USER MOD reduce.3.24.130724 H: found=0, std=0, add=1349, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1349 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 151 LYS NZ :NH3+ 138:sc= 0.0121 (180deg=0) USER MOD Set 1.2: A 155 GLN : amide:sc= -1.61! K(o=-1.6!,f=-0.67) USER MOD Set 2.1: A 143 THR OG1 : rot 180:sc= -0.0557 USER MOD Set 2.2: A 144 THR OG1 : rot 180:sc= 0.00875 USER MOD Set 3.1: A 109 SER OG : rot 140:sc= -3.03! USER MOD Set 3.2: A 112 GLN : amide:sc= -3.08! C(o=-6.1!,f=-8!) USER MOD Set 4.1: A 103 GLN : amide:sc= -1.31 K(o=-2.7,f=-1.4) USER MOD Set 4.2: A 117 GLN : amide:sc= -1.44 K(o=-2.7,f=-4.5!) USER MOD Set 5.1: A 53 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 54 SER OG : rot 180:sc= 0 USER MOD Set 6.1: A 42 LYS NZ :NH3+ -156:sc= 0 (180deg=0) USER MOD Set 6.2: A 46 ASN : amide:sc= -0.137 K(o=-0.14,f=-2.5!) USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.208 USER MOD Single : A 22 SER OG : rot -170:sc= -0.102 USER MOD Single : A 23 SER OG : rot 180:sc=-0.00253 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= -0.769 K(o=-0.77,f=-2.2) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot -59:sc= 0.983 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot -176:sc= -3.6! USER MOD Single : A 49 ASN : amide:sc= -0.469 K(o=-0.47,f=-3.4!) USER MOD Single : A 50 MET CE :methyl 160:sc= -7.91! (180deg=-11.1!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= -0.46 K(o=-0.46,f=-3.9!) USER MOD Single : A 62 ASN : amide:sc= -4.41! C(o=-4.4!,f=-7.6!) USER MOD Single : A 64 ASN : amide:sc= -1.94! C(o=-1.9!,f=-1.3!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl -172:sc= -3.06 (180deg=-3.2!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= -0.746 K(o=-0.75,f=-0.12) USER MOD Single : A 77 SER OG : rot 180:sc= 0.0694 USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 THR OG1 : rot -170:sc= -0.879 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 61:sc= 0.442 USER MOD Single : A 101 TYR OH : rot 165:sc= -3.96! USER MOD Single : A 104 ASN : amide:sc= -0.401 X(o=-0.4,f=-0.096) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 119 SER OG : rot -150:sc= 0.0876 USER MOD Single : A 120 THR OG1 : rot 95:sc= -4.41! USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 GLN : amide:sc= -1.57 K(o=-1.6,f=-5.8!) USER MOD Single : A 128 GLN : amide:sc= -0.0869 K(o=-0.087,f=-2!) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 LYS NZ :NH3+ 168:sc= -1.64 (180deg=-1.89) USER MOD Single : A 132 LYS NZ :NH3+ -153:sc=-0.00815 (180deg=-0.62) USER MOD Single : A 133 ASN : amide:sc= -1.06 X(o=-1.1,f=-1.5) USER MOD Single : A 138 THR OG1 : rot 180:sc= -1.39! USER MOD Single : A 139 THR OG1 : rot -100:sc= -6.63! USER MOD Single : A 145 ASN : amide:sc= -3.26! C(o=-3.3!,f=-3!) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 116:sc= 0.992 USER MOD Single : A 153 GLN : amide:sc= -0.329 X(o=-0.33,f=-0.029) USER MOD Single : A 156 ASN : amide:sc= -0.0045 K(o=-0.0045,f=-1.7!) USER MOD Single : A 157 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 160 GLN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 162 MET CE :methyl -137:sc= -11.2! (180deg=-21.6!) USER MOD Single : A 163 THR OG1 : rot 140:sc= -0.254 USER MOD Single : A 164 THR OG1 : rot 180:sc= 0 USER MOD Single : A 165 HIS : no HD1:sc=-0.00788 X(o=-0.0079,f=-0.098) USER MOD Single : A 170 SER OG : rot 60:sc= -0.334 USER MOD Single : A 172 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.0824) USER MOD Single : A 176 GLN : amide:sc= -0.355 X(o=-0.35,f=-0.05) USER MOD Single : A 177 SER OG : rot -148:sc= 2.09 USER MOD Single : A 178 SER OG : rot 171:sc= -3.47! USER MOD Single : A 184 GLN : amide:sc= -0.142 X(o=-0.14,f=-0.57) USER MOD Single : A 185 MET CE :methyl -157:sc= -0.237 (180deg=-1.37) USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 20 20.631 15.824 1.415 1.00 2.16 N ATOM 2 CA LEU A 20 19.567 15.229 0.559 1.00 2.21 C ATOM 3 C LEU A 20 20.133 14.024 -0.195 1.00 1.86 C ATOM 4 O LEU A 20 21.167 14.106 -0.827 1.00 1.72 O ATOM 5 CB LEU A 20 19.070 16.273 -0.443 1.00 2.41 C ATOM 6 CG LEU A 20 17.679 15.875 -0.940 1.00 2.67 C ATOM 7 CD1 LEU A 20 16.665 16.948 -0.537 1.00 3.32 C ATOM 8 CD2 LEU A 20 17.703 15.741 -2.464 1.00 2.70 C ATOM 0 HA LEU A 20 18.736 14.907 1.186 1.00 2.21 H new ATOM 0 HB2 LEU A 20 19.033 17.256 0.027 1.00 2.41 H new ATOM 0 HB3 LEU A 20 19.761 16.346 -1.282 1.00 2.41 H new ATOM 0 HG LEU A 20 17.393 14.922 -0.495 1.00 2.67 H new ATOM 0 HD11 LEU A 20 15.674 16.664 -0.891 1.00 3.32 H new ATOM 0 HD12 LEU A 20 16.648 17.043 0.549 1.00 3.32 H new ATOM 0 HD13 LEU A 20 16.949 17.902 -0.981 1.00 3.32 H new ATOM 0 HD21 LEU A 20 16.713 15.457 -2.820 1.00 2.70 H new ATOM 0 HD22 LEU A 20 17.989 16.694 -2.909 1.00 2.70 H new ATOM 0 HD23 LEU A 20 18.424 14.976 -2.751 1.00 2.70 H new ATOM 20 N THR A 21 19.466 12.906 -0.131 1.00 1.78 N ATOM 21 CA THR A 21 19.970 11.699 -0.841 1.00 1.44 C ATOM 22 C THR A 21 18.792 10.921 -1.431 1.00 1.17 C ATOM 23 O THR A 21 17.643 11.207 -1.151 1.00 1.16 O ATOM 24 CB THR A 21 20.728 10.808 0.146 1.00 1.46 C ATOM 25 OG1 THR A 21 21.242 9.675 -0.539 1.00 1.28 O ATOM 26 CG2 THR A 21 19.781 10.351 1.257 1.00 1.51 C ATOM 0 H THR A 21 18.594 12.776 0.382 1.00 1.78 H new ATOM 0 HA THR A 21 20.640 12.004 -1.645 1.00 1.44 H new ATOM 0 HB THR A 21 21.552 11.371 0.585 1.00 1.46 H new ATOM 0 HG1 THR A 21 21.729 9.105 0.092 1.00 1.28 H new ATOM 0 HG21 THR A 21 20.323 9.717 1.959 1.00 1.51 H new ATOM 0 HG22 THR A 21 19.390 11.222 1.783 1.00 1.51 H new ATOM 0 HG23 THR A 21 18.955 9.788 0.822 1.00 1.51 H new ATOM 34 N SER A 22 19.070 9.940 -2.244 1.00 0.96 N ATOM 35 CA SER A 22 17.971 9.140 -2.855 1.00 0.69 C ATOM 36 C SER A 22 17.055 8.605 -1.752 1.00 0.66 C ATOM 37 O SER A 22 15.848 8.585 -1.890 1.00 0.57 O ATOM 38 CB SER A 22 18.567 7.970 -3.636 1.00 0.44 C ATOM 39 OG SER A 22 19.133 7.035 -2.727 1.00 1.68 O ATOM 0 H SER A 22 20.013 9.657 -2.512 1.00 0.96 H new ATOM 0 HA SER A 22 17.394 9.771 -3.531 1.00 0.69 H new ATOM 0 HB2 SER A 22 17.795 7.489 -4.237 1.00 0.44 H new ATOM 0 HB3 SER A 22 19.330 8.330 -4.326 1.00 0.44 H new ATOM 0 HG SER A 22 19.651 6.368 -3.224 1.00 1.68 H new ATOM 45 N SER A 23 17.617 8.171 -0.659 1.00 0.79 N ATOM 46 CA SER A 23 16.776 7.640 0.449 1.00 0.84 C ATOM 47 C SER A 23 15.888 8.758 0.995 1.00 0.95 C ATOM 48 O SER A 23 14.753 8.536 1.360 1.00 0.80 O ATOM 49 CB SER A 23 17.675 7.112 1.567 1.00 1.09 C ATOM 50 OG SER A 23 16.922 7.016 2.768 1.00 1.95 O ATOM 0 H SER A 23 18.622 8.161 -0.485 1.00 0.79 H new ATOM 0 HA SER A 23 16.152 6.829 0.073 1.00 0.84 H new ATOM 0 HB2 SER A 23 18.076 6.135 1.296 1.00 1.09 H new ATOM 0 HB3 SER A 23 18.526 7.778 1.710 1.00 1.09 H new ATOM 0 HG SER A 23 17.495 6.676 3.487 1.00 1.95 H new ATOM 56 N GLU A 24 16.390 9.961 1.051 1.00 1.25 N ATOM 57 CA GLU A 24 15.560 11.084 1.569 1.00 1.41 C ATOM 58 C GLU A 24 14.321 11.236 0.684 1.00 1.22 C ATOM 59 O GLU A 24 13.236 11.510 1.158 1.00 1.17 O ATOM 60 CB GLU A 24 16.372 12.380 1.542 1.00 1.78 C ATOM 61 CG GLU A 24 15.803 13.356 2.574 1.00 2.56 C ATOM 62 CD GLU A 24 16.926 13.835 3.497 1.00 2.26 C ATOM 63 OE1 GLU A 24 17.327 13.065 4.356 1.00 1.04 O ATOM 64 OE2 GLU A 24 17.363 14.962 3.333 1.00 3.64 O ATOM 0 H GLU A 24 17.335 10.214 0.762 1.00 1.25 H new ATOM 0 HA GLU A 24 15.257 10.875 2.595 1.00 1.41 H new ATOM 0 HB2 GLU A 24 17.419 12.171 1.761 1.00 1.78 H new ATOM 0 HB3 GLU A 24 16.337 12.824 0.547 1.00 1.78 H new ATOM 0 HG2 GLU A 24 15.344 14.207 2.071 1.00 2.56 H new ATOM 0 HG3 GLU A 24 15.021 12.870 3.157 1.00 2.56 H new ATOM 71 N ARG A 25 14.475 11.051 -0.598 1.00 1.15 N ATOM 72 CA ARG A 25 13.304 11.176 -1.514 1.00 1.10 C ATOM 73 C ARG A 25 12.356 10.004 -1.262 1.00 0.75 C ATOM 74 O ARG A 25 11.156 10.115 -1.419 1.00 0.77 O ATOM 75 CB ARG A 25 13.777 11.143 -2.973 1.00 1.21 C ATOM 76 CG ARG A 25 15.057 11.971 -3.125 1.00 0.97 C ATOM 77 CD ARG A 25 15.245 12.358 -4.593 1.00 1.47 C ATOM 78 NE ARG A 25 16.678 12.205 -4.971 1.00 1.96 N ATOM 79 CZ ARG A 25 17.211 13.012 -5.847 1.00 2.29 C ATOM 80 NH1 ARG A 25 17.260 14.294 -5.608 1.00 1.95 N ATOM 81 NH2 ARG A 25 17.694 12.537 -6.962 1.00 3.23 N ATOM 0 H ARG A 25 15.359 10.819 -1.051 1.00 1.15 H new ATOM 0 HA ARG A 25 12.792 12.120 -1.328 1.00 1.10 H new ATOM 0 HB2 ARG A 25 13.960 10.114 -3.282 1.00 1.21 H new ATOM 0 HB3 ARG A 25 12.998 11.538 -3.626 1.00 1.21 H new ATOM 0 HG2 ARG A 25 14.999 12.867 -2.507 1.00 0.97 H new ATOM 0 HG3 ARG A 25 15.916 11.398 -2.776 1.00 0.97 H new ATOM 0 HD2 ARG A 25 14.622 11.728 -5.228 1.00 1.47 H new ATOM 0 HD3 ARG A 25 14.924 13.388 -4.752 1.00 1.47 H new ATOM 0 HE ARG A 25 17.242 11.470 -4.545 1.00 1.96 H new ATOM 0 HH11 ARG A 25 16.882 14.665 -4.736 1.00 1.95 H new ATOM 0 HH12 ARG A 25 17.677 14.925 -6.293 1.00 1.95 H new ATOM 0 HH21 ARG A 25 17.655 11.535 -7.149 1.00 3.23 H new ATOM 0 HH22 ARG A 25 18.111 13.168 -7.647 1.00 3.23 H new ATOM 95 N ILE A 26 12.886 8.881 -0.865 1.00 0.48 N ATOM 96 CA ILE A 26 12.019 7.701 -0.597 1.00 0.14 C ATOM 97 C ILE A 26 11.094 8.011 0.584 1.00 0.22 C ATOM 98 O ILE A 26 9.895 7.872 0.493 1.00 0.23 O ATOM 99 CB ILE A 26 12.899 6.489 -0.264 1.00 0.30 C ATOM 100 CG1 ILE A 26 13.734 6.110 -1.498 1.00 0.57 C ATOM 101 CG2 ILE A 26 12.024 5.301 0.156 1.00 0.18 C ATOM 102 CD1 ILE A 26 12.832 5.526 -2.595 1.00 0.60 C ATOM 0 H ILE A 26 13.883 8.730 -0.714 1.00 0.48 H new ATOM 0 HA ILE A 26 11.417 7.477 -1.478 1.00 0.14 H new ATOM 0 HB ILE A 26 13.564 6.745 0.561 1.00 0.30 H new ATOM 0 HG12 ILE A 26 14.255 6.989 -1.877 1.00 0.57 H new ATOM 0 HG13 ILE A 26 14.497 5.383 -1.220 1.00 0.57 H new ATOM 0 HG21 ILE A 26 12.659 4.446 0.390 1.00 0.18 H new ATOM 0 HG22 ILE A 26 11.441 5.572 1.036 1.00 0.18 H new ATOM 0 HG23 ILE A 26 11.350 5.040 -0.659 1.00 0.18 H new ATOM 0 HD11 ILE A 26 13.438 5.263 -3.462 1.00 0.60 H new ATOM 0 HD12 ILE A 26 12.331 4.634 -2.218 1.00 0.60 H new ATOM 0 HD13 ILE A 26 12.086 6.266 -2.885 1.00 0.60 H new ATOM 114 N ASP A 27 11.647 8.423 1.691 1.00 0.30 N ATOM 115 CA ASP A 27 10.809 8.732 2.889 1.00 0.40 C ATOM 116 C ASP A 27 9.785 9.827 2.566 1.00 0.40 C ATOM 117 O ASP A 27 8.597 9.651 2.756 1.00 0.39 O ATOM 118 CB ASP A 27 11.719 9.207 4.023 1.00 0.58 C ATOM 119 CG ASP A 27 10.879 9.528 5.260 1.00 0.56 C ATOM 120 OD1 ASP A 27 10.498 8.596 5.949 1.00 0.84 O ATOM 121 OD2 ASP A 27 10.631 10.697 5.498 1.00 1.92 O ATOM 0 H ASP A 27 12.649 8.560 1.820 1.00 0.30 H new ATOM 0 HA ASP A 27 10.272 7.832 3.187 1.00 0.40 H new ATOM 0 HB2 ASP A 27 12.453 8.437 4.260 1.00 0.58 H new ATOM 0 HB3 ASP A 27 12.275 10.091 3.710 1.00 0.58 H new ATOM 126 N LYS A 28 10.231 10.958 2.095 1.00 0.43 N ATOM 127 CA LYS A 28 9.281 12.065 1.781 1.00 0.45 C ATOM 128 C LYS A 28 8.269 11.608 0.728 1.00 0.36 C ATOM 129 O LYS A 28 7.177 12.133 0.636 1.00 0.40 O ATOM 130 CB LYS A 28 10.062 13.264 1.246 1.00 0.55 C ATOM 131 CG LYS A 28 10.852 12.837 0.008 1.00 1.78 C ATOM 132 CD LYS A 28 10.103 13.278 -1.248 1.00 2.54 C ATOM 133 CE LYS A 28 10.463 14.730 -1.571 1.00 2.80 C ATOM 134 NZ LYS A 28 11.691 14.768 -2.419 1.00 4.02 N ATOM 0 H LYS A 28 11.213 11.165 1.913 1.00 0.43 H new ATOM 0 HA LYS A 28 8.747 12.345 2.689 1.00 0.45 H new ATOM 0 HB2 LYS A 28 9.379 14.075 0.994 1.00 0.55 H new ATOM 0 HB3 LYS A 28 10.739 13.643 2.011 1.00 0.55 H new ATOM 0 HG2 LYS A 28 11.847 13.282 0.027 1.00 1.78 H new ATOM 0 HG3 LYS A 28 10.986 11.755 0.004 1.00 1.78 H new ATOM 0 HD2 LYS A 28 10.364 12.632 -2.086 1.00 2.54 H new ATOM 0 HD3 LYS A 28 9.028 13.184 -1.096 1.00 2.54 H new ATOM 0 HE2 LYS A 28 9.635 15.213 -2.091 1.00 2.80 H new ATOM 0 HE3 LYS A 28 10.629 15.287 -0.649 1.00 2.80 H new ATOM 0 HZ1 LYS A 28 11.932 15.756 -2.636 1.00 4.02 H new ATOM 0 HZ2 LYS A 28 12.480 14.323 -1.908 1.00 4.02 H new ATOM 0 HZ3 LYS A 28 11.517 14.251 -3.305 1.00 4.02 H new ATOM 148 N GLN A 29 8.618 10.639 -0.070 1.00 0.25 N ATOM 149 CA GLN A 29 7.666 10.162 -1.114 1.00 0.22 C ATOM 150 C GLN A 29 6.560 9.326 -0.458 1.00 0.16 C ATOM 151 O GLN A 29 5.398 9.432 -0.808 1.00 0.20 O ATOM 152 CB GLN A 29 8.416 9.309 -2.139 1.00 0.19 C ATOM 153 CG GLN A 29 9.013 10.212 -3.222 1.00 0.20 C ATOM 154 CD GLN A 29 7.891 10.784 -4.091 1.00 1.03 C ATOM 155 OE1 GLN A 29 7.032 10.058 -4.550 1.00 1.84 O ATOM 156 NE2 GLN A 29 7.863 12.065 -4.339 1.00 1.52 N ATOM 0 H GLN A 29 9.517 10.157 -0.046 1.00 0.25 H new ATOM 0 HA GLN A 29 7.219 11.020 -1.616 1.00 0.22 H new ATOM 0 HB2 GLN A 29 9.207 8.743 -1.647 1.00 0.19 H new ATOM 0 HB3 GLN A 29 7.738 8.584 -2.589 1.00 0.19 H new ATOM 0 HG2 GLN A 29 9.579 11.022 -2.762 1.00 0.20 H new ATOM 0 HG3 GLN A 29 9.711 9.645 -3.838 1.00 0.20 H new ATOM 0 HE21 GLN A 29 8.584 12.675 -3.954 1.00 1.52 H new ATOM 0 HE22 GLN A 29 7.120 12.456 -4.918 1.00 1.52 H new ATOM 165 N ILE A 30 6.899 8.507 0.503 1.00 0.10 N ATOM 166 CA ILE A 30 5.848 7.691 1.173 1.00 0.08 C ATOM 167 C ILE A 30 4.915 8.641 1.924 1.00 0.09 C ATOM 168 O ILE A 30 3.722 8.430 1.993 1.00 0.12 O ATOM 169 CB ILE A 30 6.464 6.716 2.182 1.00 0.16 C ATOM 170 CG1 ILE A 30 7.639 5.935 1.553 1.00 0.39 C ATOM 171 CG2 ILE A 30 5.383 5.754 2.667 1.00 0.13 C ATOM 172 CD1 ILE A 30 7.133 4.778 0.679 1.00 0.52 C ATOM 0 H ILE A 30 7.849 8.370 0.849 1.00 0.10 H new ATOM 0 HA ILE A 30 5.312 7.116 0.418 1.00 0.08 H new ATOM 0 HB ILE A 30 6.859 7.280 3.027 1.00 0.16 H new ATOM 0 HG12 ILE A 30 8.247 6.610 0.951 1.00 0.39 H new ATOM 0 HG13 ILE A 30 8.283 5.544 2.341 1.00 0.39 H new ATOM 0 HG21 ILE A 30 5.813 5.056 3.386 1.00 0.13 H new ATOM 0 HG22 ILE A 30 4.581 6.318 3.144 1.00 0.13 H new ATOM 0 HG23 ILE A 30 4.982 5.200 1.818 1.00 0.13 H new ATOM 0 HD11 ILE A 30 7.983 4.247 0.250 1.00 0.52 H new ATOM 0 HD12 ILE A 30 6.546 4.091 1.289 1.00 0.52 H new ATOM 0 HD13 ILE A 30 6.510 5.174 -0.123 1.00 0.52 H new ATOM 184 N ARG A 31 5.455 9.692 2.485 1.00 0.13 N ATOM 185 CA ARG A 31 4.610 10.663 3.227 1.00 0.16 C ATOM 186 C ARG A 31 3.521 11.182 2.290 1.00 0.18 C ATOM 187 O ARG A 31 2.454 11.578 2.716 1.00 0.16 O ATOM 188 CB ARG A 31 5.479 11.826 3.704 1.00 0.21 C ATOM 189 CG ARG A 31 4.625 12.807 4.502 1.00 0.56 C ATOM 190 CD ARG A 31 5.306 13.108 5.840 1.00 0.73 C ATOM 191 NE ARG A 31 5.183 14.562 6.150 1.00 0.55 N ATOM 192 CZ ARG A 31 6.231 15.337 6.077 1.00 1.26 C ATOM 193 NH1 ARG A 31 7.006 15.486 7.117 1.00 1.79 N ATOM 194 NH2 ARG A 31 6.503 15.964 4.966 1.00 2.33 N ATOM 0 H ARG A 31 6.450 9.917 2.459 1.00 0.13 H new ATOM 0 HA ARG A 31 4.152 10.181 4.091 1.00 0.16 H new ATOM 0 HB2 ARG A 31 6.296 11.453 4.321 1.00 0.21 H new ATOM 0 HB3 ARG A 31 5.930 12.331 2.850 1.00 0.21 H new ATOM 0 HG2 ARG A 31 4.487 13.729 3.937 1.00 0.56 H new ATOM 0 HG3 ARG A 31 3.634 12.387 4.673 1.00 0.56 H new ATOM 0 HD2 ARG A 31 4.848 12.517 6.633 1.00 0.73 H new ATOM 0 HD3 ARG A 31 6.357 12.823 5.796 1.00 0.73 H new ATOM 0 HE ARG A 31 4.279 14.951 6.419 1.00 0.55 H new ATOM 0 HH11 ARG A 31 6.793 14.997 7.986 1.00 1.79 H new ATOM 0 HH12 ARG A 31 7.825 16.091 7.060 1.00 1.79 H new ATOM 0 HH21 ARG A 31 5.897 15.849 4.154 1.00 2.33 H new ATOM 0 HH22 ARG A 31 7.322 16.569 4.909 1.00 2.33 H new ATOM 208 N TYR A 32 3.782 11.166 1.013 1.00 0.24 N ATOM 209 CA TYR A 32 2.767 11.637 0.038 1.00 0.28 C ATOM 210 C TYR A 32 1.753 10.516 -0.169 1.00 0.27 C ATOM 211 O TYR A 32 0.571 10.748 -0.331 1.00 0.29 O ATOM 212 CB TYR A 32 3.456 11.961 -1.289 1.00 0.32 C ATOM 213 CG TYR A 32 2.926 13.267 -1.828 1.00 0.27 C ATOM 214 CD1 TYR A 32 1.695 13.300 -2.491 1.00 1.20 C ATOM 215 CD2 TYR A 32 3.667 14.443 -1.665 1.00 0.82 C ATOM 216 CE1 TYR A 32 1.202 14.510 -2.992 1.00 1.15 C ATOM 217 CE2 TYR A 32 3.176 15.654 -2.165 1.00 0.89 C ATOM 218 CZ TYR A 32 1.944 15.688 -2.829 1.00 0.24 C ATOM 219 OH TYR A 32 1.460 16.884 -3.324 1.00 0.26 O ATOM 0 H TYR A 32 4.659 10.845 0.604 1.00 0.24 H new ATOM 0 HA TYR A 32 2.267 12.532 0.407 1.00 0.28 H new ATOM 0 HB2 TYR A 32 4.534 12.026 -1.144 1.00 0.32 H new ATOM 0 HB3 TYR A 32 3.279 11.161 -2.007 1.00 0.32 H new ATOM 0 HD1 TYR A 32 1.125 12.391 -2.616 1.00 1.20 H new ATOM 0 HD2 TYR A 32 4.618 14.416 -1.153 1.00 0.82 H new ATOM 0 HE1 TYR A 32 0.251 14.536 -3.504 1.00 1.15 H new ATOM 0 HE2 TYR A 32 3.747 16.562 -2.039 1.00 0.89 H new ATOM 0 HH TYR A 32 2.097 17.602 -3.125 1.00 0.26 H new ATOM 229 N ILE A 33 2.218 9.296 -0.158 1.00 0.26 N ATOM 230 CA ILE A 33 1.299 8.141 -0.348 1.00 0.27 C ATOM 231 C ILE A 33 0.226 8.146 0.743 1.00 0.28 C ATOM 232 O ILE A 33 -0.941 7.956 0.476 1.00 0.32 O ATOM 233 CB ILE A 33 2.101 6.843 -0.271 1.00 0.23 C ATOM 234 CG1 ILE A 33 3.187 6.864 -1.348 1.00 0.22 C ATOM 235 CG2 ILE A 33 1.174 5.649 -0.504 1.00 0.23 C ATOM 236 CD1 ILE A 33 3.997 5.573 -1.272 1.00 0.21 C ATOM 0 H ILE A 33 3.199 9.050 -0.025 1.00 0.26 H new ATOM 0 HA ILE A 33 0.816 8.218 -1.322 1.00 0.27 H new ATOM 0 HB ILE A 33 2.558 6.753 0.714 1.00 0.23 H new ATOM 0 HG12 ILE A 33 2.735 6.966 -2.335 1.00 0.22 H new ATOM 0 HG13 ILE A 33 3.840 7.725 -1.206 1.00 0.22 H new ATOM 0 HG21 ILE A 33 1.750 4.725 -0.448 1.00 0.23 H new ATOM 0 HG22 ILE A 33 0.396 5.638 0.259 1.00 0.23 H new ATOM 0 HG23 ILE A 33 0.715 5.732 -1.489 1.00 0.23 H new ATOM 0 HD11 ILE A 33 4.772 5.584 -2.038 1.00 0.21 H new ATOM 0 HD12 ILE A 33 4.460 5.491 -0.289 1.00 0.21 H new ATOM 0 HD13 ILE A 33 3.338 4.720 -1.435 1.00 0.21 H new ATOM 248 N LEU A 34 0.616 8.356 1.971 1.00 0.25 N ATOM 249 CA LEU A 34 -0.376 8.364 3.084 1.00 0.29 C ATOM 250 C LEU A 34 -1.249 9.617 3.002 1.00 0.34 C ATOM 251 O LEU A 34 -2.454 9.550 3.143 1.00 0.36 O ATOM 252 CB LEU A 34 0.368 8.360 4.418 1.00 0.31 C ATOM 253 CG LEU A 34 0.355 6.951 5.007 1.00 0.34 C ATOM 254 CD1 LEU A 34 1.718 6.296 4.789 1.00 0.41 C ATOM 255 CD2 LEU A 34 0.062 7.034 6.508 1.00 0.48 C ATOM 0 H LEU A 34 1.582 8.523 2.252 1.00 0.25 H new ATOM 0 HA LEU A 34 -1.009 7.480 3.004 1.00 0.29 H new ATOM 0 HB2 LEU A 34 1.395 8.696 4.274 1.00 0.31 H new ATOM 0 HB3 LEU A 34 -0.102 9.059 5.110 1.00 0.31 H new ATOM 0 HG LEU A 34 -0.415 6.356 4.517 1.00 0.34 H new ATOM 0 HD11 LEU A 34 1.710 5.290 5.209 1.00 0.41 H new ATOM 0 HD12 LEU A 34 1.929 6.241 3.721 1.00 0.41 H new ATOM 0 HD13 LEU A 34 2.489 6.888 5.281 1.00 0.41 H new ATOM 0 HD21 LEU A 34 0.052 6.030 6.933 1.00 0.48 H new ATOM 0 HD22 LEU A 34 0.835 7.627 6.997 1.00 0.48 H new ATOM 0 HD23 LEU A 34 -0.909 7.504 6.664 1.00 0.48 H new ATOM 267 N ASP A 35 -0.657 10.760 2.774 1.00 0.38 N ATOM 268 CA ASP A 35 -1.463 12.013 2.683 1.00 0.46 C ATOM 269 C ASP A 35 -2.590 11.798 1.678 1.00 0.46 C ATOM 270 O ASP A 35 -3.657 12.371 1.782 1.00 0.49 O ATOM 271 CB ASP A 35 -0.575 13.166 2.214 1.00 0.48 C ATOM 272 CG ASP A 35 -1.077 14.475 2.827 1.00 0.64 C ATOM 273 OD1 ASP A 35 -1.072 14.576 4.043 1.00 1.08 O ATOM 274 OD2 ASP A 35 -1.458 15.353 2.072 1.00 1.42 O ATOM 0 H ASP A 35 0.348 10.880 2.647 1.00 0.38 H new ATOM 0 HA ASP A 35 -1.876 12.258 3.662 1.00 0.46 H new ATOM 0 HB2 ASP A 35 0.459 12.986 2.509 1.00 0.48 H new ATOM 0 HB3 ASP A 35 -0.590 13.232 1.126 1.00 0.48 H new ATOM 279 N GLY A 36 -2.357 10.956 0.715 1.00 0.42 N ATOM 280 CA GLY A 36 -3.401 10.670 -0.294 1.00 0.42 C ATOM 281 C GLY A 36 -4.446 9.742 0.325 1.00 0.39 C ATOM 282 O GLY A 36 -5.631 9.942 0.175 1.00 0.38 O ATOM 0 H GLY A 36 -1.480 10.451 0.585 1.00 0.42 H new ATOM 0 HA2 GLY A 36 -3.869 11.597 -0.625 1.00 0.42 H new ATOM 0 HA3 GLY A 36 -2.957 10.204 -1.174 1.00 0.42 H