USER MOD reduce.3.24.130724 H: found=0, std=0, add=1053, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1051 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 120 CYS SG : rot -134:sc= -6.78! USER MOD Set 1.2: A 127 CYS SG : rot -55:sc= -5.87! USER MOD Set 2.1: A 97 HIS : no HD1:sc= 0.298 K(o=1.2,f=-6.4!) USER MOD Set 2.2: A 106 THR OG1 : rot 173:sc= 0.89 USER MOD Set 3.1: A 67 CYS SG : rot -36:sc= -1.48 USER MOD Set 3.2: A 87 CYS SG : rot -70:sc= 0.129 USER MOD Set 3.3: A 96 GLN : amide:sc= 0.0731 X(o=-1.3,f=-1.5) USER MOD Set 4.1: A 83 THR OG1 : rot 87:sc= 0.616 USER MOD Set 4.2: A 85 THR OG1 : rot 170:sc= 1.53 USER MOD Set 5.1: A 76 THR OG1 : rot 150:sc= 1.02 USER MOD Set 5.2: A 82 LYS NZ :NH3+ 167:sc= 2.22 (180deg=0.843) USER MOD Set 6.1: A 43 CYS SG : rot -54:sc= -0.5 USER MOD Set 6.2: A 56 THR OG1 : rot -45:sc= 0.128 USER MOD Set 7.1: A 22 TYR OH : rot -25:sc= 0.965 USER MOD Set 7.2: A 98 GLN : amide:sc= 0.96 K(o=4.3,f=-0.96) USER MOD Set 7.3: A 105 SER OG : rot -117:sc= 2.34 USER MOD Single : A 3 THR OG1 : rot -29:sc= 0.0164 USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 GLN : amide:sc=-0.00715 X(o=-0.0071,f=-0.25) USER MOD Single : A 16 SER OG : rot 34:sc= 1.16 USER MOD Single : A 17 LYS NZ :NH3+ -162:sc= 1.21 (180deg=0.929) USER MOD Single : A 23 MET CE :methyl 166:sc= -0.0984 (180deg=-0.178) USER MOD Single : A 24 LYS NZ :NH3+ -107:sc= 1.11 (180deg=-0.834!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 MET CE :methyl 168:sc= 0 (180deg=-0.0905) USER MOD Single : A 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot -78:sc= 0.956 USER MOD Single : A 47 CYS SG : rot 150:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ -150:sc= 1.25 (180deg=1.16) USER MOD Single : A 51 ASN : amide:sc= 0.612 K(o=0.61,f=-0.18) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ -116:sc= 0.97 (180deg=0.246) USER MOD Single : A 58 SER OG : rot -33:sc= 1.6 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 166:sc= 1.22 (180deg=1.15) USER MOD Single : A 62 THR OG1 : rot -47:sc= 1.13 USER MOD Single : A 63 THR OG1 : rot 180:sc=-0.00477 USER MOD Single : A 64 GLN : amide:sc= 0 K(o=0,f=-3.1!) USER MOD Single : A 66 SER OG : rot 34:sc= 0.897 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ -126:sc= 1.09 (180deg=-0.995!) USER MOD Single : A 77 THR OG1 : rot -77:sc= 1.02 USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 ASN : amide:sc= -0.0184 K(o=-0.018,f=-0.54) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 1.14 (180deg=1.14) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ 161:sc= 1.32 (180deg=0.224) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 MET CE :methyl 177:sc=-0.00384 (180deg=-0.00838) USER MOD Single : A 123 ASN : amide:sc= 0.0271 X(o=0.027,f=-0.0061) USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot 180:sc= 0 USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ 165:sc= 2.24 (180deg=1.1) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 3 -2.267 -3.645 -1.262 1.00 0.00 N ATOM 2 CA THR A 3 -1.175 -2.628 -1.273 1.00 0.00 C ATOM 3 C THR A 3 -0.091 -2.911 -2.365 1.00 0.00 C ATOM 4 O THR A 3 0.129 -4.049 -2.790 1.00 0.00 O ATOM 5 CB THR A 3 -0.539 -2.434 0.133 1.00 0.00 C ATOM 6 OG1 THR A 3 0.004 -3.653 0.623 1.00 0.00 O ATOM 7 CG2 THR A 3 -1.483 -1.882 1.212 1.00 0.00 C ATOM 0 HA THR A 3 -1.648 -1.685 -1.546 1.00 0.00 H new ATOM 0 HB THR A 3 0.233 -1.684 -0.039 1.00 0.00 H new ATOM 0 HG1 THR A 3 -0.499 -4.408 0.252 1.00 0.00 H new ATOM 0 HG21 THR A 3 -0.942 -1.785 2.153 1.00 0.00 H new ATOM 0 HG22 THR A 3 -1.855 -0.905 0.904 1.00 0.00 H new ATOM 0 HG23 THR A 3 -2.322 -2.565 1.345 1.00 0.00 H new ATOM 14 N VAL A 4 0.627 -1.861 -2.815 1.00 0.00 N ATOM 15 CA VAL A 4 1.732 -2.002 -3.824 1.00 0.00 C ATOM 16 C VAL A 4 2.965 -2.879 -3.378 1.00 0.00 C ATOM 17 O VAL A 4 3.534 -3.594 -4.205 1.00 0.00 O ATOM 18 CB VAL A 4 2.073 -0.595 -4.425 1.00 0.00 C ATOM 19 CG1 VAL A 4 2.912 0.330 -3.512 1.00 0.00 C ATOM 20 CG2 VAL A 4 2.763 -0.693 -5.803 1.00 0.00 C ATOM 0 H VAL A 4 0.472 -0.902 -2.504 1.00 0.00 H new ATOM 0 HA VAL A 4 1.356 -2.623 -4.637 1.00 0.00 H new ATOM 0 HB VAL A 4 1.091 -0.133 -4.528 1.00 0.00 H new ATOM 0 HG11 VAL A 4 3.093 1.277 -4.021 1.00 0.00 H new ATOM 0 HG12 VAL A 4 2.370 0.514 -2.584 1.00 0.00 H new ATOM 0 HG13 VAL A 4 3.865 -0.148 -3.287 1.00 0.00 H new ATOM 0 HG21 VAL A 4 2.977 0.309 -6.175 1.00 0.00 H new ATOM 0 HG22 VAL A 4 3.694 -1.251 -5.705 1.00 0.00 H new ATOM 0 HG23 VAL A 4 2.105 -1.207 -6.504 1.00 0.00 H new ATOM 30 N GLN A 5 3.317 -2.896 -2.076 1.00 0.00 N ATOM 31 CA GLN A 5 4.207 -3.927 -1.469 1.00 0.00 C ATOM 32 C GLN A 5 3.710 -5.417 -1.543 1.00 0.00 C ATOM 33 O GLN A 5 4.540 -6.314 -1.700 1.00 0.00 O ATOM 34 CB GLN A 5 4.466 -3.493 -0.001 1.00 0.00 C ATOM 35 CG GLN A 5 5.353 -2.230 0.185 1.00 0.00 C ATOM 36 CD GLN A 5 5.666 -1.875 1.641 1.00 0.00 C ATOM 37 OE1 GLN A 5 6.764 -2.080 2.144 1.00 0.00 O ATOM 38 NE2 GLN A 5 4.721 -1.327 2.366 1.00 0.00 N ATOM 0 H GLN A 5 2.995 -2.196 -1.408 1.00 0.00 H new ATOM 0 HA GLN A 5 5.117 -3.956 -2.068 1.00 0.00 H new ATOM 0 HB2 GLN A 5 3.504 -3.312 0.480 1.00 0.00 H new ATOM 0 HB3 GLN A 5 4.935 -4.324 0.526 1.00 0.00 H new ATOM 0 HG2 GLN A 5 6.292 -2.381 -0.348 1.00 0.00 H new ATOM 0 HG3 GLN A 5 4.854 -1.381 -0.282 1.00 0.00 H new ATOM 0 HE21 GLN A 5 3.803 -1.151 1.958 1.00 0.00 H new ATOM 0 HE22 GLN A 5 4.904 -1.076 3.338 1.00 0.00 H new ATOM 47 N GLN A 6 2.391 -5.702 -1.481 1.00 0.00 N ATOM 48 CA GLN A 6 1.832 -7.043 -1.853 1.00 0.00 C ATOM 49 C GLN A 6 2.022 -7.462 -3.355 1.00 0.00 C ATOM 50 O GLN A 6 2.249 -8.645 -3.622 1.00 0.00 O ATOM 51 CB GLN A 6 0.334 -7.121 -1.449 1.00 0.00 C ATOM 52 CG GLN A 6 0.033 -7.065 0.073 1.00 0.00 C ATOM 53 CD GLN A 6 -1.449 -6.900 0.436 1.00 0.00 C ATOM 54 OE1 GLN A 6 -2.363 -6.951 -0.380 1.00 0.00 O ATOM 55 NE2 GLN A 6 -1.739 -6.671 1.693 1.00 0.00 N ATOM 0 H GLN A 6 1.686 -5.030 -1.179 1.00 0.00 H new ATOM 0 HA GLN A 6 2.422 -7.767 -1.291 1.00 0.00 H new ATOM 0 HB2 GLN A 6 -0.195 -6.301 -1.934 1.00 0.00 H new ATOM 0 HB3 GLN A 6 -0.081 -8.047 -1.847 1.00 0.00 H new ATOM 0 HG2 GLN A 6 0.405 -7.979 0.535 1.00 0.00 H new ATOM 0 HG3 GLN A 6 0.592 -6.237 0.508 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -0.994 -6.625 2.388 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -2.710 -6.539 1.977 1.00 0.00 H new ATOM 64 N LEU A 7 1.990 -6.516 -4.318 1.00 0.00 N ATOM 65 CA LEU A 7 2.481 -6.762 -5.708 1.00 0.00 C ATOM 66 C LEU A 7 4.036 -6.979 -5.893 1.00 0.00 C ATOM 67 O LEU A 7 4.450 -7.257 -7.020 1.00 0.00 O ATOM 68 CB LEU A 7 2.018 -5.609 -6.661 1.00 0.00 C ATOM 69 CG LEU A 7 0.539 -5.128 -6.706 1.00 0.00 C ATOM 70 CD1 LEU A 7 0.342 -4.137 -7.868 1.00 0.00 C ATOM 71 CD2 LEU A 7 -0.490 -6.255 -6.857 1.00 0.00 C ATOM 0 H LEU A 7 1.631 -5.573 -4.167 1.00 0.00 H new ATOM 0 HA LEU A 7 2.030 -7.721 -5.965 1.00 0.00 H new ATOM 0 HB2 LEU A 7 2.626 -4.737 -6.420 1.00 0.00 H new ATOM 0 HB3 LEU A 7 2.282 -5.912 -7.674 1.00 0.00 H new ATOM 0 HG LEU A 7 0.361 -4.658 -5.739 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -0.696 -3.806 -7.892 1.00 0.00 H new ATOM 0 HD12 LEU A 7 0.995 -3.276 -7.726 1.00 0.00 H new ATOM 0 HD13 LEU A 7 0.588 -4.627 -8.810 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -1.494 -5.831 -6.879 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -0.304 -6.796 -7.785 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -0.405 -6.941 -6.014 1.00 0.00 H new ATOM 83 N GLU A 8 4.902 -6.866 -4.861 1.00 0.00 N ATOM 84 CA GLU A 8 6.378 -6.975 -5.012 1.00 0.00 C ATOM 85 C GLU A 8 6.864 -8.461 -5.122 1.00 0.00 C ATOM 86 O GLU A 8 6.612 -9.276 -4.226 1.00 0.00 O ATOM 87 CB GLU A 8 7.035 -6.231 -3.813 1.00 0.00 C ATOM 88 CG GLU A 8 8.435 -5.614 -4.059 1.00 0.00 C ATOM 89 CD GLU A 8 9.580 -6.535 -4.469 1.00 0.00 C ATOM 90 OE1 GLU A 8 9.972 -7.404 -3.666 1.00 0.00 O ATOM 91 OE2 GLU A 8 10.108 -6.375 -5.591 1.00 0.00 O ATOM 0 H GLU A 8 4.602 -6.697 -3.901 1.00 0.00 H new ATOM 0 HA GLU A 8 6.682 -6.511 -5.950 1.00 0.00 H new ATOM 0 HB2 GLU A 8 6.362 -5.433 -3.498 1.00 0.00 H new ATOM 0 HB3 GLU A 8 7.113 -6.930 -2.980 1.00 0.00 H new ATOM 0 HG2 GLU A 8 8.330 -4.853 -4.833 1.00 0.00 H new ATOM 0 HG3 GLU A 8 8.735 -5.100 -3.146 1.00 0.00 H new ATOM 98 N GLY A 9 7.554 -8.812 -6.219 1.00 0.00 N ATOM 99 CA GLY A 9 8.130 -10.174 -6.393 1.00 0.00 C ATOM 100 C GLY A 9 8.443 -10.588 -7.847 1.00 0.00 C ATOM 101 O GLY A 9 8.213 -9.844 -8.804 1.00 0.00 O ATOM 0 H GLY A 9 7.731 -8.181 -7.001 1.00 0.00 H new ATOM 0 HA2 GLY A 9 9.049 -10.237 -5.811 1.00 0.00 H new ATOM 0 HA3 GLY A 9 7.435 -10.899 -5.970 1.00 0.00 H new ATOM 105 N ARG A 10 8.962 -11.818 -8.003 1.00 0.00 N ATOM 106 CA ARG A 10 9.250 -12.419 -9.338 1.00 0.00 C ATOM 107 C ARG A 10 8.032 -13.277 -9.799 1.00 0.00 C ATOM 108 O ARG A 10 7.745 -14.335 -9.235 1.00 0.00 O ATOM 109 CB ARG A 10 10.562 -13.230 -9.199 1.00 0.00 C ATOM 110 CG ARG A 10 11.232 -13.740 -10.500 1.00 0.00 C ATOM 111 CD ARG A 10 12.365 -14.776 -10.296 1.00 0.00 C ATOM 112 NE ARG A 10 13.411 -14.368 -9.301 1.00 0.00 N ATOM 113 CZ ARG A 10 13.439 -14.750 -8.017 1.00 0.00 C ATOM 114 NH1 ARG A 10 12.654 -15.653 -7.508 1.00 0.00 N ATOM 115 NH2 ARG A 10 14.274 -14.198 -7.189 1.00 0.00 N ATOM 0 H ARG A 10 9.196 -12.428 -7.220 1.00 0.00 H new ATOM 0 HA ARG A 10 9.393 -11.665 -10.112 1.00 0.00 H new ATOM 0 HB2 ARG A 10 11.285 -12.610 -8.669 1.00 0.00 H new ATOM 0 HB3 ARG A 10 10.358 -14.093 -8.566 1.00 0.00 H new ATOM 0 HG2 ARG A 10 10.465 -14.184 -11.135 1.00 0.00 H new ATOM 0 HG3 ARG A 10 11.637 -12.884 -11.041 1.00 0.00 H new ATOM 0 HD2 ARG A 10 11.924 -15.719 -9.974 1.00 0.00 H new ATOM 0 HD3 ARG A 10 12.847 -14.961 -11.256 1.00 0.00 H new ATOM 0 HE ARG A 10 14.157 -13.753 -9.626 1.00 0.00 H new ATOM 0 HH11 ARG A 10 11.963 -16.118 -8.096 1.00 0.00 H new ATOM 0 HH12 ARG A 10 12.729 -15.896 -6.520 1.00 0.00 H new ATOM 0 HH21 ARG A 10 14.911 -13.471 -7.516 1.00 0.00 H new ATOM 0 HH22 ARG A 10 14.293 -14.491 -6.212 1.00 0.00 H new ATOM 129 N TRP A 11 7.283 -12.794 -10.796 1.00 0.00 N ATOM 130 CA TRP A 11 5.936 -13.334 -11.121 1.00 0.00 C ATOM 131 C TRP A 11 5.969 -14.100 -12.469 1.00 0.00 C ATOM 132 O TRP A 11 6.049 -13.478 -13.531 1.00 0.00 O ATOM 133 CB TRP A 11 4.939 -12.147 -11.173 1.00 0.00 C ATOM 134 CG TRP A 11 4.654 -11.451 -9.841 1.00 0.00 C ATOM 135 CD1 TRP A 11 5.120 -10.179 -9.468 1.00 0.00 C ATOM 136 CD2 TRP A 11 3.850 -11.874 -8.802 1.00 0.00 C ATOM 137 NE1 TRP A 11 4.604 -9.782 -8.224 1.00 0.00 N ATOM 138 CE2 TRP A 11 3.818 -10.844 -7.830 1.00 0.00 C ATOM 139 CE3 TRP A 11 3.100 -13.062 -8.616 1.00 0.00 C ATOM 140 CZ2 TRP A 11 3.016 -10.981 -6.678 1.00 0.00 C ATOM 141 CZ3 TRP A 11 2.323 -13.179 -7.465 1.00 0.00 C ATOM 142 CH2 TRP A 11 2.279 -12.155 -6.510 1.00 0.00 C ATOM 0 H TRP A 11 7.578 -12.027 -11.400 1.00 0.00 H new ATOM 0 HA TRP A 11 5.618 -14.043 -10.356 1.00 0.00 H new ATOM 0 HB2 TRP A 11 5.324 -11.405 -11.873 1.00 0.00 H new ATOM 0 HB3 TRP A 11 3.995 -12.509 -11.580 1.00 0.00 H new ATOM 0 HD1 TRP A 11 5.792 -9.580 -10.065 1.00 0.00 H new ATOM 0 HE1 TRP A 11 4.772 -8.908 -7.726 1.00 0.00 H new ATOM 0 HE3 TRP A 11 3.130 -13.856 -9.347 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 2.973 -10.193 -5.940 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 1.744 -14.076 -7.306 1.00 0.00 H new ATOM 0 HH2 TRP A 11 1.665 -12.276 -5.630 1.00 0.00 H new ATOM 153 N ARG A 12 5.886 -15.438 -12.462 1.00 0.00 N ATOM 154 CA ARG A 12 5.974 -16.237 -13.712 1.00 0.00 C ATOM 155 C ARG A 12 4.582 -16.512 -14.351 1.00 0.00 C ATOM 156 O ARG A 12 3.675 -17.026 -13.690 1.00 0.00 O ATOM 157 CB ARG A 12 6.748 -17.529 -13.385 1.00 0.00 C ATOM 158 CG ARG A 12 7.086 -18.399 -14.622 1.00 0.00 C ATOM 159 CD ARG A 12 7.745 -19.734 -14.254 1.00 0.00 C ATOM 160 NE ARG A 12 9.120 -19.490 -13.748 1.00 0.00 N ATOM 161 CZ ARG A 12 9.595 -19.854 -12.563 1.00 0.00 C ATOM 162 NH1 ARG A 12 8.936 -20.554 -11.667 1.00 0.00 N ATOM 163 NH2 ARG A 12 10.789 -19.440 -12.269 1.00 0.00 N ATOM 0 H ARG A 12 5.759 -15.994 -11.617 1.00 0.00 H new ATOM 0 HA ARG A 12 6.509 -15.671 -14.474 1.00 0.00 H new ATOM 0 HB2 ARG A 12 7.675 -17.265 -12.877 1.00 0.00 H new ATOM 0 HB3 ARG A 12 6.160 -18.124 -12.686 1.00 0.00 H new ATOM 0 HG2 ARG A 12 6.172 -18.594 -15.183 1.00 0.00 H new ATOM 0 HG3 ARG A 12 7.751 -17.841 -15.281 1.00 0.00 H new ATOM 0 HD2 ARG A 12 7.153 -20.246 -13.495 1.00 0.00 H new ATOM 0 HD3 ARG A 12 7.778 -20.387 -15.126 1.00 0.00 H new ATOM 0 HE ARG A 12 9.760 -18.996 -14.370 1.00 0.00 H new ATOM 0 HH11 ARG A 12 7.982 -20.860 -11.860 1.00 0.00 H new ATOM 0 HH12 ARG A 12 9.378 -20.791 -10.779 1.00 0.00 H new ATOM 0 HH21 ARG A 12 11.308 -18.867 -12.934 1.00 0.00 H new ATOM 0 HH22 ARG A 12 11.208 -19.687 -11.373 1.00 0.00 H new ATOM 177 N LEU A 13 4.446 -16.255 -15.666 1.00 0.00 N ATOM 178 CA LEU A 13 3.238 -16.661 -16.439 1.00 0.00 C ATOM 179 C LEU A 13 3.064 -18.217 -16.511 1.00 0.00 C ATOM 180 O LEU A 13 3.975 -18.941 -16.922 1.00 0.00 O ATOM 181 CB LEU A 13 3.314 -16.005 -17.849 1.00 0.00 C ATOM 182 CG LEU A 13 2.120 -16.250 -18.816 1.00 0.00 C ATOM 183 CD1 LEU A 13 0.772 -15.797 -18.231 1.00 0.00 C ATOM 184 CD2 LEU A 13 2.355 -15.534 -20.158 1.00 0.00 C ATOM 0 H LEU A 13 5.151 -15.770 -16.221 1.00 0.00 H new ATOM 0 HA LEU A 13 2.346 -16.305 -15.923 1.00 0.00 H new ATOM 0 HB2 LEU A 13 3.424 -14.929 -17.715 1.00 0.00 H new ATOM 0 HB3 LEU A 13 4.222 -16.360 -18.337 1.00 0.00 H new ATOM 0 HG LEU A 13 2.069 -17.328 -18.969 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -0.022 -15.994 -18.952 1.00 0.00 H new ATOM 0 HD12 LEU A 13 0.571 -16.346 -17.311 1.00 0.00 H new ATOM 0 HD13 LEU A 13 0.810 -14.729 -18.015 1.00 0.00 H new ATOM 0 HD21 LEU A 13 1.509 -15.717 -20.821 1.00 0.00 H new ATOM 0 HD22 LEU A 13 2.456 -14.462 -19.986 1.00 0.00 H new ATOM 0 HD23 LEU A 13 3.266 -15.915 -20.619 1.00 0.00 H new ATOM 196 N VAL A 14 1.888 -18.712 -16.099 1.00 0.00 N ATOM 197 CA VAL A 14 1.582 -20.178 -16.072 1.00 0.00 C ATOM 198 C VAL A 14 0.262 -20.521 -16.835 1.00 0.00 C ATOM 199 O VAL A 14 0.311 -21.288 -17.800 1.00 0.00 O ATOM 200 CB VAL A 14 1.703 -20.814 -14.639 1.00 0.00 C ATOM 201 CG1 VAL A 14 3.177 -20.991 -14.208 1.00 0.00 C ATOM 202 CG2 VAL A 14 0.940 -20.089 -13.503 1.00 0.00 C ATOM 0 H VAL A 14 1.118 -18.126 -15.775 1.00 0.00 H new ATOM 0 HA VAL A 14 2.370 -20.674 -16.639 1.00 0.00 H new ATOM 0 HB VAL A 14 1.214 -21.780 -14.768 1.00 0.00 H new ATOM 0 HG11 VAL A 14 3.214 -21.433 -13.212 1.00 0.00 H new ATOM 0 HG12 VAL A 14 3.687 -21.645 -14.915 1.00 0.00 H new ATOM 0 HG13 VAL A 14 3.671 -20.019 -14.192 1.00 0.00 H new ATOM 0 HG21 VAL A 14 1.098 -20.618 -12.563 1.00 0.00 H new ATOM 0 HG22 VAL A 14 1.309 -19.068 -13.411 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -0.125 -20.070 -13.734 1.00 0.00 H new ATOM 212 N ASP A 15 -0.897 -19.972 -16.427 1.00 0.00 N ATOM 213 CA ASP A 15 -2.195 -20.164 -17.134 1.00 0.00 C ATOM 214 C ASP A 15 -2.570 -18.874 -17.946 1.00 0.00 C ATOM 215 O ASP A 15 -2.403 -17.745 -17.469 1.00 0.00 O ATOM 216 CB ASP A 15 -3.216 -20.577 -16.042 1.00 0.00 C ATOM 217 CG ASP A 15 -4.647 -20.880 -16.474 1.00 0.00 C ATOM 218 OD1 ASP A 15 -4.930 -21.048 -17.679 1.00 0.00 O ATOM 219 OD2 ASP A 15 -5.529 -20.918 -15.588 1.00 0.00 O ATOM 0 H ASP A 15 -0.969 -19.381 -15.599 1.00 0.00 H new ATOM 0 HA ASP A 15 -2.165 -20.948 -17.891 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -2.826 -21.461 -15.538 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -3.253 -19.778 -15.301 1.00 0.00 H new ATOM 224 N SER A 16 -3.060 -19.047 -19.188 1.00 0.00 N ATOM 225 CA SER A 16 -3.359 -17.914 -20.112 1.00 0.00 C ATOM 226 C SER A 16 -4.565 -18.236 -21.050 1.00 0.00 C ATOM 227 O SER A 16 -4.375 -18.813 -22.128 1.00 0.00 O ATOM 228 CB SER A 16 -2.080 -17.533 -20.911 1.00 0.00 C ATOM 229 OG SER A 16 -1.762 -18.501 -21.912 1.00 0.00 O ATOM 0 H SER A 16 -3.262 -19.964 -19.586 1.00 0.00 H new ATOM 0 HA SER A 16 -3.659 -17.050 -19.518 1.00 0.00 H new ATOM 0 HB2 SER A 16 -2.223 -16.560 -21.381 1.00 0.00 H new ATOM 0 HB3 SER A 16 -1.240 -17.434 -20.224 1.00 0.00 H new ATOM 0 HG SER A 16 -2.589 -18.886 -22.270 1.00 0.00 H new ATOM 235 N LYS A 17 -5.792 -17.844 -20.662 1.00 0.00 N ATOM 236 CA LYS A 17 -7.012 -18.024 -21.510 1.00 0.00 C ATOM 237 C LYS A 17 -7.438 -16.692 -22.201 1.00 0.00 C ATOM 238 O LYS A 17 -7.537 -15.646 -21.549 1.00 0.00 O ATOM 239 CB LYS A 17 -8.147 -18.699 -20.696 1.00 0.00 C ATOM 240 CG LYS A 17 -8.713 -17.928 -19.471 1.00 0.00 C ATOM 241 CD LYS A 17 -8.955 -18.814 -18.231 1.00 0.00 C ATOM 242 CE LYS A 17 -7.633 -19.247 -17.570 1.00 0.00 C ATOM 243 NZ LYS A 17 -7.862 -20.212 -16.468 1.00 0.00 N ATOM 0 H LYS A 17 -5.978 -17.397 -19.764 1.00 0.00 H new ATOM 0 HA LYS A 17 -6.773 -18.704 -22.328 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -8.974 -18.901 -21.377 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -7.780 -19.664 -20.345 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -8.020 -17.130 -19.205 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -9.652 -17.454 -19.755 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -9.561 -18.269 -17.508 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -9.523 -19.698 -18.521 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -6.982 -19.698 -18.319 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -7.115 -18.369 -17.