 1.00 H new ATOM 0 HB2 LYS A 51 2.836 11.014 -6.069 1.00 1.00 H new ATOM 0 HB3 LYS A 51 2.049 12.228 -7.059 1.00 1.00 H new ATOM 0 HG2 LYS A 51 4.694 12.517 -7.813 1.00 1.00 H new ATOM 0 HG3 LYS A 51 4.599 10.797 -7.491 1.00 1.00 H new ATOM 0 HD2 LYS A 51 3.811 10.660 -9.623 1.00 1.00 H new ATOM 0 HD3 LYS A 51 2.284 11.146 -8.914 1.00 1.00 H new ATOM 0 HE2 LYS A 51 2.456 12.759 -10.562 1.00 1.00 H new ATOM 0 HE3 LYS A 51 3.263 13.604 -9.256 1.00 1.00 H new ATOM 0 HZ1 LYS A 51 4.544 13.718 -11.296 1.00 1.00 H new ATOM 0 HZ2 LYS A 51 5.403 12.842 -10.122 1.00 1.00 H new ATOM 0 HZ3 LYS A 51 4.621 12.024 -11.387 1.00 1.00 H new ATOM 836 N ARG A 52 2.430 14.713 -4.213 1.00 1.00 N ATOM 837 CA ARG A 52 1.365 15.319 -3.419 1.00 1.00 C ATOM 838 C ARG A 52 1.073 16.742 -3.890 1.00 1.00 C ATOM 839 O ARG A 52 1.960 17.436 -4.403 1.00 1.00 O ATOM 840 CB ARG A 52 1.771 15.325 -1.944 1.00 1.00 C ATOM 841 CG ARG A 52 1.048 14.285 -1.110 1.00 1.00 C ATOM 842 CD ARG A 52 1.440 14.380 0.354 1.00 1.00 C ATOM 843 NE ARG A 52 1.322 15.743 0.859 1.00 1.00 N ATOM 844 CZ ARG A 52 1.925 16.191 1.956 1.00 1.00 C ATOM 845 NH1 ARG A 52 2.670 15.375 2.692 1.00 1.00 N ATOM 846 NH2 ARG A 52 1.784 17.459 2.317 1.00 1.00 N ATOM 0 H ARG A 52 3.294 15.254 -4.245 1.00 1.00 H new ATOM 0 HA ARG A 52 0.456 14.730 -3.546 1.00 1.00 H new ATOM 0 HB2 ARG A 52 2.845 15.154 -1.871 1.00 1.00 H new ATOM 0 HB3 ARG A 52 1.576 16.313 -1.526 1.00 1.00 H new ATOM 0 HG2 ARG A 52 -0.029 14.421 -1.210 1.00 1.00 H new ATOM 0 HG3 ARG A 52 1.280 13.289 -1.487 1.00 1.00 H new ATOM 0 HD2 ARG A 52 0.806 13.718 0.944 1.00 1.00 H new ATOM 0 HD3 ARG A 52 2.466 14.034 0.479 1.00 1.00 H new ATOM 0 HE ARG A 52 0.738 16.396 0.336 1.00 1.00 H new ATOM 0 HH11 ARG A 52 2.782 14.399 2.417 1.00 1.00 H new ATOM 0 HH12 ARG A 52 3.130 15.724 3.533 1.00 1.00 H new ATOM 0 HH21 ARG A 52 1.214 18.089 1.753 1.00 1.00 H new ATOM 0 HH22 ARG A 52 2.246 17.804 3.158 1.00 1.00 H new ATOM 860 N PRO A 53 -0.175 17.208 -3.721 1.00 1.00 N ATOM 861 CA PRO A 53 -1.249 16.415 -3.115 1.00 1.00 C ATOM 862 C PRO A 53 -1.838 15.405 -4.095 1.00 1.00 C ATOM 863 O PRO A 53 -1.339 15.254 -5.215 1.00 1.00 O ATOM 864 CB PRO A 53 -2.283 17.473 -2.745 1.00 1.00 C ATOM 865 CG PRO A 53 -2.114 18.525 -3.785 1.00 1.00 C ATOM 866 CD PRO A 53 -0.644 18.550 -4.113 1.00 1.00 C ATOM 0 HA PRO A 53 -0.904 15.820 -2.270 1.00 1.00 H new ATOM 0 HB2 PRO A 53 -3.293 17.063 -2.753 1.00 1.00 H new ATOM 0 HB3 PRO A 53 -2.108 17.869 -1.745 1.00 1.00 H new ATOM 0 HG2 PRO A 53 -2.708 18.298 -4.670 1.00 1.00 H new ATOM 0 HG3 PRO A 53 -2.449 19.495 -3.417 1.00 1.00 H new ATOM 0 HD2 PRO A 53 -0.473 18.740 -5.173 1.00 1.00 H new ATOM 0 HD3 PRO A 53 -0.124 19.333 -3.561 1.00 1.00 H new ATOM 874 N LEU A 54 -2.892 14.713 -3.680 1.00 1.00 N ATOM 875 CA LEU A 54 -3.544 13.706 -4.518 1.00 1.00 C ATOM 876 C LEU A 54 -4.425 14.363 -5.578 1.00 1.00 C ATOM 877 O LEU A 54 -4.889 15.490 -5.412 1.00 1.00 O ATOM 878 CB LEU A 54 -4.382 12.765 -3.651 1.00 1.00 C ATOM 879 CG LEU A 54 -3.701 11.450 -3.285 1.00 1.00 C ATOM 880 CD1 LEU A 54 -3.043 11.558 -1.920 1.00 1.00 C ATOM 881 CD2 LEU A 54 -4.699 10.302 -3.332 1.00 1.00 C ATOM 0 H LEU A 54 -3.319 14.830 -2.761 1.00 1.00 H new ATOM 0 HA LEU A 54 -2.769 13.132 -5.026 1.00 1.00 H new ATOM 0 HB2 LEU A 54 -4.652 13.285 -2.732 1.00 1.00 H new ATOM 0 HB3 LEU A 54 -5.311 12.542 -4.176 1.00 1.00 H new ATOM 0 HG LEU A 54 -2.921 11.241 -4.017 1.00 1.00 H new ATOM 0 HD11 LEU A 54 -2.561 10.612 -1.672 1.00 1.00 H new ATOM 0 HD12 LEU A 54 -2.296 12.352 -1.938 1.00 1.00 H new ATOM 0 HD13 LEU A 54 -3.799 11.788 -1.169 1.00 1.00 H new ATOM 0 HD21 LEU A 54 -4.196 9.372 -3.068 1.00 1.00 H new ATOM 0 HD22 LEU A 54 -5.506 10.492 -2.624 1.00 1.00 H new ATOM 0 HD23 LEU A 54 -5.111 10.219 -4.338 1.00 1.00 H new ATOM 893 N PRO A 55 -4.684 13.649 -6.689 1.00 1.00 N ATOM 894 CA PRO A 55 -5.521 14.160 -7.782 1.00 1.00 C ATOM 895 C PRO A 55 -7.012 14.152 -7.428 1.00 1.00 C ATOM 896 O PRO A 55 -7.795 13.412 -8.016 1.00 1.00 O ATOM 897 CB PRO A 55 -5.228 13.185 -8.933 1.00 1.00 C ATOM 898 CG PRO A 55 -4.875 11.901 -8.253 1.00 1.00 C ATOM 899 CD PRO A 55 -4.175 12.282 -6.971 1.00 1.00 C ATOM 0 HA PRO A 55 -5.298 15.200 -8.020 1.00 1.00 H new ATOM 0 HB2 PRO A 55 -6.095 13.065 -9.583 1.00 1.00 H new ATOM 0 HB3 PRO A 55 -4.409 13.542 -9.557 1.00 1.00 H new ATOM 0 HG2 PRO A 55 -5.768 11.311 -8.048 1.00 1.00 H new ATOM 0 HG3 PRO A 55 -4.228 11.292 -8.884 1.00 1.00 H new ATOM 0 HD2 PRO A 55 -4.414 11.591 -6.163 1.00 1.00 H new ATOM 0 HD3 PRO A 55 -3.091 12.274 -7.088 1.00 1.00 H new ATOM 907 N GLU A 56 -7.386 14.992 -6.470 1.00 1.00 N ATOM 908 CA GLU A 56 -8.776 15.095 -6.036 1.00 1.00 C ATOM 909 C GLU A 56 -9.323 13.739 -5.600 1.00 1.00 C ATOM 910 O GLU A 56 -10.297 13.239 -6.168 1.00 1.00 O ATOM 911 CB GLU A 56 -9.629 15.676 -7.167 1.00 1.00 C ATOM 912 CG GLU A 56 -9.419 17.162 -7.403 1.00 1.00 C ATOM 913 CD GLU A 56 -8.246 17.727 -6.624 1.00 1.00 C ATOM 914 OE1 GLU A 56 -7.098 17.568 -7.090 1.00 1.00 O ATOM 915 OE2 GLU A 56 -8.471 18.319 -5.547 1.00 1.00 O ATOM 0 H GLU A 56 -6.745 15.614 -5.977 1.00 1.00 H new ATOM 0 HA GLU A 56 -8.818 15.761 -5.174 1.00 1.00 H new ATOM 0 HB2 GLU A 56 -9.406 15.138 -8.088 1.00 1.00 H new ATOM 0 HB3 GLU A 56 -10.681 15.500 -6.941 1.00 1.00 H new ATOM 0 HG2 GLU A 56 -9.259 17.336 -8.467 1.00 1.00 H new ATOM 0 HG3 GLU A 56 -10.325 17.700 -7.125 1.00 1.00 H new ATOM 922 N ARG A 57 -8.692 13.157 -4.576 1.00 1.00 N ATOM 923 CA ARG A 57 -9.107 11.867 -4.052 1.00 1.00 C ATOM 924 C ARG A 57 -9.475 11.991 -2.577 1.00 1.00 C ATOM 925 O ARG A 57 -8.969 12.875 -1.880 1.00 1.00 O ATOM 926 CB ARG A 57 -8.008 10.826 -4.250 1.00 1.00 C ATOM 927 CG ARG A 57 -8.307 9.806 -5.330 1.00 1.00 C ATOM 928 CD ARG A 57 -8.592 10.469 -6.671 1.00 1.00 C ATOM 929 NE ARG A 57 -9.964 10.231 -7.116 1.00 1.00 N ATOM 930 CZ ARG A 57 -10.597 10.990 -8.009 1.00 1.00 C ATOM 931 NH1 ARG A 57 -9.979 12.019 -8.573 1.00 1.00 N ATOM 932 NH2 ARG A 57 -11.851 10.714 -8.342 1.00 1.00 N ATOM 0 H ARG A 57 -7.890 13.566 -4.097 1.00 1.00 H new ATOM 0 HA ARG A 57 -9.988 11.536 -4.602 1.00 1.00 H new ATOM 0 HB2 ARG A 57 -7.078 11.338 -4.497 1.00 1.00 H new ATOM 0 HB3 ARG A 57 -7.844 10.303 -3.308 1.00 1.00 H new ATOM 0 HG2 ARG A 57 -7.461 9.127 -5.433 1.00 1.00 H new ATOM 0 HG3 ARG A 57 -9.165 9.203 -5.033 1.00 1.00 H new ATOM 0 HD2 ARG A 57 -8.418 11.542 -6.590 1.00 1.00 H new ATOM 0 HD3 ARG A 57 -7.897 10.089 -7.419 1.00 1.00 H new ATOM 0 HE ARG A 57 -10.466 9.437 -6.719 1.00 1.00 H new ATOM 0 HH11 ARG A 57 -9.013 12.233 -8.324 1.00 1.00 H new ATOM 0 HH12 ARG A 57 -10.469 12.596 -9.256 1.00 1.00 H new ATOM 0 HH21 ARG A 57 -12.330 9.921 -7.914 1.00 1.00 H new ATOM 0 HH22 ARG A 57 -12.337 11.295 -9.026 1.00 1.00 H new ATOM 946 N THR A 58 -10.371 11.112 -2.110 1.00 1.00 N ATOM 947 CA THR A 58 -10.807 11.142 -0.713 1.00 1.00 C ATOM 948 C THR A 58 -9.748 10.535 0.214 1.00 1.00 C ATOM 949 O THR A 58 -9.873 9.390 0.657 1.00 1.00 O ATOM 950 CB THR A 58 -12.127 10.381 -0.568 1.00 1.00 C ATOM 951 OG1 THR A 58 -12.335 9.504 -1.672 1.00 1.00 O ATOM 952 CG2 THR A 58 -13.332 11.302 -0.488 1.00 1.00 C ATOM 0 H THR A 58 -10.803 10.380 -2.674 1.00 1.00 H new ATOM 0 HA THR A 58 -10.951 12.183 -0.423 1.00 1.00 H new ATOM 0 HB THR A 58 -12.039 9.823 0.365 1.00 1.00 H new ATOM 0 HG1 THR A 58 -11.635 8.818 -1.681 1.00 1.00 H new ATOM 0 HG21 THR A 58 -14.239 10.706 -0.386 1.00 1.00 H new ATOM 0 HG22 THR A 58 -13.231 11.960 0.375 1.00 1.00 H new ATOM 0 HG23 THR A 58 -13.392 11.902 -1.396 1.00 1.00 H new ATOM 960 N ASN A 59 -8.724 11.324 0.509 1.00 1.00 N ATOM 961 CA ASN A 59 -7.644 10.891 1.381 1.00 1.00 C ATOM 962 C ASN A 59 -7.765 11.565 2.748 1.00 1.00 C ATOM 963 O ASN A 59 -8.132 12.745 2.835 1.00 1.00 O ATOM 964 CB ASN A 59 -6.284 11.202 0.757 1.00 1.00 C ATOM 965 CG ASN A 59 -5.574 9.957 0.267 1.00 1.00 C ATOM 966 OD1 ASN A 59 -4.387 9.763 0.524 1.00 1.00 O ATOM 967 ND2 ASN A 59 -6.297 9.104 -0.448 1.00 1.00 N ATOM 0 H ASN A 59 -8.620 12.274 0.153 1.00 1.00 H new ATOM 0 HA ASN A 59 -7.722 9.812 1.511 1.00 1.00 H new ATOM 0 HB2 ASN A 59 -6.419 11.891 -0.076 1.00 1.00 H new ATOM 0 HB3 ASN A 59 -5.658 11.709 1.491 1.00 1.00 H new ATOM 0 HD21 ASN A 59 -5.871 8.250 -0.807 1.00 1.00 H new ATOM 0 HD22 ASN A 59 -7.279 9.303 -0.639 1.00 1.00 H new ATOM 974 N VAL A 60 -7.449 10.840 3.805 1.00 1.00 N ATOM 975 CA VAL A 60 -7.516 11.409 5.149 1.00 1.00 C ATOM 976 C VAL A 60 -6.154 11.306 5.846 1.00 1.00 C ATOM 977 O VAL A 60 -5.560 10.231 5.902 1.00 1.00 O ATOM 978 CB VAL A 60 -8.582 10.695 6.000 1.00 1.00 C ATOM 979 CG1 VAL A 60 -9.980 11.041 5.532 1.00 1.00 C ATOM 980 CG2 VAL A 60 -8.360 9.186 5.970 1.00 1.00 C ATOM 0 H VAL A 60 -7.146 9.867 3.767 1.00 1.00 H new ATOM 0 HA VAL A 60 -7.792 12.459 5.049 1.00 1.00 H new ATOM 0 HB VAL A 60 -8.482 11.041 7.029 1.00 1.00 H new ATOM 0 HG11 VAL A 60 -10.710 10.522 6.152 1.00 1.00 H new ATOM 0 HG12 VAL A 60 -10.135 12.117 5.613 1.00 1.00 H new ATOM 0 HG13 VAL A 60 -10.102 10.734 4.493 1.00 1.00 H new ATOM 0 HG21 VAL A 60 -9.121 8.694 6.576 1.00 1.00 H new ATOM 0 HG22 VAL A 60 -8.427 8.829 4.942 1.00 1.00 H new ATOM 0 HG23 VAL A 60 -7.373 8.955 6.370 1.00 1.00 H new ATOM 990 N VAL A 61 -5.674 12.418 6.403 1.00 1.00 N ATOM 991 CA VAL A 61 -4.380 12.409 7.110 1.00 1.00 C ATOM 992 C VAL A 61 -4.574 11.914 8.541 1.00 1.00 C ATOM 993 O VAL A 61 -5.470 12.370 9.245 1.00 1.00 O ATOM 994 CB VAL A 61 -3.733 13.807 7.147 1.00 1.00 C ATOM 995 CG1 VAL A 61 -3.091 14.072 8.509 1.00 1.00 C ATOM 996 CG2 VAL A 61 -2.703 13.937 6.042 1.00 1.00 C ATOM 0 H VAL A 61 -6.145 13.322 6.384 1.00 1.00 H new ATOM 0 HA VAL A 61 -3.716 11.740 6.563 1.00 1.00 H new ATOM 0 HB VAL A 61 -4.513 14.551 6.988 1.00 1.00 H new ATOM 0 HG11 VAL A 61 -2.641 15.065 8.512 1.00 1.00 H new ATOM 0 HG12 VAL A 61 -3.852 14.017 9.287 1.00 1.00 H new ATOM 0 HG13 VAL A 61 -2.322 13.324 8.700 1.00 1.00 H new ATOM 0 HG21 VAL A 61 -2.253 14.929 6.079 1.00 1.00 H new ATOM 0 HG22 VAL A 61 -1.928 13.182 6.176 1.00 1.00 H new ATOM 0 HG23 VAL A 61 -3.186 13.793 5.076 1.00 1.00 H new ATOM 1006 N LEU A 62 -3.746 10.968 8.980 1.00 1.00 N ATOM 1007 CA LEU A 62 -3.875 10.452 10.328 1.00 1.00 C ATOM 1008 C LEU A 62 -2.858 11.110 11.237 1.00 1.00 C ATOM 1009 O LEU A 62 -1.658 11.100 10.960 1.00 1.00 O ATOM 1010 CB LEU A 62 -3.686 8.931 10.348 1.00 1.00 C ATOM 1011 CG LEU A 62 -4.922 8.111 10.729 1.00 1.00 C ATOM 1012 CD1 LEU A 62 -5.129 8.115 12.229 1.00 1.00 C ATOM 1013 CD2 LEU A 62 -6.162 8.645 10.020 1.00 1.00 C ATOM 0 H LEU A 62 -2.994 10.554 8.429 1.00 1.00 H new ATOM 0 HA LEU A 62 -4.878 10.681 10.688 1.00 1.00 H new ATOM 0 HB2 LEU A 62 -3.352 8.612 9.361 1.00 1.00 H new ATOM 0 HB3 LEU A 62 -2.885 8.692 11.048 1.00 1.00 H new ATOM 0 HG LEU A 62 -4.757 7.082 10.408 1.00 1.00 H new ATOM 0 HD11 LEU A 62 -6.013 7.526 12.476 1.00 1.00 H new ATOM 0 HD12 LEU A 62 -4.256 7.682 12.718 1.00 1.00 H new ATOM 0 HD13 LEU A 62 -5.267 9.139 12.574 1.00 1.00 H new ATOM 0 HD21 LEU A 62 -7.029 8.049 10.304 1.00 1.00 H new ATOM 0 HD22 LEU A 62 -6.326 9.684 10.307 1.00 1.00 H new ATOM 0 HD23 LEU A 62 -6.018 8.585 8.941 1.00 1.00 H new ATOM 1025 N THR A 63 -3.342 11.705 12.319 1.00 1.00 N ATOM 1026 CA THR A 63 -2.471 12.394 13.257 1.00 1.00 C ATOM 1027 C THR A 63 -2.834 12.042 14.689 1.00 1.00 C ATOM 1028 O THR A 63 -3.966 11.633 14.986 1.00 1.00 O ATOM 1029 CB THR A 63 -2.524 13.906 13.057 1.00 1.00 C ATOM 1030 OG1 THR A 63 -3.844 14.388 13.178 1.00 1.00 O ATOM 1031 CG2 THR A 63 -2.007 14.349 11.707 1.00 1.00 C ATOM 0 H THR A 63 -4.331 11.724 12.567 1.00 1.00 H new ATOM 0 HA THR A 63 -1.451 12.061 13.062 1.00 1.00 H new ATOM 0 HB THR A 63 -1.880 14.316 13.835 1.00 1.00 H new ATOM 0 HG1 THR A 63 -3.942 14.865 14.029 1.00 1.00 H new ATOM 0 HG21 THR A 63 -2.073 15.434 11.630 1.00 1.00 H new ATOM 0 HG22 THR A 63 -0.968 14.040 11.596 1.00 1.00 H new ATOM 0 HG23 THR A 63 -2.607 13.893 10.920 1.00 1.00 H new ATOM 1039 N HIS A 64 -1.865 12.212 15.578 1.00 1.00 N ATOM 1040 CA HIS A 64 -2.071 11.928 16.988 1.00 1.00 C ATOM 1041 C HIS A 64 -3.075 12.889 17.617 1.00 1.00 C ATOM 1042 O HIS A 64 -3.925 12.486 18.414 1.00 1.00 O ATOM 1043 CB HIS A 64 -0.741 12.013 17.745 1.00 1.00 C ATOM 1044 CG HIS A 64 -0.130 10.682 18.012 1.00 1.00 C ATOM 