new ATOM 286 N ILE A 37 -4.009 8.721 1.018 1.00 0.38 N ATOM 287 CA ILE A 37 -4.970 7.764 1.642 1.00 0.35 C ATOM 288 C ILE A 37 -5.951 8.495 2.558 1.00 0.40 C ATOM 289 O ILE A 37 -7.075 8.064 2.726 1.00 0.33 O ATOM 290 CB ILE A 37 -4.216 6.721 2.467 1.00 0.36 C ATOM 291 CG1 ILE A 37 -3.210 5.981 1.576 1.00 0.32 C ATOM 292 CG2 ILE A 37 -5.221 5.724 3.057 1.00 0.35 C ATOM 293 CD1 ILE A 37 -3.948 5.130 0.541 1.00 0.38 C ATOM 0 H ILE A 37 -3.024 8.509 1.178 1.00 0.38 H new ATOM 0 HA ILE A 37 -5.522 7.277 0.838 1.00 0.35 H new ATOM 0 HB ILE A 37 -3.675 7.215 3.274 1.00 0.36 H new ATOM 0 HG12 ILE A 37 -2.562 6.699 1.072 1.00 0.32 H new ATOM 0 HG13 ILE A 37 -2.568 5.347 2.188 1.00 0.32 H new ATOM 0 HG21 ILE A 37 -4.689 4.977 3.647 1.00 0.35 H new ATOM 0 HG22 ILE A 37 -5.928 6.254 3.695 1.00 0.35 H new ATOM 0 HG23 ILE A 37 -5.761 5.231 2.249 1.00 0.35 H new ATOM 0 HD11 ILE A 37 -3.224 4.610 -0.085 1.00 0.38 H new ATOM 0 HD12 ILE A 37 -4.577 4.400 1.051 1.00 0.38 H new ATOM 0 HD13 ILE A 37 -4.570 5.773 -0.081 1.00 0.38 H new ATOM 305 N SER A 38 -5.562 9.593 3.143 1.00 0.57 N ATOM 306 CA SER A 38 -6.515 10.315 4.022 1.00 0.63 C ATOM 307 C SER A 38 -7.654 10.788 3.142 1.00 0.54 C ATOM 308 O SER A 38 -8.812 10.721 3.502 1.00 0.48 O ATOM 309 CB SER A 38 -5.825 11.514 4.671 1.00 0.79 C ATOM 310 OG SER A 38 -6.810 12.400 5.186 1.00 1.32 O ATOM 0 H SER A 38 -4.638 10.015 3.051 1.00 0.57 H new ATOM 0 HA SER A 38 -6.879 9.666 4.818 1.00 0.63 H new ATOM 0 HB2 SER A 38 -5.166 11.179 5.472 1.00 0.79 H new ATOM 0 HB3 SER A 38 -5.202 12.029 3.940 1.00 0.79 H new ATOM 0 HG SER A 38 -6.371 13.170 5.605 1.00 1.32 H new ATOM 316 N ALA A 39 -7.323 11.240 1.967 1.00 0.53 N ATOM 317 CA ALA A 39 -8.366 11.700 1.027 1.00 0.46 C ATOM 318 C ALA A 39 -9.011 10.483 0.354 1.00 0.35 C ATOM 319 O ALA A 39 -10.067 10.581 -0.241 1.00 0.30 O ATOM 320 CB ALA A 39 -7.737 12.602 -0.036 1.00 0.53 C ATOM 0 H ALA A 39 -6.366 11.309 1.620 1.00 0.53 H new ATOM 0 HA ALA A 39 -9.126 12.262 1.570 1.00 0.46 H new ATOM 0 HB1 ALA A 39 -8.508 12.940 -0.728 1.00 0.53 H new ATOM 0 HB2 ALA A 39 -7.277 13.465 0.445 1.00 0.53 H new ATOM 0 HB3 ALA A 39 -6.977 12.044 -0.583 1.00 0.53 H new ATOM 326 N LEU A 40 -8.390 9.333 0.444 1.00 0.34 N ATOM 327 CA LEU A 40 -8.979 8.124 -0.190 1.00 0.27 C ATOM 328 C LEU A 40 -9.875 7.392 0.807 1.00 0.41 C ATOM 329 O LEU A 40 -10.628 6.515 0.441 1.00 0.61 O ATOM 330 CB LEU A 40 -7.875 7.167 -0.658 1.00 0.41 C ATOM 331 CG LEU A 40 -6.994 7.836 -1.719 1.00 0.42 C ATOM 332 CD1 LEU A 40 -6.025 6.803 -2.298 1.00 0.67 C ATOM 333 CD2 LEU A 40 -7.865 8.398 -2.844 1.00 0.39 C ATOM 0 H LEU A 40 -7.505 9.184 0.928 1.00 0.34 H new ATOM 0 HA LEU A 40 -9.567 8.446 -1.050 1.00 0.27 H new ATOM 0 HB2 LEU A 40 -7.264 6.865 0.192 1.00 0.41 H new ATOM 0 HB3 LEU A 40 -8.321 6.261 -1.067 1.00 0.41 H new ATOM 0 HG LEU A 40 -6.435 8.650 -1.258 1.00 0.42 H new ATOM 0 HD11 LEU A 40 -5.397 7.276 -3.053 1.00 0.67 H new ATOM 0 HD12 LEU A 40 -5.397 6.406 -1.500 1.00 0.67 H new ATOM 0 HD13 LEU A 40 -6.590 5.990 -2.754 1.00 0.67 H new ATOM 0 HD21 LEU A 40 -7.231 8.872 -3.593 1.00 0.39 H new ATOM 0 HD22 LEU A 40 -8.430 7.588 -3.306 1.00 0.39 H new ATOM 0 HD23 LEU A 40 -8.556 9.135 -2.435 1.00 0.39 H new ATOM 345 N ARG A 41 -9.802 7.736 2.063 1.00 0.43 N ATOM 346 CA ARG A 41 -10.655 7.046 3.063 1.00 0.62 C ATOM 347 C ARG A 41 -11.504 8.066 3.828 1.00 0.54 C ATOM 348 O ARG A 41 -12.270 7.709 4.702 1.00 0.69 O ATOM 349 CB ARG A 41 -9.770 6.286 4.048 1.00 0.83 C ATOM 350 CG ARG A 41 -10.649 5.383 4.905 1.00 1.05 C ATOM 351 CD ARG A 41 -9.776 4.388 5.673 1.00 1.29 C ATOM 352 NE ARG A 41 -10.169 4.380 7.114 1.00 1.53 N ATOM 353 CZ ARG A 41 -10.085 5.472 7.826 1.00 1.52 C ATOM 354 NH1 ARG A 41 -9.258 6.421 7.480 1.00 1.69 N ATOM 355 NH2 ARG A 41 -10.824 5.613 8.892 1.00 2.39 N ATOM 0 H ARG A 41 -9.191 8.462 2.436 1.00 0.43 H new ATOM 0 HA ARG A 41 -11.315 6.350 2.545 1.00 0.62 H new ATOM 0 HB2 ARG A 41 -9.031 5.692 3.510 1.00 0.83 H new ATOM 0 HB3 ARG A 41 -9.220 6.985 4.678 1.00 0.83 H new ATOM 0 HG2 ARG A 41 -11.232 5.984 5.603 1.00 1.05 H new ATOM 0 HG3 ARG A 41 -11.359 4.847 4.275 1.00 1.05 H new ATOM 0 HD2 ARG A 41 -9.888 3.390 5.250 1.00 1.29 H new ATOM 0 HD3 ARG A 41 -8.725 4.660 5.574 1.00 1.29 H new ATOM 0 HE ARG A 41 -10.504 3.518 7.544 1.00 1.53 H new ATOM 0 HH11 ARG A 41 -8.674 6.311 6.651 1.00 1.69 H new ATOM 0 HH12 ARG A 41 -9.196 7.272 8.039 1.00 1.69 H new ATOM 0 HH21 ARG A 41 -11.467 4.871 9.169 1.00 2.39 H new ATOM 0 HH22 ARG A 41 -10.759 6.465 9.449 1.00 2.39 H new ATOM 369 N LYS A 42 -11.386 9.328 3.510 1.00 0.33 N ATOM 370 CA LYS A 42 -12.197 10.346 4.223 1.00 0.30 C ATOM 371 C LYS A 42 -13.588 10.385 3.612 1.00 0.46 C ATOM 372 O LYS A 42 -14.581 10.432 4.303 1.00 0.56 O ATOM 373 CB LYS A 42 -11.541 11.718 4.071 1.00 0.15 C ATOM 374 CG LYS A 42 -11.016 12.191 5.430 1.00 1.10 C ATOM 375 CD LYS A 42 -12.182 12.705 6.278 1.00 1.54 C ATOM 376 CE LYS A 42 -11.729 12.856 7.733 1.00 2.35 C ATOM 377 NZ LYS A 42 -12.745 13.637 8.500 1.00 3.03 N ATOM 0 H LYS A 42 -10.764 9.693 2.789 1.00 0.33 H new ATOM 0 HA LYS A 42 -12.262 10.090 5.281 1.00 0.30 H new ATOM 0 HB2 LYS A 42 -10.723 11.663 3.353 1.00 0.15 H new ATOM 0 HB3 LYS A 42 -12.262 12.435 3.679 1.00 0.15 H new ATOM 0 HG2 LYS A 42 -10.513 11.371 5.943 1.00 1.10 H new ATOM 0 HG3 LYS A 42 -10.278 12.981 5.292 1.00 1.10 H new ATOM 0 HD2 LYS A 42 -12.530 13.664 5.893 1.00 1.54 H new ATOM 0 HD3 LYS A 42 -13.022 12.013 6.218 1.00 1.54 H new ATOM 0 HE2 LYS A 42 -11.594 11.874 8.186 1.00 2.35 H new ATOM 0 HE3 LYS A 42 -10.763 13.360 7.773 1.00 2.35 H new ATOM 0 HZ1 LYS A 42 -12.292 14.082 9.323 1.00 3.03 H new ATOM 0 HZ2 LYS A 42 -13.151 14.373 7.888 1.00 3.03 H new ATOM 0 HZ3 LYS A 42 -13.501 13.000 8.824 1.00 3.03 H new ATOM 391 N GLU A 43 -13.673 10.353 2.318 1.00 0.54 N ATOM 392 CA GLU A 43 -15.004 10.383 1.678 1.00 0.75 C ATOM 393 C GLU A 43 -15.559 8.966 1.652 1.00 0.87 C ATOM 394 O GLU A 43 -16.639 8.698 2.158 1.00 0.93 O ATOM 395 CB GLU A 43 -14.871 10.913 0.247 1.00 0.82 C ATOM 396 CG GLU A 43 -16.239 10.884 -0.439 1.00 0.53 C ATOM 397 CD GLU A 43 -16.107 10.213 -1.806 1.00 1.29 C ATOM 398 OE1 GLU A 43 -15.690 10.882 -2.736 1.00 1.74 O ATOM 399 OE2 GLU A 43 -16.425 9.038 -1.900 1.00 2.38 O ATOM 0 H GLU A 43 -12.879 10.307 1.679 1.00 0.54 H new ATOM 0 HA GLU A 43 -15.676 11.035 2.236 1.00 0.75 H new ATOM 0 HB2 GLU A 43 -14.481 11.931 0.260 1.00 0.82 H new ATOM 0 HB3 GLU A 43 -14.159 10.306 -0.312 1.00 0.82 H new ATOM 0 HG2 GLU A 43 -16.956 10.341 0.177 1.00 0.53 H new ATOM 0 HG3 GLU A 43 -16.622 11.898 -0.555 1.00 0.53 H new ATOM 406 N THR A 44 -14.816 8.065 1.057 1.00 0.97 N ATOM 407 CA THR A 44 -15.268 6.655 0.961 1.00 1.13 C ATOM 408 C THR A 44 -14.912 5.880 2.240 1.00 0.99 C ATOM 409 O THR A 44 -14.244 4.875 2.203 1.00 0.97 O ATOM 410 CB THR A 44 -14.630 6.007 -0.291 1.00 1.40 C ATOM 411 OG1 THR A 44 -15.364 4.849 -0.652 1.00 1.90 O ATOM 412 CG2 THR A 44 -13.167 5.623 -0.035 1.00 1.07 C ATOM 0 H THR A 44 -13.908 8.255 0.632 1.00 0.97 H new ATOM 0 HA THR A 44 -16.353 6.624 0.861 1.00 1.13 H new ATOM 0 HB THR A 44 -14.657 6.735 -1.101 1.00 1.40 H new ATOM 0 HG1 THR A 44 -15.357 4.212 0.093 1.00 1.90 H new ATOM 0 HG21 THR A 44 -12.747 5.170 -0.933 1.00 1.07 H new ATOM 0 HG22 THR A 44 -12.596 6.515 0.222 1.00 1.07 H new ATOM 0 HG23 THR A 44 -13.117 4.910 0.788 1.00 1.07 H new ATOM 420 N CYS A 45 -15.389 6.331 3.370 1.00 0.97 N ATOM 421 CA CYS A 45 -15.120 5.622 4.650 1.00 0.88 C ATOM 422 C CYS A 45 -15.641 6.485 5.789 1.00 0.52 C ATOM 423 O CYS A 45 -16.201 5.980 6.742 1.00 0.47 O ATOM 424 CB CYS A 45 -13.626 5.317 4.805 1.00 1.05 C ATOM 425 SG CYS A 45 -13.413 3.532 5.097 1.00 1.93 S ATOM 0 H CYS A 45 -15.960 7.171 3.459 1.00 0.97 H new ATOM 0 HA CYS A 45 -15.634 4.661 4.662 1.00 0.88 H new ATOM 0 HB2 CYS A 45 -13.085 5.619 3.908 1.00 1.05 H new ATOM 0 HB3 CYS A 45 -13.210 5.887 5.636 1.00 1.05 H new ATOM 430 N ASN A 46 -15.543 7.786 5.679 1.00 0.45 N ATOM 431 CA ASN A 46 -16.136 8.629 6.744 1.00 0.56 C ATOM 432 C ASN A 46 -17.639 8.577 6.498 1.00 0.77 C ATOM 433 O ASN A 46 -18.426 8.383 7.402 1.00 0.99 O ATOM 434 CB ASN A 46 -15.636 10.069 6.653 1.00 0.70 C ATOM 435 CG ASN A 46 -15.930 10.794 7.967 1.00 0.70 C ATOM 436 OD1 ASN A 46 -16.339 10.182 8.934 1.00 0.70 O ATOM 437 ND2 ASN A 46 -15.738 12.081 8.043 1.00 1.33 N ATOM 0 H ASN A 46 -15.088 8.286 4.915 1.00 0.45 H new ATOM 0 HA ASN A 46 -15.863 8.270 7.736 1.00 0.56 H new ATOM 0 HB2 ASN A 46 -14.565 10.081 6.450 1.00 0.70 H new ATOM 0 HB3 ASN A 46 -16.123 10.583 5.825 1.00 0.70 H new ATOM 0 HD21 ASN A 46 -15.931 12.575 8.914 1.00 1.33 H new ATOM 0 HD22 ASN A 46 -15.395 12.594 7.231 1.00 1.33 H new ATOM 444 N LYS A 47 -18.035 8.693 5.250 1.00 0.74 N ATOM 445 CA LYS A 47 -19.479 8.588 4.918 1.00 1.00 C ATOM 446 C LYS A 47 -19.785 7.141 4.547 1.00 1.06 C ATOM 447 O LYS A 47 -20.718 6.865 3.818 1.00 1.14 O ATOM 448 CB LYS A 47 -19.815 9.509 3.742 1.00 1.02 C ATOM 449 CG LYS A 47 -21.106 10.273 4.050 1.00 1.17 C ATOM 450 CD LYS A 47 -21.214 11.490 3.130 1.00 1.57 C ATOM 451 CE LYS A 47 -22.673 11.947 3.060 1.00 1.93 C ATOM 452 NZ LYS A 47 -23.201 11.716 1.686 1.00 1.75 N ATOM 0 H LYS A 47 -17.417 8.855 4.455 1.00 0.74 H new ATOM 0 HA LYS A 47 -20.080 8.889 5.776 1.00 1.00 H new ATOM 0 HB2 LYS A 47 -18.998 10.209 3.568 1.00 1.02 H new ATOM 0 HB3 LYS A 47 -19.934 8.924 2.830 1.00 1.02 H new ATOM 0 HG2 LYS A 47 -21.968 9.621 3.910 1.00 1.17 H new ATOM 0 HG3 LYS A 47 -21.112 10.591 5.093 1.00 1.17 H new ATOM 0 HD2 LYS A 47 -20.586 12.299 3.503 1.00 1.57 H new ATOM 0 HD3 LYS A 47 -20.852 11.239 2.133 1.00 1.57 H new ATOM 0 HE2 LYS A 47 -23.272 11.400 3.788 1.00 1.93 H new ATOM 0 HE3 LYS A 47 -22.747 13.004 3.317 1.00 1.93 H new ATOM 0 HZ1 LYS A 47 -24.192 12.027 1.638 1.00 1.75 H new ATOM 0 HZ2 LYS A 47 -22.635 12.257 1.001 1.00 1.75 H new ATOM 0 HZ3 LYS A 47 -23.144 10.703 1.458 1.00 1.75 H new ATOM 466 N SER A 48 -18.995 6.207 5.017 1.00 1.09 N ATOM 467 CA SER A 48 -19.253 4.793 4.644 1.00 1.25 C ATOM 468 C SER A 48 -18.778 3.804 5.710 1.00 1.12 C ATOM 469 O SER A 48 -18.859 2.617 5.498 1.00 0.84 O ATOM 470 CB SER A 48 -18.523 4.495 3.340 1.00 1.50 C ATOM 471 OG SER A 48 -19.067 5.300 2.303 1.00 2.94 O ATOM 0 H SER A 48 -18.197 6.364 5.632 1.00 1.09 H new ATOM 0 HA SER A 48 -20.331 4.670 4.541 1.00 1.25 H new ATOM 0 HB2 SER A 48 -17.458 4.697 3.452 1.00 1.50 H new ATOM 0 HB3 SER A 48 -18.623 3.439 3.087 1.00 1.50 H new ATOM 0 HG SER A 48 -18.642 5.068 1.451 1.00 2.94 H new ATOM 477 N ASN A 49 -18.283 4.251 6.840 1.00 2.10 N ATOM 478 CA ASN A 49 -17.806 3.277 7.876 1.00 2.90 C ATOM 479 C ASN A 49 -16.818 2.297 7.217 1.00 2.79 C ATOM 480 O ASN A 49 -15.635 2.565 7.140 1.00 4.42 O ATOM 481 CB ASN A 49 -18.998 2.508 8.455 1.00 3.44 C ATOM 482 CG ASN A 49 -19.344 3.056 9.842 1.00 4.52 C ATOM 483 OD1 ASN A 49 -18.553 3.748 10.451 1.00 5.45 O ATOM 484 ND2 ASN A 49 -20.502 2.770 10.371 1.00 4.55 N ATOM 0 H ASN A 49 -18.189 5.236 7.089 1.00 2.10 H new ATOM 0 HA ASN A 49 -17.309 3.811 8.686 1.00 2.90 H new ATOM 0 HB2 ASN A 49 -19.859 2.600 7.792 1.00 3.44 H new ATOM 0 HB3 ASN A 49 -18.760 1.446 8.522 1.00 3.44 H new ATOM 0 HD21 ASN A 49 -20.743 3.128 11.295 1.00 4.55 H new ATOM 0 HD22 ASN A 49 -21.167 2.189 9.860 1.00 4.55 H new ATOM 491 N MET A 50 -17.291 1.180 6.706 1.00 1.21 N ATOM 492 CA MET A 50 -16.379 0.220 6.019 1.00 1.34 C ATOM 493 C MET A 50 -15.548 0.982 4.991 1.00 2.19 C ATOM 494 O MET A 50 -14.339 0.899 4.981 1.00 2.37 O ATOM 495 CB MET A 50 -17.211 -0.827 5.278 1.00 0.26 C ATOM 496 CG MET A 50 -17.093 -2.177 5.978 1.00 1.15 C ATOM 497 SD MET A 50 -18.655 -3.091 5.831 1.00 1.28 S ATOM 498 CE MET A 50 -19.031 -2.718 4.097 1.00 0.87 C ATOM 0 H MET A 50 -18.270 0.897 6.738 1.00 1.21 H new ATOM 0 HA MET A 50 -15.735 -0.263 6.754 1.00 1.34 H new ATOM 0 HB2 MET A 50 -18.255 -0.516 5.243 1.00 0.26 H new ATOM 0 HB3 MET A 50 -16.869 -0.912 4.246 1.00 0.26 H new ATOM 0 HG2 MET A 50 -16.281 -2.755 5.537 1.00 1.15 H new ATOM 0 HG3 MET A 50 -16.845 -2.030 7.029 1.00 1.15 H new ATOM 0 HE1 MET A 50 -19.739 -3.452 3.712 1.00 0.87 H new ATOM 0 HE2 MET A 50 -19.467 -1.721 4.025 1.00 0.87 H new ATOM 0 HE3 MET A 50 -18.114 -2.756 3.509 1.00 0.87 H new ATOM 508 N CYS A 51 -16.226 1.724 4.139 1.00 3.25 N ATOM 509 CA CYS A 51 -15.569 2.543 3.067 1.00 4.70 C ATOM 510 C CYS A 51 -16.539 2.680 1.884 1.00 6.66 C ATOM 511 O CYS A 51 -16.399 3.557 1.060 1.00 7.90 O ATOM 512 CB CYS A 51 -14.260 1.907 2.579 1.00 4.37 C ATOM 513 SG CYS A 51 -12.813 2.748 3.319 1.00 3.88 S ATOM 0 H CYS A 51 -17.243 1.796 4.146 1.00 3.25 H new ATOM 0 HA CYS A 51 -15.326 3.520 3.486 1.00 4.70 H new ATOM 0 HB2 CYS A 51 -14.245 0.849 2.841 1.00 4.37 H new ATOM 0 HB3 CYS A 51 -14.204 1.967 1.492 1.00 4.37 H new ATOM 518 N GLU A 52 -17.526 1.822 1.791 1.00 7.13 N ATOM 519 CA GLU A 52 -18.492 1.912 0.658 1.00 9.14 C ATOM 520 C GLU A 52 -19.480 3.069 0.884 1.00 8.75 C ATOM 521 O GLU A 52 -19.389 4.094 0.237 1.00 9.57 O ATOM 522 CB GLU A 52 -19.261 0.592 0.546 1.00 10.24 C ATOM 523 CG GLU A 52 -19.943 0.515 -0.818 1.00 12.20 C ATOM 524 CD GLU A 52 -21.326 -0.119 -0.659 1.00 13.36 C ATOM 525 OE1 GLU A 52 -21.383 -1.306 -0.380 1.00 13.79 O ATOM 526 OE2 GLU A 52 -22.304 0.591 -0.820 1.00 13.98 O ATOM 0 H GLU A 52 -17.702 1.065 2.451 1.00 7.13 H new ATOM 0 HA GLU A 52 -17.942 2.100 -0.264 1.00 9.14 H new ATOM 0 HB2 GLU A 52 -18.580 -0.250 0.672 1.00 10.24 H new ATOM 0 HB3 GLU A 52 -20.004 0.523 1.341 1.00 10.24 H new ATOM 0 HG2 GLU A 52 -20.035 1.512 -1.248 1.00 12.20 H new ATOM 0 HG3 GLU A 52 -19.338 -0.074 -1.507 1.00 12.20 H new ATOM 533 N SER A 53 -20.420 2.901 1.794 1.00 7.56 N ATOM 534 CA SER A 53 -21.447 3.962 2.093 1.00 7.10 C ATOM 535 C SER A 53 -22.696 3.267 2.641 1.00 7.95 C ATOM 536 O SER A 53 -23.120 3.508 3.755 1.00 7.41 O ATOM 537 CB SER A 53 -21.835 4.730 0.822 1.00 7.77 C ATOM 538 OG SER A 53 -23.094 5.359 1.021 1.00 7.57 O ATOM 0 H SER A 53 -20.520 2.054 2.354 1.00 7.56 H new ATOM 0 HA SER A 53 -21.031 4.669 2.811 1.00 7.10 H new ATOM 0 HB2 SER A 53 -21.076 5.476 0.588 1.00 7.77 H new ATOM 0 HB3 SER A 53 -21.886 4.049 -0.027 1.00 7.77 H new ATOM 0 HG SER A 53 -23.345 5.852 0.212 1.00 7.57 H new ATOM 544 N SER A 54 -23.279 2.394 1.861 1.00 9.38 N ATOM 545 CA SER A 54 -24.493 1.660 2.319 1.00 10.39 C ATOM 546 C SER A 54 -24.189 0.159 2.333 1.00 11.06 C ATOM 547 O SER A 54 -23.061 -0.253 2.146 1.00 11.27 O ATOM 548 CB SER A 54 -25.652 1.937 1.359 1.00 11.39 C ATOM 549 OG SER A 54 -25.804 3.342 1.197 1.00 11.00 O ATOM 0 H SER A 54 -22.963 2.158 0.920 1.00 9.38 H new ATOM 0 HA SER A 54 -24.769 1.992 3.320 1.00 10.39 H new ATOM 0 HB2 SER A 54 -25.460 1.467 0.394 1.00 11.39 H new ATOM 0 HB3 SER A 54 -26.573 1.503 1.748 1.00 11.39 H new ATOM 0 HG SER A 54 -26.545 3.522 0.581 1.00 11.00 H new ATOM 555 N LYS A 55 -25.178 -0.664 2.562 1.00 11.60 N ATOM 556 CA LYS A 55 -24.928 -2.133 2.596 1.00 12.25 C ATOM 557 C LYS A 55 -24.111 -2.450 3.846 1.00 10.90 C ATOM 558 O LYS A 55 -22.984 -2.900 3.777 1.00 10.89 O ATOM 559 CB LYS A 55 -24.163 -2.567 1.339 1.00 12.91 C ATOM 560 CG LYS A 55 -25.030 -3.528 0.522 1.00 14.18 C ATOM 561 CD LYS A 55 -24.844 -3.247 -0.971 1.00 15.10 C ATOM 562 CE LYS A 55 -25.810 -4.117 -1.779 1.00 16.32 C ATOM 563 NZ LYS A 55 -25.321 -4.234 -3.182 1.00 17.40 N ATOM 0 H LYS A 55 -26.145 -0.383 2.726 1.00 11.60 H new ATOM 0 HA LYS A 55 -25.874 -2.674 2.621 1.00 12.25 H new ATOM 0 HB2 LYS A 55 -23.903 -1.695 0.739 1.00 12.91 H new ATOM 0 HB3 LYS A 55 -23.228 -3.052 1.619 1.00 12.91 H new ATOM 0 HG2 LYS A 55 -24.756 -4.559 0.745 1.00 14.18 H new ATOM 0 HG3 LYS A 55 -26.078 -3.410 0.796 1.00 14.18 H new ATOM 0 HD2 LYS A 55 -25.027 -2.193 -1.179 1.00 15.10 H new ATOM 0 HD3 LYS A 55 -23.816 -3.456 -1.266 1.00 15.10 H new ATOM 0 HE2 LYS A 55 -25.890 -5.106 -1.327 1.00 16.32 H new ATOM 0 HE3 LYS A 55 -26.808 -3.679 -1.766 1.00 16.32 H new ATOM 0 HZ1 LYS A 55 -25.978 -4.825 -3.730 1.00 17.40 H new ATOM 0 HZ2 LYS A 55 -25.266 -3.288 -3.611 1.00 17.40 H new ATOM 0 HZ3 LYS A 55 -24.377 -4.671 -3.185 1.00 17.40 H new ATOM 577 N GLU A 56 -24.679 -2.203 4.991 1.00 9.90 N ATOM 578 CA GLU A 56 -23.963 -2.464 6.263 1.00 8.75 C ATOM 579 C GLU A 56 -22.699 -1.622 6.337 1.00 7.34 C ATOM 580 O GLU A 56 -22.493 -0.717 5.553 1.00 7.80 O ATOM 581 CB GLU A 56 -23.600 -3.940 6.365 1.00 8.75 C ATOM 582 CG GLU A 56 -24.349 -4.528 7.550 1.00 8.13 C ATOM 583 CD GLU A 56 -24.240 -6.053 7.527 1.00 8.56 C ATOM 584 OE1 GLU A 56 -23.134 -6.549 7.662 1.00 8.27 O ATOM 585 OE2 GLU A 56 -25.264 -6.699 7.373 1.00 9.23 O ATOM 0 H GLU A 56 -25.621 -1.827 5.098 1.00 9.90 H new ATOM 0 HA GLU A 56 -24.618 -2.197 7.092 1.00 8.75 H new ATOM 0 HB2 GLU A 56 -23.869 -4.463 5.447 1.00 8.75 H new ATOM 0 HB3 GLU A 56 -22.525 -4.060 6.497 1.00 8.75 H new ATOM 0 HG2 GLU A 56 -23.937 -4.139 8.481 1.00 8.13 H new ATOM 0 HG3 GLU A 56 -25.396 -4.229 7.515 1.00 8.13 H new ATOM 592 N ALA A 57 -21.858 -1.903 7.289 1.00 5.73 N ATOM 593 CA ALA A 57 -20.617 -1.106 7.430 1.00 4.41 C ATOM 594 C ALA A 57 -19.683 -1.772 8.444 1.00 3.81 C ATOM 595 O ALA A 57 -18.909 -1.117 9.113 1.00 3.58 O ATOM 596 CB ALA A 57 -21.001 0.287 7.914 1.00 4.06 C ATOM 0 H ALA A 57 -21.978 -2.649 7.974 1.00 5.73 H new ATOM 0 HA ALA A 57 -20.098 -1.042 6.473 1.00 4.41 H new ATOM 0 HB1 ALA A 57 -20.103 0.894 8.026 1.00 4.06 H new ATOM 0 HB2 ALA A 57 -21.666 0.754 7.188 1.00 4.06 H new ATOM 0 HB3 ALA A 57 -21.509 0.211 8.875 1.00 4.06 H new ATOM 602 N LEU A 58 -19.745 -3.070 8.555 1.00 3.70 N ATOM 603 CA LEU A 58 -18.856 -3.780 9.515 1.00 3.19 C ATOM 604 C LEU A 58 -17.720 -4.469 8.733 1.00 2.77 C ATOM 605 O LEU A 58 -16.846 -3.810 8.209 1.00 2.31 O ATOM 606 CB LEU A 58 -19.681 -4.802 10.305 1.00 3.14 C ATOM 607 CG LEU A 58 -20.785 -4.076 11.074 1.00 3.59 C ATOM 608 CD1 LEU A 58 -22.017 -4.978 11.173 1.00 3.96 C ATOM 609 CD2 LEU A 58 -20.286 -3.735 12.480 1.00 3.29 C ATOM 0 H LEU A 58 -20.374 -3.670 8.021 1.00 3.70 H new ATOM 0 HA LEU A 58 -18.415 -3.075 10.220 1.00 3.19 H new ATOM 0 HB2 LEU A 58 -20.117 -5.536 9.627 1.00 3.14 H new ATOM 0 HB3 LEU A 58 -19.039 -5.348 10.996 1.00 3.14 H new ATOM 0 HG LEU A 58 -21.050 -3.158 10.550 1.00 3.59 H new ATOM 0 HD11 LEU A 58 -22.804 -4.460 11.721 1.00 3.96 H new ATOM 0 HD12 LEU A 58 -22.372 -5.220 10.171 1.00 3.96 H new ATOM 0 HD13 LEU A 58 -21.754 -5.897 11.697 1.00 3.96 H new ATOM 0 HD21 LEU A 58 -21.072 -3.217 13.029 1.00 3.29 H new ATOM 0 HD22 LEU A 58 -20.021 -4.653 13.005 1.00 3.29 H new ATOM 0 HD23 LEU A 58 -19.409 -3.092 12.409 1.00 3.29 H new ATOM 621 N ALA A 59 -17.712 -5.778 8.634 1.00 3.40 N ATOM 622 CA ALA A 59 -16.621 -6.449 7.868 1.00 3.10 C ATOM 623 C ALA A 59 -16.790 -7.966 7.937 1.00 3.96 C ATOM 624 O ALA A 59 -16.344 -8.605 8.870 1.00 4.33 O ATOM 625 CB ALA A 59 -15.259 -6.069 8.455 1.00 2.36 C ATOM 0 H ALA A 59 -18.406 -6.402 9.046 1.00 3.40 H new ATOM 0 HA ALA A 59 -16.674 -6.124 6.829 1.00 3.10 H new ATOM 0 HB1 ALA A 59 -14.469 -6.563 7.890 1.00 2.36 H new ATOM 0 HB2 ALA A 59 -15.126 -4.989 8.396 1.00 2.36 H new ATOM 0 HB3 ALA A 59 -15.211 -6.384 9.497 1.00 2.36 H new ATOM 631 N GLU A 60 -17.411 -8.556 6.955 1.00 4.44 N ATOM 632 CA GLU A 60 -17.578 -10.034 6.974 1.00 5.24 C ATOM 633 C GLU A 60 -16.312 -10.675 6.399 1.00 4.28 C ATOM 634 O