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -7.020 -20.249 -15.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -8.683 -19.909 -15.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -8.044 -21.156 -16.865 1.00 0.00 H new ATOM 257 N GLY A 18 -7.644 -16.732 -23.531 1.00 0.00 N ATOM 258 CA GLY A 18 -7.801 -15.496 -24.356 1.00 0.00 C ATOM 259 C GLY A 18 -6.528 -14.746 -24.834 1.00 0.00 C ATOM 260 O GLY A 18 -6.665 -13.726 -25.512 1.00 0.00 O ATOM 0 H GLY A 18 -7.707 -17.599 -24.065 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.379 -15.762 -25.241 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -8.403 -14.791 -23.782 1.00 0.00 H new ATOM 264 N PHE A 19 -5.306 -15.199 -24.485 1.00 0.00 N ATOM 265 CA PHE A 19 -4.055 -14.431 -24.738 1.00 0.00 C ATOM 266 C PHE A 19 -3.607 -14.347 -26.230 1.00 0.00 C ATOM 267 O PHE A 19 -3.398 -13.229 -26.708 1.00 0.00 O ATOM 268 CB PHE A 19 -2.955 -14.904 -23.741 1.00 0.00 C ATOM 269 CG PHE A 19 -1.616 -14.133 -23.783 1.00 0.00 C ATOM 270 CD1 PHE A 19 -1.598 -12.732 -23.785 1.00 0.00 C ATOM 271 CD2 PHE A 19 -0.404 -14.829 -23.868 1.00 0.00 C ATOM 272 CE1 PHE A 19 -0.400 -12.041 -23.932 1.00 0.00 C ATOM 273 CE2 PHE A 19 0.800 -14.134 -23.986 1.00 0.00 C ATOM 274 CZ PHE A 19 0.798 -12.742 -24.027 1.00 0.00 C ATOM 0 H PHE A 19 -5.152 -16.096 -24.025 1.00 0.00 H new ATOM 0 HA PHE A 19 -4.265 -13.381 -24.537 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -3.357 -14.836 -22.730 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.750 -15.957 -23.932 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -2.522 -12.184 -23.671 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -0.401 -15.909 -23.842 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -0.400 -10.962 -23.972 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.733 -14.675 -24.045 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.729 -12.205 -24.133 1.00 0.00 H new ATOM 284 N ASP A 20 -3.505 -15.470 -26.971 1.00 0.00 N ATOM 285 CA ASP A 20 -3.356 -15.435 -28.460 1.00 0.00 C ATOM 286 C ASP A 20 -4.444 -14.592 -29.230 1.00 0.00 C ATOM 287 O ASP A 20 -4.104 -13.844 -30.149 1.00 0.00 O ATOM 288 CB ASP A 20 -3.206 -16.898 -28.967 1.00 0.00 C ATOM 289 CG ASP A 20 -2.609 -17.033 -30.370 1.00 0.00 C ATOM 290 OD1 ASP A 20 -1.598 -16.370 -30.677 1.00 0.00 O ATOM 291 OD2 ASP A 20 -3.148 -17.787 -31.207 1.00 0.00 O ATOM 0 H ASP A 20 -3.522 -16.410 -26.576 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.451 -14.875 -28.696 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -2.578 -17.448 -28.266 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -4.187 -17.373 -28.957 1.00 0.00 H new ATOM 296 N GLU A 21 -5.715 -14.638 -28.795 1.00 0.00 N ATOM 297 CA GLU A 21 -6.811 -13.763 -29.292 1.00 0.00 C ATOM 298 C GLU A 21 -6.616 -12.227 -29.032 1.00 0.00 C ATOM 299 O GLU A 21 -6.727 -11.427 -29.965 1.00 0.00 O ATOM 300 CB GLU A 21 -8.163 -14.322 -28.748 1.00 0.00 C ATOM 301 CG GLU A 21 -8.439 -15.851 -28.823 1.00 0.00 C ATOM 302 CD GLU A 21 -8.106 -16.521 -30.145 1.00 0.00 C ATOM 303 OE1 GLU A 21 -8.796 -16.296 -31.158 1.00 0.00 O ATOM 304 OE2 GLU A 21 -7.089 -17.243 -30.203 1.00 0.00 O ATOM 0 H GLU A 21 -6.023 -15.293 -28.076 1.00 0.00 H new ATOM 0 HA GLU A 21 -6.804 -13.804 -30.381 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -8.243 -14.025 -27.702 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.966 -13.817 -29.285 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -7.869 -16.343 -28.035 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -9.494 -16.021 -28.607 1.00 0.00 H new ATOM 311 N TYR A 22 -6.282 -11.814 -27.793 1.00 0.00 N ATOM 312 CA TYR A 22 -5.742 -10.450 -27.492 1.00 0.00 C ATOM 313 C TYR A 22 -4.472 -10.026 -28.321 1.00 0.00 C ATOM 314 O TYR A 22 -4.429 -8.907 -28.836 1.00 0.00 O ATOM 315 CB TYR A 22 -5.565 -10.391 -25.944 1.00 0.00 C ATOM 316 CG TYR A 22 -4.794 -9.187 -25.369 1.00 0.00 C ATOM 317 CD1 TYR A 22 -5.386 -7.923 -25.260 1.00 0.00 C ATOM 318 CD2 TYR A 22 -3.466 -9.361 -24.961 1.00 0.00 C ATOM 319 CE1 TYR A 22 -4.659 -6.851 -24.741 1.00 0.00 C ATOM 320 CE2 TYR A 22 -2.751 -8.295 -24.425 1.00 0.00 C ATOM 321 CZ TYR A 22 -3.345 -7.042 -24.319 1.00 0.00 C ATOM 322 OH TYR A 22 -2.608 -6.007 -23.814 1.00 0.00 O ATOM 0 H TYR A 22 -6.374 -12.406 -26.967 1.00 0.00 H new ATOM 0 HA TYR A 22 -6.447 -9.689 -27.827 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -6.556 -10.406 -25.490 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -5.055 -11.301 -25.627 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -6.408 -7.777 -25.578 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -2.995 -10.327 -25.063 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -5.114 -5.874 -24.667 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -1.734 -8.440 -24.091 1.00 0.00 H new ATOM 0 HH TYR A 22 -2.957 -5.158 -24.158 1.00 0.00 H new ATOM 332 N MET A 23 -3.467 -10.907 -28.470 1.00 0.00 N ATOM 333 CA MET A 23 -2.322 -10.710 -29.408 1.00 0.00 C ATOM 334 C MET A 23 -2.711 -10.514 -30.921 1.00 0.00 C ATOM 335 O MET A 23 -2.194 -9.600 -31.570 1.00 0.00 O ATOM 336 CB MET A 23 -1.326 -11.883 -29.169 1.00 0.00 C ATOM 337 CG MET A 23 -0.590 -11.886 -27.803 1.00 0.00 C ATOM 338 SD MET A 23 -0.400 -13.560 -27.151 1.00 0.00 S ATOM 339 CE MET A 23 0.886 -14.246 -28.200 1.00 0.00 C ATOM 0 H MET A 23 -3.416 -11.781 -27.947 1.00 0.00 H new ATOM 0 HA MET A 23 -1.851 -9.753 -29.182 1.00 0.00 H new ATOM 0 HB2 MET A 23 -1.872 -12.822 -29.267 1.00 0.00 H new ATOM 0 HB3 MET A 23 -0.578 -11.865 -29.962 1.00 0.00 H new ATOM 0 HG2 MET A 23 0.392 -11.426 -27.917 1.00 0.00 H new ATOM 0 HG3 MET A 23 -1.145 -11.278 -27.089 1.00 0.00 H new ATOM 0 HE1 MET A 23 1.267 -15.165 -27.755 1.00 0.00 H new ATOM 0 HE2 MET A 23 0.474 -14.464 -29.185 1.00 0.00 H new ATOM 0 HE3 MET A 23 1.698 -13.526 -28.298 1.00 0.00 H new ATOM 349 N LYS A 24 -3.666 -11.294 -31.466 1.00 0.00 N ATOM 350 CA LYS A 24 -4.357 -10.976 -32.757 1.00 0.00 C ATOM 351 C LYS A 24 -5.049 -9.561 -32.812 1.00 0.00 C ATOM 352 O LYS A 24 -4.810 -8.827 -33.773 1.00 0.00 O ATOM 353 CB LYS A 24 -5.382 -12.100 -33.095 1.00 0.00 C ATOM 354 CG LYS A 24 -4.804 -13.517 -33.343 1.00 0.00 C ATOM 355 CD LYS A 24 -5.876 -14.630 -33.255 1.00 0.00 C ATOM 356 CE LYS A 24 -5.249 -16.011 -33.002 1.00 0.00 C ATOM 357 NZ LYS A 24 -6.295 -17.022 -32.697 1.00 0.00 N ATOM 0 H LYS A 24 -3.987 -12.161 -31.035 1.00 0.00 H new ATOM 0 HA LYS A 24 -3.571 -10.932 -33.511 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -6.100 -12.163 -32.277 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -5.937 -11.799 -33.983 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -4.338 -13.546 -34.328 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -4.020 -13.717 -32.613 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -6.576 -14.397 -32.453 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -6.449 -14.656 -34.182 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -4.681 -16.323 -33.879 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -4.545 -15.949 -32.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -6.264 -17.259 -31.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -7.231 -16.635 -32.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -6.123 -17.880 -33.259 1.00 0.00 H new ATOM 371 N GLU A 25 -5.855 -9.164 -31.797 1.00 0.00 N ATOM 372 CA GLU A 25 -6.418 -7.780 -31.686 1.00 0.00 C ATOM 373 C GLU A 25 -5.360 -6.619 -31.571 1.00 0.00 C ATOM 374 O GLU A 25 -5.500 -5.607 -32.264 1.00 0.00 O ATOM 375 CB GLU A 25 -7.492 -7.766 -30.554 1.00 0.00 C ATOM 376 CG GLU A 25 -8.397 -6.501 -30.537 1.00 0.00 C ATOM 377 CD GLU A 25 -9.543 -6.496 -29.532 1.00 0.00 C ATOM 378 OE1 GLU A 25 -9.302 -6.427 -28.311 1.00 0.00 O ATOM 379 OE2 GLU A 25 -10.714 -6.494 -29.957 1.00 0.00 O ATOM 0 H GLU A 25 -6.136 -9.781 -31.035 1.00 0.00 H new ATOM 0 HA GLU A 25 -6.891 -7.546 -32.640 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -8.124 -8.648 -30.660 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -6.988 -7.849 -29.591 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -7.767 -5.634 -30.340 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -8.817 -6.369 -31.534 1.00 0.00 H new ATOM 386 N LEU A 26 -4.290 -6.762 -30.761 1.00 0.00 N ATOM 387 CA LEU A 26 -3.103 -5.845 -30.787 1.00 0.00 C ATOM 388 C LEU A 26 -2.360 -5.643 -32.157 1.00 0.00 C ATOM 389 O LEU A 26 -1.850 -4.549 -32.422 1.00 0.00 O ATOM 390 CB LEU A 26 -2.060 -6.351 -29.743 1.00 0.00 C ATOM 391 CG LEU A 26 -2.338 -6.153 -28.233 1.00 0.00 C ATOM 392 CD1 LEU A 26 -1.196 -6.799 -27.427 1.00 0.00 C ATOM 393 CD2 LEU A 26 -2.449 -4.672 -27.834 1.00 0.00 C ATOM 0 H LEU A 26 -4.213 -7.508 -30.070 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.527 -4.866 -30.562 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -1.919 -7.419 -29.912 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.111 -5.865 -29.967 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.297 -6.623 -28.015 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.382 -6.665 -26.361 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -1.146 -7.864 -27.656 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -0.251 -6.326 -27.693 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -2.644 -4.597 -26.764 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.515 -4.161 -28.069 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.266 -4.207 -28.385 1.00 0.00 H new ATOM 405 N GLY A 27 -2.217 -6.710 -32.957 1.00 0.00 N ATOM 406 CA GLY A 27 -1.286 -6.750 -34.116 1.00 0.00 C ATOM 407 C GLY A 27 0.074 -7.425 -33.834 1.00 0.00 C ATOM 408 O GLY A 27 1.125 -6.829 -34.074 1.00 0.00 O ATOM 0 H GLY A 27 -2.740 -7.576 -32.826 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -1.773 -7.276 -34.937 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -1.106 -5.730 -34.454 1.00 0.00 H new ATOM 412 N VAL A 28 0.032 -8.678 -33.365 1.00 0.00 N ATOM 413 CA VAL A 28 1.242 -9.502 -33.081 1.00 0.00 C ATOM 414 C VAL A 28 1.382 -10.511 -34.274 1.00 0.00 C ATOM 415 O VAL A 28 0.502 -11.354 -34.495 1.00 0.00 O ATOM 416 CB VAL A 28 1.094 -10.228 -31.695 1.00 0.00 C ATOM 417 CG1 VAL A 28 2.326 -11.076 -31.315 1.00 0.00 C ATOM 418 CG2 VAL A 28 0.844 -9.318 -30.468 1.00 0.00 C ATOM 0 H VAL A 28 -0.843 -9.164 -33.166 1.00 0.00 H new ATOM 0 HA VAL A 28 2.142 -8.892 -33.005 1.00 0.00 H new ATOM 0 HB VAL A 28 0.208 -10.834 -31.885 1.00 0.00 H new ATOM 0 HG11 VAL A 28 2.158 -11.549 -30.348 1.00 0.00 H new ATOM 0 HG12 VAL A 28 2.487 -11.844 -32.072 1.00 0.00 H new ATOM 0 HG13 VAL A 28 3.205 -10.435 -31.257 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.759 -9.932 -29.571 1.00 0.00 H new ATOM 0 HG22 VAL A 28 1.676 -8.623 -30.355 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -0.080 -8.758 -30.613 1.00 0.00 H new ATOM 428 N GLY A 29 2.494 -10.451 -35.032 1.00 0.00 N ATOM 429 CA GLY A 29 2.749 -11.407 -36.153 1.00 0.00 C ATOM 430 C GLY A 29 2.982 -12.890 -35.758 1.00 0.00 C ATOM 431 O GLY A 29 3.230 -13.204 -34.596 1.00 0.00 O ATOM 0 H GLY A 29 3.232 -9.759 -34.898 1.00 0.00 H new ATOM 0 HA2 GLY A 29 1.901 -11.365 -36.837 1.00 0.00 H new ATOM 0 HA3 GLY A 29 3.622 -11.060 -36.706 1.00 0.00 H new ATOM 435 N ILE A 30 2.914 -13.819 -36.725 1.00 0.00 N ATOM 436 CA ILE A 30 2.897 -15.297 -36.453 1.00 0.00 C ATOM 437 C ILE A 30 4.128 -15.865 -35.650 1.00 0.00 C ATOM 438 O ILE A 30 3.930 -16.570 -34.655 1.00 0.00 O ATOM 439 CB ILE A 30 2.590 -16.118 -37.763 1.00 0.00 C ATOM 440 CG1 ILE A 30 1.508 -15.519 -38.723 1.00 0.00 C ATOM 441 CG2 ILE A 30 2.182 -17.579 -37.429 1.00 0.00 C ATOM 442 CD1 ILE A 30 2.065 -14.603 -39.830 1.00 0.00 C ATOM 0 H ILE A 30 2.869 -13.586 -37.717 1.00 0.00 H new ATOM 0 HA ILE A 30 2.070 -15.438 -35.758 1.00 0.00 H new ATOM 0 HB ILE A 30 3.536 -16.072 -38.303 1.00 0.00 H new ATOM 0 HG12 ILE A 30 0.962 -16.339 -39.189 1.00 0.00 H new ATOM 0 HG13 ILE A 30 0.789 -14.954 -38.130 1.00 0.00 H new ATOM 0 HG21 ILE A 30 1.977 -18.120 -38.353 1.00 0.00 H new ATOM 0 HG22 ILE A 30 2.995 -18.070 -36.894 1.00 0.00 H new ATOM 0 HG23 ILE A 30 1.288 -17.574 -36.805 1.00 0.00 H new ATOM 0 HD11 ILE A 30 1.244 -14.235 -40.445 1.00 0.00 H new ATOM 0 HD12 ILE A 30 2.585 -13.759 -39.377 1.00 0.00 H new ATOM 0 HD13 ILE A 30 2.761 -15.166 -40.452 1.00 0.00 H new ATOM 454 N ALA A 31 5.375 -15.537 -36.041 1.00 0.00 N ATOM 455 CA ALA A 31 6.583 -15.812 -35.208 1.00 0.00 C ATOM 456 C ALA A 31 6.631 -15.117 -33.802 1.00 0.00 C ATOM 457 O ALA A 31 6.968 -15.773 -32.813 1.00 0.00 O ATOM 458 CB ALA A 31 7.811 -15.467 -36.072 1.00 0.00 C ATOM 0 H ALA A 31 5.582 -15.080 -36.929 1.00 0.00 H new ATOM 0 HA ALA A 31 6.560 -16.866 -34.932 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.721 -15.653 -35.502 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.811 -16.087 -36.968 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.771 -14.416 -36.358 1.00 0.00 H new ATOM 464 N LEU A 32 6.243 -13.829 -33.705 1.00 0.00 N ATOM 465 CA LEU A 32 5.989 -13.135 -32.406 1.00 0.00 C ATOM 466 C LEU A 32 4.870 -13.780 -31.509 1.00 0.00 C ATOM 467 O LEU A 32 5.080 -13.927 -30.304 1.00 0.00 O ATOM 468 CB LEU A 32 5.704 -11.626 -32.673 1.00 0.00 C ATOM 469 CG LEU A 32 6.805 -10.778 -33.369 1.00 0.00 C ATOM 470 CD1 LEU A 32 6.254 -9.392 -33.743 1.00 0.00 C ATOM 471 CD2 LEU A 32 8.056 -10.600 -32.493 1.00 0.00 C ATOM 0 H LEU A 32 6.094 -13.233 -34.519 1.00 0.00 H new ATOM 0 HA LEU A 32 6.898 -13.252 -31.816 1.00 0.00 H new ATOM 0 HB2 LEU A 32 4.801 -11.561 -33.280 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.479 -11.156 -31.716 1.00 0.00 H new ATOM 0 HG LEU A 32 7.098 -11.324 -34.266 1.00 0.00 H new ATOM 0 HD11 LEU A 32 7.036 -8.809 -34.230 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.410 -9.507 -34.424 1.00 0.00 H new ATOM 0 HD13 LEU A 32 5.925 -8.876 -32.841 1.00 0.00 H new ATOM 0 HD21 LEU A 32 8.792 -10.000 -33.028 1.00 0.00 H new ATOM 0 HD22 LEU A 32 7.782 -10.097 -31.566 1.00 0.00 H new ATOM 0 HD23 LEU A 32 8.481 -11.577 -32.263 1.00 0.00 H new ATOM 483 N ARG A 33 3.726 -14.208 -32.085 1.00 0.00 N ATOM 484 CA ARG A 33 2.701 -15.047 -31.399 1.00 0.00 C ATOM 485 C ARG A 33 3.233 -16.407 -30.839 1.00 0.00 C ATOM 486 O ARG A 33 3.046 -16.686 -29.651 1.00 0.00 O ATOM 487 CB ARG A 33 1.486 -15.268 -32.349 1.00 0.00 C ATOM 488 CG ARG A 33 0.464 -14.103 -32.441 1.00 0.00 C ATOM 489 CD ARG A 33 -0.720 -14.269 -33.422 1.00 0.00 C ATOM 490 NE ARG A 33 -1.438 -15.558 -33.199 1.00 0.00 N ATOM 491 CZ ARG A 33 -1.562 -16.552 -34.071 1.00 0.00 C ATOM 492 NH1 ARG A 33 -1.276 -16.447 -35.346 1.00 0.00 N ATOM 493 NH2 ARG A 33 -2.007 -17.692 -33.630 1.00 0.00 N ATOM 0 H ARG A 33 3.479 -13.982 -33.049 1.00 0.00 H new ATOM 0 HA ARG A 33 2.393 -14.489 -30.515 1.00 0.00 H new ATOM 0 HB2 ARG A 33 1.867 -15.469 -33.350 1.00 0.00 H new ATOM 0 HB3 ARG A 33 0.956 -16.163 -32.024 1.00 0.00 H new ATOM 0 HG2 ARG A 33 0.055 -13.935 -31.445 1.00 0.00 H new ATOM 0 HG3 ARG A 33 1.007 -13.200 -32.719 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -1.415 -13.438 -33.299 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -0.353 -14.228 -34.447 1.00 0.00 H new ATOM 0 HE ARG A 33 -1.877 -15.688 -32.287 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -0.936 -15.562 -35.721 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -1.394 -17.251 -35.963 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -2.247 -17.799 -32.644 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -2.116 -18.479 -34.270 1.00 0.00 H new ATOM 507 N LYS A 34 3.926 -17.221 -31.663 1.00 0.00 N ATOM 508 CA LYS A 34 4.667 -18.421 -31.193 1.00 0.00 C ATOM 509 C LYS A 34 5.716 -18.145 -30.057 1.00 0.00 C ATOM 510 O LYS A 34 5.613 -18.762 -28.995 1.00 0.00 O ATOM 511 CB LYS A 34 5.238 -19.109 -32.460 1.00 0.00 C ATOM 512 CG LYS A 34 5.843 -20.504 -32.200 1.00 0.00 C ATOM 513 CD LYS A 34 6.386 -21.156 -33.486 1.00 0.00 C ATOM 514 CE LYS A 34 7.037 -22.524 -33.208 1.00 0.00 C ATOM 515 NZ LYS A 34 7.559 -23.108 -34.474 1.00 0.00 N ATOM 0 H LYS A 34 3.990 -17.070 -32.670 1.00 0.00 H new ATOM 0 HA LYS A 34 3.989 -19.101 -30.676 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.443 -19.202 -33.200 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.005 -18.467 -32.895 1.00 0.00 H new ATOM 0 HG2 LYS A 34 6.649 -20.418 -31.471 1.00 0.00 H new ATOM 0 HG3 LYS A 34 5.083 -21.151 -31.760 1.00 0.00 H new ATOM 0 HD2 LYS A 34 5.573 -21.280 -34.201 1.00 0.00 H new ATOM 0 HD3 LYS A 34 7.118 -20.493 -33.948 1.00 0.00 H new ATOM 0 HE2 LYS A 34 7.848 -22.410 -32.489 1.00 0.00 H new ATOM 0 HE3 LYS A 34 6.307 -23.199 -32.