USER MOD reduce.3.24.130724 H: found=0, std=0, add=1293, rem=0, adj=36 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 84:sc= -0.0064 USER MOD Set 1.2: A 170 NDP O2D : rot 83:sc= -1.02! USER MOD Set 2.1: A 116 THR OG1 : rot -134:sc= -0.908 USER MOD Set 2.2: A 155 TYR OH : rot 81:sc= 1.17 USER MOD Set 3.1: A 112 THR OG1 : rot -43:sc= 0.0789 USER MOD Set 3.2: A 159 GLN : amide:sc= 0.0797 X(o=0.16,f=0.52) USER MOD Set 4.1: A 89 HIS : no HD1:sc= 0.0428 K(o=0.23,f=-0.35) USER MOD Set 4.2: A 92 GLN : amide:sc= 0.183 X(o=0.23,f=-0.18) USER MOD Set 5.1: A 63 THR OG1 : rot 180:sc= -0.87 USER MOD Set 5.2: A 65 GLN : amide:sc=-0.00556 X(o=-0.88,f=-0.87) USER MOD Single : A 1 THR N :NH3+ 157:sc= 0.421 (180deg=-0.87) USER MOD Single : A 1 THR OG1 : rot 180:sc= -0.887 USER MOD Single : A 7 GLN :FLIP amide:sc= -4.12 F(o=-7.3,f=-4.1) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS : no HD1:sc= -0.144 X(o=-0.14,f=0.0048) USER MOD Single : A 22 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 28 HIS : no HD1:sc= -0.0582 X(o=-0.058,f=-0.28) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.225 X(o=-0.22,f=-0.03) USER MOD Single : A 34 THR OG1 : rot -80:sc= 0.00885 USER MOD Single : A 37 LYS NZ :NH3+ 147:sc= 0.229 (180deg=0.00641) USER MOD Single : A 39 MET CE :methyl -163:sc= -1.05 (180deg=-1.29) USER MOD Single : A 45 THR OG1 : rot -0:sc= -0.165 USER MOD Single : A 46 TYR OH : rot 91:sc= 1.3 USER MOD Single : A 48 SER OG : rot -54:sc= -0.0795 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= -5.23 K(o=-5.2,f=-10!) USER MOD Single : A 64 HIS :FLIP no HD1:sc= -0.43 F(o=-2.4,f=-0.43) USER MOD Single : A 68 TYR OH : rot 89:sc= 1.78 USER MOD Single : A 69 GLN : amide:sc= -0.266 K(o=-0.27,f=-0.82) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 HIS : no HE2:sc= -3.26 K(o=-3.3,f=-7.7!) USER MOD Single : A 85 TYR OH : rot 180:sc= -8.36! USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= -0.122 X(o=-0.12,f=-0.0025) USER MOD Single : A 101 GLN :FLIP amide:sc= -0.0979 F(o=-1.8!,f=-0.098) USER MOD Single : A 104 THR OG1 : rot 64:sc= -5.58! USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 SER OG : rot -170:sc= -0.357 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl -144:sc= -3.74! (180deg=-6.48!) USER MOD Single : A 132 ASN : amide:sc= -0.326 X(o=-0.33,f=0) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.0717 USER MOD Single : A 148 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 152 THR OG1 : rot 92:sc= 0.402 USER MOD Single : A 153 HIS : no HE2:sc= -8.9! C(o=-8.9!,f=-8.6!) USER MOD Single : A 154 THR OG1 : rot -150:sc= -0.621 USER MOD Single : A 160 LYS NZ :NH3+ -114:sc= 0.194 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 170 NDP O3B : rot 36:sc= -0.0439 USER MOD Single : A 170 NDP O3D : rot -42:sc= 0.00941 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -4.754 8.664 5.410 1.00 0.00 N ATOM 2 CA THR A 1 -4.377 8.420 3.993 1.00 0.00 C ATOM 3 C THR A 1 -2.869 8.244 3.847 1.00 0.00 C ATOM 4 O THR A 1 -2.140 9.210 3.623 1.00 0.00 O ATOM 5 CB THR A 1 -4.853 9.605 3.152 1.00 0.00 C ATOM 6 OG1 THR A 1 -4.609 10.828 3.825 1.00 0.00 O ATOM 7 CG2 THR A 1 -6.329 9.550 2.822 1.00 0.00 C ATOM 0 H1 THR A 1 -5.671 9.152 5.446 1.00 0.00 H new ATOM 0 H2 THR A 1 -4.825 7.756 5.912 1.00 0.00 H new ATOM 0 H3 THR A 1 -4.029 9.255 5.865 1.00 0.00 H new ATOM 0 HA THR A 1 -4.850 7.500 3.650 1.00 0.00 H new ATOM 0 HB THR A 1 -4.287 9.545 2.223 1.00 0.00 H new ATOM 0 HG1 THR A 1 -4.919 11.574 3.270 1.00 0.00 H new ATOM 0 HG21 THR A 1 -6.601 10.420 2.224 1.00 0.00 H new ATOM 0 HG22 THR A 1 -6.542 8.641 2.259 1.00 0.00 H new ATOM 0 HG23 THR A 1 -6.908 9.549 3.745 1.00 0.00 H new ATOM 17 N ALA A 2 -2.408 7.004 3.977 1.00 0.00 N ATOM 18 CA ALA A 2 -0.986 6.703 3.860 1.00 0.00 C ATOM 19 C ALA A 2 -0.751 5.506 2.945 1.00 0.00 C ATOM 20 O ALA A 2 -1.582 4.602 2.861 1.00 0.00 O ATOM 21 CB ALA A 2 -0.388 6.444 5.234 1.00 0.00 C ATOM 0 H ALA A 2 -2.998 6.193 4.163 1.00 0.00 H new ATOM 0 HA ALA A 2 -0.492 7.568 3.417 1.00 0.00 H new ATOM 0 HB1 ALA A 2 0.674 6.221 5.132 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -0.515 7.328 5.858 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -0.894 5.597 5.697 1.00 0.00 H new ATOM 27 N PHE A 3 0.389 5.507 2.262 1.00 0.00 N ATOM 28 CA PHE A 3 0.739 4.421 1.353 1.00 0.00 C ATOM 29 C PHE A 3 1.790 3.509 1.976 1.00 0.00 C ATOM 30 O PHE A 3 2.902 3.944 2.271 1.00 0.00 O ATOM 31 CB PHE A 3 1.268 4.983 0.030 1.00 0.00 C ATOM 32 CG PHE A 3 0.260 5.772 -0.764 1.00 0.00 C ATOM 33 CD1 PHE A 3 -1.072 5.838 -0.376 1.00 0.00 C ATOM 34 CD2 PHE A 3 0.653 6.451 -1.907 1.00 0.00 C ATOM 35 CE1 PHE A 3 -1.987 6.565 -1.114 1.00 0.00 C ATOM 36 CE2 PHE A 3 -0.259 7.178 -2.647 1.00 0.00 C ATOM 37 CZ PHE A 3 -1.579 7.236 -2.251 1.00 0.00 C ATOM 0 H PHE A 3 1.087 6.248 2.321 1.00 0.00 H new ATOM 0 HA PHE A 3 -0.163 3.839 1.162 1.00 0.00 H new ATOM 0 HB2 PHE A 3 2.126 5.621 0.239 1.00 0.00 H new ATOM 0 HB3 PHE A 3 1.627 4.156 -0.583 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -1.396 5.316 0.512 1.00 0.00 H new ATOM 0 HD2 PHE A 3 1.685 6.411 -2.223 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -3.020 6.609 -0.802 1.00 0.00 H new ATOM 0 HE2 PHE A 3 0.062 7.701 -3.536 1.00 0.00 H new ATOM 0 HZ PHE A 3 -2.292 7.805 -2.829 1.00 0.00 H new ATOM 47 N LEU A 4 1.436 2.243 2.172 1.00 0.00 N ATOM 48 CA LEU A 4 2.360 1.278 2.758 1.00 0.00 C ATOM 49 C LEU A 4 2.606 0.111 1.807 1.00 0.00 C ATOM 50 O LEU A 4 1.696 -0.666 1.516 1.00 0.00 O ATOM 51 CB LEU A 4 1.812 0.759 4.088 1.00 0.00 C ATOM 52 CG LEU A 4 2.665 -0.317 4.763 1.00 0.00 C ATOM 53 CD1 LEU A 4 4.106 0.151 4.902 1.00 0.00 C ATOM 54 CD2 LEU A 4 2.085 -0.677 6.122 1.00 0.00 C ATOM 0 H LEU A 4 0.520 1.862 1.935 1.00 0.00 H new ATOM 0 HA LEU A 4 3.309 1.784 2.936 1.00 0.00 H new ATOM 0 HB2 LEU A 4 1.706 1.600 4.773 1.00 0.00 H new ATOM 0 HB3 LEU A 4 0.813 0.357 3.920 1.00 0.00 H new ATOM 0 HG LEU A 4 2.656 -1.209 4.136 1.00 0.00 H new ATOM 0 HD11 LEU A 4 4.697 -0.628 5.384 1.00 0.00 H new ATOM 0 HD12 LEU A 4 4.518 0.360 3.915 1.00 0.00 H new ATOM 0 HD13 LEU A 4 4.138 1.057 5.507 1.00 0.00 H new ATOM 0 HD21 LEU A 4 2.703 -1.444 6.590 1.00 0.00 H new ATOM 0 HD22 LEU A 4 2.065 0.210 6.756 1.00 0.00 H new ATOM 0 HD23 LEU A 4 1.071 -1.055 5.996 1.00 0.00 H new ATOM 66 N TRP A 5 3.840 -0.009 1.326 1.00 0.00 N ATOM 67 CA TRP A 5 4.196 -1.088 0.409 1.00 0.00 C ATOM 68 C TRP A 5 5.705 -1.322 0.387 1.00 0.00 C ATOM 69 O TRP A 5 6.482 -0.475 0.829 1.00 0.00 O ATOM 70 CB TRP A 5 3.682 -0.777 -1.003 1.00 0.00 C ATOM 71 CG TRP A 5 4.582 0.124 -1.798 1.00 0.00 C ATOM 72 CD1 TRP A 5 5.556 -0.260 -2.674 1.00 0.00 C ATOM 73 CD2 TRP A 5 4.590 1.556 -1.791 1.00 0.00 C ATOM 74 NE1 TRP A 5 6.168 0.846 -3.213 1.00 0.00 N ATOM 75 CE2 TRP A 5 5.593 1.972 -2.687 1.00 0.00 C ATOM 76 CE3 TRP A 5 3.846 2.527 -1.116 1.00 0.00 C ATOM 77 CZ2 TRP A 5 5.869 3.316 -2.924 1.00 0.00 C ATOM 78 CZ3 TRP A 5 4.121 3.861 -1.353 1.00 0.00 C ATOM 79 CH2 TRP A 5 5.124 4.245 -2.251 1.00 0.00 C ATOM 0 H TRP A 5 4.607 0.624 1.554 1.00 0.00 H new ATOM 0 HA TRP A 5 3.721 -2.002 0.765 1.00 0.00 H new ATOM 0 HB2 TRP A 5 3.552 -1.714 -1.545 1.00 0.00 H new ATOM 0 HB3 TRP A 5 2.698 -0.314 -0.926 1.00 0.00 H new ATOM 0 HD1 TRP A 5 5.809 -1.283 -2.909 1.00 0.00 H new ATOM 0 HE1 TRP A 5 6.927 0.831 -3.894 1.00 0.00 H new ATOM 0 HE3 TRP A 5 3.070 2.241 -0.422 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 6.644 3.614 -3.615 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 3.552 4.620 -0.836 1.00 0.00 H new ATOM 0 HH2 TRP A 5 5.313 5.295 -2.416 1.00 0.00 H new ATOM 90 N ALA A 6 6.111 -2.475 -0.137 1.00 0.00 N ATOM 91 CA ALA A 6 7.527 -2.819 -0.225 1.00 0.00 C ATOM 92 C ALA A 6 8.035 -2.654 -1.654 1.00 0.00 C ATOM 93 O ALA A 6 7.304 -2.903 -2.612 1.00 0.00 O ATOM 94 CB ALA A 6 7.756 -4.243 0.259 1.00 0.00 C ATOM 0 H ALA A 6 5.480 -3.186 -0.507 1.00 0.00 H new ATOM 0 HA ALA A 6 8.086 -2.138 0.417 1.00 0.00 H new ATOM 0 HB1 ALA A 6 8.816 -4.485 0.188 1.00 0.00 H new ATOM 0 HB2 ALA A 6 7.433 -4.331 1.296 1.00 0.00 H new ATOM 0 HB3 ALA A 6 7.183 -4.934 -0.360 1.00 0.00 H new ATOM 100 N GLN A 7 9.288 -2.228 -1.795 1.00 0.00 N ATOM 101 CA GLN A 7 9.873 -2.030 -3.118 1.00 0.00 C ATOM 102 C GLN A 7 11.365 -2.343 -3.122 1.00 0.00 C ATOM 103 O GLN A 7 12.004 -2.386 -2.070 1.00 0.00 O ATOM 104 CB GLN A 7 9.646 -0.591 -3.584 1.00 0.00 C ATOM 105 CG GLN A 7 9.971 0.450 -2.525 1.00 0.00 C ATOM 106 CD GLN A 7 8.759 1.262 -2.112 1.00 0.00 C ATOM 107 OE1 GLN A 7 7.970 0.721 -1.191 1.00 0.00 O flip ATOM 108 NE2 GLN A 7 8.534 2.363 -2.615 1.00 0.00 N flip ATOM 0 H GLN A 7 9.913 -2.015 -1.017 1.00 0.00 H new ATOM 0 HA GLN A 7 9.380 -2.718 -3.805 1.00 0.00 H new ATOM 0 HB2 GLN A 7 10.258 -0.403 -4.466 1.00 0.00 H new ATOM 0 HB3 GLN A 7 8.605 -0.476 -3.887 1.00 0.00 H new ATOM 0 HG2 GLN A 7 10.386 -0.047 -1.648 1.00 0.00 H new ATOM 0 HG3 GLN A 7 10.741 1.121 -2.905 1.00 0.00 H new ATOM 0 HE21 GLN A 7 9.167 2.741 -3.320 1.00 0.00 H new ATOM 0 HE22 GLN A 7 7.714 2.897 -2.327 1.00 0.00 H new ATOM 117 N ASP A 8 11.916 -2.559 -4.315 1.00 0.00 N ATOM 118 CA ASP A 8 13.336 -2.864 -4.456 1.00 0.00 C ATOM 119 C ASP A 8 14.143 -1.593 -4.716 1.00 0.00 C ATOM 120 O ASP A 8 13.621 -0.483 -4.613 1.00 0.00 O ATOM 121 CB ASP A 8 13.559 -3.883 -5.579 1.00 0.00 C ATOM 122 CG ASP A 8 13.215 -3.333 -6.950 1.00 0.00 C ATOM 123 OD1 ASP A 8 12.803 -2.160 -7.032 1.00 0.00 O ATOM 124 OD2 ASP A 8 13.360 -4.079 -7.941 1.00 0.00 O ATOM 0 H ASP A 8 11.401 -2.528 -5.195 1.00 0.00 H new ATOM 0 HA ASP A 8 13.684 -3.301 -3.520 1.00 0.00 H new ATOM 0 HB2 ASP A 8 14.601 -4.202 -5.572 1.00 0.00 H new ATOM 0 HB3 ASP A 8 12.953 -4.768 -5.385 1.00 0.00 H new ATOM 129 N ARG A 9 15.423 -1.764 -5.032 1.00 0.00 N ATOM 130 CA ARG A 9 16.313 -0.632 -5.283 1.00 0.00 C ATOM 131 C ARG A 9 15.844 0.231 -6.455 1.00 0.00 C ATOM 132 O ARG A 9 16.180 1.412 -6.531 1.00 0.00 O ATOM 133 CB ARG A 9 17.738 -1.129 -5.536 1.00 0.00 C ATOM 134 CG ARG A 9 18.716 -0.742 -4.439 1.00 0.00 C ATOM 135 CD ARG A 9 20.144 -0.684 -4.957 1.00 0.00 C ATOM 136 NE ARG A 9 20.301 0.301 -6.026 1.00 0.00 N ATOM 137 CZ ARG A 9 20.302 0.004 -7.325 1.00 0.00 C ATOM 138 NH1 ARG A 9 20.135 -1.250 -7.731 1.00 0.00 N ATOM 139 NH2 ARG A 9 20.463 0.966 -8.222 1.00 0.00 N ATOM 0 H ARG A 9 15.869 -2.677 -5.121 1.00 0.00 H new ATOM 0 HA ARG A 9 16.295 -0.005 -4.392 1.00 0.00 H new ATOM 0 HB2 ARG A 9 17.724 -2.215 -5.634 1.00 0.00 H new ATOM 0 HB3 ARG A 9 18.092 -0.728 -6.486 1.00 0.00 H new ATOM 0 HG2 ARG A 9 18.438 0.229 -4.028 1.00 0.00 H new ATOM 0 HG3 ARG A 9 18.653 -1.463 -3.624 1.00 0.00 H new ATOM 0 HD2 ARG A 9 20.817 -0.438 -4.136 1.00 0.00 H new ATOM 0 HD3 ARG A 9 20.436 -1.668 -5.325 1.00 0.00 H new ATOM 0 HE ARG A 9 20.417 1.279 -5.760 1.00 0.00 H new ATOM 0 HH11 ARG A 9 20.005 -1.995 -7.046 1.00 0.00 H new ATOM 0 HH12 ARG A 9 20.137 -1.468 -8.727 1.00 0.00 H new ATOM 0 HH21 ARG A 9 20.586 1.932 -7.918 1.00 0.00 H new ATOM 0 HH22 ARG A 9 20.464 0.741 -9.217 1.00 0.00 H new ATOM 153 N ASP A 10 15.074 -0.352 -7.366 1.00 0.00 N ATOM 154 CA ASP A 10 14.581 0.390 -8.522 1.00 0.00 C ATOM 155 C ASP A 10 13.230 1.026 -8.218 1.00 0.00 C ATOM 156 O ASP A 10 12.921 2.120 -8.692 1.00 0.00 O ATOM 157 CB ASP A 10 14.461 -0.534 -9.735 1.00 0.00 C ATOM 158 CG ASP A 10 14.820 0.164 -11.032 1.00 0.00 C ATOM 159 OD1 ASP A 10 14.443 1.344 -11.196 1.00 0.00 O ATOM 160 OD2 ASP A 10 15.479 -0.468 -11.884 1.00 0.00 O ATOM 0 H ASP A 10 14.779 -1.328 -7.329 1.00 0.00 H new ATOM 0 HA ASP A 10 15.295 1.182 -8.748 1.00 0.00 H new ATOM 0 HB2 ASP A 10 15.113 -1.396 -9.597 1.00 0.00 H new ATOM 0 HB3 ASP A 10 13.441 -0.913 -9.800 1.00 0.00 H new ATOM 165 N GLY A 11 12.431 0.323 -7.431 1.00 0.00 N ATOM 166 CA GLY A 11 11.113 0.813 -7.073 1.00 0.00 C ATOM 167 C GLY A 11 10.026 -0.230 -7.269 1.00 0.00 C ATOM 168 O GLY A 11 8.846 0.054 -7.067 1.00 0.00 O ATOM 0 H GLY A 11 12.672 -0.584 -7.031 1.00 0.00 H new ATOM 0 HA2 GLY A 11 11.120 1.133 -6.031 1.00 0.00 H new ATOM 0 HA3 GLY A 11 10.881 1.691 -7.675 1.00 0.00 H new ATOM 172 N LEU A 12 10.424 -1.443 -7.656 1.00 0.00 N ATOM 173 CA LEU A 12 9.477 -2.535 -7.870 1.00 0.00 C ATOM 174 C LEU A 12 8.506 -2.646 -6.699 1.00 0.00 C ATOM 175 O LEU A 12 8.662 -1.968 -5.686 1.00 0.00 O ATOM 176 CB LEU A 12 10.235 -3.858 -8.035 1.00 0.00 C ATOM 177 CG LEU A 12 9.578 -4.898 -8.952 1.00 0.00 C ATOM 178 CD1 LEU A 12 9.289 -4.300 -10.320 1.00 0.00 C ATOM 179 CD2 LEU A 12 10.477 -6.118 -9.084 1.00 0.00 C ATOM 0 H LEU A 12 11.398 -1.693 -7.828 1.00 0.00 H new ATOM 0 HA LEU A 12 8.909 -2.324 -8.776 1.00 0.00 H new ATOM 0 HB2 LEU A 12 11.230 -3.638 -8.422 1.00 0.00 H new ATOM 0 HB3 LEU A 12 10.368 -4.304 -7.049 1.00 0.00 H new ATOM 0 HG LEU A 12 8.631 -5.205 -8.508 1.00 0.00 H new ATOM 0 HD11 LEU A 12 8.823 -5.053 -10.955 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.615 -3.450 -10.211 1.00 0.00 H new ATOM 0 HD13 LEU A 12 10.221 -3.967 -10.776 1.00 0.00 H new ATOM 0 HD21 LEU A 12 10.002 -6.851 -9.737 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.435 -5.820 -9.510 1.00 0.00 H new ATOM 0 HD23 LEU A 12 10.639 -6.559 -8.100 1.00 0.00 H new ATOM 191 N ILE A 13 7.532 -3.531 -6.830 1.00 0.00 N ATOM 192 CA ILE A 13 6.562 -3.771 -5.771 1.00 0.00 C ATOM 193 C ILE A 13 6.017 -5.189 -5.879 1.00 0.00 C ATOM 194 O ILE A 13 5.766 -5.852 -4.876 1.00 0.00 O ATOM 195 CB ILE A 13 5.402 -2.746 -5.783 1.00 0.00 C ATOM 196 CG1 ILE A 13 4.509 -2.911 -7.018 1.00 0.00 C ATOM 197 CG2 ILE A 13 5.954 -1.330 -5.718 1.00 0.00 C ATOM 198 CD1 ILE A 13 3.045 -2.646 -6.735 1.00 0.00 C ATOM 0 H ILE A 13 7.390 -4.100 -7.665 1.00 0.00 H new ATOM 0 HA ILE A 13 7.082 -3.648 -4.821 1.00 0.00 H new ATOM 0 HB ILE A 13 4.785 -2.934 -4.904 1.00 0.00 H new ATOM 0 HG12 ILE A 13 4.850 -2.231 -7.799 1.00 0.00 H new ATOM 0 HG13 ILE A 13 4.620 -3.924 -7.406 1.00 0.00 H new ATOM 0 HG21 ILE A 13 5.129 -0.617 -5.727 1.00 0.00 H new ATOM 0 HG22 ILE A 13 6.531 -1.206 -4.801 1.00 0.00 H new ATOM 0 HG23 ILE A 13 6.598 -1.151 -6.579 1.00 0.00 H new ATOM 0 HD11 ILE A 13 2.468 -2.780 -7.650 1.00 0.00 H new ATOM 0 HD12 ILE A 13 2.689 -3.343 -5.976 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.923 -1.624 -6.375 1.00 0.00 H new ATOM 210 N GLY A 14 5.846 -5.648 -7.114 1.00 0.00 N ATOM 211 CA GLY A 14 5.338 -6.980 -7.350 1.00 0.00 C ATOM 212 C GLY A 14 5.877 -7.581 -8.631 1.00 0.00 C ATOM 213 O GLY A 14 6.623 -6.936 -9.367 1.00 0.00 O ATOM 0 H GLY A 14 6.053 -5.115 -7.959 1.00 0.00 H new ATOM 0 HA2 GLY A 14 5.603 -7.622 -6.510 1.00 0.00 H new ATOM 0 HA3 GLY A 14 4.249 -6.949 -7.396 1.00 0.00 H new ATOM 217 N LYS A 15 5.485 -8.816 -8.899 1.00 0.00 N ATOM 218 CA LYS A 15 5.909 -9.520 -10.101 1.00 0.00 C ATOM 219 C LYS A 15 4.705 -10.162 -10.781 1.00 0.00 C ATOM 220 O LYS A 15 4.655 -11.379 -10.966 1.00 0.00 O ATOM 221 CB LYS A 15 6.949 -10.588 -9.755 1.00 0.00 C ATOM 222 CG LYS A 15 6.510 -11.519 -8.637 1.00 0.00 C ATOM 223 CD LYS A 15 6.861 -12.967 -8.943 1.00 0.00 C ATOM 224 CE LYS A 15 5.744 -13.914 -8.533 1.00 0.00 C ATOM 225 NZ LYS A 15 6.221 -14.959 -7.586 1.00 0.00 N ATOM 0 H LYS A 15 4.867 -9.357 -8.294 1.00 0.00 H new ATOM 0 HA LYS A 15 6.362 -8.802 -10.785 1.00 0.00 H new ATOM 0 HB2 LYS A 15 7.163 -11.178 -10.646 1.00 0.00 H new ATOM 0 HB3 LYS A 15 7.879 -10.099 -9.466 1.00 0.00 H new ATOM 0 HG2 LYS A 15 6.987 -11.218 -7.704 1.00 0.00 H new ATOM 0 HG3 LYS A 15 5.434 -11.428 -8.489 1.00 0.00 H new ATOM 0 HD2 LYS A 15 7.058 -13.076 -10.009 1.00 0.00 H new ATOM 0 HD3 LYS A 15 7.778 -13.238 -8.420 1.00 0.00 H new ATOM 0 HE2 LYS A 15 4.938 -13.345 -8.070 1.00 0.00 H new ATOM 0 HE3 LYS A 15 5.328 -14.391 -9.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 5.430 -15.584 -7.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 6.973 -15.519 -8.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 6.594 -14.505 -6.728 1.00 0.00 H new ATOM 239 N ASP A 16 3.727 -9.332 -11.138 1.00 0.00 N ATOM 240 CA ASP A 16 2.505 -9.806 -11.784 1.00 0.00 C ATOM 241 C ASP A 16 1.575 -10.448 -10.760 1.00 0.00 C ATOM 242 O ASP A 16 0.845 -11.390 -11.070 1.00 0.00 O ATOM 243 CB ASP A 16 2.830 -10.805 -12.900 1.00 0.00 C ATOM 244 CG ASP A 16 1.949 -10.617 -14.119 1.00 0.00 C ATOM 245 OD1 ASP A 16 1.483 -9.480 -14.345 1.00 0.00 O ATOM 246 OD2 ASP A 16 1.726 -11.606 -14.849 1.00 0.00 O ATOM 0 H ASP A 16 3.758 -8.323 -10.990 1.00 0.00 H new ATOM 0 HA ASP A 16 2.001 -8.947 -12.227 1.00 0.00 H new ATOM 0 HB2 ASP A 16 3.875 -10.694 -13.190 1.00 0.00 H new ATOM 0 HB3 ASP A 16 2.710 -11.820 -12.521 1.00 0.00 H new ATOM 251 N GLY A 17 1.611 -9.928 -9.536 1.00 0.00 N ATOM 252 CA GLY A 17 0.772 -10.455 -8.475 1.00 0.00 C ATOM 253 C GLY A 17 1.014 -9.759 -7.149 1.00 0.00 C ATOM 254 O GLY A 17 0.095 -9.179 -6.569 1.00 0.00 O ATOM 0 H GLY A 17 2.208 -9.149 -9.260 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -0.276 -10.344 -8.755 1.00 0.00 H new ATOM 0 HA3 GLY A 17 0.961 -11.523 -8.362 1.00 0.00 H new ATOM 258 N HIS A 18 2.253 -9.815 -6.669 1.00 0.00 N ATOM 259 CA HIS A 18 2.616 -9.185 -5.403 1.00 0.00 C ATOM 260 C HIS A 18 4.120 -9.281 -5.161 1.00 0.00 C ATOM 261 O HIS A 18 4.872 -9.714 -6.034 1.00 0.00 O ATOM 262 CB HIS A 18 1.856 -9.843 -4.251 1.00 0.00 C ATOM 263 CG HIS A 18 2.209 -11.284 -4.048 1.00 0.00 C ATOM 264 ND1 HIS A 18 1.619 -12.311 -4.756 1.00 0.00 N ATOM 265 CD2 HIS A 18 3.098 -11.870 -3.211 1.00 0.00 C ATOM 266 CE1 HIS A 18 2.129 -13.464 -4.363 1.00 0.00 C ATOM 267 NE2 HIS A 18 3.029 -13.224 -3.428 1.00 0.00 N ATOM 0 H HIS A 18 3.024 -10.291 -7.138 1.00 0.00 H new ATOM 0 HA HIS A 18 2.343 -8.131 -5.454 1.00 0.00 H new ATOM 0 HB2 HIS A 18 2.060 -9.294 -3.332 1.00 0.00 H new ATOM 0 HB3 HIS A 18 0.785 -9.763 -4.440 1.00 0.00 H new ATOM 0 HD2 HIS A 18 3.741 -11.366 -2.505 1.00 0.00 H new ATOM 0 HE1 HIS A 18 1.856 -14.438 -4.742 1.00 0.00 H new ATOM 0 HE2 HIS A 18 3.584 -13.930 -2.945 1.00 0.00 H new ATOM 276 N LEU A 19 4.551 -8.877 -3.970 1.00 0.00 N ATOM 277 CA LEU A 19 5.965 -8.920 -3.616 1.00 0.00 C ATOM 278 C LEU A 19 6.462 -10.365 -3.534 1.00 0.00 C ATOM 279 O LEU A 19 6.004 -11.136 -2.691 1.00 0.00 O ATOM 280 CB LEU A 19 6.204 -8.211 -2.282 1.00 0.00 C ATOM 281 CG LEU A 19 5.333 -8.694 -1.120 1.00 0.00 C ATOM 282 CD1 LEU A 19 6.056 -9.768 -0.319 1.00 0.00 C ATOM 283 CD2 LEU A 19 4.950 -7.526 -0.224 1.00 0.00 C ATOM 0 H LEU A 19 3.942 -8.517 -3.235 1.00 0.00 H new ATOM 0 HA LEU A 19 6.524 -8.404 -4.397 1.00 0.00 H new ATOM 0 HB2 LEU A 19 7.251 -8.335 -2.006 1.00 0.00 H new ATOM 0 HB3 LEU A 19 6.036 -7.143 -2.421 1.00 0.00 H new ATOM 0 HG LEU A 19 4.421 -9.129 -1.530 1.00 0.00 H new ATOM 0 HD11 LEU A 19 5.421 -10.099 0.503 1.00 0.00 H new ATOM 0 HD12 LEU A 19 6.282 -10.615 -0.967 1.00 0.00 H new ATOM 0 HD13 LEU A 19 6.984 -9.360 0.081 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.331 -7.886 0.598 1.00 0.00 H new ATOM 0 HD22 LEU A 19 5.852 -7.064 0.177 1.00 0.00 H new ATOM 0 HD23 LEU A 19 4.392 -6.790 -0.804 1.00 0.00 H new ATOM 295 N PRO A 20 7.402 -10.757 -4.414 1.00 0.00 N ATOM 296 CA PRO A 20 7.945 -12.116 -4.434 1.00 0.00 C ATOM 297 C PRO A 20 9.050 -12.334 -3.402 1.00 0.00 C ATOM 298 O PRO A 20 9.387 -13.472 -3.077 1.00 0.00 O ATOM 299 CB PRO A 20 8.510 -12.231 -5.846 1.00 0.00 C ATOM 300 CG PRO A 20 8.942 -10.846 -6.190 1.00 0.00 C ATOM 301 CD PRO A 20 8.003 -9.912 -5.466 1.00 0.00 C ATOM 0 HA PRO A 20 7.188 -12.860 -4.186 1.00 0.00 H new ATOM 0 HB2 PRO A 20 9.347 -12.928 -5.883 1.00 0.00 H new ATOM 0 HB3 PRO A 20 7.759 -12.598 -6.545 1.00 0.00 H new ATOM 0 HG2 PRO A 20 9.974 -10.674 -5.883 1.00 0.00 H new ATOM 0 HG3 PRO A 20 8.898 -10.682 -7.267 1.00 0.00 H new ATOM 0 HD2 PRO A 20 8.535 -9.062 -5.040 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.244 -9.509 -6.137 1.00 0.00 H new ATOM 309 N TRP A 21 9.615 -11.243 -2.892 1.00 0.00 N ATOM 310 CA TRP A 21 10.684 -11.335 -1.903 1.00 0.00 C ATOM 311 C TRP A 21 10.132 -11.717 -0.533 1.00 0.00 C ATOM 312 O TRP A 21 9.025 -11.324 -0.166 1.00 0.00 O ATOM 313 CB TRP A 21 11.446 -10.010 -1.812 1.00 0.00 C ATOM 314 CG TRP A 21 10.556 -8.808 -1.733 1.00 0.00 C ATOM 315 CD1 TRP A 21 9.648 -8.524 -0.755 1.00 0.00 C ATOM 316 CD2 TRP A 21 10.487 -7.729 -2.672 1.00 0.00 C ATOM 317 NE1 TRP A 21 9.022 -7.331 -1.024 1.00 0.00 N ATOM 318 CE2 TRP A 21 9.519 -6.824 -2.197 1.00 0.00 C ATOM 319 CE3 TRP A 21 11.152 -7.439 -3.867 1.00 0.00 C ATOM 320 CZ2 TRP A 21 9.199 -5.651 -2.876 1.00 0.00 C ATOM 321 CZ3 TRP A 21 10.833 -6.274 -4.540 1.00 0.00 C ATOM 322 CH2 TRP A 21 9.865 -5.393 -4.043 1.00 0.00 C ATOM 0 H TRP A 21 9.352 -10.291 -3.145 1.00 0.00 H new ATOM 0 HA TRP A 21 11.372 -12.117 -2.225 1.00 0.00 H new ATOM 0 HB2 TRP A 21 12.091 -10.032 -0.934 1.00 0.00 H new ATOM 0 HB3 TRP A 21 12.095 -9.914 -2.682 1.00 0.00 H new ATOM 0 HD1 TRP A 21 9.450 -9.146 0.105 1.00 0.00 H new ATOM 0 HE1 TRP A 21 8.305 -6.894 -0.446 1.00 0.00 H new ATOM 0 HE3 TRP A 21 11.901 -8.112 -4.257 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 8.452 -4.970 -2.495 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 11.339 -6.040 -5.465 1.00 0.00 H new ATOM 0 HH2 TRP A 21 9.639 -4.491 -4.592 1.00 0.00 H new ATOM 333 N HIS A 22 10.913 -12.488 0.217 1.00 0.00 N ATOM 334 CA HIS A 22 10.505 -12.928 1.547 1.00 0.00 C ATOM 335 C HIS A 22 10.833 -11.870 2.595 1.00 0.00 C ATOM 336 O HIS A 22 11.932 -11.848 3.148 1.00 0.00 O ATOM 337 CB HIS A 22 11.195 -14.246 1.903 1.00 0.00 C ATOM 338 CG HIS A 22 10.368 -15.138 2.777 1.00 0.00 C ATOM 339 ND1 HIS A 22 9.519 -16.104 2.278 1.00 0.00 N ATOM 340 CD2 HIS A 22 10.264 -15.208 4.125 1.00 0.00 C ATOM 341 CE1 HIS A 22 8.928 -16.728 3.281 1.00 0.00 C ATOM 342 NE2 HIS A 22 9.363 -16.204 4.412 1.00 0.00 N ATOM 0 H HIS A 22 11.832 -12.821 -0.074 1.00 0.00 H new ATOM 0 HA HIS A 22 9.426 -13.081 1.537 1.00 0.00 H new ATOM 0 HB2 HIS A 22 11.441 -14.778 0.984 1.00 0.00 H new ATOM 0 HB3 HIS A 22 12.137 -14.029 2.407 1.00 0.00 H new ATOM 0 HD2 HIS A 22 10.791 -14.595 4.841 1.00 0.00 H new ATOM 0 HE1 HIS A 22 8.211 -17.530 3.191 1.00 0.00 H new ATOM 0 HE2 HIS A 22 9.076 -16.492 5.347 1.00 0.00 H new ATOM 351 N LEU A 23 9.871 -10.992 2.861 1.00 0.00 N ATOM 352 CA LEU A 23 10.052 -9.929 3.838 1.00 0.00 C ATOM 353 C LEU A 23 9.339 -10.262 5.148 1.00 0.00 C ATOM 354 O LEU A 23 8.198 -9.855 5.364 1.00 0.00 O ATOM 355 CB LEU A 23 9.526 -8.609 3.271 1.00 0.00 C ATOM 356 CG LEU A 23 10.572 -7.504 3.151 1.00 0.00 C ATOM 357 CD1 LEU A 23 11.583 -7.842 2.066 1.00 0.00 C ATOM 358 CD2 LEU A 23 9.906 -6.164 2.870 1.00 0.00 C ATOM 0 H LEU A 23 8.956 -10.998 2.411 1.00 0.00 H new ATOM 0 HA LEU A 23 11.117 -9.831 4.049 1.00 0.00 H new ATOM 0 HB2 LEU A 23 9.101 -8.797 2.285 1.00 0.00 H new ATOM 0 HB3 LEU A 23 8.714 -8.254 3.906 1.00 0.00 H new ATOM 0 HG LEU A 23 11.103 -7.427 4.100 1.00 0.00 H new ATOM 0 HD11 LEU A 23 12.321 -7.043 1.995 1.00 0.00 H new ATOM 0 HD12 LEU A 23 12.084 -8.778 2.314 1.00 0.00 H new ATOM 0 HD13 LEU A 23 11.069 -7.948 1.110 1.00 0.00 H new ATOM 0 HD21 LEU A 23 10.668 -5.389 2.788 1.00 0.00 H new ATOM 0 HD22 LEU A 23 9.347 -6.224 1.936 1.00 0.00 H new ATOM 0 HD23 LEU A 23 9.225 -5.918 3.685 1.00 0.00 H new ATOM 370 N PRO A 24 10.005 -11.010 6.045 1.00 0.00 N ATOM 371 CA PRO A 24 9.426 -11.395 7.338 1.00 0.00 C ATOM 372 C PRO A 24 9.152 -10.191 8.232 1.00 0.00 C ATOM 373 O PRO A 24 8.090 -10.090 8.847 1.00 0.00 O ATOM 374 CB PRO A 24 10.499 -12.293 7.964 1.00 0.00 C ATOM 375 CG PRO A 24 11.764 -11.921 7.271 1.00 0.00 C ATOM 376 CD PRO A 24 11.370 -11.538 5.874 1.00 0.00 C ATOM 0 HA PRO A 24 8.461 -11.887 7.218 1.00 0.00 H new ATOM 0 HB2 PRO A 24 10.574 -12.128 9.039 1.00 0.00 H new ATOM 0 HB3 PRO A 24 10.265 -13.348 7.819 1.00 0.00 H new ATOM 0 HG2 PRO A 24 12.258 -11.093 7.778 1.00 0.00 H new ATOM 0 HG3 PRO A 24 12.466 -12.755 7.264 1.00 0.00 H new ATOM 0 HD2 PRO A 24 12.043 -10.789 5.456 1.00 0.00 H new ATOM 0 HD3 PRO A 24 11.389 -12.395 5.200 1.00 0.00 H new ATOM 384 N ASP A 25 10.117 -9.280 8.302 1.00 0.00 N ATOM 385 CA ASP A 25 9.986 -8.086 9.119 1.00 0.00 C ATOM 386 C ASP A 25 8.843 -7.202 8.627 1.00 0.00 C ATOM 387 O ASP A 25 8.274 -6.425 9.395 1.00 0.00 O ATOM 388 CB ASP A 25 11.298 -7.304 9.100 1.00 0.00 C ATOM 389 CG ASP A 25 11.852 -7.128 7.699 1.00 0.00 C ATOM 390 OD1 ASP A 25 12.565 -8.037 7.225 1.00 0.00 O ATOM 391 OD2 ASP A 25 11.574 -6.081 7.078 1.00 0.00 O ATOM 0 H ASP A 25 11.001 -9.350 7.799 1.00 0.00 H new ATOM 0 HA ASP A 25 9.758 -8.392 10.140 1.00 0.00 H new ATOM 0 HB2 ASP A 25 11.139 -6.324 9.550 1.00 0.00 H new ATOM 0 HB3 ASP A 25 12.034 -7.821 9.715 1.00 0.00 H new ATOM 396 N ASP A 26 8.512 -7.321 7.345 1.00 0.00 N ATOM 397 CA ASP A 26 7.438 -6.528 6.757 1.00 0.00 C ATOM 398 C ASP A 26 6.071 -7.091 7.133 1.00 0.00 C ATOM 399 O ASP A 26 5.173 -6.349 7.532 1.00 0.00 O ATOM 400 CB ASP A 26 7.584 -6.485 5.235 1.00 0.00 C ATOM 401 CG ASP A 26 7.067 -5.190 4.640 1.00 0.00 C ATOM 402 OD1 ASP A 26 7.782 -4.169 4.724 1.00 0.00 O ATOM 403 OD2 ASP A 26 5.946 -5.196 4.089 1.00 0.00 O ATOM 0 H ASP A 26 8.971 -7.958 6.694 1.00 0.00 H new ATOM 0 HA ASP A 26 7.512 -5.515 7.153 1.00 0.00 H new ATOM 0 HB2 ASP A 26 8.634 -6.609 4.970 1.00 0.00 H new ATOM 0 HB3 ASP A 26 7.043 -7.324 4.797 1.00 0.00 H new ATOM 408 N LEU A 27 5.920 -8.405 7.004 1.00 0.00 N ATOM 409 CA LEU A 27 4.661 -9.066 7.330 1.00 0.00 C ATOM 410 C LEU A 27 4.273 -8.815 8.784 1.00 0.00 C ATOM 411 O LEU A 27 3.205 -8.272 9.067 1.00 0.00 O ATOM 412 CB LEU A 27 4.767 -10.571 7.076 1.00 0.00 C ATOM 413 CG LEU A 27 5.386 -10.962 5.732 1.00 0.00 C ATOM 414 CD1 LEU A 27 6.295 -12.171 5.894 1.00 0.00 C ATOM 415 CD2 LEU A 27 4.297 -11.243 4.709 1.00 0.00 C ATOM 0 H LEU A 27 6.654 -9.033 6.676 1.00 0.00 H new ATOM 0 HA LEU A 27 3.887 -8.648 6.687 1.00 0.00 H new ATOM 0 HB2 LEU A 27 5.360 -11.017 7.875 1.00 0.00 H new ATOM 0 HB3 LEU A 27 3.769 -11.005 7.139 1.00 0.00 H new ATOM 0 HG LEU A 27 5.989 -10.128 5.373 1.00 0.00 H new ATOM 0 HD11 LEU A 27 6.726 -12.434 4.928 1.00 0.00 H new ATOM 0 HD12 LEU A 27 7.095 -11.934 6.596 1.00 0.00 H new ATOM 0 HD13 LEU A 27 5.717 -13.013 6.275 1.00 0.00 H new ATOM 0 HD21 LEU A 27 4.753 -11.520 3.759 1.00 0.00 H new ATOM 0 HD22 LEU A 27 3.669 -12.061 5.062 1.00 0.00 H new ATOM 0 HD23 LEU A 27 3.687 -10.350 4.572 1.00 0.00 H new ATOM 427 N HIS A 28 5.147 -9.217 9.701 1.00 0.00 N ATOM 428 CA HIS A 28 4.899 -9.041 11.129 1.00 0.00 C ATOM 429 C HIS A 28 4.524 -7.596 11.451 1.00 0.00 C ATOM 430 O HIS A 28 3.596 -7.343 12.219 1.00 0.00 O ATOM 431 CB HIS A 28 6.134 -9.449 11.935 1.00 0.00 C ATOM 432 CG HIS A 28 5.862 -9.625 13.397 1.00 0.00 C ATOM 433 ND1 HIS A 28 4.629 -9.992 13.895 1.00 0.00 N ATOM 434 CD2 HIS A 28 6.672 -9.484 14.473 1.00 0.00 C ATOM 435 CE1 HIS A 28 4.693 -10.067 15.212 1.00 0.00 C ATOM 436 NE2 HIS A 28 5.921 -9.764 15.588 1.00 0.00 N ATOM 0 H HIS A 28 6.035 -9.668 9.481 1.00 0.00 H new ATOM 0 HA HIS A 28 4.061 -9.681 11.404 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.529 -10.382 11.532 1.00 0.00 H new ATOM 0 HB3 HIS A 28 6.908 -8.693 11.806 1.00 0.00 H new ATOM 0 HD2 HIS A 28 7.715 -9.203 14.457 1.00 0.00 H new ATOM 0 HE1 HIS A 28 3.878 -10.332 15.870 1.00 0.00 H new ATOM 0 HE2 HIS A 28 6.258 -9.741 16.551 1.00 0.00 H new ATOM 445 N TYR A 29 5.251 -6.654 10.860 1.00 0.00 N ATOM 446 CA TYR A 29 4.993 -5.237 11.086 1.00 0.00 C ATOM 447 C TYR A 29 3.719 -4.793 10.375 1.00 0.00 C ATOM 448 O TYR A 29 2.995 -3.926 10.862 1.00 0.00 O ATOM 449 CB TYR A 29 6.178 -4.398 10.604 1.00 0.00 C ATOM 450 CG TYR A 29 6.210 -3.002 11.187 1.00 0.00 C ATOM 451 CD1 TYR A 29 6.206 -2.803 12.562 1.00 0.00 C ATOM 452 CD2 TYR A 29 6.243 -1.885 10.362 1.00 0.00 C ATOM 453 CE1 TYR A 29 6.234 -1.530 13.098 1.00 0.00 C ATOM 454 CE2 TYR A 29 6.272 -0.609 10.891 1.00 0.00 C ATOM 455 CZ TYR A 29 6.268 -0.436 12.258 1.00 0.00 C ATOM 456 OH TYR A 29 6.296 0.833 12.789 1.00 0.00 O ATOM 0 H TYR A 29 6.023 -6.846 10.221 1.00 0.00 H new ATOM 0 HA TYR A 29 4.860 -5.086 12.157 1.00 0.00 H new ATOM 0 HB2 TYR A 29 7.104 -4.911 10.862 1.00 0.00 H new ATOM 0 HB3 TYR A 29 6.144 -4.328 9.517 1.00 0.00 H new ATOM 0 HD1 TYR A 29 6.181 -3.657 13.222 1.00 0.00 H new ATOM 0 HD2 TYR A 29 6.246 -2.016 9.290 1.00 0.00 H new ATOM 0 HE1 TYR A 29 6.229 -1.392 14.169 1.00 0.00 H new ATOM 0 HE2 TYR A 29 6.298 0.249 10.236 1.00 0.00 H new ATOM 0 HH TYR A 29 6.319 1.491 12.063 1.00 0.00 H new ATOM 466 N PHE A 30 3.452 -5.393 9.219 1.00 0.00 N ATOM 467 CA PHE A 30 2.265 -5.059 8.438 1.00 0.00 C ATOM 468 C PHE A 30 0.992 -5.279 9.252 1.00 0.00 C ATOM 469 O PHE A 30 0.241 -4.340 9.514 1.00 0.00 O ATOM 470 CB PHE A 30 2.220 -5.900 7.160 1.00 0.00 C ATOM 471 CG PHE A 30 2.444 -5.102 5.907 1.00 0.00 C ATOM 472 CD1 PHE A 30 3.579 -4.321 5.761 1.00 0.00 C ATOM 473 CD2 PHE A 30 1.519 -5.134 4.875 1.00 0.00 C ATOM 474 CE1 PHE A 30 3.788 -3.587 4.609 1.00 0.00 C ATOM 475 CE2 PHE A 30 1.723 -4.402 3.721 1.00 0.00 C ATOM 476 CZ PHE A 30 2.858 -3.627 3.587 1.00 0.00 C ATOM 0 H PHE A 30 4.042 -6.113 8.802 1.00 0.00 H new ATOM 0 HA PHE A 30 2.322 -4.004 8.171 1.00 0.00 H new ATOM 0 HB2 PHE A 30 2.977 -6.682 7.223 1.00 0.00 H new ATOM 0 HB3 PHE A 30 1.252 -6.397 7.096 1.00 0.00 H new ATOM 0 HD1 PHE A 30 4.309 -4.285 6.556 1.00 0.00 H new ATOM 0 HD2 PHE A 30 0.629 -5.738 4.974 1.00 0.00 H new ATOM 0 HE1 PHE A 30 4.677 -2.983 4.507 1.00 0.00 H new ATOM 0 HE2 PHE A 30 0.995 -4.436 2.924 1.00 0.00 H new ATOM 0 HZ PHE A 30 3.019 -3.054 2.686 1.00 0.00 H new ATOM 486 N ARG A 31 0.756 -6.526 9.642 1.00 0.00 N ATOM 487 CA ARG A 31 -0.428 -6.875 10.421 1.00 0.00 C ATOM 488 C ARG A 31 -0.479 -6.090 11.728 1.00 0.00 C ATOM 489 O ARG A 31 -1.550 -5.676 12.172 1.00 0.00 O ATOM 490 CB ARG A 31 -0.443 -8.376 10.716 1.00 0.00 C ATOM 491 CG ARG A 31 -0.906 -9.223 9.543 1.00 0.00 C ATOM 492 CD ARG A 31 -0.222 -10.580 9.531 1.00 0.00 C ATOM 493 NE ARG A 31 -0.873 -11.529 10.432 1.00 0.00 N ATOM 494 CZ ARG A 31 -0.385 -12.734 10.718 1.00 0.00 C ATOM 495 NH1 ARG A 31 0.757 -13.140 10.178 1.00 0.00 N ATOM 496 NH2 ARG A 31 -1.040 -13.535 11.547 1.00 0.00 N ATOM 0 H ARG A 31 1.369 -7.314 9.432 1.00 0.00 H new ATOM 0 HA ARG A 31 -1.307 -6.615 9.831 1.00 0.00 H new ATOM 0 HB2 ARG A 31 0.559 -8.690 11.007 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -1.096 -8.564 11.569 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -1.986 -9.359 9.595 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -0.696 -8.700 8.610 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -0.228 -10.980 8.517 1.00 0.00 H new ATOM 0 HD3 ARG A 31 0.822 -10.462 9.821 1.00 0.00 H new ATOM 0 HE ARG A 31 -1.753 -11.252 10.867 1.00 0.00 H new ATOM 0 HH11 ARG A 31 1.266 -12.528 9.540 1.00 0.00 H new ATOM 0 HH12 ARG A 31 1.126 -14.064 10.401 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -1.918 -13.228 11.966 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -0.666 -14.458 11.766 1.00 0.00 H new ATOM 510 N ALA A 32 0.682 -5.896 12.343 1.00 0.00 N ATOM 511 CA ALA A 32 0.769 -5.168 13.605 1.00 0.00 C ATOM 512 C ALA A 32 0.386 -3.701 13.435 1.00 0.00 C ATOM 513 O ALA A 32 -0.156 -3.083 14.351 1.00 0.00 O ATOM 514 CB ALA A 32 2.171 -5.284 14.182 1.00 0.00 C ATOM 0 H ALA A 32 1.577 -6.233 11.988 1.00 0.00 H new ATOM 0 HA ALA A 32 0.058 -5.617 14.299 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.223 -4.737 15.123 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.406 -6.334 14.359 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.890 -4.865 13.478 1.00 0.00 H new ATOM 520 N GLN A 33 0.676 -3.144 12.264 1.00 0.00 N ATOM 521 CA GLN A 33 0.366 -1.746 11.987 1.00 0.00 C ATOM 522 C GLN A 33 -1.074 -1.582 11.506 1.00 0.00 C ATOM 523 O GLN A 33 -1.695 -0.542 11.724 1.00 0.00 O ATOM 524 CB GLN A 33 1.333 -1.185 10.941 1.00 0.00 C ATOM 525 CG GLN A 33 2.245 -0.095 11.480 1.00 0.00 C ATOM 526 CD GLN A 33 1.589 1.272 11.470 1.00 0.00 C ATOM 527 OE1 GLN A 33 1.526 1.950 12.495 1.00 0.00 O ATOM 528 NE2 GLN A 33 1.096 1.683 10.308 1.00 0.00 N ATOM 0 H GLN A 33 1.124 -3.638 11.493 1.00 0.00 H new ATOM 0 HA GLN A 33 0.480 -1.188 12.917 1.00 0.00 H new ATOM 0 HB2 GLN A 33 1.944 -1.998 10.550 1.00 0.00 H new ATOM 0 HB3 GLN A 33 0.759 -0.787 10.104 1.00 0.00 H new ATOM 0 HG2 GLN A 33 2.540 -0.345 12.499 1.00 0.00 H new ATOM 0 HG3 GLN A 33 3.156 -0.061 10.883 1.00 0.00 H new ATOM 0 HE21 GLN A 33 1.171 1.088 9.483 1.00 0.00 H new ATOM 0 HE22 GLN A 33 0.643 2.594 10.240 1.00 0.00 H new ATOM 537 N THR A 34 -1.600 -2.610 10.850 1.00 0.00 N ATOM 538 CA THR A 34 -2.966 -2.567 10.336 1.00 0.00 C ATOM 539 C THR A 34 -3.983 -3.005 11.390 1.00 0.00 C ATOM 540 O THR A 34 -5.082 -3.446 11.053 1.00 0.00 O ATOM 541 CB THR A 34 -3.092 -3.452 9.095 1.00 0.00 C ATOM 542 OG1 THR A 34 -2.592 -4.753 9.352 1.00 0.00 O ATOM 543 CG2 THR A 34 -2.355 -2.903 7.892 1.00 0.00 C ATOM 0 H THR A 34 -1.104 -3.481 10.661 1.00 0.00 H new ATOM 0 HA THR A 34 -3.183 -1.533 10.070 1.00 0.00 H new ATOM 0 HB THR A 34 -4.157 -3.479 8.866 1.00 0.00 H new ATOM 0 HG1 THR A 34 -1.614 -4.747 9.282 1.00 0.00 H new ATOM 0 HG21 THR A 34 -2.485 -3.578 7.046 1.00 0.00 H new ATOM 0 HG22 THR A 34 -2.755 -1.921 7.637 1.00 0.00 H new ATOM 0 HG23 THR A 34 -1.294 -2.813 8.125 1.00 0.00 H new ATOM 551 N VAL A 35 -3.620 -2.877 12.663 1.00 0.00 N ATOM 552 CA VAL A 35 -4.515 -3.258 13.748 1.00 0.00 C ATOM 553 C VAL A 35 -5.340 -2.066 14.219 1.00 0.00 C ATOM 554 O VAL A 35 -4.870 -1.246 15.007 1.00 0.00 O ATOM 555 CB VAL A 35 -3.741 -3.839 14.946 1.00 0.00 C ATOM 556 CG1 VAL A 35 -4.704 -4.385 15.990 1.00 0.00 C ATOM 557 CG2 VAL A 35 -2.777 -4.921 14.485 1.00 0.00 C ATOM 0 H VAL A 35 -2.716 -2.514 12.966 1.00 0.00 H new ATOM 0 HA VAL A 35 -5.179 -4.027 13.353 1.00 0.00 H new ATOM 0 HB VAL A 35 -3.161 -3.037 15.403 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -4.139 -4.791 16.829 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -5.351 -3.582 16.343 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -5.313 -5.173 15.547 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.239 -5.320 15.345 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -3.335 -5.723 14.002 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -2.065 -4.497 13.777 1.00 0.00 H new ATOM 567 N GLY A 36 -6.570 -1.977 13.727 1.00 0.00 N ATOM 568 CA GLY A 36 -7.441 -0.880 14.104 1.00 0.00 C ATOM 569 C GLY A 36 -7.496 0.207 13.049 1.00 0.00 C ATOM 570 O GLY A 36 -7.891 1.338 13.334 1.00 0.00 O ATOM 0 H GLY A 36 -6.980 -2.645 13.074 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.446 -1.263 14.280 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.094 -0.452 15.044 1.00 0.00 H new ATOM 574 N LYS A 37 -7.099 -0.133 11.825 1.00 0.00 N ATOM 575 CA LYS A 37 -7.107 0.827 10.727 1.00 0.00 C ATOM 576 C LYS A 37 -7.808 0.244 9.505 1.00 0.00 C ATOM 577 O LYS A 37 -8.314 -0.878 9.544 1.00 0.00 O ATOM 578 CB LYS A 37 -5.677 1.231 10.363 1.00 0.00 C ATOM 579 CG LYS A 37 -4.912 1.866 11.514 1.00 0.00 C ATOM 580 CD LYS A 37 -3.473 2.164 11.128 1.00 0.00 C ATOM 581 CE LYS A 37 -2.776 3.006 12.185 1.00 0.00 C ATOM 582 NZ LYS A 37 -2.193 2.167 13.269 1.00 0.00 N ATOM 0 H LYS A 37 -6.769 -1.064 11.570 1.00 0.00 H new ATOM 0 HA LYS A 37 -7.654 1.711 11.053 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -5.135 0.349 10.020 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -5.707 1.931 9.528 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -5.407 2.789 11.817 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -4.928 1.198 12.375 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -2.931 1.228 10.991 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -3.452 2.688 10.172 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -1.987 3.595 11.718 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -3.488 3.711 12.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -1.323 2.613 13.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -2.878 2.079 14.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -1.970 1.223 12.895 1.00 0.00 H new ATOM 596 N ILE A 38 -7.833 1.011 8.419 1.00 0.00 N ATOM 597 CA ILE A 38 -8.471 0.565 7.186 1.00 0.00 C ATOM 598 C ILE A 38 -7.469 0.546 6.037 1.00 0.00 C ATOM 599 O ILE A 38 -6.752 1.521 5.810 1.00 0.00 O ATOM 600 CB ILE A 38 -9.681 1.448 6.780 1.00 0.00 C ATOM 601 CG1 ILE A 38 -10.085 2.414 7.903 1.00 0.00 C ATOM 602 CG2 ILE A 38 -10.864 0.572 6.387 1.00 0.00 C ATOM 603 CD1 ILE A 38 -10.498 3.782 7.398 1.00 0.00 C ATOM 0 H ILE A 38 -7.420 1.942 8.368 1.00 0.00 H new ATOM 0 HA ILE A 38 -8.839 -0.442 7.384 1.00 0.00 H new ATOM 0 HB ILE A 38 -9.378 2.049 5.922 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -10.909 1.979 8.468 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -9.250 2.527 8.594 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -11.706 1.203 6.104 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -10.585 -0.059 5.544 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.148 -0.056 7.232 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -10.771 4.415 8.243 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -9.667 4.236 6.858 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -11.353 3.680 6.730 1.00 0.00 H new ATOM 615 N MET A 39 -7.422 -0.569 5.316 1.00 0.00 N ATOM 616 CA MET A 39 -6.502 -0.711 4.193 1.00 0.00 C ATOM 617 C MET A 39 -7.256 -0.849 2.873 1.00 0.00 C ATOM 618 O MET A 39 -8.004 -1.806 2.670 1.00 0.00 O ATOM 619 CB MET A 39 -5.595 -1.926 4.402 1.00 0.00 C ATOM 620 CG MET A 39 -4.579 -2.127 3.290 1.00 0.00 C ATOM 621 SD MET A 39 -4.028 -3.838 3.154 1.00 0.00 S ATOM 622 CE MET A 39 -5.517 -4.626 2.547 1.00 0.00 C ATOM 0 H MET A 39 -8.008 -1.386 5.488 1.00 0.00 H new ATOM 0 HA MET A 39 -5.892 0.191 4.145 1.00 0.00 H new ATOM 0 HB2 MET A 39 -5.067 -1.816 5.349 1.00 0.00 H new ATOM 0 HB3 MET A 39 -6.213 -2.820 4.484 1.00 0.00 H new ATOM 0 HG2 MET A 39 -5.017 -1.814 2.342 1.00 0.00 H new ATOM 0 HG3 MET A 39 -3.717 -1.485 3.470 1.00 0.00 H new ATOM 0 HE1 MET A 39 -5.445 -5.703 2.695 1.00 0.00 H new ATOM 0 HE2 MET A 39 -6.380 -4.242 3.091 1.00 0.00 H new ATOM 0 HE3 MET A 39 -5.634 -4.413 1.485 1.00 0.00 H new ATOM 632 N VAL A 40 -7.047 0.110 1.975 1.00 0.00 N ATOM 633 CA VAL A 40 -7.697 0.092 0.670 1.00 0.00 C ATOM 634 C VAL A 40 -6.901 -0.760 -0.313 1.00 0.00 C ATOM 635 O VAL A 40 -5.694 -0.577 -0.470 1.00 0.00 O ATOM 636 CB VAL A 40 -7.848 1.514 0.095 1.00 0.00 C ATOM 637 CG1 VAL A 40 -8.665 1.490 -1.188 1.00 0.00 C ATOM 638 CG2 VAL A 40 -8.482 2.443 1.121 1.00 0.00 C ATOM 0 H VAL A 40 -6.432 0.909 2.128 1.00 0.00 H new ATOM 0 HA VAL A 40 -8.689 -0.337 0.810 1.00 0.00 H new ATOM 0 HB VAL A 40 -6.855 1.895 -0.141 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -8.760 2.503 -1.578 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.165 0.863 -1.926 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.656 1.087 -0.981 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.580 3.442 0.696 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.468 2.066 1.393 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.853 2.487 2.010 1.00 0.00 H new ATOM 648 N VAL A 41 -7.580 -1.695 -0.968 1.00 0.00 N ATOM 649 CA VAL A 41 -6.928 -2.578 -1.927 1.00 0.00 C ATOM 650 C VAL A 41 -7.551 -2.443 -3.317 1.00 0.00 C ATOM 651 O VAL A 41 -8.752 -2.208 -3.449 1.00 0.00 O ATOM 652 CB VAL A 41 -6.987 -4.051 -1.454 1.00 0.00 C ATOM 653 CG1 VAL A 41 -8.236 -4.758 -1.967 1.00 0.00 C ATOM 654 