USER MOD reduce.3.24.130724 H: found=0, std=0, add=1293, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1293 hydrogens (26 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 126 THR OG1 : rot 180:sc= -0.108 USER MOD Set 1.2: A 170 NDP O2D : rot 2:sc= -1.82! USER MOD Set 2.1: A 116 THR OG1 : rot -83:sc= -0.593 USER MOD Set 2.2: A 155 TYR OH : rot 73:sc= 0.013 USER MOD Set 3.1: A 63 THR OG1 : rot -151:sc= -2.85! USER MOD Set 3.2: A 65 GLN :FLIP amide:sc= -0.477 F(o=-5.4,f=-3.3) USER MOD Set 4.1: A 58 THR OG1 : rot 162:sc= 0.238 USER MOD Set 4.2: A 92 GLN : amide:sc= -0.256 K(o=-0.018,f=-1.9) USER MOD Single : A 1 THR N :NH3+ 143:sc= 0.353 (180deg=0.0245) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0.166 USER MOD Single : A 7 GLN :FLIP amide:sc= -2.47! C(o=-5.1!,f=-2.5!) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS : no HD1:sc= -0.874 K(o=-0.87,f=-2.2!) USER MOD Single : A 22 HIS : no HD1:sc= -1.24 X(o=-1.2,f=-0.78) USER MOD Single : A 28 HIS : no HD1:sc= -0.71 X(o=-0.71,f=-0.36) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.109 USER MOD Single : A 37 LYS NZ :NH3+ -104:sc= 0.592 (180deg=-0.62) USER MOD Single : A 39 MET CE :methyl -147:sc= -3.17 (180deg=-4.62!) USER MOD Single : A 45 THR OG1 : rot -90:sc= -0.327 USER MOD Single : A 46 TYR OH : rot 102:sc= 0.295 USER MOD Single : A 48 SER OG : rot 105:sc= 1.21 USER MOD Single : A 51 LYS NZ :NH3+ -153:sc= -0.0231 (180deg=-0.946) USER MOD Single : A 59 ASN : amide:sc= -5.9! C(o=-5.9!,f=-9.2!) USER MOD Single : A 64 HIS :FLIP no HD1:sc= -1.45 F(o=-3!,f=-1.5) USER MOD Single : A 68 TYR OH : rot 95:sc= 1.48 USER MOD Single : A 69 GLN : amide:sc= -0.466 X(o=-0.47,f=-0.33) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 HIS : no HE2:sc= -4.79! C(o=-4.8!,f=-10!) USER MOD Single : A 85 TYR OH : rot 177:sc= -6.82! USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=-0.0075) USER MOD Single : A 89 HIS : no HD1:sc= -0.306 X(o=-0.31,f=-0.35) USER MOD Single : A 101 GLN :FLIP amide:sc= -0.0374 F(o=-2!,f=-0.037) USER MOD Single : A 104 THR OG1 : rot 170:sc= -6.15! USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot -13:sc= 0.714! USER MOD Single : A 127 LYS NZ :NH3+ -155:sc= -0.202 (180deg=-1.16) USER MOD Single : A 128 MET CE :methyl -145:sc= -3.29 (180deg=-10.2!) USER MOD Single : A 132 ASN : amide:sc= -0.0957 X(o=-0.096,f=0) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ 143:sc= 0.053 (180deg=0) USER MOD Single : A 140 SER OG : rot 40:sc= 0.35 USER MOD Single : A 141 SER OG : rot 15:sc= 0.423 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.0585 USER MOD Single : A 148 ASN : amide:sc= -0.247 K(o=-0.25,f=-2.7!) USER MOD Single : A 152 THR OG1 : rot 90:sc= 1.15 USER MOD Single : A 153 HIS : no HE2:sc= -9.44! C(o=-9.4!,f=-14!) USER MOD Single : A 154 THR OG1 : rot 180:sc= -0.937 USER MOD Single : A 159 GLN : amide:sc=-0.00203 K(o=-0.002,f=-0.78) USER MOD Single : A 160 LYS NZ :NH3+ 150:sc= 0.376 (180deg=-0.589) USER MOD Single : A 161 LYS NZ :NH3+ 168:sc=-0.000671 (180deg=-0.0754) USER MOD Single : A 170 NDP O3B : rot 156:sc= -0.62 USER MOD Single : A 170 NDP O3D : rot -42:sc=-0.00289 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -5.419 8.826 5.288 1.00 0.00 N ATOM 2 CA THR A 1 -4.901 8.291 4.002 1.00 0.00 C ATOM 3 C THR A 1 -3.381 8.168 4.028 1.00 0.00 C ATOM 4 O THR A 1 -2.667 9.171 4.010 1.00 0.00 O ATOM 5 CB THR A 1 -5.337 9.228 2.874 1.00 0.00 C ATOM 6 OG1 THR A 1 -6.569 9.851 3.188 1.00 0.00 O ATOM 7 CG2 THR A 1 -5.503 8.527 1.543 1.00 0.00 C ATOM 0 H1 THR A 1 -6.223 9.459 5.102 1.00 0.00 H new ATOM 0 H2 THR A 1 -5.731 8.038 5.891 1.00 0.00 H new ATOM 0 H3 THR A 1 -4.666 9.356 5.772 1.00 0.00 H new ATOM 0 HA THR A 1 -5.307 7.293 3.840 1.00 0.00 H new ATOM 0 HB THR A 1 -4.536 9.961 2.782 1.00 0.00 H new ATOM 0 HG1 THR A 1 -6.830 10.447 2.455 1.00 0.00 H new ATOM 0 HG21 THR A 1 -5.813 9.249 0.788 1.00 0.00 H new ATOM 0 HG22 THR A 1 -4.555 8.078 1.248 1.00 0.00 H new ATOM 0 HG23 THR A 1 -6.261 7.749 1.634 1.00 0.00 H new ATOM 17 N ALA A 2 -2.892 6.933 4.074 1.00 0.00 N ATOM 18 CA ALA A 2 -1.456 6.681 4.105 1.00 0.00 C ATOM 19 C ALA A 2 -1.063 5.609 3.094 1.00 0.00 C ATOM 20 O ALA A 2 -1.875 4.762 2.725 1.00 0.00 O ATOM 21 CB ALA A 2 -1.024 6.272 5.505 1.00 0.00 C ATOM 0 H ALA A 2 -3.469 6.092 4.091 1.00 0.00 H new ATOM 0 HA ALA A 2 -0.944 7.604 3.832 1.00 0.00 H new ATOM 0 HB1 ALA A 2 0.050 6.087 5.515 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.261 7.072 6.207 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -1.551 5.364 5.798 1.00 0.00 H new ATOM 27 N PHE A 3 0.190 5.653 2.652 1.00 0.00 N ATOM 28 CA PHE A 3 0.698 4.686 1.683 1.00 0.00 C ATOM 29 C PHE A 3 1.700 3.741 2.337 1.00 0.00 C ATOM 30 O PHE A 3 2.592 4.180 3.058 1.00 0.00 O ATOM 31 CB PHE A 3 1.375 5.409 0.519 1.00 0.00 C ATOM 32 CG PHE A 3 0.435 5.848 -0.567 1.00 0.00 C ATOM 33 CD1 PHE A 3 -0.808 6.379 -0.259 1.00 0.00 C ATOM 34 CD2 PHE A 3 0.801 5.736 -1.898 1.00 0.00 C ATOM 35 CE1 PHE A 3 -1.667 6.790 -1.260 1.00 0.00 C ATOM 36 CE2 PHE A 3 -0.054 6.144 -2.903 1.00 0.00 C ATOM 37 CZ PHE A 3 -1.289 6.672 -2.584 1.00 0.00 C ATOM 0 H PHE A 3 0.874 6.349 2.950 1.00 0.00 H new ATOM 0 HA PHE A 3 -0.147 4.107 1.311 1.00 0.00 H new ATOM 0 HB2 PHE A 3 1.899 6.283 0.905 1.00 0.00 H new ATOM 0 HB3 PHE A 3 2.129 4.751 0.087 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -1.108 6.472 0.774 1.00 0.00 H new ATOM 0 HD2 PHE A 3 1.766 5.325 -2.153 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -2.633 7.203 -1.008 1.00 0.00 H new ATOM 0 HE2 PHE A 3 0.243 6.050 -3.937 1.00 0.00 H new ATOM 0 HZ PHE A 3 -1.959 6.992 -3.368 1.00 0.00 H new ATOM 47 N LEU A 4 1.555 2.446 2.078 1.00 0.00 N ATOM 48 CA LEU A 4 2.461 1.456 2.645 1.00 0.00 C ATOM 49 C LEU A 4 2.701 0.312 1.666 1.00 0.00 C ATOM 50 O LEU A 4 1.786 -0.450 1.354 1.00 0.00 O ATOM 51 CB LEU A 4 1.890 0.915 3.956 1.00 0.00 C ATOM 52 CG LEU A 4 2.658 -0.257 4.567 1.00 0.00 C ATOM 53 CD1 LEU A 4 3.978 0.215 5.155 1.00 0.00 C ATOM 54 CD2 LEU A 4 1.811 -0.943 5.625 1.00 0.00 C ATOM 0 H LEU A 4 0.823 2.060 1.482 1.00 0.00 H new ATOM 0 HA LEU A 4 3.417 1.940 2.843 1.00 0.00 H new ATOM 0 HB2 LEU A 4 1.860 1.727 4.683 1.00 0.00 H new ATOM 0 HB3 LEU A 4 0.860 0.603 3.784 1.00 0.00 H new ATOM 0 HG LEU A 4 2.879 -0.978 3.780 1.00 0.00 H new ATOM 0 HD11 LEU A 4 4.509 -0.634 5.585 1.00 0.00 H new ATOM 0 HD12 LEU A 4 4.586 0.664 4.370 1.00 0.00 H new ATOM 0 HD13 LEU A 4 3.786 0.954 5.933 1.00 0.00 H new ATOM 0 HD21 LEU A 4 2.368 -1.776 6.053 1.00 0.00 H new ATOM 0 HD22 LEU A 4 1.563 -0.230 6.411 1.00 0.00 H new ATOM 0 HD23 LEU A 4 0.893 -1.316 5.171 1.00 0.00 H new ATOM 66 N TRP A 5 3.937 0.191 1.184 1.00 0.00 N ATOM 67 CA TRP A 5 4.278 -0.873 0.244 1.00 0.00 C ATOM 68 C TRP A 5 5.785 -1.127 0.213 1.00 0.00 C ATOM 69 O TRP A 5 6.579 -0.258 0.573 1.00 0.00 O ATOM 70 CB TRP A 5 3.758 -0.529 -1.160 1.00 0.00 C ATOM 71 CG TRP A 5 4.669 0.365 -1.949 1.00 0.00 C ATOM 72 CD1 TRP A 5 5.665 -0.026 -2.797 1.00 0.00 C ATOM 73 CD2 TRP A 5 4.665 1.797 -1.968 1.00 0.00 C ATOM 74 NE1 TRP A 5 6.282 1.075 -3.339 1.00 0.00 N ATOM 75 CE2 TRP A 5 5.687 2.206 -2.845 1.00 0.00 C ATOM 76 CE3 TRP A 5 3.897 2.774 -1.328 1.00 0.00 C ATOM 77 CZ2 TRP A 5 5.961 3.547 -3.097 1.00 0.00 C ATOM 78 CZ3 TRP A 5 4.170 4.106 -1.581 1.00 0.00 C ATOM 79 CH2 TRP A 5 5.194 4.481 -2.458 1.00 0.00 C ATOM 0 H TRP A 5 4.711 0.810 1.426 1.00 0.00 H new ATOM 0 HA TRP A 5 3.796 -1.790 0.583 1.00 0.00 H new ATOM 0 HB2 TRP A 5 3.604 -1.454 -1.715 1.00 0.00 H new ATOM 0 HB3 TRP A 5 2.785 -0.047 -1.067 1.00 0.00 H new ATOM 0 HD1 TRP A 5 5.929 -1.051 -3.010 1.00 0.00 H new ATOM 0 HE1 TRP A 5 7.057 1.054 -4.002 1.00 0.00 H new ATOM 0 HE3 TRP A 5 3.105 2.494 -0.649 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 6.751 3.839 -3.773 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 3.583 4.870 -1.093 1.00 0.00 H new ATOM 0 HH2 TRP A 5 5.382 5.530 -2.634 1.00 0.00 H new ATOM 90 N ALA A 6 6.169 -2.324 -0.226 1.00 0.00 N ATOM 91 CA ALA A 6 7.580 -2.694 -0.311 1.00 0.00 C ATOM 92 C ALA A 6 8.085 -2.562 -1.744 1.00 0.00 C ATOM 93 O ALA A 6 7.324 -2.745 -2.694 1.00 0.00 O ATOM 94 CB ALA A 6 7.787 -4.113 0.198 1.00 0.00 C ATOM 0 H ALA A 6 5.523 -3.054 -0.528 1.00 0.00 H new ATOM 0 HA ALA A 6 8.153 -2.013 0.318 1.00 0.00 H new ATOM 0 HB1 ALA A 6 8.843 -4.374 0.128 1.00 0.00 H new ATOM 0 HB2 ALA A 6 7.465 -4.177 1.237 1.00 0.00 H new ATOM 0 HB3 ALA A 6 7.201 -4.805 -0.407 1.00 0.00 H new ATOM 100 N GLN A 7 9.365 -2.233 -1.900 1.00 0.00 N ATOM 101 CA GLN A 7 9.941 -2.068 -3.231 1.00 0.00 C ATOM 102 C GLN A 7 11.454 -2.275 -3.224 1.00 0.00 C ATOM 103 O GLN A 7 12.110 -2.103 -2.199 1.00 0.00 O ATOM 104 CB GLN A 7 9.619 -0.669 -3.759 1.00 0.00 C ATOM 105 CG GLN A 7 10.074 0.445 -2.829 1.00 0.00 C ATOM 106 CD GLN A 7 8.957 1.407 -2.471 1.00 0.00 C ATOM 107 OE1 GLN A 7 8.186 1.070 -1.441 1.00 0.00 O flip ATOM 108 NE2 GLN A 7 8.788 2.444 -3.113 1.00 0.00 N flip ATOM 0 H GLN A 7 10.016 -2.077 -1.131 1.00 0.00 H new ATOM 0 HA GLN A 7 9.502 -2.825 -3.881 1.00 0.00 H new ATOM 0 HB2 GLN A 7 10.093 -0.537 -4.731 1.00 0.00 H new ATOM 0 HB3 GLN A 7 8.543 -0.586 -3.915 1.00 0.00 H new ATOM 0 HG2 GLN A 7 10.477 0.007 -1.916 1.00 0.00 H new ATOM 0 HG3 GLN A 7 10.885 0.998 -3.302 1.00 0.00 H new ATOM 0 HE21 GLN A 7 9.403 2.665 -3.897 1.00 0.00 H new ATOM 0 HE22 GLN A 7 8.033 3.082 -2.861 1.00 0.00 H new ATOM 117 N ASP A 8 12.001 -2.626 -4.387 1.00 0.00 N ATOM 118 CA ASP A 8 13.442 -2.835 -4.531 1.00 0.00 C ATOM 119 C ASP A 8 14.098 -1.559 -5.051 1.00 0.00 C ATOM 120 O ASP A 8 13.483 -0.494 -5.038 1.00 0.00 O ATOM 121 CB ASP A 8 13.761 -4.018 -5.466 1.00 0.00 C ATOM 122 CG ASP A 8 12.545 -4.583 -6.169 1.00 0.00 C ATOM 123 OD1 ASP A 8 11.544 -4.874 -5.484 1.00 0.00 O ATOM 124 OD2 ASP A 8 12.598 -4.735 -7.407 1.00 0.00 O ATOM 0 H ASP A 8 11.468 -2.772 -5.244 1.00 0.00 H new ATOM 0 HA ASP A 8 13.845 -3.080 -3.548 1.00 0.00 H new ATOM 0 HB2 ASP A 8 14.484 -3.694 -6.214 1.00 0.00 H new ATOM 0 HB3 ASP A 8 14.235 -4.810 -4.887 1.00 0.00 H new ATOM 129 N ARG A 9 15.340 -1.662 -5.515 1.00 0.00 N ATOM 130 CA ARG A 9 16.046 -0.498 -6.042 1.00 0.00 C ATOM 131 C ARG A 9 15.456 -0.062 -7.384 1.00 0.00 C ATOM 132 O ARG A 9 15.584 1.096 -7.782 1.00 0.00 O ATOM 133 CB ARG A 9 17.536 -0.811 -6.203 1.00 0.00 C ATOM 134 CG ARG A 9 18.392 -0.291 -5.060 1.00 0.00 C ATOM 135 CD ARG A 9 18.559 1.219 -5.132 1.00 0.00 C ATOM 136 NE ARG A 9 18.880 1.797 -3.830 1.00 0.00 N ATOM 137 CZ ARG A 9 20.075 1.703 -3.252 1.00 0.00 C ATOM 138 NH1 ARG A 9 21.065 1.060 -3.859 1.00 0.00 N ATOM 139 NH2 ARG A 9 20.282 2.256 -2.065 1.00 0.00 N ATOM 0 H ARG A 9 15.874 -2.531 -5.537 1.00 0.00 H new ATOM 0 HA ARG A 9 15.927 0.321 -5.332 1.00 0.00 H new ATOM 0 HB2 ARG A 9 17.666 -1.890 -6.282 1.00 0.00 H new ATOM 0 HB3 ARG A 9 17.891 -0.378 -7.138 1.00 0.00 H new ATOM 0 HG2 ARG A 9 17.935 -0.563 -4.109 1.00 0.00 H new ATOM 0 HG3 ARG A 9 19.371 -0.768 -5.091 1.00 0.00 H new ATOM 0 HD2 ARG A 9 19.350 1.463 -5.842 1.00 0.00 H new ATOM 0 HD3 ARG A 9 17.641 1.668 -5.511 1.00 0.00 H new ATOM 0 HE ARG A 9 18.145 2.302 -3.335 1.00 0.00 H new ATOM 0 HH11 ARG A 9 20.912 0.635 -4.773 1.00 0.00 H new ATOM 0 HH12 ARG A 9 21.979 0.991 -3.411 1.00 0.00 H new ATOM 0 HH21 ARG A 9 19.525 2.753 -1.595 1.00 0.00 H new ATOM 0 HH22 ARG A 9 21.198 2.184 -1.622 1.00 0.00 H new ATOM 153 N ASP A 10 14.809 -0.998 -8.074 1.00 0.00 N ATOM 154 CA ASP A 10 14.195 -0.718 -9.369 1.00 0.00 C ATOM 155 C ASP A 10 12.791 -0.131 -9.207 1.00 0.00 C ATOM 156 O ASP A 10 12.101 0.127 -10.193 1.00 0.00 O ATOM 157 CB ASP A 10 14.130 -1.994 -10.211 1.00 0.00 C ATOM 158 CG ASP A 10 15.363 -2.182 -11.073 1.00 0.00 C ATOM 159 OD1 ASP A 10 16.368 -2.721 -10.563 1.00 0.00 O ATOM 160 OD2 ASP A 10 15.324 -1.790 -12.258 1.00 0.00 O ATOM 0 H ASP A 10 14.696 -1.961 -7.756 1.00 0.00 H new ATOM 0 HA ASP A 10 14.815 0.020 -9.878 1.00 0.00 H new ATOM 0 HB2 ASP A 10 14.016 -2.855 -9.552 1.00 0.00 H new ATOM 0 HB3 ASP A 10 13.246 -1.961 -10.848 1.00 0.00 H new ATOM 165 N GLY A 11 12.373 0.074 -7.961 1.00 0.00 N ATOM 166 CA GLY A 11 11.055 0.624 -7.702 1.00 0.00 C ATOM 167 C GLY A 11 9.961 -0.428 -7.747 1.00 0.00 C ATOM 168 O GLY A 11 8.795 -0.131 -7.487 1.00 0.00 O ATOM 0 H GLY A 11 12.923 -0.131 -7.127 1.00 0.00 H new ATOM 0 HA2 GLY A 11 11.052 1.104 -6.723 1.00 0.00 H new ATOM 0 HA3 GLY A 11 10.838 1.399 -8.437 1.00 0.00 H new ATOM 172 N LEU A 12 10.337 -1.663 -8.074 1.00 0.00 N ATOM 173 CA LEU A 12 9.387 -2.768 -8.147 1.00 0.00 C ATOM 174 C LEU A 12 8.528 -2.830 -6.889 1.00 0.00 C ATOM 175 O LEU A 12 8.796 -2.139 -5.907 1.00 0.00 O ATOM 176 CB LEU A 12 10.147 -4.086 -8.311 1.00 0.00 C ATOM 177 CG LEU A 12 9.400 -5.227 -9.012 1.00 0.00 C ATOM 178 CD1 LEU A 12 9.044 -4.844 -10.441 1.00 0.00 C ATOM 179 CD2 LEU A 12 10.256 -6.485 -8.991 1.00 0.00 C ATOM 0 H LEU A 12 11.299 -1.923 -8.293 1.00 0.00 H new ATOM 0 HA LEU A 12 8.734 -2.606 -9.005 1.00 0.00 H new ATOM 0 HB2 LEU A 12 11.062 -3.885 -8.868 1.00 0.00 H new ATOM 0 HB3 LEU A 12 10.446 -4.432 -7.322 1.00 0.00 H new ATOM 0 HG LEU A 12 8.470 -5.420 -8.478 1.00 0.00 H new ATOM 0 HD11 LEU A 12 8.515 -5.669 -10.918 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.406 -3.960 -10.433 1.00 0.00 H new ATOM 0 HD13 LEU A 12 9.956 -4.628 -10.998 1.00 0.00 H new ATOM 0 HD21 LEU A 12 9.724 -7.295 -9.489 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.196 -6.294 -9.510 1.00 0.00 H new ATOM 0 HD23 LEU A 12 10.462 -6.767 -7.959 1.00 0.00 H new ATOM 191 N ILE A 13 7.519 -3.686 -6.918 1.00 0.00 N ATOM 192 CA ILE A 13 6.637 -3.880 -5.777 1.00 0.00 C ATOM 193 C ILE A 13 6.062 -5.292 -5.801 1.00 0.00 C ATOM 194 O ILE A 13 5.860 -5.913 -4.762 1.00 0.00 O ATOM 195 CB ILE A 13 5.493 -2.840 -5.734 1.00 0.00 C ATOM 196 CG1 ILE A 13 4.532 -3.006 -6.916 1.00 0.00 C ATOM 197 CG2 ILE A 13 6.067 -1.432 -5.715 1.00 0.00 C ATOM 198 CD1 ILE A 13 3.088 -2.727 -6.555 1.00 0.00 C ATOM 0 H ILE A 13 7.289 -4.263 -7.727 1.00 0.00 H new ATOM 0 HA ILE A 13 7.233 -3.740 -4.875 1.00 0.00 H new ATOM 0 HB ILE A 13 4.924 -3.009 -4.820 1.00 0.00 H new ATOM 0 HG12 ILE A 13 4.835 -2.335 -7.719 1.00 0.00 H new ATOM 0 HG13 ILE A 13 4.613 -4.022 -7.302 1.00 0.00 H new ATOM 0 HG21 ILE A 13 5.253 -0.708 -5.685 1.00 0.00 H new ATOM 0 HG22 ILE A 13 6.696 -1.308 -4.834 1.00 0.00 H new ATOM 0 HG23 ILE A 13 6.664 -1.270 -6.613 1.00 0.00 H new ATOM 0 HD11 ILE A 13 2.460 -2.862 -7.436 1.00 0.00 H new ATOM 0 HD12 ILE A 13 2.769 -3.416 -5.773 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.994 -1.702 -6.196 1.00 0.00 H new ATOM 210 N GLY A 14 5.807 -5.793 -7.005 1.00 0.00 N ATOM 211 CA GLY A 14 5.261 -7.122 -7.155 1.00 0.00 C ATOM 212 C GLY A 14 5.765 -7.816 -8.404 1.00 0.00 C ATOM 213 O GLY A 14 6.528 -7.243 -9.181 1.00 0.00 O ATOM 0 H GLY A 14 5.971 -5.297 -7.881 1.00 0.00 H new ATOM 0 HA2 GLY A 14 5.521 -7.719 -6.281 1.00 0.00 H new ATOM 0 HA3 GLY A 14 4.173 -7.063 -7.189 1.00 0.00 H new ATOM 217 N LYS A 15 5.322 -9.049 -8.597 1.00 0.00 N ATOM 218 CA LYS A 15 5.707 -9.838 -9.760 1.00 0.00 C ATOM 219 C LYS A 15 4.469 -10.437 -10.421 1.00 0.00 C ATOM 220 O LYS A 15 4.363 -11.653 -10.583 1.00 0.00 O ATOM 221 CB LYS A 15 6.671 -10.952 -9.350 1.00 0.00 C ATOM 222 CG LYS A 15 6.055 -11.960 -8.394 1.00 0.00 C ATOM 223 CD LYS A 15 6.449 -13.386 -8.749 1.00 0.00 C ATOM 224 CE LYS A 15 5.253 -14.324 -8.705 1.00 0.00 C ATOM 225 NZ LYS A 15 4.923 -14.869 -10.051 1.00 0.00 N ATOM 0 H LYS A 15 4.689 -9.530 -7.957 1.00 0.00 H new ATOM 0 HA LYS A 15 6.209 -9.185 -10.474 1.00 0.00 H new ATOM 0 HB2 LYS A 15 7.014 -11.473 -10.244 1.00 0.00 H new ATOM 0 HB3 LYS A 15 7.550 -10.508 -8.882 1.00 0.00 H new ATOM 0 HG2 LYS A 15 6.373 -11.737 -7.376 1.00 0.00 H new ATOM 0 HG3 LYS A 15 4.969 -11.866 -8.416 1.00 0.00 H new ATOM 0 HD2 LYS A 15 6.891 -13.405 -9.745 1.00 0.00 H new ATOM 0 HD3 LYS A 15 7.213 -13.737 -8.055 1.00 0.00 H new ATOM 0 HE2 LYS A 15 5.462 -15.147 -8.022 1.00 0.00 H new ATOM 0 HE3 LYS A 15 4.389 -13.792 -8.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 4.102 -15.503 -9.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 4.698 -14.086 -10.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 5.738 -15.399 -10.420 1.00 0.00 H new ATOM 239 N ASP A 16 3.527 -9.571 -10.786 1.00 0.00 N ATOM 240 CA ASP A 16 2.281 -10.003 -11.416 1.00 0.00 C ATOM 241 C ASP A 16 1.333 -10.592 -10.375 1.00 0.00 C ATOM 242 O ASP A 16 0.524 -11.468 -10.679 1.00 0.00 O ATOM 243 CB ASP A 16 2.555 -11.029 -12.520 1.00 0.00 C ATOM 244 CG ASP A 16 1.675 -10.818 -13.737 1.00 0.00 C ATOM 245 OD1 ASP A 16 0.451 -10.646 -13.562 1.00 0.00 O ATOM 246 OD2 ASP A 16 2.212 -10.824 -14.865 1.00 0.00 O ATOM 0 H ASP A 16 3.603 -8.562 -10.656 1.00 0.00 H new ATOM 0 HA ASP A 16 1.810 -9.130 -11.867 1.00 0.00 H new ATOM 0 HB2 ASP A 16 3.602 -10.968 -12.817 1.00 0.00 H new ATOM 0 HB3 ASP A 16 2.393 -12.033 -12.128 1.00 0.00 H new ATOM 251 N GLY A 17 1.444 -10.099 -9.145 1.00 0.00 N ATOM 252 CA GLY A 17 0.599 -10.576 -8.066 1.00 0.00 C ATOM 253 C GLY A 17 0.871 -9.851 -6.762 1.00 0.00 C ATOM 254 O GLY A 17 -0.025 -9.235 -6.185 1.00 0.00 O ATOM 0 H GLY A 17 2.108 -9.373 -8.876 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -0.447 -10.445 -8.341 1.00 0.00 H new ATOM 0 HA3 GLY A 17 0.760 -11.645 -7.926 1.00 0.00 H new ATOM 258 N HIS A 18 2.116 -9.923 -6.298 1.00 0.00 N ATOM 259 CA HIS A 18 2.517 -9.269 -5.056 1.00 0.00 C ATOM 260 C HIS A 18 4.021 -9.401 -4.838 1.00 0.00 C ATOM 261 O HIS A 18 4.743 -9.882 -5.712 1.00 0.00 O ATOM 262 CB HIS A 18 1.760 -9.875 -3.873 1.00 0.00 C ATOM 263 CG HIS A 18 2.086 -11.316 -3.629 1.00 0.00 C ATOM 264 ND1 HIS A 18 2.840 -12.075 -4.500 1.00 0.00 N ATOM 265 CD2 HIS A 18 1.756 -12.139 -2.606 1.00 0.00 C ATOM 266 CE1 HIS A 18 2.959 -13.301 -4.023 1.00 0.00 C ATOM 267 NE2 HIS A 18 2.311 -13.365 -2.875 1.00 0.00 N ATOM 0 H HIS A 18 2.867 -10.430 -6.766 1.00 0.00 H new ATOM 0 HA HIS A 18 2.271 -8.210 -5.131 1.00 0.00 H new ATOM 0 HB2 HIS A 18 1.988 -9.302 -2.974 1.00 0.00 H new ATOM 0 HB3 HIS A 18 0.689 -9.778 -4.049 1.00 0.00 H new ATOM 0 HD2 HIS A 18 1.166 -11.879 -1.740 1.00 0.00 H new ATOM 0 HE1 HIS A 18 3.495 -14.113 -4.492 1.00 0.00 H new ATOM 0 HE2 HIS A 18 2.235 -14.192 -2.283 1.00 0.00 H new ATOM 276 N LEU A 19 4.489 -8.976 -3.669 1.00 0.00 N ATOM 277 CA LEU A 19 5.910 -9.054 -3.344 1.00 0.00 C ATOM 278 C LEU A 19 6.359 -10.512 -3.221 1.00 0.00 C ATOM 279 O LEU A 19 5.937 -11.221 -2.308 1.00 0.00 O ATOM 280 CB LEU A 19 6.206 -8.308 -2.041 1.00 0.00 C ATOM 281 CG LEU A 19 5.325 -8.689 -0.849 1.00 0.00 C ATOM 282 CD1 LEU A 19 5.998 -9.763 -0.006 1.00 0.00 C ATOM 283 CD2 LEU A 19 5.020 -7.461 -0.003 1.00 0.00 C ATOM 0 H LEU A 19 3.908 -8.575 -2.933 1.00 0.00 H new ATOM 0 HA LEU A 19 6.466 -8.583 -4.155 1.00 0.00 H new ATOM 0 HB2 LEU A 19 7.248 -8.483 -1.771 1.00 0.00 H new ATOM 0 HB3 LEU A 19 6.099 -7.239 -2.223 1.00 0.00 H new ATOM 0 HG LEU A 19 4.386 -9.091 -1.229 1.00 0.00 H new ATOM 0 HD11 LEU A 19 5.356 -10.020 0.836 1.00 0.00 H new ATOM 0 HD12 LEU A 19 6.169 -10.650 -0.616 1.00 0.00 H new ATOM 0 HD13 LEU A 19 6.952 -9.389 0.366 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.393 -7.747 0.841 1.00 0.00 H new ATOM 0 HD22 LEU A 19 5.952 -7.033 0.366 1.00 0.00 H new ATOM 0 HD23 LEU A 19 4.497 -6.722 -0.610 1.00 0.00 H new ATOM 295 N PRO A 20 7.215 -10.986 -4.146 1.00 0.00 N ATOM 296 CA PRO A 20 7.704 -12.364 -4.134 1.00 0.00 C ATOM 297 C PRO A 20 8.931 -12.559 -3.246 1.00 0.00 C ATOM 298 O PRO A 20 9.579 -13.605 -3.298 1.00 0.00 O ATOM 299 CB PRO A 20 8.067 -12.597 -5.596 1.00 0.00 C ATOM 300 CG PRO A 20 8.514 -11.262 -6.090 1.00 0.00 C ATOM 301 CD PRO A 20 7.765 -10.225 -5.285 1.00 0.00 C ATOM 0 HA PRO A 20 6.965 -13.056 -3.731 1.00 