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 7.996 -24.031 -34.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 6.776 -23.233 -35.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 8.270 -22.469 -34.884 1.00 0.00 H new ATOM 529 N MET A 35 6.662 -17.204 -30.256 1.00 0.00 N ATOM 530 CA MET A 35 7.590 -16.712 -29.193 1.00 0.00 C ATOM 531 C MET A 35 6.904 -16.212 -27.872 1.00 0.00 C ATOM 532 O MET A 35 7.202 -16.756 -26.806 1.00 0.00 O ATOM 533 CB MET A 35 8.492 -15.647 -29.877 1.00 0.00 C ATOM 534 CG MET A 35 9.653 -15.089 -29.028 1.00 0.00 C ATOM 535 SD MET A 35 10.413 -13.677 -29.859 1.00 0.00 S ATOM 536 CE MET A 35 9.232 -12.371 -29.459 1.00 0.00 C ATOM 0 H MET A 35 6.812 -16.756 -31.160 1.00 0.00 H new ATOM 0 HA MET A 35 8.180 -17.545 -28.810 1.00 0.00 H new ATOM 0 HB2 MET A 35 8.910 -16.084 -30.784 1.00 0.00 H new ATOM 0 HB3 MET A 35 7.862 -14.813 -30.186 1.00 0.00 H new ATOM 0 HG2 MET A 35 9.284 -14.787 -28.048 1.00 0.00 H new ATOM 0 HG3 MET A 35 10.398 -15.867 -28.862 1.00 0.00 H new ATOM 0 HE1 MET A 35 9.661 -11.402 -29.715 1.00 0.00 H new ATOM 0 HE2 MET A 35 8.315 -12.523 -30.028 1.00 0.00 H new ATOM 0 HE3 MET A 35 9.007 -12.398 -28.393 1.00 0.00 H new ATOM 546 N GLY A 36 5.984 -15.226 -27.932 1.00 0.00 N ATOM 547 CA GLY A 36 5.201 -14.762 -26.749 1.00 0.00 C ATOM 548 C GLY A 36 4.352 -15.792 -25.961 1.00 0.00 C ATOM 549 O GLY A 36 4.345 -15.752 -24.728 1.00 0.00 O ATOM 0 H GLY A 36 5.758 -14.727 -28.792 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.901 -14.307 -26.048 1.00 0.00 H new ATOM 0 HA3 GLY A 36 4.530 -13.972 -27.087 1.00 0.00 H new ATOM 553 N ALA A 37 3.663 -16.714 -26.654 1.00 0.00 N ATOM 554 CA ALA A 37 3.008 -17.882 -26.011 1.00 0.00 C ATOM 555 C ALA A 37 3.974 -18.937 -25.369 1.00 0.00 C ATOM 556 O ALA A 37 3.791 -19.273 -24.195 1.00 0.00 O ATOM 557 CB ALA A 37 2.063 -18.493 -27.064 1.00 0.00 C ATOM 0 H ALA A 37 3.541 -16.678 -27.666 1.00 0.00 H new ATOM 0 HA ALA A 37 2.459 -17.532 -25.137 1.00 0.00 H new ATOM 0 HB1 ALA A 37 1.555 -19.359 -26.639 1.00 0.00 H new ATOM 0 HB2 ALA A 37 1.324 -17.750 -27.364 1.00 0.00 H new ATOM 0 HB3 ALA A 37 2.640 -18.803 -27.935 1.00 0.00 H new ATOM 563 N MET A 38 4.993 -19.453 -26.094 1.00 0.00 N ATOM 564 CA MET A 38 5.952 -20.458 -25.535 1.00 0.00 C ATOM 565 C MET A 38 7.008 -19.954 -24.488 1.00 0.00 C ATOM 566 O MET A 38 7.399 -20.733 -23.614 1.00 0.00 O ATOM 567 CB MET A 38 6.564 -21.294 -26.696 1.00 0.00 C ATOM 568 CG MET A 38 7.750 -20.696 -27.465 1.00 0.00 C ATOM 569 SD MET A 38 8.089 -21.743 -28.888 1.00 0.00 S ATOM 570 CE MET A 38 9.223 -20.658 -29.754 1.00 0.00 C ATOM 0 H MET A 38 5.179 -19.197 -27.064 1.00 0.00 H new ATOM 0 HA MET A 38 5.350 -21.102 -24.894 1.00 0.00 H new ATOM 0 HB2 MET A 38 6.881 -22.253 -26.286 1.00 0.00 H new ATOM 0 HB3 MET A 38 5.770 -21.500 -27.414 1.00 0.00 H new ATOM 0 HG2 MET A 38 7.520 -19.681 -27.787 1.00 0.00 H new ATOM 0 HG3 MET A 38 8.628 -20.635 -26.821 1.00 0.00 H new ATOM 0 HE1 MET A 38 9.551 -21.136 -30.677 1.00 0.00 H new ATOM 0 HE2 MET A 38 8.720 -19.720 -29.990 1.00 0.00 H new ATOM 0 HE3 MET A 38 10.088 -20.457 -29.122 1.00 0.00 H new ATOM 580 N ALA A 39 7.462 -18.685 -24.555 1.00 0.00 N ATOM 581 CA ALA A 39 8.429 -18.105 -23.581 1.00 0.00 C ATOM 582 C ALA A 39 8.021 -18.084 -22.073 1.00 0.00 C ATOM 583 O ALA A 39 8.876 -18.359 -21.228 1.00 0.00 O ATOM 584 CB ALA A 39 8.778 -16.690 -24.082 1.00 0.00 C ATOM 0 H ALA A 39 7.173 -18.030 -25.281 1.00 0.00 H new ATOM 0 HA ALA A 39 9.283 -18.782 -23.564 1.00 0.00 H new ATOM 0 HB1 ALA A 39 9.487 -16.226 -23.396 1.00 0.00 H new ATOM 0 HB2 ALA A 39 9.223 -16.755 -25.075 1.00 0.00 H new ATOM 0 HB3 ALA A 39 7.871 -16.087 -24.130 1.00 0.00 H new ATOM 590 N LYS A 40 6.749 -17.766 -21.746 1.00 0.00 N ATOM 591 CA LYS A 40 6.210 -17.761 -20.349 1.00 0.00 C ATOM 592 C LYS A 40 7.087 -17.034 -19.247 1.00 0.00 C ATOM 593 O LYS A 40 7.621 -17.711 -18.362 1.00 0.00 O ATOM 594 CB LYS A 40 5.642 -19.163 -19.981 1.00 0.00 C ATOM 595 CG LYS A 40 6.640 -20.342 -19.881 1.00 0.00 C ATOM 596 CD LYS A 40 5.982 -21.613 -19.312 1.00 0.00 C ATOM 597 CE LYS A 40 6.979 -22.781 -19.231 1.00 0.00 C ATOM 598 NZ LYS A 40 6.303 -23.966 -18.639 1.00 0.00 N ATOM 0 H LYS A 40 6.053 -17.502 -22.444 1.00 0.00 H new ATOM 0 HA LYS A 40 5.364 -17.074 -20.347 1.00 0.00 H new ATOM 0 HB2 LYS A 40 5.129 -19.076 -19.023 1.00 0.00 H new ATOM 0 HB3 LYS A 40 4.888 -19.424 -20.723 1.00 0.00 H new ATOM 0 HG2 LYS A 40 7.047 -20.557 -20.869 1.00 0.00 H new ATOM 0 HG3 LYS A 40 7.478 -20.054 -19.247 1.00 0.00 H new ATOM 0 HD2 LYS A 40 5.585 -21.404 -18.319 1.00 0.00 H new ATOM 0 HD3 LYS A 40 5.138 -21.898 -19.940 1.00 0.00 H new ATOM 0 HE2 LYS A 40 7.356 -23.022 -20.225 1.00 0.00 H new ATOM 0 HE3 LYS A 40 7.839 -22.498 -18.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 6.975 -24.757 -18.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 5.964 -23.731 -17.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 5.496 -24.239 -19.235 1.00 0.00 H new ATOM 612 N PRO A 41 7.294 -15.682 -19.271 1.00 0.00 N ATOM 613 CA PRO A 41 8.438 -15.047 -18.556 1.00 0.00 C ATOM 614 C PRO A 41 8.280 -14.828 -17.019 1.00 0.00 C ATOM 615 O PRO A 41 7.174 -14.651 -16.496 1.00 0.00 O ATOM 616 CB PRO A 41 8.584 -13.718 -19.328 1.00 0.00 C ATOM 617 CG PRO A 41 7.183 -13.403 -19.853 1.00 0.00 C ATOM 618 CD PRO A 41 6.636 -14.773 -20.233 1.00 0.00 C ATOM 0 HA PRO A 41 9.313 -15.697 -18.562 1.00 0.00 H new ATOM 0 HB2 PRO A 41 8.949 -12.923 -18.678 1.00 0.00 H new ATOM 0 HB3 PRO A 41 9.298 -13.814 -20.146 1.00 0.00 H new ATOM 0 HG2 PRO A 41 6.568 -12.921 -19.094 1.00 0.00 H new ATOM 0 HG3 PRO A 41 7.216 -12.731 -20.711 1.00 0.00 H new ATOM 0 HD2 PRO A 41 5.550 -14.811 -20.144 1.00 0.00 H new ATOM 0 HD3 PRO A 41 6.881 -15.032 -21.263 1.00 0.00 H new ATOM 626 N ASP A 42 9.436 -14.768 -16.334 1.00 0.00 N ATOM 627 CA ASP A 42 9.535 -14.345 -14.910 1.00 0.00 C ATOM 628 C ASP A 42 9.517 -12.778 -14.812 1.00 0.00 C ATOM 629 O ASP A 42 10.524 -12.092 -15.020 1.00 0.00 O ATOM 630 CB ASP A 42 10.820 -14.981 -14.300 1.00 0.00 C ATOM 631 CG ASP A 42 10.660 -16.387 -13.712 1.00 0.00 C ATOM 632 OD1 ASP A 42 10.733 -17.401 -14.442 1.00 0.00 O ATOM 633 OD2 ASP A 42 10.485 -16.496 -12.481 1.00 0.00 O ATOM 0 H ASP A 42 10.336 -15.011 -16.747 1.00 0.00 H new ATOM 0 HA ASP A 42 8.679 -14.696 -14.334 1.00 0.00 H new ATOM 0 HB2 ASP A 42 11.586 -15.018 -15.075 1.00 0.00 H new ATOM 0 HB3 ASP A 42 11.191 -14.321 -13.516 1.00 0.00 H new ATOM 638 N CYS A 43 8.338 -12.209 -14.521 1.00 0.00 N ATOM 639 CA CYS A 43 8.117 -10.746 -14.469 1.00 0.00 C ATOM 640 C CYS A 43 8.354 -10.166 -13.045 1.00 0.00 C ATOM 641 O CYS A 43 7.508 -10.271 -12.152 1.00 0.00 O ATOM 642 CB CYS A 43 6.698 -10.484 -15.014 1.00 0.00 C ATOM 643 SG CYS A 43 6.430 -8.692 -15.203 1.00 0.00 S ATOM 0 H CYS A 43 7.500 -12.752 -14.312 1.00 0.00 H new ATOM 0 HA CYS A 43 8.844 -10.222 -15.089 1.00 0.00 H new ATOM 0 HB2 CYS A 43 6.570 -10.983 -15.974 1.00 0.00 H new ATOM 0 HB3 CYS A 43 5.955 -10.902 -14.335 1.00 0.00 H new ATOM 0 HG CYS A 43 6.685 -8.094 -14.077 1.00 0.00 H new ATOM 649 N ILE A 44 9.505 -9.513 -12.847 1.00 0.00 N ATOM 650 CA ILE A 44 9.879 -8.885 -11.548 1.00 0.00 C ATOM 651 C ILE A 44 9.144 -7.513 -11.434 1.00 0.00 C ATOM 652 O ILE A 44 9.474 -6.571 -12.161 1.00 0.00 O ATOM 653 CB ILE A 44 11.437 -8.770 -11.398 1.00 0.00 C ATOM 654 CG1 ILE A 44 12.213 -10.114 -11.567 1.00 0.00 C ATOM 655 CG2 ILE A 44 11.864 -8.123 -10.053 1.00 0.00 C ATOM 656 CD1 ILE A 44 13.537 -9.962 -12.330 1.00 0.00 C ATOM 0 H ILE A 44 10.211 -9.398 -13.574 1.00 0.00 H new ATOM 0 HA ILE A 44 9.559 -9.513 -10.717 1.00 0.00 H new ATOM 0 HB ILE A 44 11.714 -8.121 -12.229 1.00 0.00 H new ATOM 0 HG12 ILE A 44 12.416 -10.534 -10.582 1.00 0.00 H new ATOM 0 HG13 ILE A 44 11.579 -10.827 -12.093 1.00 0.00 H new ATOM 0 HG21 ILE A 44 12.952 -8.069 -10.004 1.00 0.00 H new ATOM 0 HG22 ILE A 44 11.447 -7.118 -9.984 1.00 0.00 H new ATOM 0 HG23 ILE A 44 11.493 -8.727 -9.225 1.00 0.00 H new ATOM 0 HD11 ILE A 44 14.024 -10.934 -12.411 1.00 0.00 H new ATOM 0 HD12 ILE A 44 13.339 -9.571 -13.328 1.00 0.00 H new ATOM 0 HD13 ILE A 44 14.189 -9.273 -11.793 1.00 0.00 H new ATOM 668 N ILE A 45 8.160 -7.420 -10.525 1.00 0.00 N ATOM 669 CA ILE A 45 7.501 -6.128 -10.171 1.00 0.00 C ATOM 670 C ILE A 45 8.195 -5.628 -8.863 1.00 0.00 C ATOM 671 O ILE A 45 8.060 -6.271 -7.819 1.00 0.00 O ATOM 672 CB ILE A 45 5.939 -6.268 -10.024 1.00 0.00 C ATOM 673 CG1 ILE A 45 5.234 -6.828 -11.298 1.00 0.00 C ATOM 674 CG2 ILE A 45 5.284 -4.915 -9.627 1.00 0.00 C ATOM 675 CD1 ILE A 45 3.748 -7.198 -11.131 1.00 0.00 C ATOM 0 H ILE A 45 7.794 -8.222 -10.013 1.00 0.00 H new ATOM 0 HA ILE A 45 7.623 -5.397 -10.970 1.00 0.00 H new ATOM 0 HB ILE A 45 5.795 -6.998 -9.228 1.00 0.00 H new ATOM 0 HG12 ILE A 45 5.318 -6.087 -12.093 1.00 0.00 H new ATOM 0 HG13 ILE A 45 5.775 -7.714 -11.630 1.00 0.00 H new ATOM 0 HG21 ILE A 45 4.206 -5.046 -9.534 1.00 0.00 H new ATOM 0 HG22 ILE A 45 5.692 -4.579 -8.674 1.00 0.00 H new ATOM 0 HG23 ILE A 45 5.494 -4.170 -10.395 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.359 -7.576 -12.076 1.00 0.00 H new ATOM 0 HD12 ILE A 45 3.648 -7.966 -10.364 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.184 -6.314 -10.834 1.00 0.00 H new ATOM 687 N THR A 46 8.911 -4.491 -8.918 1.00 0.00 N ATOM 688 CA THR A 46 9.585 -3.902 -7.718 1.00 0.00 C ATOM 689 C THR A 46 9.305 -2.367 -7.680 1.00 0.00 C ATOM 690 O THR A 46 9.686 -1.638 -8.600 1.00 0.00 O ATOM 691 CB THR A 46 11.098 -4.284 -7.692 1.00 0.00 C ATOM 692 OG1 THR A 46 11.237 -5.700 -7.570 1.00 0.00 O ATOM 693 CG2 THR A 46 11.896 -3.697 -6.516 1.00 0.00 C ATOM 0 H THR A 46 9.045 -3.953 -9.774 1.00 0.00 H new ATOM 0 HA THR A 46 9.174 -4.319 -6.799 1.00 0.00 H new ATOM 0 HB THR A 46 11.492 -3.876 -8.623 1.00 0.00 H new ATOM 0 HG1 THR A 46 11.075 -5.966 -6.641 1.00 0.00 H new ATOM 0 HG21 THR A 46 12.935 -4.018 -6.585 1.00 0.00 H new ATOM 0 HG22 THR A 46 11.850 -2.609 -6.552 1.00 0.00 H new ATOM 0 HG23 THR A 46 11.470 -4.047 -5.576 1.00 0.00 H new ATOM 701 N CYS A 47 8.625 -1.877 -6.625 1.00 0.00 N ATOM 702 CA CYS A 47 8.148 -0.470 -6.552 1.00 0.00 C ATOM 703 C CYS A 47 8.694 0.314 -5.324 1.00 0.00 C ATOM 704 O CYS A 47 8.351 0.008 -4.176 1.00 0.00 O ATOM 705 CB CYS A 47 6.605 -0.523 -6.561 1.00 0.00 C ATOM 706 SG CYS A 47 5.882 1.156 -6.500 1.00 0.00 S ATOM 0 H CYS A 47 8.390 -2.434 -5.804 1.00 0.00 H new ATOM 0 HA CYS A 47 8.530 0.086 -7.408 1.00 0.00 H new ATOM 0 HB2 CYS A 47 6.262 -1.037 -7.459 1.00 0.00 H new ATOM 0 HB3 CYS A 47 6.254 -1.104 -5.708 1.00 0.00 H new ATOM 0 HG CYS A 47 4.739 1.159 -7.120 1.00 0.00 H new ATOM 712 N ASP A 48 9.452 1.401 -5.572 1.00 0.00 N ATOM 713 CA ASP A 48 9.874 2.354 -4.497 1.00 0.00 C ATOM 714 C ASP A 48 8.781 3.460 -4.242 1.00 0.00 C ATOM 715 O ASP A 48 9.006 4.662 -4.437 1.00 0.00 O ATOM 716 CB ASP A 48 11.251 2.977 -4.864 1.00 0.00 C ATOM 717 CG ASP A 48 12.430 2.038 -5.104 1.00 0.00 C ATOM 718 OD1 ASP A 48 12.865 1.353 -4.155 1.00 0.00 O ATOM 719 OD2 ASP A 48 12.933 2.002 -6.249 1.00 0.00 O ATOM 0 H ASP A 48 9.790 1.650 -6.502 1.00 0.00 H new ATOM 0 HA ASP A 48 9.980 1.804 -3.562 1.00 0.00 H new ATOM 0 HB2 ASP A 48 11.115 3.577 -5.764 1.00 0.00 H new ATOM 0 HB3 ASP A 48 11.530 3.662 -4.064 1.00 0.00 H new ATOM 724 N GLY A 49 7.555 3.055 -3.847 1.00 0.00 N ATOM 725 CA GLY A 49 6.385 3.978 -3.771 1.00 0.00 C ATOM 726 C GLY A 49 5.803 4.467 -5.122 1.00 0.00 C ATOM 727 O GLY A 49 4.697 4.084 -5.506 1.00 0.00 O ATOM 0 H GLY A 49 7.342 2.096 -3.574 1.00 0.00 H new ATOM 0 HA2 GLY A 49 5.590 3.477 -3.218 1.00 0.00 H new ATOM 0 HA3 GLY A 49 6.677 4.852 -3.189 1.00 0.00 H new ATOM 731 N LYS A 50 6.553 5.341 -5.809 1.00 0.00 N ATOM 732 CA LYS A 50 6.162 5.918 -7.130 1.00 0.00 C ATOM 733 C LYS A 50 6.821 5.258 -8.382 1.00 0.00 C ATOM 734 O LYS A 50 6.112 5.021 -9.361 1.00 0.00 O ATOM 735 CB LYS A 50 6.383 7.457 -7.101 1.00 0.00 C ATOM 736 CG LYS A 50 5.267 8.279 -6.401 1.00 0.00 C ATOM 737 CD LYS A 50 4.090 8.710 -7.306 1.00 0.00 C ATOM 738 CE LYS A 50 4.444 9.802 -8.342 1.00 0.00 C ATOM 739 NZ LYS A 50 3.224 10.190 -9.101 1.00 0.00 N ATOM 0 H LYS A 50 7.455 5.678 -5.473 1.00 0.00 H new ATOM 0 HA LYS A 50 5.105 5.687 -7.259 1.00 0.00 H new ATOM 0 HB2 LYS A 50 7.329 7.661 -6.600 1.00 0.00 H new ATOM 0 HB3 LYS A 50 6.482 7.812 -8.127 1.00 0.00 H new ATOM 0 HG2 LYS A 50 4.870 7.690 -5.575 1.00 0.00 H new ATOM 0 HG3 LYS A 50 5.716 9.173 -5.968 1.00 0.00 H new ATOM 0 HD2 LYS A 50 3.715 7.834 -7.835 1.00 0.00 H new ATOM 0 HD3 LYS A 50 3.278 9.074 -6.676 1.00 0.00 H new ATOM 0 HE2 LYS A 50 4.862 10.673 -7.838 1.00 0.00 H new ATOM 0 HE3 LYS A 50 5.208 9.433 -9.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 3.493 10.491 -10.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 2.579 9.376 -9.