1045 ND1 HIS A 64 -0.556 9.844 19.021 1.00 1.00 N ATOM 1046 CD2 HIS A 64 0.878 10.030 17.386 1.00 1.00 C ATOM 1047 CE1 HIS A 64 0.165 8.736 19.005 1.00 1.00 C ATOM 1048 NE2 HIS A 64 1.041 8.824 18.022 1.00 1.00 N ATOM 0 H HIS A 64 -0.929 12.545 15.346 1.00 1.00 H new ATOM 0 HA HIS A 64 -2.474 10.918 17.062 1.00 1.00 H new ATOM 0 HB2 HIS A 64 -0.041 12.618 17.169 1.00 1.00 H new ATOM 0 HB3 HIS A 64 -0.902 12.528 18.692 1.00 1.00 H new ATOM 0 HD2 HIS A 64 1.448 10.391 16.543 1.00 1.00 H new ATOM 0 HE1 HIS A 64 0.056 7.901 19.681 1.00 1.00 H new ATOM 0 HE2 HIS A 64 1.728 8.112 17.775 1.00 1.00 H new ATOM 1057 N GLN A 65 -2.965 14.170 17.270 1.00 1.00 N ATOM 1058 CA GLN A 65 -3.850 15.187 17.823 1.00 1.00 C ATOM 1059 C GLN A 65 -4.928 15.620 16.835 1.00 1.00 C ATOM 1060 O GLN A 65 -4.647 15.903 15.676 1.00 1.00 O ATOM 1061 CB GLN A 65 -3.033 16.405 18.259 1.00 1.00 C ATOM 1062 CG GLN A 65 -2.532 16.330 19.698 1.00 1.00 C ATOM 1063 CD GLN A 65 -3.478 16.993 20.678 1.00 1.00 C ATOM 1064 OE1 GLN A 65 -3.912 18.127 20.481 1.00 1.00 O ATOM 1065 NE2 GLN A 65 -3.812 16.276 21.746 1.00 1.00 N ATOM 0 H GLN A 65 -2.273 14.525 16.610 1.00 1.00 H new ATOM 0 HA GLN A 65 -4.353 14.745 18.683 1.00 1.00 H new ATOM 0 HB2 GLN A 65 -2.178 16.514 17.592 1.00 1.00 H new ATOM 0 HB3 GLN A 65 -3.644 17.300 18.143 1.00 1.00 H new ATOM 0 HG2 GLN A 65 -2.398 15.285 19.978 1.00 1.00 H new ATOM 0 HG3 GLN A 65 -1.554 16.806 19.764 1.00 1.00 H new ATOM 0 HE21 GLN A 65 -3.429 15.339 21.871 1.00 1.00 H new ATOM 0 HE22 GLN A 65 -4.451 16.663 22.440 1.00 1.00 H new ATOM 1074 N GLU A 66 -6.164 15.663 17.320 1.00 1.00 N ATOM 1075 CA GLU A 66 -7.314 16.069 16.522 1.00 1.00 C ATOM 1076 C GLU A 66 -7.212 17.553 16.148 1.00 1.00 C ATOM 1077 O GLU A 66 -7.609 17.958 15.059 1.00 1.00 O ATOM 1078 CB GLU A 66 -8.615 15.804 17.289 1.00 1.00 C ATOM 1079 CG GLU A 66 -8.856 16.782 18.428 1.00 1.00 C ATOM 1080 CD GLU A 66 -10.163 16.529 19.143 1.00 1.00 C ATOM 1081 OE1 GLU A 66 -11.224 16.908 18.602 1.00 1.00 O ATOM 1082 OE2 GLU A 66 -10.128 15.951 20.248 1.00 1.00 O ATOM 0 H GLU A 66 -6.397 15.416 18.282 1.00 1.00 H new ATOM 0 HA GLU A 66 -7.322 15.480 15.605 1.00 1.00 H new ATOM 0 HB2 GLU A 66 -9.454 15.853 16.594 1.00 1.00 H new ATOM 0 HB3 GLU A 66 -8.592 14.790 17.689 1.00 1.00 H new ATOM 0 HG2 GLU A 66 -8.036 16.712 19.142 1.00 1.00 H new ATOM 0 HG3 GLU A 66 -8.851 17.799 18.036 1.00 1.00 H new ATOM 1089 N ASP A 67 -6.682 18.339 17.073 1.00 1.00 N ATOM 1090 CA ASP A 67 -6.528 19.777 16.893 1.00 1.00 C ATOM 1091 C ASP A 67 -5.546 20.091 15.757 1.00 1.00 C ATOM 1092 O ASP A 67 -5.720 21.094 15.067 1.00 1.00 O ATOM 1093 CB ASP A 67 -6.052 20.417 18.200 1.00 1.00 C ATOM 1094 CG ASP A 67 -6.290 21.911 18.227 1.00 1.00 C ATOM 1095 OD1 ASP A 67 -7.461 22.323 18.364 1.00 1.00 O ATOM 1096 OD2 ASP A 67 -5.303 22.671 18.124 1.00 1.00 O ATOM 0 H ASP A 67 -6.345 17.997 17.973 1.00 1.00 H new ATOM 0 HA ASP A 67 -7.498 20.195 16.622 1.00 1.00 H new ATOM 0 HB2 ASP A 67 -6.571 19.953 19.039 1.00 1.00 H new ATOM 0 HB3 ASP A 67 -4.989 20.218 18.333 1.00 1.00 H new ATOM 1101 N TYR A 68 -4.529 19.261 15.567 1.00 1.00 N ATOM 1102 CA TYR A 68 -3.557 19.502 14.507 1.00 1.00 C ATOM 1103 C TYR A 68 -4.248 19.523 13.144 1.00 1.00 C ATOM 1104 O TYR A 68 -5.132 18.714 12.863 1.00 1.00 O ATOM 1105 CB TYR A 68 -2.457 18.420 14.537 1.00 1.00 C ATOM 1106 CG TYR A 68 -1.054 18.973 14.660 1.00 1.00 C ATOM 1107 CD1 TYR A 68 -0.584 19.482 15.867 1.00 1.00 C ATOM 1108 CD2 TYR A 68 -0.198 18.988 13.563 1.00 1.00 C ATOM 1109 CE1 TYR A 68 0.697 19.989 15.976 1.00 1.00 C ATOM 1110 CE2 TYR A 68 1.084 19.493 13.666 1.00 1.00 C ATOM 1111 CZ TYR A 68 1.526 19.993 14.873 1.00 1.00 C ATOM 1112 OH TYR A 68 2.808 20.489 14.992 1.00 1.00 O ATOM 0 H TYR A 68 -4.356 18.425 16.125 1.00 1.00 H new ATOM 0 HA TYR A 68 -3.094 20.475 14.673 1.00 1.00 H new ATOM 0 HB2 TYR A 68 -2.646 17.747 15.373 1.00 1.00 H new ATOM 0 HB3 TYR A 68 -2.523 17.824 13.627 1.00 1.00 H new ATOM 0 HD1 TYR A 68 -1.231 19.481 16.732 1.00 1.00 H new ATOM 0 HD2 TYR A 68 -0.541 18.599 12.616 1.00 1.00 H new ATOM 0 HE1 TYR A 68 1.047 20.380 16.920 1.00 1.00 H new ATOM 0 HE2 TYR A 68 1.737 19.496 12.806 1.00 1.00 H new ATOM 0 HH TYR A 68 3.266 20.422 14.128 1.00 1.00 H new ATOM 1122 N GLN A 69 -3.862 20.485 12.310 1.00 1.00 N ATOM 1123 CA GLN A 69 -4.463 20.643 10.991 1.00 1.00 C ATOM 1124 C GLN A 69 -3.565 20.091 9.883 1.00 1.00 C ATOM 1125 O GLN A 69 -2.348 20.308 9.871 1.00 1.00 O ATOM 1126 CB GLN A 69 -4.748 22.114 10.719 1.00 1.00 C ATOM 1127 CG GLN A 69 -3.489 22.967 10.616 1.00 1.00 C ATOM 1128 CD GLN A 69 -3.779 24.439 10.819 1.00 1.00 C ATOM 1129 OE1 GLN A 69 -3.492 25.262 9.950 1.00 1.00 O ATOM 1130 NE2 GLN A 69 -4.350 24.779 11.969 1.00 1.00 N ATOM 0 H GLN A 69 -3.135 21.167 12.526 1.00 1.00 H new ATOM 0 HA GLN A 69 -5.393 20.074 10.989 1.00 1.00 H new ATOM 0 HB2 GLN A 69 -5.313 22.201 9.791 1.00 1.00 H new ATOM 0 HB3 GLN A 69 -5.380 22.507 11.516 1.00 1.00 H new ATOM 0 HG2 GLN A 69 -2.765 22.635 11.360 1.00 1.00 H new ATOM 0 HG3 GLN A 69 -3.031 22.820 9.638 1.00 1.00 H new ATOM 0 HE21 GLN A 69 -4.570 24.062 12.661 1.00 1.00 H new ATOM 0 HE22 GLN A 69 -4.568 25.757 12.161 1.00 1.00 H new ATOM 1139 N ALA A 70 -4.182 19.365 8.960 1.00 1.00 N ATOM 1140 CA ALA A 70 -3.459 18.764 7.841 1.00 1.00 C ATOM 1141 C ALA A 70 -4.049 19.210 6.508 1.00 1.00 C ATOM 1142 O ALA A 70 -5.251 19.466 6.408 1.00 1.00 O ATOM 1143 CB ALA A 70 -3.473 17.255 7.955 1.00 1.00 C ATOM 0 H ALA A 70 -5.184 19.176 8.962 1.00 1.00 H new ATOM 0 HA ALA A 70 -2.424 19.105 7.880 1.00 1.00 H new ATOM 0 HB1 ALA A 70 -2.931 16.822 7.115 1.00 1.00 H new ATOM 0 HB2 ALA A 70 -2.995 16.956 8.888 1.00 1.00 H new ATOM 0 HB3 ALA A 70 -4.503 16.899 7.945 1.00 1.00 H new ATOM 1149 N GLN A 71 -3.204 19.340 5.504 1.00 1.00 N ATOM 1150 CA GLN A 71 -3.657 19.790 4.190 1.00 1.00 C ATOM 1151 C GLN A 71 -3.717 18.641 3.188 1.00 1.00 C ATOM 1152 O GLN A 71 -2.806 17.818 3.086 1.00 1.00 O ATOM 1153 CB GLN A 71 -2.738 20.888 3.658 1.00 1.00 C ATOM 1154 CG GLN A 71 -3.325 21.672 2.506 1.00 1.00 C ATOM 1155 CD GLN A 71 -2.275 22.326 1.640 1.00 1.00 C ATOM 1156 OE1 GLN A 71 -1.099 22.354 2.005 1.00 1.00 O ATOM 1157 NE2 GLN A 71 -2.681 22.853 0.491 1.00 1.00 N ATOM 0 H GLN A 71 -2.205 19.143 5.566 1.00 1.00 H new ATOM 0 HA GLN A 71 -4.665 20.186 4.312 1.00 1.00 H new ATOM 0 HB2 GLN A 71 -2.502 21.576 4.470 1.00 1.00 H new ATOM 0 HB3 GLN A 71 -1.798 20.438 3.337 1.00 1.00 H new ATOM 0 HG2 GLN A 71 -3.931 21.006 1.892 1.00 1.00 H new ATOM 0 HG3 GLN A 71 -3.993 22.439 2.899 1.00 1.00 H new ATOM 0 HE21 GLN A 71 -3.666 22.807 0.228 1.00 1.00 H new ATOM 0 HE22 GLN A 71 -2.008 23.304 -0.129 1.00 1.00 H new ATOM 1166 N GLY A 72 -4.809 18.581 2.457 1.00 1.00 N ATOM 1167 CA GLY A 72 -4.974 17.547 1.455 1.00 1.00 C ATOM 1168 C GLY A 72 -5.718 16.335 1.978 1.00 1.00 C ATOM 1169 O GLY A 72 -6.263 15.557 1.212 1.00 1.00 O ATOM 0 H GLY A 72 -5.592 19.230 2.535 1.00 1.00 H new ATOM 0 HA2 GLY A 72 -5.513 17.958 0.601 1.00 1.00 H new ATOM 0 HA3 GLY A 72 -3.993 17.238 1.094 1.00 1.00 H new ATOM 1173 N ALA A 73 -5.727 16.158 3.299 1.00 1.00 N ATOM 1174 CA ALA A 73 -6.414 15.008 3.893 1.00 1.00 C ATOM 1175 C ALA A 73 -7.004 15.311 5.271 1.00 1.00 C ATOM 1176 O ALA A 73 -6.400 16.005 6.068 1.00 1.00 O ATOM 1177 CB ALA A 73 -5.457 13.840 3.958 1.00 1.00 C ATOM 0 H ALA A 73 -5.276 16.782 3.968 1.00 1.00 H new ATOM 0 HA ALA A 73 -7.262 14.759 3.255 1.00 1.00 H new ATOM 0 HB1 ALA A 73 -5.962 12.980 4.399 1.00 1.00 H new ATOM 0 HB2 ALA A 73 -5.122 13.587 2.952 1.00 1.00 H new ATOM 0 HB3 ALA A 73 -4.596 14.109 4.570 1.00 1.00 H new ATOM 1183 N VAL A 74 -8.178 14.738 5.557 1.00 1.00 N ATOM 1184 CA VAL A 74 -8.853 14.951 6.850 1.00 1.00 C ATOM 1185 C VAL A 74 -8.075 14.362 8.029 1.00 1.00 C ATOM 1186 O VAL A 74 -7.528 13.267 7.929 1.00 1.00 O ATOM 1187 CB VAL A 74 -10.272 14.349 6.835 1.00 1.00 C ATOM 1188 CG1 VAL A 74 -11.090 14.879 8.004 1.00 1.00 C ATOM 1189 CG2 VAL A 74 -10.961 14.647 5.507 1.00 1.00 C ATOM 0 H VAL A 74 -8.682 14.125 4.916 1.00 1.00 H new ATOM 0 HA VAL A 74 -8.907 16.031 6.987 1.00 1.00 H new ATOM 0 HB VAL A 74 -10.193 13.267 6.942 1.00 1.00 H new ATOM 0 HG11 VAL A 74 -12.089 14.443 7.977 1.00 1.00 H new ATOM 0 HG12 VAL A 74 -10.602 14.610 8.941 1.00 1.00 H new ATOM 0 HG13 VAL A 74 -11.166 15.964 7.933 1.00 1.00 H new ATOM 0 HG21 VAL A 74 -11.962 14.216 5.512 1.00 1.00 H new ATOM 0 HG22 VAL A 74 -11.031 15.726 5.368 1.00 1.00 H new ATOM 0 HG23 VAL A 74 -10.383 14.213 4.692 1.00 1.00 H new ATOM 1199 N VAL A 75 -8.021 15.115 9.136 1.00 1.00 N ATOM 1200 CA VAL A 75 -7.290 14.674 10.321 1.00 1.00 C ATOM 1201 C VAL A 75 -8.181 13.888 11.282 1.00 1.00 C ATOM 1202 O VAL A 75 -9.143 14.410 11.844 1.00 1.00 O ATOM 1203 CB VAL A 75 -6.720 15.885 11.103 1.00 1.00 C ATOM 1204 CG1 VAL A 75 -6.527 15.538 12.577 1.00 1.00 C ATOM 1205 CG2 VAL A 75 -5.417 16.340 10.473 1.00 1.00 C ATOM 0 H VAL A 75 -8.473 16.025 9.231 1.00 1.00 H new ATOM 0 HA VAL A 75 -6.485 14.034 9.959 1.00 1.00 H new ATOM 0 HB VAL A 75 -7.435 16.706 11.050 1.00 1.00 H new ATOM 0 HG11 VAL A 75 -6.126 16.403 13.105 1.00 1.00 H new ATOM 0 HG12 VAL A 75 -7.486 15.259 13.014 1.00 1.00 H new ATOM 0 HG13 VAL A 75 -5.831 14.704 12.666 1.00 1.00 H new ATOM 0 HG21 VAL A 75 -5.022 17.191 11.028 1.00 1.00 H new ATOM 0 HG22 VAL A 75 -4.695 15.523 10.500 1.00 1.00 H new ATOM 0 HG23 VAL A 75 -5.596 16.633 9.438 1.00 1.00 H new ATOM 1215 N VAL A 76 -7.832 12.621 11.468 1.00 1.00 N ATOM 1216 CA VAL A 76 -8.564 11.745 12.380 1.00 1.00 C ATOM 1217 C VAL A 76 -7.612 11.130 13.414 1.00 1.00 C ATOM 1218 O VAL A 76 -6.560 10.614 13.053 1.00 1.00 O ATOM 1219 CB VAL A 76 -9.290 10.610 11.627 1.00 1.00 C ATOM 1220 CG1 VAL A 76 -10.096 9.761 12.584 1.00 1.00 C ATOM 1221 CG2 VAL A 76 -10.186 11.175 10.530 1.00 1.00 C ATOM 0 H VAL A 76 -7.044 12.174 10.999 1.00 1.00 H new ATOM 0 HA VAL A 76 -9.311 12.360 12.882 1.00 1.00 H new ATOM 0 HB VAL A 76 -8.535 9.978 11.161 1.00 1.00 H new ATOM 0 HG11 VAL A 76 -10.599 8.968 12.031 1.00 1.00 H new ATOM 0 HG12 VAL A 76 -9.432 9.320 13.328 1.00 1.00 H new ATOM 0 HG13 VAL A 76 -10.839 10.382 13.084 1.00 1.00 H new ATOM 0 HG21 VAL A 76 -10.688 10.357 10.013 1.00 1.00 H new ATOM 0 HG22 VAL A 76 -10.931 11.835 10.973 1.00 1.00 H new ATOM 0 HG23 VAL A 76 -9.580 11.737 9.819 1.00 1.00 H new ATOM 1231 N HIS A 77 -7.975 11.202 14.695 1.00 1.00 N ATOM 1232 CA HIS A 77 -7.113 10.654 15.724 1.00 1.00 C ATOM 1233 C HIS A 77 -7.608 9.300 16.235 1.00 1.00 C ATOM 1234 O HIS A 77 -6.894 8.616 16.961 1.00 1.00 O ATOM 1235 CB HIS A 77 -6.974 11.640 16.890 1.00 1.00 C ATOM 1236 CG HIS A 77 -8.246 11.888 17.628 1.00 1.00 C ATOM 1237 ND1 HIS A 77 -9.385 12.510 17.246 1.00 1.00 N flip ATOM 1238 CD2 HIS A 77 -8.452 11.479 18.929 1.00 1.00 C flip ATOM 1239 CE1 HIS A 77 -10.249 12.468 18.311 1.00 1.00 C flip ATOM 1240 NE2 HIS A 77 -9.663 11.839 19.314 1.00 1.00 N flip ATOM 0 H HIS A 77 -8.840 11.625 15.032 1.00 1.00 H new ATOM 0 HA HIS A 77 -6.135 10.494 15.269 1.00 1.00 H new ATOM 0 HB2 HIS A 77 -6.229 11.259 17.588 1.00 1.00 H new ATOM 0 HB3 HIS A 77 -6.597 12.588 16.508 1.00 1.00 H new ATOM 0 HD2 HIS A 77 -7.735 10.948 19.538 1.00 1.00 H new ATOM 0 HE1 HIS A 77 -11.246 12.882 18.327 1.00 1.00 H new ATOM 0 HE2 HIS A 77 -10.076 11.662 20.230 1.00 1.00 H new ATOM 1249 N ASP A 78 -8.827 8.913 15.874 1.00 1.00 N ATOM 1250 CA ASP A 78 -9.370 7.639 16.345 1.00 1.00 C ATOM 1251 C ASP A 78 -9.234 6.548 15.282 1.00 1.00 C ATOM 1252 O ASP A 78 -9.940 6.551 14.286 1.00 1.00 O ATOM 1253 CB ASP A 78 -10.838 7.805 16.718 1.00 1.00 C ATOM 1254 CG ASP A 78 -11.014 8.185 18.174 1.00 1.00 C ATOM 1255 OD1 ASP A 78 -11.048 7.273 19.025 1.00 1.00 O ATOM 1256 OD2 ASP A 78 -11.134 9.395 18.462 1.00 1.00 O ATOM 0 H ASP A 78 -9.449 9.449 15.269 1.00 1.00 H new ATOM 0 HA ASP A 78 -8.798 7.336 17.222 1.00 1.00 H new ATOM 0 HB2 ASP A 78 -11.288 8.571 16.086 1.00 1.00 H new ATOM 0 HB3 ASP A 78 -11.370 6.875 16.519 1.00 1.00 H new ATOM 1261 N VAL A 79 -8.346 5.602 15.530 1.00 1.00 N ATOM 1262 CA VAL A 79 -8.145 4.493 14.606 1.00 1.00 C ATOM 1263 C VAL A 79 -9.424 3.658 14.500 1.00 1.00 C ATOM 1264 O VAL A 79 -9.835 3.246 13.414 1.00 1.00 O ATOM 1265 CB VAL A 79 -6.974 3.586 15.049 1.00 1.00 C ATOM 1266 