0.00 H new ATOM 0 HB2 PRO A 20 8.857 -13.341 -5.694 1.00 0.00 H new ATOM 0 HB3 PRO A 20 7.212 -12.964 -6.163 1.00 0.00 H new ATOM 0 HG2 PRO A 20 9.590 -11.144 -5.966 1.00 0.00 H new ATOM 0 HG3 PRO A 20 8.302 -11.153 -7.154 1.00 0.00 H new ATOM 0 HD2 PRO A 20 8.426 -9.426 -4.949 1.00 0.00 H new ATOM 0 HD3 PRO A 20 6.974 -9.758 -5.872 1.00 0.00 H new ATOM 309 N TRP A 21 9.253 -11.556 -2.433 1.00 0.00 N ATOM 310 CA TRP A 21 10.408 -11.644 -1.546 1.00 0.00 C ATOM 311 C TRP A 21 9.976 -11.953 -0.118 1.00 0.00 C ATOM 312 O TRP A 21 8.930 -11.494 0.340 1.00 0.00 O ATOM 313 CB TRP A 21 11.213 -10.344 -1.581 1.00 0.00 C ATOM 314 CG TRP A 21 10.368 -9.112 -1.479 1.00 0.00 C ATOM 315 CD1 TRP A 21 9.680 -8.677 -0.384 1.00 0.00 C ATOM 316 CD2 TRP A 21 10.123 -8.154 -2.514 1.00 0.00 C ATOM 317 NE1 TRP A 21 9.025 -7.504 -0.673 1.00 0.00 N ATOM 318 CE2 TRP A 21 9.281 -7.163 -1.976 1.00 0.00 C ATOM 319 CE3 TRP A 21 10.536 -8.038 -3.844 1.00 0.00 C ATOM 320 CZ2 TRP A 21 8.845 -6.071 -2.722 1.00 0.00 C ATOM 321 CZ3 TRP A 21 10.102 -6.955 -4.583 1.00 0.00 C ATOM 322 CH2 TRP A 21 9.265 -5.983 -4.021 1.00 0.00 C ATOM 0 H TRP A 21 8.735 -10.680 -2.370 1.00 0.00 H new ATOM 0 HA TRP A 21 11.040 -12.459 -1.899 1.00 0.00 H new ATOM 0 HB2 TRP A 21 11.932 -10.350 -0.762 1.00 0.00 H new ATOM 0 HB3 TRP A 21 11.786 -10.306 -2.508 1.00 0.00 H new ATOM 0 HD1 TRP A 21 9.654 -9.181 0.571 1.00 0.00 H new ATOM 0 HE1 TRP A 21 8.443 -6.974 -0.024 1.00 0.00 H new ATOM 0 HE3 TRP A 21 11.183 -8.782 -4.286 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 8.199 -5.321 -2.291 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 10.414 -6.856 -5.612 1.00 0.00 H new ATOM 0 HH2 TRP A 21 8.945 -5.147 -4.625 1.00 0.00 H new ATOM 333 N HIS A 22 10.791 -12.737 0.581 1.00 0.00 N ATOM 334 CA HIS A 22 10.496 -13.112 1.958 1.00 0.00 C ATOM 335 C HIS A 22 11.006 -12.054 2.930 1.00 0.00 C ATOM 336 O HIS A 22 12.146 -12.117 3.390 1.00 0.00 O ATOM 337 CB HIS A 22 11.127 -14.466 2.284 1.00 0.00 C ATOM 338 CG HIS A 22 10.617 -15.073 3.554 1.00 0.00 C ATOM 339 ND1 HIS A 22 11.224 -14.880 4.777 1.00 0.00 N ATOM 340 CD2 HIS A 22 9.550 -15.873 3.789 1.00 0.00 C ATOM 341 CE1 HIS A 22 10.553 -15.535 5.708 1.00 0.00 C ATOM 342 NE2 HIS A 22 9.533 -16.145 5.134 1.00 0.00 N ATOM 0 H HIS A 22 11.661 -13.125 0.216 1.00 0.00 H new ATOM 0 HA HIS A 22 9.414 -13.187 2.065 1.00 0.00 H new ATOM 0 HB2 HIS A 22 10.937 -15.154 1.460 1.00 0.00 H new ATOM 0 HB3 HIS A 22 12.208 -14.346 2.357 1.00 0.00 H new ATOM 0 HD2 HIS A 22 8.844 -16.231 3.054 1.00 0.00 H new ATOM 0 HE1 HIS A 22 10.798 -15.566 6.759 1.00 0.00 H new ATOM 0 HE2 HIS A 22 8.844 -16.725 5.613 1.00 0.00 H new ATOM 351 N LEU A 23 10.154 -11.081 3.237 1.00 0.00 N ATOM 352 CA LEU A 23 10.517 -10.008 4.155 1.00 0.00 C ATOM 353 C LEU A 23 9.684 -10.081 5.434 1.00 0.00 C ATOM 354 O LEU A 23 8.655 -9.415 5.551 1.00 0.00 O ATOM 355 CB LEU A 23 10.326 -8.649 3.478 1.00 0.00 C ATOM 356 CG LEU A 23 11.614 -7.859 3.240 1.00 0.00 C ATOM 357 CD1 LEU A 23 12.296 -8.324 1.964 1.00 0.00 C ATOM 358 CD2 LEU A 23 11.319 -6.368 3.178 1.00 0.00 C ATOM 0 H LEU A 23 9.207 -11.014 2.863 1.00 0.00 H new ATOM 0 HA LEU A 23 11.567 -10.127 4.423 1.00 0.00 H new ATOM 0 HB2 LEU A 23 9.830 -8.804 2.520 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.655 -8.046 4.090 1.00 0.00 H new ATOM 0 HG LEU A 23 12.291 -8.041 4.075 1.00 0.00 H new ATOM 0 HD11 LEU A 23 13.210 -7.751 1.811 1.00 0.00 H new ATOM 0 HD12 LEU A 23 12.541 -9.383 2.047 1.00 0.00 H new ATOM 0 HD13 LEU A 23 11.626 -8.172 1.117 1.00 0.00 H new ATOM 0 HD21 LEU A 23 12.246 -5.820 3.008 1.00 0.00 H new ATOM 0 HD22 LEU A 23 10.625 -6.168 2.362 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.874 -6.046 4.120 1.00 0.00 H new ATOM 370 N PRO A 24 10.119 -10.892 6.413 1.00 0.00 N ATOM 371 CA PRO A 24 9.406 -11.047 7.685 1.00 0.00 C ATOM 372 C PRO A 24 9.138 -9.709 8.367 1.00 0.00 C ATOM 373 O PRO A 24 8.020 -9.437 8.804 1.00 0.00 O ATOM 374 CB PRO A 24 10.361 -11.894 8.531 1.00 0.00 C ATOM 375 CG PRO A 24 11.191 -12.635 7.542 1.00 0.00 C ATOM 376 CD PRO A 24 11.338 -11.721 6.357 1.00 0.00 C ATOM 0 HA PRO A 24 8.424 -11.499 7.546 1.00 0.00 H new ATOM 0 HB2 PRO A 24 10.978 -11.269 9.176 1.00 0.00 H new ATOM 0 HB3 PRO A 24 9.814 -12.578 9.180 1.00 0.00 H new ATOM 0 HG2 PRO A 24 12.164 -12.889 7.962 1.00 0.00 H new ATOM 0 HG3 PRO A 24 10.713 -13.572 7.255 1.00 0.00 H new ATOM 0 HD2 PRO A 24 12.241 -11.114 6.427 1.00 0.00 H new ATOM 0 HD3 PRO A 24 11.401 -12.280 5.423 1.00 0.00 H new ATOM 384 N ASP A 25 10.173 -8.880 8.459 1.00 0.00 N ATOM 385 CA ASP A 25 10.062 -7.576 9.087 1.00 0.00 C ATOM 386 C ASP A 25 8.962 -6.737 8.441 1.00 0.00 C ATOM 387 O ASP A 25 8.333 -5.909 9.100 1.00 0.00 O ATOM 388 CB ASP A 25 11.403 -6.852 8.992 1.00 0.00 C ATOM 389 CG ASP A 25 11.772 -6.491 7.566 1.00 0.00 C ATOM 390 OD1 ASP A 25 11.613 -7.353 6.675 1.00 0.00 O ATOM 391 OD2 ASP A 25 12.219 -5.347 7.340 1.00 0.00 O ATOM 0 H ASP A 25 11.104 -9.095 8.102 1.00 0.00 H new ATOM 0 HA ASP A 25 9.795 -7.719 10.134 1.00 0.00 H new ATOM 0 HB2 ASP A 25 11.365 -5.944 9.594 1.00 0.00 H new ATOM 0 HB3 ASP A 25 12.183 -7.484 9.416 1.00 0.00 H new ATOM 396 N ASP A 26 8.737 -6.953 7.149 1.00 0.00 N ATOM 397 CA ASP A 26 7.715 -6.210 6.420 1.00 0.00 C ATOM 398 C ASP A 26 6.315 -6.677 6.807 1.00 0.00 C ATOM 399 O ASP A 26 5.502 -5.890 7.294 1.00 0.00 O ATOM 400 CB ASP A 26 7.919 -6.367 4.912 1.00 0.00 C ATOM 401 CG ASP A 26 7.210 -5.288 4.118 1.00 0.00 C ATOM 402 OD1 ASP A 26 7.623 -4.112 4.211 1.00 0.00 O ATOM 403 OD2 ASP A 26 6.241 -5.618 3.403 1.00 0.00 O ATOM 0 H ASP A 26 9.247 -7.634 6.587 1.00 0.00 H new ATOM 0 HA ASP A 26 7.811 -5.157 6.686 1.00 0.00 H new ATOM 0 HB2 ASP A 26 8.985 -6.338 4.687 1.00 0.00 H new ATOM 0 HB3 ASP A 26 7.553 -7.345 4.598 1.00 0.00 H new ATOM 408 N LEU A 27 6.038 -7.959 6.590 1.00 0.00 N ATOM 409 CA LEU A 27 4.732 -8.521 6.920 1.00 0.00 C ATOM 410 C LEU A 27 4.477 -8.458 8.422 1.00 0.00 C ATOM 411 O LEU A 27 3.368 -8.151 8.860 1.00 0.00 O ATOM 412 CB LEU A 27 4.618 -9.970 6.429 1.00 0.00 C ATOM 413 CG LEU A 27 5.939 -10.737 6.313 1.00 0.00 C ATOM 414 CD1 LEU A 27 5.794 -12.143 6.868 1.00 0.00 C ATOM 415 CD2 LEU A 27 6.405 -10.778 4.864 1.00 0.00 C ATOM 0 H LEU A 27 6.697 -8.626 6.189 1.00 0.00 H new ATOM 0 HA LEU A 27 3.976 -7.922 6.412 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.962 -10.514 7.108 1.00 0.00 H new ATOM 0 HB3 LEU A 27 4.134 -9.966 5.452 1.00 0.00 H new ATOM 0 HG LEU A 27 6.692 -10.215 6.903 1.00 0.00 H new ATOM 0 HD11 LEU A 27 6.744 -12.670 6.776 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.508 -12.092 7.919 1.00 0.00 H new ATOM 0 HD13 LEU A 27 5.026 -12.678 6.309 1.00 0.00 H new ATOM 0 HD21 LEU A 27 7.345 -11.327 4.799 1.00 0.00 H new ATOM 0 HD22 LEU A 27 5.652 -11.276 4.253 1.00 0.00 H new ATOM 0 HD23 LEU A 27 6.553 -9.761 4.500 1.00 0.00 H new ATOM 427 N HIS A 28 5.510 -8.747 9.209 1.00 0.00 N ATOM 428 CA HIS A 28 5.394 -8.719 10.665 1.00 0.00 C ATOM 429 C HIS A 28 4.849 -7.376 11.142 1.00 0.00 C ATOM 430 O HIS A 28 3.901 -7.321 11.926 1.00 0.00 O ATOM 431 CB HIS A 28 6.753 -8.987 11.313 1.00 0.00 C ATOM 432 CG HIS A 28 7.113 -10.439 11.373 1.00 0.00 C ATOM 433 ND1 HIS A 28 7.932 -10.972 12.346 1.00 0.00 N ATOM 434 CD2 HIS A 28 6.760 -11.473 10.573 1.00 0.00 C ATOM 435 CE1 HIS A 28 8.068 -12.270 12.142 1.00 0.00 C ATOM 436 NE2 HIS A 28 7.366 -12.599 11.073 1.00 0.00 N ATOM 0 H HIS A 28 6.435 -9.003 8.864 1.00 0.00 H new ATOM 0 HA HIS A 28 4.696 -9.502 10.962 1.00 0.00 H new ATOM 0 HB2 HIS A 28 7.523 -8.453 10.756 1.00 0.00 H new ATOM 0 HB3 HIS A 28 6.751 -8.580 12.324 1.00 0.00 H new ATOM 0 HD2 HIS A 28 6.121 -11.422 9.704 1.00 0.00 H new ATOM 0 HE1 HIS A 28 8.654 -12.947 12.746 1.00 0.00 H new ATOM 0 HE2 HIS A 28 7.287 -13.538 10.682 1.00 0.00 H new ATOM 445 N TYR A 29 5.455 -6.296 10.661 1.00 0.00 N ATOM 446 CA TYR A 29 5.032 -4.952 11.035 1.00 0.00 C ATOM 447 C TYR A 29 3.769 -4.548 10.280 1.00 0.00 C ATOM 448 O TYR A 29 2.994 -3.715 10.749 1.00 0.00 O ATOM 449 CB TYR A 29 6.151 -3.948 10.754 1.00 0.00 C ATOM 450 CG TYR A 29 5.843 -2.546 11.229 1.00 0.00 C ATOM 451 CD1 TYR A 29 5.430 -2.310 12.534 1.00 0.00 C ATOM 452 CD2 TYR A 29 5.964 -1.460 10.372 1.00 0.00 C ATOM 453 CE1 TYR A 29 5.147 -1.030 12.972 1.00 0.00 C ATOM 454 CE2 TYR A 29 5.684 -0.177 10.802 1.00 0.00 C ATOM 455 CZ TYR A 29 5.276 0.033 12.103 1.00 0.00 C ATOM 456 OH TYR A 29 4.996 1.309 12.535 1.00 0.00 O ATOM 0 H TYR A 29 6.241 -6.325 10.011 1.00 0.00 H new ATOM 0 HA TYR A 29 4.810 -4.951 12.102 1.00 0.00 H new ATOM 0 HB2 TYR A 29 7.066 -4.293 11.236 1.00 0.00 H new ATOM 0 HB3 TYR A 29 6.345 -3.924 9.682 1.00 0.00 H new ATOM 0 HD1 TYR A 29 5.328 -3.140 13.217 1.00 0.00 H new ATOM 0 HD2 TYR A 29 6.282 -1.621 9.353 1.00 0.00 H new ATOM 0 HE1 TYR A 29 4.826 -0.863 13.990 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.784 0.657 10.123 1.00 0.00 H new ATOM 0 HH TYR A 29 5.138 1.942 11.800 1.00 0.00 H new ATOM 466 N PHE A 30 3.568 -5.143 9.107 1.00 0.00 N ATOM 467 CA PHE A 30 2.399 -4.844 8.288 1.00 0.00 C ATOM 468 C PHE A 30 1.122 -5.341 8.958 1.00 0.00 C ATOM 469 O PHE A 30 0.173 -4.580 9.150 1.00 0.00 O ATOM 470 CB PHE A 30 2.545 -5.484 6.906 1.00 0.00 C ATOM 471 CG PHE A 30 1.500 -5.040 5.922 1.00 0.00 C ATOM 472 CD1 PHE A 30 0.178 -5.427 6.073 1.00 0.00 C ATOM 473 CD2 PHE A 30 1.841 -4.237 4.846 1.00 0.00 C ATOM 474 CE1 PHE A 30 -0.785 -5.021 5.169 1.00 0.00 C ATOM 475 CE2 PHE A 30 0.882 -3.827 3.939 1.00 0.00 C ATOM 476 CZ PHE A 30 -0.432 -4.219 4.101 1.00 0.00 C ATOM 0 H PHE A 30 4.200 -5.835 8.703 1.00 0.00 H new ATOM 0 HA PHE A 30 2.331 -3.762 8.177 1.00 0.00 H new ATOM 0 HB2 PHE A 30 3.531 -5.246 6.507 1.00 0.00 H new ATOM 0 HB3 PHE A 30 2.496 -6.568 7.010 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -0.103 -6.053 6.907 1.00 0.00 H new ATOM 0 HD2 PHE A 30 2.867 -3.928 4.714 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -1.812 -5.330 5.297 1.00 0.00 H new ATOM 0 HE2 PHE A 30 1.160 -3.201 3.104 1.00 0.00 H new ATOM 0 HZ PHE A 30 -1.183 -3.899 3.394 1.00 0.00 H new ATOM 486 N ARG A 31 1.104 -6.622 9.308 1.00 0.00 N ATOM 487 CA ARG A 31 -0.057 -7.224 9.954 1.00 0.00 C ATOM 488 C ARG A 31 -0.224 -6.711 11.382 1.00 0.00 C ATOM 489 O ARG A 31 -1.318 -6.764 11.945 1.00 0.00 O ATOM 490 CB ARG A 31 0.076 -8.748 9.962 1.00 0.00 C ATOM 491 CG ARG A 31 -1.209 -9.470 10.334 1.00 0.00 C ATOM 492 CD ARG A 31 -0.925 -10.820 10.971 1.00 0.00 C ATOM 493 NE ARG A 31 -0.654 -11.851 9.972 1.00 0.00 N ATOM 494 CZ ARG A 31 -0.040 -13.001 10.240 1.00 0.00 C ATOM 495 NH1 ARG A 31 0.368 -13.272 11.474 1.00 0.00 N ATOM 496 NH2 ARG A 31 0.167 -13.884 9.273 1.00 0.00 N ATOM 0 H ARG A 31 1.881 -7.265 9.155 1.00 0.00 H new ATOM 0 HA ARG A 31 -0.942 -6.941 9.384 1.00 0.00 H new ATOM 0 HB2 ARG A 31 0.397 -9.081 8.975 1.00 0.00 H new ATOM 0 HB3 ARG A 31 0.859 -9.032 10.665 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -1.786 -8.855 11.024 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -1.821 -9.609 9.443 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -0.070 -10.732 11.642 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -1.778 -11.120 11.580 1.00 0.00 H new ATOM 0 HE ARG A 31 -0.953 -11.679 9.012 1.00 0.00 H new ATOM 0 HH11 ARG A 31 0.211 -12.597 12.223 1.00 0.00 H new ATOM 0 HH12 ARG A 31 0.838 -14.155 11.673 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -0.144 -13.682 8.323 1.00 0.00 H new ATOM 0 HH22 ARG A 31 0.638 -14.765 9.479 1.00 0.00 H new ATOM 510 N ALA A 32 0.865 -6.219 11.967 1.00 0.00 N ATOM 511 CA ALA A 32 0.832 -5.704 13.331 1.00 0.00 C ATOM 512 C ALA A 32 0.264 -4.289 13.381 1.00 0.00 C ATOM 513 O ALA A 32 -0.401 -3.913 14.346 1.00 0.00 O ATOM 514 CB ALA A 32 2.227 -5.735 13.937 1.00 0.00 C ATOM 0 H ALA A 32 1.779 -6.167 11.518 1.00 0.00 H new ATOM 0 HA ALA A 32 0.174 -6.347 13.916 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.190 -5.348 14.955 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.595 -6.761 13.952 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.897 -5.118 13.339 1.00 0.00 H new ATOM 520 N GLN A 33 0.533 -3.507 12.341 1.00 0.00 N ATOM 521 CA GLN A 33 0.049 -2.132 12.275 1.00 0.00 C ATOM 522 C GLN A 33 -1.362 -2.068 11.698 1.00 0.00 C ATOM 523 O GLN A 33 -2.124 -1.151 12.000 1.00 0.00 O ATOM 524 CB GLN A 33 0.999 -1.275 11.433 1.00 0.00 C ATOM 525 CG GLN A 33 1.785 -0.261 12.248 1.00 0.00 C ATOM 526 CD GLN A 33 1.560 1.165 11.783 1.00 0.00 C ATOM 527 OE1 GLN A 33 1.041 1.998 12.525 1.00 0.00 O ATOM 528 NE2 GLN A 33 1.951 1.453 10.547 1.00 0.00 N ATOM 0 H GLN A 33 1.082 -3.801 11.533 1.00 0.00 H new ATOM 0 HA GLN A 33 0.018 -1.740 13.291 1.00 0.00 H new ATOM 0 HB2 GLN A 33 1.697 -1.928 10.910 1.00 0.00 H new ATOM 0 HB3 GLN A 33 0.423 -0.749 10.672 1.00 0.00 H new ATOM 0 HG2 GLN A 33 1.501 -0.346 13.297 1.00 0.00 H new ATOM 0 HG3 GLN A 33 2.848 -0.496 12.185 1.00 0.00 H new ATOM 0 HE21 GLN A 33 2.377 0.731 9.966 1.00 0.00 H new ATOM 0 HE22 GLN A 33 1.825 2.396 10.179 1.00 0.00 H new ATOM 537 N THR A 34 -1.707 -3.045 10.865 1.00 0.00 N ATOM 538 CA THR A 34 -3.028 -3.090 10.246 1.00 0.00 C ATOM 539 C THR A 34 -4.053 -3.771 11.154 1.00 0.00 C ATOM 540 O THR A 34 -5.079 -4.262 10.682 1.00 0.00 O ATOM 541 CB THR A 34 -2.955 -3.824 8.907 1.00 0.00 C ATOM 542 OG1 THR A 34 -2.651 -5.194 9.100 1.00 0.00 O ATOM 543 CG2 THR A 34 -1.916 -3.251 7.967 1.00 0.00 C ATOM 0 H THR A 34 -1.092 -3.815 10.603 1.00 0.00 H new ATOM 0 HA THR A 34 -3.353 -2.062 10.083 1.00 0.00 H new ATOM 0 HB THR A 34 -3.939 -3.699 8.456 1.00 0.00 H new ATOM 0 HG1 THR A 34 -2.610 -5.646 8.231 1.00 0.00 H new ATOM 0 HG21 THR A 34 -1.916 -3.817 7.036 1.00 0.00 H new ATOM 0 HG22 THR A 34 -2.151 -2.208 7.757 1.00 0.00 H new ATOM 0 HG23 THR A 34 -0.931 -3.315 8.430 1.00 0.00 H new ATOM 551 N VAL A 35 -3.776 -3.798 12.455 1.00 0.00 N ATOM 552 CA VAL A 35 -4.682 -4.420 13.412 1.00 0.00 C ATOM 553 C VAL A 35 -5.702 -3.417 13.940 1.00 0.00 C ATOM 554 O VAL A 35 -5.419 -2.657 14.865 1.00 0.00 O ATOM 555 CB VAL A 35 -3.912 -5.027 14.601 1.00 0.00 C ATOM 556 CG1 VAL A 35 -4.850 -5.823 15.495 1.00 0.00 C ATOM 557 CG2 VAL A 35 -2.767 -5.897 14.107 1.00 0.00 C ATOM 0 H VAL A 35 -2.934 -3.397 12.868 1.00 0.00 H new ATOM 0 HA VAL A 35 -5.203 -5.216 12.881 1.00 0.00 H new ATOM 0 HB VAL A 35 -3.490 -4.213 15.191 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -4.288 -6.244 16.329 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -5.631 -5.167 15.878 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -5.304 -6.630 14.919 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.235 -6.317 14.960 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -3.163 -6.706 13.493 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -2.081 -5.293 13.513 1.00 0.00 H new ATOM 567 N GLY A 36 -6.891 -3.424 13.346 1.00 0.00 N ATOM 568 CA GLY A 36 -7.938 -2.514 13.771 1.00 0.00 C ATOM 569 C GLY A 36 -8.009 -1.264 12.915 1.00 0.00 C ATOM 570 O GLY A 36 -8.476 -0.220 13.369 1.00 0.00 O ATOM 0 H GLY A 36 -7.148 -4.044 12.578 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.898 -3.029 13.735 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.767 -2.229 14.809 1.00 0.00 H new ATOM 574 N LYS A 37 -7.546 -1.367 11.673 1.00 0.00 N ATOM 575 CA LYS A 37 -7.562 -0.232 10.756 1.00 0.00 C ATOM 576 C LYS A 37 -8.266 -0.592 9.452 1.00 0.00 C ATOM 577 O LYS A 37 -8.762 -1.706 9.289 1.00 0.00 O ATOM 578 CB LYS A 37 -6.135 0.236 10.466 1.00 0.00 C ATOM 579 CG LYS A 37 -5.582 1.187 11.515 1.00 0.00 C ATOM 580 CD LYS A 37 -4.796 2.323 10.879 1.00 0.00 C ATOM 581 CE LYS A 37 -3.893 3.010 11.892 1.00 0.00 C ATOM 582 NZ LYS A 37 -4.658 3.915 12.793 1.00 0.00 N ATOM 0 H LYS A 37 -7.156 -2.223 11.279 1.00 0.00 H new ATOM 0 HA LYS A 37 -8.114 0.578 11.232 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -5.483 -0.635 10.397 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -6.113 0.728 9.494 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -6.402 1.596 12.105 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -4.938 0.638 12.202 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -4.194 1.935 10.057 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -5.486 3.051 10.453 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -3.376 2.257 12.487 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -3.128 3.582 11.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -4.501 4.903 12.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -5.672 3.693 12.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -4.336 3.782 13.773 1.00 0.00 H new ATOM 596 N ILE A 38 -8.301 0.359 8.523 1.00 0.00 N ATOM 597 CA ILE A 38 -8.938 0.142 7.227 1.00 0.00 C ATOM 598 C ILE A 38 -7.908 0.215 6.105 1.00 0.00 C ATOM 599 O ILE A 38 -7.356 1.279 5.825 1.00 0.00 O ATOM 600 CB ILE A 38 -10.066 1.167 6.939 1.00 0.00 C ATOM 601 CG1 ILE A 38 -10.273 2.125 8.117 1.00 0.00 C ATOM 602 CG2 ILE A 38 -11.368 0.447 6.619 1.00 0.00 C ATOM 603 CD1 ILE A 38 -11.033 3.379 7.742 1.00 0.00 C ATOM 0 H ILE A 38 -7.896 1.287 8.643 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.384 -0.852 7.266 1.00 0.00 H new ATOM 0 HB ILE A 38 -9.760 1.758 6.075 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -10.812 1.605 8.909 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -9.301 2.405 8.524 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -12.150 1.180 6.419 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -11.229 -0.183 5.741 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.659 -0.172 7.467 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -11.145 4.013 8.621 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -10.484 3.920 6.971 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -12.018 3.108 7.363 1.00 0.00 H new ATOM 615 N MET A 39 -7.648 -0.922 5.469 1.00 0.00 N ATOM 616 CA MET A 39 -6.678 -0.983 4.381 1.00 0.00 C ATOM 617 C MET A 39 -7.375 -1.029 3.024 1.00 0.00 C ATOM 618 O MET A 39 -8.291 -1.824 2.810 1.00 0.00 O ATOM 619 CB MET A 39 -5.773 -2.207 4.550 1.00 0.00 C ATOM 620 CG MET A 39 -4.860 -2.465 3.361 1.00 0.00 C ATOM 621 SD MET A 39 -5.567 -3.638 2.188 1.00 0.00 S ATOM 622 CE MET A 39 -5.867 -5.045 3.255 1.00 0.00 C ATOM 0 H MET A 39 -8.094 -1.813 5.687 1.00 0.00 H new ATOM 0 HA MET A 39 -6.069 -0.080 4.419 1.00 0.00 H new ATOM 0 HB2 MET A 39 -5.162 -2.075 5.443 1.00 0.00 H new ATOM 0 HB3 MET A 39 -6.395 -3.087 4.716 1.00 0.00 H new ATOM 0 HG2 MET A 39 -4.658 -1.523 2.851 1.00 0.00 H new ATOM 0 HG3 MET A 39 -3.903 -2.845 3.718 1.00 0.00 H new ATOM 0 HE1 MET A 39 -5.732 -5.966 2.689 1.00 0.00 H new ATOM 0 HE2 MET A 39 -5.165 -5.025 4.089 1.00 0.00 H new ATOM 0 HE3 MET A 39 -6.887 -5.000 3.638 1.00 0.00 H new ATOM 632 N VAL A 40 -6.927 -0.176 2.109 1.00 0.00 N ATOM 633 CA VAL A 40 -7.497 -0.120 0.768 1.00 0.00 C ATOM 634 C VAL A 40 -6.673 -0.960 -0.202 1.00 0.00 C ATOM 635 O VAL A 40 -5.448 -0.847 -0.249 1.00 0.00 O ATOM 636 CB VAL A 40 -7.573 1.328 0.247 1.00 0.00 C ATOM 637 CG1 VAL A 40 -8.411 1.396 -1.020 1.00 0.00 C ATOM 638 CG2 VAL A 40 -8.134 2.254 1.317 1.00 0.00 C ATOM 0 H VAL A 40 -6.169 0.487 2.272 1.00 0.00 H new ATOM 0 HA VAL A 40 -8.508 -0.522 0.831 1.00 0.00 H new ATOM 0 HB VAL A 40 -6.563 1.661 0.006 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -8.453 2.426 -1.373 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -7.961 0.767 -1.788 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.420 1.043 -0.808 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.180 3.272 0.930 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.136 1.926 1.594 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.489 2.229 2.195 1.00 0.00 H new ATOM 648 N VAL A 41 -7.350 -1.812 -0.965 1.00 0.00 N ATOM 649 CA VAL A 41 -6.674 -2.679 -1.922 1.00 0.00 C ATOM 650 C VAL A 41 -7.273 -2.540 -3.323 1.00 0.00 C ATOM 651 O VAL A 41 -8.465 -2.279 -3.474 1.00 0.00 O ATOM 652 CB VAL A 41 -6.730 -4.156 -1.459 1.00 0.00 C ATOM 653 CG1 VAL A 41 -7.892 -4.905 -2.102 1.00 0.00 C ATOM 654 CG2 VAL A 41 -5.411 -4.854 -1.747 1.00 0.00 C ATOM 0 H VAL A 41 -8.364 -1.920 -0.939 1.00 0.00 H new ATOM 0 HA VAL A 41 -5.631 -2.366 -1.969 1.00 0.00 H new ATOM 0 HB VAL A 41 -6.898 -4.160 -0.382 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -7.897 -5.937 -1.752 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -8.831 -4.424 -1.828 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -7.779 -4.890 -3.186 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -5.468 -5.891 -1.415 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -5.211 -4.826 -2.818 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.607 -4.346 -1.214 1.00 0.00 H new ATOM 664 N GLY A 42 -6.436 -2.716 -4.343 1.00 0.00 N ATOM 665 CA GLY A 42 -6.900 -2.606 -5.716 1.00 0.00 C ATOM 666 C GLY A 42 -7.630 -3.850 -6.183 1.00 0.00 C ATOM 667 O GLY A 42 -7.616 -4.876 -5.501 1.00 0.00 O ATOM 0 H GLY A 42 -5.444 -2.933 -4.243 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -7.563 -1.745 -5.804 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.048 -2.421 -6.370 1.00 0.00 H new ATOM 671 N ARG A 43 -8.280 -3.762 -7.342 1.00 0.00 N ATOM 672 CA ARG A 43 -9.026 -4.893 -7.884 1.00 0.00 C ATOM 673 C ARG A 43 -8.146 -6.139 -7.999 1.00 0.00 C ATOM 674 O ARG A 43 -8.402 -7.164 -7.358 1.00 0.00 O ATOM 675 CB ARG A 43 -9.605 -4.540 -9.258 1.00 0.00 C ATOM 676 CG ARG A 43 -10.124 -5.745 -10.035 1.00 0.00 C ATOM 677 CD ARG A 43 -11.553 -5.536 -10.505 1.00 0.00 C ATOM 678 NE ARG A 43 -11.693 -4.311 -11.289 1.00 0.00 N ATOM 679 CZ ARG A 43 -11.923 -4.285 -12.602 1.00 0.00 C ATOM 680 NH1 ARG A 43 -12.044 -5.412 -13.293 1.00 0.00 N ATOM 681 NH2 ARG A 43 -12.028 -3.122 -13.228 1.00 0.00 N ATOM 0 H ARG A 43 -8.305 -2.922 -7.921 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.841 -5.112 -7.194 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -10.418 -3.826 -9.127 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -8.836 -4.042 -9.849 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -9.481 -5.928 -10.896 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -10.074 -6.633 -9.405 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -11.867 -6.390 -11.106 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -12.217 -5.493 -9.642 1.00 0.00 H new ATOM 0 HE ARG A 43 -11.609 -3.419 -10.801 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -11.961 -6.312 -12.820 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -12.220 -5.378 -14.297 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -11.933 -2.251 -12.706 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -12.204 -3.098 -14.232 1.00 0.00 H new ATOM 695 N ARG A 44 -7.109 -6.041 -8.822 1.00 0.00 N ATOM 696 CA ARG A 44 -6.192 -7.153 -9.032 1.00 0.00 C ATOM 697 C ARG A 44 -5.566 -7.604 -7.719 1.00 0.00 C ATOM 698 O ARG A 44 -5.077 -8.727 -7.611 1.00 0.00 O ATOM 699 CB ARG A 44 -5.095 -6.756 -10.022 1.00 0.00 C ATOM 700 CG ARG A 44 -5.540 -6.806 -11.475 1.00 0.00 C ATOM 701 CD ARG A 44 -5.945 -5.431 -11.984 1.00 0.00 C ATOM 702 NE ARG A 44 -7.340 -5.397 -12.417 1.00 0.00 N ATOM 703 CZ ARG A 44 -7.773 -5.915 -13.564 1.00 0.00 C ATOM 704 NH1 ARG A 44 -6.925 -6.507 -14.395 1.00 0.00 N ATOM 705 NH2 ARG A 44 -9.059 -5.841 -13.881 1.00 0.00 N ATOM 0 H ARG A 44 -6.882 -5.201 -9.355 1.00 0.00 H new ATOM 0 HA ARG A 44 -6.763 -7.985 -9.444 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -4.755 -5.747 -9.789 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.240 -7.419 -9.889 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -4.731 -7.199 -12.091 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -6.380 -7.494 -11.576 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -5.792 -4.693 -11.196 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -5.300 -5.148 -12.816 1.00 0.00 H new ATOM 0 HE ARG A 44 -8.022 -4.950 -11.804 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -5.935 -6.567 -14.156 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -7.263 -6.902 -15.273 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -9.716 -5.387 -13.246 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -9.391 -6.238 -14.760 1.00 0.00 H new ATOM 719 N THR A 45 -5.575 -6.723 -6.724 1.00 0.00 N ATOM 720 CA THR A 45 -4.996 -7.038 -5.427 1.00 0.00 C ATOM 721 C THR A 45 -5.945 -7.877 -4.572 1.00 0.00 C ATOM 722 O THR A 45 -5.523 -8.862 -3.965 1.00 0.00 O ATOM 723 CB THR A 45 -4.616 -5.755 -4.690 1.00 0.00 C ATOM 724 OG1 THR A 45 -4.220 -4.751 -5.607 1.00 0.00 O ATOM 725 CG2 THR A 45 -3.483 -5.948 -3.705 1.00 0.00 C ATOM 0 H THR A 45 -5.976 -5.788 -6.793 1.00 0.00 H new ATOM 0 HA THR A 45 -4.098 -7.630 -5.602 1.00 0.00 H new ATOM 0 HB THR A 45 -5.510 -5.459 -4.141 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.254 -4.810 -5.760 1.00 0.00 H new ATOM 0 HG21 THR A 45 -3.261 -5.000 -3.215 1.00 0.00 H new ATOM 0 HG22 THR A 45 -3.774 -6.684 -2.956 1.00 0.00 H new ATOM 0 HG23 THR A 45 -2.597 -6.299 -4.234 1.00 0.00 H new ATOM 733 N TYR A 46 -7.225 -7.497 -4.517 1.00 0.00 N ATOM 734 CA TYR A 46 -8.189 -8.250 -3.716 1.00 0.00 C ATOM 735 C TYR A 46 -8.157 -9.728 -4.095 1.00 0.00 C ATOM 736 O TYR A 46 -8.257 -10.601 -3.232 1.00 0.00 O ATOM 737 CB TYR A 46 -9.616 -7.670 -3.838 1.00 0.00 C ATOM 738 CG TYR A 46 -10.295 -7.874 -5.182 1.00 0.00 C ATOM 739 CD1 TYR A 46 -10.528 -9.147 -5.689 1.00 0.00 C ATOM 740 CD2 TYR A 46 -10.710 -6.786 -5.943 1.00 0.00 C ATOM 741 CE1 TYR A 46 -11.143 -9.329 -6.909 1.00 0.00 C ATOM 742 CE2 TYR A 46 -11.329 -6.964 -7.166 1.00 0.00 C ATOM 743 CZ TYR A 46 -11.540 -8.237 -7.646 1.00 0.00 C ATOM 744 OH TYR A 46 -12.155 -8.417 -8.863 1.00 0.00 O ATOM 0 H TYR A 46 -7.610 -6.690 -5.007 1.00 0.00 H new ATOM 0 HA TYR A 46 -7.898 -8.157 -2.670 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -10.239 -8.119 -3.065 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -9.573 -6.601 -3.631 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -10.221 -10.010 -5.116 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -10.546 -5.785 -5.572 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -11.313 -10.327 -7.286 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -11.646 -6.108 -7.743 1.00 0.00 H new ATOM 0 HH TYR A 46 -13.121 -8.284 -8.764 1.00 0.00 H new ATOM 754 N GLU A 47 -8.010 -10.005 -5.390 1.00 0.00 N ATOM 755 CA GLU A 47 -7.959 -11.380 -5.874 1.00 0.00 C ATOM 756 C GLU A 47 -6.537 -11.930 -5.820 1.00 0.00 C ATOM 757 O GLU A 47 -6.328 -13.143 -5.850 1.00 0.00 O ATOM 758 CB GLU A 47 -8.491 -11.457 -7.304 1.00 0.00 C ATOM 759 CG GLU A 47 -9.780 -12.246 -7.415 1.00 0.00 C ATOM 760 CD GLU A 47 -10.438 -12.108 -8.774 1.00 0.00 C ATOM 761 OE1 GLU A 47 -10.310 -11.027 -9.388 1.00 0.00 O ATOM 762 OE2 GLU A 47 -11.080 -13.079 -9.224 1.00 0.00 O ATOM 0 H GLU A 47 -7.925 -9.297 -6.119 1.00 0.00 H new ATOM 0 HA GLU A 47 -8.587 -11.988 -5.223 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -8.656 -10.447 -7.679 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -7.735 -11.914 -7.943 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -9.574 -13.299 -7.221 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -10.474 -11.910 -6.645 1.00 0.00 H new ATOM 769 N SER A 48 -5.563 -11.031 -5.744 1.00 0.00 N ATOM 770 CA SER A 48 -4.159 -11.432 -5.690 1.00 0.00 C ATOM 771 C SER A 48 -3.612 -11.388 -4.263 1.00 0.00 C ATOM 772 O SER A 48 -2.398 -11.406 -4.059 1.00 0.00 O ATOM 773 CB SER A 48 -3.311 -10.535 -6.594 1.00 0.00 C ATOM 774 OG SER A 48 -3.648 -10.719 -7.958 1.00 0.00 O ATOM 0 H SER A 48 -5.717 -10.023 -5.718 1.00 0.00 H new ATOM 0 HA SER A 48 -4.102 -12.461 -6.044 1.00 0.00 H new ATOM 0 HB2 SER A 48 -3.459 -9.491 -6.317 1.00 0.00 H new ATOM 0 HB3 SER A 48 -2.255 -10.758 -6.444 1.00 0.00 H new ATOM 0 HG SER A 48 -4.183 -9.959 -8.268 1.00 0.00 H new ATOM 780 N PHE A 49 -4.505 -11.331 -3.279 1.00 0.00 N ATOM 781 CA PHE A 49 -4.088 -11.289 -1.879 1.00 0.00 C ATOM 782 C PHE A 49 -4.324 -12.637 -1.197 1.00 0.00 C ATOM 783 O PHE A 49 -5.345 -13.286 -1.427 1.00 0.00 O ATOM 784 CB PHE A 49 -4.841 -10.186 -1.133 1.00 0.00 C ATOM 785 CG PHE A 49 -3.988 -9.443 -0.142 1.00 0.00 C ATOM 786 CD1 PHE A 49 -3.022 -8.547 -0.572 1.00 0.00 C ATOM 787 CD2 PHE A 49 -4.153 -9.642 1.219 1.00 0.00 C ATOM 788 CE1 PHE A 49 -2.238 -7.863 0.337 1.00 0.00 C ATOM 789 CE2 PHE A 49 -3.372 -8.961 2.133 1.00 0.00 C ATOM 790 CZ PHE A 49 -2.413 -8.071 1.692 1.00 0.00 C ATOM 0 H PHE A 49 -5.515 -11.313 -3.422 1.00 0.00 H new ATOM 0 HA PHE A 49 -3.020 -11.072 -1.851 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -5.243 -9.478 -1.857 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -5.691 -10.626 -0.611 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -2.880 -8.382 -1.630 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -4.901 -10.338 1.570 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -1.489 -7.167 -0.011 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -3.512 -9.125 3.191 1.00 0.00 H new ATOM 0 HZ PHE A 49 -1.801 -7.538 2.405 1.00 0.00 H new ATOM 800 N PRO A 50 -3.378 -13.079 -0.347 1.00 0.00 N ATOM 801 CA PRO A 50 -3.489 -14.356 0.365 1.00 0.00 C ATOM 802 C PRO A 50 -4.432 -14.281 1.563 1.00 0.00 C ATOM 803 O PRO A 50 -4.935 -15.302 2.033 1.00 0.00 O ATOM 804 CB PRO A 50 -2.058 -14.616 0.827 1.00 0.00 C ATOM 805 CG PRO A 50 -1.475 -13.259 1.016 1.00 0.00 C ATOM 806 CD PRO A 50 -2.125 -12.372 -0.015 1.00 0.00 C ATOM 0 HA PRO A 50 -3.904 -15.142 -0.266 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -2.038 -15.189 1.754 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -1.500 -15.188 0.086 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -1.668 -12.890 2.023 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -0.393 -13.279 0.885 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -2.321 -11.375 0.381 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -1.491 -12.248 -0.893 1.00 0.00 H new ATOM 814 N LYS A 51 -4.671 -13.068 2.051 1.00 0.00 N ATOM 815 CA LYS A 51 -5.558 -12.863 3.191 1.00 0.00 C ATOM 816 C LYS A 51 -6.707 -11.936 2.814 1.00 0.00 C ATOM 817 O LYS A 51 -6.713 -10.759 3.174 1.00 0.00 O ATOM 818 CB LYS A 51 -4.779 -12.282 4.373 1.00 0.00 C ATOM 819 CG LYS A 51 -4.000 -13.324 5.158 1.00 0.00 C ATOM 820 CD LYS A 51 -4.785 -13.814 6.364 1.00 0.00 C ATOM 821 CE LYS A 51 -4.020 -14.879 7.134 1.00 0.00 C ATOM 822 NZ LYS A 51 -4.081 -14.652 8.604 1.00 0.00 N ATOM 0 H LYS A 51 -4.263 -12.212 1.675 1.00 0.00 H new ATOM 0 HA LYS A 51 -5.971 -13.828 3.483 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -4.087 -11.524 4.005 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -5.475 -11.779 5.044 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -3.763 -14.167 4.510 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -3.052 -12.899 5.488 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -5.003 -12.974 7.023 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -5.743 -14.218 6.036 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -4.431 -15.861 6.901 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -2.979 -14.884 6.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -3.239 -15.063 9.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -4.112 -13.630 8.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -4.935 -15.103 8.990 1.00 0.00 H new ATOM 836 N ARG A 52 -7.673 -12.473 2.078 1.00 0.00 N ATOM 837 CA ARG A 52 -8.824 -11.692 1.641 1.00 0.00 C ATOM 838 C ARG A 52 -10.135 -12.298 2.149 1.00 0.00 C ATOM 839 O ARG A 52 -10.599 -13.306 1.616 1.00 0.00 O ATOM 840 CB ARG A 52 -8.854 -11.612 0.113 1.00 0.00 C ATOM 841 CG ARG A 52 -8.515 -12.927 -0.572 1.00 0.00 C ATOM 842 CD ARG A 52 -9.411 -13.182 -1.773 1.00 0.00 C ATOM 843 NE ARG A 52 -8.908 -14.269 -2.610 1.00 0.00 N ATOM 844 CZ ARG A 52 -9.579 -14.785 -3.637 1.00 0.00 C ATOM 845 NH1 ARG A 52 -10.778 -14.317 -3.959 1.00 0.00 N ATOM 846 NH2 ARG A 52 -9.048 -15.773 -4.345 1.00 0.00 N ATOM 0 H ARG A 52 -7.682 -13.446 1.771 1.00 0.00 H new ATOM 0 HA ARG A 52 -8.725 -10.690 2.059 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -9.845 -11.291 -0.206 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -8.150 -10.848 -0.216 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -7.473 -12.913 -0.892 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -8.619 -13.746 0.140 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -10.417 -13.424 -1.430 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -9.488 -12.272 -2.368 1.00 0.00 H new ATOM 0 HE ARG A 52 -7.989 -14.655 -2.395 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -11.191 -13.557 -3.418 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -11.287 -14.717 -4.747 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -8.126 -16.136 -4.102 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -9.561 -16.169 -5.132 1.00 0.00 H new ATOM 860 N PRO A 53 -10.762 -11.695 3.181 1.00 0.00 N ATOM 861 CA PRO A 53 -10.266 -10.498 3.856 1.00 0.00 C ATOM 862 C PRO A 53 -9.341 -10.830 5.024 1.00 0.00 C ATOM 863 O PRO A 53 -9.381 -11.935 5.565 1.00 0.00 O ATOM 864 CB PRO A 53 -11.551 -9.849 4.358 1.00 0.00 C ATOM 865 CG PRO A 53 -12.483 -10.988 4.626 1.00 0.00 C ATOM 866 CD PRO A 53 -12.028 -12.154 3.776 1.00 0.00 C ATOM 0 HA PRO A 53 -9.669 -9.864 3.200 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -11.371 -9.266 5.261 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -11.965 -9.167 3.615 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -12.469 -11.255 5.683 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -13.508 -10.711 4.381 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -11.883 -13.052 4.377 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -12.763 -12.398 3.009 1.00 0.00 H new ATOM 874 N LEU A 54 -8.515 -9.865 5.415 1.00 0.00 N ATOM 875 CA LEU A 54 -7.588 -10.055 6.525 1.00 0.00 C ATOM 876 C LEU A 54 -8.347 -10.150 7.850 1.00 0.00 C ATOM 877 O LEU A 54 -9.319 -9.427 8.071 1.00 0.00 O ATOM 878 CB LEU A 54 -6.579 -8.906 6.576 1.00 0.00 C ATOM 879 CG LEU A 54 -5.504 -8.940 5.485 1.00 0.00 C ATOM 880 CD1 LEU A 54 -5.635 -7.737 4.564 1.00 0.00 C ATOM 881 CD2 LEU A 54 -4.114 -8.991 6.102 1.00 0.00 C ATOM 0 H LEU A 54 -8.469 -8.944 4.980 1.00 0.00 H new ATOM 0 HA LEU A 54 -7.049 -10.989 6.367 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -7.121 -7.963 6.502 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -6.088 -8.916 7.549 1.00 0.00 H new ATOM 0 HG LEU A 54 -5.650 -9.843 4.892 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.862 -7.780 3.797 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -6.617 -7.746 4.091 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -5.520 -6.821 5.143 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.365 -9.015 5.310 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.959 -8.108 6.722 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -4.021 -9.887 6.716 1.00 0.00 H new ATOM 893 N PRO A 55 -7.921 -11.057 8.747 1.00 0.00 N ATOM 894 CA PRO A 55 -8.578 -11.254 10.044 1.00 0.00 C ATOM 895 C PRO A 55 -8.301 -10.133 11.042 1.00 0.00 C ATOM 896 O PRO A 55 -7.246 -9.500 11.015 1.00 0.00 O ATOM 897 CB PRO A 55 -7.976 -12.568 10.544 1.00 0.00 C ATOM 898 CG PRO A 55 -6.633 -12.633 9.906 1.00 0.00 C ATOM 899 CD PRO A 55 -6.778 -11.973 8.562 1.00 0.00 C ATOM 0 HA PRO A 55 -9.663 -11.264 9.941 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -7.899 -12.580 11.631 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -8.592 -13.420 10.258 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -5.887 -12.120 10.514 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -6.302 -13.666 9.799 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -5.874 -11.434 8.280 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -6.972 -12.703 7.776 1.00 0.00 H new ATOM 907 N GLU A 56 -9.264 -9.912 11.933 1.00 0.00 N ATOM 908 CA GLU A 56 -9.156 -8.889 12.970 1.00 0.00 C ATOM 909 C GLU A 56 -8.812 -7.517 12.396 1.00 0.00 C ATOM 910 O GLU A 56 -8.195 -6.695 13.073 1.00 0.00 O ATOM 911 CB GLU A 56 -8.101 -9.296 14.000 1.00 0.00 C ATOM 912 CG GLU A 56 -8.343 -8.711 15.382 1.00 0.00 C ATOM 913 CD GLU A 56 -8.390 -9.772 16.466 1.00 0.00 C ATOM 914 OE1 GLU A 56 -9.262 -10.662 16.388 1.00 0.00 O ATOM 915 OE2 GLU A 56 -7.554 -9.712 17.392 1.00 0.00 O ATOM 0 H GLU A 56 -10.139 -10.435 11.957 1.00 0.00 H new ATOM 0 HA GLU A 56 -10.132 -8.810 13.449 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -8.078 -10.383 14.074 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -7.120 -8.979 13.647 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -7.553 -7.996 15.613 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -9.283 -8.158 15.379 1.00 0.00 H new ATOM 922 N ARG A 57 -9.221 -7.261 11.157 1.00 0.00 N ATOM 923 CA ARG A 57 -8.954 -5.971 10.529 1.00 0.00 C ATOM 924 C ARG A 57 -10.037 -5.619 9.511 1.00 0.00 C ATOM 925 O ARG A 57 -10.776 -6.490 9.052 1.00 0.00 O ATOM 926 CB ARG A 57 -7.566 -5.968 9.875 1.00 0.00 C ATOM 927 CG ARG A 57 -7.517 -6.629 8.504 1.00 0.00 C ATOM 928 CD ARG A 57 -7.901 -5.662 7.392 1.00 0.00 C ATOM 929 NE ARG A 57 -7.399 -4.309 7.627 1.00 0.00 N ATOM 930 CZ ARG A 57 -6.161 -3.915 7.340 1.00 0.00 C ATOM 931 NH1 ARG A 57 -5.291 -4.767 6.813 1.00 0.00 N ATOM 932 NH2 ARG A 57 -5.792 -2.665 7.582 1.00 0.00 N ATOM 0 H ARG A 57 -9.733 -7.922 10.573 1.00 0.00 H new ATOM 0 HA ARG A 57 -8.969 -5.207 11.306 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.224 -4.937 9.781 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -6.865 -6.477 10.536 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -6.513 -7.012 8.321 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -8.192 -7.485 8.490 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -7.511 -6.031 6.444 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -8.987 -5.632 7.300 1.00 0.00 H new ATOM 0 HE ARG A 57 -8.037 -3.626 8.036 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -5.570 -5.730 6.626 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.343 -4.459 6.595 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -6.457 -2.006 7.988 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -4.843 -2.362 7.362 1.00 0.00 H new ATOM 946 N THR A 58 -10.123 -4.339 9.159 1.00 0.00 N ATOM 947 CA THR A 58 -11.112 -3.875 8.192 1.00 0.00 C ATOM 948 C THR A 58 -10.504 -3.804 6.796 1.00 0.00 C ATOM 949 O THR A 58 -9.505 -3.119 6.578 1.00 0.00 O ATOM 950 CB THR A 58 -11.653 -2.504 8.597 1.00 0.00 C ATOM 951 OG1 THR A 58 -11.810 -2.421 10.003 1.00 0.00 O ATOM 952 CG2 THR A 58 -12.990 -2.177 7.967 1.00 0.00 C ATOM 0 H THR A 58 -9.519 -3.605 9.529 1.00 0.00 H new ATOM 0 HA THR A 58 -11.936 -4.588 8.178 1.00 0.00 H new ATOM 0 HB THR A 58 -10.915 -1.786 8.238 1.00 0.00 H new ATOM 0 HG1 THR A 58 -11.868 -1.480 10.271 1.00 0.00 H new ATOM 0 HG21 THR A 58 -13.316 -1.190 8.297 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.892 -2.183 6.881 1.00 0.00 H new ATOM 0 HG23 THR A 58 -13.726 -2.922 8.269 1.00 0.00 H new ATOM 960 N ASN A 59 -11.105 -4.526 5.855 1.00 0.00 N ATOM 961 CA ASN A 59 -10.610 -4.553 4.484 1.00 0.00 C ATOM 962 C ASN A 59 -11.404 -3.617 3.581 1.00 0.00 C ATOM 963 O ASN A 59 -12.609 -3.433 3.757 1.00 0.00 O ATOM 964 CB ASN A 59 -10.671 -5.975 3.927 1.00 0.00 C ATOM 965 CG ASN A 59 -9.621 -6.879 4.538 1.00 0.00 C ATOM 966 OD1 ASN A 59 -8.704 -7.336 3.856 1.00 0.00 O ATOM 967 ND2 ASN A 59 -9.752 -7.144 