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 2.746 10.974 -8.613 1.00 0.00 H new ATOM 753 N ASN A 51 8.139 4.999 -8.416 1.00 0.00 N ATOM 754 CA ASN A 51 8.791 4.322 -9.578 1.00 0.00 C ATOM 755 C ASN A 51 8.576 2.773 -9.530 1.00 0.00 C ATOM 756 O ASN A 51 9.179 2.074 -8.713 1.00 0.00 O ATOM 757 CB ASN A 51 10.277 4.763 -9.724 1.00 0.00 C ATOM 758 CG ASN A 51 11.250 4.478 -8.569 1.00 0.00 C ATOM 759 OD1 ASN A 51 11.417 5.292 -7.667 1.00 0.00 O ATOM 760 ND2 ASN A 51 11.909 3.341 -8.569 1.00 0.00 N ATOM 0 H ASN A 51 8.781 5.242 -7.662 1.00 0.00 H new ATOM 0 HA ASN A 51 8.302 4.648 -10.496 1.00 0.00 H new ATOM 0 HB2 ASN A 51 10.677 4.285 -10.618 1.00 0.00 H new ATOM 0 HB3 ASN A 51 10.286 5.838 -9.906 1.00 0.00 H new ATOM 0 HD21 ASN A 51 12.564 3.131 -7.816 1.00 0.00 H new ATOM 0 HD22 ASN A 51 11.765 2.668 -9.322 1.00 0.00 H new ATOM 767 N LEU A 52 7.688 2.246 -10.389 1.00 0.00 N ATOM 768 CA LEU A 52 7.355 0.799 -10.426 1.00 0.00 C ATOM 769 C LEU A 52 8.118 0.110 -11.600 1.00 0.00 C ATOM 770 O LEU A 52 7.863 0.356 -12.784 1.00 0.00 O ATOM 771 CB LEU A 52 5.808 0.677 -10.428 1.00 0.00 C ATOM 772 CG LEU A 52 5.251 -0.772 -10.344 1.00 0.00 C ATOM 773 CD1 LEU A 52 3.991 -0.845 -9.466 1.00 0.00 C ATOM 774 CD2 LEU A 52 4.923 -1.316 -11.738 1.00 0.00 C ATOM 0 H LEU A 52 7.179 2.802 -11.077 1.00 0.00 H new ATOM 0 HA LEU A 52 7.697 0.252 -9.548 1.00 0.00 H new ATOM 0 HB2 LEU A 52 5.415 1.248 -9.587 1.00 0.00 H new ATOM 0 HB3 LEU A 52 5.425 1.143 -11.336 1.00 0.00 H new ATOM 0 HG LEU A 52 6.031 -1.383 -9.890 1.00 0.00 H new ATOM 0 HD11 LEU A 52 3.631 -1.873 -9.431 1.00 0.00 H new ATOM 0 HD12 LEU A 52 4.231 -0.510 -8.457 1.00 0.00 H new ATOM 0 HD13 LEU A 52 3.217 -0.203 -9.887 1.00 0.00 H new ATOM 0 HD21 LEU A 52 4.535 -2.331 -11.651 1.00 0.00 H new ATOM 0 HD22 LEU A 52 4.173 -0.681 -12.209 1.00 0.00 H new ATOM 0 HD23 LEU A 52 5.827 -1.324 -12.347 1.00 0.00 H new ATOM 786 N THR A 53 9.078 -0.751 -11.244 1.00 0.00 N ATOM 787 CA THR A 53 10.008 -1.402 -12.207 1.00 0.00 C ATOM 788 C THR A 53 9.432 -2.787 -12.616 1.00 0.00 C ATOM 789 O THR A 53 9.301 -3.688 -11.782 1.00 0.00 O ATOM 790 CB THR A 53 11.438 -1.489 -11.589 1.00 0.00 C ATOM 791 OG1 THR A 53 11.913 -0.185 -11.264 1.00 0.00 O ATOM 792 CG2 THR A 53 12.505 -2.090 -12.522 1.00 0.00 C ATOM 0 H THR A 53 9.242 -1.025 -10.275 1.00 0.00 H new ATOM 0 HA THR A 53 10.100 -0.808 -13.116 1.00 0.00 H new ATOM 0 HB THR A 53 11.315 -2.139 -10.722 1.00 0.00 H new ATOM 0 HG1 THR A 53 12.810 -0.251 -10.875 1.00 0.00 H new ATOM 0 HG21 THR A 53 13.467 -2.111 -12.009 1.00 0.00 H new ATOM 0 HG22 THR A 53 12.218 -3.105 -12.797 1.00 0.00 H new ATOM 0 HG23 THR A 53 12.587 -1.480 -13.422 1.00 0.00 H new ATOM 800 N ILE A 54 9.109 -2.941 -13.909 1.00 0.00 N ATOM 801 CA ILE A 54 8.658 -4.234 -14.497 1.00 0.00 C ATOM 802 C ILE A 54 9.849 -4.776 -15.352 1.00 0.00 C ATOM 803 O ILE A 54 10.104 -4.292 -16.461 1.00 0.00 O ATOM 804 CB ILE A 54 7.301 -4.029 -15.266 1.00 0.00 C ATOM 805 CG1 ILE A 54 6.121 -3.771 -14.279 1.00 0.00 C ATOM 806 CG2 ILE A 54 6.929 -5.218 -16.192 1.00 0.00 C ATOM 807 CD1 ILE A 54 4.862 -3.136 -14.891 1.00 0.00 C ATOM 0 H ILE A 54 9.150 -2.179 -14.586 1.00 0.00 H new ATOM 0 HA ILE A 54 8.423 -4.992 -13.750 1.00 0.00 H new ATOM 0 HB ILE A 54 7.461 -3.153 -15.895 1.00 0.00 H new ATOM 0 HG12 ILE A 54 5.841 -4.720 -13.822 1.00 0.00 H new ATOM 0 HG13 ILE A 54 6.478 -3.124 -13.477 1.00 0.00 H new ATOM 0 HG21 ILE A 54 5.982 -5.009 -16.690 1.00 0.00 H new ATOM 0 HG22 ILE A 54 7.710 -5.355 -16.940 1.00 0.00 H new ATOM 0 HG23 ILE A 54 6.833 -6.126 -15.597 1.00 0.00 H new ATOM 0 HD11 ILE A 54 4.108 -3.003 -14.115 1.00 0.00 H new ATOM 0 HD12 ILE A 54 5.116 -2.167 -15.321 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.468 -3.788 -15.671 1.00 0.00 H new ATOM 819 N LYS A 55 10.554 -5.799 -14.836 1.00 0.00 N ATOM 820 CA LYS A 55 11.588 -6.542 -15.609 1.00 0.00 C ATOM 821 C LYS A 55 11.031 -7.943 -16.022 1.00 0.00 C ATOM 822 O LYS A 55 10.960 -8.869 -15.211 1.00 0.00 O ATOM 823 CB LYS A 55 12.895 -6.619 -14.776 1.00 0.00 C ATOM 824 CG LYS A 55 14.093 -7.161 -15.584 1.00 0.00 C ATOM 825 CD LYS A 55 15.328 -7.511 -14.735 1.00 0.00 C ATOM 826 CE LYS A 55 16.493 -7.928 -15.648 1.00 0.00 C ATOM 827 NZ LYS A 55 17.489 -8.772 -14.939 1.00 0.00 N ATOM 0 H LYS A 55 10.431 -6.138 -13.882 1.00 0.00 H new ATOM 0 HA LYS A 55 11.831 -6.020 -16.534 1.00 0.00 H new ATOM 0 HB2 LYS A 55 13.138 -5.626 -14.398 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.730 -7.258 -13.909 1.00 0.00 H new ATOM 0 HG2 LYS A 55 13.776 -8.052 -16.127 1.00 0.00 H new ATOM 0 HG3 LYS A 55 14.378 -6.419 -16.329 1.00 0.00 H new ATOM 0 HD2 LYS A 55 15.619 -6.652 -14.130 1.00 0.00 H new ATOM 0 HD3 LYS A 55 15.088 -8.320 -14.045 1.00 0.00 H new ATOM 0 HE2 LYS A 55 16.102 -8.474 -16.506 1.00 0.00 H new ATOM 0 HE3 LYS A 55 16.986 -7.036 -16.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 18.400 -8.272 -14.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 17.155 -8.966 -13.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 17.610 -9.669 -15.450 1.00 0.00 H new ATOM 841 N THR A 56 10.656 -8.091 -17.298 1.00 0.00 N ATOM 842 CA THR A 56 10.124 -9.363 -17.865 1.00 0.00 C ATOM 843 C THR A 56 11.297 -10.243 -18.405 1.00 0.00 C ATOM 844 O THR A 56 11.820 -10.006 -19.500 1.00 0.00 O ATOM 845 CB THR A 56 9.046 -8.968 -18.917 1.00 0.00 C ATOM 846 OG1 THR A 56 8.018 -8.199 -18.295 1.00 0.00 O ATOM 847 CG2 THR A 56 8.335 -10.147 -19.585 1.00 0.00 C ATOM 0 H THR A 56 10.708 -7.335 -17.981 1.00 0.00 H new ATOM 0 HA THR A 56 9.641 -9.995 -17.120 1.00 0.00 H new ATOM 0 HB THR A 56 9.602 -8.421 -19.678 1.00 0.00 H new ATOM 0 HG1 THR A 56 7.765 -8.618 -17.446 1.00 0.00 H new ATOM 0 HG21 THR A 56 7.603 -9.772 -20.301 1.00 0.00 H new ATOM 0 HG22 THR A 56 9.067 -10.766 -20.104 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.828 -10.743 -18.826 1.00 0.00 H new ATOM 855 N GLU A 57 11.708 -11.245 -17.608 1.00 0.00 N ATOM 856 CA GLU A 57 12.898 -12.090 -17.896 1.00 0.00 C ATOM 857 C GLU A 57 12.497 -13.417 -18.619 1.00 0.00 C ATOM 858 O GLU A 57 11.895 -14.327 -18.036 1.00 0.00 O ATOM 859 CB GLU A 57 13.634 -12.389 -16.554 1.00 0.00 C ATOM 860 CG GLU A 57 14.480 -11.252 -15.946 1.00 0.00 C ATOM 861 CD GLU A 57 15.911 -11.145 -16.433 1.00 0.00 C ATOM 862 OE1 GLU A 57 16.136 -10.823 -17.613 1.00 0.00 O ATOM 863 OE2 GLU A 57 16.826 -11.230 -15.583 1.00 0.00 O ATOM 0 H GLU A 57 11.229 -11.498 -16.744 1.00 0.00 H new ATOM 0 HA GLU A 57 13.564 -11.552 -18.570 1.00 0.00 H new ATOM 0 HB2 GLU A 57 12.887 -12.685 -15.818 1.00 0.00 H new ATOM 0 HB3 GLU A 57 14.286 -13.249 -16.710 1.00 0.00 H new ATOM 0 HG2 GLU A 57 13.978 -10.306 -16.149 1.00 0.00 H new ATOM 0 HG3 GLU A 57 14.496 -11.379 -14.863 1.00 0.00 H new ATOM 870 N SER A 58 12.893 -13.540 -19.894 1.00 0.00 N ATOM 871 CA SER A 58 13.049 -14.857 -20.575 1.00 0.00 C ATOM 872 C SER A 58 14.188 -14.793 -21.640 1.00 0.00 C ATOM 873 O SER A 58 14.466 -13.738 -22.223 1.00 0.00 O ATOM 874 CB SER A 58 11.710 -15.360 -21.175 1.00 0.00 C ATOM 875 OG SER A 58 11.259 -14.576 -22.281 1.00 0.00 O ATOM 0 H SER A 58 13.116 -12.742 -20.489 1.00 0.00 H new ATOM 0 HA SER A 58 13.341 -15.592 -19.825 1.00 0.00 H new ATOM 0 HB2 SER A 58 11.829 -16.395 -21.496 1.00 0.00 H new ATOM 0 HB3 SER A 58 10.946 -15.353 -20.398 1.00 0.00 H new ATOM 0 HG SER A 58 11.526 -13.642 -22.150 1.00 0.00 H new ATOM 881 N THR A 59 14.823 -15.943 -21.932 1.00 0.00 N ATOM 882 CA THR A 59 15.805 -16.077 -23.062 1.00 0.00 C ATOM 883 C THR A 59 15.221 -15.814 -24.494 1.00 0.00 C ATOM 884 O THR A 59 15.841 -15.098 -25.283 1.00 0.00 O ATOM 885 CB THR A 59 16.547 -17.450 -23.009 1.00 0.00 C ATOM 886 OG1 THR A 59 15.623 -18.534 -23.030 1.00 0.00 O ATOM 887 CG2 THR A 59 17.462 -17.650 -21.789 1.00 0.00 C ATOM 0 H THR A 59 14.683 -16.806 -21.407 1.00 0.00 H new ATOM 0 HA THR A 59 16.519 -15.270 -22.897 1.00 0.00 H new ATOM 0 HB THR A 59 17.178 -17.436 -23.898 1.00 0.00 H new ATOM 0 HG1 THR A 59 16.113 -19.382 -22.998 1.00 0.00 H new ATOM 0 HG21 THR A 59 17.931 -18.632 -21.843 1.00 0.00 H new ATOM 0 HG22 THR A 59 18.233 -16.879 -21.782 1.00 0.00 H new ATOM 0 HG23 THR A 59 16.871 -17.580 -20.876 1.00 0.00 H new ATOM 895 N LEU A 60 14.027 -16.349 -24.813 1.00 0.00 N ATOM 896 CA LEU A 60 13.257 -15.972 -26.036 1.00 0.00 C ATOM 897 C LEU A 60 12.804 -14.473 -26.135 1.00 0.00 C ATOM 898 O LEU A 60 12.867 -13.902 -27.227 1.00 0.00 O ATOM 899 CB LEU A 60 12.036 -16.931 -26.158 1.00 0.00 C ATOM 900 CG LEU A 60 12.328 -18.384 -26.616 1.00 0.00 C ATOM 901 CD1 LEU A 60 11.117 -19.282 -26.327 1.00 0.00 C ATOM 902 CD2 LEU A 60 12.662 -18.464 -28.117 1.00 0.00 C ATOM 0 H LEU A 60 13.562 -17.053 -24.239 1.00 0.00 H new ATOM 0 HA LEU A 60 13.946 -16.080 -26.874 1.00 0.00 H new ATOM 0 HB2 LEU A 60 11.540 -16.974 -25.188 1.00 0.00 H new ATOM 0 HB3 LEU A 60 11.327 -16.490 -26.859 1.00 0.00 H new ATOM 0 HG LEU A 60 13.197 -18.727 -26.054 1.00 0.00 H new ATOM 0 HD11 LEU A 60 11.333 -20.300 -26.652 1.00 0.00 H new ATOM 0 HD12 LEU A 60 10.909 -19.280 -25.257 1.00 0.00 H new ATOM 0 HD13 LEU A 60 10.248 -18.905 -26.866 1.00 0.00 H new ATOM 0 HD21 LEU A 60 12.859 -19.500 -28.391 1.00 0.00 H new ATOM 0 HD22 LEU A 60 11.819 -18.089 -28.698 1.00 0.00 H new ATOM 0 HD23 LEU A 60 13.545 -17.859 -28.326 1.00 0.00 H new ATOM 914 N LYS A 61 12.328 -13.841 -25.040 1.00 0.00 N ATOM 915 CA LYS A 61 11.954 -12.401 -25.036 1.00 0.00 C ATOM 916 C LYS A 61 12.282 -11.749 -23.656 1.00 0.00 C ATOM 917 O LYS A 61 11.632 -12.036 -22.643 1.00 0.00 O ATOM 918 CB LYS A 61 10.460 -12.273 -25.442 1.00 0.00 C ATOM 919 CG LYS A 61 9.930 -10.845 -25.721 1.00 0.00 C ATOM 920 CD LYS A 61 10.662 -10.104 -26.867 1.00 0.00 C ATOM 921 CE LYS A 61 9.841 -8.922 -27.403 1.00 0.00 C ATOM 922 NZ LYS A 61 10.556 -8.213 -28.496 1.00 0.00 N ATOM 0 H LYS A 61 12.192 -14.304 -24.141 1.00 0.00 H new ATOM 0 HA LYS A 61 12.544 -11.849 -25.767 1.00 0.00 H new ATOM 0 HB2 LYS A 61 10.299 -12.875 -26.336 1.00 0.00 H new ATOM 0 HB3 LYS A 61 9.854 -12.711 -24.649 1.00 0.00 H new ATOM 0 HG2 LYS A 61 8.869 -10.905 -25.963 1.00 0.00 H new ATOM 0 HG3 LYS A 61 10.016 -10.254 -24.809 1.00 0.00 H new ATOM 0 HD2 LYS A 61 11.626 -9.743 -26.508 1.00 0.00 H new ATOM 0 HD3 LYS A 61 10.865 -10.802 -27.679 1.00 0.00 H new ATOM 0 HE2 LYS A 61 8.880 -9.282 -27.769 1.00 0.00 H new ATOM 0 HE3 LYS A 61 9.632 -8.225 -26.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 9.894 -7.582 -28.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 11.334 -7.652 -28.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 10.941 -8.908 -29.167 1.00 0.00 H new ATOM 936 N THR A 62 13.288 -10.859 -23.635 1.00 0.00 N ATOM 937 CA THR A 62 13.741 -10.156 -22.398 1.00 0.00 C ATOM 938 C THR A 62 13.399 -8.633 -22.534 1.00 0.00 C ATOM 939 O THR A 62 13.884 -7.975 -23.462 1.00 0.00 O ATOM 940 CB THR A 62 15.272 -10.379 -22.139 1.00 0.00 C ATOM 941 OG1 THR A 62 15.782 -11.612 -22.651 1.00 0.00 O ATOM 942 CG2 THR A 62 15.640 -10.347 -20.651 1.00 0.00 C ATOM 0 H THR A 62 13.817 -10.599 -24.468 1.00 0.00 H new ATOM 0 HA THR A 62 13.218 -10.569 -21.535 1.00 0.00 H new ATOM 0 HB THR A 62 15.725 -9.543 -22.673 1.00 0.00 H new ATOM 0 HG1 THR A 62 15.183 -12.345 -22.396 1.00 0.00 H new ATOM 0 HG21 THR A 62 16.712 -10.507 -20.538 1.00 0.00 H new ATOM 0 HG22 THR A 62 15.372 -9.378 -20.231 1.00 0.00 H new ATOM 0 HG23 THR A 62 15.098 -11.133 -20.125 1.00 0.00 H new ATOM 950 N THR A 63 12.558 -8.066 -21.646 1.00 0.00 N ATOM 951 CA THR A 63 12.130 -6.625 -21.734 1.00 0.00 C ATOM 952 C THR A 63 12.076 -5.945 -20.326 1.00 0.00 C ATOM 953 O THR A 63 11.677 -6.565 -19.338 1.00 0.00 O ATOM 954 CB THR A 63 10.770 -6.446 -22.489 1.00 0.00 C ATOM 955 OG1 THR A 63 9.766 -7.296 -21.954 1.00 0.00 O ATOM 956 CG2 THR A 63 10.823 -6.719 -24.000 1.00 0.00 C ATOM 0 H THR A 63 12.154 -8.569 -20.856 1.00 0.00 H new ATOM 0 HA THR A 63 12.896 -6.120 -22.323 1.00 0.00 H new ATOM 0 HB THR A 63 10.538 -5.391 -22.341 1.00 0.00 H new ATOM 0 HG1 THR A 63 8.928 -7.161 -22.444 1.00 0.00 H new ATOM 0 HG21 THR A 63 9.834 -6.569 -24.432 1.00 0.00 H new ATOM 0 HG22 THR A 63 11.531 -6.036 -24.469 1.00 0.00 H new ATOM 0 HG23 THR A 63 11.142 -7.747 -24.173 1.00 0.00 H new ATOM 964 N GLN A 64 12.467 -4.658 -20.221 1.00 0.00 N ATOM 965 CA GLN A 64 12.491 -3.916 -18.924 1.00 0.00 C ATOM 966 C GLN A 64 11.974 -2.449 -19.084 1.00 0.00 C ATOM 967 O GLN A 64 12.426 -1.717 -19.970 1.00 0.00 O ATOM 968 CB GLN A 64 13.940 -3.976 -18.358 1.00 0.00 C ATOM 969 CG GLN A 64 14.120 -3.409 -16.924 1.00 0.00 C ATOM 970 CD GLN A 64 15.558 -3.476 -16.401 1.00 0.00 C ATOM 971 OE1 GLN A 64 16.010 -4.475 -15.853 1.00 0.00 O ATOM 972 NE2 GLN A 64 16.324 -2.422 -16.543 1.00 0.00 N ATOM 0 H GLN A 64 12.774 -4.101 -21.018 1.00 0.00 H new ATOM 0 HA GLN A 64 11.809 -4.387 -18.216 1.00 0.00 H new ATOM 0 HB2 GLN A 64 14.271 -5.014 -18.364 1.00 0.00 H new ATOM 0 HB3 GLN A 64 14.598 -3.428 -19.032 1.00 0.00 H new ATOM 0 HG2 GLN A 64 13.788 -2.371 -16.911 1.00 0.00 H new ATOM 0 HG3 GLN A 64 13.471 -3.960 -16.243 1.00 0.00 H new ATOM 0 HE21 GLN A 64 15.960 -1.584 -16.997 1.00 0.00 H new ATOM 0 HE22 GLN A 64 17.284 -2.439 -16.199 1.00 0.00 H new ATOM 981 N PHE A 65 11.082 -2.000 -18.178 1.00 0.00 N ATOM 982 CA PHE A 65 10.669 -0.566 -18.087 1.00 0.00 C ATOM 983 C PHE A 65 10.356 -0.114 -16.620 1.00 0.00 C ATOM 984 O PHE A 65 9.830 -0.878 -15.804 1.00 0.00 O ATOM 985 CB PHE A 65 9.523 -0.229 -19.090 1.00 0.00 C ATOM 986 CG PHE A 65 8.158 -0.927 -18.917 1.00 0.00 C ATOM 987 CD1 PHE A 65 7.253 -0.485 -17.945 1.00 0.00 C ATOM 988 CD2 PHE A 65 7.782 -1.958 -19.784 1.00 0.00 C ATOM 989 CE1 PHE A 65 5.987 -1.056 -17.852 1.00 0.00 C ATOM 990 CE2 PHE A 65 6.515 -2.529 -19.688 1.00 0.00 C ATOM 991 CZ PHE A 65 5.618 -2.075 -18.727 1.00 0.00 C ATOM 0 H PHE A 65 10.627 -2.604 -17.493 1.00 0.00 H new ATOM 0 HA PHE A 65 11.530 0.029 -18.391 1.00 0.00 H new ATOM 0 HB2 PHE A 65 9.352 0.847 -19.047 1.00 0.00 H new ATOM 0 HB3 PHE A 65 9.885 -0.455 -20.093 1.00 0.00 H new ATOM 0 HD1 PHE A 65 7.538 0.303 -17.264 1.00 0.00 H new ATOM 0 HD2 PHE A 65 8.477 -2.313 -20.531 1.00 0.00 H new ATOM 0 HE1 PHE A 65 5.291 -0.709 -17.102 1.00 0.00 H new ATOM 0 HE2 PHE A 65 6.229 -3.325 -20.360 1.00 0.00 H new ATOM 0 HZ PHE A 65 4.633 -2.513 -18.659 1.00 0.00 H new ATOM 1001 N SER A 66 10.638 1.164 -16.309 1.00 0.00 N ATOM 1002 CA SER A 66 10.251 1.803 -15.020 1.00 0.00 C ATOM 1003 C SER A 66 9.055 2.781 -15.223 1.00 0.00 C ATOM 1004 O SER A 66 9.239 3.875 -15.771 1.00 0.00 O ATOM 1005 CB SER A 66 11.486 2.519 -14.422 1.00 0.00 C ATOM 1006 OG SER A 66 11.875 3.645 -15.213 1.00 0.00 O ATOM 0 H SER A 66 11.140 1.790 -16.938 1.00 0.00 H new ATOM 0 HA SER A 66 9.916 1.040 -14.317 1.00 0.00 H new ATOM 0 HB2 SER A 66 11.261 2.847 -13.407 1.00 0.00 H new ATOM 0 HB3 SER A 66 12.317 1.817 -14.354 1.00 0.00 H new ATOM 0 HG SER A 66 11.078 4.061 -15.604 1.00 0.00 H new ATOM 1012 N CYS A 67 7.849 2.396 -14.777 1.00 0.00 N ATOM 1013 CA CYS A 67 6.638 3.241 -14.905 1.00 0.00 C ATOM 1014 C CYS A 67 6.375 4.097 -13.628 1.00 0.00 C ATOM 1015 O CYS A 67 6.262 3.576 -12.513 1.00 0.00 O ATOM 1016 CB CYS A 67 5.461 2.312 -15.265 1.00 0.00 C ATOM 1017 SG CYS A 67 5.048 1.128 -13.946 1.00 0.00 S ATOM 0 H CYS A 67 7.680 1.500 -14.321 1.00 0.00 H new ATOM 0 HA CYS A 67 6.774 3.977 -15.698 1.00 0.00 H new ATOM 0 HB2 CYS A 67 4.583 2.919 -15.487 1.00 0.00 H new ATOM 0 HB3 CYS A 67 5.706 1.762 -16.174 1.00 0.00 H new ATOM 0 HG CYS A 67 6.139 0.735 -13.358 1.00 0.00 H new ATOM 1023 N THR A 68 6.253 5.424 -13.794 1.00 0.00 N ATOM 1024 CA THR A 68 5.939 6.355 -12.670 1.00 0.00 C ATOM 1025 C THR A 68 4.411 6.288 -12.327 1.00 0.00 C ATOM 1026 O THR A 68 3.542 6.498 -13.178 1.00 0.00 O ATOM 1027 CB THR A 68 6.428 7.790 -13.033 1.00 0.00 C ATOM 1028 OG1 THR A 68 7.824 7.783 -13.316 1.00 0.00 O ATOM 1029 CG2 THR A 68 6.251 8.829 -11.913 1.00 0.00 C ATOM 0 H THR A 68 6.365 5.889 -14.695 1.00 0.00 H new ATOM 0 HA THR A 68 6.470 6.056 -11.766 1.00 0.00 H new ATOM 0 HB THR A 68 5.811 8.070 -13.887 1.00 0.00 H new ATOM 0 HG1 THR A 68 8.116 8.690 -13.544 1.00 0.00 H new ATOM 0 HG21 THR A 68 6.618 9.797 -12.254 1.00 0.00 H new ATOM 0 HG22 THR A 68 5.195 8.911 -11.656 1.00 0.00 H new ATOM 0 HG23 THR A 68 6.815 8.516 -11.034 1.00 0.00 H new ATOM 1037 N LEU A 69 4.096 5.973 -11.063 1.00 0.00 N ATOM 1038 CA LEU A 69 2.722 5.611 -10.633 1.00 0.00 C ATOM 1039 C LEU A 69 1.771 6.842 -10.467 1.00 0.00 C ATOM 1040 O LEU A 69 2.138 7.860 -9.873 1.00 0.00 O ATOM 1041 CB LEU A 69 2.901 4.825 -9.309 1.00 0.00 C ATOM 1042 CG LEU A 69 1.697 3.962 -8.878 1.00 0.00 C ATOM 1043 CD1 LEU A 69 1.652 2.647 -9.674 1.00 0.00 C ATOM 1044 