CG2 VAL A 41 -5.730 -4.797 -1.876 1.00 0.00 C ATOM 0 H VAL A 41 -8.580 -1.861 -0.853 1.00 0.00 H new ATOM 0 HA VAL A 41 -5.882 -2.277 -1.991 1.00 0.00 H new ATOM 0 HB VAL A 41 -7.040 -4.048 -0.365 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -8.241 -5.789 -1.614 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -9.123 -4.243 -1.597 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -8.238 -4.748 -3.057 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -5.789 -5.831 -1.535 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -5.643 -4.777 -2.962 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.857 -4.318 -1.433 1.00 0.00 H new ATOM 664 N GLY A 42 -6.725 -2.589 -4.350 1.00 0.00 N ATOM 665 CA GLY A 42 -7.211 -2.476 -5.714 1.00 0.00 C ATOM 666 C GLY A 42 -7.920 -3.728 -6.187 1.00 0.00 C ATOM 667 O GLY A 42 -7.909 -4.751 -5.503 1.00 0.00 O ATOM 0 H GLY A 42 -5.727 -2.784 -4.266 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -7.893 -1.629 -5.783 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.373 -2.265 -6.378 1.00 0.00 H new ATOM 671 N ARG A 43 -8.544 -3.647 -7.358 1.00 0.00 N ATOM 672 CA ARG A 43 -9.265 -4.782 -7.916 1.00 0.00 C ATOM 673 C ARG A 43 -8.343 -5.988 -8.095 1.00 0.00 C ATOM 674 O ARG A 43 -8.561 -7.046 -7.500 1.00 0.00 O ATOM 675 CB ARG A 43 -9.912 -4.412 -9.254 1.00 0.00 C ATOM 676 CG ARG A 43 -9.141 -3.383 -10.068 1.00 0.00 C ATOM 677 CD ARG A 43 -9.277 -3.647 -11.558 1.00 0.00 C ATOM 678 NE ARG A 43 -10.626 -3.358 -12.038 1.00 0.00 N ATOM 679 CZ ARG A 43 -11.144 -3.872 -13.152 1.00 0.00 C ATOM 680 NH1 ARG A 43 -10.424 -4.687 -13.913 1.00 0.00 N ATOM 681 NH2 ARG A 43 -12.385 -3.569 -13.507 1.00 0.00 N ATOM 0 H ARG A 43 -8.564 -2.808 -7.937 1.00 0.00 H new ATOM 0 HA ARG A 43 -10.051 -5.052 -7.210 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -10.025 -5.317 -9.851 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -10.914 -4.028 -9.064 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -9.510 -2.383 -9.838 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -8.088 -3.407 -9.786 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -8.558 -3.035 -12.103 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -9.032 -4.688 -11.767 1.00 0.00 H new ATOM 0 HE ARG A 43 -11.206 -2.725 -11.487 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -9.468 -4.923 -13.646 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -10.826 -5.077 -14.765 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -12.943 -2.942 -12.927 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -12.782 -3.963 -14.360 1.00 0.00 H new ATOM 695 N ARG A 44 -7.313 -5.823 -8.915 1.00 0.00 N ATOM 696 CA ARG A 44 -6.359 -6.895 -9.172 1.00 0.00 C ATOM 697 C ARG A 44 -5.650 -7.323 -7.890 1.00 0.00 C ATOM 698 O ARG A 44 -5.064 -8.404 -7.828 1.00 0.00 O ATOM 699 CB ARG A 44 -5.328 -6.445 -10.209 1.00 0.00 C ATOM 700 CG ARG A 44 -5.722 -6.769 -11.641 1.00 0.00 C ATOM 701 CD ARG A 44 -6.867 -5.890 -12.121 1.00 0.00 C ATOM 702 NE ARG A 44 -8.045 -6.676 -12.481 1.00 0.00 N ATOM 703 CZ ARG A 44 -8.172 -7.337 -13.629 1.00 0.00 C ATOM 704 NH1 ARG A 44 -7.197 -7.311 -14.530 1.00 0.00 N ATOM 705 NH2 ARG A 44 -9.277 -8.028 -13.877 1.00 0.00 N ATOM 0 H ARG A 44 -7.116 -4.956 -9.414 1.00 0.00 H new ATOM 0 HA ARG A 44 -6.912 -7.751 -9.559 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -5.179 -5.369 -10.117 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.372 -6.920 -9.988 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -4.861 -6.634 -12.295 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -6.014 -7.817 -11.710 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -7.131 -5.179 -11.338 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -6.541 -5.309 -12.984 1.00 0.00 H new ATOM 0 HE ARG A 44 -8.815 -6.721 -11.813 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -6.345 -6.782 -14.344 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -7.300 -7.820 -15.408 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -10.029 -8.052 -13.188 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -9.375 -8.535 -14.757 1.00 0.00 H new ATOM 719 N THR A 45 -5.697 -6.469 -6.871 1.00 0.00 N ATOM 720 CA THR A 45 -5.047 -6.767 -5.601 1.00 0.00 C ATOM 721 C THR A 45 -5.887 -7.714 -4.747 1.00 0.00 C ATOM 722 O THR A 45 -5.390 -8.741 -4.286 1.00 0.00 O ATOM 723 CB THR A 45 -4.761 -5.476 -4.835 1.00 0.00 C ATOM 724 OG1 THR A 45 -4.404 -4.434 -5.725 1.00 0.00 O ATOM 725 CG2 THR A 45 -3.642 -5.619 -3.826 1.00 0.00 C ATOM 0 H THR A 45 -6.177 -5.569 -6.901 1.00 0.00 H new ATOM 0 HA THR A 45 -4.104 -7.267 -5.822 1.00 0.00 H new ATOM 0 HB THR A 45 -5.684 -5.243 -4.304 1.00 0.00 H new ATOM 0 HG1 THR A 45 -4.409 -4.773 -6.644 1.00 0.00 H new ATOM 0 HG21 THR A 45 -3.488 -4.668 -3.316 1.00 0.00 H new ATOM 0 HG22 THR A 45 -3.906 -6.384 -3.096 1.00 0.00 H new ATOM 0 HG23 THR A 45 -2.725 -5.908 -4.339 1.00 0.00 H new ATOM 733 N TYR A 46 -7.160 -7.375 -4.530 1.00 0.00 N ATOM 734 CA TYR A 46 -8.034 -8.224 -3.721 1.00 0.00 C ATOM 735 C TYR A 46 -7.976 -9.671 -4.205 1.00 0.00 C ATOM 736 O TYR A 46 -7.943 -10.604 -3.404 1.00 0.00 O ATOM 737 CB TYR A 46 -9.484 -7.704 -3.731 1.00 0.00 C ATOM 738 CG TYR A 46 -10.237 -7.938 -5.028 1.00 0.00 C ATOM 739 CD1 TYR A 46 -10.523 -9.224 -5.473 1.00 0.00 C ATOM 740 CD2 TYR A 46 -10.661 -6.870 -5.808 1.00 0.00 C ATOM 741 CE1 TYR A 46 -11.200 -9.439 -6.653 1.00 0.00 C ATOM 742 CE2 TYR A 46 -11.343 -7.078 -6.993 1.00 0.00 C ATOM 743 CZ TYR A 46 -11.608 -8.363 -7.412 1.00 0.00 C ATOM 744 OH TYR A 46 -12.285 -8.573 -8.593 1.00 0.00 O ATOM 0 H TYR A 46 -7.602 -6.532 -4.897 1.00 0.00 H new ATOM 0 HA TYR A 46 -7.675 -8.189 -2.692 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -10.032 -8.182 -2.918 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -9.473 -6.634 -3.522 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -10.208 -10.071 -4.882 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -10.455 -5.861 -5.484 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -11.410 -10.446 -6.982 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -11.666 -6.236 -7.587 1.00 0.00 H new ATOM 0 HH TYR A 46 -13.249 -8.586 -8.419 1.00 0.00 H new ATOM 754 N GLU A 47 -7.961 -9.848 -5.524 1.00 0.00 N ATOM 755 CA GLU A 47 -7.905 -11.179 -6.117 1.00 0.00 C ATOM 756 C GLU A 47 -6.486 -11.732 -6.067 1.00 0.00 C ATOM 757 O GLU A 47 -6.277 -12.945 -6.091 1.00 0.00 O ATOM 758 CB GLU A 47 -8.400 -11.136 -7.566 1.00 0.00 C ATOM 759 CG GLU A 47 -9.640 -11.978 -7.809 1.00 0.00 C ATOM 760 CD GLU A 47 -9.311 -13.369 -8.313 1.00 0.00 C ATOM 761 OE1 GLU A 47 -8.930 -14.225 -7.487 1.00 0.00 O ATOM 762 OE2 GLU A 47 -9.434 -13.604 -9.533 1.00 0.00 O ATOM 0 H GLU A 47 -7.987 -9.086 -6.201 1.00 0.00 H new ATOM 0 HA GLU A 47 -8.554 -11.838 -5.540 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -8.614 -10.102 -7.838 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -7.602 -11.480 -8.224 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -10.209 -12.056 -6.882 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -10.280 -11.475 -8.534 1.00 0.00 H new ATOM 769 N SER A 48 -5.516 -10.830 -5.995 1.00 0.00 N ATOM 770 CA SER A 48 -4.110 -11.219 -5.939 1.00 0.00 C ATOM 771 C SER A 48 -3.526 -10.976 -4.549 1.00 0.00 C ATOM 772 O SER A 48 -2.322 -10.764 -4.402 1.00 0.00 O ATOM 773 CB SER A 48 -3.305 -10.446 -6.985 1.00 0.00 C ATOM 774 OG SER A 48 -2.116 -11.137 -7.327 1.00 0.00 O ATOM 0 H SER A 48 -5.676 -9.823 -5.974 1.00 0.00 H new ATOM 0 HA SER A 48 -4.048 -12.286 -6.154 1.00 0.00 H new ATOM 0 HB2 SER A 48 -3.912 -10.297 -7.878 1.00 0.00 H new ATOM 0 HB3 SER A 48 -3.057 -9.457 -6.599 1.00 0.00 H new ATOM 0 HG SER A 48 -1.604 -11.330 -6.514 1.00 0.00 H new ATOM 780 N PHE A 49 -4.383 -11.007 -3.533 1.00 0.00 N ATOM 781 CA PHE A 49 -3.948 -10.789 -2.158 1.00 0.00 C ATOM 782 C PHE A 49 -3.770 -12.119 -1.425 1.00 0.00 C ATOM 783 O PHE A 49 -4.508 -13.074 -1.669 1.00 0.00 O ATOM 784 CB PHE A 49 -4.960 -9.912 -1.416 1.00 0.00 C ATOM 785 CG PHE A 49 -4.326 -8.891 -0.514 1.00 0.00 C ATOM 786 CD1 PHE A 49 -3.429 -7.961 -1.018 1.00 0.00 C ATOM 787 CD2 PHE A 49 -4.628 -8.861 0.837 1.00 0.00 C ATOM 788 CE1 PHE A 49 -2.847 -7.021 -0.189 1.00 0.00 C ATOM 789 CE2 PHE A 49 -4.049 -7.924 1.671 1.00 0.00 C ATOM 790 CZ PHE A 49 -3.157 -7.002 1.157 1.00 0.00 C ATOM 0 H PHE A 49 -5.383 -11.181 -3.636 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.985 -10.279 -2.182 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -5.588 -9.400 -2.145 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -5.616 -10.550 -0.824 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -3.183 -7.972 -2.069 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -5.325 -9.579 1.244 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -2.150 -6.302 -0.593 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -4.293 -7.912 2.723 1.00 0.00 H new ATOM 0 HZ PHE A 49 -2.703 -6.268 1.806 1.00 0.00 H new ATOM 800 N PRO A 50 -2.780 -12.200 -0.517 1.00 0.00 N ATOM 801 CA PRO A 50 -2.505 -13.421 0.244 1.00 0.00 C ATOM 802 C PRO A 50 -3.469 -13.621 1.411 1.00 0.00 C ATOM 803 O PRO A 50 -3.728 -14.750 1.826 1.00 0.00 O ATOM 804 CB PRO A 50 -1.087 -13.189 0.759 1.00 0.00 C ATOM 805 CG PRO A 50 -0.983 -11.711 0.913 1.00 0.00 C ATOM 806 CD PRO A 50 -1.846 -11.111 -0.168 1.00 0.00 C ATOM 0 HA PRO A 50 -2.620 -14.317 -0.366 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -0.921 -13.700 1.708 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -0.343 -13.568 0.058 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -1.323 -11.398 1.900 1.00 0.00 H new ATOM 0 HG3 PRO A 50 0.051 -11.381 0.813 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -2.376 -10.228 0.188 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -1.252 -10.802 -1.028 1.00 0.00 H new ATOM 814 N LYS A 51 -3.995 -12.520 1.940 1.00 0.00 N ATOM 815 CA LYS A 51 -4.926 -12.584 3.061 1.00 0.00 C ATOM 816 C LYS A 51 -6.103 -11.638 2.853 1.00 0.00 C ATOM 817 O LYS A 51 -6.093 -10.504 3.332 1.00 0.00 O ATOM 818 CB LYS A 51 -4.207 -12.241 4.367 1.00 0.00 C ATOM 819 CG LYS A 51 -4.793 -12.937 5.585 1.00 0.00 C ATOM 820 CD LYS A 51 -4.449 -14.418 5.600 1.00 0.00 C ATOM 821 CE LYS A 51 -5.265 -15.169 6.640 1.00 0.00 C ATOM 822 NZ LYS A 51 -5.653 -16.527 6.168 1.00 0.00 N ATOM 0 H LYS A 51 -3.793 -11.576 1.611 1.00 0.00 H new ATOM 0 HA LYS A 51 -5.311 -13.602 3.120 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -3.155 -12.512 4.275 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -4.246 -11.163 4.521 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -4.415 -12.465 6.492 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -5.876 -12.814 5.590 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -4.632 -14.845 4.614 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -3.387 -14.544 5.809 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -4.688 -15.256 7.561 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -6.162 -14.598 6.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -6.208 -17.006 6.906 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -6.225 -16.444 5.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -4.797 -17.081 5.964 1.00 0.00 H new ATOM 836 N ARG A 52 -7.118 -12.112 2.137 1.00 0.00 N ATOM 837 CA ARG A 52 -8.304 -11.309 1.867 1.00 0.00 C ATOM 838 C ARG A 52 -9.563 -11.994 2.405 1.00 0.00 C ATOM 839 O ARG A 52 -9.949 -13.055 1.914 1.00 0.00 O ATOM 840 CB ARG A 52 -8.448 -11.072 0.362 1.00 0.00 C ATOM 841 CG ARG A 52 -8.331 -12.342 -0.467 1.00 0.00 C ATOM 842 CD ARG A 52 -9.228 -12.297 -1.695 1.00 0.00 C ATOM 843 NE ARG A 52 -10.352 -13.227 -1.588 1.00 0.00 N ATOM 844 CZ ARG A 52 -11.561 -12.892 -1.141 1.00 0.00 C ATOM 845 NH1 ARG A 52 -11.816 -11.649 -0.747 1.00 0.00 N ATOM 846 NH2 ARG A 52 -12.521 -13.805 -1.085 1.00 0.00 N ATOM 0 H ARG A 52 -7.142 -13.049 1.734 1.00 0.00 H new ATOM 0 HA ARG A 52 -8.187 -10.351 2.374 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -9.415 -10.608 0.166 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -7.684 -10.365 0.039 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -7.295 -12.480 -0.778 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -8.597 -13.203 0.147 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -9.607 -11.284 -1.830 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -8.641 -12.538 -2.581 1.00 0.00 H new ATOM 0 HE ARG A 52 -10.200 -14.194 -1.874 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -11.083 -10.941 -0.785 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -12.745 -11.403 -0.406 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -12.333 -14.762 -1.384 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -13.448 -13.550 -0.743 1.00 0.00 H new ATOM 860 N PRO A 53 -10.228 -11.408 3.422 1.00 0.00 N ATOM 861 CA PRO A 53 -9.832 -10.153 4.056 1.00 0.00 C ATOM 862 C PRO A 53 -8.852 -10.372 5.206 1.00 0.00 C ATOM 863 O PRO A 53 -8.586 -11.508 5.598 1.00 0.00 O ATOM 864 CB PRO A 53 -11.160 -9.590 4.588 1.00 0.00 C ATOM 865 CG PRO A 53 -12.181 -10.682 4.434 1.00 0.00 C ATOM 866 CD PRO A 53 -11.442 -11.933 4.042 1.00 0.00 C ATOM 0 HA PRO A 53 -9.317 -9.489 3.362 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -11.064 -9.293 5.632 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -11.456 -8.702 4.030 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -12.725 -10.833 5.366 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -12.917 -10.416 3.675 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -11.217 -12.558 4.906 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -12.019 -12.544 3.348 1.00 0.00 H new ATOM 874 N LEU A 54 -8.320 -9.278 5.745 1.00 0.00 N ATOM 875 CA LEU A 54 -7.374 -9.358 6.853 1.00 0.00 C ATOM 876 C LEU A 54 -8.111 -9.410 8.192 1.00 0.00 C ATOM 877 O LEU A 54 -9.087 -8.688 8.401 1.00 0.00 O ATOM 878 CB LEU A 54 -6.417 -8.166 6.824 1.00 0.00 C ATOM 879 CG LEU A 54 -5.267 -8.284 5.822 1.00 0.00 C ATOM 880 CD1 LEU A 54 -4.822 -6.908 5.354 1.00 0.00 C ATOM 881 CD2 LEU A 54 -4.101 -9.043 6.437 1.00 0.00 C ATOM 0 H LEU A 54 -8.527 -8.329 5.433 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.796 -10.275 6.742 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -6.988 -7.266 6.594 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -5.998 -8.032 7.821 1.00 0.00 H new ATOM 0 HG LEU A 54 -5.622 -8.842 4.955 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.003 -7.013 4.642 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.658 -6.399 4.874 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.485 -6.324 6.210 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.292 -9.118 5.711 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.747 -8.512 7.321 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -4.427 -10.044 6.721 1.00 0.00 H new ATOM 893 N PRO A 55 -7.659 -10.275 9.117 1.00 0.00 N ATOM 894 CA PRO A 55 -8.290 -10.425 10.432 1.00 0.00 C ATOM 895 C PRO A 55 -7.984 -9.271 11.383 1.00 0.00 C ATOM 896 O PRO A 55 -6.913 -8.667 11.328 1.00 0.00 O ATOM 897 CB PRO A 55 -7.683 -11.724 10.963 1.00 0.00 C ATOM 898 CG PRO A 55 -6.346 -11.806 10.312 1.00 0.00 C ATOM 899 CD PRO A 55 -6.507 -11.184 8.951 1.00 0.00 C ATOM 0 HA PRO A 55 -9.377 -10.434 10.354 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -7.595 -11.706 12.049 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -8.302 -12.584 10.708 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -5.594 -11.276 10.897 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -6.015 -12.841 10.231 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -5.610 -10.643 8.649 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -6.698 -11.937 8.186 1.00 0.00 H new ATOM 907 N GLU A 56 -8.939 -8.985 12.263 1.00 0.00 N ATOM 908 CA GLU A 56 -8.799 -7.919 13.250 1.00 0.00 C ATOM 909 C GLU A 56 -8.489 -6.573 12.600 1.00 0.00 C ATOM 910 O GLU A 56 -7.855 -5.714 13.212 1.00 0.00 O ATOM 911 CB GLU A 56 -7.701 -8.275 14.255 1.00 0.00 C ATOM 912 CG GLU A 56 -8.068 -7.959 15.695 1.00 0.00 C ATOM 913 CD GLU A 56 -6.856 -7.874 16.601 1.00 0.00 C ATOM 914 OE1 GLU A 56 -6.163 -8.900 16.764 1.00 0.00 O ATOM 915 OE2 GLU A 56 -6.599 -6.780 17.148 1.00 0.00 O ATOM 0 H GLU A 56 -9.828 -9.483 12.312 1.00 0.00 H new ATOM 0 HA GLU A 56 -9.754 -7.825 13.766 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -7.475 -9.338 14.172 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -6.792 -7.734 13.994 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -8.609 -7.013 15.729 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -8.744 -8.727 16.070 1.00 0.00 H new ATOM 922 N ARG A 57 -8.948 -6.383 11.367 1.00 0.00 N ATOM 923 CA ARG A 57 -8.720 -5.126 10.663 1.00 0.00 C ATOM 924 C ARG A 57 -9.846 -4.839 9.672 1.00 0.00 C ATOM 925 O ARG A 57 -10.608 -5.734 9.306 1.00 0.00 O ATOM 926 CB ARG A 57 -7.362 -5.145 9.950 1.00 0.00 C ATOM 927 CG ARG A 57 -7.361 -5.881 8.615 1.00 0.00 C ATOM 928 CD ARG A 57 -7.829 -4.992 7.468 1.00 0.00 C ATOM 929 NE ARG A 57 -7.412 -3.600 7.633 1.00 0.00 N ATOM 930 CZ ARG A 57 -6.197 -3.147 7.331 1.00 0.00 C ATOM 931 NH1 ARG A 57 -5.278 -3.970 6.843 1.00 0.00 N ATOM 932 NH2 ARG A 57 -5.902 -1.868 7.518 1.00 0.00 N ATOM 0 H ARG A 57 -9.476 -7.077 10.838 1.00 0.00 H new ATOM 0 HA ARG A 57 -8.710 -4.324 11.401 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.038 -4.118 9.785 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -6.627 -5.609 10.607 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -6.356 -6.245 8.403 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -8.009 -6.755 8.683 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -7.433 -5.378 6.529 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -8.916 -5.037 7.398 1.00 0.00 H new ATOM 0 HE ARG A 57 -8.093 -2.936 8.002 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -5.501 -4.955 6.698 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.349 -3.618 6.613 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -6.606 -1.232 7.893 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -4.971 -1.520 7.287 1.00 0.00 H new ATOM 946 N THR A 58 -9.939 -3.587 9.236 1.00 0.00 N ATOM 947 CA THR A 58 -10.963 -3.183 8.280 1.00 0.00 C ATOM 948 C THR A 58 -10.383 -3.144 6.871 1.00 0.00 C ATOM 949 O THR A 58 -9.444 -2.398 6.597 1.00 0.00 O ATOM 950 CB THR A 58 -11.533 -1.814 8.656 1.00 0.00 C ATOM 951 OG1 THR A 58 -11.976 -1.809 10.002 1.00 0.00 O ATOM 952 CG2 THR A 58 -12.699 -1.392 7.788 1.00 0.00 C ATOM 0 H THR A 58 -9.317 -2.834 9.530 1.00 0.00 H new ATOM 0 HA THR A 58 -11.771 -3.915 8.306 1.00 0.00 H new ATOM 0 HB THR A 58 -10.715 -1.109 8.506 1.00 0.00 H new ATOM 0 HG1 THR A 58 -12.336 -0.925 10.225 1.00 0.00 H new ATOM 0 HG21 THR A 58 -13.055 -0.413 8.108 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.378 -1.339 6.748 1.00 0.00 H new ATOM 0 HG23 THR A 58 -13.505 -2.120 7.882 1.00 0.00 H new ATOM 960 N ASN A 59 -10.937 -3.960 5.982 1.00 0.00 N ATOM 961 CA ASN A 59 -10.456 -4.021 4.604 1.00 0.00 C ATOM 962 C ASN A 59 -11.380 -3.263 3.658 1.00 0.00 C ATOM 963 O ASN A 59 -12.595 -3.223 3.851 1.00 0.00 O ATOM 964 CB ASN A 59 -10.304 -5.476 4.134 1.00 0.00 C ATOM 965 CG ASN A 59 -11.039 -6.469 5.016 1.00 0.00 C ATOM 966 OD1 ASN A 59 -12.207 -6.779 4.782 1.00 0.00 O ATOM 967 ND2 ASN A 59 -10.356 -6.971 6.038 1.00 0.00 N ATOM 0 H ASN A 59 -11.716 -4.586 6.187 1.00 0.00 H new ATOM 0 HA ASN A 59 -9.476 -3.543 4.584 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -10.676 -5.562 3.113 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -9.245 -5.735 4.111 