5.832 1.00 0.00 N ATOM 0 H ASN A 59 -11.933 -5.099 6.017 1.00 0.00 H new ATOM 0 HA ASN A 59 -9.575 -4.211 4.503 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -11.660 -6.393 4.114 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -10.536 -5.945 2.846 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -9.076 -7.748 6.300 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -10.528 -6.743 6.359 1.00 0.00 H new ATOM 974 N VAL A 60 -10.714 -3.041 2.604 1.00 0.00 N ATOM 975 CA VAL A 60 -11.335 -2.135 1.649 1.00 0.00 C ATOM 976 C VAL A 60 -10.865 -2.464 0.235 1.00 0.00 C ATOM 977 O VAL A 60 -9.665 -2.535 -0.030 1.00 0.00 O ATOM 978 CB VAL A 60 -11.014 -0.660 1.974 1.00 0.00 C ATOM 979 CG1 VAL A 60 -11.558 0.266 0.896 1.00 0.00 C ATOM 980 CG2 VAL A 60 -11.572 -0.282 3.338 1.00 0.00 C ATOM 0 H VAL A 60 -9.716 -3.188 2.453 1.00 0.00 H new ATOM 0 HA VAL A 60 -12.415 -2.269 1.718 1.00 0.00 H new ATOM 0 HB VAL A 60 -9.930 -0.546 2.000 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -11.319 1.299 1.149 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -11.106 0.013 -0.063 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -12.640 0.150 0.829 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -11.337 0.761 3.551 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -12.654 -0.417 3.339 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -11.126 -0.918 4.103 1.00 0.00 H new ATOM 990 N VAL A 61 -11.816 -2.677 -0.666 1.00 0.00 N ATOM 991 CA VAL A 61 -11.499 -3.013 -2.048 1.00 0.00 C ATOM 992 C VAL A 61 -11.793 -1.847 -2.986 1.00 0.00 C ATOM 993 O VAL A 61 -12.775 -1.125 -2.810 1.00 0.00 O ATOM 994 CB VAL A 61 -12.293 -4.252 -2.513 1.00 0.00 C ATOM 995 CG1 VAL A 61 -12.004 -4.569 -3.973 1.00 0.00 C ATOM 996 CG2 VAL A 61 -11.974 -5.448 -1.629 1.00 0.00 C ATOM 0 H VAL A 61 -12.814 -2.623 -0.464 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.432 -3.235 -2.085 1.00 0.00 H new ATOM 0 HB VAL A 61 -13.356 -4.029 -2.423 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -12.576 -5.446 -4.275 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -12.289 -3.719 -4.593 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -10.940 -4.769 -4.098 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -12.542 -6.314 -1.970 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -10.908 -5.668 -1.685 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.244 -5.220 -0.598 1.00 0.00 H new ATOM 1006 N LEU A 62 -10.936 -1.678 -3.987 1.00 0.00 N ATOM 1007 CA LEU A 62 -11.098 -0.609 -4.962 1.00 0.00 C ATOM 1008 C LEU A 62 -11.185 -1.177 -6.374 1.00 0.00 C ATOM 1009 O LEU A 62 -10.171 -1.527 -6.981 1.00 0.00 O ATOM 1010 CB LEU A 62 -9.937 0.383 -4.868 1.00 0.00 C ATOM 1011 CG LEU A 62 -10.116 1.668 -5.680 1.00 0.00 C ATOM 1012 CD1 LEU A 62 -11.405 2.375 -5.286 1.00 0.00 C ATOM 1013 CD2 LEU A 62 -8.920 2.588 -5.488 1.00 0.00 C ATOM 0 H LEU A 62 -10.120 -2.270 -4.144 1.00 0.00 H new ATOM 0 HA LEU A 62 -12.027 -0.085 -4.739 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -9.791 0.650 -3.821 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -9.026 -0.115 -5.200 1.00 0.00 H new ATOM 0 HG LEU A 62 -10.181 1.403 -6.735 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -11.515 3.286 -5.874 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -12.253 1.717 -5.475 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -11.372 2.629 -4.226 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -9.063 3.497 -6.072 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -8.825 2.846 -4.433 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -8.014 2.081 -5.821 1.00 0.00 H new ATOM 1025 N THR A 63 -12.405 -1.258 -6.890 1.00 0.00 N ATOM 1026 CA THR A 63 -12.644 -1.771 -8.232 1.00 0.00 C ATOM 1027 C THR A 63 -13.532 -0.808 -9.018 1.00 0.00 C ATOM 1028 O THR A 63 -14.423 -0.174 -8.454 1.00 0.00 O ATOM 1029 CB THR A 63 -13.298 -3.153 -8.157 1.00 0.00 C ATOM 1030 OG1 THR A 63 -13.435 -3.721 -9.449 1.00 0.00 O ATOM 1031 CG2 THR A 63 -14.671 -3.129 -7.519 1.00 0.00 C ATOM 0 H THR A 63 -13.250 -0.973 -6.395 1.00 0.00 H new ATOM 0 HA THR A 63 -11.688 -1.861 -8.748 1.00 0.00 H new ATOM 0 HB THR A 63 -12.633 -3.751 -7.535 1.00 0.00 H new ATOM 0 HG1 THR A 63 -14.210 -4.320 -9.462 1.00 0.00 H new ATOM 0 HG21 THR A 63 -15.079 -4.139 -7.496 1.00 0.00 H new ATOM 0 HG22 THR A 63 -14.593 -2.746 -6.501 1.00 0.00 H new ATOM 0 HG23 THR A 63 -15.331 -2.484 -8.099 1.00 0.00 H new ATOM 1039 N HIS A 64 -13.283 -0.697 -10.320 1.00 0.00 N ATOM 1040 CA HIS A 64 -14.063 0.197 -11.171 1.00 0.00 C ATOM 1041 C HIS A 64 -15.505 -0.286 -11.304 1.00 0.00 C ATOM 1042 O HIS A 64 -16.429 0.517 -11.427 1.00 0.00 O ATOM 1043 CB HIS A 64 -13.423 0.310 -12.556 1.00 0.00 C ATOM 1044 CG HIS A 64 -12.378 1.378 -12.646 1.00 0.00 C ATOM 1045 ND1 HIS A 64 -11.114 1.342 -13.131 1.00 0.00 N flip ATOM 1046 CD2 HIS A 64 -12.580 2.669 -12.204 1.00 0.00 C flip ATOM 1047 CE1 HIS A 64 -10.582 2.598 -12.975 1.00 0.00 C flip ATOM 1048 NE2 HIS A 64 -11.486 3.380 -12.414 1.00 0.00 N flip ATOM 0 H HIS A 64 -12.550 -1.213 -10.807 1.00 0.00 H new ATOM 0 HA HIS A 64 -14.072 1.180 -10.700 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -12.975 -0.648 -12.820 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -14.201 0.512 -13.292 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -13.490 3.041 -11.756 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -9.586 2.898 -13.264 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -11.361 4.365 -12.182 1.00 0.00 H new ATOM 1057 N GLN A 65 -15.690 -1.603 -11.282 1.00 0.00 N ATOM 1058 CA GLN A 65 -17.020 -2.194 -11.403 1.00 0.00 C ATOM 1059 C GLN A 65 -18.001 -1.528 -10.445 1.00 0.00 C ATOM 1060 O GLN A 65 -17.708 -1.357 -9.262 1.00 0.00 O ATOM 1061 CB GLN A 65 -16.960 -3.698 -11.130 1.00 0.00 C ATOM 1062 CG GLN A 65 -16.667 -4.530 -12.368 1.00 0.00 C ATOM 1063 CD GLN A 65 -15.707 -5.670 -12.090 1.00 0.00 C ATOM 1064 OE1 GLN A 65 -14.478 -5.332 -11.720 1.00 0.00 O flip ATOM 1065 NE2 GLN A 65 -16.067 -6.842 -12.207 1.00 0.00 N flip ATOM 0 H GLN A 65 -14.935 -2.282 -11.181 1.00 0.00 H new ATOM 0 HA GLN A 65 -17.371 -2.032 -12.422 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -16.192 -3.893 -10.382 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -17.910 -4.019 -10.703 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -17.601 -4.933 -12.760 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -16.248 -3.887 -13.142 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -17.022 -7.056 -12.494 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -15.410 -7.599 -12.017 1.00 0.00 H new ATOM 1074 N GLU A 66 -19.164 -1.153 -10.965 1.00 0.00 N ATOM 1075 CA GLU A 66 -20.188 -0.503 -10.157 1.00 0.00 C ATOM 1076 C GLU A 66 -21.015 -1.527 -9.386 1.00 0.00 C ATOM 1077 O GLU A 66 -21.436 -1.275 -8.257 1.00 0.00 O ATOM 1078 CB GLU A 66 -21.104 0.344 -11.043 1.00 0.00 C ATOM 1079 CG GLU A 66 -21.868 -0.466 -12.077 1.00 0.00 C ATOM 1080 CD GLU A 66 -22.009 0.262 -13.399 1.00 0.00 C ATOM 1081 OE1 GLU A 66 -21.056 0.968 -13.792 1.00 0.00 O ATOM 1082 OE2 GLU A 66 -23.071 0.126 -14.042 1.00 0.00 O ATOM 0 H GLU A 66 -19.421 -1.288 -11.943 1.00 0.00 H new ATOM 0 HA GLU A 66 -19.686 0.143 -9.437 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -21.816 0.876 -10.412 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -20.506 1.098 -11.554 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -21.356 -1.414 -12.241 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -22.859 -0.702 -11.689 1.00 0.00 H new ATOM 1089 N ASP A 67 -21.254 -2.677 -10.007 1.00 0.00 N ATOM 1090 CA ASP A 67 -22.044 -3.732 -9.381 1.00 0.00 C ATOM 1091 C ASP A 67 -21.159 -4.792 -8.728 1.00 0.00 C ATOM 1092 O ASP A 67 -21.601 -5.917 -8.494 1.00 0.00 O ATOM 1093 CB ASP A 67 -22.961 -4.387 -10.415 1.00 0.00 C ATOM 1094 CG ASP A 67 -24.350 -4.654 -9.869 1.00 0.00 C ATOM 1095 OD1 ASP A 67 -24.478 -5.502 -8.962 1.00 0.00 O ATOM 1096 OD2 ASP A 67 -25.310 -4.014 -10.349 1.00 0.00 O ATOM 0 H ASP A 67 -20.913 -2.902 -10.941 1.00 0.00 H new ATOM 0 HA ASP A 67 -22.646 -3.271 -8.598 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -23.036 -3.742 -11.291 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -22.517 -5.326 -10.747 1.00 0.00 H new ATOM 1101 N TYR A 68 -19.913 -4.434 -8.428 1.00 0.00 N ATOM 1102 CA TYR A 68 -18.990 -5.371 -7.796 1.00 0.00 C ATOM 1103 C TYR A 68 -19.411 -5.653 -6.357 1.00 0.00 C ATOM 1104 O TYR A 68 -19.853 -4.754 -5.643 1.00 0.00 O ATOM 1105 CB TYR A 68 -17.564 -4.820 -7.821 1.00 0.00 C ATOM 1106 CG TYR A 68 -16.529 -5.806 -7.329 1.00 0.00 C ATOM 1107 CD1 TYR A 68 -16.207 -6.935 -8.072 1.00 0.00 C ATOM 1108 CD2 TYR A 68 -15.874 -5.609 -6.119 1.00 0.00 C ATOM 1109 CE1 TYR A 68 -15.263 -7.839 -7.624 1.00 0.00 C ATOM 1110 CE2 TYR A 68 -14.928 -6.508 -5.665 1.00 0.00 C ATOM 1111 CZ TYR A 68 -14.627 -7.621 -6.421 1.00 0.00 C ATOM 1112 OH TYR A 68 -13.687 -8.520 -5.971 1.00 0.00 O ATOM 0 H TYR A 68 -19.522 -3.510 -8.611 1.00 0.00 H new ATOM 0 HA TYR A 68 -19.018 -6.304 -8.359 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -17.316 -4.522 -8.840 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -17.519 -3.921 -7.206 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -16.703 -7.109 -9.016 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.108 -4.739 -5.524 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -15.025 -8.712 -8.214 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -14.427 -6.340 -4.723 1.00 0.00 H new ATOM 0 HH TYR A 68 -12.793 -8.217 -6.233 1.00 0.00 H new ATOM 1122 N GLN A 69 -19.272 -6.908 -5.938 1.00 0.00 N ATOM 1123 CA GLN A 69 -19.642 -7.304 -4.584 1.00 0.00 C ATOM 1124 C GLN A 69 -18.469 -7.965 -3.865 1.00 0.00 C ATOM 1125 O GLN A 69 -18.141 -9.123 -4.124 1.00 0.00 O ATOM 1126 CB GLN A 69 -20.838 -8.256 -4.617 1.00 0.00 C ATOM 1127 CG GLN A 69 -22.158 -7.565 -4.919 1.00 0.00 C ATOM 1128 CD GLN A 69 -22.422 -6.385 -4.003 1.00 0.00 C ATOM 1129 OE1 GLN A 69 -22.601 -6.549 -2.797 1.00 0.00 O ATOM 1130 NE2 GLN A 69 -22.448 -5.187 -4.575 1.00 0.00 N ATOM 0 H GLN A 69 -18.907 -7.666 -6.515 1.00 0.00 H new ATOM 0 HA GLN A 69 -19.917 -6.404 -4.034 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -20.659 -9.024 -5.369 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -20.915 -8.763 -3.655 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -22.156 -7.223 -5.954 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -22.971 -8.285 -4.822 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -22.294 -5.098 -5.579 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -22.622 -4.356 -4.010 1.00 0.00 H new ATOM 1139 N ALA A 70 -17.846 -7.219 -2.959 1.00 0.00 N ATOM 1140 CA ALA A 70 -16.712 -7.726 -2.196 1.00 0.00 C ATOM 1141 C ALA A 70 -17.129 -8.075 -0.773 1.00 0.00 C ATOM 1142 O ALA A 70 -17.220 -7.203 0.092 1.00 0.00 O ATOM 1143 CB ALA A 70 -15.582 -6.708 -2.183 1.00 0.00 C ATOM 0 H ALA A 70 -18.108 -6.259 -2.735 1.00 0.00 H new ATOM 0 HA ALA A 70 -16.356 -8.635 -2.680 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -14.743 -7.103 -1.609 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -15.260 -6.508 -3.205 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -15.931 -5.782 -1.725 1.00 0.00 H new ATOM 1149 N GLN A 71 -17.383 -9.356 -0.539 1.00 0.00 N ATOM 1150 CA GLN A 71 -17.795 -9.828 0.775 1.00 0.00 C ATOM 1151 C GLN A 71 -16.642 -9.753 1.766 1.00 0.00 C ATOM 1152 O GLN A 71 -15.571 -10.314 1.533 1.00 0.00 O ATOM 1153 CB GLN A 71 -18.311 -11.265 0.685 1.00 0.00 C ATOM 1154 CG GLN A 71 -19.530 -11.420 -0.212 1.00 0.00 C ATOM 1155 CD GLN A 71 -19.402 -12.582 -1.177 1.00 0.00 C ATOM 1156 OE1 GLN A 71 -19.835 -13.697 -0.885 1.00 0.00 O ATOM 1157 NE2 GLN A 71 -18.803 -12.327 -2.335 1.00 0.00 N ATOM 0 H GLN A 71 -17.310 -10.088 -1.245 1.00 0.00 H new ATOM 0 HA GLN A 71 -18.598 -9.182 1.130 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -17.512 -11.906 0.312 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -18.560 -11.616 1.686 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -20.416 -11.563 0.407 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -19.680 -10.499 -0.776 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -18.459 -11.388 -2.535 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -18.687 -13.070 -3.024 1.00 0.00 H new ATOM 1166 N GLY A 72 -16.869 -9.060 2.875 1.00 0.00 N ATOM 1167 CA GLY A 72 -15.842 -8.930 3.888 1.00 0.00 C ATOM 1168 C GLY A 72 -15.166 -7.573 3.877 1.00 0.00 C ATOM 1169 O GLY A 72 -14.690 -7.109 4.914 1.00 0.00 O ATOM 0 H GLY A 72 -17.746 -8.586 3.090 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -16.284 -9.101 4.869 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -15.091 -9.705 3.737 1.00 0.00 H new ATOM 1173 N ALA A 73 -15.112 -6.929 2.712 1.00 0.00 N ATOM 1174 CA ALA A 73 -14.475 -5.620 2.602 1.00 0.00 C ATOM 1175 C ALA A 73 -15.402 -4.598 1.948 1.00 0.00 C ATOM 1176 O ALA A 73 -16.447 -4.952 1.402 1.00 0.00 O ATOM 1177 CB ALA A 73 -13.178 -5.734 1.816 1.00 0.00 C ATOM 0 H ALA A 73 -15.498 -7.289 1.839 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.254 -5.270 3.610 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -12.711 -4.752 1.740 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -12.502 -6.419 2.328 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.390 -6.113 0.816 1.00 0.00 H new ATOM 1183 N VAL A 74 -15.008 -3.327 2.007 1.00 0.00 N ATOM 1184 CA VAL A 74 -15.799 -2.247 1.419 1.00 0.00 C ATOM 1185 C VAL A 74 -15.506 -2.111 -0.071 1.00 0.00 C ATOM 1186 O VAL A 74 -14.360 -2.226 -0.499 1.00 0.00 O ATOM 1187 CB VAL A 74 -15.521 -0.893 2.105 1.00 0.00 C ATOM 1188 CG1 VAL A 74 -16.706 0.044 1.932 1.00 0.00 C ATOM 1189 CG2 VAL A 74 -15.199 -1.087 3.581 1.00 0.00 C ATOM 0 H VAL A 74 -14.145 -3.020 2.456 1.00 0.00 H new ATOM 0 HA VAL A 74 -16.847 -2.509 1.569 1.00 0.00 H new ATOM 0 HB VAL A 74 -14.651 -0.441 1.628 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -16.493 0.994 2.422 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -16.883 0.215 0.870 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -17.593 -0.404 2.380 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -15.007 -0.118 4.042 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -16.044 -1.564 4.078 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -14.316 -1.718 3.681 1.00 0.00 H new ATOM 1199 N VAL A 75 -16.549 -1.880 -0.860 1.00 0.00 N ATOM 1200 CA VAL A 75 -16.390 -1.748 -2.304 1.00 0.00 C ATOM 1201 C VAL A 75 -16.668 -0.329 -2.791 1.00 0.00 C ATOM 1202 O VAL A 75 -17.707 0.257 -2.485 1.00 0.00 O ATOM 1203 CB VAL A 75 -17.309 -2.728 -3.057 1.00 0.00 C ATOM 1204 CG1 VAL A 75 -17.093 -2.624 -4.561 1.00 0.00 C ATOM 1205 CG2 VAL A 75 -17.072 -4.150 -2.576 1.00 0.00 C ATOM 0 H VAL A 75 -17.508 -1.781 -0.527 1.00 0.00 H new ATOM 0 HA VAL A 75 -15.348 -1.986 -2.517 1.00 0.00 H new ATOM 0 HB VAL A 75 -18.344 -2.461 -2.846 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -17.752 -3.325 -5.073 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -17.316 -1.609 -4.891 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -16.056 -2.863 -4.797 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -17.729 -4.831 -3.117 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -16.033 -4.427 -2.757 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -17.284 -4.213 -1.509 1.00 0.00 H new ATOM 1215 N VAL A 76 -15.733 0.199 -3.573 1.00 0.00 N ATOM 1216 CA VAL A 76 -15.857 1.535 -4.144 1.00 0.00 C ATOM 1217 C VAL A 76 -15.281 1.548 -5.557 1.00 0.00 C ATOM 1218 O VAL A 76 -14.731 0.546 -6.012 1.00 0.00 O ATOM 1219 CB VAL A 76 -15.148 2.598 -3.283 1.00 0.00 C ATOM 1220 CG1 VAL A 76 -15.746 2.639 -1.885 1.00 0.00 C ATOM 1221 CG2 VAL A 76 -13.650 2.337 -3.222 1.00 0.00 C ATOM 0 H VAL A 76 -14.872 -0.284 -3.828 1.00 0.00 H new ATOM 0 HA VAL A 76 -16.918 1.785 -4.172 1.00 0.00 H new ATOM 0 HB VAL A 76 -15.301 3.571 -3.750 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -15.232 3.396 -1.292 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -16.806 2.886 -1.950 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -15.629 1.665 -1.410 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -13.172 3.101 -2.608 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -13.469 1.355 -2.785 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -13.234 2.368 -4.229 1.00 0.00 H new ATOM 1231 N HIS A 77 -15.422 2.667 -6.259 1.00 0.00 N ATOM 1232 CA HIS A 77 -14.918 2.755 -7.630 1.00 0.00 C ATOM 1233 C HIS A 77 -14.197 4.075 -7.907 1.00 0.00 C ATOM 1234 O HIS A 77 -13.478 4.192 -8.899 1.00 0.00 O ATOM 1235 CB HIS A 77 -16.066 2.567 -8.628 1.00 0.00 C ATOM 1236 CG HIS A 77 -17.228 1.802 -8.071 1.00 0.00 C ATOM 1237 ND1 HIS A 77 -17.100 0.554 -7.498 1.00 0.00 N ATOM 1238 CD2 HIS A 77 -18.542 2.119 -7.987 1.00 0.00 C ATOM 1239 CE1 HIS A 77 -18.284 0.136 -7.087 1.00 0.00 C ATOM 1240 NE2 HIS A 77 -19.176 1.068 -7.371 1.00 0.00 N ATOM 0 H HIS A 77 -15.873 3.514 -5.912 1.00 0.00 H new ATOM 0 HA HIS A 77 -14.187 1.956 -7.753 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -16.412 3.546 -8.959 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -15.689 2.047 -9.509 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -16.227 0.035 -7.406 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -19.005 3.029 -8.339 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -18.488 -0.807 -6.602 1.00 0.00 H new ATOM 1249 N ASP A 78 -14.395 5.074 -7.051 1.00 0.00 N ATOM 1250 CA ASP A 78 -13.757 6.372 -7.250 1.00 0.00 C ATOM 1251 C ASP A 78 -13.059 6.850 -5.981 1.00 0.00 C ATOM 1252 O ASP A 78 -13.421 6.453 -4.873 1.00 0.00 O ATOM 1253 CB ASP A 78 -14.793 7.407 -7.694 1.00 0.00 C ATOM 1254 CG ASP A 78 -14.854 7.552 -9.202 1.00 0.00 C ATOM 1255 OD1 ASP A 78 -14.725 6.526 -9.903 1.00 0.00 O ATOM 1256 OD2 ASP A 78 -15.031 8.691 -9.682 1.00 0.00 O ATOM 0 H ASP A 78 -14.985 5.012 -6.222 1.00 0.00 H new ATOM 0 HA ASP A 78 -13.003 6.256 -8.029 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -15.775 7.118 -7.319 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -14.553 8.372 -7.248 1.00 0.00 H new ATOM 1261 N VAL A 79 -12.059 7.711 -6.153 1.00 0.00 N ATOM 1262 CA VAL A 79 -11.313 8.251 -5.033 1.00 0.00 C ATOM 1263 C VAL A 79 -12.216 9.074 -4.125 1.00 0.00 C ATOM 1264 O VAL A 79 -12.083 9.042 -2.902 1.00 0.00 O ATOM 1265 CB VAL A 79 -10.140 9.125 -5.513 1.00 0.00 C ATOM 1266 CG1 VAL A 79 -8.947 8.262 -5.893 1.00 0.00 C ATOM 1267 CG2 VAL A 79 -10.557 10.013 -6.678 1.00 0.00 C ATOM 0 H VAL A 79 -11.750 8.048 -7.065 1.00 0.00 H new ATOM 0 HA VAL A 79 -10.916 7.405 -4.472 1.00 0.00 H new ATOM 0 HB VAL A 79 -9.845 9.773 -4.688 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -8.129 8.899 -6.229 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -8.624 7.685 -5.026 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -9.231 7.582 -6.696 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -9.708 10.619 -6.996 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -10.890 9.391 -7.509 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -11.372 10.666 -6.364 1.00 0.00 H new ATOM 1277 N ALA A 80 -13.142 9.804 -4.734 1.00 0.00 N ATOM 1278 CA ALA A 80 -14.079 10.629 -3.984 1.00 0.00 C ATOM 1279 C ALA A 80 -15.021 9.755 -3.167 1.00 0.00 C ATOM 1280 O ALA A 80 -15.281 10.029 -1.996 1.00 0.00 O ATOM 1281 CB ALA A 80 -14.866 11.528 -4.925 1.00 0.00 C ATOM 0 H ALA A 80 -13.264 9.841 -5.746 1.00 0.00 H new ATOM 0 HA ALA A 80 -13.513 11.260 -3.298 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -15.562 12.138 -4.349 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -14.179 12.177 -5.468 