CG1 VAL A 79 -5.678 4.390 15.158 1.00 1.00 C ATOM 1267 CG2 VAL A 79 -7.292 2.930 16.380 1.00 1.00 C ATOM 0 H VAL A 79 -7.753 5.576 16.360 1.00 1.00 H new ATOM 0 HA VAL A 79 -7.898 4.917 13.633 1.00 1.00 H new ATOM 0 HB VAL A 79 -6.838 2.811 14.295 1.00 1.00 H new ATOM 0 HG11 VAL A 79 -4.867 3.732 15.471 1.00 1.00 H new ATOM 0 HG12 VAL A 79 -5.438 4.826 14.188 1.00 1.00 H new ATOM 0 HG13 VAL A 79 -5.804 5.186 15.892 1.00 1.00 H new ATOM 0 HG21 VAL A 79 -6.459 2.294 16.680 1.00 1.00 H new ATOM 0 HG22 VAL A 79 -7.452 3.699 17.136 1.00 1.00 H new ATOM 0 HG23 VAL A 79 -8.193 2.325 16.281 1.00 1.00 H new ATOM 1277 N ALA A 80 -10.038 3.409 15.658 1.00 1.00 N ATOM 1278 CA ALA A 80 -11.265 2.621 15.742 1.00 1.00 C ATOM 1279 C ALA A 80 -12.422 3.292 15.007 1.00 1.00 C ATOM 1280 O ALA A 80 -13.247 2.617 14.387 1.00 1.00 O ATOM 1281 CB ALA A 80 -11.641 2.395 17.197 1.00 1.00 C ATOM 0 H ALA A 80 -9.699 3.747 16.559 1.00 1.00 H new ATOM 0 HA ALA A 80 -11.074 1.663 15.259 1.00 1.00 H new ATOM 0 HB1 ALA A 80 -12.557 1.807 17.249 1.00 1.00 H new ATOM 0 HB2 ALA A 80 -10.837 1.860 17.702 1.00 1.00 H new ATOM 0 HB3 ALA A 80 -11.799 3.356 17.685 1.00 1.00 H new ATOM 1287 N ALA A 81 -12.491 4.615 15.078 1.00 1.00 N ATOM 1288 CA ALA A 81 -13.575 5.348 14.432 1.00 1.00 C ATOM 1289 C ALA A 81 -13.539 5.155 12.916 1.00 1.00 C ATOM 1290 O ALA A 81 -14.572 5.008 12.271 1.00 1.00 O ATOM 1291 CB ALA A 81 -13.478 6.825 14.766 1.00 1.00 C ATOM 0 H ALA A 81 -11.816 5.199 15.572 1.00 1.00 H new ATOM 0 HA ALA A 81 -14.520 4.955 14.807 1.00 1.00 H new ATOM 0 HB1 ALA A 81 -14.292 7.362 14.279 1.00 1.00 H new ATOM 0 HB2 ALA A 81 -13.549 6.959 15.845 1.00 1.00 H new ATOM 0 HB3 ALA A 81 -12.523 7.216 14.414 1.00 1.00 H new ATOM 1297 N VAL A 82 -12.338 5.114 12.361 1.00 1.00 N ATOM 1298 CA VAL A 82 -12.159 4.896 10.930 1.00 1.00 C ATOM 1299 C VAL A 82 -12.703 3.519 10.529 1.00 1.00 C ATOM 1300 O VAL A 82 -13.386 3.381 9.516 1.00 1.00 O ATOM 1301 CB VAL A 82 -10.677 5.002 10.519 1.00 1.00 C ATOM 1302 CG1 VAL A 82 -10.525 4.726 9.031 1.00 1.00 C ATOM 1303 CG2 VAL A 82 -10.112 6.361 10.886 1.00 1.00 C ATOM 0 H VAL A 82 -11.468 5.229 12.880 1.00 1.00 H new ATOM 0 HA VAL A 82 -12.715 5.676 10.410 1.00 1.00 H new ATOM 0 HB VAL A 82 -10.108 4.250 11.066 1.00 1.00 H new ATOM 0 HG11 VAL A 82 -9.474 4.804 8.752 1.00 1.00 H new ATOM 0 HG12 VAL A 82 -10.886 3.722 8.808 1.00 1.00 H new ATOM 0 HG13 VAL A 82 -11.105 5.454 8.465 1.00 1.00 H new ATOM 0 HG21 VAL A 82 -9.065 6.413 10.587 1.00 1.00 H new ATOM 0 HG22 VAL A 82 -10.675 7.140 10.372 1.00 1.00 H new ATOM 0 HG23 VAL A 82 -10.189 6.508 11.963 1.00 1.00 H new ATOM 1313 N PHE A 83 -12.386 2.520 11.338 1.00 1.00 N ATOM 1314 CA PHE A 83 -12.819 1.146 11.097 1.00 1.00 C ATOM 1315 C PHE A 83 -14.344 1.029 11.100 1.00 1.00 C ATOM 1316 O PHE A 83 -14.928 0.380 10.222 1.00 1.00 O ATOM 1317 CB PHE A 83 -12.229 0.209 12.149 1.00 1.00 C ATOM 1318 CG PHE A 83 -12.022 -1.197 11.663 1.00 1.00 C ATOM 1319 CD1 PHE A 83 -13.070 -2.104 11.653 1.00 1.00 C ATOM 1320 CD2 PHE A 83 -10.774 -1.613 11.228 1.00 1.00 C ATOM 1321 CE1 PHE A 83 -12.878 -3.400 11.215 1.00 1.00 C ATOM 1322 CE2 PHE A 83 -10.575 -2.909 10.790 1.00 1.00 C ATOM 1323 CZ PHE A 83 -11.628 -3.804 10.783 1.00 1.00 C ATOM 0 H PHE A 83 -11.822 2.635 12.180 1.00 1.00 H new ATOM 0 HA PHE A 83 -12.457 0.857 10.110 1.00 1.00 H new ATOM 0 HB2 PHE A 83 -11.273 0.611 12.485 1.00 1.00 H new ATOM 0 HB3 PHE A 83 -12.889 0.190 13.016 1.00 1.00 H new ATOM 0 HD1 PHE A 83 -14.048 -1.794 11.991 1.00 1.00 H new ATOM 0 HD2 PHE A 83 -9.948 -0.917 11.231 1.00 1.00 H new ATOM 0 HE1 PHE A 83 -13.703 -4.097 11.210 1.00 1.00 H new ATOM 0 HE2 PHE A 83 -9.598 -3.222 10.454 1.00 1.00 H new ATOM 0 HZ PHE A 83 -11.475 -4.817 10.441 1.00 1.00 H new ATOM 1333 N ALA A 84 -14.984 1.643 12.089 1.00 1.00 N ATOM 1334 CA ALA A 84 -16.441 1.600 12.216 1.00 1.00 C ATOM 1335 C ALA A 84 -17.131 2.264 11.022 1.00 1.00 C ATOM 1336 O ALA A 84 -18.169 1.806 10.573 1.00 1.00 O ATOM 1337 CB ALA A 84 -16.885 2.264 13.516 1.00 1.00 C ATOM 0 H ALA A 84 -14.516 2.180 12.819 1.00 1.00 H new ATOM 0 HA ALA A 84 -16.737 0.551 12.233 1.00 1.00 H new ATOM 0 HB1 ALA A 84 -17.971 2.223 13.593 1.00 1.00 H new ATOM 0 HB2 ALA A 84 -16.441 1.740 14.362 1.00 1.00 H new ATOM 0 HB3 ALA A 84 -16.560 3.304 13.522 1.00 1.00 H new ATOM 1343 N TYR A 85 -16.550 3.350 10.517 1.00 1.00 N ATOM 1344 CA TYR A 85 -17.142 4.052 9.386 1.00 1.00 C ATOM 1345 C TYR A 85 -17.236 3.128 8.164 1.00 1.00 C ATOM 1346 O TYR A 85 -18.273 3.047 7.515 1.00 1.00 O ATOM 1347 CB TYR A 85 -16.331 5.297 9.048 1.00 1.00 C ATOM 1348 CG TYR A 85 -16.647 6.479 9.935 1.00 1.00 C ATOM 1349 CD1 TYR A 85 -17.961 6.870 10.162 1.00 1.00 C ATOM 1350 CD2 TYR A 85 -15.631 7.213 10.532 1.00 1.00 C ATOM 1351 CE1 TYR A 85 -18.253 7.961 10.959 1.00 1.00 C ATOM 1352 CE2 TYR A 85 -15.915 8.305 11.332 1.00 1.00 C ATOM 1353 CZ TYR A 85 -17.227 8.674 11.542 1.00 1.00 C ATOM 1354 OH TYR A 85 -17.513 9.772 12.327 1.00 1.00 O ATOM 0 H TYR A 85 -15.683 3.757 10.868 1.00 1.00 H new ATOM 0 HA TYR A 85 -18.150 4.359 9.664 1.00 1.00 H new ATOM 0 HB2 TYR A 85 -15.270 5.064 9.131 1.00 1.00 H new ATOM 0 HB3 TYR A 85 -16.517 5.572 8.010 1.00 1.00 H new ATOM 0 HD1 TYR A 85 -18.767 6.312 9.708 1.00 1.00 H new ATOM 0 HD2 TYR A 85 -14.602 6.927 10.369 1.00 1.00 H new ATOM 0 HE1 TYR A 85 -19.279 8.253 11.124 1.00 1.00 H new ATOM 0 HE2 TYR A 85 -15.113 8.866 11.790 1.00 1.00 H new ATOM 0 HH TYR A 85 -16.678 10.160 12.663 1.00 1.00 H new ATOM 1364 N ALA A 86 -16.141 2.432 7.877 1.00 1.00 N ATOM 1365 CA ALA A 86 -16.110 1.512 6.748 1.00 1.00 C ATOM 1366 C ALA A 86 -17.100 0.371 6.976 1.00 1.00 C ATOM 1367 O ALA A 86 -17.774 -0.096 6.055 1.00 1.00 O ATOM 1368 CB ALA A 86 -14.707 0.961 6.541 1.00 1.00 C ATOM 0 H ALA A 86 -15.271 2.487 8.406 1.00 1.00 H new ATOM 0 HA ALA A 86 -16.398 2.057 5.849 1.00 1.00 H new ATOM 0 HB1 ALA A 86 -14.707 0.276 5.693 1.00 1.00 H new ATOM 0 HB2 ALA A 86 -14.019 1.783 6.344 1.00 1.00 H new ATOM 0 HB3 ALA A 86 -14.389 0.429 7.437 1.00 1.00 H new ATOM 1374 N LYS A 87 -17.189 -0.069 8.235 1.00 1.00 N ATOM 1375 CA LYS A 87 -18.098 -1.137 8.602 1.00 1.00 C ATOM 1376 C LYS A 87 -19.534 -0.707 8.343 1.00 1.00 C ATOM 1377 O LYS A 87 -20.357 -1.497 7.894 1.00 1.00 O ATOM 1378 CB LYS A 87 -17.900 -1.530 10.068 1.00 1.00 C ATOM 1379 CG LYS A 87 -18.611 -2.823 10.440 1.00 1.00 C ATOM 1380 CD LYS A 87 -19.357 -2.707 11.753 1.00 1.00 C ATOM 1381 CE LYS A 87 -18.412 -2.671 12.943 1.00 1.00 C ATOM 1382 NZ LYS A 87 -18.105 -4.032 13.475 1.00 1.00 N ATOM 0 H LYS A 87 -16.640 0.303 9.010 1.00 1.00 H new ATOM 0 HA LYS A 87 -17.883 -2.012 7.989 1.00 1.00 H new ATOM 0 HB2 LYS A 87 -16.834 -1.638 10.268 1.00 1.00 H new ATOM 0 HB3 LYS A 87 -18.265 -0.725 10.706 1.00 1.00 H new ATOM 0 HG2 LYS A 87 -19.311 -3.092 9.649 1.00 1.00 H new ATOM 0 HG3 LYS A 87 -17.882 -3.630 10.508 1.00 1.00 H new ATOM 0 HD2 LYS A 87 -19.965 -1.803 11.746 1.00 1.00 H new ATOM 0 HD3 LYS A 87 -20.040 -3.550 11.858 1.00 1.00 H new ATOM 0 HE2 LYS A 87 -17.483 -2.182 12.650 1.00 1.00 H new ATOM 0 HE3 LYS A 87 -18.854 -2.067 13.735 1.00 1.00 H new ATOM 0 HZ1 LYS A 87 -17.457 -3.950 14.285 1.00 1.00 H new ATOM 0 HZ2 LYS A 87 -18.986 -4.492 13.781 1.00 1.00 H new ATOM 0 HZ3 LYS A 87 -17.658 -4.603 12.730 1.00 1.00 H new ATOM 1396 N GLN A 88 -19.823 0.563 8.611 1.00 1.00 N ATOM 1397 CA GLN A 88 -21.146 1.122 8.411 1.00 1.00 C ATOM 1398 C GLN A 88 -21.525 1.113 6.936 1.00 1.00 C ATOM 1399 O GLN A 88 -22.675 0.866 6.575 1.00 1.00 O ATOM 1400 CB GLN A 88 -21.208 2.553 8.957 1.00 1.00 C ATOM 1401 CG GLN A 88 -21.355 2.608 10.468 1.00 1.00 C ATOM 1402 CD GLN A 88 -22.568 1.823 10.972 1.00 1.00 C ATOM 1403 OE1 GLN A 88 -23.714 2.177 10.697 1.00 1.00 O ATOM 1404 NE2 GLN A 88 -22.309 0.757 11.720 1.00 1.00 N ATOM 0 H GLN A 88 -19.142 1.230 8.973 1.00 1.00 H new ATOM 0 HA GLN A 88 -21.859 0.502 8.954 1.00 1.00 H new ATOM 0 HB2 GLN A 88 -20.303 3.086 8.666 1.00 1.00 H new ATOM 0 HB3 GLN A 88 -22.047 3.075 8.497 1.00 1.00 H new ATOM 0 HG2 GLN A 88 -20.452 2.211 10.932 1.00 1.00 H new ATOM 0 HG3 GLN A 88 -21.444 3.648 10.783 1.00 1.00 H new ATOM 0 HE21 GLN A 88 -21.343 0.499 11.924 1.00 1.00 H new ATOM 0 HE22 GLN A 88 -23.076 0.196 12.091 1.00 1.00 H new ATOM 1413 N HIS A 89 -20.554 1.409 6.084 1.00 1.00 N ATOM 1414 CA HIS A 89 -20.799 1.448 4.652 1.00 1.00 C ATOM 1415 C HIS A 89 -20.028 0.349 3.930 1.00 1.00 C ATOM 1416 O HIS A 89 -18.888 0.556 3.512 1.00 1.00 O ATOM 1417 CB HIS A 89 -20.399 2.816 4.101 1.00 1.00 C ATOM 1418 CG HIS A 89 -21.212 3.943 4.643 1.00 1.00 C ATOM 1419 ND1 HIS A 89 -21.974 4.768 3.843 1.00 1.00 N ATOM 1420 CD2 HIS A 89 -21.370 4.395 5.908 1.00 1.00 C ATOM 1421 CE1 HIS A 89 -22.565 5.681 4.594 1.00 1.00 C ATOM 1422 NE2 HIS A 89 -22.216 5.476 5.850 1.00 1.00 N ATOM 0 H HIS A 89 -19.595 1.624 6.358 1.00 1.00 H new ATOM 0 HA HIS A 89 -21.862 1.281 4.480 1.00 1.00 H new ATOM 0 HB2 HIS A 89 -19.348 2.996 4.328 1.00 1.00 H new ATOM 0 HB3 HIS A 89 -20.493 2.802 3.015 1.00 1.00 H new ATOM 0 HD2 HIS A 89 -20.916 3.983 6.797 1.00 1.00 H new ATOM 0 HE1 HIS A 89 -23.222 6.462 4.240 1.00 1.00 H new ATOM 0 HE2 HIS A 89 -22.524 6.030 6.649 1.00 1.00 H new ATOM 1431 N PRO A 90 -20.651 -0.833 3.747 1.00 1.00 N ATOM 1432 CA PRO A 90 -20.022 -1.969 3.058 1.00 1.00 C ATOM 1433 C PRO A 90 -19.612 -1.623 1.624 1.00 1.00 C ATOM 1434 O PRO A 90 -18.629 -2.144 1.111 1.00 1.00 O ATOM 1435 CB PRO A 90 -21.116 -3.050 3.058 1.00 1.00 C ATOM 1436 CG PRO A 90 -22.057 -2.645 4.137 1.00 1.00 C ATOM 1437 CD PRO A 90 -22.021 -1.147 4.176 1.00 1.00 C ATOM 0 HA PRO A 90 -19.102 -2.281 3.552 1.00 1.00 H new ATOM 0 HB2 PRO A 90 -21.620 -3.101 2.093 1.00 1.00 H new ATOM 0 HB3 PRO A 90 -20.696 -4.037 3.251 1.00 1.00 H new ATOM 0 HG2 PRO A 90 -23.065 -3.006 3.931 1.00 1.00 H new ATOM 0 HG3 PRO A 90 -21.756 -3.068 5.096 1.00 1.00 H new ATOM 0 HD2 PRO A 90 -22.763 -0.709 3.508 1.00 1.00 H new ATOM 0 HD3 PRO A 90 -22.227 -0.765 5.176 1.00 1.00 H new ATOM 1445 N ASP A 91 -20.367 -0.745 0.985 1.00 1.00 N ATOM 1446 CA ASP A 91 -20.079 -0.330 -0.384 1.00 1.00 C ATOM 1447 C ASP A 91 -18.750 0.417 -0.467 1.00 1.00 C ATOM 1448 O ASP A 91 -18.018 0.300 -1.453 1.00 1.00 O ATOM 1449 CB ASP A 91 -21.207 0.574 -0.902 1.00 1.00 C ATOM 1450 CG ASP A 91 -22.250 -0.190 -1.699 1.00 1.00 C ATOM 1451 OD1 ASP A 91 -22.154 -1.435 -1.749 1.00 1.00 O ATOM 1452 OD2 ASP A 91 -23.150 0.452 -2.281 1.00 1.00 O ATOM 0 H ASP A 91 -21.190 -0.302 1.393 1.00 1.00 H new ATOM 0 HA ASP A 91 -20.010 -1.226 -1.001 1.00 1.00 H new ATOM 0 HB2 ASP A 91 -21.689 1.066 -0.058 1.00 1.00 H new ATOM 0 HB3 ASP A 91 -20.781 1.358 -1.527 1.00 1.00 H new ATOM 1457 N GLN A 92 -18.452 1.190 0.575 1.00 1.00 N ATOM 1458 CA GLN A 92 -17.211 1.951 0.634 1.00 1.00 C ATOM 1459 C GLN A 92 -16.042 1.036 1.005 1.00 1.00 C ATOM 1460 O GLN A 92 -16.148 0.199 1.907 1.00 1.00 O ATOM 1461 CB GLN A 92 -17.347 3.082 1.648 1.00 1.00 C ATOM 1462 CG GLN A 92 -18.566 3.962 1.438 1.00 1.00 C ATOM 1463 CD GLN A 92 -18.495 4.765 0.154 1.00 1.00 C ATOM 1464 OE1 GLN A 92 -17.523 5.476 -0.095 1.00 1.00 O ATOM 1465 NE2 GLN A 92 -19.527 4.652 -0.670 1.00 1.00 N ATOM 0 H GLN A 92 -19.055 1.304 1.390 1.00 1.00 H new ATOM 0 HA GLN A 92 -17.011 2.380 -0.348 1.00 1.00 H new ATOM 0 HB2 GLN A 92 -17.390 2.654 2.650 1.00 1.00 H new ATOM 0 HB3 GLN A 92 -16.452 3.703 1.605 1.00 1.00 H new ATOM 0 HG2 GLN A 92 -19.460 3.339 1.423 1.00 1.00 H new ATOM 0 HG3 GLN A 92 -18.667 4.644 2.283 1.00 1.00 H new ATOM 0 HE21 GLN A 92 -20.313 4.050 -0.423 1.00 1.00 H new ATOM 0 HE22 GLN A 92 -19.535 5.167 -1.551 1.00 1.00 H new ATOM 1474 N GLU A 93 -14.922 1.194 0.294 1.00 1.00 N ATOM 1475 CA GLU A 93 -13.729 0.386 0.534 1.00 1.00 C ATOM 1476 C GLU A 93 -12.594 1.242 1.068 1.00 1.00 C ATOM 1477 O GLU A 93 -12.255 2.286 0.494 1.00 1.00 O ATOM 1478 CB GLU A 93 -13.295 -0.311 -0.763 1.00 1.00 C ATOM 1479 CG GLU A 93 -13.294 -1.821 -0.657 1.00 1.00 C ATOM 1480 CD GLU A 93 -11.941 -2.360 -0.235 1.00 1.00 C ATOM 1481 OE1 GLU A 93 -11.538 -2.108 0.920 1.00 1.00 O ATOM 1482 OE2 GLU A 93 -11.280 -3.025 -1.060 1.00 1.00 O ATOM 0 H GLU A 93 -14.819 1.878 -0.455 1.00 1.00 H new ATOM 0 HA GLU A 93 -13.972 -0.368 1.282 1.00 1.00 H new ATOM 0 HB2 GLU A 93 -13.963 -0.010 -1.570 1.00 1.00 H