GLU A 60 -15.946 -11.781 6.743 1.00 4.15 O ATOM 635 CB GLU A 60 -18.788 -10.422 6.123 1.00 6.46 C ATOM 636 CG GLU A 60 -19.475 -11.640 6.743 1.00 7.61 C ATOM 637 CD GLU A 60 -20.498 -12.206 5.757 1.00 8.76 C ATOM 638 OE1 GLU A 60 -20.082 -12.722 4.733 1.00 8.70 O ATOM 639 OE2 GLU A 60 -21.680 -12.116 6.043 1.00 9.83 O ATOM 0 H GLU A 60 -17.808 -8.081 6.144 1.00 4.44 H new ATOM 0 HA GLU A 60 -17.738 -10.381 7.995 1.00 5.24 H new ATOM 0 HB2 GLU A 60 -19.487 -9.588 6.063 1.00 6.46 H new ATOM 0 HB3 GLU A 60 -18.473 -10.648 5.104 1.00 6.46 H new ATOM 0 HG2 GLU A 60 -18.735 -12.401 6.992 1.00 7.61 H new ATOM 0 HG3 GLU A 60 -19.968 -11.358 7.673 1.00 7.61 H new ATOM 646 N ASN A 61 -15.638 -9.973 5.529 1.00 3.61 N ATOM 647 CA ASN A 61 -14.385 -10.507 4.924 1.00 2.63 C ATOM 648 C ASN A 61 -13.484 -9.327 4.553 1.00 2.87 C ATOM 649 O ASN A 61 -13.961 -8.252 4.253 1.00 4.18 O ATOM 650 CB ASN A 61 -14.725 -11.308 3.664 1.00 3.27 C ATOM 651 CG ASN A 61 -14.717 -12.803 3.986 1.00 3.49 C ATOM 652 OD1 ASN A 61 -14.279 -13.207 5.044 1.00 3.42 O ATOM 653 ND2 ASN A 61 -15.187 -13.649 3.110 1.00 4.28 N ATOM 0 H ASN A 61 -15.905 -9.042 5.208 1.00 3.61 H new ATOM 0 HA ASN A 61 -13.875 -11.159 5.633 1.00 2.63 H new ATOM 0 HB2 ASN A 61 -15.704 -11.013 3.287 1.00 3.27 H new ATOM 0 HB3 ASN A 61 -14.002 -11.092 2.878 1.00 3.27 H new ATOM 0 HD21 ASN A 61 -15.186 -14.648 3.315 1.00 4.28 H new ATOM 0 HD22 ASN A 61 -15.555 -13.311 2.221 1.00 4.28 H new ATOM 660 N ASN A 62 -12.190 -9.503 4.583 1.00 2.31 N ATOM 661 CA ASN A 62 -11.289 -8.361 4.238 1.00 2.68 C ATOM 662 C ASN A 62 -10.035 -8.871 3.520 1.00 1.71 C ATOM 663 O ASN A 62 -8.930 -8.555 3.909 1.00 1.57 O ATOM 664 CB ASN A 62 -10.871 -7.625 5.520 1.00 3.23 C ATOM 665 CG ASN A 62 -12.044 -7.574 6.505 1.00 3.76 C ATOM 666 OD1 ASN A 62 -12.623 -6.529 6.727 1.00 4.28 O ATOM 667 ND2 ASN A 62 -12.420 -8.668 7.110 1.00 3.94 N ATOM 0 H ASN A 62 -11.721 -10.375 4.828 1.00 2.31 H new ATOM 0 HA ASN A 62 -11.827 -7.679 3.579 1.00 2.68 H new ATOM 0 HB2 ASN A 62 -10.022 -8.132 5.979 1.00 3.23 H new ATOM 0 HB3 ASN A 62 -10.545 -6.613 5.278 1.00 3.23 H new ATOM 0 HD21 ASN A 62 -13.199 -8.645 7.768 1.00 3.94 H new ATOM 0 HD22 ASN A 62 -11.935 -9.546 6.925 1.00 3.94 H new ATOM 674 N LEU A 63 -10.209 -9.645 2.467 1.00 2.21 N ATOM 675 CA LEU A 63 -9.042 -10.189 1.682 1.00 1.57 C ATOM 676 C LEU A 63 -7.886 -10.574 2.612 1.00 1.42 C ATOM 677 O LEU A 63 -8.080 -10.784 3.794 1.00 1.82 O ATOM 678 CB LEU A 63 -8.557 -9.179 0.616 1.00 1.69 C ATOM 679 CG LEU A 63 -9.050 -7.762 0.897 1.00 0.69 C ATOM 680 CD1 LEU A 63 -8.106 -7.080 1.884 1.00 1.93 C ATOM 681 CD2 LEU A 63 -9.050 -6.985 -0.412 1.00 1.01 C ATOM 0 H LEU A 63 -11.123 -9.927 2.113 1.00 2.21 H new ATOM 0 HA LEU A 63 -9.387 -11.085 1.167 1.00 1.57 H new ATOM 0 HB2 LEU A 63 -7.467 -9.183 0.584 1.00 1.69 H new ATOM 0 HB3 LEU A 63 -8.906 -9.495 -0.367 1.00 1.69 H new ATOM 0 HG LEU A 63 -10.054 -7.793 1.321 1.00 0.69 H new ATOM 0 HD11 LEU A 63 -8.458 -6.068 2.084 1.00 1.93 H new ATOM 0 HD12 LEU A 63 -8.081 -7.647 2.815 1.00 1.93 H new ATOM 0 HD13 LEU A 63 -7.103 -7.037 1.458 1.00 1.93 H new ATOM 0 HD21 LEU A 63 -9.400 -5.968 -0.232 1.00 1.01 H new ATOM 0 HD22 LEU A 63 -8.038 -6.954 -0.817 1.00 1.01 H new ATOM 0 HD23 LEU A 63 -9.712 -7.475 -1.126 1.00 1.01 H new ATOM 693 N ASN A 64 -6.687 -10.690 2.100 1.00 1.37 N ATOM 694 CA ASN A 64 -5.555 -11.074 2.984 1.00 1.98 C ATOM 695 C ASN A 64 -4.252 -10.564 2.379 1.00 1.84 C ATOM 696 O ASN A 64 -3.318 -11.309 2.158 1.00 2.27 O ATOM 697 CB ASN A 64 -5.477 -12.598 3.146 1.00 2.92 C ATOM 698 CG ASN A 64 -6.797 -13.274 2.748 1.00 3.31 C ATOM 699 OD1 ASN A 64 -7.527 -13.755 3.592 1.00 4.27 O ATOM 700 ND2 ASN A 64 -7.132 -13.331 1.488 1.00 2.94 N ATOM 0 H ASN A 64 -6.448 -10.537 1.120 1.00 1.37 H new ATOM 0 HA ASN A 64 -5.715 -10.630 3.967 1.00 1.98 H new ATOM 0 HB2 ASN A 64 -4.667 -12.989 2.531 1.00 2.92 H new ATOM 0 HB3 ASN A 64 -5.239 -12.843 4.181 1.00 2.92 H new ATOM 0 HD21 ASN A 64 -8.006 -13.779 1.212 1.00 2.94 H new ATOM 0 HD22 ASN A 64 -6.520 -12.928 0.779 1.00 2.94 H new ATOM 707 N LEU A 65 -4.192 -9.295 2.106 1.00 1.34 N ATOM 708 CA LEU A 65 -2.961 -8.710 1.507 1.00 1.21 C ATOM 709 C LEU A 65 -2.005 -8.036 2.537 1.00 1.10 C ATOM 710 O LEU A 65 -0.905 -7.689 2.155 1.00 0.18 O ATOM 711 CB LEU A 65 -3.375 -7.677 0.462 1.00 1.07 C ATOM 712 CG LEU A 65 -4.035 -6.485 1.152 1.00 0.88 C ATOM 713 CD1 LEU A 65 -3.030 -5.341 1.244 1.00 0.70 C ATOM 714 CD2 LEU A 65 -5.249 -6.031 0.341 1.00 0.99 C ATOM 0 H LEU A 65 -4.948 -8.631 2.273 1.00 1.34 H new ATOM 0 HA LEU A 65 -2.401 -9.537 1.070 1.00 1.21 H new ATOM 0 HB2 LEU A 65 -2.503 -7.346 -0.102 1.00 1.07 H new ATOM 0 HB3 LEU A 65 -4.066 -8.125 -0.252 1.00 1.07 H new ATOM 0 HG LEU A 65 -4.357 -6.774 2.152 1.00 0.88 H new ATOM 0 HD11 LEU A 65 -3.495 -4.487 1.736 1.00 0.70 H new ATOM 0 HD12 LEU A 65 -2.163 -5.664 1.820 1.00 0.70 H new ATOM 0 HD13 LEU A 65 -2.713 -5.054 0.241 1.00 0.70 H new ATOM 0 HD21 LEU A 65 -5.719 -5.180 0.835 1.00 0.99 H new ATOM 0 HD22 LEU A 65 -4.930 -5.739 -0.659 1.00 0.99 H new ATOM 0 HD23 LEU A 65 -5.965 -6.850 0.269 1.00 0.99 H new ATOM 726 N PRO A 66 -2.391 -7.844 3.796 1.00 2.18 N ATOM 727 CA PRO A 66 -1.484 -7.198 4.764 1.00 2.40 C ATOM 728 C PRO A 66 -0.380 -8.161 5.215 1.00 2.10 C ATOM 729 O PRO A 66 -0.570 -8.979 6.092 1.00 3.34 O ATOM 730 CB PRO A 66 -2.396 -6.815 5.933 1.00 3.78 C ATOM 731 CG PRO A 66 -3.632 -7.733 5.836 1.00 4.31 C ATOM 732 CD PRO A 66 -3.699 -8.226 4.380 1.00 3.35 C ATOM 0 HA PRO A 66 -0.967 -6.337 4.340 1.00 2.40 H new ATOM 0 HB2 PRO A 66 -1.885 -6.951 6.886 1.00 3.78 H new ATOM 0 HB3 PRO A 66 -2.685 -5.766 5.873 1.00 3.78 H new ATOM 0 HG2 PRO A 66 -3.546 -8.573 6.526 1.00 4.31 H new ATOM 0 HG3 PRO A 66 -4.539 -7.191 6.104 1.00 4.31 H new ATOM 0 HD2 PRO A 66 -3.855 -9.304 4.333 1.00 3.35 H new ATOM 0 HD3 PRO A 66 -4.525 -7.761 3.841 1.00 3.35 H new ATOM 740 N LYS A 67 0.780 -8.056 4.623 1.00 0.99 N ATOM 741 CA LYS A 67 1.909 -8.948 5.013 1.00 1.09 C ATOM 742 C LYS A 67 3.141 -8.087 5.304 1.00 0.64 C ATOM 743 O LYS A 67 4.107 -8.093 4.567 1.00 0.86 O ATOM 744 CB LYS A 67 2.220 -9.910 3.867 1.00 1.77 C ATOM 745 CG LYS A 67 1.818 -11.331 4.268 1.00 2.54 C ATOM 746 CD LYS A 67 0.315 -11.513 4.054 1.00 3.01 C ATOM 747 CE LYS A 67 -0.148 -12.802 4.737 1.00 3.72 C ATOM 748 NZ LYS A 67 -1.322 -12.510 5.607 1.00 4.44 N ATOM 0 H LYS A 67 0.994 -7.388 3.883 1.00 0.99 H new ATOM 0 HA LYS A 67 1.638 -9.521 5.900 1.00 1.09 H new ATOM 0 HB2 LYS A 67 1.681 -9.608 2.969 1.00 1.77 H new ATOM 0 HB3 LYS A 67 3.283 -9.875 3.628 1.00 1.77 H new ATOM 0 HG2 LYS A 67 2.372 -12.059 3.675 1.00 2.54 H new ATOM 0 HG3 LYS A 67 2.072 -11.512 5.312 1.00 2.54 H new ATOM 0 HD2 LYS A 67 -0.227 -10.659 4.461 1.00 3.01 H new ATOM 0 HD3 LYS A 67 0.091 -11.554 2.988 1.00 3.01 H new ATOM 0 HE2 LYS A 67 -0.414 -13.548 3.988 1.00 3.72 H new ATOM 0 HE3 LYS A 67 0.663 -13.223 5.332 1.00 3.72 H new ATOM 0 HZ1 LYS A 67 -1.637 -13.386 6.071 1.00 4.44 H new ATOM 0 HZ2 LYS A 67 -1.053 -11.812 6.330 1.00 4.44 H new ATOM 0 HZ3 LYS A 67 -2.097 -12.128 5.028 1.00 4.44 H new ATOM 762 N MET A 68 3.105 -7.336 6.368 1.00 0.56 N ATOM 763 CA MET A 68 4.264 -6.460 6.707 1.00 1.11 C ATOM 764 C MET A 68 5.333 -7.261 7.427 1.00 1.86 C ATOM 765 O MET A 68 5.174 -8.430 7.713 1.00 2.45 O ATOM 766 CB MET A 68 3.795 -5.312 7.604 1.00 0.87 C ATOM 767 CG MET A 68 4.589 -4.044 7.274 1.00 1.40 C ATOM 768 SD MET A 68 5.620 -3.580 8.688 1.00 1.40 S ATOM 769 CE MET A 68 6.759 -2.497 7.790 1.00 0.67 C ATOM 0 H MET A 68 2.322 -7.290 7.020 1.00 0.56 H new ATOM 0 HA MET A 68 4.683 -6.056 5.785 1.00 1.11 H new ATOM 0 HB2 MET A 68 2.730 -5.134 7.457 1.00 0.87 H new ATOM 0 HB3 MET A 68 3.933 -5.577 8.652 1.00 0.87 H new ATOM 0 HG2 MET A 68 5.214 -4.213 6.397 1.00 1.40 H new ATOM 0 HG3 MET A 68 3.907 -3.231 7.027 1.00 1.40 H new ATOM 0 HE1 MET A 68 7.577 -2.204 8.448 1.00 0.67 H new ATOM 0 HE2 MET A 68 7.160 -3.027 6.926 1.00 0.67 H new ATOM 0 HE3 MET A 68 6.227 -1.607 7.455 1.00 0.67 H new ATOM 779 N ALA A 69 6.434 -6.632 7.707 1.00 2.65 N ATOM 780 CA ALA A 69 7.536 -7.324 8.388 1.00 3.84 C ATOM 781 C ALA A 69 7.542 -6.929 9.862 1.00 2.84 C ATOM 782 O ALA A 69 8.582 -6.768 10.460 1.00 2.51 O ATOM 783 CB ALA A 69 8.849 -6.908 7.727 1.00 5.90 C ATOM 0 H ALA A 69 6.612 -5.652 7.486 1.00 2.65 H new ATOM 0 HA ALA A 69 7.414 -8.405 8.313 1.00 3.84 H new ATOM 0 HB1 ALA A 69 9.680 -7.412 8.220 1.00 5.90 H new ATOM 0 HB2 ALA A 69 8.830 -7.185 6.673 1.00 5.90 H new ATOM 0 HB3 ALA A 69 8.975 -5.829 7.816 1.00 5.90 H new ATOM 789 N GLU A 70 6.386 -6.778 10.461 1.00 2.98 N ATOM 790 CA GLU A 70 6.335 -6.400 11.907 1.00 2.94 C ATOM 791 C GLU A 70 7.261 -7.322 12.694 1.00 2.36 C ATOM 792 O GLU A 70 8.276 -6.906 13.216 1.00 2.43 O ATOM 793 CB GLU A 70 4.905 -6.550 12.429 1.00 4.06 C ATOM 794 CG GLU A 70 4.092 -5.311 12.050 1.00 5.54 C ATOM 795 CD GLU A 70 2.602 -5.604 12.233 1.00 6.36 C ATOM 796 OE1 GLU A 70 2.246 -6.771 12.255 1.00 6.50 O ATOM 797 OE2 GLU A 70 1.842 -4.657 12.347 1.00 7.01 O ATOM 0 H GLU A 70 5.478 -6.900 10.012 1.00 2.98 H new ATOM 0 HA GLU A 70 6.653 -5.364 12.026 1.00 2.94 H new ATOM 0 HB2 GLU A 70 4.444 -7.443 12.008 1.00 4.06 H new ATOM 0 HB3 GLU A 70 4.913 -6.676 13.512 1.00 4.06 H new ATOM 0 HG2 GLU A 70 4.386 -4.465 12.672 1.00 5.54 H new ATOM 0 HG3 GLU A 70 4.295 -5.032 11.016 1.00 5.54 H new ATOM 804 N LYS A 71 6.933 -8.577 12.756 1.00 2.12 N ATOM 805 CA LYS A 71 7.806 -9.532 13.477 1.00 2.44 C ATOM 806 C LYS A 71 8.825 -10.125 12.496 1.00 1.79 C ATOM 807 O LYS A 71 9.597 -10.996 12.847 1.00 2.40 O ATOM 808 CB LYS A 71 6.952 -10.650 14.077 1.00 3.21 C ATOM 809 CG LYS A 71 6.152 -11.336 12.967 1.00 3.26 C ATOM 810 CD LYS A 71 6.486 -12.829 12.941 1.00 2.60 C ATOM 811 CE LYS A 71 6.834 -13.247 11.511 1.00 1.57 C ATOM 812 NZ LYS A 71 6.926 -14.734 11.428 1.00 0.62 N ATOM 0 H LYS A 71 6.096 -8.983 12.337 1.00 2.12 H new ATOM 0 HA LYS A 71 8.334 -9.016 14.279 1.00 2.44 H new ATOM 0 HB2 LYS A 71 7.588 -11.376 14.583 1.00 3.21 H new ATOM 0 HB3 LYS A 71 6.275 -10.242 14.828 1.00 3.21 H new ATOM 0 HG2 LYS A 71 5.084 -11.195 13.134 1.00 3.26 H new ATOM 0 HG3 LYS A 71 6.386 -10.884 12.003 1.00 3.26 H new ATOM 0 HD2 LYS A 71 7.324 -13.037 13.607 1.00 2.60 H new ATOM 0 HD3 LYS A 71 5.638 -13.409 13.305 1.00 2.60 H new ATOM 0 HE2 LYS A 71 6.074 -12.881 10.820 1.00 1.57 H new ATOM 0 HE3 LYS A 71 7.781 -12.797 11.211 1.00 1.57 H new ATOM 0 HZ1 LYS A 71 7.163 -15.013 10.455 1.00 0.62 H new ATOM 0 HZ2 LYS A 71 7.666 -15.073 12.075 1.00 0.62 H new ATOM 0 HZ3 LYS A 71 6.013 -15.154 11.696 1.00 0.62 H new ATOM 826 N ASP A 72 8.842 -9.662 11.269 1.00 0.94 N ATOM 827 CA ASP A 72 9.819 -10.210 10.288 1.00 1.40 C ATOM 828 C ASP A 72 11.177 -9.541 10.490 1.00 1.47 C ATOM 829 O ASP A 72 12.130 -10.171 10.902 1.00 2.64 O ATOM 830 CB ASP A 72 9.317 -9.965 8.864 1.00 1.34 C ATOM 831 CG ASP A 72 9.872 -11.045 7.934 1.00 2.24 C ATOM 832 OD1 ASP A 72 9.895 -12.196 8.340 1.00 2.87 O ATOM 833 OD2 ASP A 72 10.265 -10.704 6.830 1.00 2.62 O ATOM 0 H ASP A 72 8.225 -8.934 10.910 1.00 0.94 H new ATOM 0 HA ASP A 72 9.925 -11.284 10.443 1.00 1.40 H new ATOM 0 HB2 ASP A 72 8.227 -9.978 8.844 1.00 1.34 H new ATOM 0 HB3 ASP A 72 9.630 -8.979 8.521 1.00 1.34 H new ATOM 838 N GLY A 73 11.277 -8.273 10.212 1.00 0.86 N ATOM 839 CA GLY A 73 12.587 -7.584 10.403 1.00 1.32 C ATOM 840 C GLY A 73 12.414 -6.082 10.195 1.00 1.25 C ATOM 841 O GLY A 73 13.311 -5.403 9.745 1.00 1.54 O ATOM 0 H GLY A 73 10.518 -7.686 9.864 1.00 0.86 H new ATOM 0 HA2 GLY A 73 12.969 -7.780 11.405 1.00 1.32 H new ATOM 0 HA3 GLY A 73 13.321 -7.976 9.699 1.00 1.32 H new ATOM 845 N CYS A 74 11.266 -5.563 10.523 1.00 0.91 N ATOM 846 CA CYS A 74 11.029 -4.098 10.343 1.00 0.84 C ATOM 847 C CYS A 74 10.936 -3.413 11.706 1.00 0.91 C ATOM 848 O CYS A 74 11.182 -2.230 11.833 1.00 1.57 O ATOM 849 CB CYS A 74 9.710 -3.874 9.597 1.00 0.76 C ATOM 850 SG CYS A 74 9.987 -3.920 7.808 1.00 1.02 S ATOM 0 H CYS A 74 10.479 -6.086 10.908 1.00 0.91 H new ATOM 0 HA CYS A 74 11.858 -3.679 9.773 1.00 0.84 H new ATOM 0 HB2 CYS A 74 8.989 -4.641 9.880 1.00 0.76 H new ATOM 0 HB3 CYS A 74 9.282 -2.913 9.881 1.00 0.76 H new ATOM 855 N PHE A 75 10.561 -4.136 12.724 1.00 0.71 N ATOM 856 CA PHE A 75 10.430 -3.510 14.068 1.00 0.62 C ATOM 857 C PHE A 75 11.640 -3.870 14.935 1.00 0.76 C ATOM 858 O PHE A 75 12.568 -4.514 14.486 1.00 1.18 O ATOM 859 CB PHE A 75 9.141 -4.004 14.728 1.00 0.40 C ATOM 860 CG PHE A 75 7.958 -3.275 14.125 1.00 0.34 C ATOM 861 CD1 PHE A 75 7.733 -3.318 12.741 1.00 1.31 C ATOM 862 CD2 PHE A 75 7.090 -2.552 14.950 1.00 1.85 C ATOM 863 CE1 PHE A 75 6.640 -2.639 12.188 1.00 1.04 C ATOM 864 CE2 PHE A 75 5.998 -1.873 14.396 1.00 2.32 C ATOM 865 CZ PHE A 75 5.772 -1.917 13.015 1.00 1.21 C ATOM 0 H PHE A 75 10.340 -5.131 12.683 1.00 0.71 H new ATOM 0 HA PHE A 75 10.390 -2.426 13.963 1.00 0.62 H new ATOM 0 HB2 PHE A 75 9.033 -5.079 14.582 1.00 0.40 H new ATOM 0 HB3 PHE A 75 9.180 -3.830 15.803 1.00 0.40 H new ATOM 0 HD1 PHE A 75 8.403 -3.875 12.102 1.00 1.31 H new ATOM 0 HD2 PHE A 75 7.262 -2.517 16.016 1.00 1.85 H new ATOM 0 HE1 PHE A 75 6.467 -2.673 11.123 1.00 1.04 H new ATOM 0 HE2 PHE A 75 5.329 -1.315 15.035 1.00 2.32 H new ATOM 0 HZ PHE A 75 4.929 -1.394 12.588 1.00 1.21 H new ATOM 875 N GLN A 76 11.644 -3.446 16.170 1.00 0.43 N ATOM 876 CA GLN A 76 12.801 -3.745 17.064 1.00 0.56 C ATOM 877 C GLN A 76 12.805 -5.226 17.460 1.00 0.68 C ATOM 878 O GLN A 76 13.784 -5.730 17.975 1.00 0.77 O ATOM 879 CB GLN A 76 12.699 -2.883 18.325 1.00 0.45 C ATOM 880 CG GLN A 76 13.989 -2.079 18.502 1.00 0.84 C ATOM 881 CD GLN A 76 13.645 -0.627 18.838 1.00 1.40 C ATOM 882 OE1 GLN A 76 14.368 0.280 18.475 1.00 2.56 O ATOM 883 NE2 GLN A 76 12.566 -0.365 19.523 1.00 1.27 N ATOM 0 H GLN A 76 10.894 -2.904 16.600 1.00 0.43 H new ATOM 0 HA GLN A 76 13.726 -3.522 16.532 1.00 0.56 H new ATOM 0 HB2 GLN A 76 11.846 -2.209 18.249 1.00 0.45 H new ATOM 0 HB3 GLN A 76 12.530 -3.515 19.197 1.00 0.45 H new ATOM 0 HG2 GLN A 76 14.594 -2.514 19.297 1.00 0.84 H new ATOM 0 HG3 GLN A 76 14.584 -2.121 17.590 1.00 0.84 H new ATOM 0 HE21 GLN A 76 11.958 -1.125 19.828 1.00 1.27 H new ATOM 0 HE22 GLN A 76 12.330 0.600 19.753 1.00 1.27 H new ATOM 892 N SER A 77 11.732 -5.930 17.230 1.00 0.87 N ATOM 893 CA SER A 77 11.703 -7.373 17.603 1.00 1.10 C ATOM 894 C SER A 77 12.785 -8.127 16.824 1.00 1.01 C ATOM 895 O SER A 77 13.226 -9.187 17.222 1.00 1.76 O ATOM 896 CB SER A 77 10.332 -7.961 17.274 1.00 1.44 C ATOM 897 OG SER A 77 9.354 -6.931 17.333 1.00 2.39 O ATOM 0 H SER A 77 10.878 -5.572 16.802 1.00 0.87 H new ATOM 0 HA SER A 77 11.891 -7.473 18.672 1.00 1.10 H new ATOM 0 HB2 SER A 77 10.345 -8.410 16.281 1.00 1.44 H new ATOM 0 HB3 SER A 77 10.085 -8.754 17.979 1.00 1.44 H new ATOM 0 HG SER A 77 8.473 -7.304 17.121 1.00 2.39 H new ATOM 903 N GLY A 78 13.217 -7.588 15.718 1.00 1.30 N ATOM 904 CA GLY A 78 14.270 -8.269 14.913 1.00 1.03 C ATOM 905 C GLY A 78 14.650 -7.378 13.733 1.00 0.88 C ATOM 906 O GLY A 78 14.761 -7.827 12.610 1.00 0.94 O ATOM 0 H GLY A 78 12.885 -6.702 15.336 1.00 1.30 H new ATOM 0 HA2 GLY A 78 15.146 -8.469 15.531 1.00 1.03 H new ATOM 0 HA3 GLY A 78 13.906 -9.232 14.555 1.00 1.03 H new ATOM 910 N PHE A 79 14.852 -6.115 13.982 1.00 0.79 N ATOM 911 CA PHE A 79 15.223 -5.182 12.886 1.00 0.74 C ATOM 912 C PHE A 79 16.508 -5.667 12.210 1.00 0.72 C ATOM 913 O PHE A 79 17.599 -5.435 12.692 1.00 0.49 O ATOM 914 CB PHE A 79 15.443 -3.794 13.484 1.00 0.64 C ATOM 915 CG PHE A 79 15.338 -2.747 12.403 1.00 0.56 C ATOM 916 CD1 PHE A 79 14.234 -2.739 11.542 1.00 0.84 C ATOM 917 CD2 PHE A 79 16.342 -1.783 12.262 1.00 0.31 C ATOM 918 CE1 PHE A 79 14.132 -1.764 10.543 1.00 0.77 C ATOM 919 CE2 PHE A 79 16.240 -0.808 11.263 1.00 0.24 C ATOM 920 CZ PHE A 79 15.136 -0.799 10.402 1.00 0.42 C ATOM 0 H PHE A 79 14.775 -5.687 14.905 1.00 0.79 H new ATOM 0 HA PHE A 79 14.428 -5.143 12.141 1.00 0.74 H new ATOM 0 HB2 PHE A 79 14.704 -3.602 14.261 1.00 0.64 H new ATOM 0 HB3 PHE A 79 16.424 -3.744 13.957 1.00 0.64 H new ATOM 0 HD1 PHE A 79 13.461 -3.485 11.649 1.00 0.84 H new ATOM 0 HD2 PHE A 79 17.195 -1.791 12.924 1.00 0.31 H new ATOM 0 HE1 PHE A 79 13.279 -1.756 9.881 1.00 0.77 H new ATOM 0 HE2 PHE A 79 17.014 -0.062 11.156 1.00 0.24 H new ATOM 0 HZ PHE A 79 15.059 -0.048 9.630 1.00 0.42 H new ATOM 930 N ASN A 80 16.388 -6.340 11.096 1.00 1.16 N ATOM 931 CA ASN A 80 17.604 -6.840 10.394 1.00 1.34 C ATOM 932 C ASN A 80 17.967 -5.904 9.237 1.00 1.57 C ATOM 933 O ASN A 80 18.769 -6.240 8.391 1.00 2.95 O ATOM 934 CB ASN A 80 17.341 -8.247 9.854 1.00 1.63 C ATOM 935 CG ASN A 80 18.389 -9.212 10.412 1.00 1.88 C ATOM 936 OD1 ASN A 80 18.403 -9.497 11.594 1.00 2.25 O ATOM 937 ND2 ASN A 80 19.274 -9.731 9.606 1.00 2.38 N ATOM 0 H ASN A 80 15.502 -6.564 10.643 1.00 1.16 H new ATOM 0 HA ASN A 80 18.435 -6.870 11.099 1.00 1.34 H new ATOM 0 HB2 ASN A 80 16.341 -8.576 10.137 1.00 1.63 H new ATOM 0 HB3 ASN A 80 17.378 -8.243 8.765 1.00 1.63 H new ATOM 0 HD21 ASN A 80 19.977 -10.375 9.967 1.00 2.38 H new ATOM 0 HD22 ASN A 80 19.263 -9.492 8.614 1.00 2.38 H new ATOM 944 N GLU A 81 17.397 -4.729 9.204 1.00 0.78 N ATOM 945 CA GLU A 81 17.717 -3.756 8.118 1.00 0.78 C ATOM 946 C GLU A 81 17.336 -4.324 6.741 1.00 0.81 C ATOM 947 O GLU A 81 16.256 -4.081 6.240 1.00 1.03 O ATOM 948 CB GLU A 81 19.213 -3.434 8.148 1.00 0.88 C ATOM 949 CG GLU A 81 19.559 -2.727 9.459 1.00 0.97 C ATOM 950 CD GLU A 81 21.025 -2.988 9.806 1.00 1.63 C ATOM 951 OE1 GLU A 81 21.817 -3.118 8.886 1.00 1.72 O ATOM 952 OE2 GLU A 81 21.332 -3.056 10.985 1.00 2.11 O ATOM 0 H GLU A 81 16.717 -4.398 9.889 1.00 0.78 H new ATOM 0 HA GLU A 81 17.139 -2.847 8.285 1.00 0.78 H new ATOM 0 HB2 GLU A 81 19.795 -4.351 8.053 1.00 0.88 H new ATOM 0 HB3 GLU A 81 19.476 -2.800 7.301 1.00 0.88 H new ATOM 0 HG2 GLU A 81 19.381 -1.656 9.365 1.00 0.97 H new ATOM 0 HG3 GLU A 81 18.914 -3.088 10.261 1.00 0.97 H new ATOM 959 N GLU A 82 18.221 -5.056 6.115 1.00 0.64 N ATOM 960 CA GLU A 82 17.925 -5.615 4.764 1.00 0.64 C ATOM 961 C GLU A 82 16.644 -6.457 4.792 1.00 0.67 C ATOM 962 O GLU A 82 16.027 -6.685 3.772 1.00 0.70 O ATOM 963 CB GLU A 82 19.100 -6.489 4.317 1.00 0.62 C ATOM 964 CG GLU A 82 18.878 -6.954 2.876 1.00 0.74 C ATOM 965 CD GLU A 82 18.814 -8.481 2.837 1.00 1.30 C ATOM 966 OE1 GLU A 82 18.157 -9.048 3.694 1.00 1.80 O ATOM 967 OE2 GLU A 82 19.425 -9.058 1.952 1.00 1.38 O ATOM 0 H GLU A 82 19.142 -5.291 6.485 1.00 0.64 H new ATOM 0 HA GLU A 82 17.781 -4.791 4.065 1.00 0.64 H new ATOM 0 HB2 GLU A 82 20.031 -5.927 4.389 1.00 0.62 H new ATOM 0 HB3 GLU A 82 19.196 -7.351 4.977 1.00 0.62 H new ATOM 0 HG2 GLU A 82 17.953 -6.531 2.484 1.00 0.74 H new ATOM 0 HG3 GLU A 82 19.687 -6.597 2.239 1.00 0.74 H new ATOM 974 N THR A 83 16.231 -6.918 5.941 1.00 0.68 N ATOM 975 CA THR A 83 14.988 -7.735 6.001 1.00 0.73 C ATOM 976 C THR A 83 13.787 -6.805 5.862 1.00 0.60 C ATOM 977 O THR A 83 12.800 -7.132 5.231 1.00 0.60 O ATOM 978 CB THR A 83 14.922 -8.473 7.345 1.00 0.79 C ATOM 979 OG1 THR A 83 15.990 -9.409 7.421 1.00 0.85 O ATOM 980 CG2 THR A 83 13.587 -9.215 7.469 1.00 0.99 C ATOM 0 H THR A 83 16.698 -6.765 6.835 1.00 0.68 H new ATOM 0 HA THR A 83 14.983 -8.469 5.195 1.00 0.73 H new ATOM 0 HB THR A 83 15.006 -7.749 8.156 1.00 