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -15.422 10.915 -5.634 1.00 0.00 H new ATOM 1287 N ALA A 81 -15.521 8.692 -3.793 1.00 0.00 N ATOM 1288 CA ALA A 81 -16.425 7.766 -3.122 1.00 0.00 C ATOM 1289 C ALA A 81 -15.799 7.253 -1.831 1.00 0.00 C ATOM 1290 O ALA A 81 -16.273 7.553 -0.736 1.00 0.00 O ATOM 1291 CB ALA A 81 -16.770 6.604 -4.041 1.00 0.00 C ATOM 0 H ALA A 81 -15.315 8.452 -4.763 1.00 0.00 H new ATOM 0 HA ALA A 81 -17.344 8.298 -2.874 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -17.446 5.921 -3.526 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -17.254 6.983 -4.941 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -15.858 6.074 -4.315 1.00 0.00 H new ATOM 1297 N VAL A 82 -14.724 6.485 -1.972 1.00 0.00 N ATOM 1298 CA VAL A 82 -14.017 5.934 -0.824 1.00 0.00 C ATOM 1299 C VAL A 82 -13.653 7.037 0.171 1.00 0.00 C ATOM 1300 O VAL A 82 -13.541 6.797 1.373 1.00 0.00 O ATOM 1301 CB VAL A 82 -12.738 5.187 -1.271 1.00 0.00 C ATOM 1302 CG1 VAL A 82 -11.604 6.161 -1.552 1.00 0.00 C ATOM 1303 CG2 VAL A 82 -12.316 4.163 -0.232 1.00 0.00 C ATOM 0 H VAL A 82 -14.323 6.230 -2.874 1.00 0.00 H new ATOM 0 HA VAL A 82 -14.683 5.225 -0.333 1.00 0.00 H new ATOM 0 HB VAL A 82 -12.969 4.660 -2.197 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -10.718 5.608 -1.864 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.902 6.847 -2.345 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -11.378 6.727 -0.648 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -11.415 3.652 -0.570 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -12.115 4.666 0.714 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -13.115 3.435 -0.093 1.00 0.00 H new ATOM 1313 N PHE A 83 -13.474 8.250 -0.339 1.00 0.00 N ATOM 1314 CA PHE A 83 -13.129 9.383 0.507 1.00 0.00 C ATOM 1315 C PHE A 83 -14.260 9.684 1.481 1.00 0.00 C ATOM 1316 O PHE A 83 -14.025 9.886 2.672 1.00 0.00 O ATOM 1317 CB PHE A 83 -12.820 10.615 -0.350 1.00 0.00 C ATOM 1318 CG PHE A 83 -11.360 10.981 -0.396 1.00 0.00 C ATOM 1319 CD1 PHE A 83 -10.376 10.021 -0.211 1.00 0.00 C ATOM 1320 CD2 PHE A 83 -10.974 12.292 -0.628 1.00 0.00 C ATOM 1321 CE1 PHE A 83 -9.037 10.362 -0.255 1.00 0.00 C ATOM 1322 CE2 PHE A 83 -9.637 12.639 -0.674 1.00 0.00 C ATOM 1323 CZ PHE A 83 -8.668 11.673 -0.487 1.00 0.00 C ATOM 0 H PHE A 83 -13.562 8.472 -1.331 1.00 0.00 H new ATOM 0 HA PHE A 83 -12.238 9.127 1.081 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -13.171 10.435 -1.366 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -13.384 11.464 0.036 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -10.659 8.995 -0.030 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -11.727 13.052 -0.775 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -8.281 9.605 -0.108 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -9.350 13.664 -0.856 1.00 0.00 H new ATOM 0 HZ PHE A 83 -7.623 11.942 -0.522 1.00 0.00 H new ATOM 1333 N ALA A 84 -15.490 9.692 0.978 1.00 0.00 N ATOM 1334 CA ALA A 84 -16.644 9.947 1.828 1.00 0.00 C ATOM 1335 C ALA A 84 -16.724 8.883 2.908 1.00 0.00 C ATOM 1336 O ALA A 84 -17.041 9.171 4.062 1.00 0.00 O ATOM 1337 CB ALA A 84 -17.924 9.982 1.006 1.00 0.00 C ATOM 0 H ALA A 84 -15.711 9.527 -0.004 1.00 0.00 H new ATOM 0 HA ALA A 84 -16.528 10.923 2.300 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -18.773 10.174 1.662 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -17.856 10.774 0.260 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -18.062 9.023 0.506 1.00 0.00 H new ATOM 1343 N TYR A 85 -16.398 7.652 2.527 1.00 0.00 N ATOM 1344 CA TYR A 85 -16.396 6.552 3.473 1.00 0.00 C ATOM 1345 C TYR A 85 -15.344 6.839 4.540 1.00 0.00 C ATOM 1346 O TYR A 85 -15.667 6.972 5.719 1.00 0.00 O ATOM 1347 CB TYR A 85 -16.146 5.217 2.750 1.00 0.00 C ATOM 1348 CG TYR A 85 -14.935 4.446 3.227 1.00 0.00 C ATOM 1349 CD1 TYR A 85 -14.903 3.865 4.488 1.00 0.00 C ATOM 1350 CD2 TYR A 85 -13.825 4.299 2.409 1.00 0.00 C ATOM 1351 CE1 TYR A 85 -13.796 3.160 4.919 1.00 0.00 C ATOM 1352 CE2 TYR A 85 -12.714 3.595 2.832 1.00 0.00 C ATOM 1353 CZ TYR A 85 -12.705 3.028 4.087 1.00 0.00 C ATOM 1354 OH TYR A 85 -11.601 2.329 4.513 1.00 0.00 O ATOM 0 H TYR A 85 -16.134 7.396 1.575 1.00 0.00 H new ATOM 0 HA TYR A 85 -17.369 6.462 3.956 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -17.028 4.587 2.868 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -16.035 5.414 1.684 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -15.757 3.966 5.142 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -13.829 4.742 1.424 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -13.785 2.715 5.903 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -11.858 3.490 2.182 1.00 0.00 H new ATOM 0 HH TYR A 85 -10.941 2.288 3.790 1.00 0.00 H new ATOM 1364 N ALA A 86 -14.082 6.938 4.116 1.00 0.00 N ATOM 1365 CA ALA A 86 -12.985 7.218 5.037 1.00 0.00 C ATOM 1366 C ALA A 86 -13.358 8.324 6.018 1.00 0.00 C ATOM 1367 O ALA A 86 -12.972 8.285 7.187 1.00 0.00 O ATOM 1368 CB ALA A 86 -11.725 7.587 4.264 1.00 0.00 C ATOM 0 H ALA A 86 -13.798 6.828 3.143 1.00 0.00 H new ATOM 0 HA ALA A 86 -12.788 6.314 5.614 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -10.916 7.793 4.964 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -11.441 6.759 3.615 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -11.916 8.473 3.659 1.00 0.00 H new ATOM 1374 N LYS A 87 -14.134 9.295 5.548 1.00 0.00 N ATOM 1375 CA LYS A 87 -14.578 10.385 6.404 1.00 0.00 C ATOM 1376 C LYS A 87 -15.591 9.849 7.407 1.00 0.00 C ATOM 1377 O LYS A 87 -15.535 10.153 8.599 1.00 0.00 O ATOM 1378 CB LYS A 87 -15.201 11.503 5.563 1.00 0.00 C ATOM 1379 CG LYS A 87 -14.679 12.888 5.909 1.00 0.00 C ATOM 1380 CD LYS A 87 -13.890 13.493 4.758 1.00 0.00 C ATOM 1381 CE LYS A 87 -12.619 14.173 5.244 1.00 0.00 C ATOM 1382 NZ LYS A 87 -11.395 13.489 4.740 1.00 0.00 N ATOM 0 H LYS A 87 -14.466 9.348 4.585 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.723 10.799 6.938 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -15.008 11.304 4.509 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -16.283 11.488 5.697 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -15.515 13.540 6.160 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -14.045 12.828 6.794 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -13.634 12.712 4.042 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -14.512 14.217 4.231 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -12.615 15.212 4.916 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -12.607 14.183 6.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -10.551 13.983 5.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -11.385 12.504 5.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -11.393 13.502 3.700 1.00 0.00 H new ATOM 1396 N GLN A 88 -16.519 9.050 6.896 1.00 0.00 N ATOM 1397 CA GLN A 88 -17.565 8.456 7.708 1.00 0.00 C ATOM 1398 C GLN A 88 -16.972 7.605 8.829 1.00 0.00 C ATOM 1399 O GLN A 88 -17.633 7.341 9.833 1.00 0.00 O ATOM 1400 CB GLN A 88 -18.474 7.604 6.826 1.00 0.00 C ATOM 1401 CG GLN A 88 -19.451 8.417 5.993 1.00 0.00 C ATOM 1402 CD GLN A 88 -20.857 8.400 6.561 1.00 0.00 C ATOM 1403 OE1 GLN A 88 -21.497 7.350 6.632 1.00 0.00 O ATOM 1404 NE2 GLN A 88 -21.345 9.565 6.967 1.00 0.00 N ATOM 0 H GLN A 88 -16.565 8.798 5.909 1.00 0.00 H new ATOM 0 HA GLN A 88 -18.147 9.256 8.165 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -17.858 7.000 6.160 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -19.034 6.913 7.456 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -19.100 9.447 5.931 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -19.469 8.025 4.976 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -20.779 10.410 6.889 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -22.286 9.616 7.357 1.00 0.00 H new ATOM 1413 N HIS A 89 -15.722 7.183 8.656 1.00 0.00 N ATOM 1414 CA HIS A 89 -15.045 6.371 9.659 1.00 0.00 C ATOM 1415 C HIS A 89 -13.976 7.184 10.390 1.00 0.00 C ATOM 1416 O HIS A 89 -12.781 7.014 10.147 1.00 0.00 O ATOM 1417 CB HIS A 89 -14.409 5.147 8.999 1.00 0.00 C ATOM 1418 CG HIS A 89 -15.249 3.912 9.096 1.00 0.00 C ATOM 1419 ND1 HIS A 89 -15.882 3.519 10.257 1.00 0.00 N ATOM 1420 CD2 HIS A 89 -15.561 2.980 8.166 1.00 0.00 C ATOM 1421 CE1 HIS A 89 -16.546 2.399 10.036 1.00 0.00 C ATOM 1422 NE2 HIS A 89 -16.368 2.051 8.775 1.00 0.00 N ATOM 0 H HIS A 89 -15.159 7.391 7.831 1.00 0.00 H new ATOM 0 HA HIS A 89 -15.785 6.043 10.389 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -14.221 5.367 7.948 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -13.441 4.956 9.463 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -15.236 2.969 7.136 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -17.135 1.859 10.763 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -16.765 1.226 8.326 1.00 0.00 H new ATOM 1431 N PRO A 90 -14.394 8.085 11.298 1.00 0.00 N ATOM 1432 CA PRO A 90 -13.466 8.925 12.063 1.00 0.00 C ATOM 1433 C PRO A 90 -12.731 8.153 13.158 1.00 0.00 C ATOM 1434 O PRO A 90 -11.870 8.704 13.844 1.00 0.00 O ATOM 1435 CB PRO A 90 -14.383 9.979 12.683 1.00 0.00 C ATOM 1436 CG PRO A 90 -15.695 9.290 12.826 1.00 0.00 C ATOM 1437 CD PRO A 90 -15.802 8.357 11.651 1.00 0.00 C ATOM 0 HA PRO A 90 -12.676 9.333 11.432 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -14.005 10.317 13.648 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -14.464 10.860 12.046 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -15.747 8.741 13.766 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -16.515 10.008 12.830 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -16.334 7.442 11.912 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -16.342 8.815 10.823 1.00 0.00 H new ATOM 1445 N ASP A 91 -13.073 6.877 13.320 1.00 0.00 N ATOM 1446 CA ASP A 91 -12.440 6.042 14.334 1.00 0.00 C ATOM 1447 C ASP A 91 -11.345 5.162 13.731 1.00 0.00 C ATOM 1448 O ASP A 91 -10.759 4.330 14.423 1.00 0.00 O ATOM 1449 CB ASP A 91 -13.488 5.168 15.027 1.00 0.00 C ATOM 1450 CG ASP A 91 -14.003 5.790 16.310 1.00 0.00 C ATOM 1451 OD1 ASP A 91 -13.409 5.528 17.377 1.00 0.00 O ATOM 1452 OD2 ASP A 91 -15.000 6.539 16.248 1.00 0.00 O ATOM 0 H ASP A 91 -13.783 6.401 12.763 1.00 0.00 H new ATOM 0 HA ASP A 91 -11.977 6.702 15.067 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -14.323 4.999 14.347 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -13.055 4.192 15.248 1.00 0.00 H new ATOM 1457 N GLN A 92 -11.070 5.348 12.441 1.00 0.00 N ATOM 1458 CA GLN A 92 -10.044 4.566 11.761 1.00 0.00 C ATOM 1459 C GLN A 92 -9.330 5.403 10.705 1.00 0.00 C ATOM 1460 O GLN A 92 -9.812 6.465 10.310 1.00 0.00 O ATOM 1461 CB GLN A 92 -10.664 3.328 11.110 1.00 0.00 C ATOM 1462 CG GLN A 92 -11.145 2.288 12.109 1.00 0.00 C ATOM 1463 CD GLN A 92 -12.253 1.414 11.553 1.00 0.00 C ATOM 1464 OE1 GLN A 92 -12.032 0.617 10.642 1.00 0.00 O ATOM 1465 NE2 GLN A 92 -13.454 1.562 12.099 1.00 0.00 N ATOM 0 H GLN A 92 -11.543 6.031 11.849 1.00 0.00 H new ATOM 0 HA GLN A 92 -9.313 4.251 12.505 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -11.504 3.638 10.488 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -9.929 2.870 10.448 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -10.306 1.659 12.406 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -11.500 2.791 13.008 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -13.592 2.235 12.853 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -14.239 1.002 11.765 1.00 0.00 H new ATOM 1474 N GLU A 93 -8.179 4.917 10.250 1.00 0.00 N ATOM 1475 CA GLU A 93 -7.398 5.618 9.237 1.00 0.00 C ATOM 1476 C GLU A 93 -7.315 4.797 7.953 1.00 0.00 C ATOM 1477 O GLU A 93 -7.550 3.589 7.962 1.00 0.00 O ATOM 1478 CB GLU A 93 -5.991 5.912 9.760 1.00 0.00 C ATOM 1479 CG GLU A 93 -5.874 7.253 10.468 1.00 0.00 C ATOM 1480 CD GLU A 93 -5.740 7.109 11.972 1.00 0.00 C ATOM 1481 OE1 GLU A 93 -4.609 6.872 12.447 1.00 0.00 O ATOM 1482 OE2 GLU A 93 -6.765 7.234 12.674 1.00 0.00 O ATOM 0 H GLU A 93 -7.766 4.040 10.567 1.00 0.00 H new ATOM 0 HA GLU A 93 -7.898 6.560 9.014 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -5.695 5.120 10.448 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -5.290 5.888 8.926 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -5.009 7.790 10.080 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -6.753 7.857 10.241 1.00 0.00 H new ATOM 1489 N LEU A 94 -6.981 5.460 6.851 1.00 0.00 N ATOM 1490 CA LEU A 94 -6.872 4.789 5.561 1.00 0.00 C ATOM 1491 C LEU A 94 -5.413 4.510 5.210 1.00 0.00 C ATOM 1492 O LEU A 94 -4.557 5.387 5.327 1.00 0.00 O ATOM 1493 CB LEU A 94 -7.523 5.638 4.465 1.00 0.00 C ATOM 1494 CG LEU A 94 -8.643 4.944 3.689 1.00 0.00 C ATOM 1495 CD1 LEU A 94 -9.804 4.612 4.613 1.00 0.00 C ATOM 1496 CD2 LEU A 94 -9.110 5.817 2.534 1.00 0.00 C ATOM 0 H LEU A 94 -6.781 6.460 6.825 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.395 3.835 5.631 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.924 6.545 4.919 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.751 5.948 3.760 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.254 4.012 3.279 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -10.592 4.119 4.044 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -9.459 3.949 5.406 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -10.194 5.530 5.052 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.907 5.308 1.992 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.483 6.765 2.922 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -8.275 6.004 1.859 1.00 0.00 H new ATOM 1508 N VAL A 95 -5.139 3.283 4.779 1.00 0.00 N ATOM 1509 CA VAL A 95 -3.785 2.887 4.411 1.00 0.00 C ATOM 1510 C VAL A 95 -3.783 2.060 3.129 1.00 0.00 C ATOM 1511 O VAL A 95 -4.338 0.962 3.085 1.00 0.00 O ATOM 1512 CB VAL A 95 -3.112 2.076 5.533 1.00 0.00 C ATOM 1513 CG1 VAL A 95 -1.639 1.856 5.224 1.00 0.00 C ATOM 1514 CG2 VAL A 95 -3.285 2.774 6.874 1.00 0.00 C ATOM 0 H VAL A 95 -5.837 2.546 4.676 1.00 0.00 H new ATOM 0 HA VAL A 95 -3.220 3.805 4.249 1.00 0.00 H new ATOM 0 HB VAL A 95 -3.596 1.101 5.592 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -1.180 1.281 6.028 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -1.542 1.309 4.286 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -1.138 2.820 5.136 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.803 2.186 7.655 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -2.829 3.763 6.831 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -4.347 2.873 7.098 1.00 0.00 H new ATOM 1524 N ILE A 96 -3.151 2.594 2.089 1.00 0.00 N ATOM 1525 CA ILE A 96 -3.072 1.906 0.805 1.00 0.00 C ATOM 1526 C ILE A 96 -1.954 0.870 0.813 1.00 0.00 C ATOM 1527 O ILE A 96 -0.810 1.179 1.148 1.00 0.00 O ATOM 1528 CB ILE A 96 -2.831 2.891 -0.360 1.00 0.00 C ATOM 1529 CG1 ILE A 96 -3.549 4.222 -0.109 1.00 0.00 C ATOM 1530 CG2 ILE A 96 -3.293 2.278 -1.673 1.00 0.00 C ATOM 1531 CD1 ILE A 96 -5.025 4.071 0.196 1.00 0.00 C ATOM 0 H ILE A 96 -2.686 3.501 2.110 1.00 0.00 H new ATOM 0 HA ILE A 96 -4.032 1.412 0.654 1.00 0.00 H new ATOM 0 HB ILE A 96 -1.761 3.090 -0.423 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.066 4.734 0.723 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.432 4.859 -0.986 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.117 2.983 -2.485 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -2.736 1.360 -1.862 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.357 2.051 -1.614 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.465 5.054 0.362 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.523 3.588 -0.645 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.151 3.461 1.091 1.00 0.00 H new ATOM 1543 N ALA A 97 -2.290 -0.363 0.448 1.00 0.00 N ATOM 1544 CA ALA A 97 -1.312 -1.443 0.418 1.00 0.00 C ATOM 1545 C ALA A 97 -1.034 -1.903 -1.011 1.00 0.00 C ATOM 1546 O ALA A 97 0.042 -2.423 -1.305 1.00 0.00 O ATOM 1547 CB ALA A 97 -1.795 -2.612 1.265 1.00 0.00 C ATOM 0 H ALA A 97 -3.232 -0.638 0.169 1.00 0.00 H new ATOM 0 HA ALA A 97 -0.379 -1.063 0.834 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -1.056 -3.413 1.235 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -1.932 -2.283 2.295 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -2.743 -2.978 0.872 1.00 0.00 H new ATOM 1553 N GLY A 98 -2.009 -1.712 -1.894 1.00 0.00 N ATOM 1554 CA GLY A 98 -1.844 -2.118 -3.278 1.00 0.00 C ATOM 1555 C GLY A 98 -3.144 -2.051 -4.061 1.00 0.00 C ATOM 1556 O GLY A 98 -4.188 -1.730 -3.494 1.00 0.00 O ATOM 0 H GLY A 98 -2.909 -1.284 -1.677 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -1.102 -1.478 -3.755 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.455 -3.136 -3.311 1.00 0.00 H new ATOM 1560 N GLY A 99 -3.072 -2.217 -5.387 1.00 0.00 N ATOM 1561 CA GLY A 99 -1.803 -2.454 -6.058 1.00 0.00 C ATOM 1562 C GLY A 99 -1.101 -1.168 -6.450 1.00 0.00 C ATOM 1563 O GLY A 99 -1.375 -0.107 -5.889 1.00 0.00 O ATOM 0 H GLY A 99 -3.880 -2.190 -6.009 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -1.153 -3.033 -5.403 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -1.975 -3.056 -6.950 1.00 0.00 H new ATOM 1567 N ALA A 100 -0.193 -1.265 -7.416 1.00 0.00 N ATOM 1568 CA ALA A 100 0.554 -0.103 -7.884 1.00 0.00 C ATOM 1569 C ALA A 100 -0.369 0.924 -8.531 1.00 0.00 C ATOM 1570 O ALA A 100 -0.159 2.130 -8.401 1.00 0.00 O ATOM 1571 CB ALA A 100 1.635 -0.534 -8.864 1.00 0.00 C ATOM 0 H ALA A 100 0.043 -2.137 -7.890 1.00 0.00 H new ATOM 0 HA ALA A 100 1.024 0.367 -7.020 1.00 0.00 H new ATOM 0 HB1 ALA A 100 2.186 0.342 -9.206 1.00 0.00 H new ATOM 0 HB2 ALA A 100 2.320 -1.223 -8.370 1.00 0.00 H new ATOM 0 HB3 ALA A 100 1.175 -1.030 -9.719 1.00 0.00 H new ATOM 1577 N GLN A 101 -1.392 0.439 -9.228 1.00 0.00 N ATOM 1578 CA GLN A 101 -2.345 1.319 -9.894 1.00 0.00 C ATOM 1579 C GLN A 101 -3.143 2.123 -8.872 1.00 0.00 C ATOM 1580 O GLN A 101 -3.511 3.272 -9.121 1.00 0.00 O ATOM 1581 CB GLN A 101 -3.291 0.505 -10.780 1.00 0.00 C ATOM 1582 CG GLN A 101 -3.059 0.713 -12.267 1.00 0.00 C ATOM 1583 CD GLN A 101 -3.473 2.095 -12.734 1.00 0.00 C ATOM 1584 OE1 GLN A 101 -4.758 2.404 -12.599 1.00 0.00 O flip ATOM 1585 NE2 GLN A 101 -2.649 2.876 -13.210 1.00 0.00 N flip ATOM 0 H GLN A 101 -1.582 -0.556 -9.346 1.00 0.00 H new ATOM 0 HA GLN A 101 -1.787 2.015 -10.521 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.174 -0.553 -10.547 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -4.320 0.772 -10.540 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -2.004 0.559 -12.491 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -3.617 -0.038 -12.827 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -1.672 2.597 -13.295 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -2.944 3.802 -13.519 1.00 0.00 H new ATOM 1594 N ILE A 102 -3.402 1.513 -7.721 1.00 0.00 N ATOM 1595 CA ILE A 102 -4.152 2.176 -6.663 1.00 0.00 C ATOM 1596 C ILE A 102 -3.364 3.350 -6.099 1.00 0.00 C ATOM 1597 O ILE A 102 -3.930 4.398 -5.786 1.00 0.00 O ATOM 1598 CB ILE A 102 -4.499 1.205 -5.517 1.00 0.00 C ATOM 1599 CG1 ILE A 102 -5.067 -0.101 -6.075 1.00 0.00 C ATOM 1600 CG2 ILE A 102 -5.490 1.851 -4.563 1.00 0.00 C ATOM 1601 CD1 ILE A 102 -6.324 0.090 -6.896 1.00 0.00 C ATOM 0 H ILE A 102 -3.104 0.563 -7.498 1.00 0.00 H new ATOM 0 HA ILE A 102 -5.079 2.536 -7.108 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.586 0.975 -4.968 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -4.309 -0.583 -6.692 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.282 -0.777 -5.248 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -5.727 1.155 -3.758 