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -10.798 -7.642 6.666 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -9.389 -6.686 6.195 1.00 0.00 H new ATOM 974 N VAL A 60 -10.785 -2.665 2.631 1.00 0.00 N ATOM 975 CA VAL A 60 -11.533 -1.906 1.639 1.00 0.00 C ATOM 976 C VAL A 60 -11.102 -2.306 0.230 1.00 0.00 C ATOM 977 O VAL A 60 -9.910 -2.390 -0.061 1.00 0.00 O ATOM 978 CB VAL A 60 -11.331 -0.387 1.835 1.00 0.00 C ATOM 979 CG1 VAL A 60 -11.788 0.395 0.611 1.00 0.00 C ATOM 980 CG2 VAL A 60 -12.063 0.089 3.080 1.00 0.00 C ATOM 0 H VAL A 60 -9.779 -2.693 2.465 1.00 0.00 H new ATOM 0 HA VAL A 60 -12.591 -2.134 1.770 1.00 0.00 H new ATOM 0 HB VAL A 60 -10.265 -0.204 1.966 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -11.633 1.460 0.781 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -11.212 0.079 -0.259 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -12.847 0.207 0.433 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -11.911 1.161 3.204 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -13.128 -0.117 2.977 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -11.675 -0.436 3.953 1.00 0.00 H new ATOM 990 N VAL A 61 -12.076 -2.561 -0.639 1.00 0.00 N ATOM 991 CA VAL A 61 -11.783 -2.960 -2.010 1.00 0.00 C ATOM 992 C VAL A 61 -12.158 -1.865 -3.003 1.00 0.00 C ATOM 993 O VAL A 61 -13.263 -1.323 -2.964 1.00 0.00 O ATOM 994 CB VAL A 61 -12.515 -4.267 -2.382 1.00 0.00 C ATOM 995 CG1 VAL A 61 -12.381 -4.566 -3.870 1.00 0.00 C ATOM 996 CG2 VAL A 61 -11.981 -5.425 -1.551 1.00 0.00 C ATOM 0 H VAL A 61 -13.070 -2.499 -0.419 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.708 -3.129 -2.067 1.00 0.00 H new ATOM 0 HB VAL A 61 -13.575 -4.139 -2.162 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -12.906 -5.492 -4.104 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -12.814 -3.748 -4.446 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -11.327 -4.672 -4.126 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -12.506 -6.341 -1.823 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -10.915 -5.548 -1.741 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.140 -5.217 -0.493 1.00 0.00 H new ATOM 1006 N LEU A 62 -11.225 -1.555 -3.897 1.00 0.00 N ATOM 1007 CA LEU A 62 -11.444 -0.535 -4.913 1.00 0.00 C ATOM 1008 C LEU A 62 -11.394 -1.150 -6.308 1.00 0.00 C ATOM 1009 O LEU A 62 -10.317 -1.365 -6.866 1.00 0.00 O ATOM 1010 CB LEU A 62 -10.396 0.574 -4.790 1.00 0.00 C ATOM 1011 CG LEU A 62 -10.734 1.872 -5.527 1.00 0.00 C ATOM 1012 CD1 LEU A 62 -11.904 2.576 -4.861 1.00 0.00 C ATOM 1013 CD2 LEU A 62 -9.522 2.789 -5.573 1.00 0.00 C ATOM 0 H LEU A 62 -10.307 -1.998 -3.937 1.00 0.00 H new ATOM 0 HA LEU A 62 -12.433 -0.103 -4.758 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -10.252 0.801 -3.734 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -9.445 0.197 -5.167 1.00 0.00 H new ATOM 0 HG LEU A 62 -11.019 1.621 -6.549 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -12.129 3.497 -5.399 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -12.777 1.924 -4.876 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -11.646 2.813 -3.829 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -9.780 3.707 -6.101 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -9.209 3.030 -4.557 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -8.706 2.288 -6.094 1.00 0.00 H new ATOM 1025 N THR A 63 -12.567 -1.431 -6.864 1.00 0.00 N ATOM 1026 CA THR A 63 -12.667 -2.020 -8.193 1.00 0.00 C ATOM 1027 C THR A 63 -13.643 -1.230 -9.061 1.00 0.00 C ATOM 1028 O THR A 63 -14.668 -0.750 -8.577 1.00 0.00 O ATOM 1029 CB THR A 63 -13.116 -3.479 -8.087 1.00 0.00 C ATOM 1030 OG1 THR A 63 -13.104 -4.104 -9.360 1.00 0.00 O ATOM 1031 CG2 THR A 63 -14.506 -3.636 -7.505 1.00 0.00 C ATOM 0 H THR A 63 -13.465 -1.259 -6.412 1.00 0.00 H new ATOM 0 HA THR A 63 -11.684 -1.984 -8.662 1.00 0.00 H new ATOM 0 HB THR A 63 -12.403 -3.953 -7.412 1.00 0.00 H new ATOM 0 HG1 THR A 63 -13.393 -5.036 -9.270 1.00 0.00 H new ATOM 0 HG21 THR A 63 -14.763 -4.694 -7.457 1.00 0.00 H new ATOM 0 HG22 THR A 63 -14.530 -3.211 -6.502 1.00 0.00 H new ATOM 0 HG23 THR A 63 -15.226 -3.116 -8.137 1.00 0.00 H new ATOM 1039 N HIS A 64 -13.318 -1.096 -10.342 1.00 0.00 N ATOM 1040 CA HIS A 64 -14.169 -0.360 -11.272 1.00 0.00 C ATOM 1041 C HIS A 64 -15.511 -1.062 -11.459 1.00 0.00 C ATOM 1042 O HIS A 64 -16.538 -0.415 -11.662 1.00 0.00 O ATOM 1043 CB HIS A 64 -13.467 -0.202 -12.623 1.00 0.00 C ATOM 1044 CG HIS A 64 -12.724 1.090 -12.764 1.00 0.00 C ATOM 1045 ND1 HIS A 64 -11.772 1.655 -11.983 1.00 0.00 N flip ATOM 1046 CD2 HIS A 64 -12.928 1.966 -13.809 1.00 0.00 C flip ATOM 1047 CE1 HIS A 64 -11.423 2.848 -12.566 1.00 0.00 C flip ATOM 1048 NE2 HIS A 64 -12.134 3.012 -13.666 1.00 0.00 N flip ATOM 0 H HIS A 64 -12.473 -1.486 -10.760 1.00 0.00 H new ATOM 0 HA HIS A 64 -14.355 0.628 -10.850 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -12.770 -1.029 -12.760 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -14.208 -0.274 -13.419 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -13.628 1.820 -14.618 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -10.686 3.540 -12.186 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -12.080 3.811 -14.298 1.00 0.00 H new ATOM 1057 N GLN A 65 -15.493 -2.390 -11.391 1.00 0.00 N ATOM 1058 CA GLN A 65 -16.706 -3.186 -11.554 1.00 0.00 C ATOM 1059 C GLN A 65 -17.825 -2.668 -10.657 1.00 0.00 C ATOM 1060 O GLN A 65 -17.635 -2.478 -9.456 1.00 0.00 O ATOM 1061 CB GLN A 65 -16.422 -4.655 -11.237 1.00 0.00 C ATOM 1062 CG GLN A 65 -15.900 -5.445 -12.426 1.00 0.00 C ATOM 1063 CD GLN A 65 -14.816 -6.432 -12.039 1.00 0.00 C ATOM 1064 OE1 GLN A 65 -15.014 -7.645 -12.103 1.00 0.00 O ATOM 1065 NE2 GLN A 65 -13.661 -5.915 -11.635 1.00 0.00 N ATOM 0 H GLN A 65 -14.650 -2.939 -11.224 1.00 0.00 H new ATOM 0 HA GLN A 65 -17.029 -3.100 -12.591 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -15.694 -4.709 -10.428 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -17.337 -5.123 -10.874 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -16.726 -5.982 -12.892 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -15.508 -4.754 -13.173 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -13.541 -4.903 -11.597 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -12.894 -6.530 -11.362 1.00 0.00 H new ATOM 1074 N GLU A 66 -18.994 -2.450 -11.249 1.00 0.00 N ATOM 1075 CA GLU A 66 -20.147 -1.963 -10.504 1.00 0.00 C ATOM 1076 C GLU A 66 -20.864 -3.113 -9.808 1.00 0.00 C ATOM 1077 O GLU A 66 -21.405 -2.951 -8.714 1.00 0.00 O ATOM 1078 CB GLU A 66 -21.113 -1.230 -11.436 1.00 0.00 C ATOM 1079 CG GLU A 66 -21.679 -2.107 -12.542 1.00 0.00 C ATOM 1080 CD GLU A 66 -22.882 -1.484 -13.221 1.00 0.00 C ATOM 1081 OE1 GLU A 66 -24.008 -1.653 -12.706 1.00 0.00 O ATOM 1082 OE2 GLU A 66 -22.700 -0.827 -14.268 1.00 0.00 O ATOM 0 H GLU A 66 -19.167 -2.603 -12.242 1.00 0.00 H new ATOM 0 HA GLU A 66 -19.792 -1.266 -9.745 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -21.937 -0.827 -10.847 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -20.597 -0.382 -11.885 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -20.904 -2.294 -13.285 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -21.962 -3.074 -12.125 1.00 0.00 H new ATOM 1089 N ASP A 67 -20.875 -4.273 -10.457 1.00 0.00 N ATOM 1090 CA ASP A 67 -21.537 -5.450 -9.910 1.00 0.00 C ATOM 1091 C ASP A 67 -20.561 -6.351 -9.156 1.00 0.00 C ATOM 1092 O ASP A 67 -20.844 -7.528 -8.935 1.00 0.00 O ATOM 1093 CB ASP A 67 -22.215 -6.242 -11.030 1.00 0.00 C ATOM 1094 CG ASP A 67 -23.674 -5.867 -11.202 1.00 0.00 C ATOM 1095 OD1 ASP A 67 -24.496 -6.280 -10.358 1.00 0.00 O ATOM 1096 OD2 ASP A 67 -23.994 -5.162 -12.182 1.00 0.00 O ATOM 0 H ASP A 67 -20.432 -4.422 -11.364 1.00 0.00 H new ATOM 0 HA ASP A 67 -22.289 -5.104 -9.201 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -21.685 -6.068 -11.966 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -22.140 -7.308 -10.815 1.00 0.00 H new ATOM 1101 N TYR A 68 -19.418 -5.801 -8.750 1.00 0.00 N ATOM 1102 CA TYR A 68 -18.431 -6.580 -8.011 1.00 0.00 C ATOM 1103 C TYR A 68 -18.883 -6.781 -6.568 1.00 0.00 C ATOM 1104 O TYR A 68 -19.563 -5.928 -5.997 1.00 0.00 O ATOM 1105 CB TYR A 68 -17.064 -5.893 -8.039 1.00 0.00 C ATOM 1106 CG TYR A 68 -16.014 -6.610 -7.217 1.00 0.00 C ATOM 1107 CD1 TYR A 68 -15.544 -7.862 -7.594 1.00 0.00 C ATOM 1108 CD2 TYR A 68 -15.500 -6.036 -6.062 1.00 0.00 C ATOM 1109 CE1 TYR A 68 -14.590 -8.521 -6.842 1.00 0.00 C ATOM 1110 CE2 TYR A 68 -14.545 -6.689 -5.306 1.00 0.00 C ATOM 1111 CZ TYR A 68 -14.094 -7.930 -5.700 1.00 0.00 C ATOM 1112 OH TYR A 68 -13.145 -8.583 -4.947 1.00 0.00 O ATOM 0 H TYR A 68 -19.156 -4.830 -8.919 1.00 0.00 H new ATOM 0 HA TYR A 68 -18.340 -7.554 -8.492 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -16.722 -5.824 -9.071 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -17.170 -4.873 -7.669 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -15.930 -8.327 -8.489 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -15.852 -5.064 -5.749 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -14.235 -9.494 -7.148 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -14.154 -6.229 -4.411 1.00 0.00 H new ATOM 0 HH TYR A 68 -12.251 -8.355 -5.278 1.00 0.00 H new ATOM 1122 N GLN A 69 -18.506 -7.914 -5.984 1.00 0.00 N ATOM 1123 CA GLN A 69 -18.880 -8.220 -4.609 1.00 0.00 C ATOM 1124 C GLN A 69 -17.670 -8.661 -3.791 1.00 0.00 C ATOM 1125 O GLN A 69 -17.159 -9.767 -3.966 1.00 0.00 O ATOM 1126 CB GLN A 69 -19.952 -9.311 -4.582 1.00 0.00 C ATOM 1127 CG GLN A 69 -21.348 -8.800 -4.899 1.00 0.00 C ATOM 1128 CD GLN A 69 -21.757 -7.634 -4.020 1.00 0.00 C ATOM 1129 OE1 GLN A 69 -22.141 -7.816 -2.865 1.00 0.00 O ATOM 1130 NE2 GLN A 69 -21.675 -6.425 -4.565 1.00 0.00 N ATOM 0 H GLN A 69 -17.944 -8.633 -6.440 1.00 0.00 H new ATOM 0 HA GLN A 69 -19.281 -7.310 -4.162 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -19.687 -10.087 -5.300 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -19.960 -9.777 -3.597 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -21.390 -8.494 -5.944 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -22.065 -9.612 -4.775 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -21.351 -6.320 -5.527 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -21.936 -5.602 -4.022 1.00 0.00 H new ATOM 1139 N ALA A 70 -17.224 -7.791 -2.891 1.00 0.00 N ATOM 1140 CA ALA A 70 -16.083 -8.091 -2.036 1.00 0.00 C ATOM 1141 C ALA A 70 -16.551 -8.573 -0.669 1.00 0.00 C ATOM 1142 O ALA A 70 -16.870 -7.772 0.210 1.00 0.00 O ATOM 1143 CB ALA A 70 -15.191 -6.868 -1.890 1.00 0.00 C ATOM 0 H ALA A 70 -17.637 -6.871 -2.735 1.00 0.00 H new ATOM 0 HA ALA A 70 -15.504 -8.888 -2.503 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -14.344 -7.110 -1.248 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -14.827 -6.564 -2.871 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -15.762 -6.053 -1.445 1.00 0.00 H new ATOM 1149 N GLN A 71 -16.602 -9.889 -0.501 1.00 0.00 N ATOM 1150 CA GLN A 71 -17.044 -10.484 0.753 1.00 0.00 C ATOM 1151 C GLN A 71 -16.049 -10.218 1.879 1.00 0.00 C ATOM 1152 O GLN A 71 -14.916 -10.696 1.844 1.00 0.00 O ATOM 1153 CB GLN A 71 -17.240 -11.992 0.584 1.00 0.00 C ATOM 1154 CG GLN A 71 -17.959 -12.376 -0.701 1.00 0.00 C ATOM 1155 CD GLN A 71 -17.207 -13.423 -1.500 1.00 0.00 C ATOM 1156 OE1 GLN A 71 -17.324 -14.621 -1.240 1.00 0.00 O ATOM 1157 NE2 GLN A 71 -16.429 -12.976 -2.478 1.00 0.00 N ATOM 0 H GLN A 71 -16.342 -10.565 -1.219 1.00 0.00 H new ATOM 0 HA GLN A 71 -17.994 -10.022 1.021 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -16.266 -12.480 0.604 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -17.806 -12.373 1.434 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -18.952 -12.754 -0.458 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -18.098 -11.486 -1.315 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -16.362 -11.974 -2.659 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -15.898 -13.634 -3.049 1.00 0.00 H new ATOM 1166 N GLY A 72 -16.489 -9.469 2.886 1.00 0.00 N ATOM 1167 CA GLY A 72 -15.632 -9.174 4.018 1.00 0.00 C ATOM 1168 C GLY A 72 -15.060 -7.767 4.004 1.00 0.00 C ATOM 1169 O GLY A 72 -14.615 -7.273 5.040 1.00 0.00 O ATOM 0 H GLY A 72 -17.423 -9.062 2.937 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -16.199 -9.316 4.938 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -14.810 -9.890 4.036 1.00 0.00 H new ATOM 1173 N ALA A 73 -15.056 -7.117 2.844 1.00 0.00 N ATOM 1174 CA ALA A 73 -14.517 -5.764 2.733 1.00 0.00 C ATOM 1175 C ALA A 73 -15.515 -4.823 2.064 1.00 0.00 C ATOM 1176 O ALA A 73 -16.538 -5.261 1.537 1.00 0.00 O ATOM 1177 CB ALA A 73 -13.207 -5.782 1.960 1.00 0.00 C ATOM 0 H ALA A 73 -15.418 -7.502 1.971 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.330 -5.392 3.740 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -12.815 -4.768 1.884 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -12.486 -6.411 2.481 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.380 -6.180 0.960 1.00 0.00 H new ATOM 1183 N VAL A 74 -15.211 -3.527 2.087 1.00 0.00 N ATOM 1184 CA VAL A 74 -16.083 -2.525 1.480 1.00 0.00 C ATOM 1185 C VAL A 74 -15.827 -2.426 -0.020 1.00 0.00 C ATOM 1186 O VAL A 74 -14.690 -2.550 -0.475 1.00 0.00 O ATOM 1187 CB VAL A 74 -15.880 -1.135 2.114 1.00 0.00 C ATOM 1188 CG1 VAL A 74 -17.036 -0.213 1.757 1.00 0.00 C ATOM 1189 CG2 VAL A 74 -15.728 -1.248 3.624 1.00 0.00 C ATOM 0 H VAL A 74 -14.369 -3.147 2.519 1.00 0.00 H new ATOM 0 HA VAL A 74 -17.109 -2.846 1.659 1.00 0.00 H new ATOM 0 HB VAL A 74 -14.962 -0.706 1.713 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -16.876 0.764 2.213 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -17.093 -0.103 0.674 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -17.969 -0.638 2.128 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -15.586 -0.255 4.051 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -16.625 -1.700 4.047 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -14.864 -1.870 3.857 1.00 0.00 H new ATOM 1199 N VAL A 75 -16.894 -2.222 -0.787 1.00 0.00 N ATOM 1200 CA VAL A 75 -16.781 -2.131 -2.238 1.00 0.00 C ATOM 1201 C VAL A 75 -17.090 -0.730 -2.758 1.00 0.00 C ATOM 1202 O VAL A 75 -18.068 -0.102 -2.353 1.00 0.00 O ATOM 1203 CB VAL A 75 -17.722 -3.132 -2.934 1.00 0.00 C ATOM 1204 CG1 VAL A 75 -17.420 -3.203 -4.423 1.00 0.00 C ATOM 1205 CG2 VAL A 75 -17.611 -4.506 -2.293 1.00 0.00 C ATOM 0 H VAL A 75 -17.843 -2.117 -0.429 1.00 0.00 H new ATOM 0 HA VAL A 75 -15.744 -2.370 -2.474 1.00 0.00 H new ATOM 0 HB VAL A 75 -18.747 -2.783 -2.812 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -18.095 -3.915 -4.898 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -17.559 -2.219 -4.870 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -16.389 -3.526 -4.570 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -18.283 -5.199 -2.799 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -16.586 -4.866 -2.380 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -17.884 -4.439 -1.240 1.00 0.00 H new ATOM 1215 N VAL A 76 -16.252 -0.263 -3.680 1.00 0.00 N ATOM 1216 CA VAL A 76 -16.421 1.048 -4.297 1.00 0.00 C ATOM 1217 C VAL A 76 -15.719 1.080 -5.652 1.00 0.00 C ATOM 1218 O VAL A 76 -14.927 0.190 -5.963 1.00 0.00 O ATOM 1219 CB VAL A 76 -15.881 2.183 -3.402 1.00 0.00 C ATOM 1220 CG1 VAL A 76 -16.568 2.166 -2.045 1.00 0.00 C ATOM 1221 CG2 VAL A 76 -14.371 2.082 -3.243 1.00 0.00 C ATOM 0 H VAL A 76 -15.441 -0.780 -4.019 1.00 0.00 H new ATOM 0 HA VAL A 76 -17.490 1.212 -4.430 1.00 0.00 H new ATOM 0 HB VAL A 76 -16.104 3.133 -3.889 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -16.174 2.973 -1.428 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -17.641 2.302 -2.179 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -16.382 1.210 -1.555 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -14.017 2.894 -2.608 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -14.116 1.126 -2.786 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -13.896 2.154 -4.222 1.00 0.00 H new ATOM 1231 N HIS A 77 -16.020 2.085 -6.468 1.00 0.00 N ATOM 1232 CA HIS A 77 -15.412 2.180 -7.795 1.00 0.00 C ATOM 1233 C HIS A 77 -14.835 3.568 -8.080 1.00 0.00 C ATOM 1234 O HIS A 77 -14.104 3.745 -9.054 1.00 0.00 O ATOM 1235 CB HIS A 77 -16.437 1.818 -8.876 1.00 0.00 C ATOM 1236 CG HIS A 77 -17.550 0.941 -8.389 1.00 0.00 C ATOM 1237 ND1 HIS A 77 -17.338 -0.280 -7.785 1.00 0.00 N ATOM 1238 CD2 HIS A 77 -18.893 1.118 -8.413 1.00 0.00 C ATOM 1239 CE1 HIS A 77 -18.501 -0.817 -7.459 1.00 0.00 C ATOM 1240 NE2 HIS A 77 -19.459 0.011 -7.829 1.00 0.00 N ATOM 0 H HIS A 77 -16.671 2.836 -6.241 1.00 0.00 H new ATOM 0 HA HIS A 77 -14.585 1.471 -7.813 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -16.862 2.736 -9.282 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -15.924 1.315 -9.696 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -16.425 -0.703 -7.616 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -19.420 1.970 -8.816 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -18.643 -1.771 -6.973 1.00 0.00 H new ATOM 1249 N ASP A 78 -15.172 4.554 -7.254 1.00 0.00 N ATOM 1250 CA ASP A 78 -14.681 5.914 -7.466 1.00 0.00 C ATOM 1251 C ASP A 78 -13.907 6.426 -6.256 1.00 0.00 C ATOM 1252 O ASP A 78 -14.022 5.885 -5.156 1.00 0.00 O ATOM 1253 CB ASP A 78 -15.847 6.855 -7.771 1.00 0.00 C ATOM 1254 CG ASP A 78 -16.557 6.497 -9.062 1.00 0.00 C ATOM 1255 OD1 ASP A 78 -17.107 5.379 -9.147 1.00 0.00 O ATOM 1256 OD2 ASP A 78 -16.563 7.335 -9.988 1.00 0.00 O ATOM 0 H ASP A 78 -15.776 4.441 -6.440 1.00 0.00 H new ATOM 0 HA ASP A 78 -14.000 5.890 -8.317 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -16.560 6.824 -6.947 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -15.477 7.878 -7.835 1.00 0.00 H new ATOM 1261 N VAL A 79 -13.120 7.478 -6.470 1.00 0.00 N ATOM 1262 CA VAL A 79 -12.330 8.072 -5.409 1.00 0.00 C ATOM 1263 C VAL A 79 -13.216 8.828 -4.428 1.00 0.00 C ATOM 1264 O VAL A 79 -12.995 8.792 -3.218 1.00 0.00 O ATOM 1265 CB VAL A 79 -11.262 9.027 -5.973 1.00 0.00 C ATOM 1266 CG1 VAL A 79 -10.057 8.247 -6.475 1.00 0.00 C ATOM 1267 CG2 VAL A 79 -11.835 9.904 -7.079 1.00 0.00 C ATOM 0 H VAL A 79 -13.016 7.934 -7.376 1.00 0.00 H new ATOM 0 HA VAL A 79 -11.831 7.257 -4.886 1.00 0.00 H new ATOM 0 HB VAL A 79 -10.937 9.681 -5.164 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -9.314 8.940 -6.870 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -9.623 7.679 -5.652 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -10.369 7.562 -7.264 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -11.057 10.567 -7.457 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -12.201 9.274 -7.890 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -12.658 10.499 -6.682 1.00 0.00 H new ATOM 1277 N ALA A 80 -14.219 9.513 -4.958 1.00 0.00 N ATOM 1278 CA ALA A 80 -15.143 10.277 -4.130 1.00 0.00 C ATOM 1279 C ALA A 80 -16.013 9.346 -3.297 1.00 0.00 C ATOM 1280 O ALA A 80 -16.265 9.603 -2.119 1.00 0.00 O ATOM 1281 CB ALA A 80 -16.006 11.183 -4.994 1.00 0.00 C ATOM 0 H ALA A 80 -14.414 9.556 -5.958 1.00 0.00 H new ATOM 0 HA ALA A 80 -14.561 10.900 -3.451 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -16.690 11.746 -4.360 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -15.369 11.875 -5.545 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -16.578 10.578 -5.697 1.00 0.00 H new ATOM 1287 N ALA A 81 -16.464 8.256 -3.913 1.00 0.00 N ATOM 1288 CA ALA A 81 -17.298 7.280 -3.222 