new ATOM 0 HB3 GLU A 93 -12.295 0.028 -1.033 1.00 1.00 H new ATOM 0 HG2 GLU A 93 -14.050 -2.134 0.063 1.00 1.00 H new ATOM 0 HG3 GLU A 93 -13.572 -2.252 -1.619 1.00 1.00 H new ATOM 1489 N LEU A 94 -12.005 0.805 2.180 1.00 1.00 N ATOM 1490 CA LEU A 94 -10.915 1.547 2.784 1.00 1.00 C ATOM 1491 C LEU A 94 -9.551 0.899 2.527 1.00 1.00 C ATOM 1492 O LEU A 94 -9.342 -0.286 2.814 1.00 1.00 O ATOM 1493 CB LEU A 94 -11.147 1.680 4.288 1.00 1.00 C ATOM 1494 CG LEU A 94 -10.629 2.975 4.907 1.00 1.00 C ATOM 1495 CD1 LEU A 94 -11.736 4.009 4.977 1.00 1.00 C ATOM 1496 CD2 LEU A 94 -10.041 2.703 6.293 1.00 1.00 C ATOM 0 H LEU A 94 -12.265 -0.050 2.672 1.00 1.00 H new ATOM 0 HA LEU A 94 -10.900 2.532 2.319 1.00 1.00 H new ATOM 0 HB2 LEU A 94 -12.217 1.603 4.484 1.00 1.00 H new ATOM 0 HB3 LEU A 94 -10.670 0.838 4.790 1.00 1.00 H new ATOM 0 HG LEU A 94 -9.836 3.374 4.274 1.00 1.00 H new ATOM 0 HD11 LEU A 94 -11.349 4.926 5.421 1.00 1.00 H new ATOM 0 HD12 LEU A 94 -12.102 4.219 3.972 1.00 1.00 H new ATOM 0 HD13 LEU A 94 -12.553 3.626 5.588 1.00 1.00 H new ATOM 0 HD21 LEU A 94 -9.675 3.636 6.723 1.00 1.00 H new ATOM 0 HD22 LEU A 94 -10.812 2.283 6.939 1.00 1.00 H new ATOM 0 HD23 LEU A 94 -9.216 1.996 6.206 1.00 1.00 H new ATOM 1508 N VAL A 95 -8.622 1.694 2.002 1.00 1.00 N ATOM 1509 CA VAL A 95 -7.269 1.217 1.724 1.00 1.00 C ATOM 1510 C VAL A 95 -6.265 2.035 2.529 1.00 1.00 C ATOM 1511 O VAL A 95 -6.314 3.268 2.525 1.00 1.00 O ATOM 1512 CB VAL A 95 -6.943 1.314 0.213 1.00 1.00 C ATOM 1513 CG1 VAL A 95 -5.582 0.710 -0.089 1.00 1.00 C ATOM 1514 CG2 VAL A 95 -8.031 0.628 -0.609 1.00 1.00 C ATOM 0 H VAL A 95 -8.781 2.672 1.760 1.00 1.00 H new ATOM 0 HA VAL A 95 -7.204 0.169 2.016 1.00 1.00 H new ATOM 0 HB VAL A 95 -6.911 2.368 -0.063 1.00 1.00 H new ATOM 0 HG11 VAL A 95 -5.377 0.791 -1.156 1.00 1.00 H new ATOM 0 HG12 VAL A 95 -4.814 1.246 0.469 1.00 1.00 H new ATOM 0 HG13 VAL A 95 -5.577 -0.340 0.203 1.00 1.00 H new ATOM 0 HG21 VAL A 95 -7.789 0.704 -1.669 1.00 1.00 H new ATOM 0 HG22 VAL A 95 -8.093 -0.423 -0.325 1.00 1.00 H new ATOM 0 HG23 VAL A 95 -8.989 1.112 -0.420 1.00 1.00 H new ATOM 1524 N ILE A 96 -5.369 1.351 3.231 1.00 1.00 N ATOM 1525 CA ILE A 96 -4.380 2.054 4.053 1.00 1.00 C ATOM 1526 C ILE A 96 -2.980 2.019 3.450 1.00 1.00 C ATOM 1527 O ILE A 96 -2.392 0.956 3.283 1.00 1.00 O ATOM 1528 CB ILE A 96 -4.330 1.474 5.478 1.00 1.00 C ATOM 1529 CG1 ILE A 96 -5.311 2.215 6.403 1.00 1.00 C ATOM 1530 CG2 ILE A 96 -2.916 1.554 6.041 1.00 1.00 C ATOM 1531 CD1 ILE A 96 -5.342 1.660 7.804 1.00 1.00 C ATOM 0 H ILE A 96 -5.303 0.333 3.252 1.00 1.00 H new ATOM 0 HA ILE A 96 -4.706 3.093 4.089 1.00 1.00 H new ATOM 0 HB ILE A 96 -4.626 0.426 5.426 1.00 1.00 H new ATOM 0 HG12 ILE A 96 -5.037 3.269 6.443 1.00 1.00 H new ATOM 0 HG13 ILE A 96 -6.313 2.162 5.976 1.00 1.00 H new ATOM 0 HG21 ILE A 96 -2.902 1.139 7.049 1.00 1.00 H new ATOM 0 HG22 ILE A 96 -2.238 0.985 5.405 1.00 1.00 H new ATOM 0 HG23 ILE A 96 -2.595 2.595 6.073 1.00 1.00 H new ATOM 0 HD11 ILE A 96 -6.053 2.227 8.404 1.00 1.00 H new ATOM 0 HD12 ILE A 96 -5.645 0.614 7.774 1.00 1.00 H new ATOM 0 HD13 ILE A 96 -4.350 1.737 8.248 1.00 1.00 H new ATOM 1543 N ALA A 97 -2.452 3.203 3.173 1.00 1.00 N ATOM 1544 CA ALA A 97 -1.110 3.328 2.628 1.00 1.00 C ATOM 1545 C ALA A 97 -0.158 3.786 3.718 1.00 1.00 C ATOM 1546 O ALA A 97 0.343 4.907 3.693 1.00 1.00 O ATOM 1547 CB ALA A 97 -1.099 4.287 1.445 1.00 1.00 C ATOM 0 H ALA A 97 -2.934 4.090 3.317 1.00 1.00 H new ATOM 0 HA ALA A 97 -0.778 2.356 2.264 1.00 1.00 H new ATOM 0 HB1 ALA A 97 -0.086 4.367 1.051 1.00 1.00 H new ATOM 0 HB2 ALA A 97 -1.763 3.912 0.666 1.00 1.00 H new ATOM 0 HB3 ALA A 97 -1.441 5.270 1.770 1.00 1.00 H new ATOM 1553 N GLY A 98 0.071 2.906 4.690 1.00 1.00 N ATOM 1554 CA GLY A 98 0.956 3.228 5.802 1.00 1.00 C ATOM 1555 C GLY A 98 0.239 3.982 6.893 1.00 1.00 C ATOM 1556 O GLY A 98 -0.962 4.224 6.787 1.00 1.00 O ATOM 0 H GLY A 98 -0.340 1.973 4.729 1.00 1.00 H new ATOM 0 HA2 GLY A 98 1.374 2.308 6.211 1.00 1.00 H new ATOM 0 HA3 GLY A 98 1.793 3.824 5.439 1.00 1.00 H new ATOM 1560 N GLY A 99 0.958 4.335 7.960 1.00 1.00 N ATOM 1561 CA GLY A 99 2.377 4.033 8.067 1.00 1.00 C ATOM 1562 C GLY A 99 2.636 2.627 8.561 1.00 1.00 C ATOM 1563 O GLY A 99 1.705 1.849 8.772 1.00 1.00 O ATOM 0 H GLY A 99 0.574 4.833 8.763 1.00 1.00 H new ATOM 0 HA2 GLY A 99 2.847 4.164 7.092 1.00 1.00 H new ATOM 0 HA3 GLY A 99 2.846 4.745 8.746 1.00 1.00 H new ATOM 1567 N ALA A 100 3.917 2.306 8.729 1.00 1.00 N ATOM 1568 CA ALA A 100 4.312 0.975 9.180 1.00 1.00 C ATOM 1569 C ALA A 100 3.798 0.681 10.585 1.00 1.00 C ATOM 1570 O ALA A 100 3.370 -0.429 10.879 1.00 1.00 O ATOM 1571 CB ALA A 100 5.822 0.829 9.122 1.00 1.00 C ATOM 0 H ALA A 100 4.694 2.945 8.561 1.00 1.00 H new ATOM 0 HA ALA A 100 3.859 0.246 8.508 1.00 1.00 H new ATOM 0 HB1 ALA A 100 6.104 -0.168 9.461 1.00 1.00 H new ATOM 0 HB2 ALA A 100 6.162 0.974 8.097 1.00 1.00 H new ATOM 0 HB3 ALA A 100 6.285 1.576 9.767 1.00 1.00 H new ATOM 1577 N GLN A 101 3.820 1.689 11.468 1.00 1.00 N ATOM 1578 CA GLN A 101 3.337 1.509 12.832 1.00 1.00 C ATOM 1579 C GLN A 101 1.861 1.188 12.793 1.00 1.00 C ATOM 1580 O GLN A 101 1.386 0.314 13.504 1.00 1.00 O ATOM 1581 CB GLN A 101 3.599 2.766 13.658 1.00 1.00 C ATOM 1582 CG GLN A 101 5.043 2.911 14.102 1.00 1.00 C ATOM 1583 CD GLN A 101 5.423 4.352 14.338 1.00 1.00 C ATOM 1584 OE1 GLN A 101 5.022 4.957 15.332 1.00 1.00 O ATOM 1585 NE2 GLN A 101 6.207 4.917 13.426 1.00 1.00 N ATOM 0 H GLN A 101 4.165 2.626 11.259 1.00 1.00 H new ATOM 0 HA GLN A 101 3.870 0.684 13.304 1.00 1.00 H new ATOM 0 HB2 GLN A 101 3.318 3.641 13.072 1.00 1.00 H new ATOM 0 HB3 GLN A 101 2.956 2.753 14.538 1.00 1.00 H new ATOM 0 HG2 GLN A 101 5.199 2.341 15.018 1.00 1.00 H new ATOM 0 HG3 GLN A 101 5.699 2.483 13.344 1.00 1.00 H new ATOM 0 HE21 GLN A 101 6.517 4.379 12.616 1.00 1.00 H new ATOM 0 HE22 GLN A 101 6.499 5.888 13.536 1.00 1.00 H new ATOM 1594 N ILE A 102 1.162 1.881 11.912 1.00 1.00 N ATOM 1595 CA ILE A 102 -0.258 1.679 11.688 1.00 1.00 C ATOM 1596 C ILE A 102 -0.484 0.289 11.109 1.00 1.00 C ATOM 1597 O ILE A 102 -1.428 -0.407 11.495 1.00 1.00 O ATOM 1598 CB ILE A 102 -0.838 2.736 10.721 1.00 1.00 C ATOM 1599 CG1 ILE A 102 -1.248 3.976 11.500 1.00 1.00 C ATOM 1600 CG2 ILE A 102 -2.018 2.178 9.943 1.00 1.00 C ATOM 1601 CD1 ILE A 102 -0.103 4.928 11.762 1.00 1.00 C ATOM 0 H ILE A 102 1.570 2.609 11.325 1.00 1.00 H new ATOM 0 HA ILE A 102 -0.769 1.780 12.645 1.00 1.00 H new ATOM 0 HB ILE A 102 -0.066 3.007 10.001 1.00 1.00 H new ATOM 0 HG12 ILE A 102 -2.028 4.501 10.948 1.00 1.00 H new ATOM 0 HG13 ILE A 102 -1.682 3.671 12.452 1.00 1.00 H new ATOM 0 HG21 ILE A 102 -2.405 2.944 9.271 1.00 1.00 H new ATOM 0 HG22 ILE A 102 -1.695 1.315 9.362 1.00 1.00 H new ATOM 0 HG23 ILE A 102 -2.801 1.875 10.638 1.00 1.00 H new ATOM 0 HD11 ILE A 102 -0.467 5.790 12.322 1.00 1.00 H new ATOM 0 HD12 ILE A 102 0.668 4.419 12.340 1.00 1.00 H new ATOM 0 HD13 ILE A 102 0.317 5.262 10.813 1.00 1.00 H new ATOM 1613 N PHE A 103 0.378 -0.098 10.177 1.00 1.00 N ATOM 1614 CA PHE A 103 0.279 -1.404 9.526 1.00 1.00 C ATOM 1615 C PHE A 103 0.410 -2.556 10.520 1.00 1.00 C ATOM 1616 O PHE A 103 -0.360 -3.514 10.473 1.00 1.00 O ATOM 1617 CB PHE A 103 1.375 -1.534 8.456 1.00 1.00 C ATOM 1618 CG PHE A 103 0.847 -1.680 7.050 1.00 1.00 C ATOM 1619 CD1 PHE A 103 0.563 -2.938 6.547 1.00 1.00 C ATOM 1620 CD2 PHE A 103 0.650 -0.575 6.239 1.00 1.00 C ATOM 1621 CE1 PHE A 103 0.089 -3.093 5.259 1.00 1.00 C ATOM 1622 CE2 PHE A 103 0.176 -0.723 4.949 1.00 1.00 C ATOM 1623 CZ PHE A 103 -0.104 -1.983 4.459 1.00 1.00 C ATOM 0 H PHE A 103 1.157 0.474 9.852 1.00 1.00 H new ATOM 0 HA PHE A 103 -0.709 -1.466 9.070 1.00 1.00 H new ATOM 0 HB2 PHE A 103 2.019 -0.656 8.502 1.00 1.00 H new ATOM 0 HB3 PHE A 103 1.997 -2.398 8.691 1.00 1.00 H new ATOM 0 HD1 PHE A 103 0.714 -3.808 7.169 1.00 1.00 H new ATOM 0 HD2 PHE A 103 0.869 0.412 6.618 1.00 1.00 H new ATOM 0 HE1 PHE A 103 -0.130 -4.079 4.878 1.00 1.00 H new ATOM 0 HE2 PHE A 103 0.025 0.146 4.325 1.00 1.00 H new ATOM 0 HZ PHE A 103 -0.474 -2.101 3.451 1.00 1.00 H new ATOM 1633 N THR A 104 1.394 -2.477 11.403 1.00 1.00 N ATOM 1634 CA THR A 104 1.617 -3.536 12.377 1.00 1.00 C ATOM 1635 C THR A 104 0.421 -3.690 13.314 1.00 1.00 C ATOM 1636 O THR A 104 -0.023 -4.809 13.576 1.00 1.00 O ATOM 1637 CB THR A 104 2.898 -3.260 13.179 1.00 1.00 C ATOM 1638 OG1 THR A 104 3.687 -4.425 13.255 1.00 1.00 O ATOM 1639 CG2 THR A 104 2.646 -2.797 14.600 1.00 1.00 C ATOM 0 H THR A 104 2.047 -1.696 11.466 1.00 1.00 H new ATOM 0 HA THR A 104 1.736 -4.474 11.834 1.00 1.00 H new ATOM 0 HB THR A 104 3.402 -2.457 12.641 1.00 1.00 H new ATOM 0 HG1 THR A 104 4.501 -4.236 13.767 1.00 1.00 H new ATOM 0 HG21 THR A 104 3.599 -2.623 15.100 1.00 1.00 H new ATOM 0 HG22 THR A 104 2.070 -1.872 14.584 1.00 1.00 H new ATOM 0 HG23 THR A 104 2.088 -3.563 15.139 1.00 1.00 H new ATOM 1647 N ALA A 105 -0.087 -2.560 13.818 1.00 1.00 N ATOM 1648 CA ALA A 105 -1.226 -2.562 14.731 1.00 1.00 C ATOM 1649 C ALA A 105 -2.495 -3.090 14.052 1.00 1.00 C ATOM 1650 O ALA A 105 -3.317 -3.763 14.687 1.00 1.00 O ATOM 1651 CB ALA A 105 -1.470 -1.163 15.277 1.00 1.00 C ATOM 0 H ALA A 105 0.277 -1.631 13.606 1.00 1.00 H new ATOM 0 HA ALA A 105 -0.984 -3.232 15.556 1.00 1.00 H new ATOM 0 HB1 ALA A 105 -2.322 -1.181 15.956 1.00 1.00 H new ATOM 0 HB2 ALA A 105 -0.585 -0.823 15.815 1.00 1.00 H new ATOM 0 HB3 ALA A 105 -1.678 -0.482 14.452 1.00 1.00 H new ATOM 1657 N PHE A 106 -2.664 -2.745 12.774 1.00 1.00 N ATOM 1658 CA PHE A 106 -3.834 -3.147 12.014 1.00 1.00 C ATOM 1659 C PHE A 106 -3.528 -4.279 11.031 1.00 1.00 C ATOM 1660 O PHE A 106 -4.311 -4.533 10.120 1.00 1.00 O ATOM 1661 CB PHE A 106 -4.415 -1.957 11.258 1.00 1.00 C ATOM 1662 CG PHE A 106 -5.390 -1.143 12.075 1.00 1.00 C ATOM 1663 CD1 PHE A 106 -5.071 -0.763 13.366 1.00 1.00 C ATOM 1664 CD2 PHE A 106 -6.605 -0.742 11.541 1.00 1.00 C ATOM 1665 CE1 PHE A 106 -5.945 0.001 14.115 1.00 1.00 C ATOM 1666 CE2 PHE A 106 -7.484 0.023 12.286 1.00 1.00 C ATOM 1667 CZ PHE A 106 -7.153 0.395 13.574 1.00 1.00 C ATOM 0 H PHE A 106 -1.996 -2.184 12.246 1.00 1.00 H new ATOM 0 HA PHE A 106 -4.565 -3.518 12.733 1.00 1.00 H new ATOM 0 HB2 PHE A 106 -3.600 -1.312 10.930 1.00 1.00 H new ATOM 0 HB3 PHE A 106 -4.917 -2.317 10.360 1.00 1.00 H new ATOM 0 HD1 PHE A 106 -4.127 -1.067 13.794 1.00 1.00 H new ATOM 0 HD2 PHE A 106 -6.868 -1.030 10.534 1.00 1.00 H new ATOM 0 HE1 PHE A 106 -5.684 0.290 15.122 1.00 1.00 H new ATOM 0 HE2 PHE A 106 -8.428 0.329 11.861 1.00 1.00 H new ATOM 0 HZ PHE A 106 -7.838 0.993 14.157 1.00 1.00 H new ATOM 1677 N LYS A 107 -2.392 -4.952 11.206 1.00 1.00 N ATOM 1678 CA LYS A 107 -2.017 -6.049 10.313 1.00 1.00 C ATOM 1679 C LYS A 107 -3.035 -7.188 10.375 1.00 1.00 C ATOM 1680 O LYS A 107 -3.405 -7.761 9.345 1.00 1.00 O ATOM 1681 CB LYS A 107 -0.613 -6.553 10.666 1.00 1.00 C ATOM 1682 CG LYS A 107 -0.542 -7.904 11.365 1.00 1.00 C ATOM 1683 CD LYS A 107 -0.884 -7.796 12.841 1.00 1.00 C ATOM 1684 CE LYS A 107 0.276 -8.254 13.720 1.00 1.00 C ATOM 1685 NZ LYS A 107 -0.156 -8.543 15.117 1.00 1.00 N ATOM 0 H LYS A 107 -1.721 -4.760 11.950 1.00 1.00 H new ATOM 0 HA LYS A 107 -2.010 -5.673 9.290 1.00 1.00 H new ATOM 0 HB2 LYS A 107 -0.028 -6.611 9.748 1.00 1.00 H new ATOM 0 HB3 LYS A 107 -0.132 -5.811 11.304 1.00 1.00 H new ATOM 0 HG2 LYS A 107 -1.230 -8.599 10.883 1.00 1.00 H new ATOM 0 HG3 LYS A 107 0.460 -8.318 11.254 1.00 1.00 H new ATOM 0 HD2 LYS A 107 -1.139 -6.764 13.082 1.00 1.00 H new ATOM 0 HD3 LYS A 107 -1.765 -8.400 13.056 1.00 1.00 H new ATOM 0 HE2 LYS A 107 0.726 -9.148 13.288 1.00 1.00 H new ATOM 0 HE3 LYS A 107 1.047 -7.483 13.732 1.00 1.00 H new ATOM 0 HZ1 LYS A 107 0.664 -8.851 15.677 1.00 1.00 H new ATOM 0 HZ2 LYS A 107 -0.562 -7.684 15.540 1.00 1.00 H new ATOM 0 HZ3 LYS A 107 -0.873 -9.297 15.110 1.00 1.00 H new ATOM 1699 N ASP A 108 -3.491 -7.506 11.583 1.00 1.00 N ATOM 1700 CA ASP A 108 -4.472 -8.568 11.762 1.00 1.00 C ATOM 1701 C ASP A 108 -5.901 -8.013 11.711 1.00 1.00 C ATOM 1702 O ASP A 108 -6.865 -8.775 11.835 1.00 1.00 O ATOM 1703 CB ASP A 108 -4.252 -9.277 13.095 1.00 1.00 C ATOM 1704 CG ASP A 108 -3.553 -10.620 12.936 1.00 1.00 C ATOM 1705 OD1 ASP A 108 -2.490 -10.663 12.280 1.00 1.00 O ATOM 1706 