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -5.053 2.757 -4.143 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -6.402 2.105 -5.103 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -6.671 -0.877 -7.260 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -7.098 0.544 -6.277 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -6.110 0.741 -7.744 1.00 0.00 H new ATOM 1613 N PHE A 103 -2.052 3.172 -5.979 1.00 0.00 N ATOM 1614 CA PHE A 103 -1.186 4.223 -5.463 1.00 0.00 C ATOM 1615 C PHE A 103 -1.255 5.454 -6.358 1.00 0.00 C ATOM 1616 O PHE A 103 -1.242 6.587 -5.877 1.00 0.00 O ATOM 1617 CB PHE A 103 0.258 3.726 -5.362 1.00 0.00 C ATOM 1618 CG PHE A 103 0.450 2.632 -4.350 1.00 0.00 C ATOM 1619 CD1 PHE A 103 -0.183 2.688 -3.118 1.00 0.00 C ATOM 1620 CD2 PHE A 103 1.264 1.546 -4.632 1.00 0.00 C ATOM 1621 CE1 PHE A 103 -0.008 1.682 -2.187 1.00 0.00 C ATOM 1622 CE2 PHE A 103 1.443 0.538 -3.704 1.00 0.00 C ATOM 1623 CZ PHE A 103 0.806 0.606 -2.480 1.00 0.00 C ATOM 0 H PHE A 103 -1.567 2.311 -6.232 1.00 0.00 H new ATOM 0 HA PHE A 103 -1.532 4.495 -4.466 1.00 0.00 H new ATOM 0 HB2 PHE A 103 0.578 3.365 -6.339 1.00 0.00 H new ATOM 0 HB3 PHE A 103 0.905 4.565 -5.105 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.820 3.528 -2.883 1.00 0.00 H new ATOM 0 HD2 PHE A 103 1.764 1.487 -5.588 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -0.507 1.737 -1.231 1.00 0.00 H new ATOM 0 HE2 PHE A 103 2.080 -0.303 -3.935 1.00 0.00 H new ATOM 0 HZ PHE A 103 0.945 -0.181 -1.754 1.00 0.00 H new ATOM 1633 N THR A 104 -1.333 5.222 -7.666 1.00 0.00 N ATOM 1634 CA THR A 104 -1.410 6.310 -8.633 1.00 0.00 C ATOM 1635 C THR A 104 -2.610 7.207 -8.352 1.00 0.00 C ATOM 1636 O THR A 104 -2.476 8.426 -8.257 1.00 0.00 O ATOM 1637 CB THR A 104 -1.505 5.757 -10.054 1.00 0.00 C ATOM 1638 OG1 THR A 104 -0.428 4.880 -10.326 1.00 0.00 O ATOM 1639 CG2 THR A 104 -1.500 6.837 -11.112 1.00 0.00 C ATOM 0 H THR A 104 -1.344 4.290 -8.079 1.00 0.00 H new ATOM 0 HA THR A 104 -0.501 6.904 -8.539 1.00 0.00 H new ATOM 0 HB THR A 104 -2.458 5.230 -10.098 1.00 0.00 H new ATOM 0 HG1 THR A 104 -0.591 4.415 -11.173 1.00 0.00 H new ATOM 0 HG21 THR A 104 -1.570 6.380 -12.099 1.00 0.00 H new ATOM 0 HG22 THR A 104 -2.351 7.501 -10.959 1.00 0.00 H new ATOM 0 HG23 THR A 104 -0.576 7.410 -11.042 1.00 0.00 H new ATOM 1647 N ALA A 105 -3.786 6.600 -8.228 1.00 0.00 N ATOM 1648 CA ALA A 105 -5.005 7.355 -7.965 1.00 0.00 C ATOM 1649 C ALA A 105 -4.871 8.193 -6.703 1.00 0.00 C ATOM 1650 O ALA A 105 -5.009 9.415 -6.744 1.00 0.00 O ATOM 1651 CB ALA A 105 -6.198 6.415 -7.858 1.00 0.00 C ATOM 0 H ALA A 105 -3.920 5.592 -8.305 1.00 0.00 H new ATOM 0 HA ALA A 105 -5.169 8.034 -8.802 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -7.101 6.994 -7.661 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -6.315 5.867 -8.793 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -6.034 5.710 -7.043 1.00 0.00 H new ATOM 1657 N PHE A 106 -4.606 7.538 -5.580 1.00 0.00 N ATOM 1658 CA PHE A 106 -4.461 8.235 -4.312 1.00 0.00 C ATOM 1659 C PHE A 106 -3.196 9.090 -4.285 1.00 0.00 C ATOM 1660 O PHE A 106 -3.035 9.929 -3.405 1.00 0.00 O ATOM 1661 CB PHE A 106 -4.436 7.230 -3.159 1.00 0.00 C ATOM 1662 CG PHE A 106 -5.783 6.643 -2.844 1.00 0.00 C ATOM 1663 CD1 PHE A 106 -6.396 5.771 -3.729 1.00 0.00 C ATOM 1664 CD2 PHE A 106 -6.433 6.962 -1.663 1.00 0.00 C ATOM 1665 CE1 PHE A 106 -7.634 5.228 -3.442 1.00 0.00 C ATOM 1666 CE2 PHE A 106 -7.670 6.421 -1.370 1.00 0.00 C ATOM 1667 CZ PHE A 106 -8.272 5.553 -2.261 1.00 0.00 C ATOM 0 H PHE A 106 -4.488 6.527 -5.523 1.00 0.00 H new ATOM 0 HA PHE A 106 -5.318 8.898 -4.196 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -3.746 6.423 -3.406 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -4.046 7.722 -2.268 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -5.901 5.513 -4.653 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -5.968 7.641 -0.964 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -8.102 4.550 -4.141 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -8.166 6.676 -0.445 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.239 5.130 -2.034 1.00 0.00 H new ATOM 1677 N LYS A 107 -2.295 8.875 -5.245 1.00 0.00 N ATOM 1678 CA LYS A 107 -1.049 9.639 -5.304 1.00 0.00 C ATOM 1679 C LYS A 107 -1.306 11.129 -5.069 1.00 0.00 C ATOM 1680 O LYS A 107 -0.533 11.806 -4.392 1.00 0.00 O ATOM 1681 CB LYS A 107 -0.351 9.422 -6.655 1.00 0.00 C ATOM 1682 CG LYS A 107 -0.715 10.447 -7.721 1.00 0.00 C ATOM 1683 CD LYS A 107 -0.112 10.087 -9.069 1.00 0.00 C ATOM 1684 CE LYS A 107 -0.322 11.196 -10.087 1.00 0.00 C ATOM 1685 NZ LYS A 107 0.868 12.085 -10.195 1.00 0.00 N ATOM 0 H LYS A 107 -2.404 8.183 -5.987 1.00 0.00 H new ATOM 0 HA LYS A 107 -0.394 9.280 -4.510 1.00 0.00 H new ATOM 0 HB2 LYS A 107 0.728 9.443 -6.501 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -0.601 8.427 -7.024 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -1.799 10.510 -7.811 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -0.363 11.432 -7.415 1.00 0.00 H new ATOM 0 HD2 LYS A 107 0.955 9.896 -8.952 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -0.563 9.165 -9.436 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -0.537 10.758 -11.062 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -1.193 11.788 -9.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 0.684 12.828 -10.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 1.059 12.523 -9.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 1.694 11.526 -10.490 1.00 0.00 H new ATOM 1699 N ASP A 108 -2.407 11.622 -5.625 1.00 0.00 N ATOM 1700 CA ASP A 108 -2.783 13.022 -5.472 1.00 0.00 C ATOM 1701 C ASP A 108 -3.623 13.223 -4.214 1.00 0.00 C ATOM 1702 O ASP A 108 -3.488 14.229 -3.517 1.00 0.00 O ATOM 1703 CB ASP A 108 -3.559 13.501 -6.700 1.00 0.00 C ATOM 1704 CG ASP A 108 -3.449 15.000 -6.905 1.00 0.00 C ATOM 1705 OD1 ASP A 108 -2.312 15.516 -6.914 1.00 0.00 O ATOM 1706 OD2 ASP A 108 -4.500 15.657 -7.056 1.00 0.00 O ATOM 0 H ASP A 108 -3.056 11.071 -6.187 1.00 0.00 H new ATOM 0 HA ASP A 108 -1.870 13.610 -5.377 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -3.185 12.987 -7.586 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -4.609 13.228 -6.592 1.00 0.00 H new ATOM 1711 N ASP A 109 -4.500 12.261 -3.939 1.00 0.00 N ATOM 1712 CA ASP A 109 -5.381 12.329 -2.774 1.00 0.00 C ATOM 1713 C ASP A 109 -4.717 11.757 -1.517 1.00 0.00 C ATOM 1714 O ASP A 109 -5.375 11.575 -0.493 1.00 0.00 O ATOM 1715 CB ASP A 109 -6.684 11.579 -3.059 1.00 0.00 C ATOM 1716 CG ASP A 109 -7.822 12.514 -3.418 1.00 0.00 C ATOM 1717 OD1 ASP A 109 -7.860 13.638 -2.876 1.00 0.00 O ATOM 1718 OD2 ASP A 109 -8.674 12.122 -4.242 1.00 0.00 O ATOM 0 H ASP A 109 -4.620 11.423 -4.508 1.00 0.00 H new ATOM 0 HA ASP A 109 -5.594 13.381 -2.586 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.524 10.875 -3.876 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.962 10.993 -2.183 1.00 0.00 H new ATOM 1723 N VAL A 110 -3.424 11.458 -1.601 1.00 0.00 N ATOM 1724 CA VAL A 110 -2.697 10.890 -0.469 1.00 0.00 C ATOM 1725 C VAL A 110 -2.177 11.975 0.470 1.00 0.00 C ATOM 1726 O VAL A 110 -1.951 13.113 0.059 1.00 0.00 O ATOM 1727 CB VAL A 110 -1.512 10.026 -0.946 1.00 0.00 C ATOM 1728 CG1 VAL A 110 -0.521 10.863 -1.741 1.00 0.00 C ATOM 1729 CG2 VAL A 110 -0.827 9.352 0.234 1.00 0.00 C ATOM 0 H VAL A 110 -2.859 11.599 -2.438 1.00 0.00 H new ATOM 0 HA VAL A 110 -3.405 10.265 0.075 1.00 0.00 H new ATOM 0 HB VAL A 110 -1.901 9.247 -1.602 1.00 0.00 H new ATOM 0 HG11 VAL A 110 0.307 10.234 -2.068 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -1.020 11.288 -2.612 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.139 11.668 -1.113 1.00 0.00 H new ATOM 0 HG21 VAL A 110 0.006 8.748 -0.125 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -0.454 10.112 0.921 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.541 8.713 0.753 1.00 0.00 H new ATOM 1739 N ASP A 111 -1.992 11.606 1.735 1.00 0.00 N ATOM 1740 CA ASP A 111 -1.499 12.538 2.744 1.00 0.00 C ATOM 1741 C ASP A 111 -0.196 12.036 3.363 1.00 0.00 C ATOM 1742 O ASP A 111 0.719 12.817 3.621 1.00 0.00 O ATOM 1743 CB ASP A 111 -2.550 12.741 3.836 1.00 0.00 C ATOM 1744 CG ASP A 111 -2.428 14.093 4.512 1.00 0.00 C ATOM 1745 OD1 ASP A 111 -1.597 14.223 5.435 1.00 0.00 O ATOM 1746 OD2 ASP A 111 -3.164 15.022 4.117 1.00 0.00 O ATOM 0 H ASP A 111 -2.177 10.666 2.086 1.00 0.00 H new ATOM 0 HA ASP A 111 -1.302 13.492 2.255 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -3.545 12.644 3.401 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -2.450 11.954 4.583 1.00 0.00 H new ATOM 1751 N THR A 112 -0.118 10.728 3.598 1.00 0.00 N ATOM 1752 CA THR A 112 1.076 10.127 4.186 1.00 0.00 C ATOM 1753 C THR A 112 1.738 9.165 3.204 1.00 0.00 C ATOM 1754 O THR A 112 1.088 8.654 2.292 1.00 0.00 O ATOM 1755 CB THR A 112 0.724 9.393 5.481 1.00 0.00 C ATOM 1756 OG1 THR A 112 -0.026 10.230 6.344 1.00 0.00 O ATOM 1757 CG2 THR A 112 1.939 8.914 6.248 1.00 0.00 C ATOM 0 H THR A 112 -0.866 10.066 3.391 1.00 0.00 H new ATOM 0 HA THR A 112 1.779 10.928 4.415 1.00 0.00 H new ATOM 0 HB THR A 112 0.144 8.524 5.171 1.00 0.00 H new ATOM 0 HG1 THR A 112 -0.243 9.742 7.166 1.00 0.00 H new ATOM 0 HG21 THR A 112 1.618 8.402 7.155 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.513 8.226 5.627 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.561 9.768 6.514 1.00 0.00 H new ATOM 1765 N LEU A 113 3.035 8.928 3.391 1.00 0.00 N ATOM 1766 CA LEU A 113 3.784 8.035 2.515 1.00 0.00 C ATOM 1767 C LEU A 113 4.777 7.179 3.301 1.00 0.00 C ATOM 1768 O LEU A 113 5.741 7.693 3.869 1.00 0.00 O ATOM 1769 CB LEU A 113 4.534 8.857 1.467 1.00 0.00 C ATOM 1770 CG LEU A 113 4.387 8.387 0.020 1.00 0.00 C ATOM 1771 CD1 LEU A 113 2.923 8.184 -0.343 1.00 0.00 C ATOM 1772 CD2 LEU A 113 5.036 9.396 -0.912 1.00 0.00 C ATOM 0 H LEU A 113 3.587 9.343 4.142 1.00 0.00 H new ATOM 0 HA LEU A 113 3.074 7.366 2.028 1.00 0.00 H new ATOM 0 HB2 LEU A 113 4.191 9.890 1.530 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.594 8.857 1.723 1.00 0.00 H new ATOM 0 HG LEU A 113 4.890 7.426 -0.089 1.00 0.00 H new ATOM 0 HD11 LEU A 113 2.848 7.850 -1.378 1.00 0.00 H new ATOM 0 HD12 LEU A 113 2.486 7.432 0.314 1.00 0.00 H new ATOM 0 HD13 LEU A 113 2.385 9.125 -0.226 1.00 0.00 H new ATOM 0 HD21 LEU A 113 4.930 9.059 -1.943 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.550 10.365 -0.795 1.00 0.00 H new ATOM 0 HD23 LEU A 113 6.094 9.489 -0.667 1.00 0.00 H new ATOM 1784 N LEU A 114 4.547 5.870 3.309 1.00 0.00 N ATOM 1785 CA LEU A 114 5.432 4.936 3.999 1.00 0.00 C ATOM 1786 C LEU A 114 5.942 3.889 3.017 1.00 0.00 C ATOM 1787 O LEU A 114 5.181 3.041 2.544 1.00 0.00 O ATOM 1788 CB LEU A 114 4.708 4.262 5.168 1.00 0.00 C ATOM 1789 CG LEU A 114 4.299 5.202 6.304 1.00 0.00 C ATOM 1790 CD1 LEU A 114 2.975 4.765 6.911 1.00 0.00 C ATOM 1791 CD2 LEU A 114 5.385 5.252 7.368 1.00 0.00 C ATOM 0 H LEU A 114 3.753 5.430 2.844 1.00 0.00 H new ATOM 0 HA LEU A 114 6.279 5.491 4.402 1.00 0.00 H new ATOM 0 HB2 LEU A 114 3.815 3.768 4.786 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.353 3.484 5.575 1.00 0.00 H new ATOM 0 HG LEU A 114 4.172 6.204 5.893 1.00 0.00 H new ATOM 0 HD11 LEU A 114 2.702 5.446 7.717 1.00 0.00 H new ATOM 0 HD12 LEU A 114 2.200 4.781 6.144 1.00 0.00 H new ATOM 0 HD13 LEU A 114 3.072 3.754 7.308 1.00 0.00 H new ATOM 0 HD21 LEU A 114 5.079 5.925 8.169 1.00 0.00 H new ATOM 0 HD22 LEU A 114 5.543 4.253 7.774 1.00 0.00 H new ATOM 0 HD23 LEU A 114 6.312 5.614 6.925 1.00 0.00 H new ATOM 1803 N VAL A 115 7.225 3.964 2.685 1.00 0.00 N ATOM 1804 CA VAL A 115 7.807 3.032 1.728 1.00 0.00 C ATOM 1805 C VAL A 115 8.996 2.268 2.299 1.00 0.00 C ATOM 1806 O VAL A 115 9.827 2.824 3.016 1.00 0.00 O ATOM 1807 CB VAL A 115 8.256 3.764 0.450 1.00 0.00 C ATOM 1808 CG1 VAL A 115 7.083 4.489 -0.187 1.00 0.00 C ATOM 1809 CG2 VAL A 115 9.387 4.737 0.751 1.00 0.00 C ATOM 0 H VAL A 115 7.877 4.653 3.060 1.00 0.00 H new ATOM 0 HA VAL A 115 7.021 2.314 1.493 1.00 0.00 H new ATOM 0 HB VAL A 115 8.628 3.021 -0.255 1.00 0.00 H new ATOM 0 HG11 VAL A 115 7.418 5.001 -1.089 1.00 0.00 H new ATOM 0 HG12 VAL A 115 6.307 3.769 -0.446 1.00 0.00 H new ATOM 0 HG13 VAL A 115 6.681 5.218 0.516 1.00 0.00 H new ATOM 0 HG21 VAL A 115 9.687 5.242 -0.167 1.00 0.00 H new ATOM 0 HG22 VAL A 115 9.048 5.476 1.477 1.00 0.00 H new ATOM 0 HG23 VAL A 115 10.238 4.191 1.159 1.00 0.00 H new ATOM 1819 N THR A 116 9.075 0.990 1.942 1.00 0.00 N ATOM 1820 CA THR A 116 10.168 0.132 2.378 1.00 0.00 C ATOM 1821 C THR A 116 11.094 -0.144 1.198 1.00 0.00 C ATOM 1822 O THR A 116 10.808 -0.998 0.359 1.00 0.00 O ATOM 1823 CB THR A 116 9.620 -1.183 2.942 1.00 0.00 C ATOM 1824 OG1 THR A 116 8.901 -0.953 4.141 1.00 0.00 O ATOM 1825 CG2 THR A 116 10.695 -2.207 3.240 1.00 0.00 C ATOM 0 H THR A 116 8.389 0.524 1.348 1.00 0.00 H new ATOM 0 HA THR A 116 10.728 0.635 3.166 1.00 0.00 H new ATOM 0 HB THR A 116 8.972 -1.581 2.161 1.00 0.00 H new ATOM 0 HG1 THR A 116 9.527 -0.908 4.894 1.00 0.00 H new ATOM 0 HG21 THR A 116 10.235 -3.112 3.636 1.00 0.00 H new ATOM 0 HG22 THR A 116 11.235 -2.445 2.323 1.00 0.00 H new ATOM 0 HG23 THR A 116 11.390 -1.801 3.975 1.00 0.00 H new ATOM 1833 N ARG A 117 12.192 0.599 1.125 1.00 0.00 N ATOM 1834 CA ARG A 117 13.141 0.444 0.029 1.00 0.00 C ATOM 1835 C ARG A 117 14.138 -0.677 0.297 1.00 0.00 C ATOM 1836 O ARG A 117 15.048 -0.533 1.114 1.00 0.00 O ATOM 1837 CB ARG A 117 13.889 1.756 -0.212 1.00 0.00 C ATOM 1838 CG ARG A 117 14.700 1.767 -1.498 1.00 0.00 C ATOM 1839 CD ARG A 117 15.989 2.555 -1.337 1.00 0.00 C ATOM 1840 NE ARG A 117 15.821 3.961 -1.696 1.00 0.00 N ATOM 1841 CZ ARG A 117 16.656 4.927 -1.322 1.00 0.00 C ATOM 1842 NH1 ARG A 117 17.719 4.644 -0.580 1.00 0.00 N ATOM 1843 NH2 ARG A 117 16.428 6.180 -1.691 1.00 0.00 N ATOM 0 H ARG A 117 12.447 1.312 1.809 1.00 0.00 H new ATOM 0 HA ARG A 117 12.571 0.180 -0.862 1.00 0.00 H new ATOM 0 HB2 ARG A 117 13.170 2.575 -0.239 1.00 0.00 H new ATOM 0 HB3 ARG A 117 14.556 1.944 0.630 1.00 0.00 H new ATOM 0 HG2 ARG A 117 14.932 0.743 -1.791 1.00 0.00 H new ATOM 0 HG3 ARG A 117 14.105 2.201 -2.301 1.00 0.00 H new ATOM 0 HD2 ARG A 117 16.331 2.483 -0.305 1.00 0.00 H new ATOM 0 HD3 ARG A 117 16.765 2.112 -1.961 1.00 0.00 H new ATOM 0 HE ARG A 117 15.016 4.217 -2.267 1.00 0.00 H new ATOM 0 HH11 ARG A 117 17.899 3.682 -0.293 1.00 0.00 H new ATOM 0 HH12 ARG A 117 18.356 5.389 -0.296 1.00 0.00 H new ATOM 0 HH21 ARG A 117 15.612 6.403 -2.262 1.00 0.00 H new ATOM 0 HH22 ARG A 117 17.068 6.921 -1.404 1.00 0.00 H new ATOM 1857 N LEU A 118 13.962 -1.790 -0.406 1.00 0.00 N ATOM 1858 CA LEU A 118 14.845 -2.939 -0.264 1.00 0.00 C ATOM 1859 C LEU A 118 16.209 -2.645 -0.882 1.00 0.00 C ATOM 1860 O LEU A 118 16.346 -1.735 -1.699 1.00 0.00 O ATOM 1861 CB LEU A 118 14.222 -4.168 -0.934 1.00 0.00 C ATOM 1862 CG LEU A 118 13.608 -5.192 0.022 1.00 0.00 C ATOM 1863 CD1 LEU A 118 12.396 -4.604 0.730 1.00 0.00 C ATOM 1864 CD2 LEU A 118 13.230 -6.460 -0.727 1.00 0.00 C ATOM 0 H LEU A 118 13.211 -1.920 -1.084 1.00 0.00 H new ATOM 0 HA LEU A 118 14.980 -3.142 0.798 1.00 0.00 H new ATOM 0 HB2 LEU A 118 13.449 -3.832 -1.626 1.00 0.00 H new ATOM 0 HB3 LEU A 118 14.988 -4.665 -1.529 1.00 0.00 H new ATOM 0 HG LEU A 118 14.352 -5.448 0.776 1.00 0.00 H new ATOM 0 HD11 LEU A 118 11.973 -5.347 1.406 1.00 0.00 H new ATOM 0 HD12 LEU A 118 12.698 -3.726 1.300 1.00 0.00 H new ATOM 0 HD13 LEU A 118 11.647 -4.317 -0.008 1.00 0.00 H new ATOM 0 HD21 LEU A 118 12.795 -7.177 -0.031 1.00 0.00 H new ATOM 0 HD22 LEU A 118 12.503 -6.221 -1.504 1.00 0.00 H new ATOM 0 HD23 LEU A 118 14.120 -6.892 -1.184 1.00 0.00 H new ATOM 1876 N ALA A 119 17.212 -3.422 -0.492 1.00 0.00 N ATOM 1877 CA ALA A 119 18.561 -3.243 -1.015 1.00 0.00 C ATOM 1878 C ALA A 119 18.741 -4.002 -2.323 1.00 0.00 C ATOM 1879 O ALA A 119 19.410 -3.530 -3.242 1.00 0.00 O ATOM 1880 CB ALA A 119 19.589 -3.705 0.005 1.00 0.00 C ATOM 0 H ALA A 119 17.117 -4.181 0.183 1.00 0.00 H new ATOM 0 HA ALA A 119 18.711 -2.181 -1.211 1.00 0.00 H new ATOM 0 HB1 ALA A 119 20.591 -3.565 -0.400 1.00 0.00 H new ATOM 0 HB2 ALA A 119 19.482 -3.121 0.919 1.00 0.00 H new ATOM 0 HB3 ALA A 119 19.432 -4.760 0.228 1.00 0.00 H new ATOM 1886 N GLY A 120 18.144 -5.186 -2.394 1.00 0.00 N ATOM 1887 CA GLY A 120 18.252 -6.001 -3.586 1.00 0.00 C ATOM 1888 C GLY A 120 17.489 -5.428 -4.763 1.00 0.00 C ATOM 1889 O GLY A 120 16.444 -4.798 -4.594 1.00 0.00 O ATOM 0 H GLY A 120 17.586 -5.596 -1.645 1.00 0.00 H new ATOM 0 HA2 GLY A 120 19.303 -6.103 -3.856 1.00 0.00 H new ATOM 0 HA3 GLY A 120 17.879 -7.002 -3.370 1.00 0.00 H new ATOM 1893 N SER A 121 18.017 -5.650 -5.960 1.00 0.00 N ATOM 1894 CA SER A 121 17.387 -5.162 -7.179 1.00 0.00 C ATOM 1895 C SER A 121 16.665 -6.294 -7.904 1.00 0.00 C ATOM 1896 O SER A 121 17.293 -7.244 -8.371 1.00 0.00 O ATOM 1897 CB SER A 121 18.434 -4.532 -8.098 1.00 0.00 C ATOM 1898 OG SER A 121 18.997 -5.494 -8.974 1.00 0.00 O ATOM 0 H SER A 121 18.883 -6.167 -6.112 1.00 0.00 H new ATOM 0 HA SER A 121 16.653 -4.404 -6.906 1.00 0.00 H new ATOM 0 HB2 SER A 121 17.976 -3.732 -8.679 1.00 0.00 H new ATOM 0 HB3 SER A 121 19.222 -4.079 -7.497 1.00 0.00 H new ATOM 0 HG SER A 121 18.760 -6.394 -8.667 1.00 0.00 H new ATOM 1904 N PHE A 122 15.344 -6.187 -7.991 1.00 0.00 N ATOM 1905 CA PHE A 122 14.537 -7.204 -8.656 1.00 0.00 C ATOM 1906 C PHE A 122 13.900 -6.649 -9.926 1.00 0.00 C ATOM 1907 O PHE A 122 13.841 -5.436 -10.125 1.00 0.00 O ATOM 1908 CB PHE A 122 13.451 -7.728 -7.713 1.00 0.00 C ATOM 1909 CG PHE A 122 13.994 -8.350 -6.457 1.00 0.00 C ATOM 1910 CD1 PHE A 122 14.694 -7.587 -5.537 1.00 0.00 C ATOM 1911 CD2 PHE A 122 13.804 -9.698 -6.199 1.00 0.00 C ATOM 1912 CE1 PHE A 122 15.194 -8.157 -4.381 1.00 0.00 C ATOM 1913 CE2 PHE A 122 14.301 -10.273 -5.045 1.00 0.00 C ATOM 1914 CZ PHE A 122 14.997 -9.502 -4.135 1.00 0.00 C ATOM 0 H PHE A 122 14.809 -5.407 -7.610 1.00 0.00 H new ATOM 0 HA PHE A 122 15.195 -8.028 -8.931 1.00 0.00 H new ATOM 0 HB2 PHE A 122 12.788 -6.906 -7.444 1.00 0.00 H new ATOM 0 HB3 PHE A 122 12.847 -8.465 -8.242 1.00 0.00 H new ATOM 0 HD1 PHE A 122 14.851 -6.535 -5.725 1.00 0.00 H new ATOM 0 HD2 PHE A 122 13.261 -10.306 -6.908 1.00 0.00 H new ATOM 0 HE1 PHE A 122 15.738 -7.552 -3.671 1.00 0.00 H new ATOM 0 HE2 PHE A 122 14.145 -11.325 -4.855 1.00 0.00 H new ATOM 0 HZ PHE A 122 15.387 -9.950 -3.233 1.00 0.00 H new ATOM 1924 N GLU A 123 13.423 -7.547 -10.782 1.00 0.00 N ATOM 1925 CA GLU A 123 12.789 -7.148 -12.033 1.00 0.00 C ATOM 1926 C GLU A 123 11.458 -7.868 -12.224 1.00 0.00 C ATOM 1927 O GLU A 123 11.354 -9.073 -11.998 1.00 0.00 O ATOM 1928 CB GLU A 123 13.715 -7.442 -13.214 1.00 0.00 C ATOM 1929 CG GLU A 123 14.004 -8.922 -13.407 1.00 0.00 C ATOM 1930 CD GLU A 123 15.484 -9.214 -13.560 1.00 0.00 C ATOM 1931 OE1 GLU A 123 16.297 -8.504 -12.931 1.00 0.00 O ATOM 1932 OE2 GLU A 123 15.830 -10.151 -14.310 1.00 0.00 O ATOM 0 H GLU A 123 13.464 -8.555 -10.632 1.00 0.00 H new ATOM 0 HA GLU A 123 12.597 -6.076 -11.988 1.00 0.00 H new ATOM 0 HB2 GLU A 123 13.265 -7.046 -14.125 1.00 0.00 H new ATOM 0 HB3 GLU A 123 14.656 -6.913 -13.067 1.00 0.00 H new ATOM 0 HG2 GLU A 123 13.614 -9.478 -12.554 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.474 -9.279 -14.290 1.00 0.00 H new ATOM 1939 N GLY A 124 10.442 -7.119 -12.642 1.00 0.00 N ATOM 1940 CA GLY A 124 9.131 -7.701 -12.857 1.00 0.00 C ATOM 1941 C GLY A 124 8.303 -6.914 -13.854 1.00 0.00 C ATOM 1942 O GLY A 124 8.781 -6.571 -14.935 1.00 0.00 O ATOM 0 H GLY A 124 10.504 -6.119 -12.835 1.00 0.00 H new ATOM 0 HA2 GLY A 124 9.245 -8.725 -13.213 1.00 0.00 H new ATOM 0 HA3 GLY A 124 8.599 -7.751 -11.907 1.00 0.00 H new ATOM 1946 N ASP A 125 7.057 -6.626 -13.490 1.00 0.00 N ATOM 1947 CA ASP A 125 6.162 -5.874 -14.361 1.00 0.00 C ATOM 1948 C ASP A 125 5.250 -4.960 -13.548 1.00 0.00 C ATOM 1949 O ASP A 125 4.129 -4.661 -13.960 1.00 0.00 O ATOM 1950 CB ASP A 125 5.320 -6.829 -15.209 1.00 0.00 C ATOM 1951 CG ASP A 125 5.106 -6.314 -16.619 1.00 0.00 C ATOM 1952 OD1 ASP A 125 4.595 -5.184 -16.767 1.00 0.00 O ATOM 1953 OD2 ASP A 125 5.451 -7.041 -17.575 1.00 0.00 O ATOM 0 H ASP A 125 6.645 -6.902 -12.599 1.00 0.00 H new ATOM 0 HA ASP A 125 6.772 -5.256 -15.019 1.00 0.00 H new ATOM 0 HB2 ASP A 125 5.810 -7.802 -15.251 1.00 0.00 H new ATOM 0 HB3 ASP A 125 4.353 -6.980 -14.729 1.00 0.00 H new ATOM 1958 N THR A 126 5.737 -4.518 -12.394 1.00 0.00 N ATOM 1959 CA THR A 126 4.963 -3.637 -11.527 1.00 0.00 C ATOM 1960 C THR A 126 5.878 -2.684 -10.764 1.00 0.00 C ATOM 1961 O THR A 126 6.551 -3.082 -9.811 1.00 0.00 O ATOM 1962 CB THR A 126 4.131 -4.461 -10.545 1.00 0.00 C ATOM 1963 OG1 THR A 126 3.537 -5.569 -11.197 1.00 0.00 O ATOM 1964 CG2 THR A 126 3.023 -3.669 -9.887 1.00 0.00 C ATOM 0 H THR A 126 6.663 -4.755 -12.037 1.00 0.00 H new ATOM 0 HA THR A 126 4.294 -3.045 -12.152 1.00 0.00 H new ATOM 0 HB THR A 126 4.831 -4.784 -9.775 1.00 0.00 H new ATOM 0 HG1 THR A 126 3.010 -6.085 -10.551 1.00 0.00 H new ATOM 0 HG21 THR A 126 2.472 -4.314 -9.202 1.00 0.00 H new ATOM 0 HG22 THR A 126 3.452 -2.834 -9.333 1.00 0.00 H new ATOM 0 HG23 THR A 126 2.345 -3.287 -10.651 1.00 0.00 H new ATOM 1972 N LYS A 127 5.896 -1.424 -11.191 1.00 0.00 N ATOM 1973 CA LYS A 127 6.728 -0.408 -10.556 1.00 0.00 C ATOM 1974 C LYS A 127 5.873 0.708 -9.961 1.00 0.00 C ATOM 1975 O LYS A 127 4.685 0.823 -10.262 1.00 0.00 O ATOM 1976 CB LYS A 127 7.717 0.175 -11.569 1.00 0.00 C ATOM 1977 CG LYS A 127 9.135 -0.348 -11.406 1.00 0.00 C ATOM 1978 CD LYS A 127 9.209 -1.846 -11.658 1.00 0.00 C ATOM 1979 CE LYS A 127 9.713 -2.153 -13.060 1.00 0.00 C ATOM 1980 NZ LYS A 127 10.695 -3.272 -13.063 1.00 0.00 N ATOM 0 H LYS A 127 5.342 -1.082 -11.976 1.00 0.00 H new ATOM 0 HA LYS A 127 7.282 -0.883 -9.747 1.00 0.00 H new ATOM 0 HB2 LYS A 127 7.369 -0.052 -12.576 1.00 0.00 H new ATOM 0 HB3 LYS A 127 7.726 1.261 -11.472 1.00 0.00 H new ATOM 0 HG2 LYS A 127 9.797 0.172 -12.098 1.00 0.00 H new ATOM 0 HG3 LYS A 127 9.491 -0.129 -10.399 1.00 0.00 H new ATOM 0 HD2 LYS A 127 9.870 -2.307 -10.924 1.00 0.00 H new ATOM 0 HD3 LYS A 127 8.222 -2.288 -11.520 1.00 0.00 H new ATOM 0 HE2 LYS A 127 8.870 -2.408 -13.701 1.00 0.00 H new ATOM 0 HE3 LYS A 127 10.177 -1.262 -13.