0.79 H new ATOM 0 HG1 THR A 83 15.862 -9.989 8.201 1.00 0.85 H new ATOM 0 HG21 THR A 83 13.548 -9.736 8.425 1.00 0.99 H new ATOM 0 HG22 THR A 83 12.766 -8.500 7.412 1.00 0.99 H new ATOM 0 HG23 THR A 83 13.496 -9.938 6.658 1.00 0.99 H new ATOM 988 N CYS A 84 13.866 -5.645 6.448 1.00 0.49 N ATOM 989 CA CYS A 84 12.729 -4.699 6.350 1.00 0.39 C ATOM 990 C CYS A 84 12.606 -4.199 4.911 1.00 0.42 C ATOM 991 O CYS A 84 11.559 -4.281 4.303 1.00 0.50 O ATOM 992 CB CYS A 84 12.959 -3.507 7.287 1.00 0.30 C ATOM 993 SG CYS A 84 11.431 -2.547 7.463 1.00 0.82 S ATOM 0 H CYS A 84 14.666 -5.314 6.988 1.00 0.49 H new ATOM 0 HA CYS A 84 11.811 -5.211 6.640 1.00 0.39 H new ATOM 0 HB2 CYS A 84 13.290 -3.861 8.264 1.00 0.30 H new ATOM 0 HB3 CYS A 84 13.753 -2.872 6.893 1.00 0.30 H new ATOM 998 N LEU A 85 13.670 -3.681 4.363 1.00 0.41 N ATOM 999 CA LEU A 85 13.618 -3.173 2.964 1.00 0.52 C ATOM 1000 C LEU A 85 13.080 -4.266 2.039 1.00 0.62 C ATOM 1001 O LEU A 85 12.343 -3.996 1.118 1.00 0.67 O ATOM 1002 CB LEU A 85 15.024 -2.773 2.517 1.00 0.61 C ATOM 1003 CG LEU A 85 14.941 -1.974 1.215 1.00 0.80 C ATOM 1004 CD1 LEU A 85 14.347 -0.592 1.496 1.00 0.77 C ATOM 1005 CD2 LEU A 85 16.345 -1.817 0.626 1.00 1.01 C ATOM 0 H LEU A 85 14.575 -3.588 4.825 1.00 0.41 H new ATOM 0 HA LEU A 85 12.959 -2.306 2.918 1.00 0.52 H new ATOM 0 HB2 LEU A 85 15.507 -2.177 3.291 1.00 0.61 H new ATOM 0 HB3 LEU A 85 15.637 -3.662 2.371 1.00 0.61 H new ATOM 0 HG LEU A 85 14.304 -2.502 0.505 1.00 0.80 H new ATOM 0 HD11 LEU A 85 14.289 -0.025 0.567 1.00 0.77 H new ATOM 0 HD12 LEU A 85 13.347 -0.704 1.916 1.00 0.77 H new ATOM 0 HD13 LEU A 85 14.981 -0.061 2.206 1.00 0.77 H new ATOM 0 HD21 LEU A 85 16.289 -1.248 -0.302 1.00 1.01 H new ATOM 0 HD22 LEU A 85 16.981 -1.290 1.337 1.00 1.01 H new ATOM 0 HD23 LEU A 85 16.767 -2.801 0.423 1.00 1.01 H new ATOM 1017 N VAL A 86 13.439 -5.499 2.273 1.00 0.71 N ATOM 1018 CA VAL A 86 12.931 -6.594 1.397 1.00 0.86 C ATOM 1019 C VAL A 86 11.397 -6.593 1.433 1.00 0.72 C ATOM 1020 O VAL A 86 10.738 -6.537 0.407 1.00 0.68 O ATOM 1021 CB VAL A 86 13.467 -7.941 1.900 1.00 1.05 C ATOM 1022 CG1 VAL A 86 12.822 -9.091 1.120 1.00 1.10 C ATOM 1023 CG2 VAL A 86 14.983 -7.989 1.701 1.00 1.28 C ATOM 0 H VAL A 86 14.058 -5.795 3.028 1.00 0.71 H new ATOM 0 HA VAL A 86 13.269 -6.438 0.373 1.00 0.86 H new ATOM 0 HB VAL A 86 13.226 -8.046 2.958 1.00 1.05 H new ATOM 0 HG11 VAL A 86 13.210 -10.042 1.486 1.00 1.10 H new ATOM 0 HG12 VAL A 86 11.741 -9.063 1.258 1.00 1.10 H new ATOM 0 HG13 VAL A 86 13.055 -8.988 0.060 1.00 1.10 H new ATOM 0 HG21 VAL A 86 15.367 -8.945 2.058 1.00 1.28 H new ATOM 0 HG22 VAL A 86 15.215 -7.877 0.642 1.00 1.28 H new ATOM 0 HG23 VAL A 86 15.449 -7.179 2.262 1.00 1.28 H new ATOM 1033 N LYS A 87 10.825 -6.650 2.607 1.00 0.65 N ATOM 1034 CA LYS A 87 9.339 -6.643 2.711 1.00 0.56 C ATOM 1035 C LYS A 87 8.792 -5.352 2.090 1.00 0.44 C ATOM 1036 O LYS A 87 7.633 -5.265 1.738 1.00 0.51 O ATOM 1037 CB LYS A 87 8.929 -6.720 4.184 1.00 0.55 C ATOM 1038 CG LYS A 87 7.632 -7.522 4.317 1.00 1.18 C ATOM 1039 CD LYS A 87 7.868 -8.968 3.873 1.00 0.69 C ATOM 1040 CE LYS A 87 7.079 -9.912 4.785 1.00 1.20 C ATOM 1041 NZ LYS A 87 7.341 -11.331 4.400 1.00 1.02 N ATOM 0 H LYS A 87 11.323 -6.701 3.496 1.00 0.65 H new ATOM 0 HA LYS A 87 8.932 -7.502 2.179 1.00 0.56 H new ATOM 0 HB2 LYS A 87 9.720 -7.190 4.768 1.00 0.55 H new ATOM 0 HB3 LYS A 87 8.790 -5.716 4.586 1.00 0.55 H new ATOM 0 HG2 LYS A 87 7.285 -7.501 5.350 1.00 1.18 H new ATOM 0 HG3 LYS A 87 6.849 -7.068 3.709 1.00 1.18 H new ATOM 0 HD2 LYS A 87 7.555 -9.098 2.837 1.00 0.69 H new ATOM 0 HD3 LYS A 87 8.931 -9.205 3.917 1.00 0.69 H new ATOM 0 HE2 LYS A 87 7.364 -9.750 5.824 1.00 1.20 H new ATOM 0 HE3 LYS A 87 6.013 -9.697 4.710 1.00 1.20 H new ATOM 0 HZ1 LYS A 87 6.802 -11.965 5.024 1.00 1.02 H new ATOM 0 HZ2 LYS A 87 7.047 -11.483 3.414 1.00 1.02 H new ATOM 0 HZ3 LYS A 87 8.357 -11.534 4.494 1.00 1.02 H new ATOM 1055 N ILE A 88 9.619 -4.348 1.953 1.00 0.41 N ATOM 1056 CA ILE A 88 9.150 -3.068 1.350 1.00 0.47 C ATOM 1057 C ILE A 88 9.119 -3.210 -0.178 1.00 0.52 C ATOM 1058 O ILE A 88 8.287 -2.629 -0.843 1.00 0.52 O ATOM 1059 CB ILE A 88 10.117 -1.941 1.744 1.00 0.66 C ATOM 1060 CG1 ILE A 88 10.045 -1.708 3.259 1.00 0.73 C ATOM 1061 CG2 ILE A 88 9.753 -0.648 1.005 1.00 0.69 C ATOM 1062 CD1 ILE A 88 8.658 -1.193 3.656 1.00 0.34 C ATOM 0 H ILE A 88 10.600 -4.361 2.233 1.00 0.41 H new ATOM 0 HA ILE A 88 8.149 -2.832 1.712 1.00 0.47 H new ATOM 0 HB ILE A 88 11.131 -2.231 1.468 1.00 0.66 H new ATOM 0 HG12 ILE A 88 10.259 -2.637 3.787 1.00 0.73 H new ATOM 0 HG13 ILE A 88 10.807 -0.988 3.559 1.00 0.73 H new ATOM 0 HG21 ILE A 88 10.446 0.143 1.293 1.00 0.69 H new ATOM 0 HG22 ILE A 88 9.817 -0.813 -0.070 1.00 0.69 H new ATOM 0 HG23 ILE A 88 8.737 -0.353 1.267 1.00 0.69 H new ATOM 0 HD11 ILE A 88 8.624 -1.033 4.734 1.00 0.34 H new ATOM 0 HD12 ILE A 88 8.459 -0.252 3.143 1.00 0.34 H new ATOM 0 HD13 ILE A 88 7.903 -1.927 3.374 1.00 0.34 H new ATOM 1074 N ILE A 89 10.018 -3.977 -0.741 1.00 0.61 N ATOM 1075 CA ILE A 89 10.022 -4.147 -2.222 1.00 0.70 C ATOM 1076 C ILE A 89 8.793 -4.970 -2.625 1.00 0.57 C ATOM 1077 O ILE A 89 7.927 -4.487 -3.328 1.00 0.48 O ATOM 1078 CB ILE A 89 11.314 -4.857 -2.664 1.00 0.86 C ATOM 1079 CG1 ILE A 89 12.524 -4.104 -2.109 1.00 1.07 C ATOM 1080 CG2 ILE A 89 11.411 -4.876 -4.197 1.00 0.77 C ATOM 1081 CD1 ILE A 89 12.497 -2.655 -2.602 1.00 0.72 C ATOM 0 H ILE A 89 10.745 -4.489 -0.241 1.00 0.61 H new ATOM 0 HA ILE A 89 9.983 -3.173 -2.710 1.00 0.70 H new ATOM 0 HB ILE A 89 11.298 -5.879 -2.286 1.00 0.86 H new ATOM 0 HG12 ILE A 89 12.512 -4.128 -1.019 1.00 1.07 H new ATOM 0 HG13 ILE A 89 13.446 -4.590 -2.428 1.00 1.07 H new ATOM 0 HG21 ILE A 89 12.329 -5.381 -4.497 1.00 0.77 H new ATOM 0 HG22 ILE A 89 10.553 -5.407 -4.609 1.00 0.77 H new ATOM 0 HG23 ILE A 89 11.420 -3.853 -4.574 1.00 0.77 H new ATOM 0 HD11 ILE A 89 13.360 -2.120 -2.206 1.00 0.72 H new ATOM 0 HD12 ILE A 89 12.530 -2.641 -3.691 1.00 0.72 H new ATOM 0 HD13 ILE A 89 11.582 -2.171 -2.260 1.00 0.72 H new ATOM 1093 N THR A 90 8.688 -6.196 -2.176 1.00 0.59 N ATOM 1094 CA THR A 90 7.486 -7.009 -2.546 1.00 0.50 C ATOM 1095 C THR A 90 6.242 -6.384 -1.919 1.00 0.39 C ATOM 1096 O THR A 90 5.164 -6.427 -2.475 1.00 0.35 O ATOM 1097 CB THR A 90 7.624 -8.446 -2.037 1.00 0.68 C ATOM 1098 OG1 THR A 90 6.379 -9.114 -2.190 1.00 1.89 O ATOM 1099 CG2 THR A 90 8.019 -8.436 -0.560 1.00 1.33 C ATOM 0 H THR A 90 9.370 -6.664 -1.579 1.00 0.59 H new ATOM 0 HA THR A 90 7.400 -7.024 -3.633 1.00 0.50 H new ATOM 0 HB THR A 90 8.394 -8.963 -2.609 1.00 0.68 H new ATOM 0 HG1 THR A 90 6.460 -10.036 -1.867 1.00 1.89 H new ATOM 0 HG21 THR A 90 8.116 -9.461 -0.202 1.00 1.33 H new ATOM 0 HG22 THR A 90 8.971 -7.919 -0.441 1.00 1.33 H new ATOM 0 HG23 THR A 90 7.252 -7.921 0.018 1.00 1.33 H new ATOM 1107 N GLY A 91 6.385 -5.804 -0.761 1.00 0.61 N ATOM 1108 CA GLY A 91 5.213 -5.174 -0.094 1.00 0.61 C ATOM 1109 C GLY A 91 4.599 -4.140 -1.035 1.00 0.56 C ATOM 1110 O GLY A 91 3.396 -4.065 -1.204 1.00 0.54 O ATOM 0 H GLY A 91 7.264 -5.739 -0.247 1.00 0.61 H new ATOM 0 HA2 GLY A 91 4.474 -5.933 0.164 1.00 0.61 H new ATOM 0 HA3 GLY A 91 5.521 -4.699 0.837 1.00 0.61 H new ATOM 1114 N LEU A 92 5.423 -3.342 -1.654 1.00 0.55 N ATOM 1115 CA LEU A 92 4.901 -2.311 -2.584 1.00 0.52 C ATOM 1116 C LEU A 92 4.460 -2.977 -3.894 1.00 0.64 C ATOM 1117 O LEU A 92 3.679 -2.427 -4.639 1.00 0.60 O ATOM 1118 CB LEU A 92 5.998 -1.284 -2.872 1.00 0.47 C ATOM 1119 CG LEU A 92 6.422 -0.609 -1.566 1.00 0.84 C ATOM 1120 CD1 LEU A 92 7.784 0.061 -1.757 1.00 0.84 C ATOM 1121 CD2 LEU A 92 5.387 0.452 -1.183 1.00 1.12 C ATOM 0 H LEU A 92 6.438 -3.362 -1.554 1.00 0.55 H new ATOM 0 HA LEU A 92 4.046 -1.810 -2.130 1.00 0.52 H new ATOM 0 HB2 LEU A 92 6.855 -1.772 -3.336 1.00 0.47 H new ATOM 0 HB3 LEU A 92 5.635 -0.537 -3.578 1.00 0.47 H new ATOM 0 HG LEU A 92 6.490 -1.357 -0.776 1.00 0.84 H new ATOM 0 HD11 LEU A 92 8.086 0.542 -0.827 1.00 0.84 H new ATOM 0 HD12 LEU A 92 8.523 -0.690 -2.034 1.00 0.84 H new ATOM 0 HD13 LEU A 92 7.714 0.809 -2.546 1.00 0.84 H new ATOM 0 HD21 LEU A 92 5.687 0.934 -0.253 1.00 1.12 H new ATOM 0 HD22 LEU A 92 5.322 1.199 -1.974 1.00 1.12 H new ATOM 0 HD23 LEU A 92 4.414 -0.021 -1.049 1.00 1.12 H new ATOM 1133 N LEU A 93 4.953 -4.159 -4.182 1.00 0.82 N ATOM 1134 CA LEU A 93 4.542 -4.855 -5.445 1.00 0.94 C ATOM 1135 C LEU A 93 3.056 -5.224 -5.345 1.00 0.79 C ATOM 1136 O LEU A 93 2.224 -4.788 -6.128 1.00 0.71 O ATOM 1137 CB LEU A 93 5.360 -6.142 -5.618 1.00 1.20 C ATOM 1138 CG LEU A 93 6.809 -5.807 -5.979 1.00 1.26 C ATOM 1139 CD1 LEU A 93 7.621 -7.101 -6.080 1.00 1.34 C ATOM 1140 CD2 LEU A 93 6.847 -5.080 -7.325 1.00 1.05 C ATOM 0 H LEU A 93 5.618 -4.670 -3.601 1.00 0.82 H new ATOM 0 HA LEU A 93 4.715 -4.196 -6.296 1.00 0.94 H new ATOM 0 HB2 LEU A 93 5.333 -6.724 -4.697 1.00 1.20 H new ATOM 0 HB3 LEU A 93 4.917 -6.760 -6.399 1.00 1.20 H new ATOM 0 HG LEU A 93 7.235 -5.166 -5.207 1.00 1.26 H new ATOM 0 HD11 LEU A 93 8.653 -6.864 -6.337 1.00 1.34 H new ATOM 0 HD12 LEU A 93 7.596 -7.622 -5.123 1.00 1.34 H new ATOM 0 HD13 LEU A 93 7.193 -7.740 -6.852 1.00 1.34 H new ATOM 0 HD21 LEU A 93 7.879 -4.842 -7.581 1.00 1.05 H new ATOM 0 HD22 LEU A 93 6.420 -5.721 -8.097 1.00 1.05 H new ATOM 0 HD23 LEU A 93 6.268 -4.159 -7.257 1.00 1.05 H new ATOM 1152 N GLU A 94 2.716 -6.024 -4.374 1.00 0.77 N ATOM 1153 CA GLU A 94 1.295 -6.420 -4.198 1.00 0.66 C ATOM 1154 C GLU A 94 0.477 -5.160 -3.904 1.00 0.61 C ATOM 1155 O GLU A 94 -0.706 -5.083 -4.179 1.00 0.80 O ATOM 1156 CB GLU A 94 1.192 -7.399 -3.027 1.00 0.69 C ATOM 1157 CG GLU A 94 1.613 -8.797 -3.490 1.00 0.70 C ATOM 1158 CD GLU A 94 0.367 -9.656 -3.718 1.00 0.96 C ATOM 1159 OE1 GLU A 94 -0.536 -9.186 -4.389 1.00 1.78 O ATOM 1160 OE2 GLU A 94 0.339 -10.768 -3.219 1.00 1.13 O ATOM 0 H GLU A 94 3.364 -6.421 -3.694 1.00 0.77 H new ATOM 0 HA GLU A 94 0.914 -6.903 -5.098 1.00 0.66 H new ATOM 0 HB2 GLU A 94 1.829 -7.069 -2.206 1.00 0.69 H new ATOM 0 HB3 GLU A 94 0.170 -7.422 -2.648 1.00 0.69 H new ATOM 0 HG2 GLU A 94 2.193 -8.728 -4.410 1.00 0.70 H new ATOM 0 HG3 GLU A 94 2.256 -9.261 -2.742 1.00 0.70 H new ATOM 1167 N PHE A 95 1.105 -4.161 -3.354 1.00 0.39 N ATOM 1168 CA PHE A 95 0.373 -2.906 -3.057 1.00 0.37 C ATOM 1169 C PHE A 95 0.105 -2.161 -4.359 1.00 0.39 C ATOM 1170 O PHE A 95 -0.856 -1.437 -4.476 1.00 0.40 O ATOM 1171 CB PHE A 95 1.224 -2.041 -2.132 1.00 0.48 C ATOM 1172 CG PHE A 95 0.943 -2.408 -0.693 1.00 0.54 C ATOM 1173 CD1 PHE A 95 0.660 -3.736 -0.346 1.00 1.03 C ATOM 1174 CD2 PHE A 95 0.962 -1.419 0.292 1.00 0.59 C ATOM 1175 CE1 PHE A 95 0.397 -4.072 0.980 1.00 1.11 C ATOM 1176 CE2 PHE A 95 0.698 -1.753 1.621 1.00 0.63 C ATOM 1177 CZ PHE A 95 0.415 -3.080 1.969 1.00 0.72 C ATOM 0 H PHE A 95 2.092 -4.161 -3.098 1.00 0.39 H new ATOM 0 HA PHE A 95 -0.576 -3.133 -2.571 1.00 0.37 H new ATOM 0 HB2 PHE A 95 2.281 -2.184 -2.354 1.00 0.48 H new ATOM 0 HB3 PHE A 95 1.003 -0.987 -2.299 1.00 0.48 H new ATOM 0 HD1 PHE A 95 0.646 -4.501 -1.109 1.00 1.03 H new ATOM 0 HD2 PHE A 95 1.181 -0.396 0.026 1.00 0.59 H new ATOM 0 HE1 PHE A 95 0.179 -5.096 1.245 1.00 1.11 H new ATOM 0 HE2 PHE A 95 0.712 -0.987 2.382 1.00 0.63 H new ATOM 0 HZ PHE A 95 0.211 -3.338 2.998 1.00 0.72 H new ATOM 1187 N GLU A 96 0.945 -2.337 -5.342 1.00 0.41 N ATOM 1188 CA GLU A 96 0.726 -1.640 -6.635 1.00 0.43 C ATOM 1189 C GLU A 96 -0.529 -2.218 -7.295 1.00 0.40 C ATOM 1190 O GLU A 96 -1.339 -1.492 -7.833 1.00 0.39 O ATOM 1191 CB GLU A 96 1.976 -1.790 -7.535 1.00 0.48 C ATOM 1192 CG GLU A 96 1.857 -2.991 -8.487 1.00 2.05 C ATOM 1193 CD GLU A 96 3.217 -3.274 -9.128 1.00 3.02 C ATOM 1194 OE1 GLU A 96 4.221 -2.957 -8.510 1.00 3.70 O ATOM 1195 OE2 GLU A 96 3.232 -3.802 -10.229 1.00 3.98 O ATOM 0 H GLU A 96 1.772 -2.933 -5.303 1.00 0.41 H new ATOM 0 HA GLU A 96 0.573 -0.573 -6.474 1.00 0.43 H new ATOM 0 HB2 GLU A 96 2.116 -0.879 -8.116 1.00 0.48 H new ATOM 0 HB3 GLU A 96 2.861 -1.909 -6.910 1.00 0.48 H new ATOM 0 HG2 GLU A 96 1.512 -3.868 -7.940 1.00 2.05 H new ATOM 0 HG3 GLU A 96 1.116 -2.784 -9.259 1.00 2.05 H new ATOM 1202 N VAL A 97 -0.706 -3.515 -7.249 1.00 0.39 N ATOM 1203 CA VAL A 97 -1.935 -4.093 -7.870 1.00 0.38 C ATOM 1204 C VAL A 97 -3.156 -3.557 -7.106 1.00 0.34 C ATOM 1205 O VAL A 97 -4.186 -3.269 -7.689 1.00 0.34 O ATOM 1206 CB VAL A 97 -1.897 -5.632 -7.824 1.00 0.37 C ATOM 1207 CG1 VAL A 97 -1.661 -6.114 -6.398 1.00 0.71 C ATOM 1208 CG2 VAL A 97 -3.228 -6.200 -8.328 1.00 0.55 C ATOM 0 H VAL A 97 -0.068 -4.185 -6.819 1.00 0.39 H new ATOM 0 HA VAL A 97 -1.994 -3.800 -8.918 1.00 0.38 H new ATOM 0 HB VAL A 97 -1.082 -5.977 -8.461 1.00 0.37 H new ATOM 0 HG11 VAL A 97 -1.637 -7.204 -6.382 1.00 0.71 H new ATOM 0 HG12 VAL A 97 -0.710 -5.724 -6.035 1.00 0.71 H new ATOM 0 HG13 VAL A 97 -2.467 -5.759 -5.756 1.00 0.71 H new ATOM 0 HG21 VAL A 97 -3.195 -7.289 -8.293 1.00 0.55 H new ATOM 0 HG22 VAL A 97 -4.040 -5.841 -7.695 1.00 0.55 H new ATOM 0 HG23 VAL A 97 -3.397 -5.875 -9.355 1.00 0.55 H new ATOM 1218 N TYR A 98 -3.049 -3.396 -5.809 1.00 0.31 N ATOM 1219 CA TYR A 98 -4.209 -2.854 -5.038 1.00 0.26 C ATOM 1220 C TYR A 98 -4.397 -1.378 -5.385 1.00 0.25 C ATOM 1221 O TYR A 98 -5.491 -0.847 -5.331 1.00 0.22 O ATOM 1222 CB TYR A 98 -3.958 -2.988 -3.533 1.00 0.22 C ATOM 1223 CG TYR A 98 -3.474 -4.381 -3.210 1.00 0.58 C ATOM 1224 CD1 TYR A 98 -3.973 -5.488 -3.912 1.00 1.45 C ATOM 1225 CD2 TYR A 98 -2.525 -4.566 -2.201 1.00 1.01 C ATOM 1226 CE1 TYR A 98 -3.518 -6.772 -3.607 1.00 1.82 C ATOM 1227 CE2 TYR A 98 -2.069 -5.851 -1.896 1.00 1.23 C ATOM 1228 CZ TYR A 98 -2.565 -6.955 -2.598 1.00 1.43 C ATOM 1229 OH TYR A 98 -2.117 -8.225 -2.294 1.00 1.85 O ATOM 0 H TYR A 98 -2.219 -3.614 -5.258 1.00 0.31 H new ATOM 0 HA TYR A 98 -5.104 -3.419 -5.300 1.00 0.26 H new ATOM 0 HB2 TYR A 98 -3.218 -2.254 -3.213 1.00 0.22 H new ATOM 0 HB3 TYR A 98 -4.875 -2.777 -2.983 1.00 0.22 H new ATOM 0 HD1 TYR A 98 -4.710 -5.347 -4.689 1.00 1.45 H new ATOM 0 HD2 TYR A 98 -2.144 -3.715 -1.656 1.00 1.01 H new ATOM 0 HE1 TYR A 98 -3.901 -7.624 -4.149 1.00 1.82 H new ATOM 0 HE2 TYR A 98 -1.333 -5.992 -1.118 1.00 1.23 H new ATOM 0 HH TYR A 98 -1.687 -8.617 -3.082 1.00 1.85 H new ATOM 1239 N LEU A 99 -3.344 -0.718 -5.778 1.00 0.32 N ATOM 1240 CA LEU A 99 -3.475 0.709 -6.162 1.00 0.32 C ATOM 1241 C LEU A 99 -4.170 0.739 -7.514 1.00 0.34 C ATOM 1242 O LEU A 99 -4.896 1.656 -7.836 1.00 0.32 O ATOM 1243 CB LEU A 99 -2.096 1.358 -6.251 1.00 0.44 C ATOM 1244 CG LEU A 99 -1.540 1.555 -4.841 1.00 0.49 C ATOM 1245 CD1 LEU A 99 -0.167 2.219 -4.919 1.00 0.75 C ATOM 1246 CD2 LEU A 99 -2.489 2.443 -4.035 1.00 0.76 C ATOM 0 H LEU A 99 -2.403 -1.105 -5.849 1.00 0.32 H new ATOM 0 HA LEU A 99 -4.050 1.265 -5.421 1.00 0.32 H new ATOM 0 HB2 LEU A 99 -1.423 0.731 -6.836 1.00 0.44 H new ATOM 0 HB3 LEU A 99 -2.165 2.317 -6.765 1.00 0.44 H new ATOM 0 HG LEU A 99 -1.447 0.585 -4.352 1.00 0.49 H new ATOM 0 HD11 LEU A 99 0.227 2.358 -3.912 1.00 0.75 H new ATOM 0 HD12 LEU A 99 0.512 1.585 -5.490 1.00 0.75 H new ATOM 0 HD13 LEU A 99 -0.259 3.188 -5.410 1.00 0.75 H new ATOM 0 HD21 LEU A 99 -2.091 2.582 -3.030 1.00 0.76 H new ATOM 0 HD22 LEU A 99 -2.585 3.412 -4.525 1.00 0.76 H new ATOM 0 HD23 LEU A 99 -3.468 1.968 -3.975 1.00 0.76 H new ATOM 1258 N GLU A 100 -3.999 -0.308 -8.278 1.00 0.39 N ATOM 1259 CA GLU A 100 -4.699 -0.406 -9.573 1.00 0.44 C ATOM 1260 C GLU A 100 -6.183 -0.470 -9.232 1.00 0.41 C ATOM 1261 O GLU A 100 -7.030 0.065 -9.920 1.00 0.43 O ATOM 1262 CB GLU A 100 -4.262 -1.697 -10.272 1.00 0.54 C ATOM 1263 CG GLU A 100 -4.152 -1.463 -11.779 1.00 0.72 C ATOM 1264 CD GLU A 100 -5.502 -1.740 -12.443 1.00 0.73 C ATOM 1265 OE1 GLU A 100 -6.330 -2.381 -11.818 1.00 1.19 O ATOM 1266 OE2 GLU A 100 -5.683 -1.305 -13.570 1.00 1.14 O ATOM 0 H GLU A 100 -3.398 -1.100 -8.050 1.00 0.39 H new ATOM 0 HA GLU A 100 -4.480 0.433 -10.234 1.00 0.44 H new ATOM 0 HB2 GLU A 100 -3.302 -2.028 -9.876 1.00 0.54 H new ATOM 0 HB3 GLU A 100 -4.981 -2.491 -10.070 1.00 0.54 H new ATOM 0 HG2 GLU A 100 -3.843 -0.437 -11.976 1.00 0.72 H new ATOM 0 HG3 GLU A 100 -3.387 -2.113 -12.203 1.00 0.72 H new ATOM 1273 N TYR A 101 -6.480 -1.105 -8.126 1.00 0.38 N ATOM 1274 CA TYR A 101 -7.880 -1.206 -7.653 1.00 0.41 C ATOM 1275 C TYR A 101 -8.447 0.194 -7.483 1.00 0.37 C ATOM 1276 O TYR A 101 -9.512 0.515 -7.967 1.00 0.46 O ATOM 1277 CB TYR A 101 -7.891 -1.917 -6.295 1.00 0.37 C ATOM 1278 CG TYR A 101 -9.099 -2.811 -6.190 1.00 0.29 C ATOM 1279 CD1 TYR A 101 -9.345 -3.767 -7.178 1.00 0.29 C ATOM 1280 CD2 TYR A 101 -9.970 -2.686 -5.102 1.00 0.24 C ATOM 1281 CE1 TYR A 101 -10.464 -4.599 -7.083 1.00 0.22 C ATOM 1282 CE2 TYR A 101 -11.089 -3.519 -5.007 1.00 0.17 C ATOM 1283 CZ TYR A 101 -11.337 -4.472 -5.997 1.00 0.16 C ATOM 1284 OH TYR A 101 -12.446 -5.283 -5.904 1.00 0.09 O ATOM 0 H TYR A 101 -5.794 -1.563 -7.526 1.00 0.38 H new ATOM 0 HA TYR A 101 -8.479 -1.763 -8.373 1.00 0.41 H new ATOM 0 HB2 TYR A 101 -6.981 -2.506 -6.176 1.00 0.37 H new ATOM 0 HB3 TYR A 101 -7.902 -1.182 -5.491 1.00 0.37 H new ATOM 0 HD1 TYR A 101 -8.670 -3.863 -8.016 1.00 0.29 H new ATOM 0 HD2 TYR A 101 -9.778 -1.948 -4.337 1.00 0.24 H new ATOM 0 HE1 TYR A 101 -10.654 -5.339 -7.847 1.00 0.22 H new ATOM 0 HE2 TYR A 101 -11.762 -3.425 -4.167 1.00 0.17 H new ATOM 0 HH TYR A 101 -12.810 -5.236 -4.995 1.00 0.09 H new ATOM 1294 N LEU A 102 -7.742 1.021 -6.772 1.00 0.28 N ATOM 1295 CA LEU A 102 -8.228 2.405 -6.525 1.00 0.30 C ATOM 1296 C LEU A 102 -7.700 3.360 -7.598 1.00 0.24 C ATOM 1297 O LEU A 102 -7.884 4.556 -7.507 1.00 0.29 O ATOM 1298 CB LEU A 102 -7.739 2.867 -5.150 1.00 0.30 C ATOM 1299 CG LEU A 102 -7.913 1.740 -4.126 1.00 0.32 C ATOM 1300 CD1 LEU A 102 -6.647 1.615 -3.281 1.00 0.28 C ATOM 1301 CD2 LEU A 102 -9.106 2.062 -3.234 1.00 0.45 C ATOM 0 H LEU A 102 -6.842 0.798 -6.347 1.00 0.28 H new ATOM 0 HA LEU A 102 -9.317 2.410 -6.559 1.00 0.30 H new ATOM 0 HB2 LEU A 102 -6.690 3.159 -5.207 1.00 0.30 H new ATOM 0 HB3 LEU A 102 -8.298 3.747 -4.833 1.00 0.30 H new ATOM 0 HG LEU A 102 -8.088 0.795 -4.640 1.00 0.32 H new ATOM 0 HD11 LEU A 102 -6.773 0.813 -2.554 1.00 0.28 H new ATOM 0 HD12 LEU A 102 -5.799 1.389 -3.927 1.00 0.28 H new ATOM 0 HD13 LEU A 102 -6.464 2.554 -2.758 1.00 0.28 H new ATOM 0 HD21 LEU A 102 -9.238 1.266 -2.502 1.00 0.45 H new ATOM 0 HD22 LEU A 102 -8.929 3.005 -2.717 1.00 0.45 H new ATOM 0 HD23 LEU A 102 -10.005 2.146 -3.845 1.00 0.45 H new ATOM 1313 N GLN A 103 -7.042 2.859 -8.608 1.00 0.27 N ATOM 1314 CA GLN A 103 -6.509 3.772 -9.657 1.00 0.28 C ATOM 1315 C GLN A 103 -7.646 4.225 -10.579 1.00 0.26 C ATOM 1316 O GLN A 103 -7.615 5.307 -11.130 1.00 0.45 O ATOM 1317 CB GLN A 103 -5.451 3.043 -10.488 1.00 0.24 C ATOM 1318 CG GLN A 103 -4.867 4.006 -11.527 1.00 0.16 C ATOM 1319 CD GLN A 103 -4.402 3.218 -12.754 1.00 0.26 C ATOM 1320 OE1 GLN A 103 -4.451 3.713 -13.862 1.00 1.14 O ATOM 1321 NE2 GLN A 103 -3.949 2.002 -12.602 1.00 1.58 N ATOM 0 H GLN A 103 -6.852 1.867 -8.751 1.00 0.27 H new ATOM 0 HA GLN A 103 -6.062 4.641 -9.175 1.00 0.28 H new ATOM 0 HB2 GLN A 103 -4.660 2.666 -9.840 1.00 0.24 H new ATOM 0 HB3 GLN A 103 -5.894 2.180 -10.985 1.00 0.24 H new ATOM 0 HG2 GLN A 103 -5.617 4.742 -11.818 1.00 0.16 H new ATOM 0 HG3 GLN A 103 -4.030 4.557 -11.097 1.00 0.16 H new ATOM 0 HE21 GLN A 103 -3.908 