1.00 0.00 C ATOM 1289 C ALA A 81 -16.633 6.828 -1.928 1.00 0.00 C ATOM 1290 O ALA A 81 -17.146 7.068 -0.833 1.00 0.00 O ATOM 1291 CB ALA A 81 -17.570 6.085 -4.124 1.00 0.00 C ATOM 0 H ALA A 81 -16.266 8.028 -4.887 1.00 0.00 H new ATOM 0 HA ALA A 81 -18.248 7.752 -2.973 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -18.194 5.364 -3.595 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -18.085 6.419 -5.025 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -16.626 5.615 -4.399 1.00 0.00 H new ATOM 1297 N VAL A 82 -15.480 6.178 -2.059 1.00 0.00 N ATOM 1298 CA VAL A 82 -14.739 5.701 -0.903 1.00 0.00 C ATOM 1299 C VAL A 82 -14.535 6.826 0.112 1.00 0.00 C ATOM 1300 O VAL A 82 -14.684 6.624 1.315 1.00 0.00 O ATOM 1301 CB VAL A 82 -13.374 5.114 -1.325 1.00 0.00 C ATOM 1302 CG1 VAL A 82 -12.444 6.205 -1.826 1.00 0.00 C ATOM 1303 CG2 VAL A 82 -12.735 4.343 -0.181 1.00 0.00 C ATOM 0 H VAL A 82 -15.041 5.971 -2.956 1.00 0.00 H new ATOM 0 HA VAL A 82 -15.326 4.910 -0.435 1.00 0.00 H new ATOM 0 HB VAL A 82 -13.550 4.417 -2.145 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -11.490 5.765 -2.117 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -12.893 6.699 -2.688 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -12.280 6.936 -1.034 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -11.775 3.940 -0.505 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -12.581 5.011 0.667 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -13.390 3.524 0.117 1.00 0.00 H new ATOM 1313 N PHE A 83 -14.211 8.020 -0.382 1.00 0.00 N ATOM 1314 CA PHE A 83 -14.005 9.173 0.492 1.00 0.00 C ATOM 1315 C PHE A 83 -15.174 9.328 1.457 1.00 0.00 C ATOM 1316 O PHE A 83 -14.982 9.645 2.631 1.00 0.00 O ATOM 1317 CB PHE A 83 -13.828 10.448 -0.335 1.00 0.00 C ATOM 1318 CG PHE A 83 -12.392 10.853 -0.512 1.00 0.00 C ATOM 1319 CD1 PHE A 83 -11.556 10.987 0.585 1.00 0.00 C ATOM 1320 CD2 PHE A 83 -11.880 11.100 -1.776 1.00 0.00 C ATOM 1321 CE1 PHE A 83 -10.235 11.360 0.425 1.00 0.00 C ATOM 1322 CE2 PHE A 83 -10.559 11.473 -1.942 1.00 0.00 C ATOM 1323 CZ PHE A 83 -9.736 11.603 -0.840 1.00 0.00 C ATOM 0 H PHE A 83 -14.086 8.213 -1.376 1.00 0.00 H new ATOM 0 HA PHE A 83 -13.097 9.006 1.071 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -14.279 10.301 -1.316 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -14.370 11.262 0.146 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -11.941 10.798 1.576 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -12.520 11.000 -2.640 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -9.594 11.461 1.288 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -10.171 11.662 -2.932 1.00 0.00 H new ATOM 0 HZ PHE A 83 -8.704 11.894 -0.967 1.00 0.00 H new ATOM 1333 N ALA A 84 -16.382 9.077 0.965 1.00 0.00 N ATOM 1334 CA ALA A 84 -17.569 9.165 1.801 1.00 0.00 C ATOM 1335 C ALA A 84 -17.483 8.124 2.902 1.00 0.00 C ATOM 1336 O ALA A 84 -17.862 8.373 4.047 1.00 0.00 O ATOM 1337 CB ALA A 84 -18.829 8.974 0.971 1.00 0.00 C ATOM 0 H ALA A 84 -16.563 8.813 -0.003 1.00 0.00 H new ATOM 0 HA ALA A 84 -17.619 10.157 2.250 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -19.704 9.044 1.617 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -18.881 9.748 0.205 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -18.806 7.993 0.495 1.00 0.00 H new ATOM 1343 N TYR A 85 -16.945 6.961 2.547 1.00 0.00 N ATOM 1344 CA TYR A 85 -16.767 5.886 3.511 1.00 0.00 C ATOM 1345 C TYR A 85 -15.886 6.389 4.652 1.00 0.00 C ATOM 1346 O TYR A 85 -16.313 6.429 5.805 1.00 0.00 O ATOM 1347 CB TYR A 85 -16.168 4.642 2.826 1.00 0.00 C ATOM 1348 CG TYR A 85 -14.858 4.149 3.412 1.00 0.00 C ATOM 1349 CD1 TYR A 85 -14.831 3.399 4.581 1.00 0.00 C ATOM 1350 CD2 TYR A 85 -13.651 4.434 2.790 1.00 0.00 C ATOM 1351 CE1 TYR A 85 -13.635 2.949 5.110 1.00 0.00 C ATOM 1352 CE2 TYR A 85 -12.454 3.990 3.311 1.00 0.00 C ATOM 1353 CZ TYR A 85 -12.451 3.249 4.470 1.00 0.00 C ATOM 1354 OH TYR A 85 -11.259 2.806 4.989 1.00 0.00 O ATOM 0 H TYR A 85 -16.627 6.742 1.603 1.00 0.00 H new ATOM 0 HA TYR A 85 -17.731 5.587 3.922 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -16.897 3.833 2.876 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -16.014 4.867 1.771 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -15.757 3.164 5.084 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -13.649 5.015 1.880 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -13.628 2.366 6.019 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -11.525 4.223 2.812 1.00 0.00 H new ATOM 0 HH TYR A 85 -10.522 3.103 4.416 1.00 0.00 H new ATOM 1364 N ALA A 86 -14.649 6.763 4.320 1.00 0.00 N ATOM 1365 CA ALA A 86 -13.698 7.256 5.313 1.00 0.00 C ATOM 1366 C ALA A 86 -14.363 8.219 6.292 1.00 0.00 C ATOM 1367 O ALA A 86 -14.031 8.235 7.477 1.00 0.00 O ATOM 1368 CB ALA A 86 -12.518 7.927 4.628 1.00 0.00 C ATOM 0 H ALA A 86 -14.283 6.733 3.368 1.00 0.00 H new ATOM 0 HA ALA A 86 -13.336 6.400 5.882 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -11.818 8.289 5.381 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -12.015 7.208 3.982 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -12.874 8.766 4.030 1.00 0.00 H new ATOM 1374 N LYS A 87 -15.319 9.003 5.801 1.00 0.00 N ATOM 1375 CA LYS A 87 -16.036 9.937 6.662 1.00 0.00 C ATOM 1376 C LYS A 87 -16.799 9.158 7.728 1.00 0.00 C ATOM 1377 O LYS A 87 -16.732 9.468 8.917 1.00 0.00 O ATOM 1378 CB LYS A 87 -17.000 10.794 5.839 1.00 0.00 C ATOM 1379 CG LYS A 87 -17.063 12.244 6.292 1.00 0.00 C ATOM 1380 CD LYS A 87 -15.784 12.991 5.951 1.00 0.00 C ATOM 1381 CE LYS A 87 -15.334 13.880 7.099 1.00 0.00 C ATOM 1382 NZ LYS A 87 -14.437 14.975 6.636 1.00 0.00 N ATOM 0 H LYS A 87 -15.612 9.011 4.824 1.00 0.00 H new ATOM 0 HA LYS A 87 -15.318 10.601 7.144 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -16.698 10.762 4.792 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -17.998 10.360 5.897 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -17.911 12.738 5.818 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -17.232 12.283 7.368 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -14.996 12.276 5.713 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -15.943 13.598 5.060 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -16.208 14.309 7.589 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -14.815 13.276 7.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -14.153 15.558 7.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -13.591 14.566 6.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -14.940 15.567 5.944 1.00 0.00 H new ATOM 1396 N GLN A 88 -17.523 8.140 7.275 1.00 0.00 N ATOM 1397 CA GLN A 88 -18.309 7.296 8.168 1.00 0.00 C ATOM 1398 C GLN A 88 -17.410 6.656 9.224 1.00 0.00 C ATOM 1399 O GLN A 88 -17.870 6.273 10.299 1.00 0.00 O ATOM 1400 CB GLN A 88 -19.037 6.211 7.370 1.00 0.00 C ATOM 1401 CG GLN A 88 -20.476 5.997 7.809 1.00 0.00 C ATOM 1402 CD GLN A 88 -21.446 6.920 7.098 1.00 0.00 C ATOM 1403 OE1 GLN A 88 -22.165 7.693 7.732 1.00 0.00 O ATOM 1404 NE2 GLN A 88 -21.472 6.844 5.772 1.00 0.00 N ATOM 0 H GLN A 88 -17.582 7.879 6.291 1.00 0.00 H new ATOM 0 HA GLN A 88 -19.049 7.919 8.670 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -19.024 6.478 6.313 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -18.492 5.272 7.468 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -20.760 4.962 7.619 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -20.551 6.156 8.885 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -20.859 6.189 5.287 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -22.105 7.441 5.239 1.00 0.00 H new ATOM 1413 N HIS A 89 -16.122 6.558 8.909 1.00 0.00 N ATOM 1414 CA HIS A 89 -15.144 5.984 9.822 1.00 0.00 C ATOM 1415 C HIS A 89 -14.169 7.062 10.295 1.00 0.00 C ATOM 1416 O HIS A 89 -13.085 7.219 9.733 1.00 0.00 O ATOM 1417 CB HIS A 89 -14.385 4.856 9.126 1.00 0.00 C ATOM 1418 CG HIS A 89 -14.999 3.507 9.333 1.00 0.00 C ATOM 1419 ND1 HIS A 89 -15.450 3.063 10.558 1.00 0.00 N ATOM 1420 CD2 HIS A 89 -15.238 2.500 8.460 1.00 0.00 C ATOM 1421 CE1 HIS A 89 -15.940 1.843 10.430 1.00 0.00 C ATOM 1422 NE2 HIS A 89 -15.824 1.479 9.166 1.00 0.00 N ATOM 0 H HIS A 89 -15.731 6.872 8.021 1.00 0.00 H new ATOM 0 HA HIS A 89 -15.664 5.579 10.690 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -14.339 5.065 8.057 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -13.359 4.839 9.492 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -15.010 2.500 7.404 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -16.363 1.245 11.224 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -16.122 0.584 8.777 1.00 0.00 H new ATOM 1431 N PRO A 90 -14.555 7.836 11.324 1.00 0.00 N ATOM 1432 CA PRO A 90 -13.721 8.921 11.854 1.00 0.00 C ATOM 1433 C PRO A 90 -12.543 8.432 12.693 1.00 0.00 C ATOM 1434 O PRO A 90 -11.429 8.937 12.557 1.00 0.00 O ATOM 1435 CB PRO A 90 -14.697 9.714 12.724 1.00 0.00 C ATOM 1436 CG PRO A 90 -15.704 8.711 13.169 1.00 0.00 C ATOM 1437 CD PRO A 90 -15.844 7.730 12.036 1.00 0.00 C ATOM 0 HA PRO A 90 -13.260 9.495 11.050 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -14.190 10.170 13.574 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -15.164 10.522 12.160 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -15.379 8.210 14.081 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -16.658 9.189 13.391 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -16.018 6.718 12.401 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -16.682 7.984 11.387 1.00 0.00 H new ATOM 1445 N ASP A 91 -12.788 7.463 13.570 1.00 0.00 N ATOM 1446 CA ASP A 91 -11.735 6.935 14.433 1.00 0.00 C ATOM 1447 C ASP A 91 -10.795 5.995 13.680 1.00 0.00 C ATOM 1448 O ASP A 91 -9.801 5.528 14.237 1.00 0.00 O ATOM 1449 CB ASP A 91 -12.352 6.202 15.626 1.00 0.00 C ATOM 1450 CG ASP A 91 -13.237 7.103 16.464 1.00 0.00 C ATOM 1451 OD1 ASP A 91 -14.305 7.517 15.966 1.00 0.00 O ATOM 1452 OD2 ASP A 91 -12.862 7.396 17.619 1.00 0.00 O ATOM 0 H ASP A 91 -13.702 7.029 13.702 1.00 0.00 H new ATOM 0 HA ASP A 91 -11.146 7.782 14.785 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -12.937 5.356 15.266 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -11.556 5.796 16.251 1.00 0.00 H new ATOM 1457 N GLN A 92 -11.106 5.715 12.418 1.00 0.00 N ATOM 1458 CA GLN A 92 -10.276 4.827 11.612 1.00 0.00 C ATOM 1459 C GLN A 92 -9.415 5.621 10.632 1.00 0.00 C ATOM 1460 O GLN A 92 -9.855 6.629 10.079 1.00 0.00 O ATOM 1461 CB GLN A 92 -11.152 3.825 10.858 1.00 0.00 C ATOM 1462 CG GLN A 92 -11.066 2.410 11.407 1.00 0.00 C ATOM 1463 CD GLN A 92 -11.813 2.247 12.717 1.00 0.00 C ATOM 1464 OE1 GLN A 92 -11.226 1.894 13.740 1.00 0.00 O ATOM 1465 NE2 GLN A 92 -13.116 2.504 12.690 1.00 0.00 N ATOM 0 H GLN A 92 -11.922 6.088 11.934 1.00 0.00 H new ATOM 0 HA GLN A 92 -9.611 4.282 12.282 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -12.189 4.159 10.898 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -10.860 3.817 9.808 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -11.471 1.714 10.673 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -10.019 2.144 11.554 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -13.561 2.794 11.819 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -13.672 2.411 13.540 1.00 0.00 H new ATOM 1474 N GLU A 93 -8.184 5.161 10.427 1.00 0.00 N ATOM 1475 CA GLU A 93 -7.256 5.828 9.518 1.00 0.00 C ATOM 1476 C GLU A 93 -7.336 5.231 8.116 1.00 0.00 C ATOM 1477 O GLU A 93 -7.831 4.119 7.931 1.00 0.00 O ATOM 1478 CB GLU A 93 -5.825 5.721 10.051 1.00 0.00 C ATOM 1479 CG GLU A 93 -5.037 7.016 9.941 1.00 0.00 C ATOM 1480 CD GLU A 93 -4.131 7.249 11.134 1.00 0.00 C ATOM 1481 OE1 GLU A 93 -3.527 6.270 11.621 1.00 0.00 O ATOM 1482 OE2 GLU A 93 -4.025 8.410 11.582 1.00 0.00 O ATOM 0 H GLU A 93 -7.805 4.328 10.878 1.00 0.00 H new ATOM 0 HA GLU A 93 -7.539 6.879 9.459 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -5.857 5.413 11.096 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -5.300 4.938 9.504 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -4.436 6.996 9.032 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -5.730 7.852 9.847 1.00 0.00 H new ATOM 1489 N LEU A 94 -6.849 5.979 7.131 1.00 0.00 N ATOM 1490 CA LEU A 94 -6.868 5.526 5.745 1.00 0.00 C ATOM 1491 C LEU A 94 -5.475 5.102 5.285 1.00 0.00 C ATOM 1492 O LEU A 94 -4.523 5.879 5.357 1.00 0.00 O ATOM 1493 CB LEU A 94 -7.399 6.637 4.837 1.00 0.00 C ATOM 1494 CG LEU A 94 -8.912 6.621 4.611 1.00 0.00 C ATOM 1495 CD1 LEU A 94 -9.449 8.040 4.496 1.00 0.00 C ATOM 1496 CD2 LEU A 94 -9.255 5.815 3.367 1.00 0.00 C ATOM 0 H LEU A 94 -6.436 6.902 7.267 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.527 4.660 5.681 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.121 7.600 5.266 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.902 6.564 3.870 1.00 0.00 H new ATOM 0 HG LEU A 94 -9.385 6.145 5.470 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -10.527 8.009 4.335 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -9.234 8.586 5.415 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -8.971 8.543 3.655 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -10.335 5.814 3.221 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -8.772 6.263 2.499 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -8.904 4.790 3.489 1.00 0.00 H new ATOM 1508 N VAL A 95 -5.366 3.866 4.807 1.00 0.00 N ATOM 1509 CA VAL A 95 -4.092 3.339 4.329 1.00 0.00 C ATOM 1510 C VAL A 95 -4.276 2.551 3.036 1.00 0.00 C ATOM 1511 O VAL A 95 -5.306 1.909 2.831 1.00 0.00 O ATOM 1512 CB VAL A 95 -3.426 2.430 5.379 1.00 0.00 C ATOM 1513 CG1 VAL A 95 -2.009 2.073 4.956 1.00 0.00 C ATOM 1514 CG2 VAL A 95 -3.430 3.099 6.745 1.00 0.00 C ATOM 0 H VAL A 95 -6.145 3.211 4.740 1.00 0.00 H new ATOM 0 HA VAL A 95 -3.446 4.197 4.143 1.00 0.00 H new ATOM 0 HB VAL A 95 -4.002 1.507 5.451 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -1.555 1.430 5.710 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -2.036 1.548 4.001 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -1.420 2.984 4.853 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.955 2.442 7.473 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -2.880 4.039 6.692 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -4.458 3.297 7.050 1.00 0.00 H new ATOM 1524 N ILE A 96 -3.273 2.606 2.165 1.00 0.00 N ATOM 1525 CA ILE A 96 -3.327 1.897 0.890 1.00 0.00 C ATOM 1526 C ILE A 96 -2.179 0.899 0.768 1.00 0.00 C ATOM 1527 O ILE A 96 -1.025 1.233 1.037 1.00 0.00 O ATOM 1528 CB ILE A 96 -3.274 2.869 -0.307 1.00 0.00 C ATOM 1529 CG1 ILE A 96 -4.034 4.159 0.011 1.00 0.00 C ATOM 1530 CG2 ILE A 96 -3.846 2.207 -1.551 1.00 0.00 C ATOM 1531 CD1 ILE A 96 -5.511 3.944 0.264 1.00 0.00 C ATOM 0 H ILE A 96 -2.414 3.134 2.318 1.00 0.00 H new ATOM 0 HA ILE A 96 -4.278 1.364 0.870 1.00 0.00 H new ATOM 0 HB ILE A 96 -2.232 3.125 -0.497 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.588 4.627 0.888 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.913 4.856 -0.818 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.802 2.905 -2.387 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -3.264 1.317 -1.790 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.883 1.924 -1.369 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.986 4.900 0.483 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.971 3.504 -0.621 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.641 3.272 1.112 1.00 0.00 H new ATOM 1543 N ALA A 97 -2.503 -0.326 0.366 1.00 0.00 N ATOM 1544 CA ALA A 97 -1.496 -1.371 0.213 1.00 0.00 C ATOM 1545 C ALA A 97 -1.244 -1.691 -1.256 1.00 0.00 C ATOM 1546 O ALA A 97 -0.114 -1.968 -1.657 1.00 0.00 O ATOM 1547 CB ALA A 97 -1.919 -2.624 0.964 1.00 0.00 C ATOM 0 H ALA A 97 -3.454 -0.619 0.141 1.00 0.00 H new ATOM 0 HA ALA A 97 -0.562 -1.002 0.637 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -1.159 -3.396 0.842 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -2.034 -2.392 2.023 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -2.868 -2.983 0.567 1.00 0.00 H new ATOM 1553 N GLY A 98 -2.305 -1.653 -2.053 1.00 0.00 N ATOM 1554 CA GLY A 98 -2.180 -1.942 -3.470 1.00 0.00 C ATOM 1555 C GLY A 98 -3.492 -1.764 -4.217 1.00 0.00 C ATOM 1556 O GLY A 98 -4.512 -1.459 -3.601 1.00 0.00 O ATOM 0 H GLY A 98 -3.250 -1.427 -1.744 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -1.425 -1.287 -3.906 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.828 -2.965 -3.599 1.00 0.00 H new ATOM 1560 N GLY A 99 -3.449 -1.811 -5.555 1.00 0.00 N ATOM 1561 CA GLY A 99 -2.200 -2.023 -6.276 1.00 0.00 C ATOM 1562 C GLY A 99 -1.513 -0.722 -6.643 1.00 0.00 C ATOM 1563 O GLY A 99 -1.865 0.340 -6.131 1.00 0.00 O ATOM 0 H GLY A 99 -4.268 -1.704 -6.154 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -1.528 -2.625 -5.664 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -2.400 -2.593 -7.183 1.00 0.00 H new ATOM 1567 N ALA A 100 -0.528 -0.807 -7.531 1.00 0.00 N ATOM 1568 CA ALA A 100 0.216 0.369 -7.967 1.00 0.00 C ATOM 1569 C ALA A 100 -0.694 1.387 -8.649 1.00 0.00 C ATOM 1570 O ALA A 100 -0.424 2.588 -8.622 1.00 0.00 O ATOM 1571 CB ALA A 100 1.344 -0.040 -8.902 1.00 0.00 C ATOM 0 H ALA A 100 -0.226 -1.680 -7.964 1.00 0.00 H new ATOM 0 HA ALA A 100 0.640 0.843 -7.082 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.892 0.847 -9.221 1.00 0.00 H new ATOM 0 HB2 ALA A 100 2.021 -0.717 -8.381 1.00 0.00 H new ATOM 0 HB3 ALA A 100 0.928 -0.543 -9.775 1.00 0.00 H new ATOM 1577 N GLN A 101 -1.770 0.903 -9.262 1.00 0.00 N ATOM 1578 CA GLN A 101 -2.711 1.779 -9.950 1.00 0.00 C ATOM 1579 C GLN A 101 -3.544 2.573 -8.949 1.00 0.00 C ATOM 1580 O GLN A 101 -3.829 3.753 -9.159 1.00 0.00 O ATOM 1581 CB GLN A 101 -3.625 0.962 -10.867 1.00 0.00 C ATOM 1582 CG GLN A 101 -3.404 1.235 -12.345 1.00 0.00 C ATOM 1583 CD GLN A 101 -3.730 2.665 -12.730 1.00 0.00 C ATOM 1584 OE1 GLN A 101 -4.958 3.087 -12.450 1.00 0.00 O flip ATOM 1585 NE2 GLN A 101 -2.889 3.382 -13.272 1.00 0.00 N flip ATOM 0 H GLN A 101 -2.011 -0.088 -9.296 1.00 0.00 H new ATOM 0 HA GLN A 101 -2.140 2.482 -10.556 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.465 -0.099 -10.674 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -4.664 1.178 -10.617 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -2.365 1.022 -12.598 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -4.021 0.555 -12.932 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -1.957 3.016 -13.469 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -3.124 4.342 -13.525 1.00 0.00 H new ATOM 1594 N ILE A 102 -3.928 1.919 -7.859 1.00 0.00 N ATOM 1595 CA ILE A 102 -4.724 2.565 -6.823 1.00 0.00 C ATOM 1596 C ILE A 102 -3.951 3.711 -6.182 1.00 0.00 C ATOM 1597 O ILE A 102 -4.538 4.687 -5.716 1.00 0.00 O ATOM 1598 CB ILE A 102 -5.138 1.567 -5.724 1.00 0.00 C ATOM 1599 CG1 ILE A 102 -5.787 0.329 -6.342 1.00 0.00 C ATOM 1600 CG2 ILE A 102 -6.087 2.227 -4.737 1.00 0.00 C ATOM 1601 CD1 ILE A 102 -7.086 0.622 -7.061 1.00 0.00 C ATOM 0 H ILE A 102 -3.701 0.943 -7.670 1.00 0.00 H new ATOM 0 HA ILE A 102 -5.621 2.952 -7.306 1.00 0.00 H new ATOM 0 HB ILE A 102 -4.242 1.255 -5.187 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -5.088 -0.126 -7.043 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.973 -0.404 -5.557 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -6.369 1.508 -3.968 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -5.593 3.081 -4.273 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -6.980 2.566 -5.262 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -7.490 -0.302 -7.474 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -7.802 1.049 -6.359 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -6.903 1.331 -7.868 1.00 0.00 H new ATOM 1613 N PHE A 103 -2.630 3.581 -6.160 1.00 0.00 N ATOM 1614 CA PHE A 103 -1.770 4.599 -5.576 1.00 0.00 C ATOM 1615 C PHE A 103 -1.645 5.795 -6.510 1.00 0.00 C ATOM 1616 O PHE A 103 -1.509 6.934 -6.063 1.00 0.00 O ATOM 1617 CB PHE A 103 -0.389 4.016 -5.271 1.00 0.00 C ATOM 1618 CG PHE A 103 -0.382 3.074 -4.098 1.00 0.00 C ATOM 1619 CD1 PHE A 103 -1.364 2.104 -3.963 1.00 0.00 C ATOM 1620 CD2 PHE A 103 0.605 3.160 -3.130 1.00 0.00 C ATOM 1621 CE1 PHE A 103 -1.360 1.239 -2.888 1.00 0.00 C ATOM 1622 CE2 PHE A 103 0.612 2.296 -2.051 1.00 0.00 C ATOM 1623 CZ PHE A 103 -0.371 1.335 -1.930 1.00 0.00 C ATOM 0 H PHE A 103 -2.131 2.777 -6.542 1.00 0.00 H new ATOM 0 HA PHE A 103 -2.221 4.937 -4.643 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -0.023 3.489 -6.152 1.00 0.00 H new ATOM 0 HB3 PHE A 103 0.306 4.832 -5.076 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -2.141 2.025 -4.708 1.00 0.00 H new ATOM 0 HD2 PHE A 103 1.377 3.910 -3.219 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -2.130 0.487 -2.796 1.00 0.00 H new ATOM 0 HE2 PHE A 103 1.387 2.373 -1.303 1.00 0.00 H new ATOM 0 HZ PHE A 103 -0.366 0.659 -1.087 1.00 0.00 H new ATOM 1633 N THR A 104 -1.700 5.530 -7.812 1.00 0.00 N ATOM 1634 CA THR A 104 -1.601 6.589 -8.808 1.00 0.00 C ATOM 1635 C THR A 104 -2.712 7.615 -8.613 1.00 0.00 C ATOM 1636 O THR A 104 -2.459 8.817 -8.575 1.00 0.00 O ATOM 1637 CB THR A 104 -1.677 6.005 -10.219 1.00 0.00 C ATOM 1638 OG1 THR A 104 -0.632 5.073 -10.435 1.00 0.00 O ATOM 1639 CG2 THR A 104 -1.585 7.058 -11.302 1.00 0.00 C ATOM 0 H THR A 104 -1.812 4.593 -8.200 1.00 0.00 H new ATOM 0 HA THR A 104 -0.639 7.085 -8.681 1.00 0.00 H new ATOM 0 HB THR A 104 -2.652 5.522 -10.282 1.00 0.00 H new ATOM 0 HG1 THR A 104 -0.738 4.315 -9.823 1.00 0.00 H new ATOM 0 HG21 THR A 104 -1.645 6.580 -12.280 1.00 0.00 H new ATOM 0 HG22 THR A 104 -2.407 7.765 -11.193 1.00 0.00 H new ATOM 0 HG23 THR A 104 -0.637 7.588 -11.215 1.00 0.00 H new ATOM 1647 N ALA A 105 -3.943 7.132 -8.485 1.00 0.00 N ATOM 1648 CA ALA A 105 -5.086 8.015 -8.288 1.00 0.00 C ATOM 1649 C ALA A 105 -4.934 8.818 -7.009 1.00 0.00 C ATOM 1650 O ALA A 105 -4.949 10.048 -7.036 1.00 0.00 O ATOM 1651 CB ALA A 105 -6.380 7.213 -8.267 1.00 0.00 C ATOM 0 H ALA A 105 -4.174 6.139 -8.514 1.00 0.00 H new ATOM 0 HA ALA A 105 -5.126 8.714 -9.123 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -7.224 7.887 -8.119 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -6.498 6.687 -9.215 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -6.347 6.490 -7.452 1.00 0.00 H new ATOM 1657 N PHE A 106 -4.788 8.126 -5.887 1.00 0.00 N ATOM 1658 CA PHE A 106 -4.634 8.791 -4.606 1.00 0.00 C ATOM 1659 C PHE A 106 -3.331 9.584 -4.545 1.00 0.00 C ATOM 1660 O PHE A 106 -3.150 10.408 -3.654 1.00 0.00 O ATOM 1661 CB PHE A 106 -4.684 7.766 -3.471 1.00 0.00 C ATOM 1662 CG PHE A 106 -6.072 7.266 -3.174 1.00 0.00 C ATOM 1663 CD1 PHE A 106 -6.808 6.603 -4.145 1.00 0.00 C ATOM 1664 CD2 PHE A 106 -6.639 7.461 -1.925 1.00 0.00 C ATOM 1665 CE1 PHE A 106 -8.084 6.145 -3.874 1.00 0.00 C ATOM 1666 CE2 PHE A 106 -7.914 7.004 -1.649 1.00 0.00 C ATOM 1667 CZ PHE A 106 -8.637 6.345 -2.626 1.00 0.00 C ATOM 0 H PHE A 106 -4.773 7.107 -5.841 1.00 0.00 H new ATOM 0 HA PHE A 106 -5.459 9.494 -4.490 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -4.049 6.919 -3.729 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -4.267 8.214 -2.569 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -6.380 6.443 -5.123 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -6.079 7.976 -1.159 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -8.647 5.631 -4.639 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -8.345 7.162 -0.671 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.633 5.987 -2.412 1.00 0.00 H new ATOM 1677 N LYS A 107 -2.420 9.340 -5.492 1.00 0.00 N ATOM 1678 CA LYS A 107 -1.142 10.054 -5.520 1.00 0.00 C ATOM 1679 C LYS A 107 -1.356 11.547 -5.281 1.00 0.00 C ATOM 1680 O LYS A 107 -0.543 12.211 -4.638 1.00 0.00 O ATOM 1681 CB LYS A 107 -0.427 9.825 -6.860 1.00 0.00 C ATOM 1682 CG LYS A 107 -0.798 10.828 -7.945 1.00 0.00 C ATOM 1683 CD LYS A 107 -0.265 10.402 -9.304 1.00 0.00 C ATOM 1684 CE LYS A 107 -0.913 11.192 -10.430 1.00 0.00 C ATOM 1685 NZ LYS A 107 -0.023 12.274 -10.934 1.00 0.00 N ATOM 0 H LYS A 107 -2.543 8.660 -6.242 1.00 0.00 H new ATOM 0 HA LYS A 107 -0.513 9.663 -4.720 1.00 0.00 H new ATOM 0 HB2 LYS A 107 0.650 9.866 -6.696 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -0.658 8.821 -7.215 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -1.882 10.929 -7.994 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -0.398 11.809 -7.687 1.00 0.00 H new ATOM 0 HD2 LYS A 107 0.815 10.545 -9.333 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -0.450 9.338 -9.451 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -1.164 10.518 -11.249 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -1.848 11.626 -10.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -0.502 12.789 -11.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 0.196 12.932 -10.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 0.859 11.858 -11.295 1.00 0.00 H new ATOM 1699 N ASP A 108 -2.472 12.055 -5.790 1.00 0.00 N ATOM 1700 CA ASP A 108 -2.825 13.457 -5.625 1.00 0.00 C ATOM 1701 C ASP A 108 -3.619 13.656 -4.338 1.00 0.00 C ATOM 1702 O ASP A 108 -3.459 14.659 -3.642 1.00 0.00 O ATOM 1703 CB ASP A 108 -3.638 13.947 -6.824 1.00 0.00 C ATOM 1704 CG ASP A 108 -2.823 13.977 -8.102 1.00 0.00 C ATOM 1705 OD1 ASP A 108 -1.902 14.815 -8.199 1.00 0.00 O ATOM 1706 OD2 ASP A 108 -3.105 13.162 -9.005 1.00 0.00 O ATOM 0 H ASP A 108 -3.151 11.512 -6.323 1.00 0.00 H new ATOM 0 HA ASP A 108 -1.906 14.039 -5.564 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -4.503 13.298 -6.963 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -4.020 14.947 -6.616 1.00 0.00 H new ATOM 1711 N ASP A 109 -4.486 12.692 -4.039 1.00 0.00 N ATOM 1712 CA ASP A 109 -5.327 12.753 -2.843 1.00 0.00 C ATOM 1713 C ASP A 109 -4.628 12.164 -1.614 1.00 0.00 C ATOM 1714 O ASP A 109 -5.255 11.973 -0.572 1.00 0.00 O ATOM 1715 CB ASP A 109 -6.644 12.015 -3.090 1.00 0.00 C ATOM 1716 CG ASP A 109 -7.731 12.933 -3.615 1.00 0.00 C ATOM 1717 OD1 ASP A 109 -7.734 14.124 -3.240 1.00 0.00 O ATOM 1718 OD2 ASP A 109 -8.579 12.460 -4.401 1.00 0.00 O ATOM 0 H ASP A 109 -4.626 11.857 -4.608 1.00 0.00 H new ATOM 0 HA ASP A 109 -5.524 13.805 -2.639 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.477 11.208 -3.804 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.979 11.554 -2.161 1.00 0.00 H new ATOM 1723 N VAL A 110 -3.339 11.860 -1.739 1.00 0.00 N ATOM 1724 CA VAL A 110 -2.582 11.274 -0.635 1.00 0.00 C ATOM 1725 C VAL A 110 -2.028 12.345 0.302 1.00 0.00 C ATOM 1726 O VAL A 110 -1.886 13.507 -0.078 1.00 0.00 O ATOM 1727 CB VAL A 110 -1.418 10.409 -1.157 1.00 0.00 C ATOM 1728 CG1 VAL A 110 -0.419 11.258 -1.930 1.00 0.00 C ATOM 1729 CG2 VAL A 110 -0.734 9.680 -0.009 1.00 0.00 C ATOM 0 H VAL A 110 -2.798 12.009 -2.591 1.00 0.00 H new ATOM 0 HA VAL A 110 -3.278 10.647 -0.078 1.00 0.00 H new ATOM 0 HB VAL A 110 -1.827 9.663 -1.839 1.00 0.00 H new ATOM 0 HG11 VAL A 110 0.394 10.627 -2.289 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.918 11.725 -2.779 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.016 12.032 -1.276 1.00 0.00 H new ATOM 0 HG21 VAL A 110 0.085 9.075 -0.399 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -0.341 10.407 0.702 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.455 9.035 0.493 1.00 0.00 H new ATOM 1739 N ASP A 111 -1.720 11.940 1.533 1.00 0.00 N ATOM 1740 CA ASP A 111 -1.183 12.857 2.534 1.00 0.00 C ATOM 1741 C ASP A 111 0.075 12.286 3.186 1.00 0.00 C ATOM 1742 O ASP A 111 1.059 12.999 3.382 1.00 0.00 O ATOM 1743 CB ASP A 111 -2.238 13.150 3.603 1.00 0.00 C ATOM 1744 CG ASP A 111 -3.069 14.375 3.274 1.00 0.00 C ATOM 1745 OD1 ASP A 111 -4.009 14.253 2.461 1.00 0.00 O ATOM 1746 OD2 ASP A 111 -2.780 15.455 3.830 1.00 0.00 O ATOM 0 H ASP A 111 -1.834 10.981 1.860 1.00 0.00 H new ATOM 0 HA ASP A 111 -0.915 13.786 2.030 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -2.895 12.286 3.708 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -1.746 13.295 4.565 1.00 0.00 H new ATOM 1751 N THR A 112 0.038 10.998 3.521 1.00 0.00 N ATOM 1752 CA THR A 112 1.179 10.339 4.151 1.00 0.00 C ATOM 1753 C THR A 112 1.745 9.252 3.244 1.00 0.00 C ATOM 1754 O THR A 112 1.057 8.756 2.351 1.00 0.00 O ATOM 1755 CB THR A 112 0.785 9.738 5.502 1.00 0.00 C ATOM 1756 OG1 THR A 112 0.153 10.708 6.317 1.00 0.00 O ATOM 1757 CG2 THR A 112 1.964 9.182 6.277 1.00 0.00 C ATOM 0 H THR A 112 -0.768 10.392 3.367 1.00 0.00 H new ATOM 0 HA THR A 112 1.948 11.093 4.316 1.00 0.00 H new ATOM 0 HB THR A 112 0.106 8.918 5.267 1.00 0.00 H new ATOM 0 HG1 THR A 112 0.641 11.555 6.255 1.00 0.00 H new ATOM 0 HG21 THR A 112 1.615 8.771 7.225 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.443 8.395 5.695 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.682 9.980 6.469 1.00 0.00 H new ATOM 1765 N LEU A 113 3.003 8.888 3.472 1.00 0.00 N ATOM 1766 CA LEU A 113 3.655 7.864 2.668 1.00 0.00 C ATOM 1767 C LEU A 113 4.594 7.002 3.511 1.00 0.00 C ATOM 1768 O LEU A 113 5.369 7.512 4.320 1.00 0.00 O ATOM 1769 CB LEU A 113 4.431 8.520 1.527 1.00 0.00 C ATOM 1770 CG LEU A 113 3.959 8.156 0.121 1.00 0.00 C ATOM 1771 CD1 LEU A 113 2.456 8.348 -0.007 1.00 0.00 C ATOM 1772 CD2 LEU A 113 4.694 8.998 -0.905 1.00 0.00 C ATOM 0 H LEU A 113 3.589 9.287 4.206 1.00 0.00 H new ATOM 0 HA LEU A 113 2.882 7.213 2.259 1.00 0.00 H new ATOM 0 HB2 LEU A 113 4.370 9.602 1.644 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.482 8.248 1.621 1.00 0.00 H new ATOM 0 HG LEU A 113 4.182 7.105 -0.062 1.00 0.00 H new ATOM 0 HD11 LEU A 113 2.140 8.083 -1.016 1.00 0.00 H new ATOM 0 HD12 LEU A 113 1.945 7.709 0.713 1.00 0.00 H new ATOM 0 HD13 LEU A 113 2.204 9.390 0.190 1.00 0.00 H new ATOM 0 HD21 LEU A 113 4.352 8.733 -1.905 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.493 10.053 -0.721 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.765 8.814 -0.827 1.00 0.00 H new ATOM 1784 N LEU A 114 4.522 5.693 3.299 1.00 0.00 N ATOM 1785 CA LEU A 114 5.364 4.740 4.013 1.00 0.00 C ATOM 1786 C LEU A 114 5.894 3.692 3.042 1.00 0.00 C ATOM 1787 O LEU A 114 5.127 2.901 2.492 1.00 0.00 O ATOM 1788 CB LEU A 114 4.575 4.065 5.137 1.00 0.00 C ATOM 1789 CG LEU A 114 4.368 4.920 6.388 1.00 0.00 C ATOM 1790 CD1 LEU A 114 3.004 4.648 7.002 1.00 0.00 C ATOM 1791 CD2 LEU A 114 5.472 4.658 7.401 1.00 0.00 C ATOM 0 H LEU A 114 3.882 5.264 2.631 1.00 0.00 H new ATOM 0 HA LEU A 114 6.204 5.276 4.455 1.00 0.00 H new ATOM 0 HB2 LEU A 114 3.599 3.773 4.750 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.092 3.149 5.423 1.00 0.00 H new ATOM 0 HG LEU A 114 4.410 5.970 6.098 1.00 0.00 H new ATOM 0 HD11 LEU A 114 2.875 5.266 7.891 1.00 0.00 H new ATOM 0 HD12 LEU A 114 2.225 4.887 6.278 1.00 0.00 H new ATOM 0 HD13 LEU A 114 2.932 3.596 7.278 1.00 0.00 H new ATOM 0 HD21 LEU A 114 5.309 5.275 8.285 1.00 0.00 H new ATOM 0 HD22 LEU A 114 5.462 3.606 7.686 1.00 0.00 H new ATOM 0 HD23 LEU A 114 6.437 4.905 6.959 1.00 0.00 H new ATOM 1803 N VAL A 115 7.201 3.701 2.807 1.00 0.00 N ATOM 1804 CA VAL A 115 7.799 2.759 1.870 1.00 0.00 C ATOM 1805 C VAL A 115 8.996 2.021 2.458 1.00 0.00 C ATOM 1806 O VAL A 115 9.708 2.539 3.318 1.00 0.00 O ATOM 1807 CB VAL A 115 8.245 3.475 0.582 1.00 0.00 C ATOM 1808 CG1 VAL A 115 7.071 4.192 -0.060 1.00 0.00 C ATOM 1809 CG2 VAL A 115 9.374 4.453 0.868 1.00 0.00 C ATOM 0 H VAL A 115 7.860 4.343 3.247 1.00 0.00 H new ATOM 0 HA VAL A 115 7.023 2.027 1.646 1.00 0.00 H new ATOM 0 HB VAL A 115 8.616 2.723 -0.114 1.00 0.00 H new ATOM 0 HG11 VAL A 115 7.404 4.693 -0.969 1.00 0.00 H new ATOM 0 HG12 VAL A 115 6.294 3.469 -0.308 1.00 0.00 H new ATOM 0 HG13 VAL A 115 6.671 4.930 0.635 1.00 0.00 H new ATOM 0 HG21 VAL A 115 9.671 4.946 -0.057 1.00 0.00 H new ATOM 0 HG22 VAL A 115 9.035 5.201 1.585 1.00 0.00 H new ATOM 0 HG23 VAL A 115 10.226 3.914 1.282 1.00 0.00 H new ATOM 1819 N THR A 116 9.216 0.810 1.957 1.00 0.00 N ATOM 1820 CA THR A 116 10.333 -0.019 2.387 1.00 0.00 C ATOM 1821 C THR A 116 11.234 -0.315 1.191 1.00 0.00 C ATOM 1822 O THR A 116 10.939 -1.197 0.384 1.00 0.00 O ATOM 1823 CB THR A 116 9.819 -1.325 3.002 1.00 0.00 C ATOM 1824 OG1 THR A 116 9.185 -1.078 4.244 1.00 0.00 O ATOM 1825 CG2 THR A 116 10.906 -2.352 3.240 1.00 0.00 C ATOM 0 H THR A 116 8.627 0.378 1.245 1.00 0.00 H new ATOM 0 HA THR A 116 10.906 0.515 3.145 1.00 0.00 H new ATOM 0 HB THR A 116 9.119 -1.728 2.270 1.00 0.00 H new ATOM 0 HG1 THR A 116 9.500 -1.728 4.907 1.00 0.00 H new ATOM 0 HG21 THR A 116 10.469 -3.250 3.677 1.00 0.00 H new ATOM 0 HG22 THR A 116 11.382 -2.604 2.292 1.00 0.00 H new ATOM 0 HG23 THR A 116 11.651 -1.942 3.922 1.00 0.00 H new ATOM 1833 N ARG A 117 12.320 0.440 1.069 1.00 0.00 N ATOM 1834 CA ARG A 117 13.244 0.268 -0.045 1.00 0.00 C ATOM 1835 C ARG A 117 14.240 -0.857 0.217 1.00 0.00 C ATOM 1836 O ARG A 117 15.167 -0.709 1.013 1.00 0.00 O ATOM 1837 CB ARG A 117 13.994 1.574 -0.314 1.00 0.00 C ATOM 1838 CG ARG A 117 14.144 1.895 -1.793 1.00 0.00 C ATOM 1839 CD ARG A 117 13.973 3.382 -2.061 1.00 0.00 C ATOM 1840 NE ARG A 117 14.746 4.199 -1.129 1.00 0.00 N ATOM 1841 CZ ARG A 117 16.054 4.419 -1.245 1.00 0.00 C ATOM 1842 NH1 ARG A 117 16.738 3.884 -2.249 1.00 0.00 N ATOM 1843 NH2 ARG A 117 16.680 5.177 -0.354 1.00 0.00 N ATOM 0 H ARG A 117 12.581 1.175 1.726 1.00 0.00 H new ATOM 0 HA ARG A 117 12.656 -0.002 -0.922 1.00 0.00 H new ATOM 0 HB2 ARG A 117 13.468 2.393 0.176 1.00 0.00 H new ATOM 0 HB3 ARG A 117 14.984 1.515 0.139 1.00 0.00 H new ATOM 0 HG2 ARG A 117 15.126 1.573 -2.138 1.00 0.00 H new ATOM 0 HG3 ARG A 117 13.405 1.334 -2.365 1.00 0.00 H new ATOM 0 HD2 ARG A 117 14.284 3.604 -3.082 1.00 0.00 H new ATOM 0 HD3 ARG A 117 12.918 3.645 -1.985 1.00 0.00 H new ATOM 0 HE ARG A 117 14.255 4.626 -0.343 1.00 0.00 H new ATOM 0 HH11 ARG A 117 16.262 3.301 -2.937 1.00 0.00 H new ATOM 0 HH12 ARG A 117 17.740 4.056 -2.333 1.00 0.00 H new ATOM 0 HH21 ARG A 117 16.159 5.591 0.419 1.00 0.00 H new ATOM 0 HH22 ARG A 117 17.682 5.346 -0.442 1.00 0.00 H new ATOM 1857 N LEU A 118 14.039 -1.981 -0.465 1.00 0.00 N ATOM 1858 CA LEU A 118 14.917 -3.135 -0.320 1.00 0.00 C ATOM 1859 C LEU A 118 16.296 -2.841 -0.904 1.00 0.00 C ATOM 1860 O LEU A 118 16.444 -1.970 -1.760 1.00 0.00 O ATOM 1861 CB LEU A 118 14.303 -4.354 -1.016 1.00 0.00 C ATOM 1862 CG LEU A 118 13.720 -5.413 -0.079 1.00 0.00 C ATOM 1863 CD1 LEU A 118 12.435 -4.910 0.562 1.00 0.00 C ATOM 1864 CD2 LEU A 118 13.469 -6.710 -0.832 1.00 0.00 C ATOM 0 H LEU A 118 13.273 -2.116 -1.125 1.00 0.00 H new ATOM 0 HA LEU A 118 15.030 -3.349 0.743 1.00 0.00 H new ATOM 0 HB2 LEU A 118 13.515 -4.011 -1.686 1.00 0.00 H new ATOM 0 HB3 LEU A 118 15.068 -4.822 -1.636 1.00 0.00 H new ATOM 0 HG LEU A 118 14.444 -5.609 0.712 1.00 0.00 H new ATOM 0 HD11 LEU A 118 12.035 -5.677 1.225 1.00 0.00 H new ATOM 0 HD12 LEU A 118 12.644 -4.007 1.136 1.00 0.00 H new ATOM 0 HD13 LEU A 118 11.705 -4.685 -0.215 1.00 0.00 H new ATOM 0 HD21 LEU A 118 13.054 -7.452 -0.150 1.00 0.00 H new ATOM 0 HD22 LEU A 118 12.764 -6.529 -1.644 1.00 0.00 H new ATOM 0 HD23 LEU A 118 14.408 -7.080 -1.243 1.00 0.00 H new ATOM 1876 N ALA A 119 17.300 -3.575 -0.438 1.00 0.00 N ATOM 1877 CA ALA A 119 18.664 -3.394 -0.918 1.00 0.00 C ATOM 1878 C ALA A 119 18.875 -4.114 -2.244 1.00 0.00 C ATOM 1879 O ALA A 119 19.387 -3.537 -3.203 1.00 0.00 O ATOM 1880 CB ALA A 119 19.660 -3.895 0.116 1.00 0.00 C ATOM 0 H ALA A 119 17.195 -4.300 0.271 1.00 0.00 H new ATOM 0 HA ALA A 119 18.828 -2.328 -1.078 1.00 0.00 H new ATOM 0 HB1 ALA A 119 20.674 -3.753 -0.257 1.00 0.00 H new ATOM 0 HB2 ALA A 119 19.533 -3.337 1.044 1.00 0.00 H new ATOM 0 HB3 ALA A 119 19.488 -4.955 0.304 1.00 0.00 H new ATOM 1886 N GLY A 120 18.477 -5.380 -2.288 1.00 0.00 N ATOM 1887 CA GLY A 120 18.630 -6.162 -3.498 1.00 0.00 C ATOM 1888 C GLY A 120 17.862 -5.579 -4.667 1.00 0.00 C ATOM 1889 O GLY A 120 16.827 -4.938 -4.483 1.00 0.00 O ATOM 0 H GLY A 120 18.051 -5.878 -1.506 1.00 0.00 H new ATOM 0 HA2 GLY A 120 19.687 -6.223 -3.756 1.00 0.00 H new ATOM 0 HA3 GLY A 120 18.288 -7.180 -3.314 1.00 0.00 H new ATOM 1893 N SER A 121 18.371 -5.805 -5.872 1.00 0.00 N ATOM 1894 CA SER A 121 17.727 -5.301 -7.080 1.00 0.00 C ATOM 1895 C SER A 121 16.877 -6.387 -7.731 1.00 0.00 C ATOM 1896 O SER A 121 17.356 -7.489 -7.997 1.00 0.00 O ATOM 1897 CB SER A 121 18.777 -4.791 -8.070 1.00 0.00 C ATOM 1898 OG SER A 121 18.561 -3.427 -8.386 1.00 0.00 O ATOM 0 H SER A 121 19.227 -6.334 -6.039 1.00 0.00 H new ATOM 0 HA SER A 121 17.076 -4.473 -6.799 1.00 0.00 H new ATOM 0 HB2 SER A 121 19.773 -4.916 -7.645 1.00 0.00 H new ATOM 0 HB3 SER A 121 18.743 -5.388 -8.981 1.00 0.00 H new ATOM 0 HG SER A 121 19.141 -3.168 -9.133 1.00 0.00 H new ATOM 1904 N PHE A 122 15.612 -6.068 -7.982 1.00 0.00 N ATOM 1905 CA PHE A 122 14.693 -7.018 -8.599 1.00 0.00 C ATOM 1906 C PHE A 122 14.059 -6.427 -9.854 1.00 0.00 C ATOM 1907 O PHE A 122 14.054 -5.211 -10.047 1.00 0.00 O ATOM 1908 CB PHE A 122 13.602 -7.422 -7.606 1.00 0.00 C ATOM 1909 CG PHE A 122 14.137 -7.982 -6.319 1.00 0.00 C ATOM 1910 CD1 PHE A 122 14.866 -7.185 -5.451 1.00 0.00 C ATOM 1911 CD2 PHE A 122 13.911 -9.306 -5.978 1.00 0.00 C ATOM 1912 CE1 PHE A 122 15.359 -7.697 -4.267 1.00 0.00 C ATOM 1913 CE2 PHE A 122 14.402 -9.824 -4.794 1.00 0.00 C ATOM 1914 CZ PHE A 122 15.127 -9.019 -3.938 1.00 0.00 C ATOM 0 H PHE A 122 15.200 -5.160 -7.768 1.00 0.00 H new ATOM 0 HA PHE A 122 15.263 -7.903 -8.884 1.00 0.00 H new ATOM 0 HB2 PHE A 122 12.984 -6.552 -7.385 1.00 0.00 H new ATOM 0 HB3 PHE A 122 12.954 -8.163 -8.073 1.00 0.00 H new ATOM 0 HD1 PHE A 122 15.051 -6.151 -5.703 1.00 0.00 H new ATOM 0 HD2 PHE A 122 13.345 -9.940 -6.644 1.00 0.00 H new ATOM 0 HE1 PHE A 122 15.925 -7.065 -3.599 1.00 0.00 H new ATOM 0 HE2 PHE A 122 14.219 -10.857 -4.539 1.00 0.00 H new ATOM 0 HZ PHE A 122 15.512 -9.422 -3.013 1.00 0.00 H new ATOM 1924 N GLU A 123 13.522 -7.297 -10.703 1.00 0.00 N ATOM 1925 CA GLU A 123 12.882 -6.864 -11.939 1.00 0.00 C ATOM 1926 C GLU A 123 11.521 -7.531 -12.106 1.00 0.00 C ATOM 1927 O GLU A 123 11.376 -8.732 -11.881 1.00 0.00 O ATOM 1928 CB GLU A 123 13.773 -7.186 -13.140 1.00 0.00 C ATOM 1929 CG GLU A 123 14.001 -8.675 -13.346 1.00 0.00 C ATOM 1930 CD GLU A 123 15.466 -9.022 -13.532 1.00 0.00 C ATOM 1931 OE1 GLU A 123 16.107 -8.431 -14.426 1.00 0.00 O ATOM 1932 OE2 GLU A 123 15.971 -9.884 -12.783 1.00 0.00 O ATOM 0 H GLU A 123 13.518 -8.307 -10.557 1.00 0.00 H new ATOM 0 HA GLU A 123 12.735 -5.785 -11.886 1.00 0.00 H new ATOM 0 HB2 GLU A 123 13.321 -6.768 -14.040 1.00 0.00 H new ATOM 0 HB3 GLU A 123 14.737 -6.694 -13.009 1.00 0.00 H new ATOM 0 HG2 GLU A 123 13.609 -9.221 -12.488 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.439 -9.007 -14.219 1.00 0.00 H new ATOM 1939 N GLY A 124 10.526 -6.744 -12.501 1.00 0.00 N ATOM 1940 CA GLY A 124 9.190 -7.277 -12.690 1.00 0.00 C ATOM 1941 C GLY A 124 8.380 -6.472 -13.687 1.00 0.00 C ATOM 1942 O GLY A 124 8.858 -6.160 -14.777 1.00 0.00 O ATOM 0 H GLY A 124 10.621 -5.747 -12.694 1.00 0.00 H new ATOM 0 HA2 GLY A 124 9.259 -8.310 -13.032 1.00 0.00 H new ATOM 0 HA3 GLY A 124 8.670 -7.293 -11.732 1.00 0.00 H new ATOM 1946 N ASP A 125 7.150 -6.135 -13.312 1.00 0.00 N ATOM 1947 CA ASP A 125 6.273 -5.361 -14.183 1.00 0.00 C ATOM 1948 C ASP A 125 5.361 -4.447 -13.370 1.00 0.00 C ATOM 1949 O ASP A 125 4.253 -4.123 -13.797 1.00 0.00 O ATOM 1950 CB ASP A 125 5.432 -6.296 -15.053 1.00 0.00 C ATOM 1951 CG ASP A 125 5.215 -5.747 -16.450 1.00 0.00 C ATOM 1952 OD1 ASP A 125 4.457 -4.765 -16.591 1.00 0.00 O ATOM 1953 OD2 ASP A 125 5.803 -6.300 -17.403 1.00 0.00 O ATOM 0 H ASP A 125 6.739 -6.385 -12.413 1.00 0.00 H new ATOM 0 HA ASP A 125 6.898 -4.740 -14.825 1.00 0.00 H new ATOM 0 HB2 ASP A 125 5.924 -7.266 -15.119 1.00 0.00 H new ATOM 0 HB3 ASP A 125 4.466 -6.460 -14.576 1.00 0.00 H new ATOM 1958 N THR A 126 5.833 -4.032 -12.198 1.00 0.00 N ATOM 1959 CA THR A 126 5.055 -3.153 -11.332 1.00 0.00 C ATOM 1960 C THR A 126 5.968 -2.227 -10.534 1.00 0.00 C ATOM 1961 O THR A 126 6.610 -2.649 -9.572 1.00 0.00 O ATOM 1962 CB THR A 126 4.184 -3.977 -10.381 1.00 0.00 C ATOM 1963 OG1 THR A 126 4.144 -5.335 -10.783 1.00 0.00 O ATOM 1964 CG2 THR A 126 2.756 -3.482 -10.300 1.00 0.00 C ATOM 0 H THR A 126 6.748 -4.290 -11.827 1.00 0.00 H new ATOM 0 HA THR A 126 4.410 -2.541 -11.963 1.00 0.00 H new ATOM 0 HB THR A 126 4.648 -3.870 -9.400 1.00 0.00 H new ATOM 0 HG1 THR A 126 4.928 -5.804 -10.429 1.00 0.00 H new ATOM 0 HG21 THR A 126 2.192 -4.109 -9.609 1.00 0.00 H new ATOM 0 HG22 THR A 126 2.748 -2.452 -9.944 1.00 0.00 H new ATOM 0 HG23 THR A 126 2.298 -3.528 -11.288 1.00 0.00 H new ATOM 1972 N LYS A 127 6.016 -0.962 -10.942 1.00 0.00 N ATOM 1973 CA LYS A 127 6.847 0.033 -10.271 1.00 0.00 C ATOM 1974 C LYS A 127 5.993 1.176 -9.730 1.00 0.00 C ATOM 1975 O LYS A 127 4.827 1.319 -10.096 1.00 0.00 O ATOM 1976 CB LYS A 127 7.899 0.582 -11.237 1.00 0.00 C ATOM 1977 CG LYS A 127 7.320 1.054 -12.561 1.00 0.00 C ATOM 1978 CD LYS A 127 8.284 1.973 -13.295 1.00 0.00 C ATOM 1979 CE LYS A 127 8.990 1.250 -14.432 1.00 0.00 C ATOM 1980 NZ LYS A 127 8.399 1.586 -15.756 1.00 0.00 N ATOM 0 H LYS A 127 5.488 -0.601 -11.736 1.00 0.00 H new ATOM 0 HA LYS A 127 7.349 -0.452 -9.434 1.00 0.00 H new ATOM 0 HB2 LYS A 127 8.420 1.413 -10.761 1.00 0.00 H new ATOM 0 HB3 LYS A 127 8.642 -0.192 -11.430 1.00 0.00 H new ATOM 0 HG2 LYS A 127 7.090 0.192 -13.187 1.00 0.00 H new ATOM 0 HG3 LYS A 127 6.381 1.578 -12.383 1.00 0.00 H new ATOM 0 HD2 LYS A 127 7.740 2.831 -13.691 1.00 0.00 H new ATOM 0 HD3 LYS A 127 9.024 2.360 -12.594 1.00 0.00 H new ATOM 0 HE2 LYS A 127 10.047 1.514 -14.429 1.00 0.00 H new ATOM 0 HE3 LYS A 127 8.930 0.174 -14.