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 11.315 -3.187 -13.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 11.269 -3.232 -12.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 10.188 -4.179 -13.101 1.00 0.00 H new ATOM 1994 N MET A 128 6.488 1.527 -9.113 1.00 0.00 N ATOM 1995 CA MET A 128 5.790 2.635 -8.470 1.00 0.00 C ATOM 1996 C MET A 128 5.534 3.771 -9.458 1.00 0.00 C ATOM 1997 O MET A 128 6.133 3.821 -10.532 1.00 0.00 O ATOM 1998 CB MET A 128 6.605 3.152 -7.282 1.00 0.00 C ATOM 1999 CG MET A 128 5.861 4.163 -6.425 1.00 0.00 C ATOM 2000 SD MET A 128 4.299 3.521 -5.791 1.00 0.00 S ATOM 2001 CE MET A 128 3.609 4.993 -5.039 1.00 0.00 C ATOM 0 H MET A 128 7.471 1.444 -8.855 1.00 0.00 H new ATOM 0 HA MET A 128 4.827 2.267 -8.114 1.00 0.00 H new ATOM 0 HB2 MET A 128 6.899 2.307 -6.659 1.00 0.00 H new ATOM 0 HB3 MET A 128 7.522 3.609 -7.653 1.00 0.00 H new ATOM 0 HG2 MET A 128 6.494 4.460 -5.588 1.00 0.00 H new ATOM 0 HG3 MET A 128 5.669 5.060 -7.013 1.00 0.00 H new ATOM 0 HE1 MET A 128 3.052 4.717 -4.144 1.00 0.00 H new ATOM 0 HE2 MET A 128 4.415 5.676 -4.769 1.00 0.00 H new ATOM 0 HE3 MET A 128 2.940 5.483 -5.746 1.00 0.00 H new ATOM 2011 N ILE A 129 4.638 4.679 -9.084 1.00 0.00 N ATOM 2012 CA ILE A 129 4.296 5.816 -9.932 1.00 0.00 C ATOM 2013 C ILE A 129 4.824 7.126 -9.342 1.00 0.00 C ATOM 2014 O ILE A 129 5.039 7.230 -8.134 1.00 0.00 O ATOM 2015 CB ILE A 129 2.770 5.924 -10.132 1.00 0.00 C ATOM 2016 CG1 ILE A 129 2.066 6.136 -8.790 1.00 0.00 C ATOM 2017 CG2 ILE A 129 2.236 4.676 -10.821 1.00 0.00 C ATOM 2018 CD1 ILE A 129 1.972 7.587 -8.381 1.00 0.00 C ATOM 0 H ILE A 129 4.135 4.649 -8.197 1.00 0.00 H new ATOM 0 HA ILE A 129 4.769 5.647 -10.899 1.00 0.00 H new ATOM 0 HB ILE A 129 2.566 6.786 -10.767 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.061 5.717 -8.846 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.600 5.583 -8.017 1.00 0.00 H new ATOM 0 HG21 ILE A 129 1.158 4.767 -10.955 1.00 0.00 H new ATOM 0 HG22 ILE A 129 2.714 4.565 -11.794 1.00 0.00 H new ATOM 0 HG23 ILE A 129 2.453 3.801 -10.208 1.00 0.00 H new ATOM 0 HD11 ILE A 129 1.462 7.662 -7.421 1.00 0.00 H new ATOM 0 HD12 ILE A 129 2.974 8.006 -8.293 1.00 0.00 H new ATOM 0 HD13 ILE A 129 1.412 8.142 -9.134 1.00 0.00 H new ATOM 2030 N PRO A 130 5.045 8.145 -10.194 1.00 0.00 N ATOM 2031 CA PRO A 130 5.557 9.453 -9.756 1.00 0.00 C ATOM 2032 C PRO A 130 4.713 10.076 -8.647 1.00 0.00 C ATOM 2033 O PRO A 130 3.510 9.834 -8.559 1.00 0.00 O ATOM 2034 CB PRO A 130 5.484 10.308 -11.025 1.00 0.00 C ATOM 2035 CG PRO A 130 5.531 9.329 -12.146 1.00 0.00 C ATOM 2036 CD PRO A 130 4.820 8.101 -11.650 1.00 0.00 C ATOM 0 HA PRO A 130 6.559 9.371 -9.334 1.00 0.00 H new ATOM 0 HB2 PRO A 130 4.568 10.897 -11.053 1.00 0.00 H new ATOM 0 HB3 PRO A 130 6.316 11.010 -11.078 1.00 0.00 H new ATOM 0 HG2 PRO A 130 5.044 9.730 -13.035 1.00 0.00 H new ATOM 0 HG3 PRO A 130 6.560 9.100 -12.422 1.00 0.00 H new ATOM 0 HD2 PRO A 130 3.758 8.125 -11.894 1.00 0.00 H new ATOM 0 HD3 PRO A 130 5.229 7.193 -12.093 1.00 0.00 H new ATOM 2044 N LEU A 131 5.353 10.882 -7.803 1.00 0.00 N ATOM 2045 CA LEU A 131 4.660 11.539 -6.697 1.00 0.00 C ATOM 2046 C LEU A 131 5.176 12.961 -6.492 1.00 0.00 C ATOM 2047 O LEU A 131 6.340 13.254 -6.765 1.00 0.00 O ATOM 2048 CB LEU A 131 4.838 10.743 -5.398 1.00 0.00 C ATOM 2049 CG LEU A 131 5.043 9.235 -5.565 1.00 0.00 C ATOM 2050 CD1 LEU A 131 5.884 8.683 -4.425 1.00 0.00 C ATOM 2051 CD2 LEU A 131 3.701 8.521 -5.631 1.00 0.00 C ATOM 0 H LEU A 131 6.349 11.096 -7.863 1.00 0.00 H new ATOM 0 HA LEU A 131 3.601 11.581 -6.953 1.00 0.00 H new ATOM 0 HB2 LEU A 131 5.694 11.150 -4.859 1.00 0.00 H new ATOM 0 HB3 LEU A 131 3.961 10.904 -4.772 1.00 0.00 H new ATOM 0 HG LEU A 131 5.574 9.060 -6.501 1.00 0.00 H new ATOM 0 HD11 LEU A 131 6.020 7.610 -4.560 1.00 0.00 H new ATOM 0 HD12 LEU A 131 6.857 9.174 -4.420 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.379 8.869 -3.477 1.00 0.00 H new ATOM 0 HD21 LEU A 131 3.864 7.450 -5.750 1.00 0.00 H new ATOM 0 HD22 LEU A 131 3.146 8.704 -4.711 1.00 0.00 H new ATOM 0 HD23 LEU A 131 3.130 8.897 -6.480 1.00 0.00 H new ATOM 2063 N ASN A 132 4.307 13.838 -5.995 1.00 0.00 N ATOM 2064 CA ASN A 132 4.683 15.225 -5.737 1.00 0.00 C ATOM 2065 C ASN A 132 5.589 15.302 -4.512 1.00 0.00 C ATOM 2066 O ASN A 132 5.166 15.721 -3.434 1.00 0.00 O ATOM 2067 CB ASN A 132 3.435 16.087 -5.531 1.00 0.00 C ATOM 2068 CG ASN A 132 3.216 17.066 -6.668 1.00 0.00 C ATOM 2069 OD1 ASN A 132 2.161 17.073 -7.302 1.00 0.00 O ATOM 2070 ND2 ASN A 132 4.216 17.899 -6.931 1.00 0.00 N ATOM 0 H ASN A 132 3.339 13.613 -5.763 1.00 0.00 H new ATOM 0 HA ASN A 132 5.227 15.607 -6.601 1.00 0.00 H new ATOM 0 HB2 ASN A 132 2.562 15.441 -5.438 1.00 0.00 H new ATOM 0 HB3 ASN A 132 3.527 16.637 -4.594 1.00 0.00 H new ATOM 0 HD21 ASN A 132 4.127 18.580 -7.685 1.00 0.00 H new ATOM 0 HD22 ASN A 132 5.073 17.858 -6.379 1.00 0.00 H new ATOM 2077 N TRP A 133 6.831 14.868 -4.686 1.00 0.00 N ATOM 2078 CA TRP A 133 7.807 14.854 -3.602 1.00 0.00 C ATOM 2079 C TRP A 133 7.952 16.218 -2.933 1.00 0.00 C ATOM 2080 O TRP A 133 7.951 16.308 -1.705 1.00 0.00 O ATOM 2081 CB TRP A 133 9.159 14.368 -4.121 1.00 0.00 C ATOM 2082 CG TRP A 133 9.119 12.951 -4.603 1.00 0.00 C ATOM 2083 CD1 TRP A 133 8.822 12.523 -5.865 1.00 0.00 C ATOM 2084 CD2 TRP A 133 9.372 11.773 -3.828 1.00 0.00 C ATOM 2085 NE1 TRP A 133 8.875 11.151 -5.922 1.00 0.00 N ATOM 2086 CE2 TRP A 133 9.213 10.667 -4.685 1.00 0.00 C ATOM 2087 CE3 TRP A 133 9.719 11.545 -2.493 1.00 0.00 C ATOM 2088 CZ2 TRP A 133 9.389 9.356 -4.251 1.00 0.00 C ATOM 2089 CZ3 TRP A 133 9.894 10.243 -2.063 1.00 0.00 C ATOM 2090 CH2 TRP A 133 9.730 9.163 -2.940 1.00 0.00 C ATOM 0 H TRP A 133 7.189 14.518 -5.575 1.00 0.00 H new ATOM 0 HA TRP A 133 7.440 14.164 -2.842 1.00 0.00 H new ATOM 0 HB2 TRP A 133 9.485 15.015 -4.935 1.00 0.00 H new ATOM 0 HB3 TRP A 133 9.901 14.456 -3.327 1.00 0.00 H new ATOM 0 HD1 TRP A 133 8.581 13.168 -6.697 1.00 0.00 H new ATOM 0 HE1 TRP A 133 8.692 10.585 -6.750 1.00 0.00 H new ATOM 0 HE3 TRP A 133 9.848 12.371 -1.810 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 9.261 8.522 -4.925 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 10.162 10.055 -1.034 1.00 0.00 H new ATOM 0 HH2 TRP A 133 9.876 8.157 -2.574 1.00 0.00 H new ATOM 2101 N ASP A 134 8.080 17.283 -3.723 1.00 0.00 N ATOM 2102 CA ASP A 134 8.225 18.624 -3.163 1.00 0.00 C ATOM 2103 C ASP A 134 7.075 18.947 -2.216 1.00 0.00 C ATOM 2104 O ASP A 134 7.281 19.507 -1.140 1.00 0.00 O ATOM 2105 CB ASP A 134 8.284 19.663 -4.284 1.00 0.00 C ATOM 2106 CG ASP A 134 7.178 19.477 -5.304 1.00 0.00 C ATOM 2107 OD1 ASP A 134 6.004 19.726 -4.958 1.00 0.00 O ATOM 2108 OD2 ASP A 134 7.486 19.081 -6.447 1.00 0.00 O ATOM 0 H ASP A 134 8.086 17.244 -4.742 1.00 0.00 H new ATOM 0 HA ASP A 134 9.156 18.655 -2.597 1.00 0.00 H new ATOM 0 HB2 ASP A 134 8.213 20.662 -3.854 1.00 0.00 H new ATOM 0 HB3 ASP A 134 9.250 19.599 -4.784 1.00 0.00 H new ATOM 2113 N ASP A 135 5.863 18.587 -2.626 1.00 0.00 N ATOM 2114 CA ASP A 135 4.676 18.837 -1.815 1.00 0.00 C ATOM 2115 C ASP A 135 4.611 17.887 -0.616 1.00 0.00 C ATOM 2116 O ASP A 135 3.676 17.950 0.182 1.00 0.00 O ATOM 2117 CB ASP A 135 3.413 18.692 -2.668 1.00 0.00 C ATOM 2118 CG ASP A 135 2.622 19.983 -2.753 1.00 0.00 C ATOM 2119 OD1 ASP A 135 3.250 21.062 -2.796 1.00 0.00 O ATOM 2120 OD2 ASP A 135 1.376 19.915 -2.778 1.00 0.00 O ATOM 0 H ASP A 135 5.677 18.122 -3.514 1.00 0.00 H new ATOM 0 HA ASP A 135 4.738 19.857 -1.435 1.00 0.00 H new ATOM 0 HB2 ASP A 135 3.691 18.372 -3.672 1.00 0.00 H new ATOM 0 HB3 ASP A 135 2.782 17.909 -2.248 1.00 0.00 H new ATOM 2125 N PHE A 136 5.606 17.009 -0.492 1.00 0.00 N ATOM 2126 CA PHE A 136 5.649 16.058 0.610 1.00 0.00 C ATOM 2127 C PHE A 136 6.949 16.201 1.395 1.00 0.00 C ATOM 2128 O PHE A 136 8.031 16.293 0.816 1.00 0.00 O ATOM 2129 CB PHE A 136 5.513 14.628 0.084 1.00 0.00 C ATOM 2130 CG PHE A 136 4.089 14.178 -0.079 1.00 0.00 C ATOM 2131 CD1 PHE A 136 3.204 14.904 -0.859 1.00 0.00 C ATOM 2132 CD2 PHE A 136 3.636 13.028 0.548 1.00 0.00 C ATOM 2133 CE1 PHE A 136 1.894 14.492 -1.012 1.00 0.00 C ATOM 2134 CE2 PHE A 136 2.327 12.611 0.400 1.00 0.00 C ATOM 2135 CZ PHE A 136 1.455 13.343 -0.381 1.00 0.00 C ATOM 0 H PHE A 136 6.390 16.939 -1.141 1.00 0.00 H new ATOM 0 HA PHE A 136 4.814 16.272 1.277 1.00 0.00 H new ATOM 0 HB2 PHE A 136 6.021 14.554 -0.878 1.00 0.00 H new ATOM 0 HB3 PHE A 136 6.024 13.949 0.767 1.00 0.00 H new ATOM 0 HD1 PHE A 136 3.542 15.803 -1.353 1.00 0.00 H new ATOM 0 HD2 PHE A 136 4.314 12.451 1.159 1.00 0.00 H new ATOM 0 HE1 PHE A 136 1.214 15.067 -1.624 1.00 0.00 H new ATOM 0 HE2 PHE A 136 1.986 11.713 0.895 1.00 0.00 H new ATOM 0 HZ PHE A 136 0.432 13.019 -0.499 1.00 0.00 H new ATOM 2145 N THR A 137 6.828 16.237 2.717 1.00 0.00 N ATOM 2146 CA THR A 137 7.989 16.389 3.587 1.00 0.00 C ATOM 2147 C THR A 137 8.222 15.132 4.415 1.00 0.00 C ATOM 2148 O THR A 137 7.293 14.579 5.005 1.00 0.00 O ATOM 2149 CB THR A 137 7.801 17.596 4.509 1.00 0.00 C ATOM 2150 OG1 THR A 137 7.670 18.788 3.755 1.00 0.00 O ATOM 2151 CG2 THR A 137 8.943 17.794 5.483 1.00 0.00 C ATOM 0 H THR A 137 5.938 16.163 3.210 1.00 0.00 H new ATOM 0 HA THR A 137 8.865 16.550 2.958 1.00 0.00 H new ATOM 0 HB THR A 137 6.895 17.384 5.076 1.00 0.00 H new ATOM 0 HG1 THR A 137 7.549 19.548 4.362 1.00 0.00 H new ATOM 0 HG21 THR A 137 8.744 18.667 6.105 1.00 0.00 H new ATOM 0 HG22 THR A 137 9.039 16.912 6.116 1.00 0.00 H new ATOM 0 HG23 THR A 137 9.870 17.947 4.930 1.00 0.00 H new ATOM 2159 N LYS A 138 9.473 14.685 4.448 1.00 0.00 N ATOM 2160 CA LYS A 138 9.841 13.491 5.195 1.00 0.00 C ATOM 2161 C LYS A 138 9.538 13.658 6.678 1.00 0.00 C ATOM 2162 O LYS A 138 10.035 14.579 7.326 1.00 0.00 O ATOM 2163 CB LYS A 138 11.324 13.176 5.000 1.00 0.00 C ATOM 2164 CG LYS A 138 11.750 11.863 5.634 1.00 0.00 C ATOM 2165 CD LYS A 138 12.731 11.109 4.752 1.00 0.00 C ATOM 2166 CE LYS A 138 14.071 11.823 4.666 1.00 0.00 C ATOM 2167 NZ LYS A 138 14.427 12.169 3.262 1.00 0.00 N ATOM 0 H LYS A 138 10.250 15.134 3.964 1.00 0.00 H new ATOM 0 HA LYS A 138 9.247 12.661 4.813 1.00 0.00 H new ATOM 0 HB2 LYS A 138 11.544 13.144 3.933 1.00 0.00 H new ATOM 0 HB3 LYS A 138 11.919 13.985 5.424 1.00 0.00 H new ATOM 0 HG2 LYS A 138 12.207 12.058 6.604 1.00 0.00 H new ATOM 0 HG3 LYS A 138 10.872 11.243 5.815 1.00 0.00 H new ATOM 0 HD2 LYS A 138 12.878 10.104 5.148 1.00 0.00 H new ATOM 0 HD3 LYS A 138 12.312 10.999 3.752 1.00 0.00 H new ATOM 0 HE2 LYS A 138 14.037 12.732 5.266 1.00 0.00 H new ATOM 0 HE3 LYS A 138 14.848 11.189 5.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 14.905 13.092 3.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 15.062 11.442 2.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 13.562 12.215 2.686 1.00 0.00 H new ATOM 2181 N VAL A 139 8.725 12.755 7.208 1.00 0.00 N ATOM 2182 CA VAL A 139 8.357 12.792 8.617 1.00 0.00 C ATOM 2183 C VAL A 139 9.324 11.957 9.444 1.00 0.00 C ATOM 2184 O VAL A 139 9.609 12.279 10.597 1.00 0.00 O ATOM 2185 CB VAL A 139 6.924 12.271 8.850 1.00 0.00 C ATOM 2186 CG1 VAL A 139 6.357 12.833 10.144 1.00 0.00 C ATOM 2187 CG2 VAL A 139 6.024 12.616 7.672 1.00 0.00 C ATOM 0 H VAL A 139 8.307 11.987 6.683 1.00 0.00 H new ATOM 0 HA VAL A 139 8.404 13.835 8.929 1.00 0.00 H new ATOM 0 HB VAL A 139 6.965 11.185 8.936 1.00 0.00 H new ATOM 0 HG11 VAL A 139 5.345 12.455 10.292 1.00 0.00 H new ATOM 0 HG12 VAL A 139 6.985 12.526 10.980 1.00 0.00 H new ATOM 0 HG13 VAL A 139 6.333 13.921 10.088 1.00 0.00 H new ATOM 0 HG21 VAL A 139 5.019 12.238 7.859 1.00 0.00 H new ATOM 0 HG22 VAL A 139 5.988 13.698 7.547 1.00 0.00 H new ATOM 0 HG23 VAL A 139 6.420 12.159 6.765 1.00 0.00 H new ATOM 2197 N SER A 140 9.824 10.879 8.847 1.00 0.00 N ATOM 2198 CA SER A 140 10.760 9.997 9.537 1.00 0.00 C ATOM 2199 C SER A 140 11.548 9.146 8.546 1.00 0.00 C ATOM 2200 O SER A 140 11.165 9.011 7.384 1.00 0.00 O ATOM 2201 CB SER A 140 10.011 9.095 10.520 1.00 0.00 C ATOM 2202 OG SER A 140 10.037 9.635 11.829 1.00 0.00 O ATOM 0 H SER A 140 9.599 10.596 7.893 1.00 0.00 H new ATOM 0 HA SER A 140 11.465 10.620 10.088 1.00 0.00 H new ATOM 0 HB2 SER A 140 8.978 8.975 10.193 1.00 0.00 H new ATOM 0 HB3 SER A 140 10.462 8.103 10.524 1.00 0.00 H new ATOM 0 HG SER A 140 9.911 10.606 11.785 1.00 0.00 H new ATOM 2208 N SER A 141 12.652 8.574 9.016 1.00 0.00 N ATOM 2209 CA SER A 141 13.497 7.735 8.176 1.00 0.00 C ATOM 2210 C SER A 141 14.371 6.820 9.027 1.00 0.00 C ATOM 2211 O SER A 141 15.119 7.286 9.888 1.00 0.00 O ATOM 2212 CB SER A 141 14.374 8.602 7.271 1.00 0.00 C ATOM 2213 OG SER A 141 15.375 9.271 8.019 1.00 0.00 O ATOM 0 H SER A 141 12.982 8.677 9.976 1.00 0.00 H new ATOM 0 HA SER A 141 12.850 7.115 7.556 1.00 0.00 H new ATOM 0 HB2 SER A 141 14.841 7.980 6.508 1.00 0.00 H new ATOM 0 HB3 SER A 141 13.755 9.333 6.751 1.00 0.00 H new ATOM 0 HG SER A 141 15.448 8.862 8.906 1.00 0.00 H new ATOM 2219 N ARG A 142 14.272 5.518 8.782 1.00 0.00 N ATOM 2220 CA ARG A 142 15.054 4.538 9.527 1.00 0.00 C ATOM 2221 C ARG A 142 15.547 3.425 8.608 1.00 0.00 C ATOM 2222 O ARG A 142 14.755 2.768 7.933 1.00 0.00 O ATOM 2223 CB ARG A 142 14.220 3.945 10.664 1.00 0.00 C ATOM 2224 CG ARG A 142 14.990 2.969 11.539 1.00 0.00 C ATOM 2225 CD ARG A 142 15.660 3.677 12.705 1.00 0.00 C ATOM 2226 NE ARG A 142 16.761 4.532 12.267 1.00 0.00 N ATOM 2227 CZ ARG A 142 17.280 5.509 13.007 1.00 0.00 C ATOM 2228 NH1 ARG A 142 16.803 5.757 14.221 1.00 0.00 N ATOM 2229 NH2 ARG A 142 18.280 6.240 12.533 1.00 0.00 N ATOM 0 H ARG A 142 13.658 5.117 8.073 1.00 0.00 H new ATOM 0 HA ARG A 142 15.920 5.047 9.950 1.00 0.00 H new ATOM 0 HB2 ARG A 142 13.840 4.756 11.286 1.00 0.00 H new ATOM 0 HB3 ARG A 142 13.354 3.436 10.241 1.00 0.00 H new ATOM 0 HG2 ARG A 142 14.312 2.204 11.917 1.00 0.00 H new ATOM 0 HG3 ARG A 142 15.744 2.458 10.940 1.00 0.00 H new ATOM 0 HD2 ARG A 142 14.922 4.279 13.236 1.00 0.00 H new ATOM 0 HD3 ARG A 142 16.035 2.937 13.412 1.00 0.00 H new ATOM 0 HE ARG A 142 17.155 4.371 11.340 1.00 0.00 H new ATOM 0 HH11 ARG A 142 16.035 5.197 14.591 1.00 0.00 H new ATOM 0 HH12 ARG A 142 17.205 6.507 14.783 1.00 0.00 H new ATOM 0 HH21 ARG A 142 18.651 6.053 11.601 1.00 0.00 H new ATOM 0 HH22 ARG A 142 18.678 6.989 13.100 1.00 0.00 H new ATOM 2243 N THR A 143 16.860 3.220 8.585 1.00 0.00 N ATOM 2244 CA THR A 143 17.457 2.188 7.746 1.00 0.00 C ATOM 2245 C THR A 143 17.635 0.887 8.521 1.00 0.00 C ATOM 2246 O THR A 143 18.395 0.826 9.487 1.00 0.00 O ATOM 2247 CB THR A 143 18.807 2.659 7.204 1.00 0.00 C ATOM 2248 OG1 THR A 143 18.842 4.072 7.097 1.00 0.00 O ATOM 2249 CG2 THR A 143 19.137 2.086 5.842 1.00 0.00 C ATOM 0 H THR A 143 17.530 3.755 9.138 1.00 0.00 H new ATOM 0 HA THR A 143 16.781 2.002 6.911 1.00 0.00 H new ATOM 0 HB THR A 143 19.546 2.301 7.921 1.00 0.00 H new ATOM 0 HG1 THR A 143 19.715 4.352 6.750 1.00 0.00 H new ATOM 0 HG21 THR A 143 20.107 2.460 5.515 1.00 0.00 H new ATOM 0 HG22 THR A 143 19.169 0.998 5.903 1.00 0.00 H new ATOM 0 HG23 THR A 143 18.372 2.387 5.126 1.00 0.00 H new ATOM 2257 N VAL A 144 16.933 -0.154 8.086 1.00 0.00 N ATOM 2258 CA VAL A 144 17.016 -1.457 8.732 1.00 0.00 C ATOM 2259 C VAL A 144 17.788 -2.444 7.863 1.00 0.00 C ATOM 2260 O VAL A 144 17.521 -2.571 6.668 1.00 0.00 O ATOM 2261 CB VAL A 144 15.616 -2.032 9.025 1.00 0.00 C ATOM 2262 CG1 VAL A 144 15.722 -3.316 9.833 1.00 0.00 C ATOM 2263 CG2 VAL A 144 14.758 -1.007 9.753 1.00 0.00 C ATOM 0 H VAL A 144 16.299 -0.120 7.287 1.00 0.00 H new ATOM 0 HA VAL A 144 17.542 -1.313 9.676 1.00 0.00 H new ATOM 0 HB VAL A 144 15.136 -2.266 8.075 1.00 0.00 H new ATOM 0 HG11 VAL A 144 14.723 -3.706 10.029 1.00 0.00 H new ATOM 0 HG12 VAL A 144 16.295 -4.053 9.271 1.00 0.00 H new ATOM 0 HG13 VAL A 144 16.224 -3.110 10.779 1.00 0.00 H new ATOM 0 HG21 VAL A 144 13.774 -1.431 9.951 1.00 0.00 H new ATOM 0 HG22 VAL A 144 15.234 -0.738 10.696 1.00 0.00 H new ATOM 0 HG23 VAL A 144 14.651 -0.116 9.134 1.00 0.00 H new ATOM 2273 N GLU A 145 18.747 -3.138 8.466 1.00 0.00 N ATOM 2274 CA GLU A 145 19.556 -4.109 7.739 1.00 0.00 C ATOM 2275 C GLU A 145 19.467 -5.489 8.380 1.00 0.00 C ATOM 2276 O GLU A 145 19.366 -5.616 9.600 1.00 0.00 O ATOM 2277 CB GLU A 145 21.016 -3.655 7.685 1.00 0.00 C ATOM 2278 CG GLU A 145 21.523 -3.081 8.996 1.00 0.00 C ATOM 2279 CD GLU A 145 22.990 -3.380 9.236 1.00 0.00 C ATOM 2280 OE1 GLU A 145 23.308 -4.525 9.618 1.00 0.00 O ATOM 2281 OE2 GLU A 145 23.821 -2.468 9.041 1.00 0.00 O ATOM 0 H GLU A 145 18.983 -3.047 9.454 1.00 0.00 H new ATOM 0 HA GLU A 145 19.164 -4.175 6.724 1.00 0.00 H new ATOM 0 HB2 GLU A 145 21.641 -4.502 7.403 1.00 0.00 H new ATOM 0 HB3 GLU A 145 21.126 -2.904 6.903 1.00 0.00 H new ATOM 0 HG2 GLU A 145 21.371 -2.002 8.998 1.00 0.00 H new ATOM 0 HG3 GLU A 145 20.934 -3.488 9.818 1.00 0.00 H new ATOM 2288 N ASP A 146 19.506 -6.519 7.543 1.00 0.00 N ATOM 2289 CA ASP A 146 19.432 -7.897 8.014 1.00 0.00 C ATOM 2290 C ASP A 146 20.743 -8.628 7.736 1.00 0.00 C ATOM 2291 O ASP A 146 21.726 -8.017 7.318 1.00 0.00 O ATOM 2292 CB ASP A 146 18.269 -8.623 7.333 1.00 0.00 C ATOM 2293 CG ASP A 146 16.926 -8.239 7.922 1.00 0.00 C ATOM 2294 OD1 ASP A 146 16.750 -7.054 8.279 1.00 0.00 