OD2 ASP A 108 -4.068 -11.625 13.471 1.00 1.00 O ATOM 0 H ASP A 108 -3.199 -7.047 12.446 1.00 1.00 H new ATOM 0 HA ASP A 108 -4.342 -9.280 10.947 1.00 1.00 H new ATOM 0 HB2 ASP A 108 -3.658 -8.638 13.749 1.00 1.00 H new ATOM 0 HB3 ASP A 108 -5.214 -9.428 13.585 1.00 1.00 H new ATOM 1711 N ASP A 109 -6.044 -6.692 11.552 1.00 1.00 N ATOM 1712 CA ASP A 109 -7.373 -6.066 11.506 1.00 1.00 C ATOM 1713 C ASP A 109 -7.915 -5.979 10.079 1.00 1.00 C ATOM 1714 O ASP A 109 -9.024 -5.478 9.879 1.00 1.00 O ATOM 1715 CB ASP A 109 -7.340 -4.664 12.091 1.00 1.00 C ATOM 1716 CG ASP A 109 -7.044 -4.664 13.580 1.00 1.00 C ATOM 1717 OD1 ASP A 109 -6.246 -5.516 14.027 1.00 1.00 O ATOM 1718 OD2 ASP A 109 -7.618 -3.820 14.299 1.00 1.00 O ATOM 0 H ASP A 109 -5.265 -6.041 11.454 1.00 1.00 H new ATOM 0 HA ASP A 109 -8.029 -6.702 12.100 1.00 1.00 H new ATOM 0 HB2 ASP A 109 -6.583 -4.075 11.573 1.00 1.00 H new ATOM 0 HB3 ASP A 109 -8.299 -4.177 11.914 1.00 1.00 H new ATOM 1723 N VAL A 110 -7.148 -6.455 9.085 1.00 1.00 N ATOM 1724 CA VAL A 110 -7.592 -6.398 7.692 1.00 1.00 C ATOM 1725 C VAL A 110 -7.716 -7.793 7.098 1.00 1.00 C ATOM 1726 O VAL A 110 -6.792 -8.597 7.161 1.00 1.00 O ATOM 1727 CB VAL A 110 -6.627 -5.569 6.820 1.00 1.00 C ATOM 1728 CG1 VAL A 110 -7.392 -4.553 5.973 1.00 1.00 C ATOM 1729 CG2 VAL A 110 -5.587 -4.868 7.701 1.00 1.00 C ATOM 0 H VAL A 110 -6.230 -6.878 9.222 1.00 1.00 H new ATOM 0 HA VAL A 110 -8.569 -5.915 7.696 1.00 1.00 H new ATOM 0 HB VAL A 110 -6.108 -6.246 6.141 1.00 1.00 H new ATOM 0 HG11 VAL A 110 -6.689 -3.981 5.367 1.00 1.00 H new ATOM 0 HG12 VAL A 110 -8.091 -5.076 5.321 1.00 1.00 H new ATOM 0 HG13 VAL A 110 -7.942 -3.876 6.626 1.00 1.00 H new ATOM 0 HG21 VAL A 110 -4.912 -4.286 7.074 1.00 1.00 H new ATOM 0 HG22 VAL A 110 -6.092 -4.205 8.403 1.00 1.00 H new ATOM 0 HG23 VAL A 110 -5.016 -5.614 8.254 1.00 1.00 H new ATOM 1739 N ASP A 111 -8.874 -8.068 6.501 1.00 1.00 N ATOM 1740 CA ASP A 111 -9.137 -9.359 5.889 1.00 1.00 C ATOM 1741 C ASP A 111 -8.221 -9.612 4.700 1.00 1.00 C ATOM 1742 O ASP A 111 -7.826 -10.747 4.441 1.00 1.00 O ATOM 1743 CB ASP A 111 -10.597 -9.454 5.431 1.00 1.00 C ATOM 1744 CG ASP A 111 -11.093 -10.887 5.388 1.00 1.00 C ATOM 1745 OD1 ASP A 111 -10.259 -11.805 5.536 1.00 1.00 O ATOM 1746 OD2 ASP A 111 -12.311 -11.091 5.203 1.00 1.00 O ATOM 0 H ASP A 111 -9.647 -7.406 6.431 1.00 1.00 H new ATOM 0 HA ASP A 111 -8.942 -10.118 6.646 1.00 1.00 H new ATOM 0 HB2 ASP A 111 -11.226 -8.874 6.106 1.00 1.00 H new ATOM 0 HB3 ASP A 111 -10.695 -9.008 4.441 1.00 1.00 H new ATOM 1751 N THR A 112 -7.897 -8.565 3.946 1.00 1.00 N ATOM 1752 CA THR A 112 -7.037 -8.735 2.776 1.00 1.00 C ATOM 1753 C THR A 112 -5.738 -7.946 2.893 1.00 1.00 C ATOM 1754 O THR A 112 -5.735 -6.737 3.144 1.00 1.00 O ATOM 1755 CB THR A 112 -7.785 -8.316 1.499 1.00 1.00 C ATOM 1756 OG1 THR A 112 -8.958 -9.078 1.334 1.00 1.00 O ATOM 1757 CG2 THR A 112 -6.955 -8.475 0.237 1.00 1.00 C ATOM 0 H THR A 112 -8.208 -7.609 4.117 1.00 1.00 H new ATOM 0 HA THR A 112 -6.778 -9.792 2.721 1.00 1.00 H new ATOM 0 HB THR A 112 -8.015 -7.259 1.635 1.00 1.00 H new ATOM 0 HG1 THR A 112 -9.419 -8.795 0.517 1.00 1.00 H new ATOM 0 HG21 THR A 112 -7.542 -8.162 -0.626 1.00 1.00 H new ATOM 0 HG22 THR A 112 -6.060 -7.858 0.310 1.00 1.00 H new ATOM 0 HG23 THR A 112 -6.667 -9.520 0.120 1.00 1.00 H new ATOM 1765 N LEU A 113 -4.629 -8.630 2.699 1.00 1.00 N ATOM 1766 CA LEU A 113 -3.321 -7.991 2.764 1.00 1.00 C ATOM 1767 C LEU A 113 -2.656 -8.024 1.387 1.00 1.00 C ATOM 1768 O LEU A 113 -2.532 -9.096 0.793 1.00 1.00 O ATOM 1769 CB LEU A 113 -2.436 -8.685 3.799 1.00 1.00 C ATOM 1770 CG LEU A 113 -2.720 -8.339 5.260 1.00 1.00 C ATOM 1771 CD1 LEU A 113 -3.695 -9.317 5.880 1.00 1.00 C ATOM 1772 CD2 LEU A 113 -1.431 -8.298 6.068 1.00 1.00 C ATOM 0 H LEU A 113 -4.602 -9.629 2.495 1.00 1.00 H new ATOM 0 HA LEU A 113 -3.453 -6.953 3.068 1.00 1.00 H new ATOM 0 HB2 LEU A 113 -2.541 -9.763 3.674 1.00 1.00 H new ATOM 0 HB3 LEU A 113 -1.396 -8.439 3.583 1.00 1.00 H new ATOM 0 HG LEU A 113 -3.175 -7.349 5.278 1.00 1.00 H new ATOM 0 HD11 LEU A 113 -3.875 -9.042 6.919 1.00 1.00 H new ATOM 0 HD12 LEU A 113 -4.636 -9.291 5.330 1.00 1.00 H new ATOM 0 HD13 LEU A 113 -3.277 -10.323 5.838 1.00 1.00 H new ATOM 0 HD21 LEU A 113 -1.659 -8.050 7.105 1.00 1.00 H new ATOM 0 HD22 LEU A 113 -0.945 -9.273 6.027 1.00 1.00 H new ATOM 0 HD23 LEU A 113 -0.765 -7.542 5.652 1.00 1.00 H new ATOM 1784 N LEU A 114 -2.226 -6.868 0.892 1.00 1.00 N ATOM 1785 CA LEU A 114 -1.571 -6.805 -0.413 1.00 1.00 C ATOM 1786 C LEU A 114 -0.076 -6.579 -0.253 1.00 1.00 C ATOM 1787 O LEU A 114 0.342 -5.624 0.400 1.00 1.00 O ATOM 1788 CB LEU A 114 -2.179 -5.694 -1.270 1.00 1.00 C ATOM 1789 CG LEU A 114 -2.871 -6.174 -2.541 1.00 1.00 C ATOM 1790 CD1 LEU A 114 -1.919 -7.040 -3.362 1.00 1.00 C ATOM 1791 CD2 LEU A 114 -4.139 -6.949 -2.203 1.00 1.00 C ATOM 0 H LEU A 114 -2.317 -5.970 1.367 1.00 1.00 H new ATOM 0 HA LEU A 114 -1.729 -7.760 -0.915 1.00 1.00 H new ATOM 0 HB2 LEU A 114 -2.900 -5.142 -0.667 1.00 1.00 H new ATOM 0 HB3 LEU A 114 -1.390 -4.993 -1.545 1.00 1.00 H new ATOM 0 HG LEU A 114 -3.152 -5.303 -3.133 1.00 1.00 H new ATOM 0 HD11 LEU A 114 -2.423 -7.377 -4.267 1.00 1.00 H new ATOM 0 HD12 LEU A 114 -1.039 -6.457 -3.633 1.00 1.00 H new ATOM 0 HD13 LEU A 114 -1.614 -7.905 -2.773 1.00 1.00 H new ATOM 0 HD21 LEU A 114 -4.618 -7.283 -3.124 1.00 1.00 H new ATOM 0 HD22 LEU A 114 -3.884 -7.815 -1.592 1.00 1.00 H new ATOM 0 HD23 LEU A 114 -4.823 -6.304 -1.651 1.00 1.00 H new ATOM 1803 N VAL A 115 0.712 -7.462 -0.859 1.00 1.00 N ATOM 1804 CA VAL A 115 2.169 -7.373 -0.790 1.00 1.00 C ATOM 1805 C VAL A 115 2.799 -7.335 -2.173 1.00 1.00 C ATOM 1806 O VAL A 115 2.486 -8.167 -3.031 1.00 1.00 O ATOM 1807 CB VAL A 115 2.759 -8.567 -0.018 1.00 1.00 C ATOM 1808 CG1 VAL A 115 2.484 -9.860 -0.772 1.00 1.00 C ATOM 1809 CG2 VAL A 115 4.250 -8.379 0.203 1.00 1.00 C ATOM 0 H VAL A 115 0.366 -8.250 -1.406 1.00 1.00 H new ATOM 0 HA VAL A 115 2.397 -6.444 -0.268 1.00 1.00 H new ATOM 0 HB VAL A 115 2.280 -8.624 0.959 1.00 1.00 H new ATOM 0 HG11 VAL A 115 2.905 -10.700 -0.219 1.00 1.00 H new ATOM 0 HG12 VAL A 115 1.408 -9.998 -0.878 1.00 1.00 H new ATOM 0 HG13 VAL A 115 2.942 -9.810 -1.760 1.00 1.00 H new ATOM 0 HG21 VAL A 115 4.647 -9.234 0.750 1.00 1.00 H new ATOM 0 HG22 VAL A 115 4.753 -8.299 -0.760 1.00 1.00 H new ATOM 0 HG23 VAL A 115 4.421 -7.469 0.778 1.00 1.00 H new ATOM 1819 N THR A 116 3.702 -6.384 -2.381 1.00 1.00 N ATOM 1820 CA THR A 116 4.387 -6.242 -3.661 1.00 1.00 C ATOM 1821 C THR A 116 5.891 -6.438 -3.466 1.00 1.00 C ATOM 1822 O THR A 116 6.492 -5.833 -2.586 1.00 1.00 O ATOM 1823 CB THR A 116 4.097 -4.869 -4.275 1.00 1.00 C ATOM 1824 OG1 THR A 116 4.997 -3.895 -3.798 1.00 1.00 O ATOM 1825 CG2 THR A 116 2.685 -4.368 -4.016 1.00 1.00 C ATOM 0 H THR A 116 3.978 -5.698 -1.678 1.00 1.00 H new ATOM 0 HA THR A 116 4.018 -7.004 -4.347 1.00 1.00 H new ATOM 0 HB THR A 116 4.216 -5.016 -5.349 1.00 1.00 H new ATOM 0 HG1 THR A 116 5.133 -3.211 -4.486 1.00 1.00 H new ATOM 0 HG21 THR A 116 2.555 -3.391 -4.481 1.00 1.00 H new ATOM 0 HG22 THR A 116 1.967 -5.070 -4.439 1.00 1.00 H new ATOM 0 HG23 THR A 116 2.520 -4.283 -2.942 1.00 1.00 H new ATOM 1833 N ARG A 117 6.490 -7.295 -4.291 1.00 1.00 N ATOM 1834 CA ARG A 117 7.921 -7.577 -4.204 1.00 1.00 C ATOM 1835 C ARG A 117 8.671 -6.903 -5.349 1.00 1.00 C ATOM 1836 O ARG A 117 8.243 -6.962 -6.493 1.00 1.00 O ATOM 1837 CB ARG A 117 8.171 -9.085 -4.219 1.00 1.00 C ATOM 1838 CG ARG A 117 8.652 -9.632 -2.884 1.00 1.00 C ATOM 1839 CD ARG A 117 8.835 -11.146 -2.920 1.00 1.00 C ATOM 1840 NE ARG A 117 10.252 -11.513 -3.000 1.00 1.00 N ATOM 1841 CZ ARG A 117 10.716 -12.732 -2.738 1.00 1.00 C ATOM 1842 NH1 ARG A 117 9.882 -13.710 -2.406 1.00 1.00 N ATOM 1843 NH2 ARG A 117 12.018 -12.974 -2.808 1.00 1.00 N ATOM 0 H ARG A 117 6.005 -7.807 -5.028 1.00 1.00 H new ATOM 0 HA ARG A 117 8.293 -7.173 -3.263 1.00 1.00 H new ATOM 0 HB2 ARG A 117 7.250 -9.595 -4.502 1.00 1.00 H new ATOM 0 HB3 ARG A 117 8.911 -9.315 -4.985 1.00 1.00 H new ATOM 0 HG2 ARG A 117 9.597 -9.159 -2.617 1.00 1.00 H new ATOM 0 HG3 ARG A 117 7.935 -9.372 -2.106 1.00 1.00 H new ATOM 0 HD2 ARG A 117 8.393 -11.588 -2.027 1.00 1.00 H new ATOM 0 HD3 ARG A 117 8.302 -11.558 -3.777 1.00 1.00 H new ATOM 0 HE ARG A 117 10.921 -10.792 -3.272 1.00 1.00 H new ATOM 0 HH11 ARG A 117 8.880 -13.529 -2.351 1.00 1.00 H new ATOM 0 HH12 ARG A 117 10.243 -14.643 -2.206 1.00 1.00 H new ATOM 0 HH21 ARG A 117 12.663 -12.226 -3.063 1.00 1.00 H new ATOM 0 HH22 ARG A 117 12.375 -13.908 -2.607 1.00 1.00 H new ATOM 1857 N LEU A 118 9.797 -6.270 -5.015 1.00 1.00 N ATOM 1858 CA LEU A 118 10.612 -5.577 -6.012 1.00 1.00 C ATOM 1859 C LEU A 118 11.886 -6.373 -6.326 1.00 1.00 C ATOM 1860 O LEU A 118 12.629 -6.757 -5.425 1.00 1.00 O ATOM 1861 CB LEU A 118 10.989 -4.180 -5.523 1.00 1.00 C ATOM 1862 CG LEU A 118 10.405 -3.022 -6.346 1.00 1.00 C ATOM 1863 CD1 LEU A 118 10.097 -1.836 -5.448 1.00 1.00 C ATOM 1864 CD2 LEU A 118 11.350 -2.630 -7.466 1.00 1.00 C ATOM 0 H LEU A 118 10.164 -6.223 -4.064 1.00 1.00 H new ATOM 0 HA LEU A 118 10.019 -5.488 -6.922 1.00 1.00 H new ATOM 0 HB2 LEU A 118 10.660 -4.073 -4.489 1.00 1.00 H new ATOM 0 HB3 LEU A 118 12.076 -4.093 -5.522 1.00 1.00 H new ATOM 0 HG LEU A 118 9.471 -3.355 -6.799 1.00 1.00 H new ATOM 0 HD11 LEU A 118 9.684 -1.024 -6.047 1.00 1.00 H new ATOM 0 HD12 LEU A 118 9.373 -2.132 -4.689 1.00 1.00 H new ATOM 0 HD13 LEU A 118 11.013 -1.499 -4.963 1.00 1.00 H new ATOM 0 HD21 LEU A 118 10.917 -1.808 -8.036 1.00 1.00 H new ATOM 0 HD22 LEU A 118 12.304 -2.315 -7.044 1.00 1.00 H new ATOM 0 HD23 LEU A 118 11.509 -3.484 -8.124 1.00 1.00 H new ATOM 1876 N ALA A 119 12.135 -6.588 -7.621 1.00 1.00 N ATOM 1877 CA ALA A 119 13.312 -7.316 -8.067 1.00 1.00 C ATOM 1878 C ALA A 119 14.573 -6.559 -7.679 1.00 1.00 C ATOM 1879 O ALA A 119 15.575 -7.155 -7.281 1.00 1.00 O ATOM 1880 CB ALA A 119 13.258 -7.537 -9.573 1.00 1.00 C ATOM 0 H ALA A 119 11.531 -6.264 -8.376 1.00 1.00 H new ATOM 0 HA ALA A 119 13.330 -8.291 -7.579 1.00 1.00 H new ATOM 0 HB1 ALA A 119 14.146 -8.083 -9.893 1.00 1.00 H new ATOM 0 HB2 ALA A 119 12.367 -8.113 -9.825 1.00 1.00 H new ATOM 0 HB3 ALA A 119 13.222 -6.573 -10.081 1.00 1.00 H new ATOM 1886 N GLY A 120 14.494 -5.238 -7.766 1.00 1.00 N ATOM 1887 CA GLY A 120 15.622 -4.409 -7.395 1.00 1.00 C ATOM 1888 C GLY A 120 15.866 -4.416 -5.895 1.00 1.00 C ATOM 1889 O GLY A 120 15.054 -4.937 -5.138 1.00 1.00 O ATOM 0 H GLY A 120 13.671 -4.727 -8.086 1.00 1.00 H new ATOM 0 HA2 GLY A 120 16.516 -4.762 -7.909 1.00 1.00 H new ATOM 0 HA3 GLY A 120 15.445 -3.386 -7.729 1.00 1.00 H new ATOM 1893 N SER A 121 16.991 -3.850 -5.477 1.00 1.00 N ATOM 1894 CA SER A 121 17.321 -3.808 -4.063 1.00 1.00 C ATOM 1895 C SER A 121 17.777 -2.418 -3.649 1.00 1.00 C ATOM 1896 O SER A 121 18.310 -1.657 -4.461 1.00 1.00 O ATOM 1897 CB SER A 121 18.398 -4.852 -3.749 1.00 1.00 C ATOM 1898 OG SER A 121 17.882 -6.159 -3.889 1.00 1.00 O ATOM 0 H SER A 121 17.682 -3.419 -6.091 1.00 1.00 H new ATOM 0 HA SER A 121 16.425 -4.044 -3.489 1.00 1.00 H new ATOM 0 HB2 SER A 121 19.248 -4.718 -4.418 1.00 1.00 H new ATOM 0 HB3 SER A 121 18.766 -4.708 -2.733 1.00 1.00 H new ATOM 0 HG SER A 121 18.584 -6.812 -3.686 1.00 1.00 H new ATOM 1904 N PHE A 122 17.548 -2.079 -2.384 1.00 1.00 N ATOM 1905 CA PHE A 122 17.915 -0.772 -1.864 1.00 1.00 C ATOM 1906 C PHE A 122 18.366 -0.877 -0.408 1.00 1.00 C ATOM 1907 O PHE A 122 18.071 -1.861 0.269 1.00 1.00 O ATOM 1908 CB PHE A 122 16.746 0.208 -1.987 1.00 1.00 C ATOM 1909 CG PHE A 122 16.746 0.975 -3.279 1.00 1.00 C ATOM 1910 CD1 PHE A 122 17.506 2.125 -3.421 1.00 1.00 C ATOM 1911 CD2 PHE A 122 15.989 0.538 -4.355 1.00 1.00 C ATOM 1912 CE1 PHE A 122 17.510 2.826 -4.612 1.00 1.00 C ATOM 1913 CE2 PHE A 122 15.989 1.235 -5.548 1.00 1.00 C ATOM 1914 CZ PHE A 122 16.751 2.379 -5.677 1.00 1.00 C ATOM 0 H PHE A 122 17.108 -2.695 -1.701 1.00 1.00 H new ATOM 0 HA PHE A 122 18.747 -0.394 -2.458 1.00 1.00 H new ATOM 0 HB2 PHE A 122 15.809 -0.342 -1.899 1.00 1.00 H new ATOM 0 HB3 PHE A 122 16.782 0.911 -1.155 1.00 1.00 H new ATOM 0 HD1 PHE A 122 18.102 2.477 -2.592 1.00 1.00 H new ATOM 0 HD2 PHE A 122 15.393 -0.357 -4.260 1.00 1.00 H new ATOM 0 HE1 PHE A 122 18.105 3.722 -4.710 1.00 1.00 H new ATOM 0 HE2 PHE A 122 15.394 0.885 -6.379 1.00 1.00 H new ATOM 0 HZ PHE A 122 16.754 2.924 -6.609 1.00 1.00 H new ATOM 1924 N GLU A 123 19.088 0.132 0.055 1.00 1.00 N ATOM 1925 CA GLU A 123 19.591 0.150 1.425 1.00 1.00 C ATOM 1926 C GLU A 123 18.945 1.283 2.226 1.00 1.00 C ATOM 1927 O GLU A 123 18.735 2.392 1.708 1.00 1.00 O ATOM 1928 CB GLU A 123 21.110 0.306 1.434 1.00 1.00 C ATOM 1929 CG GLU A 123 21.842 -0.977 1.089 1.00 1.00 C ATOM 1930 CD GLU A 123 22.875 -0.777 0.012 1.00 1.00 C ATOM 1931 OE1 GLU A 123 23.484 0.313 -0.039 1.00 1.00 O ATOM 1932 OE2 GLU A 123 23.074 -1.711 -0.792 1.00 1.00 O ATOM 0 H GLU A 123 19.340 0.952 -0.497 1.00 1.00 H new ATOM 0 HA GLU A 123 19.330 -0.799 1.893 1.00 1.00 H new ATOM 0 HB2 GLU A 123 21.394 1.082 0.723 1.00 1.00 H new ATOM 0 HB3 GLU A 123 21.429 0.645 2.420 1.00 1.00 H new ATOM 0 HG2 GLU A 123 22.326 -1.368 1.984 1.00 1.00 H new ATOM 0 HG3 GLU A 123 21.121 -1.727 0.763 1.00 1.00 H new ATOM 1939 N GLY A 124 18.621 0.986 3.484 1.00 1.00 N ATOM 1940 CA GLY A 124 17.994 1.976 4.343 1.00 1.00 C ATOM 1941 C GLY A 124 18.030 1.571 5.805 1.00 1.00 C ATOM 1942 O GLY A 124 18.435 0.454 6.135 1.00 1.00 O ATOM 0 H GLY A 124 18.782 0.079 3.922 1.00 1.00 H new ATOM 0 HA2 GLY A 124 18.500 2.934 4.220 1.00 1.00 H new ATOM 0 HA3 GLY A 124 16.959 2.120 4.033 1.00 1.00 H new ATOM 1946 N ASP A 125 17.642 2.497 6.680 1.00 1.00 N ATOM 1947 CA ASP A 125 17.655 2.241 8.119 1.00 1.00 C ATOM 1948 C ASP A 125 16.348 1.624 8.626 1.00 1.00 C ATOM 1949 O ASP A 125 16.207 1.341 9.812 1.00 1.00 O ATOM 1950 CB ASP A 125 17.925 3.543 8.877 1.00 1.00 C ATOM 1951 CG ASP A 125 19.149 4.274 8.346 1.00 1.00 C ATOM 1952 OD1 ASP A 125 20.063 3.599 7.830 1.00 1.00 O ATOM 1953 OD2 ASP A 125 19.193 5.518 8.450 1.00 1.00 O ATOM 0 H ASP A 125 17.316 3.428 6.419 1.00 1.00 H new ATOM 0 HA ASP A 125 18.450 1.519 8.303 1.00 1.00 H new ATOM 0 HB2 ASP A 125 17.054 4.193 8.800 1.00 1.00 H new ATOM 0 HB3 ASP A 125 18.066 3.323 9.935 1.00 1.00 H new ATOM 1958 N THR A 126 15.387 1.429 7.732 1.00 1.00 N ATOM 1959 CA THR A 126 14.105 0.866 8.122 1.00 1.00 C ATOM 1960 C THR A 126 13.893 -0.496 7.485 1.00 1.00 C ATOM 1961 O THR A 126 14.018 -0.655 6.270 1.00 1.00 O ATOM 1962 CB THR A 126 12.968 1.808 7.731 1.00 1.00 C ATOM 1963 OG1 THR A 126 12.564 1.578 6.400 1.00 1.00 O ATOM 1964 CG2 THR A 126 13.322 3.279 7.837 1.00 1.00 C ATOM 0 H THR A 126 15.471 1.651 6.740 1.00 1.00 H new ATOM 0 HA THR A 126 14.107 0.743 9.205 1.00 1.00 H new ATOM 0 HB THR A 126 12.172 1.589 8.443 1.00 1.00 H new ATOM 0 HG1 THR A 126 13.324 1.720 5.798 1.00 1.00 H new ATOM 0 HG21 THR A 126 12.463 3.882 7.543 1.00 1.00 H new ATOM 0 HG22 THR A 126 13.595 3.514 8.866 1.00 1.00 H new ATOM 0 HG23 THR A 126 14.163 3.499 7.179 1.00 1.00 H new ATOM 1972 N LYS A 127 13.577 -1.471 8.327 1.00 1.00 N ATOM 1973 CA LYS A 127 13.343 -2.841 7.884 1.00 1.00 C ATOM 1974 C LYS A 127 11.939 -3.295 8.257 1.00 1.00 C ATOM 1975 O LYS A 127 11.435 -2.955 9.317 1.00 1.00 O ATOM 1976 CB LYS A 127 14.375 -3.787 8.509 1.00 1.00 C ATOM 1977 CG LYS A 127 15.616 -3.083 9.022 1.00 1.00 C ATOM 1978 CD LYS A 127 15.405 -2.524 10.420 1.00 1.00 C ATOM 1979 CE LYS A 127 16.376 -3.136 11.416 1.00 1.00 C ATOM 1980 NZ LYS A 127 16.115 -2.651 12.793 1.00 1.00 N ATOM 0 H LYS A 127 13.476 -1.336 9.333 1.00 1.00 H new ATOM 0 HA LYS A 127 13.444 -2.868 6.799 1.00 1.00 H new ATOM 0 HB2 LYS A 127 13.908 -4.327 9.333 1.00 1.00 H new ATOM 0 HB3 LYS A 127 14.670 -4.530 7.768 1.00 1.00 H new ATOM 0 HG2 LYS A 127 16.453 -3.781 9.031 1.00 1.00 H new ATOM 0 HG3 LYS A 127 15.883 -2.274 8.342 1.00 1.00 H new ATOM 0 HD2 LYS A 127 15.533 -1.442 10.403 1.00 1.00 H new ATOM 0 HD3 LYS A 127 14.382 -2.719 10.741 1.00 1.00 H new ATOM 0 HE2 LYS A 127 16.291 -4.222 11.389 1.00 1.00 H new ATOM 0 HE3 LYS A 127 17.398 -2.889 11.129 1.00 1.00 H new ATOM 0 HZ1 LYS A 127 16.794 -3.087 13.449 1.00 1.00 H new ATOM 0 HZ2 LYS A 127 16.220 -1.617 12.823 1.00 1.00 H new ATOM 0 HZ3 LYS A 127 15.148 -2.909 13.074 1.00 1.00 H new ATOM 1994 N MET A 128 11.311 -4.066 7.375 1.00 1.00 N ATOM 1995 CA MET A 128 9.968 -4.563 7.613 1.00 1.00 C ATOM 1996 C MET A 128 9.997 -5.714 8.612 1.00 1.00 C ATOM 1997 O MET A 128 10.925 -6.535 8.608 1.00 1.00 O ATOM 1998 CB MET A 128 9.315 -5.016 6.304 1.00 1.00 C ATOM 1999 CG MET A 128 9.912 -6.282 5.727 1.00 1.00 C ATOM 2000 SD MET A 128 8.796 -7.690 5.860 1.00 1.00 S ATOM 2001 CE MET A 128 9.956 -9.045 5.958 1.00 1.00 C ATOM 0 H MET A 128 11.716 -4.359 6.486 1.00 1.00 H new ATOM 0 HA MET A 128 9.374 -3.750 8.030 1.00 1.00 H new ATOM 0 HB2 MET A 128 8.250 -5.174 6.476 1.00 1.00 H new ATOM 0 HB3 MET A 128 9.404 -4.216 5.569 1.00 1.00 H new ATOM 0 HG2 MET A 128 10.162 -6.118 4.679 1.00 1.00 H new ATOM 0 HG3 MET A 128 10.844 -6.510 6.245 1.00 1.00 H new ATOM 0 HE1 MET A 128 9.411 -9.985 6.044 1.00 1.00 H new ATOM 0 HE2 MET A 128 10.571 -9.063 5.058 1.00 1.00 H new ATOM 0 HE3 MET A 128 10.595 -8.915 6.832 1.00 1.00 H new ATOM 2011 N ILE A 129 8.997 -5.760 9.480 1.00 1.00 N ATOM 2012 CA ILE A 129 8.925 -6.809 10.490 1.00 1.00 C ATOM 2013 C ILE A 129 8.612 -8.157 9.857 1.00 1.00 C ATOM 2014 O ILE A 129 8.177 -8.235 8.705 1.00 1.00 O ATOM 2015 CB ILE A 129 7.876 -6.486 11.581 1.00 1.00 C ATOM 2016 CG1 ILE A 129 6.673 -5.773 10.975 1.00 1.00 C ATOM 2017 CG2 ILE A 129 8.491 -5.630 12.676 1.00 1.00 C ATOM 2018 CD1 ILE A 129 6.134 -6.430 9.730 1.00 1.00 C ATOM 0 H ILE A 129 8.229 -5.089 9.507 1.00 1.00 H new ATOM 0 HA ILE A 129 9.905 -6.859 10.964 1.00 1.00 H new ATOM 0 HB ILE A 129 7.541 -7.427 12.018 1.00 1.00 H new ATOM 0 HG12 ILE A 129 5.879 -5.724 11.720 1.00 1.00 H new ATOM 0 HG13 ILE A 129 6.953 -4.746 10.740 1.00 1.00 H new ATOM 0 HG21 ILE A 129 7.738 -5.413 13.434 1.00 1.00 H new ATOM 0 HG22 ILE A 129 9.323 -6.166 13.133 1.00 1.00 H new ATOM 0 HG23 ILE A 129 8.854 -4.696 12.247 1.00 1.00 H new ATOM 0 HD11 ILE A 129 5.280 -5.863 9.360 1.00 1.00 H new ATOM 0 HD12 ILE A 129 6.911 -6.455 8.966 1.00 1.00 H new ATOM 0 HD13 ILE A 129 5.821 -7.448 9.962 1.00 1.00 H new ATOM 2030 N PRO A 130 8.850 -9.249 10.597 1.00 1.00 N ATOM 2031 CA PRO A 130 8.621 -10.617 10.113 1.00 1.00 C ATOM 2032 C PRO A 130 7.163 -10.860 9.743 1.00 1.00 C ATOM 2033 O PRO A 130 6.243 -10.335 10.387 1.00 1.00 O ATOM 2034 CB PRO A 130 9.005 -11.503 11.308 1.00 1.00 C ATOM 2035 CG PRO A 130 9.884 -10.646 12.143 1.00 1.00 C ATOM 2036 CD PRO A 130 9.385 -9.238 11.965 1.00 1.00 C ATOM 0 HA PRO A 130 9.197 -10.821 9.210 1.00 1.00 H new ATOM 0 HB2 PRO A 130 8.123 -11.825 11.862 1.00 1.00 H new ATOM 0 HB3 PRO A 130 9.524 -12.405 10.982 1.00 1.00 H new ATOM 0 HG2 PRO A 130 9.840 -10.946 13.190 1.00 1.00 H new ATOM 0 HG3 PRO A 130 10.924 -10.733 11.830 1.00 1.00 H new ATOM 0 HD2 PRO A 130 8.617 -8.986 12.697 1.00 1.00 H new ATOM 0 HD3 PRO A 130 10.186 -8.508 12.079 1.00 1.00 H new ATOM 2044 N LEU A 131 6.951 -11.646 8.689 1.00 1.00 N ATOM 2045 CA LEU A 131 5.604 -11.957 8.209 1.00 1.00 C ATOM 2046 C LEU A 131 5.222 -13.407 8.541 1.00 1.00 C ATOM 2047 O LEU A 131 5.959 -14.341 8.222 1.00 1.00 O ATOM 2048 CB LEU A 131 5.527 -11.722 6.704 1.00 1.00 C ATOM 2049 CG LEU A 131 5.152 -10.299 6.297 1.00 1.00 C ATOM 2050 CD1 LEU A 131 6.146 -9.303 6.869 1.00 1.00 C ATOM 2051 CD2 LEU A 131 5.100 -10.189 4.782 1.00 1.00 C ATOM 0 H LEU A 131 7.698 -12.081 8.148 1.00 1.00 H new ATOM 0 HA LEU A 131 4.896 -11.299 8.713 1.00 1.00 H new ATOM 0 HB2 LEU A 131 6.492 -11.969 6.262 1.00 1.00 H new ATOM 0 HB3 LEU A 131 4.796 -12.411 6.280 1.00 1.00 H new ATOM 0 HG LEU A 131 4.166 -10.067 6.700 1.00 1.00 H new ATOM 0 HD11 LEU A 131 5.863 -8.294 6.569 1.00 1.00 H new ATOM 0 HD12 LEU A 131 6.145 -9.372 7.957 1.00 1.00 H new ATOM 0 HD13 LEU A 131 7.144 -9.528 6.492 1.00 1.00 H new ATOM 0 HD21 LEU A 131 4.832 -9.171 4.500 1.00 1.00 H new ATOM 0 HD22 LEU A 131 6.077 -10.435 4.366 1.00 1.00 H new ATOM 0 HD23 LEU A 131 4.354 -10.882 4.392 1.00 1.00 H new ATOM 2063 N ASN A 132 4.065 -13.593 9.163 1.00 1.00 N ATOM 2064 CA ASN A 132 3.598 -14.932 9.528 1.00 1.00 C ATOM 2065 C ASN A 132 2.820 -15.577 8.394 1.00 1.00 C ATOM 2066 O ASN A 132 1.674 -15.208 8.119 1.00 1.00 O ATOM 2067 CB ASN A 132 2.709 -14.870 10.780 1.00 1.00 C ATOM 2068 CG ASN A 132 3.521 -14.859 12.060 1.00 1.00 C ATOM 2069 OD1 ASN A 132 4.724 -14.593 12.046 1.00 1.00 O ATOM 2070 ND2 ASN A 132 2.863 -15.146 13.177 1.00 1.00 N ATOM 0 H ASN A 132 3.431 -12.838 9.426 1.00 1.00 H new ATOM 0 HA ASN A 132 4.480 -15.538 9.735 1.00 1.00 H new ATOM 0 HB2 ASN A 132 2.088 -13.975 10.738 1.00 1.00 H new ATOM 0 HB3 ASN A 132 2.035 -15.726 10.787 1.00 1.00 H new ATOM 0 HD21 ASN A 132 3.354 -15.152 14.071 1.00 1.00 H new ATOM 0 HD22 ASN A 132 1.866 -15.360 13.141 1.00 1.00 H new ATOM 2077 N TRP A 133 3.463 -16.539 7.737 1.00 1.00 N ATOM 2078 CA TRP A 133 2.857 -17.251 6.615 1.00 1.00 C ATOM 2079 C TRP A 133 1.598 -17.996 7.018 1.00 1.00 C ATOM 2080 O TRP A 133 0.644 -18.048 6.263 1.00 1.00 O ATOM 2081 CB TRP A 133 3.873 -18.228 6.008 1.00 1.00 C ATOM 2082 CG TRP A 133 4.958 -17.564 5.219 1.00 1.00 C ATOM 2083 CD1 TRP A 133 5.469 -16.318 5.431 1.00 1.00 C ATOM 2084 CD2 TRP A 133 5.660 -18.105 4.099 1.00 1.00 C ATOM 2085 NE1 TRP A 133 6.450 -16.050 4.508 1.00 1.00 N ATOM 2086 CE2 TRP A 133 6.585 -17.132 3.680 1.00 1.00 C ATOM 2087 CE3 TRP A 133 5.597 -19.318 3.411 1.00 1.00 C ATOM 2088 CZ2 TRP A 133 7.440 -17.335 2.603 1.00 1.00 C ATOM 2089 CZ3 TRP A 133 6.447 -19.519 2.340 1.00 1.00 C ATOM 2090 CH2 TRP A 133 7.358 -18.532 1.946 1.00 1.00 C ATOM 0 H TRP A 133 4.409 -16.845 7.964 1.00 1.00 H new ATOM 0 HA TRP A 133 2.569 -16.507 5.873 1.00 1.00 H new ATOM 0 HB2 TRP A 133 4.326 -18.811 6.810 1.00 1.00 H new ATOM 0 HB3 TRP A 133 3.346 -18.930 5.362 1.00 1.00 H new ATOM 0 HD1 TRP A 133 5.149 -15.641 6.210 1.00 1.00 H new ATOM 0 HE1 TRP A 133 6.990 -15.186 4.449 1.00 1.00 H new ATOM 0 HE3 TRP A 133 4.897 -20.085 3.710 1.00 1.00 H new ATOM 0 HZ2 TRP A 133 8.144 -16.575 2.296 1.00 1.00 H new ATOM 0 HZ3 TRP A 133 6.408 -20.453 1.798 1.00 1.00 H new ATOM 0 HH2 TRP A 133 8.010 -18.719 1.106 1.00 1.00 H new ATOM 2101 N ASP A 134 1.626 -18.594 8.202 1.00 1.00 N ATOM 2102 CA ASP A 134 0.475 -19.372 8.688 1.00 1.00 C ATOM 2103 C ASP A 134 -0.753 -18.508 8.902 1.00 1.00 C ATOM 2104 O ASP A 134 -1.879 -18.967 8.690 1.00 1.00 O ATOM 2105 CB ASP A 134 0.843 -20.099 9.986 1.00 1.00 C ATOM 2106 CG ASP A 134 1.560 -21.415 9.727 1.00 1.00 C ATOM 2107 OD1 ASP A 134 0.885 -22.388 9.329 1.00 1.00 O ATOM 2108 OD2 ASP A 134 2.795 -21.466 9.906 1.00 1.00 O ATOM 0 H ASP A 134 2.419 -18.561 8.843 1.00 1.00 H new ATOM 0 HA ASP A 134 0.226 -20.102 7.918 1.00 1.00 H new ATOM 0 HB2 ASP A 134 1.479 -19.455 10.593 1.00 1.00 H new ATOM 0 HB3 ASP A 134 -0.062 -20.288 10.563 1.00 1.00 H new ATOM 2113 N ASP A 135 -0.545 -17.278 9.341 1.00 1.00 N ATOM 2114 CA ASP A 135 -1.655 -16.356 9.601 1.00 1.00 C ATOM 2115 C ASP A 135 -2.441 -15.994 8.334 1.00 1.00 C ATOM 2116 O ASP A 135 -3.663 -15.821 8.379 1.00 1.00 O ATOM 2117 CB ASP A 135 -1.130 -15.098 10.258 1.00 1.00 C ATOM 2118 CG ASP A 135 -1.076 -15.200 11.771 1.00 1.00 C ATOM 2119 OD1 ASP A 135 -1.737 -16.104 12.323 1.00 1.00 O ATOM 2120 OD2 ASP A 135 -0.374 -14.382 12.401 1.00 1.00 O ATOM 0 H ASP A 135 0.379 -16.888 9.527 1.00 1.00 H new ATOM 0 HA ASP A 135 -2.348 -16.870 10.267 1.00 1.00 H new ATOM 0 HB2 ASP A 135 -0.131 -14.885 9.877 1.00 1.00 H new ATOM 0 HB3 ASP A 135 -1.764 -14.256 9.978 1.00 1.00 H new ATOM 2125 N PHE A 136 -1.738 -15.863 7.204 1.00 1.00 N ATOM 2126 CA PHE A 136 -2.391 -15.508 5.948 1.00 1.00 C ATOM 2127 C PHE A 136 -1.971 -16.412 4.796 1.00 1.00 C ATOM 2128 O PHE A 136 -0.847 -16.895 4.741 1.00 1.00 O ATOM 2129 CB PHE A 136 -2.075 -14.057 5.588 1.00 1.00 C ATOM 2130 CG PHE A 136 -2.757 -13.080 6.478 1.00 1.00 C ATOM 2131 CD1 PHE A 136 -4.104 -12.800 6.309 1.00 1.00 C ATOM 2132 CD2 PHE A 136 -2.067 -12.442 7.497 1.00 1.00 C ATOM 2133 CE1 PHE A 136 -4.749 -11.903 7.139 1.00 1.00 C ATOM 2134 CE2 PHE A 136 -2.707 -11.544 8.330 1.00 1.00 C ATOM 2135 CZ PHE A 136 -4.050 -11.275 8.151 1.00 1.00 C ATOM 0 H PHE A 136 -0.729 -15.996 7.137 1.00 1.00 H new ATOM 0 HA PHE A 136 -3.463 -15.638 6.099 1.00 1.00 H new ATOM 0 HB2 PHE A 136 -0.998 -13.900 5.642 1.00 1.00 H new ATOM 0 HB3 PHE A 136 -2.372 -13.871 4.556 1.00 1.00 H new ATOM 0 HD1 PHE A 136 -4.656 -13.289 5.520 1.00 1.00 H new ATOM 0 HD2 PHE A 136 -1.017 -12.649 7.642 1.00 1.00 H new ATOM 0 HE1 PHE A 136 -5.799 -11.693 6.996 1.00 1.00 H new ATOM 0 HE2 PHE A 136 -2.158 -11.053 9.120 1.00 1.00 H new ATOM 0 HZ PHE A 136 -4.553 -10.575 8.802 1.00 1.00 H new ATOM 2145 N THR A 137 -2.886 -16.621 3.861 1.00 1.00 N ATOM 2146 CA THR A 137 -2.621 -17.444 2.689 1.00 1.00 C ATOM 2147 C THR A 137 -2.861 -16.623 1.429 1.00 1.00 C ATOM 2148 O THR A 137 -3.886 -15.969 1.304 1.00 1.00 O ATOM 2149 CB THR A 137 -3.520 -18.685 2.701 1.00 1.00 C ATOM 2150 OG1 THR A 137 -2.779 -19.849 2.372 1.00 1.00 O ATOM 2151 CG2 THR A 137 -4.692 -18.597 1.747 1.00 1.00 C ATOM 0 H THR A 137 -3.827 -16.228 3.892 1.00 1.00 H new ATOM 0 HA THR A 137 -1.582 -17.774 2.706 1.00 1.00 H new ATOM 0 HB THR A 137 -3.911 -18.740 3.717 1.00 1.00 H new ATOM 0 HG1 THR A 137 -3.372 -20.629 2.387 1.00 1.00 H new ATOM 0 HG21 THR A 137 -5.283 -19.511 1.811 1.00 1.00 H new ATOM 0 HG22 THR A 137 -5.315 -17.743 2.014 1.00 1.00 H new ATOM 0 HG23 THR A 137 -4.324 -18.474 0.729 1.00 1.00 H new ATOM 2159 N LYS A 138 -1.912 -16.633 0.510 1.00 1.00 N ATOM 2160 CA LYS A 138 -2.073 -15.851 -0.693 1.00 1.00 C ATOM 2161 C LYS A 138 -3.202 -16.385 -1.555 1.00 1.00 C ATOM 2162 O LYS A 138 -3.213 -17.557 -1.932 1.00 1.00 O ATOM 2163 CB LYS A 138 -0.778 -15.854 -1.502 1.00 1.00 C ATOM 2164 CG LYS A 138 -0.321 -17.251 -1.896 1.00 1.00 C ATOM 2165 CD LYS A 138 1.177 -17.417 -1.707 1.00 1.00 C ATOM 2166 CE LYS A 138 1.665 -18.752 -2.243 1.00 1.00 C ATOM 2167 NZ LYS A 138 2.658 -19.385 -1.342 1.00 1.00 N ATOM 0 H LYS A 138 -1.042 -17.162 0.574 1.00 1.00 H new ATOM 0 HA LYS A 138 -2.318 -14.833 -0.392 1.00 1.00 H new ATOM 0 HB2 LYS A 138 -0.919 -15.257 -2.403 1.00 1.00 H new ATOM 0 HB3 LYS A 138 0.008 -15.372 -0.920 1.00 1.00 H new ATOM 0 HG2 LYS A 138 -0.849 -17.991 -1.295 1.00 1.00 H new ATOM 0 HG3 LYS A 138 -0.581 -17.441 -2.937 1.00 1.00 H new ATOM 0 HD2 LYS A 138 1.700 -16.607 -2.216 1.00 1.00 H new ATOM 0 HD3 LYS A 138 1.421 -17.339 -0.648 1.00 1.00 H new ATOM 0 HE2 LYS A 138 0.815 -19.422 -2.374 1.00 1.00 H new ATOM 0 HE3 LYS A 138 2.110 -18.606 -3.227 1.00 1.00 H new ATOM 0 HZ1 LYS A 138 2.964 -20.293 -1.746 1.00 1.00 H new ATOM 0 HZ2 LYS A 138 3.481 -18.758 -1.237 1.00 1.00 H new ATOM 0 HZ3 LYS A 138 2.226 -19.549 -0.410 1.00 1.00 H new ATOM 2181 N VAL A 139 -4.158 -15.515 -1.875 1.00 1.00 N ATOM 2182 CA VAL A 139 -5.288 -15.891 -2.697 1.00 1.00 C ATOM 2183 C VAL A 139 -4.808 -16.260 -4.090 1.00 1.00 C ATOM 2184 O VAL A 139 -5.249 -17.254 -4.675 1.00 1.00 O ATOM 2185 CB VAL A 139 -6.325 -14.753 -2.802 1.00 1.00 C ATOM 2186 CG1 VAL A 139 -7.626 -15.296 -3.346 1.00 1.00 C ATOM 2187 CG2 VAL A 139 -6.535 -14.092 -1.455 1.00 1.00 C ATOM 0 H VAL A 139 -4.165 -14.541 -1.572 1.00 1.00 H new ATOM 0 HA VAL A 139 -5.770 -16.747 -2.224 1.00 1.00 H new ATOM 0 HB VAL A 139 -5.949 -13.994 -3.488 1.00 1.00 H new ATOM 0 HG11 VAL A 139 -8.355 -14.489 -3.418 1.00 1.00 H new ATOM 0 HG12 VAL A 139 -7.457 -15.722 -4.335 1.00 1.00 H new ATOM 0 HG13 VAL A 139 -8.005 -16.069 -2.678 1.00 1.00 H new ATOM 0 HG21 VAL A 139 -7.270 -13.293 -1.552 1.00 1.00 H new ATOM 0 HG22 VAL A 139 -6.895 -14.831 -0.739 1.00 1.00 H new ATOM 0 HG23 VAL A 139 -5.591 -13.676 -1.103 1.00 1.00 H new ATOM 2197 N SER A 140 -3.909 -15.444 -4.611 1.00 1.00 N ATOM 2198 CA SER A 140 -3.354 -15.664 -5.938 1.00 1.00 C ATOM 2199 C SER A 140 -2.045 -14.902 -6.116 1.00 1.00 C ATOM 2200 O SER A 140 -1.737 -13.987 -5.361 1.00 1.00 O ATOM 2201 CB SER A 140 -4.352 -15.245 -7.005 1.00 1.00 C ATOM 2202 OG SER A 140 -5.131 -16.344 -7.433 1.00 1.00 O ATOM 0 H SER A 140 -3.545 -14.619 -4.134 1.00 1.00 H new ATOM 0 HA SER A 140 -3.147 -16.729 -6.045 1.00 1.00 H new ATOM 0 HB2 SER A 140 -5.004 -14.465 -6.612 1.00 1.00 H new ATOM 0 HB3 SER A 140 -3.821 -14.818 -7.856 1.00 1.00 H new ATOM 0 HG SER A 140 -5.358 -16.904 -6.662 1.00 1.00 H new ATOM 2208 N SER A 141 -1.281 -15.281 -7.128 1.00 1.00 N ATOM 2209 CA SER A 141 -0.026 -14.610 -7.397 1.00 1.00 C ATOM 2210 C SER A 141 0.128 -14.337 -8.893 1.00 1.00 C ATOM 2211 O SER A 141 -0.332 -15.113 -9.731 1.00 1.00 O ATOM 2212 CB SER A 141 1.149 -15.449 -6.881 1.00 1.00 C ATOM 2213 OG SER A 141 0.697 -16.680 -6.358 1.00 1.00 O ATOM 0 H SER A 141 -1.507 -16.042 -7.769 1.00 1.00 H new ATOM 0 HA SER A 141 -0.027 -13.654 -6.873 1.00 1.00 H new ATOM 0 HB2 SER A 141 1.855 -15.631 -7.691 1.00 1.00 H new ATOM 0 HB3 SER A 141 1.685 -14.896 -6.109 1.00 1.00 H new ATOM 0 HG SER A 141 1.463 -17.200 -6.036 1.00 1.00 H new ATOM 2219 N ARG A 142 0.785 -13.228 -9.216 1.00 1.00 N ATOM 2220 CA ARG A 142 1.015 -12.846 -10.603 1.00 1.00 C ATOM 2221 C ARG A 142 2.471 -12.422 -10.810 1.00 1.00 C ATOM 2222 O ARG A 142 3.080 -11.835 -9.923 1.00 1.00 O ATOM 2223 CB ARG A 142 0.086 -11.689 -11.008 1.00 1.00 C ATOM 2224 CG ARG A 142 -1.387 -12.082 -11.082 1.00 1.00 C ATOM 2225 CD ARG A 142 -2.115 -11.755 -9.785 1.00 1.00 C ATOM 2226 NE ARG A 142 -3.294 -10.929 -10.002 1.00 1.00 N ATOM 2227 CZ ARG A 142 -3.256 -9.635 -10.314 1.00 1.00 C ATOM 2228 NH1 ARG A 142 -2.094 -9.007 -10.445 1.00 1.00 N ATOM 2229 NH2 ARG A 142 -4.386 -8.967 -10.503 1.00 1.00 N ATOM 0 H ARG A 142 1.169 -12.576 -8.532 1.00 1.00 H new ATOM 0 HA ARG A 142 0.801 -13.713 -11.228 1.00 1.00 H new ATOM 0 HB2 ARG A 142 0.200 -10.875 -10.292 1.00 1.00 H new ATOM 0 HB3 ARG A 142 0.400 -11.306 -11.979 1.00 1.00 H new ATOM 0 HG2 ARG A 142 -1.864 -11.558 -11.911 1.00 1.00 H new ATOM 0 HG3 ARG A 142 -1.471 -13.149 -11.289 1.00 1.00 H new ATOM 0 HD2 ARG A 142 -2.410 -12.682 -9.294 1.00 1.00 H new ATOM 0 HD3 ARG A 142 -1.433 -11.239 -9.109 1.00 1.00 H new ATOM 0 HE ARG A 142 -4.209 -11.370 -9.909 1.00 1.00 H new ATOM 0 HH11 ARG A 142 -1.221 -9.516 -10.306 1.00 1.00 H new ATOM 0 HH12 ARG A 142 -2.074 -8.016 -10.684 1.00 1.00 H new ATOM 0 HH21 ARG A 142 -5.282 -9.444 -10.409 1.00 1.00 H new ATOM 0 HH22 ARG A 142 -4.359 -7.976 -10.742 1.00 1.00 H new ATOM 2243 N THR A 143 3.018 -12.732 -11.985 1.00 1.00 N ATOM 2244 CA THR A 143 4.393 -12.371 -12.281 1.00 1.00 C ATOM 2245 C THR A 143 4.485 -11.440 -13.493 1.00 1.00 C ATOM 2246 O THR A 143 3.974 -11.753 -14.564 1.00 1.00 O ATOM 2247 CB THR A 143 5.240 -13.627 -12.518 1.00 1.00 C ATOM 2248 OG1 THR A 143 5.201 -14.489 -11.399 1.00 1.00 O ATOM 2249 CG2 THR A 143 6.696 -13.330 -12.820 1.00 1.00 C ATOM 0 H THR A 143 2.533 -13.226 -12.735 1.00 1.00 H new ATOM 0 HA THR A 143 4.783 -11.835 -11.416 1.00 1.00 H new ATOM 0 HB THR A 143 4.795 -14.101 -13.393 1.00 1.00 H new ATOM 0 HG1 THR A 143 5.748 -15.282 -11.578 1.00 1.00 H new ATOM 0 HG21 THR A 143 7.233 -14.265 -12.976 1.00 1.00 H new ATOM 0 HG22 THR A 143 6.764 -12.718 -13.719 1.00 1.00 H new ATOM 0 HG23 THR A 143 7.139 -12.793 -11.982 1.00 1.00 H new ATOM 2257 N VAL A 144 5.161 -10.319 -13.324 1.00 1.00 N ATOM 2258 CA VAL A 144 5.353 -9.369 -14.401 1.00 1.00 C ATOM 2259 C VAL A 144 6.834 -9.117 -14.639 1.00 1.00 C ATOM 2260 O VAL A 144 7.578 -8.862 -13.694 1.00 1.00 O ATOM 2261 CB VAL A 144 4.657 -8.019 -14.108 1.00 1.00 C ATOM 2262 CG1 VAL A 144 4.548 -7.194 -15.378 1.00 1.00 C ATOM 2263 CG2 VAL A 144 3.286 -8.241 -13.491 1.00 1.00 C ATOM 0 H VAL A 144 5.590 -10.043 -12.441 1.00 1.00 H new ATOM 0 HA VAL A 144 4.904 -9.808 -15.292 1.00 1.00 H new ATOM 0 HB VAL A 144 5.264 -7.468 -13.390 1.00 1.00 H new ATOM 0 HG11 VAL A 144 4.056 -6.247 -15.156 1.00 1.00 H new ATOM 0 HG12 VAL A 144 5.545 -7.001 -15.773 1.00 1.00 H new ATOM 0 HG13 VAL A 144 3.964 -7.741 -16.118 1.00 1.00 H new ATOM 0 HG21 VAL A 144 2.816 -7.278 -13.294 1.00 1.00 H new ATOM 0 HG22 VAL A 144 2.665 -8.814 -14.180 1.00 1.00 H new ATOM 0 HG23 VAL A 144 3.393 -8.791 -12.556 1.00 1.00 H new ATOM 2273 N GLU A 145 7.278 -9.214 -15.886 1.00 1.00 N ATOM 2274 CA GLU A 145 8.685 -9.014 -16.203 1.00 1.00 C ATOM 2275 C GLU A 145 8.875 -7.743 -17.030 1.00 1.00 C ATOM 2276 O GLU A 145 8.304 -7.597 -18.108 1.00 1.00 O ATOM 2277 CB GLU A 145 9.239 -10.260 -16.918 1.00 1.00 C ATOM 2278 CG GLU A 145 9.999 -9.984 -18.213 1.00 1.00 C ATOM 2279 CD GLU A 145 11.360 -9.360 -17.967 1.00 1.00 C ATOM 2280 OE1 GLU A 145 11.741 -9.223 -16.785 1.00 1.00 O ATOM 2281 OE2 GLU A 145 12.040 -9.002 -18.951 1.00 1.00 O ATOM 0 H GLU A 145 6.688 -9.429 -16.690 1.00 1.00 H new ATOM 0 HA GLU A 145 9.250 -8.879 -15.280 1.00 1.00 H new ATOM 0 HB2 GLU A 145 9.902 -10.788 -16.232 1.00 1.00 H new ATOM 0 HB3 GLU A 145 8.409 -10.931 -17.139 1.00 1.00 H new ATOM 0 HG2 GLU A 145 10.125 -10.917 -18.762 1.00 1.00 H new ATOM 0 HG3 GLU A 145 9.407 -9.320 -18.843 1.00 1.00 H new ATOM 2288 N ASP A 146 9.661 -6.816 -16.486 1.00 1.00 N ATOM 2289 CA ASP A 146 9.928 -5.551 -17.146 1.00 1.00 C ATOM 2290 C ASP A 146 11.172 -5.649 -18.023 1.00 1.00 C ATOM 2291 O ASP A 146 11.850 -6.687 -18.056 1.00 1.00 O ATOM 2292 CB ASP A 146 10.092 -4.439 -16.123 1.00 1.00 C ATOM 2293 CG ASP A 146 8.764 -3.819 -15.731 1.00 1.00 C ATOM 2294 OD1 ASP A 146 8.067 -3.292 -16.622 1.00 1.00 O ATOM 2295 OD2 ASP A 146 8.426 -3.857 -14.529 1.00 1.00 O ATOM 0 H ASP A 146 10.124 -6.924 -15.584 1.00 1.00 H new ATOM 0 HA ASP A 146 9.075 -5.316 -17.783 1.00 1.00 H new ATOM 0 HB2 ASP A 146 10.582 -4.835 -15.234 1.00 1.00 H new ATOM 0 HB3 ASP A 146 10.745 -3.667 -16.530 1.00 1.00 H new ATOM 2300 N THR A 147 11.490 -4.558 -18.716 1.00 1.00 N ATOM 2301 CA THR A 147 12.661 -4.525 -19.570 1.00 1.00 C ATOM 2302 C THR A 147 13.915 -4.727 -18.737 1.00 1.00 C ATOM 2303 O THR A 147 14.798 -5.504 -19.100 1.00 1.00 O ATOM 2304 CB THR A 147 12.744 -3.198 -20.338 1.00 1.00 C ATOM 2305 OG1 THR A 147 13.848 -3.187 -21.221 1.00 1.00 O ATOM 2306 CG2 THR A 147 12.868 -1.996 -19.440 1.00 1.00 C ATOM 0 H THR A 147 10.952 -3.692 -18.699 1.00 1.00 H new ATOM 0 HA THR A 147 12.579 -5.333 -20.297 1.00 1.00 H new ATOM 0 HB THR A 147 11.804 -3.131 -20.886 1.00 1.00 H new ATOM 0 HG1 THR A 147 13.877 -2.332 -21.698 1.00 1.00 H new ATOM 0 HG21 THR A 147 12.922 -1.092 -20.047 1.00 1.00 H new ATOM 0 HG22 THR A 147 11.999 -1.941 -18.784 1.00 1.00 H new ATOM 0 HG23 THR A 147 13.773 -2.083 -18.838 1.00 1.00 H new ATOM 2314 N ASN A 148 13.981 -4.026 -17.606 1.00 1.00 N ATOM 2315 CA ASN A 148 15.127 -4.129 -16.695 1.00 1.00 C ATOM 2316 C ASN A 148 14.784 -5.028 -15.520 1.00 1.00 C ATOM 2317 O ASN A 148 13.633 -5.039 -15.056 1.00 1.00 O ATOM 2318 CB ASN A 148 15.515 -2.738 -16.201 1.00 1.00 C ATOM 2319 CG ASN A 148 16.998 -2.621 -15.924 1.00 1.00 C ATOM 2320 OD1 ASN A 148 17.825 -3.207 -16.623 1.00 1.00 O ATOM 2321 ND2 ASN A 148 17.343 -1.854 -14.897 1.00 1.00 N ATOM 0 H ASN A 148 13.256 -3.380 -17.296 1.00 1.00 H new ATOM 0 HA ASN A 148 15.971 -4.566 -17.229 1.00 1.00 H new ATOM 0 HB2 ASN A 148 15.227 -1.997 -16.946 1.00 1.00 H new ATOM 0 HB3 ASN A 148 14.959 -2.509 -15.292 1.00 1.00 H new ATOM 0 HD21 ASN A 148 18.328 -1.732 -14.660 1.00 1.00 H new ATOM 0 HD22 ASN A 148 16.624 -1.387 -14.345 1.00 1.00 H new ATOM 2328 N PRO A 149 15.758 -5.814 -15.016 1.00 1.00 N ATOM 2329 CA PRO A 149 15.515 -6.717 -13.894 1.00 1.00 C ATOM 2330 C PRO A 149 14.986 -5.996 -12.668 1.00 1.00 C ATOM 2331 O PRO A 149 14.113 -6.502 -11.972 1.00 1.00 O ATOM 2332 CB PRO A 149 16.893 -7.333 -13.610 1.00 1.00 C ATOM 2333 CG PRO A 149 17.643 -7.164 -14.882 1.00 1.00 C ATOM 2334 CD PRO A 149 17.143 -5.891 -15.494 1.00 1.00 C ATOM 0 HA PRO A 149 14.751 -7.457 -14.134 1.00 1.00 H new ATOM 0 HB2 PRO A 149 17.392 -6.826 -12.784 1.00 1.00 H new ATOM 0 HB3 PRO A 149 16.809 -8.384 -13.335 1.00 1.00 H new ATOM 0 HG2 PRO A 149 18.716 -7.112 -14.698 1.00 1.00 H new ATOM 0 HG3 PRO A 149 17.474 -8.009 -15.549 1.00 1.00 H new ATOM 0 HD2 PRO A 149 17.729 -5.031 -15.171 1.00 1.00 H new ATOM 0 HD3 PRO A 149 17.193 -5.920 -16.582 1.00 1.00 H new ATOM 2342 N ALA A 150 15.488 -4.780 -12.421 1.00 1.00 N ATOM 2343 CA ALA A 150 15.015 -3.991 -11.285 1.00 1.00 C ATOM 2344 C ALA A 150 13.546 -3.621 -11.461 1.00 1.00 C ATOM 2345 O ALA A 150 12.778 -3.613 -10.496 1.00 1.00 O ATOM 2346 CB ALA A 150 15.871 -2.749 -11.132 1.00 1.00 C ATOM 0 H ALA A 150 16.210 -4.330 -12.984 1.00 1.00 H new ATOM 0 HA ALA A 150 15.101 -4.589 -10.378 1.00 1.00 H new ATOM 0 HB1 ALA A 150 15.515 -2.164 -10.284 1.00 1.00 H new ATOM 0 HB2 ALA A 150 16.908 -3.040 -10.962 