1.586 -11.672 1.00 1.58 H new ATOM 0 HE22 GLN A 103 -3.637 1.469 -13.414 1.00 1.58 H new ATOM 1330 N ASN A 104 -8.642 3.400 -10.765 1.00 0.38 N ATOM 1331 CA ASN A 104 -9.768 3.780 -11.668 1.00 0.36 C ATOM 1332 C ASN A 104 -11.096 3.774 -10.903 1.00 0.34 C ATOM 1333 O ASN A 104 -12.048 4.418 -11.296 1.00 0.37 O ATOM 1334 CB ASN A 104 -9.848 2.772 -12.816 1.00 0.34 C ATOM 1335 CG ASN A 104 -10.278 3.487 -14.099 1.00 0.31 C ATOM 1336 OD1 ASN A 104 -11.186 3.047 -14.777 1.00 1.24 O ATOM 1337 ND2 ASN A 104 -9.660 4.577 -14.462 1.00 1.54 N ATOM 0 H ASN A 104 -8.725 2.480 -10.331 1.00 0.38 H new ATOM 0 HA ASN A 104 -9.588 4.783 -12.055 1.00 0.36 H new ATOM 0 HB2 ASN A 104 -8.879 2.294 -12.962 1.00 0.34 H new ATOM 0 HB3 ASN A 104 -10.559 1.983 -12.572 1.00 0.34 H new ATOM 0 HD21 ASN A 104 -9.939 5.061 -15.316 1.00 1.54 H new ATOM 0 HD22 ASN A 104 -8.898 4.945 -13.892 1.00 1.54 H new ATOM 1344 N ARG A 105 -11.176 3.048 -9.824 1.00 0.29 N ATOM 1345 CA ARG A 105 -12.451 3.001 -9.054 1.00 0.28 C ATOM 1346 C ARG A 105 -12.871 4.416 -8.657 1.00 0.31 C ATOM 1347 O ARG A 105 -14.024 4.673 -8.370 1.00 0.28 O ATOM 1348 CB ARG A 105 -12.259 2.156 -7.794 1.00 0.22 C ATOM 1349 CG ARG A 105 -13.575 1.458 -7.445 1.00 0.35 C ATOM 1350 CD ARG A 105 -13.927 1.734 -5.981 1.00 1.41 C ATOM 1351 NE ARG A 105 -14.791 2.945 -5.899 1.00 2.65 N ATOM 1352 CZ ARG A 105 -14.705 3.744 -4.870 1.00 3.85 C ATOM 1353 NH1 ARG A 105 -15.025 3.314 -3.680 1.00 4.09 N ATOM 1354 NH2 ARG A 105 -14.298 4.973 -5.033 1.00 5.15 N ATOM 0 H ARG A 105 -10.416 2.486 -9.442 1.00 0.29 H new ATOM 0 HA ARG A 105 -13.227 2.556 -9.677 1.00 0.28 H new ATOM 0 HB2 ARG A 105 -11.474 1.417 -7.955 1.00 0.22 H new ATOM 0 HB3 ARG A 105 -11.938 2.787 -6.965 1.00 0.22 H new ATOM 0 HG2 ARG A 105 -14.373 1.816 -8.096 1.00 0.35 H new ATOM 0 HG3 ARG A 105 -13.485 0.385 -7.612 1.00 0.35 H new ATOM 0 HD2 ARG A 105 -14.444 0.876 -5.552 1.00 1.41 H new ATOM 0 HD3 ARG A 105 -13.018 1.883 -5.399 1.00 1.41 H new ATOM 0 HE ARG A 105 -15.451 3.150 -6.649 1.00 2.65 H new ATOM 0 HH11 ARG A 105 -15.343 2.353 -3.553 1.00 4.09 H new ATOM 0 HH12 ARG A 105 -14.957 3.939 -2.877 1.00 4.09 H new ATOM 0 HH21 ARG A 105 -14.048 5.308 -5.963 1.00 5.15 H new ATOM 0 HH22 ARG A 105 -14.230 5.599 -4.230 1.00 5.15 H new ATOM 1368 N PHE A 106 -11.949 5.338 -8.634 1.00 0.43 N ATOM 1369 CA PHE A 106 -12.306 6.735 -8.249 1.00 0.52 C ATOM 1370 C PHE A 106 -12.797 7.503 -9.479 1.00 0.57 C ATOM 1371 O PHE A 106 -12.016 7.979 -10.278 1.00 0.81 O ATOM 1372 CB PHE A 106 -11.077 7.439 -7.669 1.00 0.62 C ATOM 1373 CG PHE A 106 -11.136 7.392 -6.161 1.00 0.67 C ATOM 1374 CD1 PHE A 106 -11.866 8.358 -5.458 1.00 1.25 C ATOM 1375 CD2 PHE A 106 -10.460 6.382 -5.466 1.00 0.66 C ATOM 1376 CE1 PHE A 106 -11.921 8.313 -4.059 1.00 1.40 C ATOM 1377 CE2 PHE A 106 -10.516 6.337 -4.068 1.00 0.58 C ATOM 1378 CZ PHE A 106 -11.245 7.303 -3.364 1.00 0.88 C ATOM 0 H PHE A 106 -10.967 5.187 -8.864 1.00 0.43 H new ATOM 0 HA PHE A 106 -13.098 6.707 -7.500 1.00 0.52 H new ATOM 0 HB2 PHE A 106 -10.167 6.956 -8.023 1.00 0.62 H new ATOM 0 HB3 PHE A 106 -11.042 8.474 -8.010 1.00 0.62 H new ATOM 0 HD1 PHE A 106 -12.387 9.138 -5.994 1.00 1.25 H new ATOM 0 HD2 PHE A 106 -9.896 5.638 -6.008 1.00 0.66 H new ATOM 0 HE1 PHE A 106 -12.485 9.057 -3.517 1.00 1.40 H new ATOM 0 HE2 PHE A 106 -9.996 5.556 -3.532 1.00 0.58 H new ATOM 0 HZ PHE A 106 -11.286 7.269 -2.285 1.00 0.88 H new ATOM 1388 N GLU A 107 -14.086 7.634 -9.633 1.00 0.39 N ATOM 1389 CA GLU A 107 -14.626 8.379 -10.805 1.00 0.44 C ATOM 1390 C GLU A 107 -14.898 9.826 -10.395 1.00 0.51 C ATOM 1391 O GLU A 107 -14.842 10.736 -11.198 1.00 0.54 O ATOM 1392 CB GLU A 107 -15.930 7.725 -11.271 1.00 0.35 C ATOM 1393 CG GLU A 107 -16.969 7.787 -10.148 1.00 0.70 C ATOM 1394 CD GLU A 107 -17.705 6.448 -10.055 1.00 1.77 C ATOM 1395 OE1 GLU A 107 -17.630 5.685 -11.005 1.00 1.81 O ATOM 1396 OE2 GLU A 107 -18.330 6.208 -9.035 1.00 2.83 O ATOM 0 H GLU A 107 -14.789 7.257 -8.997 1.00 0.39 H new ATOM 0 HA GLU A 107 -13.902 8.358 -11.620 1.00 0.44 H new ATOM 0 HB2 GLU A 107 -16.307 8.235 -12.157 1.00 0.35 H new ATOM 0 HB3 GLU A 107 -15.747 6.688 -11.554 1.00 0.35 H new ATOM 0 HG2 GLU A 107 -16.481 8.012 -9.200 1.00 0.70 H new ATOM 0 HG3 GLU A 107 -17.679 8.591 -10.340 1.00 0.70 H new ATOM 1403 N SER A 108 -15.185 10.041 -9.142 1.00 0.55 N ATOM 1404 CA SER A 108 -15.452 11.423 -8.659 1.00 0.59 C ATOM 1405 C SER A 108 -14.136 12.035 -8.185 1.00 0.50 C ATOM 1406 O SER A 108 -13.777 13.136 -8.554 1.00 0.58 O ATOM 1407 CB SER A 108 -16.448 11.378 -7.498 1.00 0.70 C ATOM 1408 OG SER A 108 -17.614 10.676 -7.909 1.00 1.23 O ATOM 0 H SER A 108 -15.246 9.315 -8.428 1.00 0.55 H new ATOM 0 HA SER A 108 -15.874 12.025 -9.464 1.00 0.59 H new ATOM 0 HB2 SER A 108 -15.998 10.886 -6.636 1.00 0.70 H new ATOM 0 HB3 SER A 108 -16.709 12.390 -7.187 1.00 0.70 H new ATOM 0 HG SER A 108 -18.254 10.643 -7.168 1.00 1.23 H new ATOM 1414 N SER A 109 -13.408 11.310 -7.383 1.00 0.40 N ATOM 1415 CA SER A 109 -12.099 11.818 -6.890 1.00 0.32 C ATOM 1416 C SER A 109 -10.998 11.096 -7.660 1.00 0.30 C ATOM 1417 O SER A 109 -10.026 10.630 -7.101 1.00 0.38 O ATOM 1418 CB SER A 109 -11.970 11.526 -5.394 1.00 0.38 C ATOM 1419 OG SER A 109 -11.589 12.715 -4.713 1.00 0.69 O ATOM 0 H SER A 109 -13.665 10.382 -7.046 1.00 0.40 H new ATOM 0 HA SER A 109 -12.020 12.895 -7.042 1.00 0.32 H new ATOM 0 HB2 SER A 109 -12.917 11.156 -5.001 1.00 0.38 H new ATOM 0 HB3 SER A 109 -11.229 10.744 -5.227 1.00 0.38 H new ATOM 0 HG SER A 109 -12.078 12.778 -3.866 1.00 0.69 H new ATOM 1425 N GLU A 110 -11.167 10.986 -8.949 1.00 0.32 N ATOM 1426 CA GLU A 110 -10.170 10.282 -9.794 1.00 0.32 C ATOM 1427 C GLU A 110 -8.754 10.784 -9.492 1.00 0.12 C ATOM 1428 O GLU A 110 -7.835 10.008 -9.318 1.00 0.19 O ATOM 1429 CB GLU A 110 -10.492 10.542 -11.266 1.00 0.43 C ATOM 1430 CG GLU A 110 -9.866 9.445 -12.127 1.00 0.41 C ATOM 1431 CD GLU A 110 -10.583 9.384 -13.477 1.00 0.64 C ATOM 1432 OE1 GLU A 110 -10.227 10.159 -14.349 1.00 1.25 O ATOM 1433 OE2 GLU A 110 -11.475 8.563 -13.616 1.00 1.38 O ATOM 0 H GLU A 110 -11.968 11.361 -9.457 1.00 0.32 H new ATOM 0 HA GLU A 110 -10.216 9.215 -9.578 1.00 0.32 H new ATOM 0 HB2 GLU A 110 -11.572 10.564 -11.415 1.00 0.43 H new ATOM 0 HB3 GLU A 110 -10.109 11.517 -11.566 1.00 0.43 H new ATOM 0 HG2 GLU A 110 -8.805 9.646 -12.276 1.00 0.41 H new ATOM 0 HG3 GLU A 110 -9.941 8.483 -11.620 1.00 0.41 H new ATOM 1440 N GLU A 111 -8.564 12.075 -9.447 1.00 0.05 N ATOM 1441 CA GLU A 111 -7.202 12.622 -9.179 1.00 0.23 C ATOM 1442 C GLU A 111 -6.732 12.231 -7.774 1.00 0.33 C ATOM 1443 O GLU A 111 -5.556 12.034 -7.540 1.00 0.53 O ATOM 1444 CB GLU A 111 -7.232 14.147 -9.300 1.00 0.30 C ATOM 1445 CG GLU A 111 -8.318 14.718 -8.385 1.00 1.99 C ATOM 1446 CD GLU A 111 -7.665 15.464 -7.218 1.00 2.94 C ATOM 1447 OE1 GLU A 111 -7.079 14.807 -6.374 1.00 3.80 O ATOM 1448 OE2 GLU A 111 -7.764 16.680 -7.189 1.00 3.34 O ATOM 0 H GLU A 111 -9.293 12.775 -9.584 1.00 0.05 H new ATOM 0 HA GLU A 111 -6.508 12.206 -9.909 1.00 0.23 H new ATOM 0 HB2 GLU A 111 -6.261 14.562 -9.030 1.00 0.30 H new ATOM 0 HB3 GLU A 111 -7.425 14.435 -10.333 1.00 0.30 H new ATOM 0 HG2 GLU A 111 -8.963 15.394 -8.947 1.00 1.99 H new ATOM 0 HG3 GLU A 111 -8.950 13.914 -8.008 1.00 1.99 H new ATOM 1455 N GLN A 112 -7.631 12.121 -6.836 1.00 0.40 N ATOM 1456 CA GLN A 112 -7.216 11.751 -5.455 1.00 0.63 C ATOM 1457 C GLN A 112 -6.606 10.348 -5.461 1.00 0.57 C ATOM 1458 O GLN A 112 -5.556 10.113 -4.896 1.00 0.64 O ATOM 1459 CB GLN A 112 -8.436 11.782 -4.533 1.00 0.80 C ATOM 1460 CG GLN A 112 -8.848 13.236 -4.289 1.00 0.79 C ATOM 1461 CD GLN A 112 -9.640 13.333 -2.985 1.00 2.20 C ATOM 1462 OE1 GLN A 112 -10.251 12.373 -2.557 1.00 3.26 O ATOM 1463 NE2 GLN A 112 -9.658 14.461 -2.329 1.00 2.41 N ATOM 0 H GLN A 112 -8.632 12.271 -6.965 1.00 0.40 H new ATOM 0 HA GLN A 112 -6.473 12.462 -5.094 1.00 0.63 H new ATOM 0 HB2 GLN A 112 -9.260 11.229 -4.983 1.00 0.80 H new ATOM 0 HB3 GLN A 112 -8.204 11.294 -3.586 1.00 0.80 H new ATOM 0 HG2 GLN A 112 -7.964 13.871 -4.237 1.00 0.79 H new ATOM 0 HG3 GLN A 112 -9.452 13.598 -5.121 1.00 0.79 H new ATOM 0 HE21 GLN A 112 -9.146 15.267 -2.687 1.00 2.41 H new ATOM 0 HE22 GLN A 112 -10.184 14.536 -1.458 1.00 2.41 H new ATOM 1472 N ALA A 113 -7.252 9.416 -6.103 1.00 0.49 N ATOM 1473 CA ALA A 113 -6.707 8.028 -6.156 1.00 0.47 C ATOM 1474 C ALA A 113 -5.369 8.039 -6.903 1.00 0.49 C ATOM 1475 O ALA A 113 -4.416 7.385 -6.518 1.00 0.59 O ATOM 1476 CB ALA A 113 -7.698 7.130 -6.896 1.00 0.45 C ATOM 0 H ALA A 113 -8.135 9.554 -6.594 1.00 0.49 H new ATOM 0 HA ALA A 113 -6.555 7.650 -5.145 1.00 0.47 H new ATOM 0 HB1 ALA A 113 -7.306 6.114 -6.939 1.00 0.45 H new ATOM 0 HB2 ALA A 113 -8.652 7.129 -6.369 1.00 0.45 H new ATOM 0 HB3 ALA A 113 -7.843 7.506 -7.909 1.00 0.45 H new ATOM 1482 N ARG A 114 -5.292 8.784 -7.969 1.00 0.44 N ATOM 1483 CA ARG A 114 -4.025 8.851 -8.744 1.00 0.46 C ATOM 1484 C ARG A 114 -2.945 9.536 -7.904 1.00 0.55 C ATOM 1485 O ARG A 114 -1.772 9.423 -8.184 1.00 0.54 O ATOM 1486 CB ARG A 114 -4.257 9.658 -10.025 1.00 0.43 C ATOM 1487 CG ARG A 114 -3.479 9.026 -11.180 1.00 0.44 C ATOM 1488 CD ARG A 114 -3.877 9.701 -12.495 1.00 0.30 C ATOM 1489 NE ARG A 114 -4.160 8.661 -13.523 1.00 1.13 N ATOM 1490 CZ ARG A 114 -5.381 8.240 -13.707 1.00 2.46 C ATOM 1491 NH1 ARG A 114 -6.074 7.786 -12.700 1.00 3.70 N ATOM 1492 NH2 ARG A 114 -5.912 8.278 -14.899 1.00 2.92 N ATOM 0 H ARG A 114 -6.055 9.351 -8.338 1.00 0.44 H new ATOM 0 HA ARG A 114 -3.702 7.842 -8.998 1.00 0.46 H new ATOM 0 HB2 ARG A 114 -5.321 9.685 -10.262 1.00 0.43 H new ATOM 0 HB3 ARG A 114 -3.937 10.690 -9.879 1.00 0.43 H new ATOM 0 HG2 ARG A 114 -2.407 9.135 -11.013 1.00 0.44 H new ATOM 0 HG3 ARG A 114 -3.687 7.957 -11.230 1.00 0.44 H new ATOM 0 HD2 ARG A 114 -4.757 10.326 -12.343 1.00 0.30 H new ATOM 0 HD3 ARG A 114 -3.076 10.356 -12.837 1.00 0.30 H new ATOM 0 HE ARG A 114 -3.399 8.278 -14.083 1.00 1.13 H new ATOM 0 HH11 ARG A 114 -5.661 7.760 -11.768 1.00 3.70 H new ATOM 0 HH12 ARG A 114 -7.029 7.457 -12.845 1.00 3.70 H new ATOM 0 HH21 ARG A 114 -5.372 8.637 -15.687 1.00 2.92 H new ATOM 0 HH22 ARG A 114 -6.867 7.949 -15.043 1.00 2.92 H new ATOM 1506 N ALA A 115 -3.329 10.254 -6.883 1.00 0.69 N ATOM 1507 CA ALA A 115 -2.316 10.954 -6.042 1.00 0.78 C ATOM 1508 C ALA A 115 -1.590 9.955 -5.136 1.00 0.68 C ATOM 1509 O ALA A 115 -0.440 10.147 -4.794 1.00 0.73 O ATOM 1510 CB ALA A 115 -3.013 12.006 -5.179 1.00 0.93 C ATOM 0 H ALA A 115 -4.299 10.386 -6.595 1.00 0.69 H new ATOM 0 HA ALA A 115 -1.586 11.432 -6.695 1.00 0.78 H new ATOM 0 HB1 ALA A 115 -2.274 12.519 -4.563 1.00 0.93 H new ATOM 0 HB2 ALA A 115 -3.515 12.729 -5.822 1.00 0.93 H new ATOM 0 HB3 ALA A 115 -3.747 11.521 -4.536 1.00 0.93 H new ATOM 1516 N VAL A 116 -2.242 8.898 -4.732 1.00 0.58 N ATOM 1517 CA VAL A 116 -1.561 7.916 -3.841 1.00 0.50 C ATOM 1518 C VAL A 116 -0.743 6.924 -4.685 1.00 0.43 C ATOM 1519 O VAL A 116 0.397 6.635 -4.381 1.00 0.43 O ATOM 1520 CB VAL A 116 -2.607 7.181 -2.979 1.00 0.57 C ATOM 1521 CG1 VAL A 116 -3.324 6.096 -3.790 1.00 0.47 C ATOM 1522 CG2 VAL A 116 -1.906 6.536 -1.782 1.00 0.91 C ATOM 0 H VAL A 116 -3.206 8.674 -4.977 1.00 0.58 H new ATOM 0 HA VAL A 116 -0.877 8.441 -3.175 1.00 0.50 H new ATOM 0 HB VAL A 116 -3.348 7.905 -2.640 1.00 0.57 H new ATOM 0 HG11 VAL A 116 -4.056 5.593 -3.158 1.00 0.47 H new ATOM 0 HG12 VAL A 116 -3.831 6.552 -4.640 1.00 0.47 H new ATOM 0 HG13 VAL A 116 -2.595 5.369 -4.150 1.00 0.47 H new ATOM 0 HG21 VAL A 116 -2.640 6.014 -1.168 1.00 0.91 H new ATOM 0 HG22 VAL A 116 -1.159 5.826 -2.137 1.00 0.91 H new ATOM 0 HG23 VAL A 116 -1.418 7.308 -1.187 1.00 0.91 H new ATOM 1532 N GLN A 117 -1.315 6.396 -5.737 1.00 0.53 N ATOM 1533 CA GLN A 117 -0.569 5.424 -6.585 1.00 0.48 C ATOM 1534 C GLN A 117 0.516 6.146 -7.393 1.00 0.33 C ATOM 1535 O GLN A 117 1.490 5.549 -7.802 1.00 0.28 O ATOM 1536 CB GLN A 117 -1.541 4.736 -7.547 1.00 0.70 C ATOM 1537 CG GLN A 117 -0.787 3.679 -8.352 1.00 0.88 C ATOM 1538 CD GLN A 117 -1.641 3.216 -9.532 1.00 1.16 C ATOM 1539 OE1 GLN A 117 -2.063 4.015 -10.343 1.00 0.66 O ATOM 1540 NE2 GLN A 117 -1.911 1.945 -9.666 1.00 2.40 N ATOM 0 H GLN A 117 -2.267 6.597 -6.044 1.00 0.53 H new ATOM 0 HA GLN A 117 -0.098 4.682 -5.940 1.00 0.48 H new ATOM 0 HB2 GLN A 117 -2.356 4.273 -6.990 1.00 0.70 H new ATOM 0 HB3 GLN A 117 -1.989 5.470 -8.217 1.00 0.70 H new ATOM 0 HG2 GLN A 117 0.156 4.089 -8.713 1.00 0.88 H new ATOM 0 HG3 GLN A 117 -0.542 2.830 -7.714 1.00 0.88 H new ATOM 0 HE21 GLN A 117 -1.556 1.274 -8.985 1.00 2.40 H new ATOM 0 HE22 GLN A 117 -2.476 1.624 -10.452 1.00 2.40 H new ATOM 1549 N MET A 118 0.361 7.422 -7.634 1.00 0.77 N ATOM 1550 CA MET A 118 1.395 8.155 -8.424 1.00 0.85 C ATOM 1551 C MET A 118 2.719 8.156 -7.659 1.00 0.57 C ATOM 1552 O MET A 118 3.726 7.678 -8.144 1.00 0.46 O ATOM 1553 CB MET A 118 0.945 9.599 -8.658 1.00 1.19 C ATOM 1554 CG MET A 118 0.179 9.686 -9.980 1.00 1.06 C ATOM 1555 SD MET A 118 -0.506 11.350 -10.174 1.00 3.21 S ATOM 1556 CE MET A 118 0.655 11.926 -11.436 1.00 1.97 C ATOM 0 H MET A 118 -0.430 7.985 -7.321 1.00 0.77 H new ATOM 0 HA MET A 118 1.527 7.658 -9.385 1.00 0.85 H new ATOM 0 HB2 MET A 118 0.312 9.932 -7.836 1.00 1.19 H new ATOM 0 HB3 MET A 118 1.810 10.262 -8.682 1.00 1.19 H new ATOM 0 HG2 MET A 118 0.843 9.455 -10.813 1.00 1.06 H new ATOM 0 HG3 MET A 118 -0.622 8.947 -9.997 1.00 1.06 H new ATOM 0 HE1 MET A 118 0.414 12.953 -11.711 1.00 1.97 H new ATOM 0 HE2 MET A 118 1.671 11.885 -11.042 1.00 1.97 H new ATOM 0 HE3 MET A 118 0.581 11.288 -12.317 1.00 1.97 H new ATOM 1566 N SER A 119 2.729 8.686 -6.468 1.00 0.58 N ATOM 1567 CA SER A 119 3.991 8.712 -5.678 1.00 0.48 C ATOM 1568 C SER A 119 4.343 7.286 -5.250 1.00 0.40 C ATOM 1569 O SER A 119 5.499 6.932 -5.119 1.00 0.35 O ATOM 1570 CB SER A 119 3.803 9.586 -4.438 1.00 0.82 C ATOM 1571 OG SER A 119 2.730 10.491 -4.658 1.00 1.07 O ATOM 0 H SER A 119 1.919 9.102 -6.008 1.00 0.58 H new ATOM 0 HA SER A 119 4.796 9.123 -6.287 1.00 0.48 H new ATOM 0 HB2 SER A 119 3.595 8.963 -3.568 1.00 0.82 H new ATOM 0 HB3 SER A 119 4.720 10.136 -4.225 1.00 0.82 H new ATOM 0 HG SER A 119 2.886 11.314 -4.149 1.00 1.07 H new ATOM 1577 N THR A 120 3.352 6.465 -5.034 1.00 0.42 N ATOM 1578 CA THR A 120 3.626 5.063 -4.617 1.00 0.40 C ATOM 1579 C THR A 120 4.309 4.322 -5.770 1.00 0.35 C ATOM 1580 O THR A 120 5.034 3.371 -5.562 1.00 0.34 O ATOM 1581 CB THR A 120 2.305 4.376 -4.228 1.00 0.55 C ATOM 1582 OG1 THR A 120 1.825 4.938 -3.014 1.00 2.05 O ATOM 1583 CG2 THR A 120 2.524 2.874 -4.037 1.00 1.17 C ATOM 0 H THR A 120 2.365 6.705 -5.129 1.00 0.42 H new ATOM 0 HA THR A 120 4.288 5.050 -3.751 1.00 0.40 H new ATOM 0 HB THR A 120 1.577 4.530 -5.025 1.00 0.55 H new ATOM 0 HG1 THR A 120 1.184 5.651 -3.215 1.00 2.05 H new ATOM 0 HG21 THR A 120 1.581 2.401 -3.762 1.00 1.17 H new ATOM 0 HG22 THR A 120 2.891 2.439 -4.967 1.00 1.17 H new ATOM 0 HG23 THR A 120 3.256 2.711 -3.246 1.00 1.17 H new ATOM 1591 N LYS A 121 4.113 4.767 -6.980 1.00 0.36 N ATOM 1592 CA LYS A 121 4.783 4.103 -8.133 1.00 0.39 C ATOM 1593 C LYS A 121 6.180 4.695 -8.246 1.00 0.37 C ATOM 1594 O LYS A 121 7.135 4.030 -8.599 1.00 0.37 O ATOM 1595 CB LYS A 121 4.005 4.388 -9.421 1.00 0.45 C ATOM 1596 CG LYS A 121 2.744 3.522 -9.468 1.00 1.35 C ATOM 1597 CD LYS A 121 2.795 2.613 -10.697 1.00 1.28 C ATOM 1598 CE LYS A 121 2.445 3.425 -11.946 1.00 1.86 C ATOM 1599 NZ LYS A 121 1.433 2.687 -12.753 1.00 2.50 N ATOM 0 H LYS A 121 3.519 5.561 -7.220 1.00 0.36 H new ATOM 0 HA LYS A 121 4.825 3.024 -7.984 1.00 0.39 H new ATOM 0 HB2 LYS A 121 3.735 5.443 -9.467 1.00 0.45 H new ATOM 0 HB3 LYS A 121 4.632 4.181 -10.288 1.00 0.45 H new ATOM 0 HG2 LYS A 121 2.668 2.922 -8.561 1.00 1.35 H new ATOM 0 HG3 LYS A 121 1.857 4.154 -9.507 1.00 1.35 H new ATOM 0 HD2 LYS A 121 3.789 2.178 -10.800 1.00 1.28 H new ATOM 0 HD3 LYS A 121 2.095 1.786 -10.580 1.00 1.28 H new ATOM 0 HE2 LYS A 121 2.055 4.402 -11.660 1.00 1.86 H new ATOM 0 HE3 LYS A 121 3.341 3.601 -12.541 1.00 1.86 H new ATOM 0 HZ1 LYS A 121 1.196 3.239 -13.602 1.00 2.50 H new ATOM 0 HZ2 LYS A 121 1.821 1.765 -13.037 1.00 2.50 H new ATOM 0 HZ3 LYS A 121 0.575 2.541 -12.184 1.00 2.50 H new ATOM 1613 N VAL A 122 6.299 5.952 -7.923 1.00 0.40 N ATOM 1614 CA VAL A 122 7.618 6.624 -7.974 1.00 0.45 C ATOM 1615 C VAL A 122 8.521 6.029 -6.895 1.00 0.45 C ATOM 1616 O VAL A 122 9.726 6.151 -6.948 1.00 0.49 O ATOM 1617 CB VAL A 122 7.415 8.116 -7.714 1.00 0.51 C ATOM 1618 CG1 VAL A 122 8.768 8.820 -7.608 1.00 0.54 C ATOM 1619 CG2 VAL A 122 6.619 8.717 -8.870 1.00 0.53 C ATOM 0 H VAL A 122 5.526 6.546 -7.623 1.00 0.40 H new ATOM 0 HA VAL A 122 8.081 6.481 -8.950 1.00 0.45 H new ATOM 0 HB VAL A 122 6.873 8.249 -6.778 1.00 0.51 H new ATOM 0 HG11 VAL A 122 8.612 9.883 -7.423 1.00 0.54 H new ATOM 0 HG12 VAL A 122 9.339 8.389 -6.786 1.00 0.54 H new ATOM 0 HG13 VAL A 122 9.319 8.691 -8.540 1.00 0.54 H new ATOM 0 HG21 VAL A 122 6.469 9.782 -8.693 1.00 0.53 H new ATOM 0 HG22 VAL A 122 7.168 8.577 -9.801 1.00 0.53 H new ATOM 0 HG23 VAL A 122 5.651 8.221 -8.942 1.00 0.53 H new ATOM 1629 N LEU A 123 7.945 5.389 -5.913 1.00 0.42 N ATOM 1630 CA LEU A 123 8.767 4.783 -4.834 1.00 0.42 C ATOM 1631 C LEU A 123 9.096 3.341 -5.203 1.00 0.38 C ATOM 1632 O LEU A 123 10.072 2.781 -4.750 1.00 0.37 O ATOM 1633 CB LEU A 123 7.984 4.823 -3.531 1.00 0.51 C ATOM 1634 CG LEU A 123 8.053 6.237 -2.972 1.00 0.79 C ATOM 1635 CD1 LEU A 123 7.123 6.356 -1.769 1.00 2.00 C ATOM 1636 CD2 LEU A 123 9.491 6.536 -2.547 1.00 1.96 C ATOM 0 H LEU A 123 6.938 5.261 -5.814 1.00 0.42 H new ATOM 0 HA LEU A 123 9.696 5.341 -4.713 1.00 0.42 H new ATOM 0 HB2 LEU A 123 6.947 4.533 -3.703 1.00 0.51 H new ATOM 0 HB3 LEU A 123 8.400 4.112 -2.817 1.00 0.51 H new ATOM 0 HG LEU A 123 7.742 6.951 -3.734 1.00 0.79 H new ATOM 0 HD11 LEU A 123 7.173 7.369 -1.369 1.00 2.00 H new ATOM 0 HD12 LEU A 123 6.100 6.137 -2.077 1.00 2.00 H new ATOM 0 HD13 LEU A 123 7.430 5.647 -1.000 1.00 2.00 H new ATOM 0 HD21 LEU A 123 9.549 7.548 -2.145 1.00 1.96 H new ATOM 0 HD22 LEU A 123 9.800 5.824 -1.782 1.00 1.96 H new ATOM 0 HD23 LEU A 123 10.151 6.450 -3.410 1.00 1.96 H new ATOM 1648 N ILE A 124 8.299 2.746 -6.040 1.00 0.40 N ATOM 1649 CA ILE A 124 8.577 1.352 -6.469 1.00 0.39 C ATOM 1650 C ILE A 124 9.781 1.398 -7.406 1.00 0.37 C ATOM 1651 O ILE A 124 10.602 0.500 -7.440 1.00 0.46 O ATOM 1652 CB ILE A 124 7.348 0.800 -7.199 1.00 0.41 C ATOM 1653 CG1 ILE A 124 6.201 0.639 -6.198 1.00 0.70 C ATOM 1654 CG2 ILE A 124 7.671 -0.559 -7.820 1.00 0.35 C ATOM 1655 CD1 ILE A 124 4.876 0.503 -6.951 1.00 1.01 C ATOM 0 H ILE A 124 7.464 3.167 -6.447 1.00 0.40 H new ATOM 0 HA ILE A 124 8.790 0.705 -5.618 1.00 0.39 H new ATOM 0 HB ILE A 124 7.060 1.492 -7.990 1.00 0.41 H new ATOM 0 HG12 ILE A 124 6.369 -0.240 -5.576 1.00 0.70 H new ATOM 0 HG13 ILE A 124 6.164 1.500 -5.530 1.00 0.70 H new ATOM 0 HG21 ILE A 124 6.790 -0.942 -8.336 1.00 0.35 H new ATOM 0 HG22 ILE A 124 8.489 -0.449 -8.532 1.00 0.35 H new ATOM 0 HG23 ILE A 124 7.964 -1.257 -7.036 1.00 0.35 H new ATOM 0 HD11 ILE A 124 4.061 0.389 -6.236 1.00 1.01 H new ATOM 0 HD12 ILE A 124 4.707 1.395 -7.554 1.00 1.01 H new ATOM 0 HD13 ILE A 124 4.915 -0.372 -7.600 1.00 1.01 H new ATOM 1667 N GLN A 125 9.897 2.462 -8.155 1.00 