O ATOM 2295 OD2 ASP A 146 16.049 -9.122 8.027 1.00 0.00 O ATOM 0 H ASP A 146 19.589 -6.425 6.531 1.00 0.00 H new ATOM 0 HA ASP A 146 19.262 -7.888 9.091 1.00 0.00 H new ATOM 0 HB2 ASP A 146 18.275 -8.394 6.267 1.00 0.00 H new ATOM 0 HB3 ASP A 146 18.410 -9.700 7.428 1.00 0.00 H new ATOM 2300 N THR A 147 20.753 -9.937 7.968 1.00 0.00 N ATOM 2301 CA THR A 147 21.947 -10.741 7.737 1.00 0.00 C ATOM 2302 C THR A 147 22.387 -10.646 6.279 1.00 0.00 C ATOM 2303 O THR A 147 23.575 -10.514 5.985 1.00 0.00 O ATOM 2304 CB THR A 147 21.686 -12.201 8.109 1.00 0.00 C ATOM 2305 OG1 THR A 147 20.322 -12.531 7.914 1.00 0.00 O ATOM 2306 CG2 THR A 147 22.035 -12.524 9.546 1.00 0.00 C ATOM 0 H THR A 147 19.950 -10.462 8.315 1.00 0.00 H new ATOM 0 HA THR A 147 22.746 -10.352 8.368 1.00 0.00 H new ATOM 0 HB THR A 147 22.332 -12.786 7.455 1.00 0.00 H new ATOM 0 HG1 THR A 147 20.175 -13.469 8.156 1.00 0.00 H new ATOM 0 HG21 THR A 147 21.826 -13.575 9.744 1.00 0.00 H new ATOM 0 HG22 THR A 147 23.093 -12.326 9.717 1.00 0.00 H new ATOM 0 HG23 THR A 147 21.437 -11.903 10.214 1.00 0.00 H new ATOM 2314 N ASN A 148 21.419 -10.710 5.371 1.00 0.00 N ATOM 2315 CA ASN A 148 21.703 -10.628 3.944 1.00 0.00 C ATOM 2316 C ASN A 148 21.804 -9.170 3.494 1.00 0.00 C ATOM 2317 O ASN A 148 21.010 -8.329 3.915 1.00 0.00 O ATOM 2318 CB ASN A 148 20.614 -11.349 3.144 1.00 0.00 C ATOM 2319 CG ASN A 148 21.075 -12.697 2.626 1.00 0.00 C ATOM 2320 OD1 ASN A 148 22.177 -13.150 2.934 1.00 0.00 O ATOM 2321 ND2 ASN A 148 20.230 -13.347 1.834 1.00 0.00 N ATOM 0 H ASN A 148 20.431 -10.818 5.599 1.00 0.00 H new ATOM 0 HA ASN A 148 22.661 -11.114 3.759 1.00 0.00 H new ATOM 0 HB2 ASN A 148 19.735 -11.486 3.774 1.00 0.00 H new ATOM 0 HB3 ASN A 148 20.310 -10.724 2.304 1.00 0.00 H new ATOM 0 HD21 ASN A 148 20.485 -14.259 1.455 1.00 0.00 H new ATOM 0 HD22 ASN A 148 19.326 -12.934 1.604 1.00 0.00 H new ATOM 2328 N PRO A 149 22.782 -8.848 2.627 1.00 0.00 N ATOM 2329 CA PRO A 149 22.972 -7.482 2.124 1.00 0.00 C ATOM 2330 C PRO A 149 21.775 -7.000 1.316 1.00 0.00 C ATOM 2331 O PRO A 149 21.494 -5.803 1.251 1.00 0.00 O ATOM 2332 CB PRO A 149 24.210 -7.587 1.223 1.00 0.00 C ATOM 2333 CG PRO A 149 24.871 -8.864 1.611 1.00 0.00 C ATOM 2334 CD PRO A 149 23.773 -9.779 2.064 1.00 0.00 C ATOM 0 HA PRO A 149 23.086 -6.766 2.938 1.00 0.00 H new ATOM 0 HB2 PRO A 149 23.930 -7.593 0.169 1.00 0.00 H new ATOM 0 HB3 PRO A 149 24.877 -6.738 1.371 1.00 0.00 H new ATOM 0 HG2 PRO A 149 25.414 -9.293 0.769 1.00 0.00 H new ATOM 0 HG3 PRO A 149 25.596 -8.701 2.408 1.00 0.00 H new ATOM 0 HD2 PRO A 149 23.361 -10.356 1.236 1.00 0.00 H new ATOM 0 HD3 PRO A 149 24.124 -10.494 2.808 1.00 0.00 H new ATOM 2342 N ALA A 150 21.075 -7.944 0.700 1.00 0.00 N ATOM 2343 CA ALA A 150 19.905 -7.626 -0.110 1.00 0.00 C ATOM 2344 C ALA A 150 18.652 -7.473 0.750 1.00 0.00 C ATOM 2345 O ALA A 150 17.639 -6.944 0.292 1.00 0.00 O ATOM 2346 CB ALA A 150 19.691 -8.698 -1.167 1.00 0.00 C ATOM 0 H ALA A 150 21.297 -8.938 0.746 1.00 0.00 H new ATOM 0 HA ALA A 150 20.089 -6.671 -0.602 1.00 0.00 H new ATOM 0 HB1 ALA A 150 18.814 -8.449 -1.765 1.00 0.00 H new ATOM 0 HB2 ALA A 150 20.568 -8.752 -1.813 1.00 0.00 H new ATOM 0 HB3 ALA A 150 19.537 -9.662 -0.682 1.00 0.00 H new ATOM 2352 N LEU A 151 18.721 -7.938 1.996 1.00 0.00 N ATOM 2353 CA LEU A 151 17.584 -7.848 2.905 1.00 0.00 C ATOM 2354 C LEU A 151 17.562 -6.512 3.648 1.00 0.00 C ATOM 2355 O LEU A 151 16.754 -6.312 4.554 1.00 0.00 O ATOM 2356 CB LEU A 151 17.612 -9.003 3.908 1.00 0.00 C ATOM 2357 CG LEU A 151 17.351 -10.389 3.312 1.00 0.00 C ATOM 2358 CD1 LEU A 151 17.096 -11.405 4.415 1.00 0.00 C ATOM 2359 CD2 LEU A 151 16.176 -10.345 2.344 1.00 0.00 C ATOM 0 H LEU A 151 19.549 -8.379 2.396 1.00 0.00 H new ATOM 0 HA LEU A 151 16.677 -7.914 2.305 1.00 0.00 H new ATOM 0 HB2 LEU A 151 18.585 -9.013 4.399 1.00 0.00 H new ATOM 0 HB3 LEU A 151 16.867 -8.811 4.680 1.00 0.00 H new ATOM 0 HG LEU A 151 18.239 -10.696 2.759 1.00 0.00 H new ATOM 0 HD11 LEU A 151 16.912 -12.384 3.972 1.00 0.00 H new ATOM 0 HD12 LEU A 151 17.967 -11.459 5.068 1.00 0.00 H new ATOM 0 HD13 LEU A 151 16.225 -11.101 4.996 1.00 0.00 H new ATOM 0 HD21 LEU A 151 16.007 -11.340 1.931 1.00 0.00 H new ATOM 0 HD22 LEU A 151 15.282 -10.014 2.872 1.00 0.00 H new ATOM 0 HD23 LEU A 151 16.397 -9.649 1.535 1.00 0.00 H new ATOM 2371 N THR A 152 18.448 -5.599 3.261 1.00 0.00 N ATOM 2372 CA THR A 152 18.514 -4.288 3.895 1.00 0.00 C ATOM 2373 C THR A 152 17.400 -3.385 3.374 1.00 0.00 C ATOM 2374 O THR A 152 17.310 -3.126 2.174 1.00 0.00 O ATOM 2375 CB THR A 152 19.876 -3.640 3.643 1.00 0.00 C ATOM 2376 OG1 THR A 152 20.908 -4.609 3.689 1.00 0.00 O ATOM 2377 CG2 THR A 152 20.219 -2.557 4.644 1.00 0.00 C ATOM 0 H THR A 152 19.128 -5.743 2.514 1.00 0.00 H new ATOM 0 HA THR A 152 18.383 -4.421 4.969 1.00 0.00 H new ATOM 0 HB THR A 152 19.802 -3.188 2.654 1.00 0.00 H new ATOM 0 HG1 THR A 152 21.049 -4.980 2.793 1.00 0.00 H new ATOM 0 HG21 THR A 152 21.198 -2.139 4.407 1.00 0.00 H new ATOM 0 HG22 THR A 152 19.468 -1.769 4.599 1.00 0.00 H new ATOM 0 HG23 THR A 152 20.239 -2.982 5.647 1.00 0.00 H new ATOM 2385 N HIS A 153 16.550 -2.914 4.282 1.00 0.00 N ATOM 2386 CA HIS A 153 15.438 -2.046 3.907 1.00 0.00 C ATOM 2387 C HIS A 153 15.533 -0.698 4.612 1.00 0.00 C ATOM 2388 O HIS A 153 16.296 -0.534 5.564 1.00 0.00 O ATOM 2389 CB HIS A 153 14.097 -2.707 4.246 1.00 0.00 C ATOM 2390 CG HIS A 153 14.124 -4.204 4.193 1.00 0.00 C ATOM 2391 ND1 HIS A 153 13.639 -5.000 5.209 1.00 0.00 N ATOM 2392 CD2 HIS A 153 14.578 -5.050 3.238 1.00 0.00 C ATOM 2393 CE1 HIS A 153 13.793 -6.271 4.882 1.00 0.00 C ATOM 2394 NE2 HIS A 153 14.360 -6.328 3.691 1.00 0.00 N ATOM 0 H HIS A 153 16.609 -3.118 5.280 1.00 0.00 H new ATOM 0 HA HIS A 153 15.496 -1.884 2.831 1.00 0.00 H new ATOM 0 HB2 HIS A 153 13.792 -2.395 5.245 1.00 0.00 H new ATOM 0 HB3 HIS A 153 13.339 -2.343 3.553 1.00 0.00 H new ATOM 0 HD1 HIS A 153 13.226 -4.661 6.078 1.00 0.00 H new ATOM 0 HD2 HIS A 153 15.027 -4.772 2.296 1.00 0.00 H new ATOM 0 HE1 HIS A 153 13.504 -7.119 5.486 1.00 0.00 H new ATOM 2403 N THR A 154 14.748 0.263 4.138 1.00 0.00 N ATOM 2404 CA THR A 154 14.735 1.599 4.721 1.00 0.00 C ATOM 2405 C THR A 154 13.306 2.118 4.850 1.00 0.00 C ATOM 2406 O THR A 154 12.608 2.298 3.852 1.00 0.00 O ATOM 2407 CB THR A 154 15.564 2.560 3.868 1.00 0.00 C ATOM 2408 OG1 THR A 154 16.823 1.993 3.553 1.00 0.00 O ATOM 2409 CG2 THR A 154 15.816 3.892 4.541 1.00 0.00 C ATOM 0 H THR A 154 14.111 0.141 3.350 1.00 0.00 H new ATOM 0 HA THR A 154 15.175 1.540 5.717 1.00 0.00 H new ATOM 0 HB THR A 154 14.972 2.731 2.969 1.00 0.00 H new ATOM 0 HG1 THR A 154 17.338 2.622 3.006 1.00 0.00 H new ATOM 0 HG21 THR A 154 16.409 4.526 3.882 1.00 0.00 H new ATOM 0 HG22 THR A 154 14.864 4.379 4.752 1.00 0.00 H new ATOM 0 HG23 THR A 154 16.356 3.732 5.474 1.00 0.00 H new ATOM 2417 N TYR A 155 12.877 2.357 6.085 1.00 0.00 N ATOM 2418 CA TYR A 155 11.531 2.856 6.343 1.00 0.00 C ATOM 2419 C TYR A 155 11.520 4.379 6.395 1.00 0.00 C ATOM 2420 O TYR A 155 12.141 4.984 7.270 1.00 0.00 O ATOM 2421 CB TYR A 155 10.997 2.286 7.659 1.00 0.00 C ATOM 2422 CG TYR A 155 10.212 1.004 7.491 1.00 0.00 C ATOM 2423 CD1 TYR A 155 8.979 1.001 6.851 1.00 0.00 C ATOM 2424 CD2 TYR A 155 10.705 -0.202 7.973 1.00 0.00 C ATOM 2425 CE1 TYR A 155 8.259 -0.169 6.696 1.00 0.00 C ATOM 2426 CE2 TYR A 155 9.991 -1.375 7.821 1.00 0.00 C ATOM 2427 CZ TYR A 155 8.770 -1.354 7.183 1.00 0.00 C ATOM 2428 OH TYR A 155 8.056 -2.520 7.030 1.00 0.00 O ATOM 0 H TYR A 155 13.441 2.213 6.922 1.00 0.00 H new ATOM 0 HA TYR A 155 10.886 2.532 5.526 1.00 0.00 H new ATOM 0 HB2 TYR A 155 11.835 2.103 8.332 1.00 0.00 H new ATOM 0 HB3 TYR A 155 10.361 3.031 8.136 1.00 0.00 H new ATOM 0 HD1 TYR A 155 8.577 1.927 6.468 1.00 0.00 H new ATOM 0 HD2 TYR A 155 11.661 -0.223 8.474 1.00 0.00 H new ATOM 0 HE1 TYR A 155 7.302 -0.155 6.196 1.00 0.00 H new ATOM 0 HE2 TYR A 155 10.388 -2.305 8.201 1.00 0.00 H new ATOM 0 HH TYR A 155 8.088 -2.803 6.092 1.00 0.00 H new ATOM 2438 N GLU A 156 10.817 4.995 5.450 1.00 0.00 N ATOM 2439 CA GLU A 156 10.735 6.449 5.390 1.00 0.00 C ATOM 2440 C GLU A 156 9.288 6.925 5.463 1.00 0.00 C ATOM 2441 O GLU A 156 8.392 6.321 4.868 1.00 0.00 O ATOM 2442 CB GLU A 156 11.385 6.963 4.104 1.00 0.00 C ATOM 2443 CG GLU A 156 12.899 6.824 4.091 1.00 0.00 C ATOM 2444 CD GLU A 156 13.602 8.120 3.738 1.00 0.00 C ATOM 2445 OE1 GLU A 156 13.058 8.885 2.914 1.00 0.00 O ATOM 2446 OE2 GLU A 156 14.697 8.370 4.284 1.00 0.00 O ATOM 0 H GLU A 156 10.298 4.511 4.718 1.00 0.00 H new ATOM 0 HA GLU A 156 11.271 6.849 6.251 1.00 0.00 H new ATOM 0 HB2 GLU A 156 10.971 6.419 3.255 1.00 0.00 H new ATOM 0 HB3 GLU A 156 11.123 8.012 3.969 1.00 0.00 H new ATOM 0 HG2 GLU A 156 13.237 6.487 5.071 1.00 0.00 H new ATOM 0 HG3 GLU A 156 13.183 6.054 3.374 1.00 0.00 H new ATOM 2453 N VAL A 157 9.071 8.019 6.190 1.00 0.00 N ATOM 2454 CA VAL A 157 7.741 8.591 6.341 1.00 0.00 C ATOM 2455 C VAL A 157 7.655 9.936 5.629 1.00 0.00 C ATOM 2456 O VAL A 157 8.633 10.682 5.572 1.00 0.00 O ATOM 2457 CB VAL A 157 7.358 8.776 7.821 1.00 0.00 C ATOM 2458 CG1 VAL A 157 5.876 9.096 7.952 1.00 0.00 C ATOM 2459 CG2 VAL A 157 7.715 7.535 8.626 1.00 0.00 C ATOM 0 H VAL A 157 9.805 8.527 6.684 1.00 0.00 H new ATOM 0 HA VAL A 157 7.040 7.888 5.891 1.00 0.00 H new ATOM 0 HB VAL A 157 7.926 9.616 8.222 1.00 0.00 H new ATOM 0 HG11 VAL A 157 5.623 9.223 9.005 1.00 0.00 H new ATOM 0 HG12 VAL A 157 5.653 10.016 7.411 1.00 0.00 H new ATOM 0 HG13 VAL A 157 5.289 8.278 7.534 1.00 0.00 H new ATOM 0 HG21 VAL A 157 7.437 7.685 9.669 1.00 0.00 H new ATOM 0 HG22 VAL A 157 7.177 6.675 8.227 1.00 0.00 H new ATOM 0 HG23 VAL A 157 8.788 7.354 8.559 1.00 0.00 H new ATOM 2469 N TRP A 158 6.471 10.238 5.108 1.00 0.00 N ATOM 2470 CA TRP A 158 6.242 11.498 4.409 1.00 0.00 C ATOM 2471 C TRP A 158 4.820 12.003 4.617 1.00 0.00 C ATOM 2472 O TRP A 158 3.864 11.232 4.567 1.00 0.00 O ATOM 2473 CB TRP A 158 6.525 11.342 2.915 1.00 0.00 C ATOM 2474 CG TRP A 158 7.939 10.950 2.614 1.00 0.00 C ATOM 2475 CD1 TRP A 158 8.495 9.713 2.759 1.00 0.00 C ATOM 2476 CD2 TRP A 158 8.977 11.802 2.116 1.00 0.00 C ATOM 2477 NE1 TRP A 158 9.816 9.742 2.382 1.00 0.00 N ATOM 2478 CE2 TRP A 158 10.135 11.014 1.983 1.00 0.00 C ATOM 2479 CE3 TRP A 158 9.039 13.155 1.769 1.00 0.00 C ATOM 2480 CZ2 TRP A 158 11.341 11.534 1.518 1.00 0.00 C ATOM 2481 CZ3 TRP A 158 10.236 13.670 1.307 1.00 0.00 C ATOM 2482 CH2 TRP A 158 11.372 12.861 1.185 1.00 0.00 C ATOM 0 H TRP A 158 5.655 9.628 5.156 1.00 0.00 H new ATOM 0 HA TRP A 158 6.928 12.234 4.829 1.00 0.00 H new ATOM 0 HB2 TRP A 158 5.852 10.591 2.502 1.00 0.00 H new ATOM 0 HB3 TRP A 158 6.301 12.282 2.411 1.00 0.00 H new ATOM 0 HD1 TRP A 158 7.973 8.838 3.118 1.00 0.00 H new ATOM 0 HE1 TRP A 158 10.455 8.947 2.397 1.00 0.00 H new ATOM 0 HE3 TRP A 158 8.168 13.786 1.860 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 12.219 10.913 1.424 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 10.296 14.714 1.036 1.00 0.00 H new ATOM 0 HH2 TRP A 158 12.292 13.293 0.820 1.00 0.00 H new ATOM 2493 N GLN A 159 4.691 13.306 4.839 1.00 0.00 N ATOM 2494 CA GLN A 159 3.388 13.926 5.043 1.00 0.00 C ATOM 2495 C GLN A 159 3.284 15.222 4.246 1.00 0.00 C ATOM 2496 O GLN A 159 4.094 16.133 4.418 1.00 0.00 O ATOM 2497 CB GLN A 159 3.154 14.206 6.527 1.00 0.00 C ATOM 2498 CG GLN A 159 2.496 13.054 7.268 1.00 0.00 C ATOM 2499 CD GLN A 159 2.225 13.376 8.724 1.00 0.00 C ATOM 2500 OE1 GLN A 159 2.910 12.881 9.620 1.00 0.00 O ATOM 2501 NE2 GLN A 159 1.220 14.210 8.969 1.00 0.00 N ATOM 0 H GLN A 159 5.476 13.955 4.882 1.00 0.00 H new ATOM 0 HA GLN A 159 2.622 13.234 4.692 1.00 0.00 H new ATOM 0 HB2 GLN A 159 4.109 14.433 7.000 1.00 0.00 H new ATOM 0 HB3 GLN A 159 2.530 15.094 6.626 1.00 0.00 H new ATOM 0 HG2 GLN A 159 1.558 12.799 6.775 1.00 0.00 H new ATOM 0 HG3 GLN A 159 3.137 12.175 7.208 1.00 0.00 H new ATOM 0 HE21 GLN A 159 0.678 14.597 8.196 1.00 0.00 H new ATOM 0 HE22 GLN A 159 0.990 14.463 9.930 1.00 0.00 H new ATOM 2510 N LYS A 160 2.291 15.296 3.366 1.00 0.00 N ATOM 2511 CA LYS A 160 2.093 16.478 2.534 1.00 0.00 C ATOM 2512 C LYS A 160 1.896 17.727 3.387 1.00 0.00 C ATOM 2513 O LYS A 160 1.291 17.673 4.458 1.00 0.00 O ATOM 2514 CB LYS A 160 0.886 16.283 1.615 1.00 0.00 C ATOM 2515 CG LYS A 160 0.773 17.338 0.527 1.00 0.00 C ATOM 2516 CD LYS A 160 -0.663 17.493 0.046 1.00 0.00 C ATOM 2517 CE LYS A 160 -1.115 18.944 0.095 1.00 0.00 C ATOM 2518 NZ LYS A 160 -0.244 19.826 -0.729 1.00 0.00 N ATOM 0 H LYS A 160 1.611 14.552 3.210 1.00 0.00 H new ATOM 0 HA LYS A 160 2.989 16.614 1.929 1.00 0.00 H new ATOM 0 HB2 LYS A 160 0.949 15.299 1.150 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -0.023 16.294 2.216 1.00 0.00 H new ATOM 0 HG2 LYS A 160 1.136 18.293 0.906 1.00 0.00 H new ATOM 0 HG3 LYS A 160 1.412 17.065 -0.313 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -0.748 17.119 -0.974 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -1.323 16.885 0.665 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -2.143 19.016 -0.260 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -1.109 19.291 1.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -0.802 20.625 -1.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 0.538 20.186 -0.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 0.142 19.284 -1.528 1.00 0.00 H new ATOM 2532 N LYS A 161 2.414 18.850 2.901 1.00 0.00 N ATOM 2533 CA LYS A 161 2.299 20.117 3.613 1.00 0.00 C ATOM 2534 C LYS A 161 0.851 20.594 3.648 1.00 0.00 C ATOM 2535 O LYS A 161 0.200 20.711 2.609 1.00 0.00 O ATOM 2536 CB LYS A 161 3.182 21.178 2.954 1.00 0.00 C ATOM 2537 CG LYS A 161 4.663 20.835 2.973 1.00 0.00 C ATOM 2538 CD LYS A 161 5.425 21.597 1.901 1.00 0.00 C ATOM 2539 CE LYS A 161 5.727 23.021 2.338 1.00 0.00 C ATOM 2540 NZ LYS A 161 6.814 23.072 3.354 1.00 0.00 N ATOM 0 H LYS A 161 2.918 18.908 2.016 1.00 0.00 H new ATOM 0 HA LYS A 161 2.635 19.960 4.638 1.00 0.00 H new ATOM 0 HB2 LYS A 161 2.862 21.314 1.921 1.00 0.00 H new ATOM 0 HB3 LYS A 161 3.032 22.130 3.462 1.00 0.00 H new ATOM 0 HG2 LYS A 161 5.079 21.069 3.953 1.00 0.00 H new ATOM 0 HG3 LYS A 161 4.791 19.763 2.820 1.00 0.00 H new ATOM 0 HD2 LYS A 161 6.357 21.078 1.678 1.00 0.00 H new ATOM 0 HD3 LYS A 161 4.841 21.614 0.981 1.00 0.00 H new ATOM 0 HE2 LYS A 161 6.014 23.614 1.470 1.00 0.00 H new ATOM 0 HE3 LYS A 161 4.825 23.474 2.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 7.129 24.056 3.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 6.459 22.707 4.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 7.614 22.489 3.036 1.00 0.00 H new ATOM 2554 N ALA A 162 0.352 20.868 4.849 1.00 0.00 N ATOM 2555 CA ALA A 162 -1.020 21.333 5.019 1.00 0.00 C ATOM 2556 C ALA A 162 -2.016 20.316 4.474 1.00 0.00 C ATOM 2557 O ALA A 162 -2.255 20.321 3.248 1.00 0.00 O ATOM 2558 CB ALA A 162 -1.209 22.679 4.337 1.00 0.00 C ATOM 2559 OXT ALA A 162 -2.550 19.521 5.277 1.00 0.00 O ATOM 0 H ALA A 162 0.877 20.776 5.719 1.00 0.00 H new ATOM 0 HA ALA A 162 -1.208 21.450 6.086 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -2.237 23.014 4.472 1.00 0.00 H new ATOM 0 HB2 ALA A 162 -0.529 23.409 4.777 1.00 0.00 H new ATOM 0 HB3 ALA A 162 -0.996 22.581 3.273 1.00 0.00 H new TER 2565 ALA A 162 HETATM 2566 PA NDP A 170 -3.914 -3.031 -8.994 1.00 0.00 P HETATM 2567 O1A NDP A 170 -3.407 -1.867 -8.241 1.00 0.00 O HETATM 2568 O2A NDP A 170 -3.972 -4.327 -8.289 1.00 0.00 O HETATM 2569 O5B NDP A 170 -5.292 -2.701 -9.720 1.00 0.00 O HETATM 2570 C5B NDP A 170 -5.359 -1.706 -10.758 1.00 0.00 C HETATM 2571 C4B NDP A 170 -6.768 -1.603 -11.291 1.00 0.00 C HETATM 2572 O4B NDP A 170 -7.675 -1.308 -10.197 1.00 0.00 O HETATM 2573 C3B NDP A 170 -7.008 -0.487 -12.295 1.00 0.00 C HETATM 2574 O3B NDP A 170 -6.669 -0.907 -13.620 1.00 0.00 O HETATM 2575 C2B NDP A 170 -8.504 -0.243 -12.150 1.00 0.00 C HETATM 2576 O2B NDP A 170 -9.296 -1.166 -12.869 1.00 0.00 O HETATM 2577 C1B NDP A 170 -8.697 -0.434 -10.644 1.00 0.00 C HETATM 2578 N9A NDP A 170 -8.592 0.812 -9.887 1.00 0.00 N HETATM 2579 C8A NDP A 170 -7.450 1.496 -9.548 1.00 0.00 C HETATM 2580 N7A NDP A 170 -7.673 2.591 -8.863 1.00 0.00 N HETATM 2581 C5A NDP A 170 -9.055 2.632 -8.742 1.00 0.00 C HETATM 2582 C6A NDP A 170 -9.926 3.548 -8.121 1.00 0.00 C HETATM 2583 N6A NDP A 170 -9.514 4.644 -7.481 1.00 0.00 N HETATM 2584 N1A NDP A 170 -11.253 3.294 -8.182 1.00 0.00 N HETATM 2585 C2A NDP A 170 -11.668 2.193 -8.826 1.00 0.00 C HETATM 2586 N3A NDP A 170 -10.947 1.260 -9.448 1.00 0.00 N HETATM 2587 C4A NDP A 170 -9.634 1.542 -9.368 1.00 0.00 C HETATM 2588 O3 NDP A 170 -2.988 -3.216 -10.346 1.00 0.00 O HETATM 2589 PN NDP A 170 -1.906 -4.341 -10.878 1.00 0.00 P HETATM 2590 O1N NDP A 170 -2.594 -5.232 -11.832 1.00 0.00 O HETATM 2591 O2N NDP A 170 -0.698 -3.637 -11.350 1.00 0.00 O HETATM 2592 O5D NDP A 170 -1.649 -5.067 -9.483 1.00 0.00 O HETATM 2593 C5D NDP A 170 -0.750 -4.503 -8.511 1.00 0.00 C HETATM 2594 C4D NDP A 170 0.501 -5.342 -8.412 1.00 0.00 C HETATM 2595 O4D NDP A 170 1.434 -4.718 -7.492 1.00 0.00 O HETATM 2596 C3D NDP A 170 0.308 -6.745 -7.861 1.00 0.00 C HETATM 2597 O3D NDP A 170 -0.086 -7.651 -8.896 1.00 0.00 O HETATM 2598 C2D NDP A 170 1.699 -7.073 -7.335 1.00 0.00 C HETATM 2599 O2D NDP A 170 2.599 -7.505 -8.356 1.00 0.00 O HETATM 2600 C1D NDP A 170 2.140 -5.718 -6.776 1.00 0.00 C HETATM 2601 N1N NDP A 170 1.853 -5.546 -5.352 1.00 0.00 N HETATM 2602 C2N NDP A 170 2.680 -5.351 -4.331 1.00 0.00 C HETATM 2603 C3N NDP A 170 2.355 -5.156 -3.092 1.00 0.00 C HETATM 2604 C7N NDP A 170 3.537 -4.966 -2.298 1.00 0.00 C HETATM 2605 O7N NDP A 170 3.077 -4.674 -1.101 1.00 0.00 O HETATM 2606 N7N NDP A 170 4.849 -4.996 -2.639 1.00 0.00 N HETATM 2607 C4N NDP A 170 0.892 -5.152 -2.747 1.00 0.00 C HETATM 2608 C5N NDP A 170 -0.061 -5.361 -3.807 1.00 0.00 C HETATM 2609 C6N NDP A 170 0.329 -5.564 -5.123 1.00 0.00 C HETATM 2610 P2B NDP A 170 -9.307 -1.449 -14.515 1.00 0.00 P HETATM 2611 O1X NDP A 170 -10.870 -1.391 -14.727 1.00 0.00 O HETATM 2612 O2X NDP A 170 -8.677 -0.151 -15.020 1.00 0.00 O HETATM 2613 O3X NDP A 170 -8.842 -2.904 -14.547 1.00 0.00 O HETATM 0 HO3N NDP A 170 -0.753 -7.221 -9.471 1.00 0.00 H new HETATM 0 HO3A NDP A 170 -7.166 -0.369 -14.271 1.00 0.00 H new HETATM 0 HO2N NDP A 170 2.146 -7.478 -9.224 1.00 0.00 H new HETATM 0 H72N NDP A 170 5.564 -4.836 -1.930 1.00 0.00 H new HETATM 0 H71N NDP A 170 5.121 -5.179 -3.605 1.00 0.00 H new HETATM 0 H62A NDP A 170 -10.195 5.270 -7.051 1.00 0.00 H new HETATM 0 H61A NDP A 170 -8.518 4.856 -7.422 1.00 0.00 H new HETATM 0 H52N NDP A 170 -0.491 -3.482 -8.793 1.00 0.00 H new HETATM 0 H52A NDP A 170 -5.039 -0.740 -10.367 1.00 0.00 H new HETATM 0 H51N NDP A 170 -1.240 -4.451 -7.539 1.00 0.00 H new HETATM 0 H51A NDP A 170 -4.675 -1.966 -11.566 1.00 0.00 H new HETATM 0 H42N NDP A 170 0.726 -5.923 -1.994 1.00 0.00 H new HETATM 0 H41N NDP A 170 0.664 -4.195 -2.279 1.00 0.00 H new HETATM 0 H8A NDP A 170 -6.451 1.159 -9.823 1.00 0.00 H new HETATM 0 H6N NDP A 170 -0.386 -5.723 -5.931 1.00 0.00 H new HETATM 0 H5N NDP A 170 -1.124 -5.360 -3.567 1.00 0.00 H new HETATM 0 H4D NDP A 170 0.848 -5.411 -9.443 1.00 0.00 H new HETATM 0 H4B NDP A 170 -6.934 -2.561 -11.783 1.00 0.00 H new HETATM 0 H3D NDP A 170 -0.473 -6.821 -7.105 1.00 0.00 H new HETATM 0 H3B NDP A 170 -6.405 0.404 -12.120 1.00 0.00 H new HETATM 0 H2N NDP A 170 3.746 -5.356 -4.560 1.00 0.00 H new HETATM 0 H2D NDP A 170 1.694 -7.895 -6.619 1.00 0.00 H new HETATM 0 H2B NDP A 170 -8.810 0.727 -12.543 1.00 0.00 H new HETATM 0 H2A NDP A 170 -12.747 2.039 -8.843 1.00 0.00 H new HETATM 0 H1D NDP A 170 3.222 -5.649 -6.890 1.00 0.00 H new HETATM 0 H1B NDP A 170 -9.700 -0.827 -10.479 1.00 0.00 H new