1.00 1.00 H new ATOM 0 HB3 ALA A 150 15.807 -2.149 -12.040 1.00 1.00 H new ATOM 2352 N LEU A 151 13.176 -3.320 -12.695 1.00 1.00 N ATOM 2353 CA LEU A 151 11.802 -2.945 -13.021 1.00 1.00 C ATOM 2354 C LEU A 151 10.833 -4.093 -12.783 1.00 1.00 C ATOM 2355 O LEU A 151 9.685 -3.879 -12.400 1.00 1.00 O ATOM 2356 CB LEU A 151 11.716 -2.483 -14.472 1.00 1.00 C ATOM 2357 CG LEU A 151 12.346 -1.123 -14.744 1.00 1.00 C ATOM 2358 CD1 LEU A 151 12.452 -0.883 -16.251 1.00 1.00 C ATOM 2359 CD2 LEU A 151 11.532 -0.031 -14.073 1.00 1.00 C ATOM 0 H LEU A 151 13.809 -3.327 -13.495 1.00 1.00 H new ATOM 0 HA LEU A 151 11.517 -2.126 -12.360 1.00 1.00 H new ATOM 0 HB2 LEU A 151 12.201 -3.226 -15.105 1.00 1.00 H new ATOM 0 HB3 LEU A 151 10.667 -2.448 -14.767 1.00 1.00 H new ATOM 0 HG LEU A 151 13.353 -1.104 -14.327 1.00 1.00 H new ATOM 0 HD11 LEU A 151 12.904 0.092 -16.433 1.00 1.00 H new ATOM 0 HD12 LEU A 151 13.071 -1.659 -16.700 1.00 1.00 H new ATOM 0 HD13 LEU A 151 11.457 -0.910 -16.695 1.00 1.00 H new ATOM 0 HD21 LEU A 151 11.989 0.938 -14.272 1.00 1.00 H new ATOM 0 HD22 LEU A 151 10.516 -0.041 -14.467 1.00 1.00 H new ATOM 0 HD23 LEU A 151 11.506 -0.205 -12.997 1.00 1.00 H new ATOM 2371 N THR A 152 11.283 -5.308 -13.044 1.00 1.00 N ATOM 2372 CA THR A 152 10.440 -6.492 -12.889 1.00 1.00 C ATOM 2373 C THR A 152 10.012 -6.671 -11.439 1.00 1.00 C ATOM 2374 O THR A 152 10.819 -6.523 -10.523 1.00 1.00 O ATOM 2375 CB THR A 152 11.201 -7.740 -13.348 1.00 1.00 C ATOM 2376 OG1 THR A 152 11.336 -7.745 -14.756 1.00 1.00 O ATOM 2377 CG2 THR A 152 10.546 -9.043 -12.943 1.00 1.00 C ATOM 0 H THR A 152 12.230 -5.506 -13.366 1.00 1.00 H new ATOM 0 HA THR A 152 9.550 -6.355 -13.503 1.00 1.00 H new ATOM 0 HB THR A 152 12.169 -7.682 -12.851 1.00 1.00 H new ATOM 0 HG1 THR A 152 11.482 -8.663 -15.067 1.00 1.00 H new ATOM 0 HG21 THR A 152 11.145 -9.879 -13.305 1.00 1.00 H new ATOM 0 HG22 THR A 152 10.474 -9.092 -11.856 1.00 1.00 H new ATOM 0 HG23 THR A 152 9.547 -9.098 -13.376 1.00 1.00 H new ATOM 2385 N HIS A 153 8.730 -6.997 -11.252 1.00 1.00 N ATOM 2386 CA HIS A 153 8.181 -7.189 -9.920 1.00 1.00 C ATOM 2387 C HIS A 153 7.064 -8.226 -9.931 1.00 1.00 C ATOM 2388 O HIS A 153 6.491 -8.534 -10.984 1.00 1.00 O ATOM 2389 CB HIS A 153 7.640 -5.856 -9.393 1.00 1.00 C ATOM 2390 CG HIS A 153 6.509 -5.323 -10.206 1.00 1.00 C ATOM 2391 ND1 HIS A 153 5.184 -5.511 -9.873 1.00 1.00 N ATOM 2392 CD2 HIS A 153 6.509 -4.607 -11.355 1.00 1.00 C ATOM 2393 CE1 HIS A 153 4.419 -4.936 -10.783 1.00 1.00 C ATOM 2394 NE2 HIS A 153 5.198 -4.379 -11.692 1.00 1.00 N ATOM 0 H HIS A 153 8.059 -7.132 -12.009 1.00 1.00 H new ATOM 0 HA HIS A 153 8.977 -7.551 -9.269 1.00 1.00 H new ATOM 0 HB2 HIS A 153 7.309 -5.986 -8.363 1.00 1.00 H new ATOM 0 HB3 HIS A 153 8.447 -5.123 -9.379 1.00 1.00 H new ATOM 0 HD2 HIS A 153 7.378 -4.277 -11.904 1.00 1.00 H new ATOM 0 HE1 HIS A 153 3.339 -4.923 -10.784 1.00 1.00 H new ATOM 0 HE2 HIS A 153 4.878 -3.863 -12.512 1.00 1.00 H new ATOM 2403 N THR A 154 6.729 -8.746 -8.757 1.00 1.00 N ATOM 2404 CA THR A 154 5.659 -9.727 -8.619 1.00 1.00 C ATOM 2405 C THR A 154 4.554 -9.202 -7.705 1.00 1.00 C ATOM 2406 O THR A 154 4.806 -8.775 -6.574 1.00 1.00 O ATOM 2407 CB THR A 154 6.207 -11.033 -8.046 1.00 1.00 C ATOM 2408 OG1 THR A 154 7.499 -10.851 -7.498 1.00 1.00 O ATOM 2409 CG2 THR A 154 6.289 -12.139 -9.072 1.00 1.00 C ATOM 0 H THR A 154 7.187 -8.502 -7.879 1.00 1.00 H new ATOM 0 HA THR A 154 5.243 -9.909 -9.610 1.00 1.00 H new ATOM 0 HB THR A 154 5.499 -11.325 -7.270 1.00 1.00 H new ATOM 0 HG1 THR A 154 7.824 -11.702 -7.137 1.00 1.00 H new ATOM 0 HG21 THR A 154 6.685 -13.040 -8.604 1.00 1.00 H new ATOM 0 HG22 THR A 154 5.294 -12.343 -9.467 1.00 1.00 H new ATOM 0 HG23 THR A 154 6.947 -11.833 -9.885 1.00 1.00 H new ATOM 2417 N TYR A 155 3.319 -9.245 -8.201 1.00 1.00 N ATOM 2418 CA TYR A 155 2.166 -8.781 -7.428 1.00 1.00 C ATOM 2419 C TYR A 155 1.365 -9.968 -6.897 1.00 1.00 C ATOM 2420 O TYR A 155 1.014 -10.878 -7.653 1.00 1.00 O ATOM 2421 CB TYR A 155 1.262 -7.886 -8.283 1.00 1.00 C ATOM 2422 CG TYR A 155 0.958 -6.546 -7.660 1.00 1.00 C ATOM 2423 CD1 TYR A 155 0.458 -6.451 -6.368 1.00 1.00 C ATOM 2424 CD2 TYR A 155 1.169 -5.372 -8.372 1.00 1.00 C ATOM 2425 CE1 TYR A 155 0.175 -5.222 -5.801 1.00 1.00 C ATOM 2426 CE2 TYR A 155 0.889 -4.139 -7.812 1.00 1.00 C ATOM 2427 CZ TYR A 155 0.392 -4.070 -6.527 1.00 1.00 C ATOM 2428 OH TYR A 155 0.109 -2.847 -5.962 1.00 1.00 O ATOM 0 H TYR A 155 3.090 -9.595 -9.131 1.00 1.00 H new ATOM 0 HA TYR A 155 2.539 -8.199 -6.585 1.00 1.00 H new ATOM 0 HB2 TYR A 155 1.737 -7.726 -9.251 1.00 1.00 H new ATOM 0 HB3 TYR A 155 0.324 -8.409 -8.471 1.00 1.00 H new ATOM 0 HD1 TYR A 155 0.287 -7.352 -5.797 1.00 1.00 H new ATOM 0 HD2 TYR A 155 1.558 -5.423 -9.378 1.00 1.00 H new ATOM 0 HE1 TYR A 155 -0.214 -5.165 -4.795 1.00 1.00 H new ATOM 0 HE2 TYR A 155 1.059 -3.235 -8.378 1.00 1.00 H new ATOM 0 HH TYR A 155 -0.529 -2.365 -6.529 1.00 1.00 H new ATOM 2438 N GLU A 156 1.080 -9.960 -5.602 1.00 1.00 N ATOM 2439 CA GLU A 156 0.327 -11.037 -4.970 1.00 1.00 C ATOM 2440 C GLU A 156 -0.697 -10.478 -3.999 1.00 1.00 C ATOM 2441 O GLU A 156 -0.478 -9.438 -3.389 1.00 1.00 O ATOM 2442 CB GLU A 156 1.280 -11.991 -4.244 1.00 1.00 C ATOM 2443 CG GLU A 156 2.431 -12.478 -5.108 1.00 1.00 C ATOM 2444 CD GLU A 156 3.745 -11.792 -4.798 1.00 1.00 C ATOM 2445 OE1 GLU A 156 3.712 -10.628 -4.347 1.00 1.00 O ATOM 2446 OE2 GLU A 156 4.807 -12.418 -5.002 1.00 1.00 O ATOM 0 H GLU A 156 1.361 -9.215 -4.964 1.00 1.00 H new ATOM 0 HA GLU A 156 -0.203 -11.589 -5.746 1.00 1.00 H new ATOM 0 HB2 GLU A 156 1.684 -11.488 -3.365 1.00 1.00 H new ATOM 0 HB3 GLU A 156 0.716 -12.852 -3.887 1.00 1.00 H new ATOM 0 HG2 GLU A 156 2.549 -13.553 -4.971 1.00 1.00 H new ATOM 0 HG3 GLU A 156 2.183 -12.315 -6.157 1.00 1.00 H new ATOM 2453 N VAL A 157 -1.804 -11.190 -3.840 1.00 1.00 N ATOM 2454 CA VAL A 157 -2.856 -10.778 -2.915 1.00 1.00 C ATOM 2455 C VAL A 157 -3.058 -11.836 -1.834 1.00 1.00 C ATOM 2456 O VAL A 157 -3.219 -13.023 -2.133 1.00 1.00 O ATOM 2457 CB VAL A 157 -4.189 -10.538 -3.652 1.00 1.00 C ATOM 2458 CG1 VAL A 157 -5.261 -10.031 -2.699 1.00 1.00 C ATOM 2459 CG2 VAL A 157 -3.986 -9.563 -4.790 1.00 1.00 C ATOM 0 H VAL A 157 -1.999 -12.058 -4.340 1.00 1.00 H new ATOM 0 HA VAL A 157 -2.540 -9.842 -2.455 1.00 1.00 H new ATOM 0 HB VAL A 157 -4.529 -11.490 -4.059 1.00 1.00 H new ATOM 0 HG11 VAL A 157 -6.189 -9.871 -3.247 1.00 1.00 H new ATOM 0 HG12 VAL A 157 -5.426 -10.767 -1.913 1.00 1.00 H new ATOM 0 HG13 VAL A 157 -4.936 -9.091 -2.253 1.00 1.00 H new ATOM 0 HG21 VAL A 157 -4.934 -9.401 -5.304 1.00 1.00 H new ATOM 0 HG22 VAL A 157 -3.620 -8.615 -4.396 1.00 1.00 H new ATOM 0 HG23 VAL A 157 -3.258 -9.970 -5.492 1.00 1.00 H new ATOM 2469 N TRP A 158 -3.035 -11.396 -0.586 1.00 1.00 N ATOM 2470 CA TRP A 158 -3.194 -12.285 0.551 1.00 1.00 C ATOM 2471 C TRP A 158 -4.502 -12.042 1.293 1.00 1.00 C ATOM 2472 O TRP A 158 -4.939 -10.902 1.453 1.00 1.00 O ATOM 2473 CB TRP A 158 -2.018 -12.144 1.516 1.00 1.00 C ATOM 2474 CG TRP A 158 -0.697 -12.510 0.903 1.00 1.00 C ATOM 2475 CD1 TRP A 158 -0.175 -12.019 -0.259 1.00 1.00 C ATOM 2476 CD2 TRP A 158 0.272 -13.428 1.423 1.00 1.00 C ATOM 2477 NE1 TRP A 158 1.059 -12.577 -0.495 1.00 1.00 N ATOM 2478 CE2 TRP A 158 1.356 -13.445 0.523 1.00 1.00 C ATOM 2479 CE3 TRP A 158 0.329 -14.237 2.561 1.00 1.00 C ATOM 2480 CZ2 TRP A 158 2.481 -14.239 0.728 1.00 1.00 C ATOM 2481 CZ3 TRP A 158 1.447 -15.025 2.762 1.00 1.00 C ATOM 2482 CH2 TRP A 158 2.509 -15.021 1.850 1.00 1.00 C ATOM 0 H TRP A 158 -2.906 -10.416 -0.334 1.00 1.00 H new ATOM 0 HA TRP A 158 -3.218 -13.301 0.156 1.00 1.00 H new ATOM 0 HB2 TRP A 158 -1.972 -11.115 1.873 1.00 1.00 H new ATOM 0 HB3 TRP A 158 -2.194 -12.776 2.386 1.00 1.00 H new ATOM 0 HD1 TRP A 158 -0.661 -11.298 -0.899 1.00 1.00 H new ATOM 0 HE1 TRP A 158 1.656 -12.377 -1.297 1.00 1.00 H new ATOM 0 HE3 TRP A 158 -0.485 -14.246 3.270 1.00 1.00 H new ATOM 0 HZ2 TRP A 158 3.302 -14.238 0.026 1.00 1.00 H new ATOM 0 HZ3 TRP A 158 1.502 -15.655 3.638 1.00 1.00 H new ATOM 0 HH2 TRP A 158 3.368 -15.648 2.036 1.00 1.00 H new ATOM 2493 N GLN A 159 -5.107 -13.133 1.776 1.00 1.00 N ATOM 2494 CA GLN A 159 -6.352 -13.052 2.529 1.00 1.00 C ATOM 2495 C GLN A 159 -6.325 -14.011 3.720 1.00 1.00 C ATOM 2496 O GLN A 159 -5.628 -15.037 3.697 1.00 1.00 O ATOM 2497 CB GLN A 159 -7.546 -13.366 1.627 1.00 1.00 C ATOM 2498 CG GLN A 159 -8.023 -12.182 0.806 1.00 1.00 C ATOM 2499 CD GLN A 159 -9.442 -11.781 1.129 1.00 1.00 C ATOM 2500 OE1 GLN A 159 -9.892 -11.918 2.265 1.00 1.00 O ATOM 2501 NE2 GLN A 159 -10.162 -11.289 0.126 1.00 1.00 N ATOM 0 H GLN A 159 -4.750 -14.081 1.656 1.00 1.00 H new ATOM 0 HA GLN A 159 -6.456 -12.034 2.905 1.00 1.00 H new ATOM 0 HB2 GLN A 159 -7.276 -14.178 0.952 1.00 1.00 H new ATOM 0 HB3 GLN A 159 -8.370 -13.724 2.243 1.00 1.00 H new ATOM 0 HG2 GLN A 159 -7.361 -11.334 0.982 1.00 1.00 H new ATOM 0 HG3 GLN A 159 -7.952 -12.428 -0.254 1.00 1.00 H new ATOM 0 HE21 GLN A 159 -9.747 -11.193 -0.801 1.00 1.00 H new ATOM 0 HE22 GLN A 159 -11.130 -11.007 0.283 1.00 1.00 H new ATOM 2510 N LYS A 160 -7.090 -13.684 4.760 1.00 1.00 N ATOM 2511 CA LYS A 160 -7.155 -14.521 5.945 1.00 1.00 C ATOM 2512 C LYS A 160 -7.864 -15.852 5.652 1.00 1.00 C ATOM 2513 O LYS A 160 -8.883 -15.882 4.959 1.00 1.00 O ATOM 2514 CB LYS A 160 -7.877 -13.795 7.076 1.00 1.00 C ATOM 2515 CG LYS A 160 -7.711 -14.460 8.427 1.00 1.00 C ATOM 2516 CD LYS A 160 -6.768 -13.679 9.326 1.00 1.00 C ATOM 2517 CE LYS A 160 -6.458 -14.431 10.616 1.00 1.00 C ATOM 2518 NZ LYS A 160 -6.830 -13.655 11.832 1.00 1.00 N ATOM 0 H LYS A 160 -7.670 -12.846 4.801 1.00 1.00 H new ATOM 0 HA LYS A 160 -6.131 -14.735 6.250 1.00 1.00 H new ATOM 0 HB2 LYS A 160 -7.505 -12.772 7.136 1.00 1.00 H new ATOM 0 HB3 LYS A 160 -8.939 -13.735 6.838 1.00 1.00 H new ATOM 0 HG2 LYS A 160 -8.684 -14.550 8.910 1.00 1.00 H new ATOM 0 HG3 LYS A 160 -7.329 -15.472 8.290 1.00 1.00 H new ATOM 0 HD2 LYS A 160 -5.840 -13.478 8.791 1.00 1.00 H new ATOM 0 HD3 LYS A 160 -7.213 -12.713 9.567 1.00 1.00 H new ATOM 0 HE2 LYS A 160 -6.993 -15.380 10.617 1.00 1.00 H new ATOM 0 HE3 LYS A 160 -5.394 -14.665 10.650 1.00 1.00 H new ATOM 0 HZ1 LYS A 160 -6.600 -14.209 12.681 1.00 1.00 H new ATOM 0 HZ2 LYS A 160 -6.300 -12.760 11.848 1.00 1.00 H new ATOM 0 HZ3 LYS A 160 -7.850 -13.453 11.817 1.00 1.00 H new ATOM 2532 N LYS A 161 -7.314 -16.947 6.183 1.00 1.00 N ATOM 2533 CA LYS A 161 -7.890 -18.275 5.968 1.00 1.00 C ATOM 2534 C LYS A 161 -9.238 -18.417 6.658 1.00 1.00 C ATOM 2535 O LYS A 161 -9.401 -18.020 7.815 1.00 1.00 O ATOM 2536 CB LYS A 161 -6.931 -19.345 6.491 1.00 1.00 C ATOM 2537 CG LYS A 161 -5.926 -19.822 5.457 1.00 1.00 C ATOM 2538 CD LYS A 161 -4.803 -20.622 6.098 1.00 1.00 C ATOM 2539 CE LYS A 161 -4.941 -22.113 5.823 1.00 1.00 C ATOM 2540 NZ LYS A 161 -4.639 -22.928 7.026 1.00 1.00 N ATOM 0 H LYS A 161 -6.474 -16.940 6.762 1.00 1.00 H new ATOM 0 HA LYS A 161 -8.043 -18.405 4.897 1.00 1.00 H new ATOM 0 HB2 LYS A 161 -6.393 -18.948 7.352 1.00 1.00 H new ATOM 0 HB3 LYS A 161 -7.510 -20.199 6.843 1.00 1.00 H new ATOM 0 HG2 LYS A 161 -6.432 -20.436 4.712 1.00 1.00 H new ATOM 0 HG3 LYS A 161 -5.508 -18.963 4.931 1.00 1.00 H new ATOM 0 HD2 LYS A 161 -3.844 -20.270 5.719 1.00 1.00 H new ATOM 0 HD3 LYS A 161 -4.803 -20.450 7.174 1.00 1.00 H new ATOM 0 HE2 LYS A 161 -5.955 -22.327 5.484 1.00 1.00 H new ATOM 0 HE3 LYS A 161 -4.268 -22.397 5.014 1.00 1.00 H new ATOM 0 HZ1 LYS A 161 -4.744 -23.937 6.797 1.00 1.00 H new ATOM 0 HZ2 LYS A 161 -3.663 -22.743 7.335 1.00 1.00 H new ATOM 0 HZ3 LYS A 161 -5.298 -22.676 7.790 1.00 1.00 H new ATOM 2554 N ALA A 162 -10.203 -18.996 5.946 1.00 1.00 N ATOM 2555 CA ALA A 162 -11.539 -19.188 6.487 1.00 1.00 C ATOM 2556 C ALA A 162 -12.190 -17.857 6.841 1.00 1.00 C ATOM 2557 O ALA A 162 -12.084 -17.438 8.012 1.00 1.00 O ATOM 2558 CB ALA A 162 -11.481 -20.101 7.706 1.00 1.00 C ATOM 2559 OXT ALA A 162 -12.797 -17.236 5.935 1.00 1.00 O ATOM 0 H ALA A 162 -10.081 -19.339 4.993 1.00 1.00 H new ATOM 0 HA ALA A 162 -12.154 -19.660 5.721 1.00 1.00 H new ATOM 0 HB1 ALA A 162 -12.486 -20.240 8.105 1.00 1.00 H new ATOM 0 HB2 ALA A 162 -11.069 -21.068 7.417 1.00 1.00 H new ATOM 0 HB3 ALA A 162 -10.847 -19.649 8.469 1.00 1.00 H new