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 8.908 1.073 -16.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 7.396 1.311 -15.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 8.479 2.610 -15.922 1.00 0.00 H new ATOM 1994 N MET A 128 6.581 1.986 -8.855 1.00 0.00 N ATOM 1995 CA MET A 128 5.871 3.115 -8.263 1.00 0.00 C ATOM 1996 C MET A 128 5.554 4.176 -9.313 1.00 0.00 C ATOM 1997 O MET A 128 6.125 4.177 -10.403 1.00 0.00 O ATOM 1998 CB MET A 128 6.701 3.728 -7.133 1.00 0.00 C ATOM 1999 CG MET A 128 5.940 4.747 -6.298 1.00 0.00 C ATOM 2000 SD MET A 128 4.407 4.084 -5.617 1.00 0.00 S ATOM 2001 CE MET A 128 3.764 5.523 -4.766 1.00 0.00 C ATOM 0 H MET A 128 7.546 1.882 -8.541 1.00 0.00 H new ATOM 0 HA MET A 128 4.930 2.746 -7.856 1.00 0.00 H new ATOM 0 HB2 MET A 128 7.056 2.930 -6.481 1.00 0.00 H new ATOM 0 HB3 MET A 128 7.582 4.207 -7.560 1.00 0.00 H new ATOM 0 HG2 MET A 128 6.576 5.090 -5.482 1.00 0.00 H new ATOM 0 HG3 MET A 128 5.713 5.618 -6.913 1.00 0.00 H new ATOM 0 HE1 MET A 128 3.265 5.211 -3.848 1.00 0.00 H new ATOM 0 HE2 MET A 128 4.584 6.198 -4.522 1.00 0.00 H new ATOM 0 HE3 MET A 128 3.050 6.038 -5.409 1.00 0.00 H new ATOM 2011 N ILE A 129 4.636 5.077 -8.974 1.00 0.00 N ATOM 2012 CA ILE A 129 4.234 6.146 -9.882 1.00 0.00 C ATOM 2013 C ILE A 129 4.805 7.493 -9.439 1.00 0.00 C ATOM 2014 O ILE A 129 5.093 7.695 -8.259 1.00 0.00 O ATOM 2015 CB ILE A 129 2.697 6.255 -9.971 1.00 0.00 C ATOM 2016 CG1 ILE A 129 2.102 6.575 -8.597 1.00 0.00 C ATOM 2017 CG2 ILE A 129 2.103 4.967 -10.525 1.00 0.00 C ATOM 2018 CD1 ILE A 129 1.882 8.053 -8.362 1.00 0.00 C ATOM 0 H ILE A 129 4.156 5.087 -8.074 1.00 0.00 H new ATOM 0 HA ILE A 129 4.633 5.894 -10.865 1.00 0.00 H new ATOM 0 HB ILE A 129 2.447 7.069 -10.651 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.151 6.053 -8.492 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.765 6.187 -7.824 1.00 0.00 H new ATOM 0 HG21 ILE A 129 1.019 5.061 -10.581 1.00 0.00 H new ATOM 0 HG22 ILE A 129 2.503 4.781 -11.522 1.00 0.00 H new ATOM 0 HG23 ILE A 129 2.362 4.136 -9.869 1.00 0.00 H new ATOM 0 HD11 ILE A 129 1.459 8.204 -7.369 1.00 0.00 H new ATOM 0 HD12 ILE A 129 2.834 8.579 -8.435 1.00 0.00 H new ATOM 0 HD13 ILE A 129 1.194 8.442 -9.113 1.00 0.00 H new ATOM 2030 N PRO A 130 4.977 8.437 -10.383 1.00 0.00 N ATOM 2031 CA PRO A 130 5.516 9.769 -10.082 1.00 0.00 C ATOM 2032 C PRO A 130 4.567 10.594 -9.217 1.00 0.00 C ATOM 2033 O PRO A 130 3.385 10.730 -9.531 1.00 0.00 O ATOM 2034 CB PRO A 130 5.678 10.413 -11.462 1.00 0.00 C ATOM 2035 CG PRO A 130 4.713 9.689 -12.336 1.00 0.00 C ATOM 2036 CD PRO A 130 4.660 8.281 -11.815 1.00 0.00 C ATOM 0 HA PRO A 130 6.445 9.712 -9.515 1.00 0.00 H new ATOM 0 HB2 PRO A 130 5.458 11.480 -11.429 1.00 0.00 H new ATOM 0 HB3 PRO A 130 6.699 10.309 -11.829 1.00 0.00 H new ATOM 0 HG2 PRO A 130 3.729 10.156 -12.301 1.00 0.00 H new ATOM 0 HG3 PRO A 130 5.038 9.708 -13.376 1.00 0.00 H new ATOM 0 HD2 PRO A 130 3.677 7.834 -11.963 1.00 0.00 H new ATOM 0 HD3 PRO A 130 5.382 7.638 -12.319 1.00 0.00 H new ATOM 2044 N LEU A 131 5.091 11.134 -8.121 1.00 0.00 N ATOM 2045 CA LEU A 131 4.289 11.936 -7.201 1.00 0.00 C ATOM 2046 C LEU A 131 4.949 13.285 -6.930 1.00 0.00 C ATOM 2047 O LEU A 131 6.111 13.496 -7.270 1.00 0.00 O ATOM 2048 CB LEU A 131 4.087 11.191 -5.873 1.00 0.00 C ATOM 2049 CG LEU A 131 4.265 9.668 -5.930 1.00 0.00 C ATOM 2050 CD1 LEU A 131 5.479 9.240 -5.119 1.00 0.00 C ATOM 2051 CD2 LEU A 131 3.013 8.962 -5.426 1.00 0.00 C ATOM 0 H LEU A 131 6.068 11.031 -7.847 1.00 0.00 H new ATOM 0 HA LEU A 131 3.320 12.107 -7.671 1.00 0.00 H new ATOM 0 HB2 LEU A 131 4.788 11.593 -5.142 1.00 0.00 H new ATOM 0 HB3 LEU A 131 3.084 11.407 -5.505 1.00 0.00 H new ATOM 0 HG LEU A 131 4.427 9.382 -6.969 1.00 0.00 H new ATOM 0 HD11 LEU A 131 5.588 8.157 -5.172 1.00 0.00 H new ATOM 0 HD12 LEU A 131 6.373 9.715 -5.524 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.347 9.541 -4.080 1.00 0.00 H new ATOM 0 HD21 LEU A 131 3.159 7.883 -5.474 1.00 0.00 H new ATOM 0 HD22 LEU A 131 2.820 9.256 -4.394 1.00 0.00 H new ATOM 0 HD23 LEU A 131 2.163 9.241 -6.048 1.00 0.00 H new ATOM 2063 N ASN A 132 4.203 14.190 -6.302 1.00 0.00 N ATOM 2064 CA ASN A 132 4.726 15.510 -5.968 1.00 0.00 C ATOM 2065 C ASN A 132 5.562 15.427 -4.695 1.00 0.00 C ATOM 2066 O ASN A 132 5.119 15.824 -3.617 1.00 0.00 O ATOM 2067 CB ASN A 132 3.581 16.509 -5.784 1.00 0.00 C ATOM 2068 CG ASN A 132 3.926 17.887 -6.315 1.00 0.00 C ATOM 2069 OD1 ASN A 132 3.155 18.487 -7.065 1.00 0.00 O ATOM 2070 ND2 ASN A 132 5.089 18.397 -5.928 1.00 0.00 N ATOM 0 H ASN A 132 3.237 14.033 -6.015 1.00 0.00 H new ATOM 0 HA ASN A 132 5.356 15.856 -6.787 1.00 0.00 H new ATOM 0 HB2 ASN A 132 2.693 16.138 -6.295 1.00 0.00 H new ATOM 0 HB3 ASN A 132 3.333 16.582 -4.725 1.00 0.00 H new ATOM 0 HD21 ASN A 132 5.374 19.321 -6.253 1.00 0.00 H new ATOM 0 HD22 ASN A 132 5.697 17.865 -5.305 1.00 0.00 H new ATOM 2077 N TRP A 133 6.766 14.882 -4.828 1.00 0.00 N ATOM 2078 CA TRP A 133 7.666 14.710 -3.694 1.00 0.00 C ATOM 2079 C TRP A 133 8.016 16.036 -3.027 1.00 0.00 C ATOM 2080 O TRP A 133 8.143 16.098 -1.805 1.00 0.00 O ATOM 2081 CB TRP A 133 8.936 13.984 -4.136 1.00 0.00 C ATOM 2082 CG TRP A 133 8.665 12.593 -4.616 1.00 0.00 C ATOM 2083 CD1 TRP A 133 8.244 12.227 -5.860 1.00 0.00 C ATOM 2084 CD2 TRP A 133 8.782 11.383 -3.859 1.00 0.00 C ATOM 2085 NE1 TRP A 133 8.084 10.864 -5.924 1.00 0.00 N ATOM 2086 CE2 TRP A 133 8.413 10.322 -4.708 1.00 0.00 C ATOM 2087 CE3 TRP A 133 9.165 11.092 -2.546 1.00 0.00 C ATOM 2088 CZ2 TRP A 133 8.414 8.995 -4.287 1.00 0.00 C ATOM 2089 CZ3 TRP A 133 9.166 9.774 -2.129 1.00 0.00 C ATOM 2090 CH2 TRP A 133 8.794 8.740 -2.997 1.00 0.00 C ATOM 0 H TRP A 133 7.143 14.550 -5.716 1.00 0.00 H new ATOM 0 HA TRP A 133 7.144 14.106 -2.952 1.00 0.00 H new ATOM 0 HB2 TRP A 133 9.417 14.552 -4.932 1.00 0.00 H new ATOM 0 HB3 TRP A 133 9.638 13.947 -3.303 1.00 0.00 H new ATOM 0 HD1 TRP A 133 8.063 12.910 -6.677 1.00 0.00 H new ATOM 0 HE1 TRP A 133 7.772 10.341 -6.742 1.00 0.00 H new ATOM 0 HE3 TRP A 133 9.455 11.883 -1.870 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 8.125 8.196 -4.954 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 9.459 9.538 -1.117 1.00 0.00 H new ATOM 0 HH2 TRP A 133 8.807 7.720 -2.641 1.00 0.00 H new ATOM 2101 N ASP A 134 8.174 17.097 -3.814 1.00 0.00 N ATOM 2102 CA ASP A 134 8.510 18.405 -3.257 1.00 0.00 C ATOM 2103 C ASP A 134 7.481 18.834 -2.216 1.00 0.00 C ATOM 2104 O ASP A 134 7.833 19.350 -1.155 1.00 0.00 O ATOM 2105 CB ASP A 134 8.596 19.451 -4.371 1.00 0.00 C ATOM 2106 CG ASP A 134 10.028 19.802 -4.725 1.00 0.00 C ATOM 2107 OD1 ASP A 134 10.710 20.428 -3.887 1.00 0.00 O ATOM 2108 OD2 ASP A 134 10.467 19.450 -5.840 1.00 0.00 O ATOM 0 H ASP A 134 8.076 17.079 -4.829 1.00 0.00 H new ATOM 0 HA ASP A 134 9.481 18.326 -2.769 1.00 0.00 H new ATOM 0 HB2 ASP A 134 8.087 19.075 -5.259 1.00 0.00 H new ATOM 0 HB3 ASP A 134 8.070 20.353 -4.060 1.00 0.00 H new ATOM 2113 N ASP A 135 6.206 18.615 -2.527 1.00 0.00 N ATOM 2114 CA ASP A 135 5.123 18.977 -1.619 1.00 0.00 C ATOM 2115 C ASP A 135 5.049 18.018 -0.429 1.00 0.00 C ATOM 2116 O ASP A 135 4.203 18.176 0.451 1.00 0.00 O ATOM 2117 CB ASP A 135 3.788 18.986 -2.367 1.00 0.00 C ATOM 2118 CG ASP A 135 3.312 20.391 -2.683 1.00 0.00 C ATOM 2119 OD1 ASP A 135 3.273 21.227 -1.756 1.00 0.00 O ATOM 2120 OD2 ASP A 135 2.978 20.654 -3.857 1.00 0.00 O ATOM 0 H ASP A 135 5.898 18.189 -3.401 1.00 0.00 H new ATOM 0 HA ASP A 135 5.328 19.976 -1.235 1.00 0.00 H new ATOM 0 HB2 ASP A 135 3.891 18.423 -3.295 1.00 0.00 H new ATOM 0 HB3 ASP A 135 3.035 18.476 -1.766 1.00 0.00 H new ATOM 2125 N PHE A 136 5.937 17.025 -0.405 1.00 0.00 N ATOM 2126 CA PHE A 136 5.964 16.052 0.679 1.00 0.00 C ATOM 2127 C PHE A 136 7.337 16.021 1.342 1.00 0.00 C ATOM 2128 O PHE A 136 8.365 15.984 0.666 1.00 0.00 O ATOM 2129 CB PHE A 136 5.609 14.660 0.153 1.00 0.00 C ATOM 2130 CG PHE A 136 4.133 14.432 -0.006 1.00 0.00 C ATOM 2131 CD1 PHE A 136 3.374 15.259 -0.819 1.00 0.00 C ATOM 2132 CD2 PHE A 136 3.505 13.389 0.655 1.00 0.00 C ATOM 2133 CE1 PHE A 136 2.016 15.050 -0.968 1.00 0.00 C ATOM 2134 CE2 PHE A 136 2.148 13.175 0.510 1.00 0.00 C ATOM 2135 CZ PHE A 136 1.402 14.006 -0.303 1.00 0.00 C ATOM 0 H PHE A 136 6.645 16.876 -1.124 1.00 0.00 H new ATOM 0 HA PHE A 136 5.225 16.351 1.422 1.00 0.00 H new ATOM 0 HB2 PHE A 136 6.096 14.510 -0.810 1.00 0.00 H new ATOM 0 HB3 PHE A 136 6.012 13.910 0.834 1.00 0.00 H new ATOM 0 HD1 PHE A 136 3.849 16.076 -1.342 1.00 0.00 H new ATOM 0 HD2 PHE A 136 4.083 12.735 1.291 1.00 0.00 H new ATOM 0 HE1 PHE A 136 1.435 15.702 -1.604 1.00 0.00 H new ATOM 0 HE2 PHE A 136 1.671 12.359 1.032 1.00 0.00 H new ATOM 0 HZ PHE A 136 0.341 13.840 -0.419 1.00 0.00 H new ATOM 2145 N THR A 137 7.342 16.050 2.669 1.00 0.00 N ATOM 2146 CA THR A 137 8.587 16.041 3.428 1.00 0.00 C ATOM 2147 C THR A 137 8.722 14.761 4.246 1.00 0.00 C ATOM 2148 O THR A 137 7.748 14.267 4.814 1.00 0.00 O ATOM 2149 CB THR A 137 8.650 17.261 4.350 1.00 0.00 C ATOM 2150 OG1 THR A 137 8.728 18.457 3.594 1.00 0.00 O ATOM 2151 CG2 THR A 137 9.831 17.242 5.298 1.00 0.00 C ATOM 0 H THR A 137 6.499 16.080 3.242 1.00 0.00 H new ATOM 0 HA THR A 137 9.415 16.082 2.721 1.00 0.00 H new ATOM 0 HB THR A 137 7.734 17.221 4.939 1.00 0.00 H new ATOM 0 HG1 THR A 137 8.766 19.226 4.201 1.00 0.00 H new ATOM 0 HG21 THR A 137 9.812 18.136 5.921 1.00 0.00 H new ATOM 0 HG22 THR A 137 9.775 16.357 5.932 1.00 0.00 H new ATOM 0 HG23 THR A 137 10.758 17.219 4.724 1.00 0.00 H new ATOM 2159 N LYS A 138 9.940 14.232 4.300 1.00 0.00 N ATOM 2160 CA LYS A 138 10.211 13.013 5.048 1.00 0.00 C ATOM 2161 C LYS A 138 9.985 13.230 6.539 1.00 0.00 C ATOM 2162 O LYS A 138 10.616 14.089 7.155 1.00 0.00 O ATOM 2163 CB LYS A 138 11.645 12.544 4.801 1.00 0.00 C ATOM 2164 CG LYS A 138 11.905 11.124 5.278 1.00 0.00 C ATOM 2165 CD LYS A 138 12.610 10.295 4.216 1.00 0.00 C ATOM 2166 CE LYS A 138 14.100 10.170 4.499 1.00 0.00 C ATOM 2167 NZ LYS A 138 14.921 10.853 3.462 1.00 0.00 N ATOM 0 H LYS A 138 10.755 14.630 3.833 1.00 0.00 H new ATOM 0 HA LYS A 138 9.521 12.244 4.701 1.00 0.00 H new ATOM 0 HB2 LYS A 138 11.862 12.607 3.735 1.00 0.00 H new ATOM 0 HB3 LYS A 138 12.333 13.221 5.307 1.00 0.00 H new ATOM 0 HG2 LYS A 138 12.512 11.149 6.183 1.00 0.00 H new ATOM 0 HG3 LYS A 138 10.960 10.650 5.542 1.00 0.00 H new ATOM 0 HD2 LYS A 138 12.163 9.302 4.173 1.00 0.00 H new ATOM 0 HD3 LYS A 138 12.462 10.754 3.238 1.00 0.00 H new ATOM 0 HE2 LYS A 138 14.321 10.598 5.477 1.00 0.00 H new ATOM 0 HE3 LYS A 138 14.374 9.116 4.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 15.930 10.745 3.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 14.730 10.428 2.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 14.678 11.864 3.437 1.00 0.00 H new ATOM 2181 N VAL A 139 9.080 12.446 7.112 1.00 0.00 N ATOM 2182 CA VAL A 139 8.767 12.551 8.531 1.00 0.00 C ATOM 2183 C VAL A 139 9.659 11.633 9.356 1.00 0.00 C ATOM 2184 O VAL A 139 9.997 11.943 10.499 1.00 0.00 O ATOM 2185 CB VAL A 139 7.293 12.202 8.820 1.00 0.00 C ATOM 2186 CG1 VAL A 139 6.839 12.842 10.123 1.00 0.00 C ATOM 2187 CG2 VAL A 139 6.397 12.633 7.667 1.00 0.00 C ATOM 0 H VAL A 139 8.550 11.730 6.615 1.00 0.00 H new ATOM 0 HA VAL A 139 8.946 13.589 8.813 1.00 0.00 H new ATOM 0 HB VAL A 139 7.213 11.120 8.922 1.00 0.00 H new ATOM 0 HG11 VAL A 139 5.797 12.585 10.311 1.00 0.00 H new ATOM 0 HG12 VAL A 139 7.457 12.475 10.943 1.00 0.00 H new ATOM 0 HG13 VAL A 139 6.938 13.925 10.050 1.00 0.00 H new ATOM 0 HG21 VAL A 139 5.362 12.376 7.894 1.00 0.00 H new ATOM 0 HG22 VAL A 139 6.480 13.710 7.524 1.00 0.00 H new ATOM 0 HG23 VAL A 139 6.706 12.121 6.755 1.00 0.00 H new ATOM 2197 N SER A 140 10.035 10.498 8.774 1.00 0.00 N ATOM 2198 CA SER A 140 10.886 9.537 9.467 1.00 0.00 C ATOM 2199 C SER A 140 11.699 8.706 8.479 1.00 0.00 C ATOM 2200 O SER A 140 11.324 8.562 7.316 1.00 0.00 O ATOM 2201 CB SER A 140 10.038 8.616 10.347 1.00 0.00 C ATOM 2202 OG SER A 140 10.691 8.338 11.573 1.00 0.00 O ATOM 0 H SER A 140 9.766 10.222 7.830 1.00 0.00 H new ATOM 0 HA SER A 140 11.579 10.096 10.095 1.00 0.00 H new ATOM 0 HB2 SER A 140 9.073 9.083 10.543 1.00 0.00 H new ATOM 0 HB3 SER A 140 9.839 7.684 9.818 1.00 0.00 H new ATOM 0 HG SER A 140 10.128 7.749 12.117 1.00 0.00 H new ATOM 2208 N SER A 141 12.814 8.162 8.954 1.00 0.00 N ATOM 2209 CA SER A 141 13.683 7.343 8.117 1.00 0.00 C ATOM 2210 C SER A 141 14.484 6.359 8.963 1.00 0.00 C ATOM 2211 O SER A 141 15.196 6.755 9.886 1.00 0.00 O ATOM 2212 CB SER A 141 14.632 8.230 7.310 1.00 0.00 C ATOM 2213 OG SER A 141 15.077 9.334 8.080 1.00 0.00 O ATOM 0 H SER A 141 13.138 8.273 9.915 1.00 0.00 H new ATOM 0 HA SER A 141 13.055 6.776 7.430 1.00 0.00 H new ATOM 0 HB2 SER A 141 15.490 7.644 6.979 1.00 0.00 H new ATOM 0 HB3 SER A 141 14.126 8.588 6.414 1.00 0.00 H new ATOM 0 HG SER A 141 15.684 9.885 7.542 1.00 0.00 H new ATOM 2219 N ARG A 142 14.363 5.076 8.641 1.00 0.00 N ATOM 2220 CA ARG A 142 15.076 4.033 9.369 1.00 0.00 C ATOM 2221 C ARG A 142 15.659 3.004 8.406 1.00 0.00 C ATOM 2222 O ARG A 142 15.070 2.710 7.366 1.00 0.00 O ATOM 2223 CB ARG A 142 14.141 3.345 10.365 1.00 0.00 C ATOM 2224 CG ARG A 142 14.842 2.336 11.261 1.00 0.00 C ATOM 2225 CD ARG A 142 15.665 3.023 12.340 1.00 0.00 C ATOM 2226 NE ARG A 142 15.061 2.883 13.662 1.00 0.00 N ATOM 2227 CZ ARG A 142 15.410 3.615 14.718 1.00 0.00 C ATOM 2228 NH1 ARG A 142 16.357 4.538 14.611 1.00 0.00 N ATOM 2229 NH2 ARG A 142 14.810 3.422 15.885 1.00 0.00 N ATOM 0 H ARG A 142 13.777 4.733 7.880 1.00 0.00 H new ATOM 0 HA ARG A 142 15.895 4.500 9.916 1.00 0.00 H new ATOM 0 HB2 ARG A 142 13.666 4.103 10.988 1.00 0.00 H new ATOM 0 HB3 ARG A 142 13.346 2.840 9.816 1.00 0.00 H new ATOM 0 HG2 ARG A 142 14.102 1.685 11.726 1.00 0.00 H new ATOM 0 HG3 ARG A 142 15.490 1.701 10.657 1.00 0.00 H new ATOM 0 HD2 ARG A 142 16.670 2.600 12.354 1.00 0.00 H new ATOM 0 HD3 ARG A 142 15.768 4.081 12.099 1.00 0.00 H new ATOM 0 HE ARG A 142 14.329 2.183 13.784 1.00 0.00 H new ATOM 0 HH11 ARG A 142 16.822 4.690 13.716 1.00 0.00 H new ATOM 0 HH12 ARG A 142 16.620 5.096 15.424 1.00 0.00 H new ATOM 0 HH21 ARG A 142 14.082 2.713 15.973 1.00 0.00 H new ATOM 0 HH22 ARG A 142 15.077 3.982 16.694 1.00 0.00 H new ATOM 2243 N THR A 143 16.821 2.462 8.756 1.00 0.00 N ATOM 2244 CA THR A 143 17.482 1.468 7.918 1.00 0.00 C ATOM 2245 C THR A 143 17.674 0.156 8.671 1.00 0.00 C ATOM 2246 O THR A 143 18.470 0.076 9.607 1.00 0.00 O ATOM 2247 CB THR A 143 18.835 1.994 7.438 1.00 0.00 C ATOM 2248 OG1 THR A 143 18.718 3.326 6.971 1.00 0.00 O ATOM 2249 CG2 THR A 143 19.437 1.167 6.323 1.00 0.00 C ATOM 0 H THR A 143 17.324 2.694 9.613 1.00 0.00 H new ATOM 0 HA THR A 143 16.844 1.279 7.055 1.00 0.00 H new ATOM 0 HB THR A 143 19.492 1.936 8.306 1.00 0.00 H new ATOM 0 HG1 THR A 143 19.594 3.645 6.670 1.00 0.00 H new ATOM 0 HG21 THR A 143 20.396 1.595 6.030 1.00 0.00 H new ATOM 0 HG22 THR A 143 19.587 0.144 6.669 1.00 0.00 H new ATOM 0 HG23 THR A 143 18.763 1.166 5.466 1.00 0.00 H new ATOM 2257 N VAL A 144 16.945 -0.872 8.250 1.00 0.00 N ATOM 2258 CA VAL A 144 17.038 -2.184 8.876 1.00 0.00 C ATOM 2259 C VAL A 144 17.741 -3.172 7.952 1.00 0.00 C ATOM 2260 O VAL A 144 17.409 -3.276 6.771 1.00 0.00 O ATOM 2261 CB VAL A 144 15.647 -2.744 9.250 1.00 0.00 C ATOM 2262 CG1 VAL A 144 15.344 -2.487 10.718 1.00 0.00 C ATOM 2263 CG2 VAL A 144 14.558 -2.153 8.364 1.00 0.00 C ATOM 0 H VAL A 144 16.282 -0.821 7.476 1.00 0.00 H new ATOM 0 HA VAL A 144 17.617 -2.058 9.791 1.00 0.00 H new ATOM 0 HB VAL A 144 15.664 -3.821 9.084 1.00 0.00 H new ATOM 0 HG11 VAL A 144 14.360 -2.888 10.962 1.00 0.00 H new ATOM 0 HG12 VAL A 144 16.098 -2.974 11.336 1.00 0.00 H new ATOM 0 HG13 VAL A 144 15.356 -1.414 10.909 1.00 0.00 H new ATOM 0 HG21 VAL A 144 13.591 -2.566 8.651 1.00 0.00 H new ATOM 0 HG22 VAL A 144 14.540 -1.070 8.484 1.00 0.00 H new ATOM 0 HG23 VAL A 144 14.763 -2.400 7.322 1.00 0.00 H new ATOM 2273 N GLU A 145 18.717 -3.894 8.494 1.00 0.00 N ATOM 2274 CA GLU A 145 19.467 -4.869 7.711 1.00 0.00 C ATOM 2275 C GLU A 145 19.422 -6.248 8.358 1.00 0.00 C ATOM 2276 O GLU A 145 19.416 -6.375 9.582 1.00 0.00 O ATOM 2277 CB GLU A 145 20.920 -4.418 7.551 1.00 0.00 C ATOM 2278 CG GLU A 145 21.542 -3.910 8.840 1.00 0.00 C ATOM 2279 CD GLU A 145 22.955 -4.419 9.046 1.00 0.00 C ATOM 2280 OE1 GLU A 145 23.197 -5.618 8.794 1.00 0.00 O ATOM 2281 OE2 GLU A 145 23.820 -3.619 9.460 1.00 0.00 O ATOM 0 H GLU A 145 19.006 -3.822 9.470 1.00 0.00 H new ATOM 0 HA GLU A 145 19.001 -4.936 6.728 1.00 0.00 H new ATOM 0 HB2 GLU A 145 21.512 -5.253 7.176 1.00 0.00 H new ATOM 0 HB3 GLU A 145 20.967 -3.630 6.799 1.00 0.00 H new ATOM 0 HG2 GLU A 145 21.550 -2.820 8.830 1.00 0.00 H new ATOM 0 HG3 GLU A 145 20.923 -4.216 9.683 1.00 0.00 H new ATOM 2288 N ASP A 146 19.396 -7.279 7.522 1.00 0.00 N ATOM 2289 CA ASP A 146 19.357 -8.656 7.997 1.00 0.00 C ATOM 2290 C ASP A 146 20.683 -9.355 7.715 1.00 0.00 C ATOM 2291 O ASP A 146 21.652 -8.720 7.301 1.00 0.00 O ATOM 2292 CB ASP A 146 18.209 -9.417 7.328 1.00 0.00 C ATOM 2293 CG ASP A 146 17.031 -9.621 8.260 1.00 0.00 C ATOM 2294 OD1 ASP A 146 16.629 -8.647 8.932 1.00 0.00 O ATOM 2295 OD2 ASP