0.27 N ATOM 1668 CA GLN A 125 11.041 2.607 -9.082 1.00 0.25 C ATOM 1669 C GLN A 125 12.198 3.282 -8.342 1.00 0.30 C ATOM 1670 O GLN A 125 13.352 2.960 -8.548 1.00 0.31 O ATOM 1671 CB GLN A 125 10.609 3.470 -10.264 1.00 0.24 C ATOM 1672 CG GLN A 125 10.232 2.566 -11.439 1.00 0.16 C ATOM 1673 CD GLN A 125 10.846 3.110 -12.730 1.00 0.30 C ATOM 1674 OE1 GLN A 125 11.747 3.925 -12.693 1.00 1.09 O ATOM 1675 NE2 GLN A 125 10.394 2.688 -13.878 1.00 0.75 N ATOM 0 H GLN A 125 9.238 3.241 -8.159 1.00 0.27 H new ATOM 0 HA GLN A 125 11.364 1.630 -9.443 1.00 0.25 H new ATOM 0 HB2 GLN A 125 9.760 4.093 -9.983 1.00 0.24 H new ATOM 0 HB3 GLN A 125 11.417 4.143 -10.552 1.00 0.24 H new ATOM 0 HG2 GLN A 125 10.586 1.551 -11.257 1.00 0.16 H new ATOM 0 HG3 GLN A 125 9.148 2.513 -11.536 1.00 0.16 H new ATOM 0 HE21 GLN A 125 9.638 2.004 -13.908 1.00 0.75 H new ATOM 0 HE22 GLN A 125 10.797 3.042 -14.746 1.00 0.75 H new ATOM 1684 N PHE A 126 11.899 4.208 -7.468 1.00 0.33 N ATOM 1685 CA PHE A 126 12.985 4.886 -6.705 1.00 0.38 C ATOM 1686 C PHE A 126 13.602 3.890 -5.722 1.00 0.47 C ATOM 1687 O PHE A 126 14.725 4.045 -5.283 1.00 0.64 O ATOM 1688 CB PHE A 126 12.408 6.070 -5.926 1.00 0.45 C ATOM 1689 CG PHE A 126 12.382 7.293 -6.810 1.00 0.43 C ATOM 1690 CD1 PHE A 126 11.892 7.204 -8.118 1.00 0.37 C ATOM 1691 CD2 PHE A 126 12.850 8.518 -6.318 1.00 0.50 C ATOM 1692 CE1 PHE A 126 11.871 8.341 -8.935 1.00 0.42 C ATOM 1693 CE2 PHE A 126 12.829 9.653 -7.135 1.00 0.53 C ATOM 1694 CZ PHE A 126 12.339 9.565 -8.444 1.00 0.50 C ATOM 0 H PHE A 126 10.953 4.522 -7.251 1.00 0.33 H new ATOM 0 HA PHE A 126 13.746 5.246 -7.398 1.00 0.38 H new ATOM 0 HB2 PHE A 126 11.400 5.836 -5.582 1.00 0.45 H new ATOM 0 HB3 PHE A 126 13.011 6.263 -5.039 1.00 0.45 H new ATOM 0 HD1 PHE A 126 11.530 6.259 -8.497 1.00 0.37 H new ATOM 0 HD2 PHE A 126 13.227 8.586 -5.308 1.00 0.50 H new ATOM 0 HE1 PHE A 126 11.493 8.273 -9.945 1.00 0.42 H new ATOM 0 HE2 PHE A 126 13.191 10.598 -6.756 1.00 0.53 H new ATOM 0 HZ PHE A 126 12.322 10.442 -9.074 1.00 0.50 H new ATOM 1704 N LEU A 127 12.872 2.864 -5.376 1.00 0.44 N ATOM 1705 CA LEU A 127 13.402 1.850 -4.427 1.00 0.52 C ATOM 1706 C LEU A 127 14.225 0.825 -5.202 1.00 0.43 C ATOM 1707 O LEU A 127 15.383 0.596 -4.915 1.00 0.48 O ATOM 1708 CB LEU A 127 12.235 1.146 -3.733 1.00 0.60 C ATOM 1709 CG LEU A 127 11.689 2.041 -2.621 1.00 1.22 C ATOM 1710 CD1 LEU A 127 10.314 1.536 -2.178 1.00 1.99 C ATOM 1711 CD2 LEU A 127 12.648 2.011 -1.430 1.00 0.94 C ATOM 0 H LEU A 127 11.926 2.686 -5.713 1.00 0.44 H new ATOM 0 HA LEU A 127 14.029 2.336 -3.679 1.00 0.52 H new ATOM 0 HB2 LEU A 127 11.449 0.924 -4.455 1.00 0.60 H new ATOM 0 HB3 LEU A 127 12.565 0.193 -3.319 1.00 0.60 H new ATOM 0 HG LEU A 127 11.595 3.061 -2.993 1.00 1.22 H new ATOM 0 HD11 LEU A 127 9.929 2.177 -1.385 1.00 1.99 H new ATOM 0 HD12 LEU A 127 9.629 1.556 -3.025 1.00 1.99 H new ATOM 0 HD13 LEU A 127 10.403 0.515 -1.807 1.00 1.99 H new ATOM 0 HD21 LEU A 127 12.261 2.649 -0.635 1.00 0.94 H new ATOM 0 HD22 LEU A 127 12.740 0.989 -1.063 1.00 0.94 H new ATOM 0 HD23 LEU A 127 13.627 2.374 -1.742 1.00 0.94 H new ATOM 1723 N GLN A 128 13.637 0.209 -6.190 1.00 0.43 N ATOM 1724 CA GLN A 128 14.386 -0.797 -6.989 1.00 0.36 C ATOM 1725 C GLN A 128 15.637 -0.140 -7.589 1.00 0.41 C ATOM 1726 O GLN A 128 16.598 -0.804 -7.926 1.00 0.41 O ATOM 1727 CB GLN A 128 13.496 -1.308 -8.122 1.00 0.45 C ATOM 1728 CG GLN A 128 12.988 -2.712 -7.785 1.00 0.96 C ATOM 1729 CD GLN A 128 12.515 -3.402 -9.067 1.00 1.03 C ATOM 1730 OE1 GLN A 128 13.020 -3.129 -10.137 1.00 1.00 O ATOM 1731 NE2 GLN A 128 11.561 -4.290 -9.003 1.00 1.71 N ATOM 0 H GLN A 128 12.670 0.360 -6.478 1.00 0.43 H new ATOM 0 HA GLN A 128 14.678 -1.628 -6.347 1.00 0.36 H new ATOM 0 HB2 GLN A 128 12.654 -0.632 -8.269 1.00 0.45 H new ATOM 0 HB3 GLN A 128 14.056 -1.328 -9.057 1.00 0.45 H new ATOM 0 HG2 GLN A 128 13.781 -3.295 -7.316 1.00 0.96 H new ATOM 0 HG3 GLN A 128 12.170 -2.652 -7.068 1.00 0.96 H new ATOM 0 HE21 GLN A 128 11.137 -4.519 -8.104 1.00 1.71 H new ATOM 0 HE22 GLN A 128 11.239 -4.755 -9.852 1.00 1.71 H new ATOM 1740 N LYS A 129 15.621 1.161 -7.737 1.00 0.61 N ATOM 1741 CA LYS A 129 16.795 1.871 -8.328 1.00 0.71 C ATOM 1742 C LYS A 129 17.909 2.013 -7.287 1.00 0.40 C ATOM 1743 O LYS A 129 19.013 1.547 -7.479 1.00 0.38 O ATOM 1744 CB LYS A 129 16.367 3.268 -8.783 1.00 1.10 C ATOM 1745 CG LYS A 129 16.016 3.245 -10.272 1.00 0.74 C ATOM 1746 CD LYS A 129 15.189 4.485 -10.620 1.00 1.17 C ATOM 1747 CE LYS A 129 14.934 4.522 -12.129 1.00 1.24 C ATOM 1748 NZ LYS A 129 15.340 5.850 -12.671 1.00 1.71 N ATOM 0 H LYS A 129 14.842 1.764 -7.473 1.00 0.61 H new ATOM 0 HA LYS A 129 17.163 1.293 -9.176 1.00 0.71 H new ATOM 0 HB2 LYS A 129 15.507 3.601 -8.203 1.00 1.10 H new ATOM 0 HB3 LYS A 129 17.171 3.982 -8.601 1.00 1.10 H new ATOM 0 HG2 LYS A 129 16.926 3.222 -10.871 1.00 0.74 H new ATOM 0 HG3 LYS A 129 15.455 2.342 -10.510 1.00 0.74 H new ATOM 0 HD2 LYS A 129 14.242 4.467 -10.081 1.00 1.17 H new ATOM 0 HD3 LYS A 129 15.716 5.386 -10.307 1.00 1.17 H new ATOM 0 HE2 LYS A 129 15.496 3.729 -12.623 1.00 1.24 H new ATOM 0 HE3 LYS A 129 13.879 4.341 -12.335 1.00 1.24 H new ATOM 0 HZ1 LYS A 129 15.166 5.874 -13.696 1.00 1.71 H new ATOM 0 HZ2 LYS A 129 14.785 6.598 -12.208 1.00 1.71 H new ATOM 0 HZ3 LYS A 129 16.352 6.005 -12.487 1.00 1.71 H new ATOM 1762 N LYS A 130 17.630 2.669 -6.193 1.00 0.35 N ATOM 1763 CA LYS A 130 18.679 2.860 -5.148 1.00 0.24 C ATOM 1764 C LYS A 130 18.689 1.678 -4.180 1.00 0.22 C ATOM 1765 O LYS A 130 19.258 1.751 -3.109 1.00 0.40 O ATOM 1766 CB LYS A 130 18.395 4.147 -4.374 1.00 0.55 C ATOM 1767 CG LYS A 130 16.969 4.106 -3.822 1.00 0.75 C ATOM 1768 CD LYS A 130 17.010 4.139 -2.293 1.00 0.90 C ATOM 1769 CE LYS A 130 16.696 2.746 -1.742 1.00 1.58 C ATOM 1770 NZ LYS A 130 15.840 2.871 -0.527 1.00 2.41 N ATOM 0 H LYS A 130 16.722 3.081 -5.977 1.00 0.35 H new ATOM 0 HA LYS A 130 19.653 2.926 -5.634 1.00 0.24 H new ATOM 0 HB2 LYS A 130 19.109 4.258 -3.558 1.00 0.55 H new ATOM 0 HB3 LYS A 130 18.519 5.011 -5.026 1.00 0.55 H new ATOM 0 HG2 LYS A 130 16.398 4.954 -4.199 1.00 0.75 H new ATOM 0 HG3 LYS A 130 16.462 3.203 -4.163 1.00 0.75 H new ATOM 0 HD2 LYS A 130 17.993 4.463 -1.952 1.00 0.90 H new ATOM 0 HD3 LYS A 130 16.287 4.862 -1.915 1.00 0.90 H new ATOM 0 HE2 LYS A 130 16.186 2.151 -2.499 1.00 1.58 H new ATOM 0 HE3 LYS A 130 17.621 2.224 -1.496 1.00 1.58 H new ATOM 0 HZ1 LYS A 130 15.461 1.937 -0.272 1.00 2.41 H new ATOM 0 HZ2 LYS A 130 16.408 3.241 0.262 1.00 2.41 H new ATOM 0 HZ3 LYS A 130 15.053 3.523 -0.722 1.00 2.41 H new ATOM 1784 N ALA A 131 18.079 0.584 -4.542 1.00 0.32 N ATOM 1785 CA ALA A 131 18.079 -0.592 -3.634 1.00 0.43 C ATOM 1786 C ALA A 131 19.298 -1.467 -3.940 1.00 0.82 C ATOM 1787 O ALA A 131 19.195 -2.674 -4.036 1.00 1.17 O ATOM 1788 CB ALA A 131 16.799 -1.400 -3.848 1.00 0.79 C ATOM 0 H ALA A 131 17.583 0.455 -5.424 1.00 0.32 H new ATOM 0 HA ALA A 131 18.124 -0.256 -2.598 1.00 0.43 H new ATOM 0 HB1 ALA A 131 16.798 -2.263 -3.182 1.00 0.79 H new ATOM 0 HB2 ALA A 131 15.933 -0.774 -3.632 1.00 0.79 H new ATOM 0 HB3 ALA A 131 16.752 -1.740 -4.883 1.00 0.79 H new ATOM 1794 N LYS A 132 20.456 -0.868 -4.093 1.00 0.88 N ATOM 1795 CA LYS A 132 21.685 -1.669 -4.391 1.00 1.37 C ATOM 1796 C LYS A 132 21.781 -2.837 -3.405 1.00 1.55 C ATOM 1797 O LYS A 132 21.263 -2.772 -2.309 1.00 1.52 O ATOM 1798 CB LYS A 132 22.922 -0.779 -4.251 1.00 1.57 C ATOM 1799 CG LYS A 132 22.953 -0.163 -2.851 1.00 1.52 C ATOM 1800 CD LYS A 132 23.864 -0.997 -1.948 1.00 2.82 C ATOM 1801 CE LYS A 132 23.244 -1.098 -0.554 1.00 2.97 C ATOM 1802 NZ LYS A 132 22.912 0.268 -0.059 1.00 2.29 N ATOM 0 H LYS A 132 20.602 0.139 -4.024 1.00 0.88 H new ATOM 0 HA LYS A 132 21.631 -2.055 -5.409 1.00 1.37 H new ATOM 0 HB2 LYS A 132 23.825 -1.364 -4.422 1.00 1.57 H new ATOM 0 HB3 LYS A 132 22.904 0.008 -5.005 1.00 1.57 H new ATOM 0 HG2 LYS A 132 23.315 0.864 -2.902 1.00 1.52 H new ATOM 0 HG3 LYS A 132 21.946 -0.126 -2.436 1.00 1.52 H new ATOM 0 HD2 LYS A 132 24.000 -1.993 -2.370 1.00 2.82 H new ATOM 0 HD3 LYS A 132 24.851 -0.539 -1.887 1.00 2.82 H new ATOM 0 HE2 LYS A 132 22.345 -1.713 -0.588 1.00 2.97 H new ATOM 0 HE3 LYS A 132 23.938 -1.586 0.130 1.00 2.97 H new ATOM 0 HZ1 LYS A 132 22.933 0.275 0.981 1.00 2.29 H new ATOM 0 HZ2 LYS A 132 23.609 0.948 -0.424 1.00 2.29 H new ATOM 0 HZ3 LYS A 132 21.962 0.535 -0.388 1.00 2.29 H new ATOM 1816 N ASN A 133 22.419 -3.916 -3.787 1.00 1.75 N ATOM 1817 CA ASN A 133 22.513 -5.090 -2.865 1.00 1.94 C ATOM 1818 C ASN A 133 21.106 -5.432 -2.386 1.00 1.75 C ATOM 1819 O ASN A 133 20.875 -5.758 -1.239 1.00 1.73 O ATOM 1820 CB ASN A 133 23.396 -4.741 -1.667 1.00 2.03 C ATOM 1821 CG ASN A 133 23.496 -5.952 -0.736 1.00 2.89 C ATOM 1822 OD1 ASN A 133 22.919 -5.961 0.333 1.00 3.38 O ATOM 1823 ND2 ASN A 133 24.208 -6.982 -1.101 1.00 3.70 N ATOM 0 H ASN A 133 22.876 -4.034 -4.691 1.00 1.75 H new ATOM 0 HA ASN A 133 22.953 -5.941 -3.384 1.00 1.94 H new ATOM 0 HB2 ASN A 133 24.389 -4.447 -2.007 1.00 2.03 H new ATOM 0 HB3 ASN A 133 22.978 -3.889 -1.130 1.00 2.03 H new ATOM 0 HD21 ASN A 133 24.280 -7.795 -0.489 1.00 3.70 H new ATOM 0 HD22 ASN A 133 24.693 -6.975 -1.999 1.00 3.70 H new ATOM 1830 N LEU A 134 20.167 -5.324 -3.275 1.00 1.63 N ATOM 1831 CA LEU A 134 18.750 -5.596 -2.927 1.00 1.53 C ATOM 1832 C LEU A 134 17.900 -5.392 -4.178 1.00 1.79 C ATOM 1833 O LEU A 134 18.401 -5.415 -5.284 1.00 2.12 O ATOM 1834 CB LEU A 134 18.312 -4.618 -1.829 1.00 1.01 C ATOM 1835 CG LEU A 134 17.994 -5.393 -0.549 1.00 1.13 C ATOM 1836 CD1 LEU A 134 18.497 -4.607 0.664 1.00 0.78 C ATOM 1837 CD2 LEU A 134 16.482 -5.589 -0.436 1.00 1.66 C ATOM 0 H LEU A 134 20.323 -5.054 -4.246 1.00 1.63 H new ATOM 0 HA LEU A 134 18.630 -6.617 -2.565 1.00 1.53 H new ATOM 0 HB2 LEU A 134 19.102 -3.891 -1.639 1.00 1.01 H new ATOM 0 HB3 LEU A 134 17.435 -4.059 -2.155 1.00 1.01 H new ATOM 0 HG LEU A 134 18.487 -6.365 -0.581 1.00 1.13 H new ATOM 0 HD11 LEU A 134 18.270 -5.160 1.575 1.00 0.78 H new ATOM 0 HD12 LEU A 134 19.575 -4.465 0.584 1.00 0.78 H new ATOM 0 HD13 LEU A 134 18.005 -3.635 0.697 1.00 0.78 H new ATOM 0 HD21 LEU A 134 16.254 -6.141 0.476 1.00 1.66 H new ATOM 0 HD22 LEU A 134 15.990 -4.617 -0.404 1.00 1.66 H new ATOM 0 HD23 LEU A 134 16.122 -6.149 -1.299 1.00 1.66 H new ATOM 1849 N ASP A 135 16.624 -5.199 -4.010 1.00 1.89 N ATOM 1850 CA ASP A 135 15.715 -4.995 -5.179 1.00 2.58 C ATOM 1851 C ASP A 135 15.427 -6.354 -5.831 1.00 1.62 C ATOM 1852 O ASP A 135 16.216 -7.274 -5.743 1.00 1.01 O ATOM 1853 CB ASP A 135 16.343 -3.986 -6.183 1.00 3.67 C ATOM 1854 CG ASP A 135 16.982 -4.687 -7.397 1.00 4.01 C ATOM 1855 OD1 ASP A 135 16.251 -5.316 -8.145 1.00 4.29 O ATOM 1856 OD2 ASP A 135 18.186 -4.575 -7.554 1.00 4.30 O ATOM 0 H ASP A 135 16.162 -5.173 -3.101 1.00 1.89 H new ATOM 0 HA ASP A 135 14.769 -4.566 -4.848 1.00 2.58 H new ATOM 0 HB2 ASP A 135 15.574 -3.295 -6.529 1.00 3.67 H new ATOM 0 HB3 ASP A 135 17.099 -3.391 -5.671 1.00 3.67 H new ATOM 1861 N ALA A 136 14.295 -6.492 -6.461 1.00 1.93 N ATOM 1862 CA ALA A 136 13.947 -7.794 -7.089 1.00 1.83 C ATOM 1863 C ALA A 136 13.679 -8.782 -5.976 1.00 1.64 C ATOM 1864 O ALA A 136 14.263 -9.843 -5.895 1.00 2.82 O ATOM 1865 CB ALA A 136 15.096 -8.296 -7.962 1.00 1.61 C ATOM 0 H ALA A 136 13.595 -5.758 -6.568 1.00 1.93 H new ATOM 0 HA ALA A 136 13.070 -7.679 -7.726 1.00 1.83 H new ATOM 0 HB1 ALA A 136 14.821 -9.250 -8.412 1.00 1.61 H new ATOM 0 HB2 ALA A 136 15.300 -7.569 -8.748 1.00 1.61 H new ATOM 0 HB3 ALA A 136 15.988 -8.428 -7.349 1.00 1.61 H new ATOM 1871 N ILE A 137 12.798 -8.406 -5.109 1.00 1.36 N ATOM 1872 CA ILE A 137 12.439 -9.255 -3.961 1.00 1.53 C ATOM 1873 C ILE A 137 11.320 -10.214 -4.408 1.00 2.06 C ATOM 1874 O ILE A 137 10.280 -10.323 -3.793 1.00 2.49 O ATOM 1875 CB ILE A 137 11.978 -8.299 -2.850 1.00 1.89 C ATOM 1876 CG1 ILE A 137 13.203 -7.684 -2.170 1.00 1.47 C ATOM 1877 CG2 ILE A 137 11.149 -9.022 -1.805 1.00 2.62 C ATOM 1878 CD1 ILE A 137 14.018 -6.878 -3.179 1.00 0.82 C ATOM 0 H ILE A 137 12.298 -7.518 -5.151 1.00 1.36 H new ATOM 0 HA ILE A 137 13.266 -9.864 -3.595 1.00 1.53 H new ATOM 0 HB ILE A 137 11.362 -7.524 -3.306 1.00 1.89 H new ATOM 0 HG12 ILE A 137 12.887 -7.040 -1.349 1.00 1.47 H new ATOM 0 HG13 ILE A 137 13.821 -8.471 -1.738 1.00 1.47 H new ATOM 0 HG21 ILE A 137 10.839 -8.316 -1.034 1.00 2.62 H new ATOM 0 HG22 ILE A 137 10.267 -9.455 -2.276 1.00 2.62 H new ATOM 0 HG23 ILE A 137 11.745 -9.815 -1.353 1.00 2.62 H new ATOM 0 HD11 ILE A 137 14.887 -6.446 -2.683 1.00 0.82 H new ATOM 0 HD12 ILE A 137 14.349 -7.533 -3.985 1.00 0.82 H new ATOM 0 HD13 ILE A 137 13.401 -6.080 -3.591 1.00 0.82 H new ATOM 1890 N THR A 138 11.520 -10.906 -5.499 1.00 2.19 N ATOM 1891 CA THR A 138 10.466 -11.830 -5.995 1.00 2.63 C ATOM 1892 C THR A 138 9.167 -11.040 -6.168 1.00 2.39 C ATOM 1893 O THR A 138 9.075 -9.891 -5.784 1.00 2.20 O ATOM 1894 CB THR A 138 10.251 -12.978 -5.001 1.00 2.92 C ATOM 1895 OG1 THR A 138 11.039 -12.766 -3.838 1.00 2.89 O ATOM 1896 CG2 THR A 138 10.664 -14.295 -5.657 1.00 3.49 C ATOM 0 H THR A 138 12.368 -10.869 -6.065 1.00 2.19 H new ATOM 0 HA THR A 138 10.774 -12.258 -6.949 1.00 2.63 H new ATOM 0 HB THR A 138 9.199 -13.017 -4.719 1.00 2.92 H new ATOM 0 HG1 THR A 138 10.895 -13.502 -3.207 1.00 2.89 H new ATOM 0 HG21 THR A 138 10.513 -15.115 -4.954 1.00 3.49 H new ATOM 0 HG22 THR A 138 10.058 -14.464 -6.547 1.00 3.49 H new ATOM 0 HG23 THR A 138 11.716 -14.247 -5.938 1.00 3.49 H new ATOM 1904 N THR A 139 8.169 -11.629 -6.752 1.00 2.38 N ATOM 1905 CA THR A 139 6.899 -10.885 -6.951 1.00 2.13 C ATOM 1906 C THR A 139 5.861 -11.825 -7.579 1.00 1.92 C ATOM 1907 O THR A 139 6.226 -12.743 -8.287 1.00 2.01 O ATOM 1908 CB THR A 139 7.186 -9.675 -7.864 1.00 1.92 C ATOM 1909 OG1 THR A 139 6.161 -8.706 -7.713 1.00 1.78 O ATOM 1910 CG2 THR A 139 7.268 -10.104 -9.337 1.00 1.73 C ATOM 0 H THR A 139 8.175 -12.588 -7.099 1.00 2.38 H new ATOM 0 HA THR A 139 6.500 -10.525 -6.003 1.00 2.13 H new ATOM 0 HB THR A 139 8.145 -9.248 -7.572 1.00 1.92 H new ATOM 0 HG1 THR A 139 5.527 -8.781 -8.457 1.00 1.78 H new ATOM 0 HG21 THR A 139 7.471 -9.232 -9.959 1.00 1.73 H new ATOM 0 HG22 THR A 139 8.070 -10.832 -9.460 1.00 1.73 H new ATOM 0 HG23 THR A 139 6.321 -10.552 -9.639 1.00 1.73 H new ATOM 1918 N PRO A 140 4.599 -11.580 -7.315 1.00 1.76 N ATOM 1919 CA PRO A 140 3.527 -12.411 -7.870 1.00 1.65 C ATOM 1920 C PRO A 140 3.350 -12.103 -9.347 1.00 1.20 C ATOM 1921 O PRO A 140 2.962 -11.016 -9.730 1.00 0.83 O ATOM 1922 CB PRO A 140 2.295 -12.033 -7.043 1.00 1.95 C ATOM 1923 CG PRO A 140 2.587 -10.639 -6.440 1.00 1.96 C ATOM 1924 CD PRO A 140 4.118 -10.462 -6.465 1.00 1.83 C ATOM 0 HA PRO A 140 3.727 -13.481 -7.814 1.00 1.65 H new ATOM 0 HB2 PRO A 140 1.401 -12.007 -7.666 1.00 1.95 H new ATOM 0 HB3 PRO A 140 2.114 -12.766 -6.257 1.00 1.95 H new ATOM 0 HG2 PRO A 140 2.097 -9.856 -7.018 1.00 1.96 H new ATOM 0 HG3 PRO A 140 2.205 -10.569 -5.421 1.00 1.96 H new ATOM 0 HD2 PRO A 140 4.401 -9.495 -6.881 1.00 1.83 H new ATOM 0 HD3 PRO A 140 4.541 -10.513 -5.462 1.00 1.83 H new ATOM 1932 N ASP A 141 3.653 -13.072 -10.168 1.00 1.45 N ATOM 1933 CA ASP A 141 3.534 -12.926 -11.648 1.00 1.57 C ATOM 1934 C ASP A 141 2.254 -12.144 -11.999 1.00 1.47 C ATOM 1935 O ASP A 141 1.357 -12.068 -11.190 1.00 1.48 O ATOM 1936 CB ASP A 141 3.459 -14.336 -12.232 1.00 2.42 C ATOM 1937 CG ASP A 141 4.520 -14.519 -13.318 1.00 2.92 C ATOM 1938 OD1 ASP A 141 5.577 -13.923 -13.193 1.00 2.97 O ATOM 1939 OD2 ASP A 141 4.259 -15.254 -14.257 1.00 3.41 O ATOM 0 H ASP A 141 3.988 -13.986 -9.864 1.00 1.45 H new ATOM 0 HA ASP A 141 4.385 -12.380 -12.054 1.00 1.57 H new ATOM 0 HB2 ASP A 141 3.607 -15.072 -11.442 1.00 2.42 H new ATOM 0 HB3 ASP A 141 2.468 -14.512 -12.650 1.00 2.42 H new ATOM 1944 N PRO A 142 2.193 -11.586 -13.188 1.00 1.41 N ATOM 1945 CA PRO A 142 1.011 -10.819 -13.622 1.00 1.34 C ATOM 1946 C PRO A 142 -0.188 -11.750 -13.846 1.00 1.31 C ATOM 1947 O PRO A 142 -1.301 -11.302 -14.039 1.00 1.31 O ATOM 1948 CB PRO A 142 1.467 -10.144 -14.921 1.00 1.44 C ATOM 1949 CG PRO A 142 2.667 -10.968 -15.437 1.00 1.53 C ATOM 1950 CD PRO A 142 3.267 -11.670 -14.205 1.00 1.44 C ATOM 0 HA PRO A 142 0.675 -10.092 -12.882 1.00 1.34 H new ATOM 0 HB2 PRO A 142 0.661 -10.128 -15.655 1.00 1.44 H new ATOM 0 HB3 PRO A 142 1.755 -9.108 -14.741 1.00 1.44 H new ATOM 0 HG2 PRO A 142 2.348 -11.696 -16.183 1.00 1.53 H new ATOM 0 HG3 PRO A 142 3.405 -10.324 -15.916 1.00 1.53 H new ATOM 0 HD2 PRO A 142 3.530 -12.705 -14.424 1.00 1.44 H new ATOM 0 HD3 PRO A 142 4.177 -11.175 -13.867 1.00 1.44 H new ATOM 1958 N THR A 143 0.021 -13.039 -13.792 1.00 1.44 N ATOM 1959 CA THR A 143 -1.119 -13.981 -13.972 1.00 1.57 C ATOM 1960 C THR A 143 -1.734 -14.262 -12.602 1.00 1.36 C ATOM 1961 O THR A 143 -2.938 -14.321 -12.450 1.00 1.36 O ATOM 1962 CB THR A 143 -0.617 -15.285 -14.595 1.00 1.85 C ATOM 1963 OG1 THR A 143 0.285 -15.919 -13.700 1.00 1.96 O ATOM 1964 CG2 THR A 143 0.095 -14.976 -15.912 1.00 1.67 C ATOM 0 H THR A 143 0.928 -13.477 -13.632 1.00 1.44 H new ATOM 0 HA THR A 143 -1.867 -13.543 -14.633 1.00 1.57 H new ATOM 0 HB THR A 143 -1.460 -15.948 -14.787 1.00 1.85 H new ATOM 0 HG1 THR A 143 0.606 -16.755 -14.097 1.00 1.96 H new ATOM 0 HG21 THR A 143 0.454 -15.904 -16.358 1.00 1.67 H new ATOM 0 HG22 THR A 143 -0.600 -14.490 -16.596 1.00 1.67 H new ATOM 0 HG23 THR A 143 0.940 -14.314 -15.722 1.00 1.67 H new ATOM 1972 N THR A 144 -0.913 -14.414 -11.597 1.00 1.22 N ATOM 1973 CA THR A 144 -1.446 -14.665 -10.231 1.00 1.06 C ATOM 1974 C THR A 144 -2.045 -13.363 -9.701 1.00 0.84 C ATOM 1975 O THR A 144 -3.045 -13.358 -9.011 1.00 0.80 O ATOM 1976 CB THR A 144 -0.312 -15.121 -9.310 1.00 0.96 C ATOM 1977 OG1 THR A 144 0.592 -15.935 -10.043 1.00 0.95 O ATOM 1978 CG2 THR A 144 -0.893 -15.918 -8.143 1.00 1.02 C ATOM 0 H THR A 144 0.104 -14.375 -11.665 1.00 1.22 H new ATOM 0 HA THR A 144 -2.208 -15.444 -10.264 1.00 1.06 H new ATOM 0 HB THR A 144 0.218 -14.250 -8.923 1.00 0.96 H new ATOM 0 HG1 THR A 144 1.320 -16.227 -9.455 1.00 0.95 H new ATOM 0 HG21 THR A 144 -0.086 -16.243 -7.487 1.00 1.02 H new ATOM 0 HG22 THR A 144 -1.586 -15.290 -7.583 1.00 1.02 H new ATOM 0 HG23 THR A 144 -1.423 -16.790 -8.526 1.00 1.02 H new ATOM 1986 N ASN A 145 -1.448 -12.256 -10.046 1.00 0.77 N ATOM 1987 CA ASN A 145 -1.984 -10.942 -9.601 1.00 0.58 C ATOM 1988 C ASN A 145 -3.351 -10.735 -10.255 1.00 0.65 C ATOM 1989 O ASN A 145 -4.141 -9.921 -9.824 1.00 0.48 O ATOM 1990 CB ASN A 145 -1.030 -9.826 -10.039 1.00 0.69 C ATOM 1991 CG ASN A 145 -0.332 -9.241 -8.812 1.00 0.80 C ATOM 1992 OD1 ASN A 145 0.873 -9.077 -8.804 1.00 1.10 O ATOM 1993 ND2 ASN A 145 -1.040 -8.914 -7.768 1.00 0.75 N ATOM 0 H ASN A 145 -0.607 -12.206 -10.621 1.00 0.77 H new ATOM 0 HA ASN A 145 -2.080 -10.921 -8.515 1.00 0.58 H new ATOM 0 HB2 ASN A 145 -0.291 -10.218 -10.738 1.00 0.69 H new ATOM 0 HB3 ASN A 145 -1.582 -9.046 -10.563 1.00 0.69 H new ATOM 0 HD21 ASN A 145 -0.583 -8.521 -6.945 1.00 0.75 H new ATOM 0 HD22 ASN A 145 -2.051 -9.051 -7.774 1.00 0.75 H new ATOM 2000 N ALA A 146 -3.632 -11.476 -11.296 1.00 0.94 N ATOM 2001 CA ALA A 146 -4.940 -11.339 -11.981 1.00 1.04 C ATOM 2002 C ALA A 146 -5.986 -12.153 -11.233 1.00 1.08 C ATOM 2003 O ALA A 146 -7.155 -11.851 -11.280 1.00 1.10 