CD2 LEU A 69 1.795 3.693 -7.371 1.00 0.00 C ATOM 0 H LEU A 69 4.779 5.959 -10.305 1.00 0.00 H new ATOM 0 HA LEU A 69 2.228 5.013 -11.399 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.773 4.178 -9.407 1.00 0.00 H new ATOM 0 HB3 LEU A 69 3.119 5.536 -8.512 1.00 0.00 H new ATOM 0 HG LEU A 69 0.771 4.497 -9.089 1.00 0.00 H new ATOM 0 HD11 LEU A 69 0.795 2.056 -9.352 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.561 2.868 -10.737 1.00 0.00 H new ATOM 0 HD13 LEU A 69 2.568 2.083 -9.497 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.949 3.083 -7.054 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.724 3.165 -7.155 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.782 4.640 -6.831 1.00 0.00 H new ATOM 1056 N GLY A 70 0.557 6.772 -11.030 1.00 0.00 N ATOM 1057 CA GLY A 70 -0.254 7.988 -11.327 1.00 0.00 C ATOM 1058 C GLY A 70 0.319 8.970 -12.382 1.00 0.00 C ATOM 1059 O GLY A 70 0.205 10.184 -12.201 1.00 0.00 O ATOM 0 H GLY A 70 0.106 5.896 -11.293 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -1.239 7.665 -11.663 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -0.398 8.536 -10.396 1.00 0.00 H new ATOM 1063 N GLU A 71 0.956 8.445 -13.444 1.00 0.00 N ATOM 1064 CA GLU A 71 1.717 9.255 -14.430 1.00 0.00 C ATOM 1065 C GLU A 71 1.922 8.467 -15.772 1.00 0.00 C ATOM 1066 O GLU A 71 1.855 7.227 -15.834 1.00 0.00 O ATOM 1067 CB GLU A 71 3.065 9.767 -13.814 1.00 0.00 C ATOM 1068 CG GLU A 71 3.249 11.306 -13.855 1.00 0.00 C ATOM 1069 CD GLU A 71 3.439 11.911 -15.238 1.00 0.00 C ATOM 1070 OE1 GLU A 71 2.486 11.886 -16.047 1.00 0.00 O ATOM 1071 OE2 GLU A 71 4.546 12.415 -15.516 1.00 0.00 O ATOM 0 H GLU A 71 0.961 7.446 -13.649 1.00 0.00 H new ATOM 0 HA GLU A 71 1.130 10.140 -14.677 1.00 0.00 H new ATOM 0 HB2 GLU A 71 3.125 9.434 -12.778 1.00 0.00 H new ATOM 0 HB3 GLU A 71 3.893 9.301 -14.347 1.00 0.00 H new ATOM 0 HG2 GLU A 71 2.378 11.770 -13.392 1.00 0.00 H new ATOM 0 HG3 GLU A 71 4.112 11.567 -13.243 1.00 0.00 H new ATOM 1078 N LYS A 72 2.121 9.241 -16.854 1.00 0.00 N ATOM 1079 CA LYS A 72 2.124 8.744 -18.254 1.00 0.00 C ATOM 1080 C LYS A 72 3.557 8.776 -18.878 1.00 0.00 C ATOM 1081 O LYS A 72 4.179 9.836 -18.981 1.00 0.00 O ATOM 1082 CB LYS A 72 1.112 9.626 -19.039 1.00 0.00 C ATOM 1083 CG LYS A 72 0.645 9.039 -20.392 1.00 0.00 C ATOM 1084 CD LYS A 72 -0.318 9.987 -21.153 1.00 0.00 C ATOM 1085 CE LYS A 72 -1.482 9.282 -21.879 1.00 0.00 C ATOM 1086 NZ LYS A 72 -2.551 8.916 -20.915 1.00 0.00 N ATOM 0 H LYS A 72 2.287 10.245 -16.786 1.00 0.00 H new ATOM 0 HA LYS A 72 1.824 7.697 -18.298 1.00 0.00 H new ATOM 0 HB2 LYS A 72 0.237 9.794 -18.412 1.00 0.00 H new ATOM 0 HB3 LYS A 72 1.566 10.600 -19.220 1.00 0.00 H new ATOM 0 HG2 LYS A 72 1.516 8.835 -21.015 1.00 0.00 H new ATOM 0 HG3 LYS A 72 0.147 8.085 -20.218 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -0.732 10.706 -20.446 1.00 0.00 H new ATOM 0 HD3 LYS A 72 0.257 10.555 -21.885 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -1.888 9.937 -22.650 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -1.116 8.387 -22.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -2.761 7.901 -20.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -2.233 9.126 -19.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -3.409 9.465 -21.124 1.00 0.00 H new ATOM 1100 N PHE A 73 4.063 7.613 -19.323 1.00 0.00 N ATOM 1101 CA PHE A 73 5.425 7.484 -19.929 1.00 0.00 C ATOM 1102 C PHE A 73 5.381 6.908 -21.389 1.00 0.00 C ATOM 1103 O PHE A 73 4.412 6.250 -21.784 1.00 0.00 O ATOM 1104 CB PHE A 73 6.332 6.675 -18.943 1.00 0.00 C ATOM 1105 CG PHE A 73 6.138 5.143 -18.887 1.00 0.00 C ATOM 1106 CD1 PHE A 73 5.005 4.595 -18.278 1.00 0.00 C ATOM 1107 CD2 PHE A 73 7.036 4.297 -19.549 1.00 0.00 C ATOM 1108 CE1 PHE A 73 4.734 3.235 -18.398 1.00 0.00 C ATOM 1109 CE2 PHE A 73 6.778 2.931 -19.638 1.00 0.00 C ATOM 1110 CZ PHE A 73 5.616 2.407 -19.081 1.00 0.00 C ATOM 0 H PHE A 73 3.552 6.732 -19.279 1.00 0.00 H new ATOM 0 HA PHE A 73 5.869 8.471 -20.059 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.372 6.873 -19.204 1.00 0.00 H new ATOM 0 HB3 PHE A 73 6.174 7.071 -17.940 1.00 0.00 H new ATOM 0 HD1 PHE A 73 4.338 5.229 -17.713 1.00 0.00 H new ATOM 0 HD2 PHE A 73 7.932 4.705 -19.992 1.00 0.00 H new ATOM 0 HE1 PHE A 73 3.837 2.823 -17.960 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.479 2.280 -20.139 1.00 0.00 H new ATOM 0 HZ PHE A 73 5.399 1.354 -19.180 1.00 0.00 H new ATOM 1120 N GLU A 74 6.467 7.080 -22.175 1.00 0.00 N ATOM 1121 CA GLU A 74 6.638 6.325 -23.451 1.00 0.00 C ATOM 1122 C GLU A 74 7.061 4.843 -23.173 1.00 0.00 C ATOM 1123 O GLU A 74 8.213 4.545 -22.837 1.00 0.00 O ATOM 1124 CB GLU A 74 7.643 7.041 -24.397 1.00 0.00 C ATOM 1125 CG GLU A 74 7.599 6.490 -25.851 1.00 0.00 C ATOM 1126 CD GLU A 74 8.813 6.770 -26.719 1.00 0.00 C ATOM 1127 OE1 GLU A 74 9.843 6.079 -26.556 1.00 0.00 O ATOM 1128 OE2 GLU A 74 8.709 7.581 -27.658 1.00 0.00 O ATOM 0 H GLU A 74 7.230 7.722 -21.960 1.00 0.00 H new ATOM 0 HA GLU A 74 5.675 6.301 -23.960 1.00 0.00 H new ATOM 0 HB2 GLU A 74 7.424 8.109 -24.411 1.00 0.00 H new ATOM 0 HB3 GLU A 74 8.652 6.928 -24.001 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.456 5.411 -25.802 1.00 0.00 H new ATOM 0 HG3 GLU A 74 6.722 6.906 -26.347 1.00 0.00 H new ATOM 1135 N GLU A 75 6.115 3.915 -23.361 1.00 0.00 N ATOM 1136 CA GLU A 75 6.392 2.463 -23.362 1.00 0.00 C ATOM 1137 C GLU A 75 6.705 2.009 -24.822 1.00 0.00 C ATOM 1138 O GLU A 75 5.855 2.075 -25.721 1.00 0.00 O ATOM 1139 CB GLU A 75 5.145 1.778 -22.758 1.00 0.00 C ATOM 1140 CG GLU A 75 5.271 0.254 -22.508 1.00 0.00 C ATOM 1141 CD GLU A 75 4.009 -0.457 -22.041 1.00 0.00 C ATOM 1142 OE1 GLU A 75 2.924 0.160 -21.946 1.00 0.00 O ATOM 1143 OE2 GLU A 75 4.089 -1.676 -21.800 1.00 0.00 O ATOM 0 H GLU A 75 5.133 4.144 -23.517 1.00 0.00 H new ATOM 0 HA GLU A 75 7.263 2.191 -22.765 1.00 0.00 H new ATOM 0 HB2 GLU A 75 4.908 2.265 -21.812 1.00 0.00 H new ATOM 0 HB3 GLU A 75 4.300 1.950 -23.425 1.00 0.00 H new ATOM 0 HG2 GLU A 75 5.608 -0.218 -23.431 1.00 0.00 H new ATOM 0 HG3 GLU A 75 6.051 0.092 -21.764 1.00 0.00 H new ATOM 1150 N THR A 76 7.938 1.529 -25.053 1.00 0.00 N ATOM 1151 CA THR A 76 8.297 0.855 -26.335 1.00 0.00 C ATOM 1152 C THR A 76 7.933 -0.657 -26.202 1.00 0.00 C ATOM 1153 O THR A 76 8.697 -1.459 -25.657 1.00 0.00 O ATOM 1154 CB THR A 76 9.784 1.137 -26.698 1.00 0.00 C ATOM 1155 OG1 THR A 76 10.032 2.540 -26.678 1.00 0.00 O ATOM 1156 CG2 THR A 76 10.180 0.650 -28.101 1.00 0.00 C ATOM 0 H THR A 76 8.704 1.589 -24.382 1.00 0.00 H new ATOM 0 HA THR A 76 7.728 1.252 -27.176 1.00 0.00 H new ATOM 0 HB THR A 76 10.368 0.594 -25.955 1.00 0.00 H new ATOM 0 HG1 THR A 76 10.965 2.704 -26.428 1.00 0.00 H new ATOM 0 HG21 THR A 76 11.230 0.881 -28.283 1.00 0.00 H new ATOM 0 HG22 THR A 76 10.028 -0.427 -28.168 1.00 0.00 H new ATOM 0 HG23 THR A 76 9.563 1.151 -28.847 1.00 0.00 H new ATOM 1164 N THR A 77 6.722 -1.011 -26.658 1.00 0.00 N ATOM 1165 CA THR A 77 6.111 -2.351 -26.402 1.00 0.00 C ATOM 1166 C THR A 77 6.819 -3.536 -27.141 1.00 0.00 C ATOM 1167 O THR A 77 7.519 -3.347 -28.141 1.00 0.00 O ATOM 1168 CB THR A 77 4.583 -2.319 -26.729 1.00 0.00 C ATOM 1169 OG1 THR A 77 4.355 -1.954 -28.085 1.00 0.00 O ATOM 1170 CG2 THR A 77 3.738 -1.390 -25.841 1.00 0.00 C ATOM 0 H THR A 77 6.132 -0.391 -27.212 1.00 0.00 H new ATOM 0 HA THR A 77 6.256 -2.550 -25.340 1.00 0.00 H new ATOM 0 HB THR A 77 4.257 -3.339 -26.527 1.00 0.00 H new ATOM 0 HG1 THR A 77 4.475 -0.987 -28.188 1.00 0.00 H new ATOM 0 HG21 THR A 77 2.694 -1.441 -26.150 1.00 0.00 H new ATOM 0 HG22 THR A 77 3.824 -1.704 -24.801 1.00 0.00 H new ATOM 0 HG23 THR A 77 4.096 -0.365 -25.942 1.00 0.00 H new ATOM 1178 N ALA A 78 6.603 -4.773 -26.646 1.00 0.00 N ATOM 1179 CA ALA A 78 7.239 -6.013 -27.181 1.00 0.00 C ATOM 1180 C ALA A 78 7.331 -6.234 -28.733 1.00 0.00 C ATOM 1181 O ALA A 78 8.393 -6.637 -29.220 1.00 0.00 O ATOM 1182 CB ALA A 78 6.532 -7.184 -26.469 1.00 0.00 C ATOM 0 H ALA A 78 5.979 -4.949 -25.858 1.00 0.00 H new ATOM 0 HA ALA A 78 8.303 -5.924 -26.964 1.00 0.00 H new ATOM 0 HB1 ALA A 78 6.952 -8.128 -26.816 1.00 0.00 H new ATOM 0 HB2 ALA A 78 6.678 -7.096 -25.392 1.00 0.00 H new ATOM 0 HB3 ALA A 78 5.466 -7.156 -26.694 1.00 0.00 H new ATOM 1188 N ASP A 79 6.265 -5.940 -29.494 1.00 0.00 N ATOM 1189 CA ASP A 79 6.306 -5.941 -30.989 1.00 0.00 C ATOM 1190 C ASP A 79 7.075 -4.749 -31.666 1.00 0.00 C ATOM 1191 O ASP A 79 7.656 -4.932 -32.739 1.00 0.00 O ATOM 1192 CB ASP A 79 4.857 -5.958 -31.551 1.00 0.00 C ATOM 1193 CG ASP A 79 3.936 -7.109 -31.162 1.00 0.00 C ATOM 1194 OD1 ASP A 79 4.397 -8.244 -30.934 1.00 0.00 O ATOM 1195 OD2 ASP A 79 2.716 -6.858 -31.094 1.00 0.00 O ATOM 0 H ASP A 79 5.353 -5.695 -29.108 1.00 0.00 H new ATOM 0 HA ASP A 79 6.871 -6.839 -31.238 1.00 0.00 H new ATOM 0 HB2 ASP A 79 4.373 -5.030 -31.247 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.924 -5.941 -32.639 1.00 0.00 H new ATOM 1200 N GLY A 80 7.009 -3.531 -31.096 1.00 0.00 N ATOM 1201 CA GLY A 80 7.435 -2.279 -31.785 1.00 0.00 C ATOM 1202 C GLY A 80 6.553 -1.014 -31.606 1.00 0.00 C ATOM 1203 O GLY A 80 7.022 0.074 -31.943 1.00 0.00 O ATOM 0 H GLY A 80 6.662 -3.378 -30.149 1.00 0.00 H new ATOM 0 HA2 GLY A 80 8.441 -2.036 -31.444 1.00 0.00 H new ATOM 0 HA3 GLY A 80 7.503 -2.491 -32.852 1.00 0.00 H new ATOM 1207 N ARG A 81 5.302 -1.116 -31.111 1.00 0.00 N ATOM 1208 CA ARG A 81 4.396 0.056 -30.941 1.00 0.00 C ATOM 1209 C ARG A 81 4.836 0.992 -29.769 1.00 0.00 C ATOM 1210 O ARG A 81 5.043 0.542 -28.634 1.00 0.00 O ATOM 1211 CB ARG A 81 2.935 -0.398 -30.668 1.00 0.00 C ATOM 1212 CG ARG A 81 2.208 -1.212 -31.764 1.00 0.00 C ATOM 1213 CD ARG A 81 0.848 -1.765 -31.273 1.00 0.00 C ATOM 1214 NE ARG A 81 0.981 -2.848 -30.259 1.00 0.00 N ATOM 1215 CZ ARG A 81 1.328 -4.105 -30.534 1.00 0.00 C ATOM 1216 NH1 ARG A 81 1.358 -4.612 -31.738 1.00 0.00 N ATOM 1217 NH2 ARG A 81 1.681 -4.888 -29.563 1.00 0.00 N ATOM 0 H ARG A 81 4.888 -2.001 -30.818 1.00 0.00 H new ATOM 0 HA ARG A 81 4.455 0.610 -31.878 1.00 0.00 H new ATOM 0 HB2 ARG A 81 2.936 -0.994 -29.756 1.00 0.00 H new ATOM 0 HB3 ARG A 81 2.341 0.493 -30.466 1.00 0.00 H new ATOM 0 HG2 ARG A 81 2.048 -0.580 -32.638 1.00 0.00 H new ATOM 0 HG3 ARG A 81 2.842 -2.040 -32.081 1.00 0.00 H new ATOM 0 HD2 ARG A 81 0.265 -0.949 -30.847 1.00 0.00 H new ATOM 0 HD3 ARG A 81 0.289 -2.145 -32.128 1.00 0.00 H new ATOM 0 HE ARG A 81 0.793 -2.611 -29.285 1.00 0.00 H new ATOM 0 HH11 ARG A 81 1.105 -4.035 -32.541 1.00 0.00 H new ATOM 0 HH12 ARG A 81 1.634 -5.584 -31.875 1.00 0.00 H new ATOM 0 HH21 ARG A 81 1.690 -4.539 -28.604 1.00 0.00 H new ATOM 0 HH22 ARG A 81 1.949 -5.853 -29.758 1.00 0.00 H new ATOM 1231 N LYS A 82 4.894 2.301 -30.055 1.00 0.00 N ATOM 1232 CA LYS A 82 5.085 3.352 -29.022 1.00 0.00 C ATOM 1233 C LYS A 82 3.725 3.692 -28.335 1.00 0.00 C ATOM 1234 O LYS A 82 2.837 4.272 -28.970 1.00 0.00 O ATOM 1235 CB LYS A 82 5.683 4.614 -29.710 1.00 0.00 C ATOM 1236 CG LYS A 82 7.108 4.505 -30.305 1.00 0.00 C ATOM 1237 CD LYS A 82 8.187 4.259 -29.233 1.00 0.00 C ATOM 1238 CE LYS A 82 9.602 4.615 -29.713 1.00 0.00 C ATOM 1239 NZ LYS A 82 10.531 4.548 -28.554 1.00 0.00 N ATOM 0 H LYS A 82 4.811 2.669 -31.003 1.00 0.00 H new ATOM 0 HA LYS A 82 5.767 2.996 -28.250 1.00 0.00 H new ATOM 0 HB2 LYS A 82 5.007 4.910 -30.512 1.00 0.00 H new ATOM 0 HB3 LYS A 82 5.686 5.424 -28.980 1.00 0.00 H new ATOM 0 HG2 LYS A 82 7.132 3.692 -31.031 1.00 0.00 H new ATOM 0 HG3 LYS A 82 7.342 5.422 -30.845 1.00 0.00 H new ATOM 0 HD2 LYS A 82 7.951 4.848 -28.346 1.00 0.00 H new ATOM 0 HD3 LYS A 82 8.163 3.211 -28.935 1.00 0.00 H new ATOM 0 HE2 LYS A 82 9.921 3.924 -30.493 1.00 0.00 H new ATOM 0 HE3 LYS A 82 9.613 5.614 -30.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 11.513 4.568 -28.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 10.365 5.362 -27.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 10.365 3.667 -28.027 1.00 0.00 H new ATOM 1253 N THR A 83 3.559 3.323 -27.053 1.00 0.00 N ATOM 1254 CA THR A 83 2.284 3.553 -26.309 1.00 0.00 C ATOM 1255 C THR A 83 2.526 4.556 -25.146 1.00 0.00 C ATOM 1256 O THR A 83 3.415 4.363 -24.311 1.00 0.00 O ATOM 1257 CB THR A 83 1.593 2.239 -25.824 1.00 0.00 C ATOM 1258 OG1 THR A 83 2.347 1.566 -24.823 1.00 0.00 O ATOM 1259 CG2 THR A 83 1.301 1.203 -26.922 1.00 0.00 C ATOM 0 H THR A 83 4.284 2.864 -26.501 1.00 0.00 H new ATOM 0 HA THR A 83 1.575 3.991 -27.011 1.00 0.00 H new ATOM 0 HB THR A 83 0.645 2.609 -25.435 1.00 0.00 H new ATOM 0 HG1 THR A 83 2.106 1.917 -23.940 1.00 0.00 H new ATOM 0 HG21 THR A 83 0.821 0.330 -26.480 1.00 0.00 H new ATOM 0 HG22 THR A 83 0.639 1.641 -27.669 1.00 0.00 H new ATOM 0 HG23 THR A 83 2.235 0.903 -27.396 1.00 0.00 H new ATOM 1267 N GLN A 84 1.705 5.616 -25.065 1.00 0.00 N ATOM 1268 CA GLN A 84 1.716 6.559 -23.916 1.00 0.00 C ATOM 1269 C GLN A 84 0.947 5.929 -22.713 1.00 0.00 C ATOM 1270 O GLN A 84 -0.282 6.009 -22.613 1.00 0.00 O ATOM 1271 CB GLN A 84 1.127 7.921 -24.379 1.00 0.00 C ATOM 1272 CG GLN A 84 2.015 8.766 -25.329 1.00 0.00 C ATOM 1273 CD GLN A 84 3.282 9.332 -24.675 1.00 0.00 C ATOM 1274 OE1 GLN A 84 3.229 10.158 -23.770 1.00 0.00 O ATOM 1275 NE2 GLN A 84 4.450 8.909 -25.094 1.00 0.00 N ATOM 0 H GLN A 84 1.018 5.849 -25.783 1.00 0.00 H new ATOM 0 HA GLN A 84 2.732 6.746 -23.569 1.00 0.00 H new ATOM 0 HB2 GLN A 84 0.177 7.731 -24.878 1.00 0.00 H new ATOM 0 HB3 GLN A 84 0.908 8.518 -23.494 1.00 0.00 H new ATOM 0 HG2 GLN A 84 2.304 8.150 -26.180 1.00 0.00 H new ATOM 0 HG3 GLN A 84 1.423 9.593 -25.721 1.00 0.00 H new ATOM 0 HE21 GLN A 84 4.504 8.222 -25.846 1.00 0.00 H new ATOM 0 HE22 GLN A 84 5.305 9.267 -24.668 1.00 0.00 H new ATOM 1284 N THR A 85 1.687 5.236 -21.837 1.00 0.00 N ATOM 1285 CA THR A 85 1.095 4.300 -20.849 1.00 0.00 C ATOM 1286 C THR A 85 0.956 5.006 -19.467 1.00 0.00 C ATOM 1287 O THR A 85 1.960 5.324 -18.824 1.00 0.00 O ATOM 1288 CB THR A 85 1.922 2.977 -20.818 1.00 0.00 C ATOM 1289 OG1 THR A 85 1.915 2.320 -22.089 1.00 0.00 O ATOM 1290 CG2 THR A 85 1.383 1.948 -19.815 1.00 0.00 C ATOM 0 H THR A 85 2.704 5.301 -21.786 1.00 0.00 H new ATOM 0 HA THR A 85 0.084 4.016 -21.139 1.00 0.00 H new ATOM 0 HB THR A 85 2.924 3.296 -20.530 1.00 0.00 H new ATOM 0 HG1 THR A 85 2.568 1.589 -22.083 1.00 0.00 H new ATOM 0 HG21 THR A 85 2.003 1.052 -19.844 1.00 0.00 H new ATOM 0 HG22 THR A 85 1.405 2.372 -18.811 1.00 0.00 H new ATOM 0 HG23 THR A 85 0.357 1.688 -20.076 1.00 0.00 H new ATOM 1298 N VAL A 86 -0.291 5.219 -18.998 1.00 0.00 N ATOM 1299 CA VAL A 86 -0.557 5.719 -17.613 1.00 0.00 C ATOM 1300 C VAL A 86 -0.752 4.524 -16.617 1.00 0.00 C ATOM 1301 O VAL A 86 -1.678 3.717 -16.772 1.00 0.00 O ATOM 1302 CB VAL A 86 -1.653 6.841 -17.598 1.00 0.00 C ATOM 1303 CG1 VAL A 86 -3.076 6.416 -18.010 1.00 0.00 C ATOM 1304 CG2 VAL A 86 -1.737 7.585 -16.247 1.00 0.00 C ATOM 0 H VAL A 86 -1.134 5.056 -19.548 1.00 0.00 H new ATOM 0 HA VAL A 86 0.322 6.238 -17.231 1.00 0.00 H new ATOM 0 HB VAL A 86 -1.288 7.507 -18.380 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -3.742 7.277 -17.960 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.060 6.029 -19.029 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.434 5.640 -17.333 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -2.513 8.349 -16.300 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.979 6.876 -15.455 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -0.778 8.056 -16.031 1.00 0.00 H new ATOM 1314 N CYS A 87 0.143 4.406 -15.613 1.00 0.00 N ATOM 1315 CA CYS A 87 0.088 3.296 -14.612 1.00 0.00 C ATOM 1316 C CYS A 87 -0.529 3.764 -13.261 1.00 0.00 C ATOM 1317 O CYS A 87 0.077 4.563 -12.548 1.00 0.00 O ATOM 1318 CB CYS A 87 1.509 2.727 -14.405 1.00 0.00 C ATOM 1319 SG CYS A 87 1.960 1.593 -15.759 1.00 0.00 S ATOM 0 H CYS A 87 0.913 5.059 -15.466 1.00 0.00 H new ATOM 0 HA CYS A 87 -0.564 2.512 -14.998 1.00 0.00 H new