A 146 16.510 -10.755 8.319 1.00 0.00 O ATOM 0 H ASP A 146 19.401 -7.186 6.506 1.00 0.00 H new ATOM 0 HA ASP A 146 19.191 -8.644 9.074 1.00 0.00 H new ATOM 0 HB2 ASP A 146 17.880 -8.870 6.445 1.00 0.00 H new ATOM 0 HB3 ASP A 146 18.570 -10.387 6.986 1.00 0.00 H new ATOM 2300 N THR A 147 20.721 -10.666 7.935 1.00 0.00 N ATOM 2301 CA THR A 147 21.933 -11.440 7.695 1.00 0.00 C ATOM 2302 C THR A 147 22.364 -11.313 6.237 1.00 0.00 C ATOM 2303 O THR A 147 23.550 -11.175 5.938 1.00 0.00 O ATOM 2304 CB THR A 147 21.704 -12.911 8.046 1.00 0.00 C ATOM 2305 OG1 THR A 147 20.345 -13.265 7.862 1.00 0.00 O ATOM 2306 CG2 THR A 147 22.077 -13.251 9.473 1.00 0.00 C ATOM 0 H THR A 147 19.930 -11.212 8.277 1.00 0.00 H new ATOM 0 HA THR A 147 22.725 -11.046 8.332 1.00 0.00 H new ATOM 0 HB THR A 147 22.353 -13.472 7.374 1.00 0.00 H new ATOM 0 HG1 THR A 147 20.219 -14.210 8.090 1.00 0.00 H new ATOM 0 HG21 THR A 147 21.890 -14.309 9.656 1.00 0.00 H new ATOM 0 HG22 THR A 147 23.133 -13.036 9.634 1.00 0.00 H new ATOM 0 HG23 THR A 147 21.476 -12.653 10.158 1.00 0.00 H new ATOM 2314 N ASN A 148 21.388 -11.355 5.337 1.00 0.00 N ATOM 2315 CA ASN A 148 21.658 -11.237 3.909 1.00 0.00 C ATOM 2316 C ASN A 148 21.591 -9.775 3.467 1.00 0.00 C ATOM 2317 O ASN A 148 20.706 -9.033 3.894 1.00 0.00 O ATOM 2318 CB ASN A 148 20.657 -12.071 3.109 1.00 0.00 C ATOM 2319 CG ASN A 148 20.999 -13.548 3.115 1.00 0.00 C ATOM 2320 OD1 ASN A 148 21.912 -13.989 2.417 1.00 0.00 O ATOM 2321 ND2 ASN A 148 20.264 -14.323 3.906 1.00 0.00 N ATOM 0 H ASN A 148 20.402 -11.470 5.571 1.00 0.00 H new ATOM 0 HA ASN A 148 22.664 -11.612 3.719 1.00 0.00 H new ATOM 0 HB2 ASN A 148 19.659 -11.931 3.523 1.00 0.00 H new ATOM 0 HB3 ASN A 148 20.629 -11.712 2.080 1.00 0.00 H new ATOM 0 HD21 ASN A 148 20.447 -15.325 3.951 1.00 0.00 H new ATOM 0 HD22 ASN A 148 19.517 -13.915 4.468 1.00 0.00 H new ATOM 2328 N PRO A 149 22.522 -9.338 2.599 1.00 0.00 N ATOM 2329 CA PRO A 149 22.552 -7.957 2.104 1.00 0.00 C ATOM 2330 C PRO A 149 21.307 -7.617 1.297 1.00 0.00 C ATOM 2331 O PRO A 149 20.913 -6.455 1.197 1.00 0.00 O ATOM 2332 CB PRO A 149 23.792 -7.914 1.201 1.00 0.00 C ATOM 2333 CG PRO A 149 24.596 -9.109 1.582 1.00 0.00 C ATOM 2334 CD PRO A 149 23.611 -10.147 2.029 1.00 0.00 C ATOM 0 HA PRO A 149 22.584 -7.236 2.921 1.00 0.00 H new ATOM 0 HB2 PRO A 149 23.513 -7.947 0.148 1.00 0.00 H new ATOM 0 HB3 PRO A 149 24.358 -6.995 1.353 1.00 0.00 H new ATOM 0 HG2 PRO A 149 25.185 -9.468 0.738 1.00 0.00 H new ATOM 0 HG3 PRO A 149 25.298 -8.868 2.380 1.00 0.00 H new ATOM 0 HD2 PRO A 149 23.266 -10.762 1.198 1.00 0.00 H new ATOM 0 HD3 PRO A 149 24.042 -10.823 2.768 1.00 0.00 H new ATOM 2342 N ALA A 150 20.696 -8.644 0.723 1.00 0.00 N ATOM 2343 CA ALA A 150 19.494 -8.469 -0.083 1.00 0.00 C ATOM 2344 C ALA A 150 18.261 -8.248 0.791 1.00 0.00 C ATOM 2345 O ALA A 150 17.255 -7.707 0.330 1.00 0.00 O ATOM 2346 CB ALA A 150 19.289 -9.673 -0.989 1.00 0.00 C ATOM 0 H ALA A 150 21.013 -9.610 0.800 1.00 0.00 H new ATOM 0 HA ALA A 150 19.630 -7.579 -0.697 1.00 0.00 H new ATOM 0 HB1 ALA A 150 18.388 -9.530 -1.586 1.00 0.00 H new ATOM 0 HB2 ALA A 150 20.149 -9.781 -1.650 1.00 0.00 H new ATOM 0 HB3 ALA A 150 19.183 -10.572 -0.381 1.00 0.00 H new ATOM 2352 N LEU A 151 18.337 -8.672 2.050 1.00 0.00 N ATOM 2353 CA LEU A 151 17.216 -8.518 2.972 1.00 0.00 C ATOM 2354 C LEU A 151 17.277 -7.184 3.715 1.00 0.00 C ATOM 2355 O LEU A 151 16.527 -6.962 4.666 1.00 0.00 O ATOM 2356 CB LEU A 151 17.184 -9.674 3.976 1.00 0.00 C ATOM 2357 CG LEU A 151 16.709 -11.020 3.416 1.00 0.00 C ATOM 2358 CD1 LEU A 151 16.365 -11.974 4.548 1.00 0.00 C ATOM 2359 CD2 LEU A 151 15.509 -10.835 2.498 1.00 0.00 C ATOM 0 H LEU A 151 19.159 -9.122 2.453 1.00 0.00 H new ATOM 0 HA LEU A 151 16.301 -8.533 2.379 1.00 0.00 H new ATOM 0 HB2 LEU A 151 18.185 -9.804 4.387 1.00 0.00 H new ATOM 0 HB3 LEU A 151 16.533 -9.395 4.805 1.00 0.00 H new ATOM 0 HG LEU A 151 17.523 -11.449 2.831 1.00 0.00 H new ATOM 0 HD11 LEU A 151 16.030 -12.925 4.133 1.00 0.00 H new ATOM 0 HD12 LEU A 151 17.248 -12.139 5.166 1.00 0.00 H new ATOM 0 HD13 LEU A 151 15.571 -11.544 5.158 1.00 0.00 H new ATOM 0 HD21 LEU A 151 15.192 -11.805 2.114 1.00 0.00 H new ATOM 0 HD22 LEU A 151 14.691 -10.380 3.056 1.00 0.00 H new ATOM 0 HD23 LEU A 151 15.784 -10.188 1.665 1.00 0.00 H new ATOM 2371 N THR A 152 18.166 -6.296 3.282 1.00 0.00 N ATOM 2372 CA THR A 152 18.303 -4.989 3.914 1.00 0.00 C ATOM 2373 C THR A 152 17.271 -4.016 3.354 1.00 0.00 C ATOM 2374 O THR A 152 17.240 -3.755 2.152 1.00 0.00 O ATOM 2375 CB THR A 152 19.713 -4.437 3.701 1.00 0.00 C ATOM 2376 OG1 THR A 152 20.687 -5.428 3.977 1.00 0.00 O ATOM 2377 CG2 THR A 152 20.023 -3.236 4.569 1.00 0.00 C ATOM 0 H THR A 152 18.800 -6.457 2.499 1.00 0.00 H new ATOM 0 HA THR A 152 18.131 -5.106 4.984 1.00 0.00 H new ATOM 0 HB THR A 152 19.747 -4.129 2.656 1.00 0.00 H new ATOM 0 HG1 THR A 152 20.910 -5.907 3.151 1.00 0.00 H new ATOM 0 HG21 THR A 152 21.038 -2.894 4.368 1.00 0.00 H new ATOM 0 HG22 THR A 152 19.319 -2.434 4.345 1.00 0.00 H new ATOM 0 HG23 THR A 152 19.935 -3.514 5.619 1.00 0.00 H new ATOM 2385 N HIS A 153 16.423 -3.485 4.230 1.00 0.00 N ATOM 2386 CA HIS A 153 15.386 -2.544 3.813 1.00 0.00 C ATOM 2387 C HIS A 153 15.464 -1.252 4.618 1.00 0.00 C ATOM 2388 O HIS A 153 16.136 -1.187 5.648 1.00 0.00 O ATOM 2389 CB HIS A 153 13.992 -3.163 3.972 1.00 0.00 C ATOM 2390 CG HIS A 153 13.979 -4.662 3.950 1.00 0.00 C ATOM 2391 ND1 HIS A 153 13.210 -5.420 4.808 1.00 0.00 N ATOM 2392 CD2 HIS A 153 14.640 -5.543 3.163 1.00 0.00 C ATOM 2393 CE1 HIS A 153 13.400 -6.701 4.550 1.00 0.00 C ATOM 2394 NE2 HIS A 153 14.261 -6.803 3.556 1.00 0.00 N ATOM 0 H HIS A 153 16.432 -3.689 5.229 1.00 0.00 H new ATOM 0 HA HIS A 153 15.556 -2.315 2.761 1.00 0.00 H new ATOM 0 HB2 HIS A 153 13.560 -2.821 4.912 1.00 0.00 H new ATOM 0 HB3 HIS A 153 13.349 -2.793 3.173 1.00 0.00 H new ATOM 0 HD1 HIS A 153 12.591 -5.049 5.529 1.00 0.00 H new ATOM 0 HD2 HIS A 153 15.336 -5.300 2.373 1.00 0.00 H new ATOM 0 HE1 HIS A 153 12.930 -7.525 5.066 1.00 0.00 H new ATOM 2403 N THR A 154 14.768 -0.224 4.141 1.00 0.00 N ATOM 2404 CA THR A 154 14.753 1.068 4.816 1.00 0.00 C ATOM 2405 C THR A 154 13.340 1.642 4.865 1.00 0.00 C ATOM 2406 O THR A 154 12.706 1.848 3.830 1.00 0.00 O ATOM 2407 CB THR A 154 15.689 2.048 4.108 1.00 0.00 C ATOM 2408 OG1 THR A 154 17.001 1.520 4.027 1.00 0.00 O ATOM 2409 CG2 THR A 154 15.778 3.394 4.795 1.00 0.00 C ATOM 0 H THR A 154 14.207 -0.262 3.290 1.00 0.00 H new ATOM 0 HA THR A 154 15.100 0.918 5.838 1.00 0.00 H new ATOM 0 HB THR A 154 15.259 2.192 3.117 1.00 0.00 H new ATOM 0 HG1 THR A 154 17.650 2.254 4.034 1.00 0.00 H new ATOM 0 HG21 THR A 154 16.458 4.041 4.241 1.00 0.00 H new ATOM 0 HG22 THR A 154 14.789 3.851 4.829 1.00 0.00 H new ATOM 0 HG23 THR A 154 16.151 3.260 5.811 1.00 0.00 H new ATOM 2417 N TYR A 155 12.853 1.901 6.075 1.00 0.00 N ATOM 2418 CA TYR A 155 11.516 2.456 6.261 1.00 0.00 C ATOM 2419 C TYR A 155 11.570 3.978 6.315 1.00 0.00 C ATOM 2420 O TYR A 155 12.400 4.552 7.019 1.00 0.00 O ATOM 2421 CB TYR A 155 10.890 1.912 7.547 1.00 0.00 C ATOM 2422 CG TYR A 155 10.063 0.663 7.341 1.00 0.00 C ATOM 2423 CD1 TYR A 155 8.764 0.739 6.854 1.00 0.00 C ATOM 2424 CD2 TYR A 155 10.581 -0.592 7.637 1.00 0.00 C ATOM 2425 CE1 TYR A 155 8.005 -0.400 6.667 1.00 0.00 C ATOM 2426 CE2 TYR A 155 9.828 -1.736 7.452 1.00 0.00 C ATOM 2427 CZ TYR A 155 8.541 -1.635 6.967 1.00 0.00 C ATOM 2428 OH TYR A 155 7.788 -2.771 6.782 1.00 0.00 O ATOM 0 H TYR A 155 13.364 1.735 6.942 1.00 0.00 H new ATOM 0 HA TYR A 155 10.901 2.158 5.412 1.00 0.00 H new ATOM 0 HB2 TYR A 155 11.683 1.698 8.264 1.00 0.00 H new ATOM 0 HB3 TYR A 155 10.261 2.685 7.989 1.00 0.00 H new ATOM 0 HD1 TYR A 155 8.341 1.704 6.618 1.00 0.00 H new ATOM 0 HD2 TYR A 155 11.588 -0.675 8.018 1.00 0.00 H new ATOM 0 HE1 TYR A 155 6.997 -0.324 6.288 1.00 0.00 H new ATOM 0 HE2 TYR A 155 10.245 -2.704 7.686 1.00 0.00 H new ATOM 0 HH TYR A 155 7.812 -3.029 5.837 1.00 0.00 H new ATOM 2438 N GLU A 156 10.689 4.631 5.563 1.00 0.00 N ATOM 2439 CA GLU A 156 10.656 6.088 5.531 1.00 0.00 C ATOM 2440 C GLU A 156 9.227 6.618 5.603 1.00 0.00 C ATOM 2441 O GLU A 156 8.304 6.029 5.040 1.00 0.00 O ATOM 2442 CB GLU A 156 11.334 6.604 4.261 1.00 0.00 C ATOM 2443 CG GLU A 156 12.850 6.639 4.352 1.00 0.00 C ATOM 2444 CD GLU A 156 13.515 6.702 2.991 1.00 0.00 C ATOM 2445 OE1 GLU A 156 12.875 7.198 2.040 1.00 0.00 O ATOM 2446 OE2 GLU A 156 14.676 6.256 2.875 1.00 0.00 O ATOM 0 H GLU A 156 9.993 4.177 4.971 1.00 0.00 H new ATOM 0 HA GLU A 156 11.197 6.450 6.406 1.00 0.00 H new ATOM 0 HB2 GLU A 156 11.043 5.972 3.422 1.00 0.00 H new ATOM 0 HB3 GLU A 156 10.968 7.608 4.046 1.00 0.00 H new ATOM 0 HG2 GLU A 156 13.155 7.504 4.942 1.00 0.00 H new ATOM 0 HG3 GLU A 156 13.199 5.753 4.882 1.00 0.00 H new ATOM 2453 N VAL A 157 9.059 7.744 6.290 1.00 0.00 N ATOM 2454 CA VAL A 157 7.752 8.374 6.428 1.00 0.00 C ATOM 2455 C VAL A 157 7.715 9.694 5.670 1.00 0.00 C ATOM 2456 O VAL A 157 8.730 10.381 5.553 1.00 0.00 O ATOM 2457 CB VAL A 157 7.378 8.626 7.901 1.00 0.00 C ATOM 2458 CG1 VAL A 157 5.921 9.062 8.012 1.00 0.00 C ATOM 2459 CG2 VAL A 157 7.636 7.383 8.738 1.00 0.00 C ATOM 0 H VAL A 157 9.816 8.240 6.761 1.00 0.00 H new ATOM 0 HA VAL A 157 7.023 7.681 6.007 1.00 0.00 H new ATOM 0 HB VAL A 157 8.006 9.430 8.286 1.00 0.00 H new ATOM 0 HG11 VAL A 157 5.672 9.236 9.059 1.00 0.00 H new ATOM 0 HG12 VAL A 157 5.772 9.981 7.446 1.00 0.00 H new ATOM 0 HG13 VAL A 157 5.276 8.280 7.611 1.00 0.00 H new ATOM 0 HG21 VAL A 157 7.366 7.580 9.775 1.00 0.00 H new ATOM 0 HG22 VAL A 157 7.035 6.557 8.357 1.00 0.00 H new ATOM 0 HG23 VAL A 157 8.692 7.119 8.682 1.00 0.00 H new ATOM 2469 N TRP A 158 6.539 10.040 5.166 1.00 0.00 N ATOM 2470 CA TRP A 158 6.366 11.281 4.419 1.00 0.00 C ATOM 2471 C TRP A 158 5.007 11.913 4.692 1.00 0.00 C ATOM 2472 O TRP A 158 3.986 11.230 4.707 1.00 0.00 O ATOM 2473 CB TRP A 158 6.524 11.024 2.920 1.00 0.00 C ATOM 2474 CG TRP A 158 7.880 10.513 2.541 1.00 0.00 C ATOM 2475 CD1 TRP A 158 8.368 9.255 2.749 1.00 0.00 C ATOM 2476 CD2 TRP A 158 8.921 11.246 1.885 1.00 0.00 C ATOM 2477 NE1 TRP A 158 9.651 9.162 2.263 1.00 0.00 N ATOM 2478 CE2 TRP A 158 10.012 10.370 1.728 1.00 0.00 C ATOM 2479 CE3 TRP A 158 9.036 12.557 1.415 1.00 0.00 C ATOM 2480 CZ2 TRP A 158 11.202 10.765 1.121 1.00 0.00 C ATOM 2481 CZ3 TRP A 158 10.218 12.947 0.813 1.00 0.00 C ATOM 2482 CH2 TRP A 158 11.287 12.054 0.670 1.00 0.00 C ATOM 0 H TRP A 158 5.691 9.481 5.260 1.00 0.00 H new ATOM 0 HA TRP A 158 7.137 11.976 4.752 1.00 0.00 H new ATOM 0 HB2 TRP A 158 5.771 10.303 2.602 1.00 0.00 H new ATOM 0 HB3 TRP A 158 6.329 11.949 2.378 1.00 0.00 H new ATOM 0 HD1 TRP A 158 7.826 8.451 3.225 1.00 0.00 H new ATOM 0 HE1 TRP A 158 10.238 8.329 2.296 1.00 0.00 H new ATOM 0 HE3 TRP A 158 8.217 13.253 1.520 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 12.028 10.078 1.010 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 10.319 13.958 0.447 1.00 0.00 H new ATOM 0 HH2 TRP A 158 12.197 12.389 0.194 1.00 0.00 H new ATOM 2493 N GLN A 159 5.007 13.226 4.902 1.00 0.00 N ATOM 2494 CA GLN A 159 3.776 13.962 5.167 1.00 0.00 C ATOM 2495 C GLN A 159 3.762 15.275 4.391 1.00 0.00 C ATOM 2496 O GLN A 159 4.691 16.076 4.494 1.00 0.00 O ATOM 2497 CB GLN A 159 3.631 14.239 6.665 1.00 0.00 C ATOM 2498 CG GLN A 159 2.795 13.201 7.397 1.00 0.00 C ATOM 2499 CD GLN A 159 1.496 13.771 7.934 1.00 0.00 C ATOM 2500 OE1 GLN A 159 0.413 13.445 7.447 1.00 0.00 O ATOM 2501 NE2 GLN A 159 1.598 14.628 8.944 1.00 0.00 N ATOM 0 H GLN A 159 5.848 13.803 4.894 1.00 0.00 H new ATOM 0 HA GLN A 159 2.935 13.351 4.839 1.00 0.00 H new ATOM 0 HB2 GLN A 159 4.622 14.279 7.116 1.00 0.00 H new ATOM 0 HB3 GLN A 159 3.178 15.221 6.802 1.00 0.00 H new ATOM 0 HG2 GLN A 159 2.573 12.376 6.720 1.00 0.00 H new ATOM 0 HG3 GLN A 159 3.375 12.789 8.223 1.00 0.00 H new ATOM 0 HE21 GLN A 159 2.516 14.870 9.317 1.00 0.00 H new ATOM 0 HE22 GLN A 159 0.758 15.044 9.347 1.00 0.00 H new ATOM 2510 N LYS A 160 2.709 15.488 3.607 1.00 0.00 N ATOM 2511 CA LYS A 160 2.586 16.703 2.809 1.00 0.00 C ATOM 2512 C LYS A 160 2.626 17.946 3.689 1.00 0.00 C ATOM 2513 O LYS A 160 2.118 17.944 4.810 1.00 0.00 O ATOM 2514 CB LYS A 160 1.285 16.679 2.005 1.00 0.00 C ATOM 2515 CG LYS A 160 1.166 17.819 1.006 1.00 0.00 C ATOM 2516 CD LYS A 160 -0.155 18.558 1.154 1.00 0.00 C ATOM 2517 CE LYS A 160 -0.435 19.445 -0.048 1.00 0.00 C ATOM 2518 NZ LYS A 160 -0.040 20.859 0.201 1.00 0.00 N ATOM 0 H LYS A 160 1.931 14.836 3.508 1.00 0.00 H new ATOM 0 HA LYS A 160 3.433 16.740 2.124 1.00 0.00 H new ATOM 0 HB2 LYS A 160 1.215 15.731 1.472 1.00 0.00 H new ATOM 0 HB3 LYS A 160 0.441 16.721 2.694 1.00 0.00 H new ATOM 0 HG2 LYS A 160 1.992 18.516 1.149 1.00 0.00 H new ATOM 0 HG3 LYS A 160 1.252 17.426 -0.007 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -0.965 17.838 1.272 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -0.134 19.166 2.059 1.00 0.00 H new ATOM 0 HE2 LYS A 160 0.106 19.064 -0.914 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -1.497 19.402 -0.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -0.889 21.460 0.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 0.444 20.928 1.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 0.601 21.178 -0.553 1.00 0.00 H new ATOM 2532 N LYS A 161 3.235 19.007 3.171 1.00 0.00 N ATOM 2533 CA LYS A 161 3.345 20.262 3.906 1.00 0.00 C ATOM 2534 C LYS A 161 1.978 20.920 4.067 1.00 0.00 C ATOM 2535 O LYS A 161 1.290 21.194 3.083 1.00 0.00 O ATOM 2536 CB LYS A 161 4.302 21.216 3.189 1.00 0.00 C ATOM 2537 CG LYS A 161 5.709 20.663 3.034 1.00 0.00 C ATOM 2538 CD LYS A 161 6.561 21.551 2.142 1.00 0.00 C ATOM 2539 CE LYS A 161 6.947 22.841 2.846 1.00 0.00 C ATOM 2540 NZ LYS A 161 7.087 23.975 1.891 1.00 0.00 N ATOM 0 H LYS A 161 3.660 19.023 2.244 1.00 0.00 H new ATOM 0 HA LYS A 161 3.740 20.040 4.897 1.00 0.00 H new ATOM 0 HB2 LYS A 161 3.900 21.447 2.202 1.00 0.00 H new ATOM 0 HB3 LYS A 161 4.348 22.154 3.742 1.00 0.00 H new ATOM 0 HG2 LYS A 161 6.177 20.575 4.015 1.00 0.00 H new ATOM 0 HG3 LYS A 161 5.662 19.659 2.612 1.00 0.00 H new ATOM 0 HD2 LYS A 161 7.462 21.014 1.846 1.00 0.00 H new ATOM 0 HD3 LYS A 161 6.013 21.784 1.229 1.00 0.00 H new ATOM 0 HE2 LYS A 161 6.192 23.087 3.593 1.00 0.00 H new ATOM 0 HE3 LYS A 161 7.887 22.697 3.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 7.351 24.836 2.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 7.825 23.752 1.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 6.183 24.130 1.401 1.00 0.00 H new ATOM 2554 N ALA A 162 1.591 21.171 5.314 1.00 0.00 N ATOM 2555 CA ALA A 162 0.307 21.798 5.604 1.00 0.00 C ATOM 2556 C ALA A 162 -0.851 20.931 5.118 1.00 0.00 C ATOM 2557 O ALA A 162 -0.613 20.054 4.261 1.00 0.00 O ATOM 2558 CB ALA A 162 0.238 23.180 4.970 1.00 0.00 C ATOM 2559 OXT ALA A 162 -1.985 21.136 5.599 1.00 0.00 O ATOM 0 H ALA A 162 2.148 20.950 6.139 1.00 0.00 H new ATOM 0 HA ALA A 162 0.218 21.902 6.685 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -0.726 23.636 5.195 1.00 0.00 H new ATOM 0 HB2 ALA A 162 1.037 23.804 5.370 1.00 0.00 H new ATOM 0 HB3 ALA A 162 0.354 23.091 3.890 1.00 0.00 H new TER 2565 ALA A 162 HETATM 2566 PA NDP A 170 -4.483 -2.789 -9.130 1.00 0.00 P HETATM 2567 O1A NDP A 170 -3.605 -1.652 -8.792 1.00 0.00 O HETATM 2568 O2A NDP A 170 -4.794 -3.755 -8.057 1.00 0.00 O HETATM 2569 O5B NDP A 170 -5.805 -2.302 -9.874 1.00 0.00 O HETATM 2570 C5B NDP A 170 -5.751 -1.264 -10.870 1.00 0.00 C HETATM 2571 C4B NDP A 170 -7.144 -0.923 -11.342 1.00 0.00 C HETATM 2572 O4B NDP A 170 -7.949 -0.514 -10.204 1.00 0.00 O HETATM 2573 C3B NDP A 170 -7.244 0.240 -12.315 1.00 0.00 C HETATM 2574 O3B NDP A 170 -7.029 -0.198 -13.661 1.00 0.00 O HETATM 2575 C2B NDP A 170 -8.676 0.712 -12.103 1.00 0.00 C HETATM 2576 O2B NDP A 170 -9.633 -0.064 -12.796 1.00 0.00 O HETATM 2577 C1B NDP A 170 -8.833 0.525 -10.592 1.00 0.00 C HETATM 2578 N9A NDP A 170 -8.489 1.723 -9.828 1.00 0.00 N HETATM 2579 C8A NDP A 170 -7.235 2.218 -9.567 1.00 0.00 C HETATM 2580 N7A NDP A 170 -7.239 3.318 -8.854 1.00 0.00 N HETATM 2581 C5A NDP A 170 -8.586 3.565 -8.630 1.00 0.00 C HETATM 2582 C6A NDP A 170 -9.261 4.587 -7.936 1.00 0.00 C HETATM 2583 N6A NDP A 170 -8.641 5.593 -7.314 1.00 0.00 N HETATM 2584 N1A NDP A 170 -10.612 4.539 -7.901 1.00 0.00 N HETATM 2585 C2A NDP A 170 -11.234 3.529 -8.525 1.00 0.00 C HETATM 2586 N3A NDP A 170 -10.711 2.512 -9.210 1.00 0.00 N HETATM 2587 C4A NDP A 170 -9.367 2.589 -9.225 1.00 0.00 C HETATM 2588 O3 NDP A 170 -3.806 -3.612 -10.388 1.00 0.00 O HETATM 2589 PN NDP A 170 -2.268 -3.966 -10.864 1.00 0.00 P HETATM 2590 O1N NDP A 170 -2.338 -4.815 -12.069 1.00 0.00 O HETATM 2591 O2N NDP A 170 -1.510 -2.703 -10.962 1.00 0.00 O HETATM 2592 O5D NDP A 170 -1.832 -4.807 -9.583 1.00 0.00 O HETATM 2593 C5D NDP A 170 -0.925 -4.257 -8.610 1.00 0.00 C HETATM 2594 C4D NDP A 170 0.306 -5.123 -8.495 1.00 0.00 C HETATM 2595 O4D NDP A 170 1.247 -4.508 -7.577 1.00 0.00 O HETATM 2596 C3D NDP A 170 0.080 -6.515 -7.928 1.00 0.00 C HETATM 2597 O3D NDP A 170 -0.322 -7.427 -8.955 1.00 0.00 O HETATM 2598 C2D NDP A 170 1.458 -6.866 -7.381 1.00 0.00 C HETATM 2599 O2D NDP A 170 2.364 -7.341 -8.377 1.00 0.00 O HETATM 2600 C1D NDP A 170 1.926 -5.512 -6.843 1.00 0.00 C HETATM 2601 N1N NDP A 170 1.640 -5.310 -5.423 1.00 0.00 N HETATM 2602 C2N NDP A 170 2.468 -5.178 -4.393 1.00 0.00 C HETATM 2603 C3N NDP A 170 2.146 -4.959 -3.158 1.00 0.00 C HETATM 2604 C7N NDP A 170 3.330 -4.855 -2.353 1.00 0.00 C HETATM 2605 O7N NDP A 170 2.880 -4.532 -1.160 1.00 0.00 O HETATM 2606 N7N NDP A 170 4.640 -4.981 -2.681 1.00 0.00 N HETATM 2607 C4N NDP A 170 0.683 -4.844 -2.829 1.00 0.00 C HETATM 2608 C5N NDP A 170 -0.270 -4.980 -3.899 1.00 0.00 C HETATM 2609 C6N NDP A 170 0.117 -5.212 -5.210 1.00 0.00 C HETATM 2610 P2B NDP A 170 -9.821 -0.228 -14.447 1.00 0.00 P HETATM 2611 O1X NDP A 170 -8.812 -1.424 -14.654 1.00 0.00 O HETATM 2612 O2X NDP A 170 -11.254 -0.754 -14.508 1.00 0.00 O HETATM 2613 O3X NDP A 170 -9.175 1.071 -14.927 1.00 0.00 O HETATM 0 HO3N NDP A 170 -0.976 -6.992 -9.541 1.00 0.00 H new HETATM 0 HO3A NDP A 170 -7.412 -1.092 -13.779 1.00 0.00 H new HETATM 0 HO2N NDP A 170 2.773 -6.579 -8.838 1.00 0.00 H new HETATM 0 H72N NDP A 170 5.358 -4.873 -1.964 1.00 0.00 H new HETATM 0 H71N NDP A 170 4.907 -5.184 -3.644 1.00 0.00 H new HETATM 0 H62A NDP A 170 -9.186 6.305 -6.827 1.00 0.00 H new HETATM 0 H61A NDP A 170 -7.623 5.650 -7.326 1.00 0.00 H new HETATM 0 H52N NDP A 170 -0.641 -3.245 -8.899 1.00 0.00 H new HETATM 0 H52A NDP A 170 -5.272 -0.377 -10.456 1.00 0.00 H new HETATM 0 H51N NDP A 170 -1.419 -4.185 -7.641 1.00 0.00 H new HETATM 0 H51A NDP A 170 -5.143 -1.590 -11.714 1.00 0.00 H new HETATM 0 H42N NDP A 170 0.451 -5.600 -2.079 1.00 0.00 H new HETATM 0 H41N NDP A 170 0.523 -3.872 -2.363 1.00 0.00 H new HETATM 0 H8A NDP A 170 -6.321 1.740 -9.920 1.00 0.00 H new HETATM 0 H6N NDP A 170 -0.599 -5.317 -6.025 1.00 0.00 H new HETATM 0 H5N NDP A 170 -1.333 -4.898 -3.671 1.00 0.00 H new HETATM 0 H4D NDP A 170 0.656 -5.213 -9.523 1.00 0.00 H new HETATM 0 H4B NDP A 170 -7.478 -1.830 -11.845 1.00 0.00 H new HETATM 0 H3D NDP A 170 -0.710 -6.564 -7.179 1.00 0.00 H new HETATM 0 H3B NDP A 170 -6.501 1.020 -12.150 1.00 0.00 H new HETATM 0 H2N NDP A 170 3.533 -5.263 -4.611 1.00 0.00 H new HETATM 0 H2D NDP A 170 1.421 -7.675 -6.652 1.00 0.00 H new HETATM 0 H2B NDP A 170 -8.842 1.724 -12.472 1.00 0.00 H new HETATM 0 H2A NDP A 170 -12.322 3.541 -8.464 1.00 0.00 H new HETATM 0 H1D NDP A 170 3.009 -5.470 -6.955 1.00 0.00 H new HETATM 0 H1B NDP A 170 -9.879 0.298 -10.384 1.00 0.00 H new