O ATOM 2004 CB ALA A 146 -4.810 -11.855 -13.415 1.00 1.13 C ATOM 0 H ALA A 146 -3.004 -12.172 -11.699 1.00 0.94 H new ATOM 0 HA ALA A 146 -5.244 -10.292 -11.998 1.00 1.04 H new ATOM 0 HB1 ALA A 146 -5.768 -11.757 -13.925 1.00 1.13 H new ATOM 0 HB2 ALA A 146 -4.056 -11.272 -13.944 1.00 1.13 H new ATOM 0 HB3 ALA A 146 -4.513 -12.904 -13.399 1.00 1.13 H new ATOM 2010 N SER A 147 -5.582 -13.178 -10.536 1.00 1.10 N ATOM 2011 CA SER A 147 -6.578 -13.988 -9.785 1.00 1.14 C ATOM 2012 C SER A 147 -6.935 -13.255 -8.495 1.00 1.02 C ATOM 2013 O SER A 147 -8.068 -13.267 -8.061 1.00 1.03 O ATOM 2014 CB SER A 147 -5.994 -15.364 -9.460 1.00 1.22 C ATOM 2015 OG SER A 147 -6.412 -16.297 -10.448 1.00 0.81 O ATOM 0 H SER A 147 -4.613 -13.487 -10.455 1.00 1.10 H new ATOM 0 HA SER A 147 -7.474 -14.125 -10.391 1.00 1.14 H new ATOM 0 HB2 SER A 147 -4.906 -15.312 -9.430 1.00 1.22 H new ATOM 0 HB3 SER A 147 -6.325 -15.689 -8.474 1.00 1.22 H new ATOM 0 HG SER A 147 -6.038 -17.179 -10.244 1.00 0.81 H new ATOM 2021 N LEU A 148 -5.985 -12.595 -7.890 1.00 0.91 N ATOM 2022 CA LEU A 148 -6.295 -11.838 -6.647 1.00 0.80 C ATOM 2023 C LEU A 148 -7.104 -10.610 -7.044 1.00 0.63 C ATOM 2024 O LEU A 148 -8.190 -10.388 -6.569 1.00 0.48 O ATOM 2025 CB LEU A 148 -4.994 -11.392 -5.961 1.00 0.85 C ATOM 2026 CG LEU A 148 -5.288 -10.308 -4.902 1.00 0.78 C ATOM 2027 CD1 LEU A 148 -6.397 -10.768 -3.954 1.00 0.77 C ATOM 2028 CD2 LEU A 148 -4.029 -10.031 -4.093 1.00 0.88 C ATOM 0 H LEU A 148 -5.015 -12.548 -8.201 1.00 0.91 H new ATOM 0 HA LEU A 148 -6.854 -12.466 -5.953 1.00 0.80 H new ATOM 0 HB2 LEU A 148 -4.512 -12.248 -5.490 1.00 0.85 H new ATOM 0 HB3 LEU A 148 -4.298 -11.004 -6.705 1.00 0.85 H new ATOM 0 HG LEU A 148 -5.611 -9.402 -5.415 1.00 0.78 H new ATOM 0 HD11 LEU A 148 -6.590 -9.990 -3.215 1.00 0.77 H new ATOM 0 HD12 LEU A 148 -7.306 -10.960 -4.524 1.00 0.77 H new ATOM 0 HD13 LEU A 148 -6.086 -11.682 -3.447 1.00 0.77 H new ATOM 0 HD21 LEU A 148 -4.238 -9.265 -3.346 1.00 0.88 H new ATOM 0 HD22 LEU A 148 -3.708 -10.946 -3.595 1.00 0.88 H new ATOM 0 HD23 LEU A 148 -3.239 -9.683 -4.758 1.00 0.88 H new ATOM 2040 N LEU A 149 -6.566 -9.814 -7.919 1.00 0.73 N ATOM 2041 CA LEU A 149 -7.283 -8.593 -8.367 1.00 0.65 C ATOM 2042 C LEU A 149 -8.664 -8.982 -8.882 1.00 0.57 C ATOM 2043 O LEU A 149 -9.629 -8.277 -8.697 1.00 0.52 O ATOM 2044 CB LEU A 149 -6.492 -7.948 -9.504 1.00 0.78 C ATOM 2045 CG LEU A 149 -7.135 -6.617 -9.905 1.00 0.79 C ATOM 2046 CD1 LEU A 149 -7.328 -5.738 -8.668 1.00 0.77 C ATOM 2047 CD2 LEU A 149 -6.225 -5.895 -10.903 1.00 1.01 C ATOM 0 H LEU A 149 -5.652 -9.958 -8.347 1.00 0.73 H new ATOM 0 HA LEU A 149 -7.384 -7.895 -7.536 1.00 0.65 H new ATOM 0 HB2 LEU A 149 -5.461 -7.783 -9.192 1.00 0.78 H new ATOM 0 HB3 LEU A 149 -6.462 -8.619 -10.362 1.00 0.78 H new ATOM 0 HG LEU A 149 -8.105 -6.810 -10.363 1.00 0.79 H new ATOM 0 HD11 LEU A 149 -7.786 -4.793 -8.961 1.00 0.77 H new ATOM 0 HD12 LEU A 149 -7.975 -6.249 -7.956 1.00 0.77 H new ATOM 0 HD13 LEU A 149 -6.361 -5.544 -8.205 1.00 0.77 H new ATOM 0 HD21 LEU A 149 -6.680 -4.947 -11.190 1.00 1.01 H new ATOM 0 HD22 LEU A 149 -5.256 -5.707 -10.441 1.00 1.01 H new ATOM 0 HD23 LEU A 149 -6.091 -6.516 -11.788 1.00 1.01 H new ATOM 2059 N THR A 150 -8.754 -10.106 -9.526 1.00 0.61 N ATOM 2060 CA THR A 150 -10.063 -10.562 -10.062 1.00 0.53 C ATOM 2061 C THR A 150 -10.952 -11.001 -8.892 1.00 0.48 C ATOM 2062 O THR A 150 -12.158 -10.894 -8.943 1.00 0.57 O ATOM 2063 CB THR A 150 -9.806 -11.735 -11.023 1.00 0.61 C ATOM 2064 OG1 THR A 150 -9.272 -11.233 -12.240 1.00 1.38 O ATOM 2065 CG2 THR A 150 -11.095 -12.490 -11.323 1.00 1.10 C ATOM 0 H THR A 150 -7.971 -10.735 -9.706 1.00 0.61 H new ATOM 0 HA THR A 150 -10.569 -9.761 -10.601 1.00 0.53 H new ATOM 0 HB THR A 150 -9.103 -12.420 -10.550 1.00 0.61 H new ATOM 0 HG1 THR A 150 -8.360 -11.571 -12.361 1.00 1.38 H new ATOM 0 HG21 THR A 150 -10.884 -13.314 -12.005 1.00 1.10 H new ATOM 0 HG22 THR A 150 -11.510 -12.884 -10.395 1.00 1.10 H new ATOM 0 HG23 THR A 150 -11.814 -11.813 -11.784 1.00 1.10 H new ATOM 2073 N LYS A 151 -10.357 -11.502 -7.848 1.00 0.49 N ATOM 2074 CA LYS A 151 -11.149 -11.967 -6.673 1.00 0.46 C ATOM 2075 C LYS A 151 -11.779 -10.778 -5.934 1.00 0.42 C ATOM 2076 O LYS A 151 -12.963 -10.774 -5.662 1.00 0.39 O ATOM 2077 CB LYS A 151 -10.230 -12.730 -5.721 1.00 0.61 C ATOM 2078 CG LYS A 151 -11.073 -13.441 -4.663 1.00 0.64 C ATOM 2079 CD LYS A 151 -10.189 -13.810 -3.472 1.00 0.81 C ATOM 2080 CE LYS A 151 -10.675 -13.063 -2.230 1.00 1.30 C ATOM 2081 NZ LYS A 151 -11.926 -13.700 -1.730 1.00 1.89 N ATOM 0 H LYS A 151 -9.347 -11.611 -7.756 1.00 0.49 H new ATOM 0 HA LYS A 151 -11.950 -12.618 -7.024 1.00 0.46 H new ATOM 0 HB2 LYS A 151 -9.635 -13.456 -6.276 1.00 0.61 H new ATOM 0 HB3 LYS A 151 -9.531 -12.043 -5.244 1.00 0.61 H new ATOM 0 HG2 LYS A 151 -11.889 -12.795 -4.338 1.00 0.64 H new ATOM 0 HG3 LYS A 151 -11.526 -14.338 -5.086 1.00 0.64 H new ATOM 0 HD2 LYS A 151 -10.222 -14.886 -3.299 1.00 0.81 H new ATOM 0 HD3 LYS A 151 -9.151 -13.553 -3.682 1.00 0.81 H new ATOM 0 HE2 LYS A 151 -9.908 -13.084 -1.456 1.00 1.30 H new ATOM 0 HE3 LYS A 151 -10.857 -12.015 -2.470 1.00 1.30 H new ATOM 0 HZ1 LYS A 151 -11.893 -13.762 -0.692 1.00 1.89 H new ATOM 0 HZ2 LYS A 151 -12.746 -13.128 -2.017 1.00 1.89 H new ATOM 0 HZ3 LYS A 151 -12.013 -14.655 -2.131 1.00 1.89 H new ATOM 2095 N LEU A 152 -11.012 -9.767 -5.605 1.00 0.62 N ATOM 2096 CA LEU A 152 -11.610 -8.600 -4.890 1.00 0.58 C ATOM 2097 C LEU A 152 -12.573 -7.914 -5.840 1.00 0.23 C ATOM 2098 O LEU A 152 -13.648 -7.494 -5.459 1.00 0.13 O ATOM 2099 CB LEU A 152 -10.543 -7.585 -4.412 1.00 0.94 C ATOM 2100 CG LEU A 152 -9.267 -7.660 -5.259 1.00 0.39 C ATOM 2101 CD1 LEU A 152 -8.618 -6.277 -5.344 1.00 0.80 C ATOM 2102 CD2 LEU A 152 -8.287 -8.629 -4.600 1.00 0.81 C ATOM 0 H LEU A 152 -10.013 -9.700 -5.798 1.00 0.62 H new ATOM 0 HA LEU A 152 -12.119 -8.966 -3.998 1.00 0.58 H new ATOM 0 HB2 LEU A 152 -10.953 -6.576 -4.461 1.00 0.94 H new ATOM 0 HB3 LEU A 152 -10.298 -7.779 -3.368 1.00 0.94 H new ATOM 0 HG LEU A 152 -9.519 -8.004 -6.262 1.00 0.39 H new ATOM 0 HD11 LEU A 152 -7.712 -6.337 -5.947 1.00 0.80 H new ATOM 0 HD12 LEU A 152 -9.314 -5.576 -5.804 1.00 0.80 H new ATOM 0 HD13 LEU A 152 -8.365 -5.932 -4.342 1.00 0.80 H new ATOM 0 HD21 LEU A 152 -7.377 -8.688 -5.197 1.00 0.81 H new ATOM 0 HD22 LEU A 152 -8.042 -8.274 -3.599 1.00 0.81 H new ATOM 0 HD23 LEU A 152 -8.742 -9.617 -4.534 1.00 0.81 H new ATOM 2114 N GLN A 153 -12.204 -7.801 -7.084 1.00 0.42 N ATOM 2115 CA GLN A 153 -13.111 -7.148 -8.056 1.00 0.60 C ATOM 2116 C GLN A 153 -14.270 -8.096 -8.402 1.00 0.61 C ATOM 2117 O GLN A 153 -15.223 -7.709 -9.048 1.00 0.98 O ATOM 2118 CB GLN A 153 -12.342 -6.785 -9.329 1.00 0.90 C ATOM 2119 CG GLN A 153 -12.478 -5.286 -9.601 1.00 0.34 C ATOM 2120 CD GLN A 153 -12.939 -5.067 -11.042 1.00 0.61 C ATOM 2121 OE1 GLN A 153 -13.775 -4.225 -11.307 1.00 0.66 O ATOM 2122 NE2 GLN A 153 -12.422 -5.795 -11.993 1.00 1.84 N ATOM 0 H GLN A 153 -11.318 -8.132 -7.465 1.00 0.42 H new ATOM 0 HA GLN A 153 -13.511 -6.237 -7.611 1.00 0.60 H new ATOM 0 HB2 GLN A 153 -11.291 -7.051 -9.219 1.00 0.90 H new ATOM 0 HB3 GLN A 153 -12.728 -7.355 -10.174 1.00 0.90 H new ATOM 0 HG2 GLN A 153 -13.194 -4.844 -8.908 1.00 0.34 H new ATOM 0 HG3 GLN A 153 -11.523 -4.788 -9.434 1.00 0.34 H new ATOM 0 HE21 GLN A 153 -11.721 -6.501 -11.771 1.00 1.84 H new ATOM 0 HE22 GLN A 153 -12.719 -5.658 -12.959 1.00 1.84 H new ATOM 2131 N ALA A 154 -14.196 -9.334 -7.980 1.00 0.40 N ATOM 2132 CA ALA A 154 -15.291 -10.300 -8.289 1.00 0.48 C ATOM 2133 C ALA A 154 -16.151 -10.514 -7.042 1.00 0.44 C ATOM 2134 O ALA A 154 -16.520 -11.626 -6.719 1.00 0.28 O ATOM 2135 CB ALA A 154 -14.682 -11.640 -8.706 1.00 0.46 C ATOM 0 H ALA A 154 -13.423 -9.716 -7.435 1.00 0.40 H new ATOM 0 HA ALA A 154 -15.905 -9.903 -9.097 1.00 0.48 H new ATOM 0 HB1 ALA A 154 -15.480 -12.348 -8.932 1.00 0.46 H new ATOM 0 HB2 ALA A 154 -14.061 -11.498 -9.591 1.00 0.46 H new ATOM 0 HB3 ALA A 154 -14.071 -12.031 -7.893 1.00 0.46 H new ATOM 2141 N GLN A 155 -16.472 -9.467 -6.333 1.00 0.81 N ATOM 2142 CA GLN A 155 -17.301 -9.634 -5.105 1.00 0.86 C ATOM 2143 C GLN A 155 -18.479 -8.658 -5.139 1.00 0.98 C ATOM 2144 O GLN A 155 -18.495 -7.712 -5.902 1.00 1.10 O ATOM 2145 CB GLN A 155 -16.446 -9.356 -3.863 1.00 0.58 C ATOM 2146 CG GLN A 155 -15.064 -9.995 -4.028 1.00 0.65 C ATOM 2147 CD GLN A 155 -14.693 -10.747 -2.750 1.00 0.45 C ATOM 2148 OE1 GLN A 155 -14.638 -11.960 -2.739 1.00 0.46 O ATOM 2149 NE2 GLN A 155 -14.431 -10.074 -1.662 1.00 1.19 N ATOM 0 H GLN A 155 -16.198 -8.508 -6.549 1.00 0.81 H new ATOM 0 HA GLN A 155 -17.678 -10.656 -5.066 1.00 0.86 H new ATOM 0 HB2 GLN A 155 -16.344 -8.281 -3.714 1.00 0.58 H new ATOM 0 HB3 GLN A 155 -16.937 -9.755 -2.976 1.00 0.58 H new ATOM 0 HG2 GLN A 155 -15.067 -10.679 -4.877 1.00 0.65 H new ATOM 0 HG3 GLN A 155 -14.320 -9.227 -4.240 1.00 0.65 H new ATOM 0 HE21 GLN A 155 -14.477 -9.055 -1.669 1.00 1.19 H new ATOM 0 HE22 GLN A 155 -14.181 -10.567 -0.805 1.00 1.19 H new ATOM 2158 N ASN A 156 -19.466 -8.878 -4.309 1.00 1.07 N ATOM 2159 CA ASN A 156 -20.646 -7.965 -4.280 1.00 1.23 C ATOM 2160 C ASN A 156 -20.175 -6.522 -4.139 1.00 1.17 C ATOM 2161 O ASN A 156 -19.089 -6.261 -3.676 1.00 0.98 O ATOM 2162 CB ASN A 156 -21.535 -8.320 -3.085 1.00 1.42 C ATOM 2163 CG ASN A 156 -22.423 -9.513 -3.445 1.00 1.56 C ATOM 2164 OD1 ASN A 156 -22.242 -10.132 -4.474 1.00 1.12 O ATOM 2165 ND2 ASN A 156 -23.383 -9.862 -2.633 1.00 2.55 N ATOM 0 H ASN A 156 -19.505 -9.654 -3.648 1.00 1.07 H new ATOM 0 HA ASN A 156 -21.209 -8.077 -5.206 1.00 1.23 H new ATOM 0 HB2 ASN A 156 -20.919 -8.560 -2.219 1.00 1.42 H new ATOM 0 HB3 ASN A 156 -22.152 -7.464 -2.810 1.00 1.42 H new ATOM 0 HD21 ASN A 156 -23.982 -10.655 -2.862 1.00 2.55 H new ATOM 0 HD22 ASN A 156 -23.534 -9.342 -1.769 1.00 2.55 H new ATOM 2172 N GLN A 157 -20.991 -5.576 -4.517 1.00 1.41 N ATOM 2173 CA GLN A 157 -20.587 -4.144 -4.379 1.00 1.44 C ATOM 2174 C GLN A 157 -20.085 -3.903 -2.954 1.00 1.42 C ATOM 2175 O GLN A 157 -19.306 -3.011 -2.695 1.00 1.40 O ATOM 2176 CB GLN A 157 -21.800 -3.254 -4.642 1.00 1.68 C ATOM 2177 CG GLN A 157 -21.374 -1.785 -4.610 1.00 2.05 C ATOM 2178 CD GLN A 157 -21.899 -1.075 -5.859 1.00 2.27 C ATOM 2179 OE1 GLN A 157 -21.186 -0.925 -6.830 1.00 3.09 O ATOM 2180 NE2 GLN A 157 -23.126 -0.631 -5.874 1.00 2.01 N ATOM 0 H GLN A 157 -21.918 -5.730 -4.914 1.00 1.41 H new ATOM 0 HA GLN A 157 -19.798 -3.910 -5.094 1.00 1.44 H new ATOM 0 HB2 GLN A 157 -22.238 -3.495 -5.611 1.00 1.68 H new ATOM 0 HB3 GLN A 157 -22.568 -3.437 -3.891 1.00 1.68 H new ATOM 0 HG2 GLN A 157 -21.763 -1.302 -3.714 1.00 2.05 H new ATOM 0 HG3 GLN A 157 -20.287 -1.711 -4.566 1.00 2.05 H new ATOM 0 HE21 GLN A 157 -23.724 -0.758 -5.058 1.00 2.01 H new ATOM 0 HE22 GLN A 157 -23.487 -0.157 -6.702 1.00 2.01 H new ATOM 2189 N TRP A 158 -20.543 -4.698 -2.033 1.00 1.42 N ATOM 2190 CA TRP A 158 -20.126 -4.548 -0.618 1.00 1.39 C ATOM 2191 C TRP A 158 -18.732 -5.167 -0.416 1.00 0.99 C ATOM 2192 O TRP A 158 -17.811 -4.505 0.008 1.00 0.85 O ATOM 2193 CB TRP A 158 -21.214 -5.228 0.252 1.00 1.68 C ATOM 2194 CG TRP A 158 -20.667 -6.239 1.230 1.00 1.19 C ATOM 2195 CD1 TRP A 158 -21.158 -7.483 1.388 1.00 2.26 C ATOM 2196 CD2 TRP A 158 -19.566 -6.117 2.178 1.00 2.21 C ATOM 2197 NE1 TRP A 158 -20.433 -8.137 2.365 1.00 2.62 N ATOM 2198 CE2 TRP A 158 -19.440 -7.335 2.884 1.00 2.51 C ATOM 2199 CE3 TRP A 158 -18.675 -5.080 2.488 1.00 4.00 C ATOM 2200 CZ2 TRP A 158 -18.464 -7.518 3.864 1.00 3.80 C ATOM 2201 CZ3 TRP A 158 -17.692 -5.258 3.475 1.00 5.39 C ATOM 2202 CH2 TRP A 158 -17.587 -6.473 4.162 1.00 5.12 C ATOM 0 H TRP A 158 -21.200 -5.459 -2.206 1.00 1.42 H new ATOM 0 HA TRP A 158 -20.040 -3.501 -0.327 1.00 1.39 H new ATOM 0 HB2 TRP A 158 -21.758 -4.461 0.803 1.00 1.68 H new ATOM 0 HB3 TRP A 158 -21.933 -5.721 -0.402 1.00 1.68 H new ATOM 0 HD1 TRP A 158 -21.987 -7.903 0.838 1.00 2.26 H new ATOM 0 HE1 TRP A 158 -20.611 -9.095 2.665 1.00 2.62 H new ATOM 0 HE3 TRP A 158 -18.745 -4.138 1.964 1.00 4.00 H new ATOM 0 HZ2 TRP A 158 -18.387 -8.460 4.388 1.00 3.80 H new ATOM 0 HZ3 TRP A 158 -17.012 -4.451 3.706 1.00 5.39 H new ATOM 0 HH2 TRP A 158 -16.829 -6.602 4.921 1.00 5.12 H new ATOM 2213 N LEU A 159 -18.585 -6.436 -0.684 1.00 0.91 N ATOM 2214 CA LEU A 159 -17.263 -7.105 -0.476 1.00 0.67 C ATOM 2215 C LEU A 159 -16.158 -6.404 -1.280 1.00 0.40 C ATOM 2216 O LEU A 159 -15.144 -5.997 -0.744 1.00 0.23 O ATOM 2217 CB LEU A 159 -17.365 -8.563 -0.933 1.00 0.98 C ATOM 2218 CG LEU A 159 -17.990 -9.407 0.179 1.00 1.20 C ATOM 2219 CD1 LEU A 159 -19.116 -10.267 -0.399 1.00 2.13 C ATOM 2220 CD2 LEU A 159 -16.920 -10.317 0.787 1.00 1.24 C ATOM 0 H LEU A 159 -19.324 -7.042 -1.039 1.00 0.91 H new ATOM 0 HA LEU A 159 -17.009 -7.052 0.583 1.00 0.67 H new ATOM 0 HB2 LEU A 159 -17.970 -8.630 -1.837 1.00 0.98 H new ATOM 0 HB3 LEU A 159 -16.376 -8.947 -1.182 1.00 0.98 H new ATOM 0 HG LEU A 159 -18.394 -8.749 0.948 1.00 1.20 H new ATOM 0 HD11 LEU A 159 -19.560 -10.867 0.395 1.00 2.13 H new ATOM 0 HD12 LEU A 159 -19.879 -9.622 -0.836 1.00 2.13 H new ATOM 0 HD13 LEU A 159 -18.713 -10.925 -1.169 1.00 2.13 H new ATOM 0 HD21 LEU A 159 -17.363 -10.920 1.580 1.00 1.24 H new ATOM 0 HD22 LEU A 159 -16.518 -10.972 0.014 1.00 1.24 H new ATOM 0 HD23 LEU A 159 -16.116 -9.708 1.200 1.00 1.24 H new ATOM 2232 N GLN A 160 -16.343 -6.281 -2.563 1.00 0.87 N ATOM 2233 CA GLN A 160 -15.311 -5.634 -3.422 1.00 1.14 C ATOM 2234 C GLN A 160 -15.047 -4.210 -2.938 1.00 1.21 C ATOM 2235 O GLN A 160 -13.991 -3.653 -3.166 1.00 1.30 O ATOM 2236 CB GLN A 160 -15.819 -5.606 -4.868 1.00 1.58 C ATOM 2237 CG GLN A 160 -17.063 -4.718 -4.966 1.00 0.49 C ATOM 2238 CD GLN A 160 -16.757 -3.513 -5.856 1.00 0.88 C ATOM 2239 OE1 GLN A 160 -16.406 -2.456 -5.369 1.00 2.11 O ATOM 2240 NE2 GLN A 160 -16.877 -3.627 -7.150 1.00 0.77 N ATOM 0 H GLN A 160 -17.173 -6.604 -3.060 1.00 0.87 H new ATOM 0 HA GLN A 160 -14.381 -6.199 -3.367 1.00 1.14 H new ATOM 0 HB2 GLN A 160 -15.039 -5.229 -5.529 1.00 1.58 H new ATOM 0 HB3 GLN A 160 -16.056 -6.617 -5.199 1.00 1.58 H new ATOM 0 HG2 GLN A 160 -17.897 -5.286 -5.378 1.00 0.49 H new ATOM 0 HG3 GLN A 160 -17.364 -4.384 -3.973 1.00 0.49 H new ATOM 0 HE21 GLN A 160 -17.172 -4.514 -7.559 1.00 0.77 H new ATOM 0 HE22 GLN A 160 -16.676 -2.829 -7.753 1.00 0.77 H new ATOM 2249 N ASP A 161 -15.994 -3.614 -2.277 1.00 1.21 N ATOM 2250 CA ASP A 161 -15.789 -2.227 -1.786 1.00 1.35 C ATOM 2251 C ASP A 161 -14.999 -2.261 -0.480 1.00 1.04 C ATOM 2252 O ASP A 161 -14.252 -1.353 -0.173 1.00 1.04 O ATOM 2253 CB ASP A 161 -17.144 -1.570 -1.554 1.00 1.61 C ATOM 2254 CG ASP A 161 -16.937 -0.120 -1.116 1.00 1.68 C ATOM 2255 OD1 ASP A 161 -16.411 0.080 -0.032 1.00 0.89 O ATOM 2256 OD2 ASP A 161 -17.303 0.765 -1.869 1.00 2.85 O ATOM 0 H ASP A 161 -16.900 -4.026 -2.055 1.00 1.21 H new ATOM 0 HA ASP A 161 -15.232 -1.653 -2.526 1.00 1.35 H new ATOM 0 HB2 ASP A 161 -17.738 -1.604 -2.467 1.00 1.61 H new ATOM 0 HB3 ASP A 161 -17.699 -2.116 -0.792 1.00 1.61 H new ATOM 2261 N MET A 162 -15.139 -3.309 0.285 1.00 0.79 N ATOM 2262 CA MET A 162 -14.374 -3.398 1.556 1.00 0.55 C ATOM 2263 C MET A 162 -12.891 -3.496 1.181 1.00 0.38 C ATOM 2264 O MET A 162 -12.023 -2.996 1.869 1.00 0.28 O ATOM 2265 CB MET A 162 -14.863 -4.628 2.370 1.00 0.45 C ATOM 2266 CG MET A 162 -13.778 -5.710 2.528 1.00 0.53 C ATOM 2267 SD MET A 162 -12.615 -5.205 3.820 1.00 0.73 S ATOM 2268 CE MET A 162 -11.093 -5.412 2.861 1.00 0.15 C ATOM 0 H MET A 162 -15.747 -4.103 0.084 1.00 0.79 H new ATOM 0 HA MET A 162 -14.526 -2.524 2.189 1.00 0.55 H new ATOM 0 HB2 MET A 162 -15.188 -4.299 3.357 1.00 0.45 H new ATOM 0 HB3 MET A 162 -15.733 -5.062 1.877 1.00 0.45 H new ATOM 0 HG2 MET A 162 -14.235 -6.665 2.787 1.00 0.53 H new ATOM 0 HG3 MET A 162 -13.251 -5.854 1.585 1.00 0.53 H new ATOM 0 HE1 MET A 162 -10.336 -5.895 3.479 1.00 0.15 H new ATOM 0 HE2 MET A 162 -11.295 -6.030 1.986 1.00 0.15 H new ATOM 0 HE3 MET A 162 -10.730 -4.436 2.540 1.00 0.15 H new ATOM 2278 N THR A 163 -12.609 -4.140 0.076 1.00 0.44 N ATOM 2279 CA THR A 163 -11.198 -4.281 -0.380 1.00 0.45 C ATOM 2280 C THR A 163 -10.541 -2.897 -0.406 1.00 0.42 C ATOM 2281 O THR A 163 -9.373 -2.749 -0.118 1.00 0.53 O ATOM 2282 CB THR A 163 -11.178 -4.893 -1.785 1.00 0.66 C ATOM 2283 OG1 THR A 163 -11.684 -6.219 -1.729 1.00 0.86 O ATOM 2284 CG2 THR A 163 -9.745 -4.916 -2.322 1.00 0.69 C ATOM 0 H THR A 163 -13.303 -4.576 -0.532 1.00 0.44 H new ATOM 0 HA THR A 163 -10.649 -4.931 0.301 1.00 0.45 H new ATOM 0 HB THR A 163 -11.799 -4.291 -2.448 1.00 0.66 H new ATOM 0 HG1 THR A 163 -12.252 -6.386 -2.510 1.00 0.86 H new ATOM 0 HG21 THR A 163 -9.738 -5.352 -3.321 1.00 0.69 H new ATOM 0 HG22 THR A 163 -9.357 -3.898 -2.368 1.00 0.69 H new ATOM 0 HG23 THR A 163 -9.118 -5.514 -1.660 1.00 0.69 H new ATOM 2292 N THR A 164 -11.292 -1.882 -0.737 1.00 0.30 N ATOM 2293 CA THR A 164 -10.713 -0.511 -0.761 1.00 0.25 C ATOM 2294 C THR A 164 -10.316 -0.140 0.666 1.00 0.29 C ATOM 2295 O THR A 164 -9.261 0.401 0.910 1.00 0.37 O ATOM 2296 CB THR A 164 -11.760 0.478 -1.285 1.00 0.19 C ATOM 2297 OG1 THR A 164 -12.066 0.164 -2.636 1.00 1.03 O ATOM 2298 CG2 THR A 164 -11.212 1.905 -1.202 1.00 1.08 C ATOM 0 H THR A 164 -12.278 -1.943 -0.991 1.00 0.30 H new ATOM 0 HA THR A 164 -9.841 -0.476 -1.414 1.00 0.25 H new ATOM 0 HB THR A 164 -12.663 0.406 -0.678 1.00 0.19 H new ATOM 0 HG1 THR A 164 -12.737 0.793 -2.974 1.00 1.03 H new ATOM 0 HG21 THR A 164 -11.960 2.604 -1.576 1.00 1.08 H new ATOM 0 HG22 THR A 164 -10.977 2.145 -0.165 1.00 1.08 H new ATOM 0 HG23 THR A 164 -10.308 1.983 -1.806 1.00 1.08 H new ATOM 2306 N HIS A 165 -11.165 -0.441 1.607 1.00 0.24 N ATOM 2307 CA HIS A 165 -10.869 -0.132 3.035 1.00 0.25 C ATOM 2308 C HIS A 165 -9.542 -0.784 3.453 1.00 0.27 C ATOM 2309 O HIS A 165 -8.557 -0.114 3.689 1.00 0.36 O ATOM 2310 CB HIS A 165 -12.008 -0.693 3.902 1.00 0.27 C ATOM 2311 CG HIS A 165 -11.655 -0.605 5.364 1.00 0.38 C ATOM 2312 ND1 HIS A 165 -11.378 -1.732 6.122 1.00 0.54 N ATOM 2313 CD2 HIS A 165 -11.530 0.461 6.217 1.00 0.39 C ATOM 2314 CE1 HIS A 165 -11.103 -1.321 7.373 1.00 0.64 C ATOM 2315 NE2 HIS A 165 -11.181 0.008 7.486 1.00 0.56 N ATOM 0 H HIS A 165 -12.064 -0.894 1.446 1.00 0.24 H new ATOM 0 HA HIS A 165 -10.787 0.947 3.167 1.00 0.25 H new ATOM 0 HB2 HIS A 165 -12.926 -0.137 3.710 1.00 0.27 H new ATOM 0 HB3 HIS A 165 -12.201 -1.731 3.631 1.00 0.27 H new ATOM 0 HD2 HIS A 165 -11.680 1.496 5.945 1.00 0.39 H new ATOM 0 HE1 HIS A 165 -10.850 -1.984 8.187 1.00 0.64 H new ATOM 0 HE2 HIS A 165 -11.020 0.570 8.322 1.00 0.56 H new ATOM 2323 N LEU A 166 -9.525 -2.084 3.581 1.00 0.20 N ATOM 2324 CA LEU A 166 -8.283 -2.785 4.027 1.00 0.22 C ATOM 2325 C LEU A 166 -7.058 -2.308 3.239 1.00 0.26 C ATOM 2326 O LEU A 166 -5.991 -2.150 3.793 1.00 0.25 O ATOM 2327 CB LEU A 166 -8.445 -4.293 3.841 1.00 0.19 C ATOM 2328 CG LEU A 166 -7.232 -5.006 4.440 1.00 0.77 C ATOM 2329 CD1 LEU A 166 -7.683 -6.287 5.142 1.00 1.51 C ATOM 2330 CD2 LEU A 166 -6.242 -5.353 3.325 1.00 2.69 C ATOM 0 H LEU A 166 -10.321 -2.694 3.395 1.00 0.20 H new ATOM 0 HA LEU A 166 -8.127 -2.552 5.080 1.00 0.22 H new ATOM 0 HB2 LEU A 166 -9.359 -4.635 4.326 1.00 0.19 H new ATOM 0 HB3 LEU A 166 -8.537 -4.533 2.782 1.00 0.19 H new