ATOM 0 HB2 CYS A 87 2.228 3.544 -14.355 1.00 0.00 H new ATOM 0 HB3 CYS A 87 1.559 2.200 -13.452 1.00 0.00 H new ATOM 0 HG CYS A 87 1.255 0.504 -15.666 1.00 0.00 H new ATOM 1325 N ASN A 88 -1.717 3.255 -12.897 1.00 0.00 N ATOM 1326 CA ASN A 88 -2.489 3.757 -11.719 1.00 0.00 C ATOM 1327 C ASN A 88 -2.783 2.607 -10.709 1.00 0.00 C ATOM 1328 O ASN A 88 -3.390 1.597 -11.074 1.00 0.00 O ATOM 1329 CB ASN A 88 -3.834 4.370 -12.206 1.00 0.00 C ATOM 1330 CG ASN A 88 -3.736 5.592 -13.127 1.00 0.00 C ATOM 1331 OD1 ASN A 88 -3.291 6.665 -12.741 1.00 0.00 O ATOM 1332 ND2 ASN A 88 -4.152 5.474 -14.365 1.00 0.00 N ATOM 0 H ASN A 88 -2.176 2.493 -13.396 1.00 0.00 H new ATOM 0 HA ASN A 88 -1.890 4.515 -11.214 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -4.393 3.594 -12.728 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -4.419 4.650 -11.330 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -4.103 6.273 -14.998 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -4.524 4.584 -14.695 1.00 0.00 H new ATOM 1339 N PHE A 89 -2.411 2.769 -9.428 1.00 0.00 N ATOM 1340 CA PHE A 89 -2.786 1.797 -8.363 1.00 0.00 C ATOM 1341 C PHE A 89 -4.170 2.134 -7.707 1.00 0.00 C ATOM 1342 O PHE A 89 -4.401 3.260 -7.257 1.00 0.00 O ATOM 1343 CB PHE A 89 -1.624 1.732 -7.336 1.00 0.00 C ATOM 1344 CG PHE A 89 -1.790 0.638 -6.272 1.00 0.00 C ATOM 1345 CD1 PHE A 89 -1.525 -0.701 -6.580 1.00 0.00 C ATOM 1346 CD2 PHE A 89 -2.307 0.968 -5.015 1.00 0.00 C ATOM 1347 CE1 PHE A 89 -1.787 -1.697 -5.643 1.00 0.00 C ATOM 1348 CE2 PHE A 89 -2.570 -0.029 -4.083 1.00 0.00 C ATOM 1349 CZ PHE A 89 -2.312 -1.357 -4.400 1.00 0.00 C ATOM 0 H PHE A 89 -1.854 3.556 -9.097 1.00 0.00 H new ATOM 0 HA PHE A 89 -2.927 0.809 -8.800 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.689 1.565 -7.871 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.538 2.698 -6.838 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -1.117 -0.962 -7.545 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -2.503 2.001 -4.768 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -1.583 -2.731 -5.880 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -2.974 0.228 -3.115 1.00 0.00 H new ATOM 0 HZ PHE A 89 -2.520 -2.131 -3.676 1.00 0.00 H new ATOM 1359 N THR A 90 -5.054 1.126 -7.606 1.00 0.00 N ATOM 1360 CA THR A 90 -6.369 1.251 -6.911 1.00 0.00 C ATOM 1361 C THR A 90 -6.690 -0.061 -6.121 1.00 0.00 C ATOM 1362 O THR A 90 -7.015 -1.085 -6.724 1.00 0.00 O ATOM 1363 CB THR A 90 -7.493 1.708 -7.897 1.00 0.00 C ATOM 1364 OG1 THR A 90 -8.716 1.858 -7.190 1.00 0.00 O ATOM 1365 CG2 THR A 90 -7.793 0.809 -9.112 1.00 0.00 C ATOM 0 H THR A 90 -4.888 0.200 -7.999 1.00 0.00 H new ATOM 0 HA THR A 90 -6.315 2.045 -6.166 1.00 0.00 H new ATOM 0 HB THR A 90 -7.088 2.634 -8.306 1.00 0.00 H new ATOM 0 HG1 THR A 90 -9.419 2.146 -7.809 1.00 0.00 H new ATOM 0 HG21 THR A 90 -8.594 1.253 -9.704 1.00 0.00 H new ATOM 0 HG22 THR A 90 -6.897 0.716 -9.726 1.00 0.00 H new ATOM 0 HG23 THR A 90 -8.101 -0.178 -8.767 1.00 0.00 H new ATOM 1373 N ASP A 91 -6.606 -0.021 -4.773 1.00 0.00 N ATOM 1374 CA ASP A 91 -7.042 -1.124 -3.852 1.00 0.00 C ATOM 1375 C ASP A 91 -6.612 -2.591 -4.233 1.00 0.00 C ATOM 1376 O ASP A 91 -7.413 -3.413 -4.690 1.00 0.00 O ATOM 1377 CB ASP A 91 -8.552 -0.930 -3.535 1.00 0.00 C ATOM 1378 CG ASP A 91 -9.051 -1.669 -2.292 1.00 0.00 C ATOM 1379 OD1 ASP A 91 -8.442 -1.509 -1.213 1.00 0.00 O ATOM 1380 OD2 ASP A 91 -10.062 -2.397 -2.389 1.00 0.00 O ATOM 0 H ASP A 91 -6.229 0.785 -4.275 1.00 0.00 H new ATOM 0 HA ASP A 91 -6.466 -1.023 -2.932 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -8.748 0.135 -3.409 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -9.134 -1.262 -4.395 1.00 0.00 H new ATOM 1385 N GLY A 92 -5.307 -2.887 -4.106 1.00 0.00 N ATOM 1386 CA GLY A 92 -4.728 -4.170 -4.608 1.00 0.00 C ATOM 1387 C GLY A 92 -4.497 -4.372 -6.132 1.00 0.00 C ATOM 1388 O GLY A 92 -4.029 -5.451 -6.502 1.00 0.00 O ATOM 0 H GLY A 92 -4.627 -2.267 -3.665 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -3.767 -4.308 -4.113 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -5.380 -4.975 -4.269 1.00 0.00 H new ATOM 1392 N ALA A 93 -4.819 -3.392 -6.997 1.00 0.00 N ATOM 1393 CA ALA A 93 -4.808 -3.555 -8.473 1.00 0.00 C ATOM 1394 C ALA A 93 -4.010 -2.433 -9.204 1.00 0.00 C ATOM 1395 O ALA A 93 -4.294 -1.241 -9.045 1.00 0.00 O ATOM 1396 CB ALA A 93 -6.282 -3.572 -8.924 1.00 0.00 C ATOM 0 H ALA A 93 -5.096 -2.458 -6.695 1.00 0.00 H new ATOM 0 HA ALA A 93 -4.297 -4.481 -8.736 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -6.330 -3.690 -10.007 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -6.800 -4.403 -8.445 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -6.760 -2.635 -8.640 1.00 0.00 H new ATOM 1402 N LEU A 94 -3.044 -2.820 -10.056 1.00 0.00 N ATOM 1403 CA LEU A 94 -2.330 -1.878 -10.962 1.00 0.00 C ATOM 1404 C LEU A 94 -3.024 -1.828 -12.362 1.00 0.00 C ATOM 1405 O LEU A 94 -2.915 -2.769 -13.153 1.00 0.00 O ATOM 1406 CB LEU A 94 -0.849 -2.346 -11.026 1.00 0.00 C ATOM 1407 CG LEU A 94 0.105 -1.542 -11.947 1.00 0.00 C ATOM 1408 CD1 LEU A 94 0.387 -0.137 -11.393 1.00 0.00 C ATOM 1409 CD2 LEU A 94 1.425 -2.303 -12.145 1.00 0.00 C ATOM 0 H LEU A 94 -2.731 -3.787 -10.142 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.363 -0.854 -10.589 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.443 -2.323 -10.015 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -0.836 -3.386 -11.351 1.00 0.00 H new ATOM 0 HG LEU A 94 -0.393 -1.426 -12.909 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.059 0.392 -12.068 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.549 0.415 -11.307 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.851 -0.220 -10.410 1.00 0.00 H new ATOM 0 HD21 LEU A 94 2.084 -1.726 -12.794 1.00 0.00 H new ATOM 0 HD22 LEU A 94 1.907 -2.453 -11.179 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.222 -3.271 -12.603 1.00 0.00 H new ATOM 1421 N VAL A 95 -3.695 -0.710 -12.676 1.00 0.00 N ATOM 1422 CA VAL A 95 -4.350 -0.477 -13.998 1.00 0.00 C ATOM 1423 C VAL A 95 -3.317 0.216 -14.952 1.00 0.00 C ATOM 1424 O VAL A 95 -2.988 1.400 -14.807 1.00 0.00 O ATOM 1425 CB VAL A 95 -5.685 0.330 -13.822 1.00 0.00 C ATOM 1426 CG1 VAL A 95 -6.393 0.646 -15.163 1.00 0.00 C ATOM 1427 CG2 VAL A 95 -6.731 -0.385 -12.930 1.00 0.00 C ATOM 0 H VAL A 95 -3.806 0.069 -12.027 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.642 -1.422 -14.457 1.00 0.00 H new ATOM 0 HB VAL A 95 -5.349 1.250 -13.343 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -7.308 1.205 -14.968 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -5.731 1.241 -15.792 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -6.638 -0.285 -15.673 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -7.627 0.232 -12.854 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -6.989 -1.347 -13.372 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -6.314 -0.543 -11.935 1.00 0.00 H new ATOM 1437 N GLN A 96 -2.827 -0.547 -15.937 1.00 0.00 N ATOM 1438 CA GLN A 96 -1.825 -0.086 -16.934 1.00 0.00 C ATOM 1439 C GLN A 96 -2.545 0.258 -18.277 1.00 0.00 C ATOM 1440 O GLN A 96 -2.873 -0.632 -19.067 1.00 0.00 O ATOM 1441 CB GLN A 96 -0.798 -1.247 -16.995 1.00 0.00 C ATOM 1442 CG GLN A 96 0.368 -1.075 -17.995 1.00 0.00 C ATOM 1443 CD GLN A 96 1.484 -2.098 -17.779 1.00 0.00 C ATOM 1444 OE1 GLN A 96 1.464 -3.220 -18.275 1.00 0.00 O ATOM 1445 NE2 GLN A 96 2.477 -1.755 -16.995 1.00 0.00 N ATOM 0 H GLN A 96 -3.113 -1.516 -16.075 1.00 0.00 H new ATOM 0 HA GLN A 96 -1.304 0.838 -16.682 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -0.377 -1.385 -15.999 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -1.332 -2.164 -17.246 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -0.014 -1.168 -19.012 1.00 0.00 H new ATOM 0 HG3 GLN A 96 0.778 -0.070 -17.900 1.00 0.00 H new ATOM 0 HE21 GLN A 96 2.500 -0.824 -16.579 1.00 0.00 H new ATOM 0 HE22 GLN A 96 3.226 -2.419 -16.801 1.00 0.00 H new ATOM 1454 N HIS A 97 -2.822 1.554 -18.505 1.00 0.00 N ATOM 1455 CA HIS A 97 -3.670 2.030 -19.638 1.00 0.00 C ATOM 1456 C HIS A 97 -2.775 2.556 -20.808 1.00 0.00 C ATOM 1457 O HIS A 97 -2.221 3.657 -20.735 1.00 0.00 O ATOM 1458 CB HIS A 97 -4.590 3.112 -19.010 1.00 0.00 C ATOM 1459 CG HIS A 97 -5.673 3.701 -19.908 1.00 0.00 C ATOM 1460 ND1 HIS A 97 -5.602 4.913 -20.568 1.00 0.00 N ATOM 1461 CD2 HIS A 97 -6.891 3.078 -20.204 1.00 0.00 C ATOM 1462 CE1 HIS A 97 -6.778 4.889 -21.273 1.00 0.00 C ATOM 1463 NE2 HIS A 97 -7.638 3.847 -21.082 1.00 0.00 N ATOM 0 H HIS A 97 -2.470 2.309 -17.916 1.00 0.00 H new ATOM 0 HA HIS A 97 -4.272 1.245 -20.095 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -5.073 2.680 -18.134 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -3.961 3.929 -18.656 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -7.206 2.126 -19.802 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -7.019 5.681 -21.967 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -8.565 3.681 -21.473 1.00 0.00 H new ATOM 1472 N GLN A 98 -2.634 1.747 -21.866 1.00 0.00 N ATOM 1473 CA GLN A 98 -1.575 1.914 -22.908 1.00 0.00 C ATOM 1474 C GLN A 98 -2.144 2.610 -24.186 1.00 0.00 C ATOM 1475 O GLN A 98 -2.875 1.975 -24.951 1.00 0.00 O ATOM 1476 CB GLN A 98 -0.999 0.512 -23.277 1.00 0.00 C ATOM 1477 CG GLN A 98 -0.460 -0.389 -22.135 1.00 0.00 C ATOM 1478 CD GLN A 98 -0.106 -1.810 -22.577 1.00 0.00 C ATOM 1479 OE1 GLN A 98 -0.972 -2.637 -22.859 1.00 0.00 O ATOM 1480 NE2 GLN A 98 1.156 -2.155 -22.647 1.00 0.00 N ATOM 0 H GLN A 98 -3.247 0.950 -22.037 1.00 0.00 H new ATOM 0 HA GLN A 98 -0.785 2.549 -22.506 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -1.781 -0.042 -23.796 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -0.189 0.663 -23.991 1.00 0.00 H new ATOM 0 HG2 GLN A 98 0.426 0.078 -21.705 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -1.208 -0.441 -21.344 1.00 0.00 H new ATOM 0 HE21 GLN A 98 1.883 -1.478 -22.416 1.00 0.00 H new ATOM 0 HE22 GLN A 98 1.411 -3.100 -22.933 1.00 0.00 H new ATOM 1489 N GLU A 99 -1.827 3.894 -24.431 1.00 0.00 N ATOM 1490 CA GLU A 99 -2.547 4.714 -25.458 1.00 0.00 C ATOM 1491 C GLU A 99 -1.694 5.005 -26.734 1.00 0.00 C ATOM 1492 O GLU A 99 -0.587 5.547 -26.657 1.00 0.00 O ATOM 1493 CB GLU A 99 -3.000 6.032 -24.776 1.00 0.00 C ATOM 1494 CG GLU A 99 -4.160 5.861 -23.760 1.00 0.00 C ATOM 1495 CD GLU A 99 -4.231 6.967 -22.732 1.00 0.00 C ATOM 1496 OE1 GLU A 99 -4.625 8.101 -23.056 1.00 0.00 O ATOM 1497 OE2 GLU A 99 -3.876 6.717 -21.558 1.00 0.00 O ATOM 0 H GLU A 99 -1.085 4.395 -23.943 1.00 0.00 H new ATOM 0 HA GLU A 99 -3.404 4.144 -25.817 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -2.146 6.474 -24.263 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -3.309 6.738 -25.547 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -5.104 5.820 -24.303 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -4.045 4.906 -23.247 1.00 0.00 H new ATOM 1504 N TRP A 100 -2.228 4.676 -27.924 1.00 0.00 N ATOM 1505 CA TRP A 100 -1.551 4.936 -29.231 1.00 0.00 C ATOM 1506 C TRP A 100 -2.601 5.052 -30.380 1.00 0.00 C ATOM 1507 O TRP A 100 -3.518 4.233 -30.439 1.00 0.00 O ATOM 1508 CB TRP A 100 -0.462 3.852 -29.533 1.00 0.00 C ATOM 1509 CG TRP A 100 -0.918 2.500 -30.125 1.00 0.00 C ATOM 1510 CD1 TRP A 100 -0.772 2.126 -31.478 1.00 0.00 C ATOM 1511 CD2 TRP A 100 -1.635 1.473 -29.535 1.00 0.00 C ATOM 1512 NE1 TRP A 100 -1.402 0.900 -31.757 1.00 0.00 N ATOM 1513 CE2 TRP A 100 -1.928 0.511 -30.535 1.00 0.00 C ATOM 1514 CE3 TRP A 100 -2.054 1.263 -28.198 1.00 0.00 C ATOM 1515 CZ2 TRP A 100 -2.608 -0.682 -30.196 1.00 0.00 C ATOM 1516 CZ3 TRP A 100 -2.729 0.085 -27.889 1.00 0.00 C ATOM 1517 CH2 TRP A 100 -3.000 -0.876 -28.870 1.00 0.00 C ATOM 0 H TRP A 100 -3.137 4.224 -28.019 1.00 0.00 H new ATOM 0 HA TRP A 100 -1.032 5.892 -29.165 1.00 0.00 H new ATOM 0 HB2 TRP A 100 0.260 4.290 -30.222 1.00 0.00 H new ATOM 0 HB3 TRP A 100 0.068 3.646 -28.603 1.00 0.00 H new ATOM 0 HD1 TRP A 100 -0.239 2.712 -32.212 1.00 0.00 H new ATOM 0 HE1 TRP A 100 -1.459 0.411 -32.650 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -1.854 2.001 -27.435 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -2.820 -1.428 -30.948 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 -3.050 -0.091 -26.873 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -3.521 -1.782 -28.597 1.00 0.00 H new ATOM 1528 N ASP A 101 -2.430 5.972 -31.354 1.00 0.00 N ATOM 1529 CA ASP A 101 -3.099 5.870 -32.702 1.00 0.00 C ATOM 1530 C ASP A 101 -4.667 5.631 -32.721 1.00 0.00 C ATOM 1531 O ASP A 101 -5.186 4.758 -33.424 1.00 0.00 O ATOM 1532 CB ASP A 101 -2.230 4.851 -33.505 1.00 0.00 C ATOM 1533 CG ASP A 101 -2.481 4.737 -35.000 1.00 0.00 C ATOM 1534 OD1 ASP A 101 -2.434 5.763 -35.707 1.00 0.00 O ATOM 1535 OD2 ASP A 101 -2.712 3.603 -35.474 1.00 0.00 O ATOM 0 H ASP A 101 -1.840 6.797 -31.248 1.00 0.00 H new ATOM 0 HA ASP A 101 -3.114 6.845 -33.189 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -1.182 5.115 -33.359 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -2.375 3.865 -33.064 1.00 0.00 H new ATOM 1540 N GLY A 102 -5.418 6.381 -31.887 1.00 0.00 N ATOM 1541 CA GLY A 102 -6.858 6.085 -31.605 1.00 0.00 C ATOM 1542 C GLY A 102 -7.258 4.783 -30.846 1.00 0.00 C ATOM 1543 O GLY A 102 -8.409 4.360 -30.955 1.00 0.00 O ATOM 0 H GLY A 102 -5.060 7.198 -31.392 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -7.255 6.926 -31.036 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -7.379 6.074 -32.562 1.00 0.00 H new ATOM 1547 N LYS A 103 -6.335 4.147 -30.108 1.00 0.00 N ATOM 1548 CA LYS A 103 -6.503 2.774 -29.549 1.00 0.00 C ATOM 1549 C LYS A 103 -5.986 2.718 -28.073 1.00 0.00 C ATOM 1550 O LYS A 103 -5.024 3.408 -27.704 1.00 0.00 O ATOM 1551 CB LYS A 103 -5.673 1.768 -30.408 1.00 0.00 C ATOM 1552 CG LYS A 103 -6.072 1.615 -31.900 1.00 0.00 C ATOM 1553 CD LYS A 103 -4.852 1.421 -32.825 1.00 0.00 C ATOM 1554 CE LYS A 103 -5.249 1.468 -34.310 1.00 0.00 C ATOM 1555 NZ LYS A 103 -4.044 1.417 -35.178 1.00 0.00 N ATOM 0 H LYS A 103 -5.436 4.567 -29.873 1.00 0.00 H new ATOM 0 HA LYS A 103 -7.561 2.513 -29.569 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -4.627 2.071 -30.367 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -5.739 0.787 -29.938 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -6.743 0.763 -32.007 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -6.626 2.499 -32.216 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -4.114 2.197 -32.621 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -4.378 0.464 -32.605 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -5.906 0.630 -34.542 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -5.811 2.380 -34.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -4.334 1.450 -36.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -3.431 2.230 -34.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -3.523 0.535 -34.997 1.00 0.00 H new ATOM 1569 N GLU A 104 -6.585 1.835 -27.252 1.00 0.00 N ATOM 1570 CA GLU A 104 -6.078 1.537 -25.880 1.00 0.00 C ATOM 1571 C GLU A 104 -5.799 0.016 -25.667 1.00 0.00 C ATOM 1572 O GLU A 104 -6.507 -0.843 -26.193 1.00 0.00 O ATOM 1573 CB GLU A 104 -6.988 2.132 -24.769 1.00 0.00 C ATOM 1574 CG GLU A 104 -8.381 1.480 -24.540 1.00 0.00 C ATOM 1575 CD GLU A 104 -8.972 1.789 -23.176 1.00 0.00 C ATOM 1576 OE1 GLU A 104 -9.354 2.951 -22.920 1.00 0.00 O ATOM 1577 OE2 GLU A 104 -8.962 0.894 -22.304 1.00 0.00 O ATOM 0 H GLU A 104 -7.422 1.310 -27.506 1.00 0.00 H new ATOM 0 HA GLU A 104 -5.116 2.042 -25.792 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -6.439 2.087 -23.828 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -7.146 3.186 -24.996 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -9.068 1.826 -25.313 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -8.292 0.400 -24.653 1.00 0.00 H new ATOM 1584 N SER A 105 -4.791 -0.300 -24.842 1.00 0.00 N ATOM 1585 CA SER A 105 -4.585 -1.660 -24.272 1.00 0.00 C ATOM 1586 C SER A 105 -4.483 -1.530 -22.723 1.00 0.00 C ATOM 1587 O SER A 105 -3.588 -0.877 -22.187 1.00 0.00 O ATOM 1588 CB SER A 105 -3.376 -2.339 -24.951 1.00 0.00 C ATOM 1589 OG SER A 105 -2.938 -3.489 -24.226 1.00 0.00 O ATOM 0 H SER A 105 -4.087 0.375 -24.544 1.00 0.00 H new ATOM 0 HA SER A 105 -5.428 -2.321 -24.476 1.00 0.00 H new ATOM 0 HB2 SER A 105 -3.645 -2.630 -25.966 1.00 0.00 H new ATOM 0 HB3 SER A 105 -2.556 -1.625 -25.031 1.00 0.00 H new ATOM 0 HG SER A 105 -2.021 -3.348 -23.911 1.00 0.00 H new ATOM 1595 N THR A 106 -5.439 -2.114 -21.997 1.00 0.00 N ATOM 1596 CA THR A 106 -5.717 -1.744 -20.582 1.00 0.00 C ATOM 1597 C THR A 106 -5.606 -3.019 -19.702 1.00 0.00 C ATOM 1598 O THR A 106 -6.381 -3.970 -19.849 1.00 0.00 O ATOM 1599 CB THR A 106 -7.075 -0.993 -20.538 1.00 0.00 C ATOM 1600 OG1 THR A 106 -6.947 0.216 -21.282 1.00 0.00 O ATOM 1601 CG2 THR A 106 -7.554 -0.599 -19.134 1.00 0.00 C ATOM 0 H THR A 106 -6.045 -2.852 -22.357 1.00 0.00 H new ATOM 0 HA THR A 106 -4.988 -1.051 -20.162 1.00 0.00 H new ATOM 0 HB THR A 106 -7.807 -1.690 -20.947 1.00 0.00 H new ATOM 0 HG1 THR A 106 -7.823 0.648 -21.357 1.00 0.00 H new ATOM 0 HG21 THR A 106 -8.510 -0.080 -19.208 1.00 0.00 H new ATOM 0 HG22 THR A 106 -7.674 -1.495 -18.526 1.00 0.00 H new ATOM 0 HG23 THR A 106 -6.819 0.059 -18.670 1.00 0.00 H new ATOM 1609 N ILE A 107 -4.591 -3.050 -18.821 1.00 0.00 N ATOM 1610 CA ILE A 107 -4.144 -4.312 -18.161 1.00 0.00 C ATOM 1611 C ILE A 107 -4.253 -4.117 -16.617 1.00 0.00 C ATOM 1612 O ILE A 107 -3.493 -3.343 -16.027 1.00 0.00 O ATOM 1613 CB ILE A 107 -2.724 -4.768 -18.662 1.00 0.00 C ATOM 1614 CG1 ILE A 107 -2.613 -4.824 -20.218 1.00 0.00 C ATOM 1615 CG2 ILE A 107 -2.339 -6.135 -18.037 1.00 0.00 C ATOM 1616 CD1 ILE A 107 -1.259 -5.239 -20.800 1.00 0.00 C ATOM 0 H ILE A 107 -4.060 -2.225 -18.543 1.00 0.00 H new ATOM 0 HA ILE A 107 -4.794 -5.141 -18.440 1.00 0.00 H new ATOM 0 HB ILE A 107 -2.017 -4.008 -18.328 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -3.368 -5.518 -20.588 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -2.864 -3.839 -20.612 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -1.354 -6.434 -18.395 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -2.319 -6.046 -16.951 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -3.074 -6.887 -18.325 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -1.315 -5.238 -21.889 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -0.492 -4.535 -20.476 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -1.004 -6.240 -20.451 1.00 0.00 H new ATOM 1628 N THR A 108 -5.181 -4.839 -15.966 1.00 0.00 N ATOM 1629 CA THR A 108 -5.366 -4.778 -14.486 1.00 0.00 C ATOM 1630 C THR A 108 -4.568 -5.938 -13.808 1.00 0.00 C ATOM 1631 O THR A 108 -5.004 -7.094 -13.798 1.00 0.00 O ATOM 1632 CB THR A 108 -6.889 -4.767 -14.161 1.00 0.00 C ATOM 1633 OG1 THR A 108 -7.527 -3.687 -14.839 1.00 0.00 O ATOM 1634 CG2 THR A 108 -7.217 -4.575 -12.674 1.00 0.00 C ATOM 0 H THR A 108 -5.823 -5.478 -16.435 1.00 0.00 H new ATOM 0 HA THR A 108 -4.958 -3.856 -14.072 1.00 0.00 H new ATOM 0 HB THR A 108 -7.244 -5.747 -14.480 1.00 0.00 H new ATOM 0 HG1 THR A 108 -8.484 -3.689 -14.630 1.00 0.00 H new ATOM 0 HG21 THR A 108 -8.298 -4.580 -12.536 1.00 0.00 H new ATOM 0 HG22 THR A 108 -6.774 -5.386 -12.096 1.00 0.00 H new ATOM 0 HG23 THR A 108 -6.812 -3.623 -12.332 1.00 0.00 H new ATOM 1642 N ARG A 109 -3.389 -5.620 -13.243 1.00 0.00 N ATOM 1643 CA ARG A 109 -2.527 -6.608 -12.531 1.00 0.00 C ATOM 1644 C ARG A 109 -2.865 -6.583 -11.008 1.00 0.00 C ATOM 1645 O ARG A 109 -2.442 -5.663 -10.298 1.00 0.00 O ATOM 1646 CB ARG A 109 -1.021 -6.297 -12.790 1.00 0.00 C ATOM 1647 CG ARG A 109 -0.560 -6.283 -14.272 1.00 0.00 C ATOM 1648 CD ARG A 109 0.965 -6.268 -14.500 1.00 0.00 C ATOM 1649 NE ARG A 109 1.548 -7.637 -14.364 1.00 0.00 N ATOM 1650 CZ ARG A 109 2.699 -8.045 -14.901 1.00 0.00 C ATOM 1651 NH1 ARG A 109 3.507 -7.257 -15.566 1.00 0.00 N ATOM 1652 NH2 ARG A 109 3.042 -9.292 -14.760 1.00 0.00 N ATOM 0 H ARG A 109 -3.000 -4.677 -13.261 1.00 0.00 H new ATOM 0 HA ARG A 109 -2.723 -7.611 -12.911 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -0.794 -5.325 -12.353 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -0.424 -7.035 -12.254 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -0.974 -7.160 -14.770 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -0.990 -5.407 -14.758 1.00 0.00 H new ATOM 0 HD2 ARG A 109 1.182 -5.875 -15.493 1.00 0.00 H new ATOM 0 HD3 ARG A 109 1.436 -5.597 -13.781 1.00 0.00 H new ATOM 0 HE ARG A 109 1.022 -8.316 -13.815 1.00 0.00 H new ATOM 0 HH11 ARG A 109 3.268 -6.274 -15.696 1.00 0.00 H new ATOM 0 HH12 ARG A 109 4.375 -7.627 -15.954 1.00 0.00 H new ATOM 0 HH21 ARG A 109 2.436 -9.933 -14.248 1.00 0.00 H new ATOM 0 HH22 ARG A 109 3.917 -9.629 -15.161 1.00 0.00 H new ATOM 1666 N LYS A 110 -3.652 -7.558 -10.511 1.00 0.00 N ATOM 1667 CA LYS A 110 -4.226 -7.500 -9.136 1.00 0.00 C ATOM 1668 C LYS A 110 -3.914 -8.764 -8.283 1.00 0.00 C ATOM 1669 O LYS A 110 -3.961 -9.894 -8.780 1.00 0.00 O ATOM 1670 CB LYS A 110 -5.737 -7.144 -9.241 1.00 0.00 C ATOM 1671 CG LYS A 110 -6.728 -8.262 -9.653 1.00 0.00 C ATOM 1672 CD LYS A 110 -8.101 -7.699 -10.089 1.00 0.00 C ATOM 1673 CE LYS A 110 -9.276 -8.687 -9.953 1.00 0.00 C ATOM 1674 NZ LYS A 110 -9.849 -8.635 -8.581 1.00 0.00 N ATOM 0 H LYS A 110 -3.909 -8.396 -11.033 1.00 0.00 H new ATOM 0 HA LYS A 110 -3.734 -6.707 -8.573 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -6.056 -6.757 -8.273 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -5.838 -6.329 -9.958 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -6.299 -8.841 -10.471 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -6.868 -8.947 -8.817 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -8.320 -6.812 -9.495 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -8.033 -7.378 -11.128 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -10.047 -8.446 -10.684 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -8.935 -9.699 -10.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -10.639 -9.307 -8.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -9.115 -8.888 -7.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -10.194 -7.674 -8.385 1.00 0.00 H new ATOM 1688 N LEU A 111 -3.616 -8.582 -6.983 1.00 0.00 N ATOM 1689 CA LEU A 111 -3.323 -9.720 -6.066 1.00 0.00 C ATOM 1690 C LEU A 111 -4.628 -10.479 -5.674 1.00 0.00 C ATOM 1691 O LEU A 111 -5.539 -9.911 -5.062 1.00 0.00 O ATOM 1692 CB LEU A 111 -2.521 -9.233 -4.817 1.00 0.00 C ATOM 1693 CG LEU A 111 -1.263 -10.051 -4.422 1.00 0.00 C ATOM 1694 CD1 LEU A 111 -1.535 -11.530 -4.091 1.00 0.00 C ATOM 1695 CD2 LEU A 111 -0.156 -9.959 -5.476 1.00 0.00 C ATOM 0 H LEU A 111 -3.570 -7.666 -6.537 1.00 0.00 H new ATOM 0 HA LEU A 111 -2.692 -10.434 -6.595 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -2.213 -8.203 -4.994 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -3.199 -9.221 -3.963 1.00 0.00 H new ATOM 0 HG LEU A 111 -0.928 -9.578 -3.499 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.599 -12.022 -3.827 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -2.228 -11.594 -3.252 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -1.971 -12.023 -4.960 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.703 -10.548 -5.154 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -0.525 -10.345 -6.426 1.00 0.00 H new ATOM 0 HD23 LEU A 111 0.143 -8.918 -5.599 1.00 0.00 H new ATOM 1707 N LYS A 112 -4.719 -11.755 -6.070 1.00 0.00 N ATOM 1708 CA LYS A 112 -5.917 -12.592 -5.831 1.00 0.00 C ATOM 1709 C LYS A 112 -5.654 -13.577 -4.653 1.00 0.00 C ATOM 1710 O LYS A 112 -5.278 -13.156 -3.553 1.00 0.00 O ATOM 1711 CB LYS A 112 -6.342 -13.114 -7.231 1.00 0.00 C ATOM 1712 CG LYS A 112 -7.742 -13.758 -7.290 1.00 0.00 C ATOM 1713 CD LYS A 112 -8.940 -12.793 -7.205 1.00 0.00 C ATOM 1714 CE LYS A 112 -10.309 -13.512 -7.187 1.00 0.00 C ATOM 1715 NZ LYS A 112 -10.512 -14.324 -5.944 1.00 0.00 N ATOM 0 H LYS A 112 -3.971 -12.241 -6.564 1.00 0.00 H new ATOM 0 HA LYS A 112 -6.802 -12.085 -5.446 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -6.311 -12.284 -7.936 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -5.608 -13.846 -7.567 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -7.821 -14.321 -8.220 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -7.823 -14.477 -6.475 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -8.845 -12.186 -6.304 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -8.908 -12.110 -8.054 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -11.106 -12.773 -7.269 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -10.387 -14.162 -8.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -11.526 -14.518 -5.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -9.995 -15.223 -6.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -10.156 -13.796 -5.122 1.00 0.00 H new ATOM 1729 N ASP A 113 -5.870 -14.880 -4.858 1.00 0.00 N ATOM 1730 CA ASP A 113 -5.961 -15.869 -3.747 1.00 0.00 C ATOM 1731 C ASP A 113 -4.543 -16.481 -3.473 1.00 0.00 C ATOM 1732 O ASP A 113 -4.272 -17.657 -3.733 1.00 0.00 O ATOM 1733 CB ASP A 113 -7.090 -16.886 -4.105 1.00 0.00 C ATOM 1734 CG ASP A 113 -8.479 -16.298 -4.423 1.00 0.00 C ATOM 1735 OD1 ASP A 113 -9.059 -15.580 -3.584 1.00 0.00 O ATOM 1736 OD2 ASP A 113 -8.967 -16.465 -5.563 1.00 0.00 O ATOM 0 H ASP A 113 -5.988 -15.289 -5.785 1.00 0.00 H new ATOM 0 HA ASP A 113 -6.248 -15.420 -2.796 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -6.762 -17.468 -4.966 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -7.198 -17.581 -3.272 1.00 0.00 H new ATOM 1741 N GLY A 114 -3.608 -15.620 -3.017 1.00 0.00 N ATOM 1742 CA GLY A 114 -2.148 -15.924 -3.058 1.00 0.00 C ATOM 1743 C GLY A 114 -1.332 -15.542 -4.327 1.00 0.00 C ATOM 1744 O GLY A 114 -0.110 -15.424 -4.222 1.00 0.00 O ATOM 0 H GLY A 114 -3.830 -14.709 -2.616 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -1.684 -15.426 -2.207 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -2.031 -16.996 -2.902 1.00 0.00 H new ATOM 1748 N LYS A 115 -1.954 -15.410 -5.516 1.00 0.00 N ATOM 1749 CA LYS A 115 -1.230 -15.222 -6.812 1.00 0.00 C ATOM 1750 C LYS A 115 -1.790 -14.013 -7.636 1.00 0.00 C ATOM 1751 O LYS A 115 -2.894 -13.512 -7.400 1.00 0.00 O ATOM 1752 CB LYS A 115 -1.220 -16.573 -7.600 1.00 0.00 C ATOM 1753 CG LYS A 115 -0.293 -17.646 -6.973 1.00 0.00 C ATOM 1754 CD LYS A 115 -0.174 -18.969 -7.754 1.00 0.00 C ATOM 1755 CE LYS A 115 0.844 -19.922 -7.084 1.00 0.00 C ATOM 1756 NZ LYS A 115 1.021 -21.149 -7.908 1.00 0.00 N ATOM 0 H LYS A 115 -2.969 -15.429 -5.616 1.00 0.00 H new ATOM 0 HA LYS A 115 -0.194 -14.952 -6.609 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.236 -16.965 -7.648 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -0.903 -16.384 -8.626 1.00 0.00 H new ATOM 0 HG2 LYS A 115 0.704 -17.219 -6.865 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -0.655 -17.870 -5.969 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -1.149 -19.453 -7.807 1.00 0.00 H new ATOM 0 HD3 LYS A 115 0.136 -18.763 -8.779 1.00 0.00 H new ATOM 0 HE2 LYS A 115 1.802 -19.416 -6.963 1.00 0.00 H new ATOM 0 HE3 LYS A 115 0.498 -20.192 -6.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 1.707 -21.781 -7.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 0.108 -21.639 -8.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 1.372 -20.886 -8.851 1.00 0.00 H new ATOM 1770 N LEU A 116 -0.997 -13.510 -8.600 1.00 0.00 N ATOM 1771 CA LEU A 116 -1.334 -12.282 -9.373 1.00 0.00 C ATOM 1772 C LEU A 116 -2.257 -12.610 -10.591 1.00 0.00 C ATOM 1773 O LEU A 116 -1.861 -13.308 -11.530 1.00 0.00 O ATOM 1774 CB LEU A 116 0.014 -11.622 -9.779 1.00 0.00 C ATOM 1775 CG LEU A 116 -0.046 -10.245 -10.492 1.00 0.00 C ATOM 1776 CD1 LEU A 116 -0.297 -9.106 -9.491 1.00 0.00 C ATOM 1777 CD2 LEU A 116 1.271 -9.967 -11.235 1.00 0.00 C ATOM 0 H LEU A 116 -0.109 -13.934 -8.870 1.00 0.00 H new ATOM 0 HA LEU A 116 -1.913 -11.580 -8.773 1.00 0.00 H new ATOM 0 HB2 LEU A 116 0.617 -11.508 -8.878 1.00 0.00 H new ATOM 0 HB3 LEU A 116 0.544 -12.315 -10.432 1.00 0.00 H new ATOM 0 HG LEU A 116 -0.873 -10.284 -11.201 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -0.333 -8.155 -10.023 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -1.246 -9.273 -8.981 1.00 0.00 H new ATOM 0 HD13 LEU A 116 0.510 -9.081 -8.758 1.00 0.00 H new ATOM 0 HD21 LEU A 116 1.212 -8.997 -11.730 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.096 -9.962 -10.523 1.00 0.00 H new ATOM 0 HD23 LEU A 116 1.440 -10.745 -11.980 1.00 0.00 H new ATOM 1789 N VAL A 117 -3.487 -12.076 -10.575 1.00 0.00 N ATOM 1790 CA VAL A 117 -4.443 -12.182 -11.715 1.00 0.00 C ATOM 1791 C VAL A 117 -4.253 -10.934 -12.638 1.00 0.00 C ATOM 1792 O VAL A 117 -4.422 -9.785 -12.218 1.00 0.00 O ATOM 1793 CB VAL A 117 -5.897 -12.400 -11.165 1.00 0.00 C ATOM 1794 CG1 VAL A 117 -7.019 -12.160 -12.196 1.00 0.00 C ATOM 1795 CG2 VAL A 117 -6.089 -13.848 -10.662 1.00 0.00 C ATOM 0 H VAL A 117 -3.858 -11.557 -9.779 1.00 0.00 H new ATOM 0 HA VAL A 117 -4.248 -13.053 -12.341 1.00 0.00 H new ATOM 0 HB VAL A 117 -5.983 -11.661 -10.368 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -7.987 -12.334 -11.727 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.969 -11.132 -12.555 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -6.894 -12.844 -13.035 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -7.105 -13.971 -10.287 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -5.919 -14.544 -11.483 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -5.379 -14.052 -9.861 1.00 0.00 H new ATOM 1805 N VAL A 118 -3.900 -11.193 -13.905 1.00 0.00 N ATOM 1806 CA VAL A 118 -3.613 -10.136 -14.914 1.00 0.00 C ATOM 1807 C VAL A 118 -4.769 -10.158 -15.965 1.00 0.00 C ATOM 1808 O VAL A 118 -4.795 -10.987 -16.884 1.00 0.00 O ATOM 1809 CB VAL A 118 -2.166 -10.348 -15.480 1.00 0.00 C ATOM 1810 CG1 VAL A 118 -1.821 -9.448 -16.686 1.00 0.00 C ATOM 1811 CG2 VAL A 118 -1.075 -10.131 -14.404 1.00 0.00 C ATOM 0 H VAL A 118 -3.802 -12.140 -14.270 1.00 0.00 H new ATOM 0 HA VAL A 118 -3.601 -9.129 -14.497 1.00 0.00 H new ATOM 0 HB VAL A 118 -2.173 -11.386 -15.813 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.804 -9.657 -17.017 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -2.516 -9.650 -17.501 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -1.900 -8.401 -16.393 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -0.091 -10.290 -14.846 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -1.140 -9.113 -14.020 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -1.224 -10.837 -13.587 1.00 0.00 H new ATOM 1821 N GLU A 119 -5.714 -9.219 -15.805 1.00 0.00 N ATOM 1822 CA GLU A 119 -6.913 -9.091 -16.674 1.00 0.00 C ATOM 1823 C GLU A 119 -6.624 -8.033 -17.785 1.00 0.00 C ATOM 1824 O GLU A 119 -6.617 -6.823 -17.524 1.00 0.00 O ATOM 1825 CB GLU A 119 -8.112 -8.697 -15.763 1.00 0.00 C ATOM 1826 CG GLU A 119 -8.588 -9.787 -14.761 1.00 0.00 C ATOM 1827 CD GLU A 119 -9.308 -9.337 -13.489 1.00 0.00 C ATOM 1828 OE1 GLU A 119 -9.488 -8.125 -13.241 1.00 0.00 O ATOM 1829 OE2 GLU A 119 -9.663 -10.226 -12.686 1.00 0.00 O ATOM 0 H GLU A 119 -5.675 -8.518 -15.065 1.00 0.00 H new ATOM 0 HA GLU A 119 -7.158 -10.025 -17.181 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -7.837 -7.806 -15.198 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -8.953 -8.424 -16.400 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -9.253 -10.464 -15.297 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -7.715 -10.367 -14.462 1.00 0.00 H new ATOM 1836 N CYS A 120 -6.337 -8.492 -19.016 1.00 0.00 N