ATOM 0 HG LEU A 166 -6.748 -4.350 5.164 1.00 0.77 H new ATOM 0 HD11 LEU A 166 -6.817 -6.793 5.568 1.00 1.51 H new ATOM 0 HD12 LEU A 166 -8.385 -6.038 5.938 1.00 1.51 H new ATOM 0 HD13 LEU A 166 -8.169 -6.945 4.422 1.00 1.51 H new ATOM 0 HD21 LEU A 166 -5.377 -5.861 3.751 1.00 2.69 H new ATOM 0 HD22 LEU A 166 -6.726 -6.007 2.599 1.00 2.69 H new ATOM 0 HD23 LEU A 166 -5.917 -4.438 2.829 1.00 2.69 H new ATOM 2342 N ILE A 167 -7.183 -2.087 1.957 1.00 0.30 N ATOM 2343 CA ILE A 167 -5.996 -1.630 1.174 1.00 0.34 C ATOM 2344 C ILE A 167 -5.499 -0.302 1.750 1.00 0.32 C ATOM 2345 O ILE A 167 -4.324 -0.119 1.993 1.00 0.32 O ATOM 2346 CB ILE A 167 -6.378 -1.454 -0.300 1.00 0.39 C ATOM 2347 CG1 ILE A 167 -6.685 -2.830 -0.902 1.00 0.50 C ATOM 2348 CG2 ILE A 167 -5.216 -0.807 -1.072 1.00 0.33 C ATOM 2349 CD1 ILE A 167 -7.445 -2.662 -2.217 1.00 0.50 C ATOM 0 H ILE A 167 -8.044 -2.201 1.423 1.00 0.30 H new ATOM 0 HA ILE A 167 -5.204 -2.375 1.241 1.00 0.34 H new ATOM 0 HB ILE A 167 -7.254 -0.810 -0.373 1.00 0.39 H new ATOM 0 HG12 ILE A 167 -5.758 -3.377 -1.075 1.00 0.50 H new ATOM 0 HG13 ILE A 167 -7.277 -3.419 -0.202 1.00 0.50 H new ATOM 0 HG21 ILE A 167 -5.497 -0.686 -2.118 1.00 0.33 H new ATOM 0 HG22 ILE A 167 -4.992 0.169 -0.641 1.00 0.33 H new ATOM 0 HG23 ILE A 167 -4.335 -1.445 -1.004 1.00 0.33 H new ATOM 0 HD11 ILE A 167 -7.661 -3.643 -2.641 1.00 0.50 H new ATOM 0 HD12 ILE A 167 -8.380 -2.133 -2.032 1.00 0.50 H new ATOM 0 HD13 ILE A 167 -6.837 -2.090 -2.918 1.00 0.50 H new ATOM 2361 N LEU A 168 -6.389 0.621 1.977 1.00 0.31 N ATOM 2362 CA LEU A 168 -5.978 1.933 2.548 1.00 0.30 C ATOM 2363 C LEU A 168 -5.529 1.730 3.999 1.00 0.26 C ATOM 2364 O LEU A 168 -4.860 2.567 4.573 1.00 0.22 O ATOM 2365 CB LEU A 168 -7.170 2.895 2.513 1.00 0.30 C ATOM 2366 CG LEU A 168 -7.190 3.650 1.180 1.00 0.77 C ATOM 2367 CD1 LEU A 168 -7.509 2.676 0.043 1.00 2.11 C ATOM 2368 CD2 LEU A 168 -8.269 4.736 1.228 1.00 1.08 C ATOM 0 H LEU A 168 -7.387 0.523 1.791 1.00 0.31 H new ATOM 0 HA LEU A 168 -5.157 2.349 1.965 1.00 0.30 H new ATOM 0 HB2 LEU A 168 -8.100 2.341 2.641 1.00 0.30 H new ATOM 0 HB3 LEU A 168 -7.103 3.601 3.340 1.00 0.30 H new ATOM 0 HG LEU A 168 -6.215 4.105 1.008 1.00 0.77 H new ATOM 0 HD11 LEU A 168 -7.523 3.215 -0.904 1.00 2.11 H new ATOM 0 HD12 LEU A 168 -6.747 1.897 0.007 1.00 2.11 H new ATOM 0 HD13 LEU A 168 -8.484 2.221 0.216 1.00 2.11 H new ATOM 0 HD21 LEU A 168 -8.285 5.275 0.281 1.00 1.08 H new ATOM 0 HD22 LEU A 168 -9.242 4.275 1.400 1.00 1.08 H new ATOM 0 HD23 LEU A 168 -8.049 5.432 2.037 1.00 1.08 H new ATOM 2380 N ARG A 169 -5.892 0.624 4.597 1.00 0.27 N ATOM 2381 CA ARG A 169 -5.489 0.367 6.007 1.00 0.24 C ATOM 2382 C ARG A 169 -4.036 -0.107 6.045 1.00 0.25 C ATOM 2383 O ARG A 169 -3.296 0.206 6.959 1.00 0.24 O ATOM 2384 CB ARG A 169 -6.389 -0.712 6.611 1.00 0.21 C ATOM 2385 CG ARG A 169 -6.290 -0.658 8.136 1.00 0.48 C ATOM 2386 CD ARG A 169 -7.397 0.241 8.688 1.00 1.44 C ATOM 2387 NE ARG A 169 -7.139 0.513 10.130 1.00 1.82 N ATOM 2388 CZ ARG A 169 -8.053 1.092 10.856 1.00 2.84 C ATOM 2389 NH1 ARG A 169 -9.217 0.522 11.016 1.00 3.18 N ATOM 2390 NH2 ARG A 169 -7.804 2.241 11.421 1.00 3.86 N ATOM 0 H ARG A 169 -6.451 -0.112 4.166 1.00 0.27 H new ATOM 0 HA ARG A 169 -5.589 1.287 6.583 1.00 0.24 H new ATOM 0 HB2 ARG A 169 -7.421 -0.558 6.297 1.00 0.21 H new ATOM 0 HB3 ARG A 169 -6.089 -1.696 6.250 1.00 0.21 H new ATOM 0 HG2 ARG A 169 -6.380 -1.661 8.553 1.00 0.48 H new ATOM 0 HG3 ARG A 169 -5.314 -0.276 8.434 1.00 0.48 H new ATOM 0 HD2 ARG A 169 -7.433 1.177 8.131 1.00 1.44 H new ATOM 0 HD3 ARG A 169 -8.367 -0.240 8.565 1.00 1.44 H new ATOM 0 HE ARG A 169 -6.248 0.246 10.548 1.00 1.82 H new ATOM 0 HH11 ARG A 169 -9.410 -0.376 10.573 1.00 3.18 H new ATOM 0 HH12 ARG A 169 -9.933 0.975 11.584 1.00 3.18 H new ATOM 0 HH21 ARG A 169 -6.895 2.685 11.294 1.00 3.86 H new ATOM 0 HH22 ARG A 169 -8.519 2.695 11.990 1.00 3.86 H new ATOM 2404 N SER A 170 -3.609 -0.842 5.053 1.00 0.28 N ATOM 2405 CA SER A 170 -2.205 -1.306 5.038 1.00 0.29 C ATOM 2406 C SER A 170 -1.346 -0.117 4.654 1.00 0.29 C ATOM 2407 O SER A 170 -0.345 0.166 5.264 1.00 0.31 O ATOM 2408 CB SER A 170 -2.033 -2.427 4.014 1.00 0.30 C ATOM 2409 OG SER A 170 -1.285 -3.485 4.598 1.00 0.66 O ATOM 0 H SER A 170 -4.175 -1.137 4.258 1.00 0.28 H new ATOM 0 HA SER A 170 -1.916 -1.695 6.014 1.00 0.29 H new ATOM 0 HB2 SER A 170 -3.008 -2.791 3.689 1.00 0.30 H new ATOM 0 HB3 SER A 170 -1.522 -2.051 3.128 1.00 0.30 H new ATOM 0 HG SER A 170 -1.761 -3.827 5.384 1.00 0.66 H new ATOM 2415 N PHE A 171 -1.752 0.616 3.660 1.00 0.27 N ATOM 2416 CA PHE A 171 -0.969 1.810 3.260 1.00 0.26 C ATOM 2417 C PHE A 171 -0.752 2.686 4.493 1.00 0.29 C ATOM 2418 O PHE A 171 0.327 3.168 4.739 1.00 0.27 O ATOM 2419 CB PHE A 171 -1.736 2.584 2.192 1.00 0.25 C ATOM 2420 CG PHE A 171 -1.376 2.018 0.845 1.00 0.23 C ATOM 2421 CD1 PHE A 171 -1.639 0.674 0.561 1.00 0.37 C ATOM 2422 CD2 PHE A 171 -0.765 2.832 -0.112 1.00 0.49 C ATOM 2423 CE1 PHE A 171 -1.293 0.142 -0.685 1.00 0.32 C ATOM 2424 CE2 PHE A 171 -0.415 2.301 -1.358 1.00 0.53 C ATOM 2425 CZ PHE A 171 -0.678 0.957 -1.646 1.00 0.23 C ATOM 0 H PHE A 171 -2.592 0.439 3.108 1.00 0.27 H new ATOM 0 HA PHE A 171 -0.004 1.511 2.851 1.00 0.26 H new ATOM 0 HB2 PHE A 171 -2.810 2.503 2.363 1.00 0.25 H new ATOM 0 HB3 PHE A 171 -1.485 3.644 2.238 1.00 0.25 H new ATOM 0 HD1 PHE A 171 -2.109 0.047 1.304 1.00 0.37 H new ATOM 0 HD2 PHE A 171 -0.563 3.870 0.110 1.00 0.49 H new ATOM 0 HE1 PHE A 171 -1.499 -0.895 -0.907 1.00 0.32 H new ATOM 0 HE2 PHE A 171 0.059 2.929 -2.098 1.00 0.53 H new ATOM 0 HZ PHE A 171 -0.407 0.548 -2.608 1.00 0.23 H new ATOM 2435 N LYS A 172 -1.765 2.869 5.288 1.00 0.35 N ATOM 2436 CA LYS A 172 -1.598 3.692 6.513 1.00 0.39 C ATOM 2437 C LYS A 172 -0.458 3.113 7.363 1.00 0.36 C ATOM 2438 O LYS A 172 0.579 3.729 7.535 1.00 0.30 O ATOM 2439 CB LYS A 172 -2.898 3.668 7.320 1.00 0.53 C ATOM 2440 CG LYS A 172 -2.967 4.901 8.223 1.00 1.22 C ATOM 2441 CD LYS A 172 -3.779 5.997 7.529 1.00 0.93 C ATOM 2442 CE LYS A 172 -4.878 6.493 8.471 1.00 1.48 C ATOM 2443 NZ LYS A 172 -5.922 5.437 8.616 1.00 3.28 N ATOM 0 H LYS A 172 -2.699 2.485 5.143 1.00 0.35 H new ATOM 0 HA LYS A 172 -1.360 4.719 6.235 1.00 0.39 H new ATOM 0 HB2 LYS A 172 -3.755 3.650 6.647 1.00 0.53 H new ATOM 0 HB3 LYS A 172 -2.947 2.761 7.922 1.00 0.53 H new ATOM 0 HG2 LYS A 172 -3.427 4.641 9.176 1.00 1.22 H new ATOM 0 HG3 LYS A 172 -1.962 5.262 8.442 1.00 1.22 H new ATOM 0 HD2 LYS A 172 -3.127 6.824 7.247 1.00 0.93 H new ATOM 0 HD3 LYS A 172 -4.220 5.611 6.610 1.00 0.93 H new ATOM 0 HE2 LYS A 172 -4.454 6.737 9.445 1.00 1.48 H new ATOM 0 HE3 LYS A 172 -5.323 7.408 8.079 1.00 1.48 H new ATOM 0 HZ1 LYS A 172 -6.800 5.864 8.974 1.00 3.28 H new ATOM 0 HZ2 LYS A 172 -6.103 4.998 7.691 1.00 3.28 H new ATOM 0 HZ3 LYS A 172 -5.592 4.712 9.284 1.00 3.28 H new ATOM 2457 N GLU A 173 -0.639 1.930 7.890 1.00 0.44 N ATOM 2458 CA GLU A 173 0.431 1.310 8.729 1.00 0.47 C ATOM 2459 C GLU A 173 1.605 0.874 7.845 1.00 0.41 C ATOM 2460 O GLU A 173 2.677 1.436 7.914 1.00 0.38 O ATOM 2461 CB GLU A 173 -0.134 0.085 9.452 1.00 0.56 C ATOM 2462 CG GLU A 173 -0.896 0.532 10.702 1.00 0.27 C ATOM 2463 CD GLU A 173 0.096 0.840 11.824 1.00 1.22 C ATOM 2464 OE1 GLU A 173 1.169 0.260 11.817 1.00 2.12 O ATOM 2465 OE2 GLU A 173 -0.235 1.650 12.674 1.00 1.71 O ATOM 0 H GLU A 173 -1.481 1.366 7.776 1.00 0.44 H new ATOM 0 HA GLU A 173 0.780 2.042 9.457 1.00 0.47 H new ATOM 0 HB2 GLU A 173 -0.798 -0.468 8.787 1.00 0.56 H new ATOM 0 HB3 GLU A 173 0.675 -0.591 9.729 1.00 0.56 H new ATOM 0 HG2 GLU A 173 -1.494 1.415 10.479 1.00 0.27 H new ATOM 0 HG3 GLU A 173 -1.587 -0.250 11.018 1.00 0.27 H new ATOM 2472 N PHE A 174 1.396 -0.135 7.033 1.00 0.40 N ATOM 2473 CA PHE A 174 2.467 -0.671 6.120 1.00 0.37 C ATOM 2474 C PHE A 174 3.435 0.429 5.653 1.00 0.33 C ATOM 2475 O PHE A 174 4.624 0.362 5.900 1.00 0.39 O ATOM 2476 CB PHE A 174 1.800 -1.295 4.892 1.00 0.30 C ATOM 2477 CG PHE A 174 2.657 -2.413 4.358 1.00 0.31 C ATOM 2478 CD1 PHE A 174 3.712 -2.127 3.485 1.00 0.92 C ATOM 2479 CD2 PHE A 174 2.396 -3.734 4.736 1.00 0.81 C ATOM 2480 CE1 PHE A 174 4.509 -3.164 2.988 1.00 0.91 C ATOM 2481 CE2 PHE A 174 3.194 -4.771 4.241 1.00 0.84 C ATOM 2482 CZ PHE A 174 4.251 -4.487 3.368 1.00 0.36 C ATOM 0 H PHE A 174 0.504 -0.625 6.961 1.00 0.40 H new ATOM 0 HA PHE A 174 3.043 -1.410 6.677 1.00 0.37 H new ATOM 0 HB2 PHE A 174 0.813 -1.675 5.157 1.00 0.30 H new ATOM 0 HB3 PHE A 174 1.653 -0.537 4.122 1.00 0.30 H new ATOM 0 HD1 PHE A 174 3.911 -1.106 3.195 1.00 0.92 H new ATOM 0 HD2 PHE A 174 1.580 -3.953 5.409 1.00 0.81 H new ATOM 0 HE1 PHE A 174 5.322 -2.944 2.312 1.00 0.91 H new ATOM 0 HE2 PHE A 174 2.994 -5.792 4.533 1.00 0.84 H new ATOM 0 HZ PHE A 174 4.867 -5.288 2.988 1.00 0.36 H new ATOM 2492 N LEU A 175 2.948 1.437 4.977 1.00 0.25 N ATOM 2493 CA LEU A 175 3.867 2.513 4.504 1.00 0.21 C ATOM 2494 C LEU A 175 4.485 3.231 5.709 1.00 0.20 C ATOM 2495 O LEU A 175 5.662 3.536 5.719 1.00 0.21 O ATOM 2496 CB LEU A 175 3.094 3.526 3.654 1.00 0.18 C ATOM 2497 CG LEU A 175 2.774 2.929 2.279 1.00 0.26 C ATOM 2498 CD1 LEU A 175 1.579 3.660 1.666 1.00 0.28 C ATOM 2499 CD2 LEU A 175 3.977 3.100 1.355 1.00 0.27 C ATOM 0 H LEU A 175 1.965 1.561 4.734 1.00 0.25 H new ATOM 0 HA LEU A 175 4.656 2.064 3.901 1.00 0.21 H new ATOM 0 HB2 LEU A 175 2.171 3.807 4.160 1.00 0.18 H new ATOM 0 HB3 LEU A 175 3.682 4.436 3.535 1.00 0.18 H new ATOM 0 HG LEU A 175 2.541 1.871 2.397 1.00 0.26 H new ATOM 0 HD11 LEU A 175 1.354 3.233 0.689 1.00 0.28 H new ATOM 0 HD12 LEU A 175 0.712 3.551 2.318 1.00 0.28 H new ATOM 0 HD13 LEU A 175 1.818 4.718 1.554 1.00 0.28 H new ATOM 0 HD21 LEU A 175 3.748 2.675 0.378 1.00 0.27 H new ATOM 0 HD22 LEU A 175 4.204 4.160 1.246 1.00 0.27 H new ATOM 0 HD23 LEU A 175 4.839 2.587 1.781 1.00 0.27 H new ATOM 2511 N GLN A 176 3.706 3.512 6.725 1.00 0.20 N ATOM 2512 CA GLN A 176 4.259 4.217 7.923 1.00 0.20 C ATOM 2513 C GLN A 176 5.555 3.539 8.386 1.00 0.28 C ATOM 2514 O GLN A 176 6.612 4.144 8.411 1.00 0.52 O ATOM 2515 CB GLN A 176 3.233 4.176 9.056 1.00 0.26 C ATOM 2516 CG GLN A 176 2.519 5.526 9.145 1.00 0.22 C ATOM 2517 CD GLN A 176 1.892 5.677 10.532 1.00 0.36 C ATOM 2518 OE1 GLN A 176 0.719 5.968 10.652 1.00 1.22 O ATOM 2519 NE2 GLN A 176 2.630 5.490 11.592 1.00 1.01 N ATOM 0 H GLN A 176 2.713 3.284 6.776 1.00 0.20 H new ATOM 0 HA GLN A 176 4.475 5.252 7.657 1.00 0.20 H new ATOM 0 HB2 GLN A 176 2.509 3.381 8.877 1.00 0.26 H new ATOM 0 HB3 GLN A 176 3.727 3.951 10.001 1.00 0.26 H new ATOM 0 HG2 GLN A 176 3.225 6.336 8.962 1.00 0.22 H new ATOM 0 HG3 GLN A 176 1.749 5.595 8.376 1.00 0.22 H new ATOM 0 HE21 GLN A 176 3.615 5.246 11.491 1.00 1.01 H new ATOM 0 HE22 GLN A 176 2.222 5.588 12.522 1.00 1.01 H new ATOM 2528 N SER A 177 5.484 2.289 8.753 1.00 0.29 N ATOM 2529 CA SER A 177 6.706 1.574 9.212 1.00 0.34 C ATOM 2530 C SER A 177 7.776 1.653 8.125 1.00 0.23 C ATOM 2531 O SER A 177 8.956 1.696 8.406 1.00 0.27 O ATOM 2532 CB SER A 177 6.367 0.109 9.485 1.00 0.46 C ATOM 2533 OG SER A 177 5.795 -0.006 10.781 1.00 0.99 O ATOM 0 H SER A 177 4.630 1.732 8.754 1.00 0.29 H new ATOM 0 HA SER A 177 7.078 2.037 10.126 1.00 0.34 H new ATOM 0 HB2 SER A 177 5.670 -0.261 8.733 1.00 0.46 H new ATOM 0 HB3 SER A 177 7.266 -0.503 9.416 1.00 0.46 H new ATOM 0 HG SER A 177 6.031 -0.876 11.167 1.00 0.99 H new ATOM 2539 N SER A 178 7.373 1.672 6.884 1.00 0.14 N ATOM 2540 CA SER A 178 8.371 1.750 5.780 1.00 0.13 C ATOM 2541 C SER A 178 9.216 3.016 5.944 1.00 0.23 C ATOM 2542 O SER A 178 10.414 3.006 5.737 1.00 0.30 O ATOM 2543 CB SER A 178 7.644 1.794 4.433 1.00 0.14 C ATOM 2544 OG SER A 178 8.589 1.626 3.384 1.00 0.90 O ATOM 0 H SER A 178 6.398 1.637 6.587 1.00 0.14 H new ATOM 0 HA SER A 178 9.018 0.873 5.815 1.00 0.13 H new ATOM 0 HB2 SER A 178 6.890 1.008 4.388 1.00 0.14 H new ATOM 0 HB3 SER A 178 7.122 2.744 4.319 1.00 0.14 H new ATOM 0 HG SER A 178 8.116 1.508 2.534 1.00 0.90 H new ATOM 2550 N LEU A 179 8.605 4.109 6.317 1.00 0.26 N ATOM 2551 CA LEU A 179 9.375 5.372 6.495 1.00 0.39 C ATOM 2552 C LEU A 179 10.329 5.227 7.679 1.00 0.49 C ATOM 2553 O LEU A 179 11.510 5.497 7.576 1.00 0.65 O ATOM 2554 CB LEU A 179 8.412 6.528 6.769 1.00 0.40 C ATOM 2555 CG LEU A 179 7.523 6.759 5.547 1.00 0.50 C ATOM 2556 CD1 LEU A 179 6.077 6.418 5.903 1.00 0.43 C ATOM 2557 CD2 LEU A 179 7.612 8.228 5.125 1.00 0.86 C ATOM 0 H LEU A 179 7.605 4.181 6.506 1.00 0.26 H new ATOM 0 HA LEU A 179 9.943 5.575 5.587 1.00 0.39 H new ATOM 0 HB2 LEU A 179 7.797 6.303 7.641 1.00 0.40 H new ATOM 0 HB3 LEU A 179 8.972 7.434 6.999 1.00 0.40 H new ATOM 0 HG LEU A 179 7.856 6.124 4.726 1.00 0.50 H new ATOM 0 HD11 LEU A 179 5.440 6.582 5.034 1.00 0.43 H new ATOM 0 HD12 LEU A 179 6.014 5.373 6.208 1.00 0.43 H new ATOM 0 HD13 LEU A 179 5.744 7.055 6.722 1.00 0.43 H new ATOM 0 HD21 LEU A 179 6.979 8.395 4.254 1.00 0.86 H new ATOM 0 HD22 LEU A 179 7.276 8.863 5.945 1.00 0.86 H new ATOM 0 HD23 LEU A 179 8.644 8.473 4.876 1.00 0.86 H new ATOM 2569 N ARG A 180 9.826 4.811 8.808 1.00 0.44 N ATOM 2570 CA ARG A 180 10.707 4.657 10.002 1.00 0.55 C ATOM 2571 C ARG A 180 11.728 3.538 9.767 1.00 0.48 C ATOM 2572 O ARG A 180 12.689 3.400 10.500 1.00 0.51 O ATOM 2573 CB ARG A 180 9.855 4.316 11.224 1.00 0.58 C ATOM 2574 CG ARG A 180 10.592 4.752 12.492 1.00 1.51 C ATOM 2575 CD ARG A 180 9.612 4.787 13.664 1.00 1.24 C ATOM 2576 NE ARG A 180 8.445 5.640 13.305 1.00 0.87 N ATOM 2577 CZ ARG A 180 8.526 6.936 13.427 1.00 2.31 C ATOM 2578 NH1 ARG A 180 8.797 7.464 14.591 1.00 2.70 N ATOM 2579 NH2 ARG A 180 8.338 7.702 12.387 1.00 3.72 N ATOM 0 H ARG A 180 8.846 4.571 8.957 1.00 0.44 H new ATOM 0 HA ARG A 180 11.238 5.594 10.172 1.00 0.55 H new ATOM 0 HB2 ARG A 180 8.890 4.818 11.160 1.00 0.58 H new ATOM 0 HB3 ARG A 180 9.656 3.245 11.255 1.00 0.58 H new ATOM 0 HG2 ARG A 180 11.408 4.062 12.707 1.00 1.51 H new ATOM 0 HG3 ARG A 180 11.037 5.736 12.347 1.00 1.51 H new ATOM 0 HD2 ARG A 180 9.279 3.777 13.904 1.00 1.24 H new ATOM 0 HD3 ARG A 180 10.105 5.180 14.553 1.00 1.24 H new ATOM 0 HE ARG A 180 7.584 5.212 12.964 1.00 0.87 H new ATOM 0 HH11 ARG A 180 8.945 6.863 15.402 1.00 2.70 H new ATOM 0 HH12 ARG A 180 8.861 8.477 14.689 1.00 2.70 H new ATOM 0 HH21 ARG A 180 8.128 7.287 11.479 1.00 3.72 H new ATOM 0 HH22 ARG A 180 8.401 8.716 12.482 1.00 3.72 H new ATOM 2593 N ALA A 181 11.538 2.739 8.752 1.00 0.47 N ATOM 2594 CA ALA A 181 12.504 1.641 8.485 1.00 0.46 C ATOM 2595 C ALA A 181 13.676 2.202 7.683 1.00 0.52 C ATOM 2596 O ALA A 181 14.820 1.852 7.902 1.00 0.54 O ATOM 2597 CB ALA A 181 11.810 0.537 7.682 1.00 0.45 C ATOM 0 H ALA A 181 10.757 2.801 8.099 1.00 0.47 H new ATOM 0 HA ALA A 181 12.866 1.225 9.425 1.00 0.46 H new ATOM 0 HB1 ALA A 181 12.517 -0.269 7.485 1.00 0.45 H new ATOM 0 HB2 ALA A 181 10.966 0.148 8.252 1.00 0.45 H new ATOM 0 HB3 ALA A 181 11.452 0.945 6.737 1.00 0.45 H new ATOM 2603 N LEU A 182 13.398 3.080 6.761 1.00 0.58 N ATOM 2604 CA LEU A 182 14.492 3.673 5.949 1.00 0.67 C ATOM 2605 C LEU A 182 15.247 4.698 6.799 1.00 0.66 C ATOM 2606 O LEU A 182 16.419 4.946 6.597 1.00 0.67 O ATOM 2607 CB LEU A 182 13.902 4.358 4.715 1.00 0.81 C ATOM 2608 CG LEU A 182 14.155 3.491 3.478 1.00 1.01 C ATOM 2609 CD1 LEU A 182 12.832 2.911 2.977 1.00 0.96 C ATOM 2610 CD2 LEU A 182 14.783 4.347 2.377 1.00 1.31 C ATOM 0 H LEU A 182 12.460 3.412 6.536 1.00 0.58 H new ATOM 0 HA LEU A 182 15.178 2.889 5.627 1.00 0.67 H new ATOM 0 HB2 LEU A 182 12.832 4.514 4.850 1.00 0.81 H new ATOM 0 HB3 LEU A 182 14.353 5.341 4.581 1.00 0.81 H new ATOM 0 HG LEU A 182 14.831 2.677 3.740 1.00 1.01 H new ATOM 0 HD11 LEU A 182 13.015 2.295 2.097 1.00 0.96 H new ATOM 0 HD12 LEU A 182 12.382 2.301 3.760 1.00 0.96 H new ATOM 0 HD13 LEU A 182 12.154 3.724 2.716 1.00 0.96 H new ATOM 0 HD21 LEU A 182 14.964 3.731 1.496 1.00 1.31 H new ATOM 0 HD22 LEU A 182 14.106 5.161 2.118 1.00 1.31 H new ATOM 0 HD23 LEU A 182 15.728 4.760 2.731 1.00 1.31 H new ATOM 2622 N ARG A 183 14.584 5.290 7.756 1.00 0.64 N ATOM 2623 CA ARG A 183 15.261 6.293 8.625 1.00 0.64 C ATOM 2624 C ARG A 183 16.004 5.567 9.745 1.00 0.53 C ATOM 2625 O ARG A 183 16.973 6.063 10.285 1.00 0.47 O ATOM 2626 CB ARG A 183 14.217 7.233 9.232 1.00 0.67 C ATOM 2627 CG ARG A 183 14.893 8.538 9.657 1.00 0.75 C ATOM 2628 CD ARG A 183 13.873 9.677 9.607 1.00 0.67 C ATOM 2629 NE ARG A 183 13.636 10.195 10.983 1.00 0.57 N ATOM 2630 CZ ARG A 183 14.110 11.361 11.331 1.00 0.74 C ATOM 2631 NH1 ARG A 183 15.321 11.458 11.808 1.00 1.85 N ATOM 2632 NH2 ARG A 183 13.372 12.430 11.201 1.00 1.09 N ATOM 0 H ARG A 183 13.602 5.121 7.973 1.00 0.64 H new ATOM 0 HA ARG A 183 15.967 6.873 8.031 1.00 0.64 H new ATOM 0 HB2 ARG A 183 13.430 7.438 8.506 1.00 0.67 H new ATOM 0 HB3 ARG A 183 13.742 6.760 10.092 1.00 0.67 H new ATOM 0 HG2 ARG A 183 15.297 8.440 10.665 1.00 0.75 H new ATOM 0 HG3 ARG A 183 15.733 8.757 8.997 1.00 0.75 H new ATOM 0 HD2 ARG A 183 14.238 10.478 8.964 1.00 0.67 H new ATOM 0 HD3 ARG A 183 12.937 9.322 9.175 1.00 0.67 H new ATOM 0 HE ARG A 183 13.104 9.640 11.653 1.00 0.57 H new ATOM 0 HH11 ARG A 183 15.898 10.623 11.909 1.00 1.85 H new ATOM 0 HH12 ARG A 183 15.691 12.369 12.080 1.00 1.85 H new ATOM 0 HH21 ARG A 183 12.426 12.354 10.828 1.00 1.09 H new ATOM 0 HH22 ARG A 183 13.742 13.341 11.473 1.00 1.09 H new ATOM 2646 N GLN A 184 15.562 4.391 10.095 1.00 0.52 N ATOM 2647 CA GLN A 184 16.249 3.631 11.171 1.00 0.42 C ATOM 2648 C GLN A 184 17.532 3.033 10.604 1.00 0.38 C ATOM 2649 O GLN A 184 18.515 2.873 11.298 1.00 0.33 O ATOM 2650 CB GLN A 184 15.332 2.511 11.671 1.00 0.51 C ATOM 2651 CG GLN A 184 14.593 2.983 12.924 1.00 0.11 C ATOM 2652 CD GLN A 184 15.155 2.261 14.150 1.00 0.95 C ATOM 2653 OE1 GLN A 184 15.380 1.068 14.116 1.00 2.28 O ATOM 2654 NE2 GLN A 184 15.395 2.940 15.239 1.00 0.53 N ATOM 0 H GLN A 184 14.754 3.925 9.681 1.00 0.52 H new ATOM 0 HA GLN A 184 16.487 4.293 12.004 1.00 0.42 H new ATOM 0 HB2 GLN A 184 14.617 2.237 10.895 1.00 0.51 H new ATOM 0 HB3 GLN A 184 15.917 1.619 11.895 1.00 0.51 H new ATOM 0 HG2 GLN A 184 14.705 4.061 13.041 1.00 0.11 H new ATOM 0 HG3 GLN A 184 13.526 2.782 12.827 1.00 0.11 H new ATOM 0 HE21 GLN A 184 15.206 3.942 15.267 1.00 0.53 H new ATOM 0 HE22 GLN A 184 15.772 2.469 16.061 1.00 0.53 H new ATOM 2663 N MET A 185 17.531 2.708 9.340 1.00 0.48 N ATOM 2664 CA MET A 185 18.754 2.130 8.727 1.00 0.49 C ATOM 2665 C MET A 185 19.144 2.948 7.494 1.00 1.20 C ATOM 2666 O MET A 185 19.669 2.364 6.560 1.00 2.43 O ATOM 2667 CB MET A 185 18.493 0.677 8.319 1.00 1.51 C ATOM 2668 CG MET A 185 17.159 0.583 7.578 1.00 0.45 C ATOM 2669 SD MET A 185 17.278 -0.674 6.281 1.00 1.51 S ATOM 2670 CE MET A 185 15.505 -0.853 5.975 1.00 0.87 C ATOM 2671 OXT MET A 185 18.912 4.145 7.506 1.00 1.59 O ATOM 0 H MET A 185 16.737 2.818 8.709 1.00 0.48 H new ATOM 0 HA MET A 185 19.567 2.157 9.452 1.00 0.49 H new ATOM 0 HB2 MET A 185 19.301 0.317 7.681 1.00 1.51 H new ATOM 0 HB3 MET A 185 18.476 0.038 9.202 1.00 1.51 H new ATOM 0 HG2 MET A 185 16.361 0.328 8.275 1.00 0.45 H new ATOM 0 HG3 MET A 185 16.904 1.549 7.141 1.00 0.45 H new ATOM 0 HE1 MET A 185 15.309 -1.828 5.529 1.00 0.87 H new ATOM 0 HE2 MET A 185 14.963 -0.770 6.917 1.00 0.87 H new ATOM 0 HE3 MET A 185 15.172 -0.069 5.294 1.00 0.87 H new TER 2681 MET A 185