ATOM 1837 CA CYS A 120 -6.034 -7.590 -20.161 1.00 0.00 C ATOM 1838 C CYS A 120 -7.255 -7.355 -21.099 1.00 0.00 C ATOM 1839 O CYS A 120 -8.095 -8.242 -21.282 1.00 0.00 O ATOM 1840 CB CYS A 120 -4.820 -8.163 -20.926 1.00 0.00 C ATOM 1841 SG CYS A 120 -5.340 -9.314 -22.204 1.00 0.00 S ATOM 0 H CYS A 120 -6.306 -9.484 -19.252 1.00 0.00 H new ATOM 0 HA CYS A 120 -5.793 -6.602 -19.768 1.00 0.00 H new ATOM 0 HB2 CYS A 120 -4.253 -7.348 -21.376 1.00 0.00 H new ATOM 0 HB3 CYS A 120 -4.153 -8.668 -20.228 1.00 0.00 H new ATOM 0 HG CYS A 120 -4.606 -10.386 -22.148 1.00 0.00 H new ATOM 1846 N VAL A 121 -7.302 -6.182 -21.747 1.00 0.00 N ATOM 1847 CA VAL A 121 -8.318 -5.867 -22.800 1.00 0.00 C ATOM 1848 C VAL A 121 -7.719 -4.846 -23.817 1.00 0.00 C ATOM 1849 O VAL A 121 -7.097 -3.862 -23.404 1.00 0.00 O ATOM 1850 CB VAL A 121 -9.686 -5.403 -22.179 1.00 0.00 C ATOM 1851 CG1 VAL A 121 -9.673 -4.040 -21.448 1.00 0.00 C ATOM 1852 CG2 VAL A 121 -10.834 -5.395 -23.215 1.00 0.00 C ATOM 0 H VAL A 121 -6.648 -5.420 -21.568 1.00 0.00 H new ATOM 0 HA VAL A 121 -8.555 -6.777 -23.350 1.00 0.00 H new ATOM 0 HB VAL A 121 -9.861 -6.163 -21.418 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -10.669 -3.825 -21.062 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -8.964 -4.077 -20.621 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -9.377 -3.256 -22.145 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -11.756 -5.067 -22.734 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -10.586 -4.712 -24.028 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -10.971 -6.400 -23.614 1.00 0.00 H new ATOM 1862 N MET A 122 -7.938 -5.034 -25.133 1.00 0.00 N ATOM 1863 CA MET A 122 -7.715 -3.937 -26.123 1.00 0.00 C ATOM 1864 C MET A 122 -9.056 -3.224 -26.484 1.00 0.00 C ATOM 1865 O MET A 122 -9.300 -2.108 -26.014 1.00 0.00 O ATOM 1866 CB MET A 122 -6.813 -4.396 -27.304 1.00 0.00 C ATOM 1867 CG MET A 122 -6.386 -3.228 -28.219 1.00 0.00 C ATOM 1868 SD MET A 122 -5.792 -3.813 -29.808 1.00 0.00 S ATOM 1869 CE MET A 122 -6.018 -2.301 -30.761 1.00 0.00 C ATOM 0 H MET A 122 -8.262 -5.912 -25.539 1.00 0.00 H new ATOM 0 HA MET A 122 -7.122 -3.144 -25.668 1.00 0.00 H new ATOM 0 HB2 MET A 122 -5.923 -4.885 -26.907 1.00 0.00 H new ATOM 0 HB3 MET A 122 -7.347 -5.139 -27.896 1.00 0.00 H new ATOM 0 HG2 MET A 122 -7.231 -2.557 -28.371 1.00 0.00 H new ATOM 0 HG3 MET A 122 -5.604 -2.649 -27.729 1.00 0.00 H new ATOM 0 HE1 MET A 122 -5.650 -2.452 -31.776 1.00 0.00 H new ATOM 0 HE2 MET A 122 -7.077 -2.046 -30.793 1.00 0.00 H new ATOM 0 HE3 MET A 122 -5.463 -1.489 -30.291 1.00 0.00 H new ATOM 1879 N ASN A 123 -9.903 -3.825 -27.332 1.00 0.00 N ATOM 1880 CA ASN A 123 -11.181 -3.200 -27.787 1.00 0.00 C ATOM 1881 C ASN A 123 -12.396 -4.120 -27.465 1.00 0.00 C ATOM 1882 O ASN A 123 -13.185 -3.802 -26.572 1.00 0.00 O ATOM 1883 CB ASN A 123 -11.070 -2.749 -29.278 1.00 0.00 C ATOM 1884 CG ASN A 123 -10.079 -1.644 -29.697 1.00 0.00 C ATOM 1885 OD1 ASN A 123 -9.722 -1.530 -30.864 1.00 0.00 O ATOM 1886 ND2 ASN A 123 -9.607 -0.775 -28.833 1.00 0.00 N ATOM 0 H ASN A 123 -9.736 -4.751 -27.727 1.00 0.00 H new ATOM 0 HA ASN A 123 -11.367 -2.285 -27.224 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -10.827 -3.636 -29.864 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -12.063 -2.424 -29.589 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -8.969 -0.042 -29.144 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -9.878 -0.833 -27.851 1.00 0.00 H new ATOM 1893 N ASN A 124 -12.541 -5.250 -28.170 1.00 0.00 N ATOM 1894 CA ASN A 124 -13.537 -6.310 -27.836 1.00 0.00 C ATOM 1895 C ASN A 124 -12.953 -7.537 -27.055 1.00 0.00 C ATOM 1896 O ASN A 124 -13.703 -8.169 -26.305 1.00 0.00 O ATOM 1897 CB ASN A 124 -14.223 -6.783 -29.150 1.00 0.00 C ATOM 1898 CG ASN A 124 -15.169 -5.774 -29.815 1.00 0.00 C ATOM 1899 OD1 ASN A 124 -14.811 -5.045 -30.732 1.00 0.00 O ATOM 1900 ND2 ASN A 124 -16.411 -5.707 -29.395 1.00 0.00 N ATOM 0 H ASN A 124 -11.976 -5.467 -28.991 1.00 0.00 H new ATOM 0 HA ASN A 124 -14.256 -5.858 -27.152 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -13.446 -7.050 -29.867 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -14.785 -7.692 -28.936 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -17.062 -5.055 -29.831 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -16.725 -6.307 -28.632 1.00 0.00 H new ATOM 1907 N VAL A 125 -11.679 -7.929 -27.256 1.00 0.00 N ATOM 1908 CA VAL A 125 -11.149 -9.250 -26.828 1.00 0.00 C ATOM 1909 C VAL A 125 -10.357 -9.104 -25.484 1.00 0.00 C ATOM 1910 O VAL A 125 -9.453 -8.273 -25.332 1.00 0.00 O ATOM 1911 CB VAL A 125 -10.305 -9.880 -27.988 1.00 0.00 C ATOM 1912 CG1 VAL A 125 -9.773 -11.282 -27.627 1.00 0.00 C ATOM 1913 CG2 VAL A 125 -11.062 -10.044 -29.333 1.00 0.00 C ATOM 0 H VAL A 125 -10.984 -7.343 -27.719 1.00 0.00 H new ATOM 0 HA VAL A 125 -11.968 -9.940 -26.625 1.00 0.00 H new ATOM 0 HB VAL A 125 -9.500 -9.156 -28.115 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -9.194 -11.678 -28.462 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -9.137 -11.214 -26.745 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -10.611 -11.947 -27.419 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -10.396 -10.488 -30.073 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -11.926 -10.692 -29.187 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -11.396 -9.068 -29.684 1.00 0.00 H new ATOM 1923 N THR A 126 -10.706 -9.968 -24.519 1.00 0.00 N ATOM 1924 CA THR A 126 -10.064 -10.013 -23.171 1.00 0.00 C ATOM 1925 C THR A 126 -9.117 -11.249 -23.004 1.00 0.00 C ATOM 1926 O THR A 126 -9.317 -12.300 -23.626 1.00 0.00 O ATOM 1927 CB THR A 126 -11.148 -9.993 -22.041 1.00 0.00 C ATOM 1928 OG1 THR A 126 -12.056 -11.081 -22.160 1.00 0.00 O ATOM 1929 CG2 THR A 126 -11.996 -8.715 -21.969 1.00 0.00 C ATOM 0 H THR A 126 -11.443 -10.663 -24.639 1.00 0.00 H new ATOM 0 HA THR A 126 -9.445 -9.120 -23.082 1.00 0.00 H new ATOM 0 HB THR A 126 -10.550 -10.058 -21.132 1.00 0.00 H new ATOM 0 HG1 THR A 126 -12.716 -11.036 -21.437 1.00 0.00 H new ATOM 0 HG21 THR A 126 -12.716 -8.801 -21.155 1.00 0.00 H new ATOM 0 HG22 THR A 126 -11.347 -7.857 -21.791 1.00 0.00 H new ATOM 0 HG23 THR A 126 -12.528 -8.578 -22.910 1.00 0.00 H new ATOM 1937 N CYS A 127 -8.116 -11.149 -22.103 1.00 0.00 N ATOM 1938 CA CYS A 127 -7.393 -12.344 -21.578 1.00 0.00 C ATOM 1939 C CYS A 127 -7.306 -12.347 -20.023 1.00 0.00 C ATOM 1940 O CYS A 127 -7.017 -11.317 -19.404 1.00 0.00 O ATOM 1941 CB CYS A 127 -5.999 -12.503 -22.230 1.00 0.00 C ATOM 1942 SG CYS A 127 -4.671 -11.694 -21.315 1.00 0.00 S ATOM 0 H CYS A 127 -7.786 -10.262 -21.722 1.00 0.00 H new ATOM 0 HA CYS A 127 -7.984 -13.215 -21.860 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -5.770 -13.565 -22.322 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -6.032 -12.096 -23.240 1.00 0.00 H new ATOM 0 HG CYS A 127 -4.961 -10.438 -21.149 1.00 0.00 H new ATOM 1947 N THR A 128 -7.494 -13.524 -19.398 1.00 0.00 N ATOM 1948 CA THR A 128 -7.207 -13.717 -17.943 1.00 0.00 C ATOM 1949 C THR A 128 -5.904 -14.567 -17.803 1.00 0.00 C ATOM 1950 O THR A 128 -5.888 -15.766 -18.114 1.00 0.00 O ATOM 1951 CB THR A 128 -8.435 -14.340 -17.217 1.00 0.00 C ATOM 1952 OG1 THR A 128 -9.604 -13.570 -17.479 1.00 0.00 O ATOM 1953 CG2 THR A 128 -8.297 -14.376 -15.686 1.00 0.00 C ATOM 0 H THR A 128 -7.842 -14.361 -19.866 1.00 0.00 H new ATOM 0 HA THR A 128 -7.035 -12.759 -17.453 1.00 0.00 H new ATOM 0 HB THR A 128 -8.499 -15.358 -17.600 1.00 0.00 H new ATOM 0 HG1 THR A 128 -10.370 -13.972 -17.019 1.00 0.00 H new ATOM 0 HG21 THR A 128 -9.191 -14.823 -15.251 1.00 0.00 H new ATOM 0 HG22 THR A 128 -7.424 -14.969 -15.413 1.00 0.00 H new ATOM 0 HG23 THR A 128 -8.178 -13.361 -15.307 1.00 0.00 H new ATOM 1961 N ARG A 129 -4.816 -13.924 -17.347 1.00 0.00 N ATOM 1962 CA ARG A 129 -3.499 -14.587 -17.145 1.00 0.00 C ATOM 1963 C ARG A 129 -3.196 -14.778 -15.625 1.00 0.00 C ATOM 1964 O ARG A 129 -3.173 -13.807 -14.862 1.00 0.00 O ATOM 1965 CB ARG A 129 -2.398 -13.737 -17.838 1.00 0.00 C ATOM 1966 CG ARG A 129 -2.347 -13.848 -19.381 1.00 0.00 C ATOM 1967 CD ARG A 129 -1.198 -13.065 -20.048 1.00 0.00 C ATOM 1968 NE ARG A 129 -1.516 -11.612 -20.155 1.00 0.00 N ATOM 1969 CZ ARG A 129 -0.668 -10.663 -20.553 1.00 0.00 C ATOM 1970 NH1 ARG A 129 0.578 -10.897 -20.883 1.00 0.00 N ATOM 1971 NH2 ARG A 129 -1.100 -9.437 -20.623 1.00 0.00 N ATOM 0 H ARG A 129 -4.815 -12.933 -17.106 1.00 0.00 H new ATOM 0 HA ARG A 129 -3.519 -15.581 -17.592 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -2.548 -12.691 -17.571 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -1.428 -14.032 -17.437 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -2.257 -14.900 -19.653 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -3.294 -13.493 -19.788 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -0.283 -13.197 -19.470 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -1.008 -13.471 -21.042 1.00 0.00 H new ATOM 0 HE ARG A 129 -2.460 -11.320 -19.903 1.00 0.00 H new ATOM 0 HH11 ARG A 129 0.946 -11.847 -20.843 1.00 0.00 H new ATOM 0 HH12 ARG A 129 1.180 -10.129 -21.180 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -2.066 -9.222 -20.376 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -0.472 -8.692 -20.924 1.00 0.00 H new ATOM 1985 N ILE A 130 -2.917 -16.022 -15.192 1.00 0.00 N ATOM 1986 CA ILE A 130 -2.500 -16.313 -13.783 1.00 0.00 C ATOM 1987 C ILE A 130 -0.935 -16.281 -13.725 1.00 0.00 C ATOM 1988 O ILE A 130 -0.244 -17.031 -14.429 1.00 0.00 O ATOM 1989 CB ILE A 130 -3.070 -17.660 -13.204 1.00 0.00 C ATOM 1990 CG1 ILE A 130 -4.571 -17.965 -13.502 1.00 0.00 C ATOM 1991 CG2 ILE A 130 -2.791 -17.815 -11.680 1.00 0.00 C ATOM 1992 CD1 ILE A 130 -5.608 -16.952 -12.988 1.00 0.00 C ATOM 0 H ILE A 130 -2.969 -16.849 -15.787 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.930 -15.544 -13.141 1.00 0.00 H new ATOM 0 HB ILE A 130 -2.509 -18.409 -13.764 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -4.690 -18.053 -14.582 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -4.809 -18.939 -13.075 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -3.204 -18.761 -11.329 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -1.715 -17.801 -11.504 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -3.258 -16.992 -11.139 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -6.609 -17.285 -13.263 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -5.536 -16.876 -11.903 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -5.415 -15.976 -13.433 1.00 0.00 H new ATOM 2004 N TYR A 131 -0.400 -15.416 -12.854 1.00 0.00 N ATOM 2005 CA TYR A 131 1.060 -15.254 -12.644 1.00 0.00 C ATOM 2006 C TYR A 131 1.449 -15.728 -11.203 1.00 0.00 C ATOM 2007 O TYR A 131 0.929 -15.223 -10.199 1.00 0.00 O ATOM 2008 CB TYR A 131 1.406 -13.759 -12.882 1.00 0.00 C ATOM 2009 CG TYR A 131 1.653 -13.317 -14.335 1.00 0.00 C ATOM 2010 CD1 TYR A 131 0.585 -12.976 -15.172 1.00 0.00 C ATOM 2011 CD2 TYR A 131 2.958 -13.144 -14.796 1.00 0.00 C ATOM 2012 CE1 TYR A 131 0.829 -12.423 -16.428 1.00 0.00 C ATOM 2013 CE2 TYR A 131 3.204 -12.611 -16.058 1.00 0.00 C ATOM 2014 CZ TYR A 131 2.135 -12.236 -16.868 1.00 0.00 C ATOM 2015 OH TYR A 131 2.367 -11.658 -18.085 1.00 0.00 O ATOM 0 H TYR A 131 -0.964 -14.801 -12.267 1.00 0.00 H new ATOM 0 HA TYR A 131 1.631 -15.868 -13.341 1.00 0.00 H new ATOM 0 HB2 TYR A 131 0.592 -13.156 -12.479 1.00 0.00 H new ATOM 0 HB3 TYR A 131 2.297 -13.522 -12.301 1.00 0.00 H new ATOM 0 HD1 TYR A 131 -0.431 -13.142 -14.844 1.00 0.00 H new ATOM 0 HD2 TYR A 131 3.788 -13.427 -14.166 1.00 0.00 H new ATOM 0 HE1 TYR A 131 0.002 -12.139 -17.061 1.00 0.00 H new ATOM 0 HE2 TYR A 131 4.219 -12.489 -16.407 1.00 0.00 H new ATOM 0 HH TYR A 131 3.333 -11.600 -18.241 1.00 0.00 H new ATOM 2025 N GLU A 132 2.375 -16.699 -11.106 1.00 0.00 N ATOM 2026 CA GLU A 132 2.769 -17.334 -9.815 1.00 0.00 C ATOM 2027 C GLU A 132 3.996 -16.672 -9.106 1.00 0.00 C ATOM 2028 O GLU A 132 4.980 -16.295 -9.752 1.00 0.00 O ATOM 2029 CB GLU A 132 2.902 -18.868 -10.032 1.00 0.00 C ATOM 2030 CG GLU A 132 3.994 -19.427 -10.989 1.00 0.00 C ATOM 2031 CD GLU A 132 5.363 -19.798 -10.428 1.00 0.00 C ATOM 2032 OE1 GLU A 132 5.572 -19.762 -9.199 1.00 0.00 O ATOM 2033 OE2 GLU A 132 6.233 -20.193 -11.238 1.00 0.00 O ATOM 0 H GLU A 132 2.876 -17.072 -11.913 1.00 0.00 H new ATOM 0 HA GLU A 132 1.974 -17.154 -9.091 1.00 0.00 H new ATOM 0 HB2 GLU A 132 3.066 -19.321 -9.054 1.00 0.00 H new ATOM 0 HB3 GLU A 132 1.939 -19.229 -10.393 1.00 0.00 H new ATOM 0 HG2 GLU A 132 3.585 -20.317 -11.468 1.00 0.00 H new ATOM 0 HG3 GLU A 132 4.152 -18.687 -11.773 1.00 0.00 H new ATOM 2040 N LYS A 133 3.916 -16.509 -7.765 1.00 0.00 N ATOM 2041 CA LYS A 133 4.974 -15.827 -6.965 1.00 0.00 C ATOM 2042 C LYS A 133 6.217 -16.735 -6.713 1.00 0.00 C ATOM 2043 O LYS A 133 6.168 -17.707 -5.951 1.00 0.00 O ATOM 2044 CB LYS A 133 4.398 -15.297 -5.615 1.00 0.00 C ATOM 2045 CG LYS A 133 5.190 -14.093 -5.040 1.00 0.00 C ATOM 2046 CD LYS A 133 4.581 -13.505 -3.742 1.00 0.00 C ATOM 2047 CE LYS A 133 4.916 -12.021 -3.468 1.00 0.00 C ATOM 2048 NZ LYS A 133 6.350 -11.799 -3.145 1.00 0.00 N ATOM 0 H LYS A 133 3.129 -16.840 -7.208 1.00 0.00 H new ATOM 0 HA LYS A 133 5.315 -14.979 -7.559 1.00 0.00 H new ATOM 0 HB2 LYS A 133 3.359 -15.002 -5.762 1.00 0.00 H new ATOM 0 HB3 LYS A 133 4.400 -16.106 -4.885 1.00 0.00 H new ATOM 0 HG2 LYS A 133 6.215 -14.407 -4.840 1.00 0.00 H new ATOM 0 HG3 LYS A 133 5.239 -13.308 -5.795 1.00 0.00 H new ATOM 0 HD2 LYS A 133 3.497 -13.613 -3.787 1.00 0.00 H new ATOM 0 HD3 LYS A 133 4.926 -14.100 -2.896 1.00 0.00 H new ATOM 0 HE2 LYS A 133 4.650 -11.427 -4.342 1.00 0.00 H new ATOM 0 HE3 LYS A 133 4.303 -11.663 -2.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 6.570 -10.785 -3.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 6.542 -12.123 -2.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 6.943 -12.333 -3.812 1.00 0.00 H new ATOM 2062 N VAL A 134 7.337 -16.356 -7.331 1.00 0.00 N ATOM 2063 CA VAL A 134 8.651 -17.028 -7.161 1.00 0.00 C ATOM 2064 C VAL A 134 9.497 -16.097 -6.230 1.00 0.00 C ATOM 2065 O VAL A 134 9.638 -14.900 -6.504 1.00 0.00 O ATOM 2066 CB VAL A 134 9.352 -17.260 -8.551 1.00 0.00 C ATOM 2067 CG1 VAL A 134 10.521 -18.267 -8.444 1.00 0.00 C ATOM 2068 CG2 VAL A 134 8.448 -17.749 -9.708 1.00 0.00 C ATOM 0 H VAL A 134 7.370 -15.565 -7.974 1.00 0.00 H new ATOM 0 HA VAL A 134 8.539 -18.018 -6.718 1.00 0.00 H new ATOM 0 HB VAL A 134 9.688 -16.254 -8.802 1.00 0.00 H new ATOM 0 HG11 VAL A 134 10.978 -18.399 -9.425 1.00 0.00 H new ATOM 0 HG12 VAL A 134 11.266 -17.887 -7.745 1.00 0.00 H new ATOM 0 HG13 VAL A 134 10.144 -19.225 -8.087 1.00 0.00 H new ATOM 0 HG21 VAL A 134 9.047 -17.871 -10.611 1.00 0.00 H new ATOM 0 HG22 VAL A 134 7.998 -18.705 -9.439 1.00 0.00 H new ATOM 0 HG23 VAL A 134 7.662 -17.016 -9.890 1.00 0.00 H new ATOM 2078 N GLU A 135 10.080 -16.631 -5.148 1.00 0.00 N ATOM 2079 CA GLU A 135 10.822 -15.803 -4.153 1.00 0.00 C ATOM 2080 C GLU A 135 12.330 -16.167 -4.223 1.00 0.00 C ATOM 2081 O GLU A 135 12.753 -17.205 -3.667 1.00 0.00 O ATOM 2082 CB GLU A 135 10.183 -15.956 -2.748 1.00 0.00 C ATOM 2083 CG GLU A 135 8.690 -15.542 -2.598 1.00 0.00 C ATOM 2084 CD GLU A 135 8.357 -14.056 -2.691 1.00 0.00 C ATOM 2085 OE1 GLU A 135 8.318 -13.493 -3.809 1.00 0.00 O ATOM 2086 OE2 GLU A 135 8.014 -13.447 -1.653 1.00 0.00 O ATOM 2087 OXT GLU A 135 13.097 -15.429 -4.893 1.00 0.00 O ATOM 0 H GLU A 135 10.060 -17.627 -4.929 1.00 0.00 H new ATOM 0 HA GLU A 135 10.748 -14.741 -4.385 1.00 0.00 H new ATOM 0 HB2 GLU A 135 10.277 -16.999 -2.446 1.00 0.00 H new ATOM 0 HB3 GLU A 135 10.770 -15.366 -2.044 1.00 0.00 H new ATOM 0 HG2 GLU A 135 8.118 -16.063 -3.366 1.00 0.00 H new ATOM 0 HG3 GLU A 135 8.335 -15.906 -1.634 1.00 0.00 H new TER 2094 GLU A 135