USER MOD reduce.3.24.130724 H: found=0, std=0, add=1398, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1392 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 67 THR OG1 : rot 158:sc= -0.113 USER MOD Set 1.2: A 94 LYS NZ :NH3+ 172:sc= -0.927 (180deg=-0.963) USER MOD Set 2.1: A 46 THR OG1 : rot 66:sc= -4.17! USER MOD Set 2.2: A 101 SER OG : rot -111:sc= 1.14 USER MOD Set 3.1: A 34 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 63 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.00763) USER MOD Set 4.1: A 29 THR OG1 : rot 171:sc= 0.0413 USER MOD Set 4.2: A 32 THR OG1 : rot 48:sc= 0.044 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= 0 K(o=0,f=-1.8!) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot 175:sc= 0.00399 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 HIS : no HD1:sc= -0.346 X(o=-0.35,f=-0.84) USER MOD Single : A 20 MET CE :methyl 169:sc= -5.56! (180deg=-6.07!) USER MOD Single : A 25 THR OG1 : rot -130:sc= -0.0536 USER MOD Single : A 26 HIS :FLIP no HD1:sc= -4.53! C(o=-5.7!,f=-4.5!) USER MOD Single : A 27 ASN : amide:sc= 0.0223 K(o=0.022,f=-4.3!) USER MOD Single : A 30 ASN : amide:sc= -0.531 K(o=-0.53,f=-5.1!) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.0101 USER MOD Single : A 41 LYS NZ :NH3+ 170:sc= 0.0855 (180deg=0.0636) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot -132:sc= -0.851 USER MOD Single : A 52 CYS SG : rot 180:sc= 0.003 USER MOD Single : A 55 THR OG1 : rot 108:sc= 1.86 USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 156:sc= 0 (180deg=-0.0801) USER MOD Single : A 59 THR OG1 : rot -155:sc= -0.689 USER MOD Single : A 82 LYS NZ :NH3+ 152:sc= -0.0487 (180deg=-0.378) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 CYS SG : rot 180:sc= 0 USER MOD Single : A 102 CYS SG : rot -142:sc= -2.57! USER MOD Single : A 106 HIS :FLIP no HD1:sc= -2.84 F(o=-4.2!,f=-2.8) USER MOD Single : A 107 CYS SG : rot -80:sc= -3.05 USER MOD Single : A 125 SER OG : rot -150:sc= -0.989 USER MOD Single : A 127 MET CE :methyl -126:sc= -7.83! (180deg=-18.5!) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 GLN : amide:sc=-0.00743 K(o=-0.0074,f=-1.3) USER MOD Single : A 138 GLN : amide:sc= -0.0441 X(o=-0.044,f=-0.044) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 ASN : amide:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD Single : A 147 LYS NZ :NH3+ -157:sc= -4.94 (180deg=-6.01!) USER MOD Single : A 148 GLN :FLIP amide:sc= -0.249 F(o=-1.4,f=-0.25) USER MOD Single : A 150 THR OG1 : rot 90:sc= 1.06 USER MOD Single : A 151 TYR OH : rot 80:sc= -0.756 USER MOD Single : A 154 LYS NZ :NH3+ -128:sc= 0.864 (180deg=-0.409) USER MOD Single : A 155 TYR OH : rot 63:sc= -4.18! USER MOD Single : A 158 LYS NZ :NH3+ 164:sc= -0.16 (180deg=-0.58) USER MOD Single : A 159 GLN : amide:sc= 0 X(o=0,f=-0.0049) USER MOD Single : A 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 HIS : no HD1:sc= 0.00595 K(o=0.0059,f=-1.2) USER MOD Single : A 168 THR OG1 : rot 180:sc= 0 USER MOD Single : A 169 HIS : no HD1:sc= -0.0831 X(o=-0.083,f=-0.28) USER MOD Single : A 170 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 171 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 0.895 19.393 -18.680 1.00 0.00 N ATOM 2 CA GLY A 1 0.313 20.587 -19.354 1.00 0.00 C ATOM 3 C GLY A 1 -1.098 20.343 -19.849 1.00 0.00 C ATOM 4 O GLY A 1 -2.059 20.882 -19.299 1.00 0.00 O ATOM 0 H1 GLY A 1 1.860 19.611 -18.360 1.00 0.00 H new ATOM 0 H2 GLY A 1 0.308 19.136 -17.861 1.00 0.00 H new ATOM 0 H3 GLY A 1 0.924 18.597 -19.348 1.00 0.00 H new ATOM 0 HA2 GLY A 1 0.311 21.427 -18.660 1.00 0.00 H new ATOM 0 HA3 GLY A 1 0.946 20.870 -20.195 1.00 0.00 H new ATOM 10 N SER A 2 -1.225 19.530 -20.893 1.00 0.00 N ATOM 11 CA SER A 2 -2.529 19.214 -21.463 1.00 0.00 C ATOM 12 C SER A 2 -2.447 17.988 -22.364 1.00 0.00 C ATOM 13 O SER A 2 -1.634 17.936 -23.287 1.00 0.00 O ATOM 14 CB SER A 2 -3.065 20.409 -22.254 1.00 0.00 C ATOM 15 OG SER A 2 -4.372 20.155 -22.741 1.00 0.00 O ATOM 0 H SER A 2 -0.440 19.078 -21.361 1.00 0.00 H new ATOM 0 HA SER A 2 -3.212 18.993 -20.643 1.00 0.00 H new ATOM 0 HB2 SER A 2 -3.076 21.294 -21.618 1.00 0.00 H new ATOM 0 HB3 SER A 2 -2.398 20.625 -23.089 1.00 0.00 H new ATOM 0 HG SER A 2 -4.692 20.935 -23.241 1.00 0.00 H new ATOM 21 N HIS A 3 -3.296 17.001 -22.092 1.00 0.00 N ATOM 22 CA HIS A 3 -3.319 15.774 -22.880 1.00 0.00 C ATOM 23 C HIS A 3 -4.722 15.175 -22.911 1.00 0.00 C ATOM 24 O HIS A 3 -5.497 15.335 -21.969 1.00 0.00 O ATOM 25 CB HIS A 3 -2.329 14.758 -22.308 1.00 0.00 C ATOM 26 CG HIS A 3 -1.610 13.968 -23.356 1.00 0.00 C ATOM 27 ND1 HIS A 3 -2.172 12.887 -24.002 1.00 0.00 N ATOM 28 CD2 HIS A 3 -0.366 14.105 -23.873 1.00 0.00 C ATOM 29 CE1 HIS A 3 -1.308 12.393 -24.870 1.00 0.00 C ATOM 30 NE2 HIS A 3 -0.204 13.115 -24.812 1.00 0.00 N ATOM 0 H HIS A 3 -3.976 17.027 -21.332 1.00 0.00 H new ATOM 0 HA HIS A 3 -3.026 16.020 -23.901 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -1.597 15.282 -21.694 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -2.864 14.072 -21.651 1.00 0.00 H new ATOM 0 HD2 HIS A 3 0.363 14.853 -23.598 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -1.476 11.544 -25.516 1.00 0.00 H new ATOM 0 HE2 HIS A 3 0.634 12.962 -25.374 1.00 0.00 H new ATOM 38 N MET A 4 -5.039 14.483 -24.001 1.00 0.00 N ATOM 39 CA MET A 4 -6.349 13.859 -24.155 1.00 0.00 C ATOM 40 C MET A 4 -7.458 14.905 -24.118 1.00 0.00 C ATOM 41 O MET A 4 -7.222 16.062 -23.771 1.00 0.00 O ATOM 42 CB MET A 4 -6.574 12.820 -23.055 1.00 0.00 C ATOM 43 CG MET A 4 -5.617 11.641 -23.126 1.00 0.00 C ATOM 44 SD MET A 4 -5.111 11.057 -21.497 1.00 0.00 S ATOM 45 CE MET A 4 -5.524 9.319 -21.616 1.00 0.00 C ATOM 0 H MET A 4 -4.408 14.340 -24.790 1.00 0.00 H new ATOM 0 HA MET A 4 -6.376 13.363 -25.125 1.00 0.00 H new ATOM 0 HB2 MET A 4 -6.470 13.303 -22.084 1.00 0.00 H new ATOM 0 HB3 MET A 4 -7.598 12.451 -23.120 1.00 0.00 H new ATOM 0 HG2 MET A 4 -6.093 10.824 -23.669 1.00 0.00 H new ATOM 0 HG3 MET A 4 -4.733 11.929 -23.695 1.00 0.00 H new ATOM 0 HE1 MET A 4 -5.268 8.819 -20.682 1.00 0.00 H new ATOM 0 HE2 MET A 4 -6.592 9.211 -21.805 1.00 0.00 H new ATOM 0 HE3 MET A 4 -4.963 8.867 -22.434 1.00 0.00 H new ATOM 55 N ALA A 5 -8.668 14.489 -24.477 1.00 0.00 N ATOM 56 CA ALA A 5 -9.815 15.389 -24.485 1.00 0.00 C ATOM 57 C ALA A 5 -10.860 14.955 -23.464 1.00 0.00 C ATOM 58 O ALA A 5 -11.094 15.644 -22.471 1.00 0.00 O ATOM 59 CB ALA A 5 -10.428 15.450 -25.876 1.00 0.00 C ATOM 0 H ALA A 5 -8.879 13.534 -24.766 1.00 0.00 H new ATOM 0 HA ALA A 5 -9.466 16.384 -24.209 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -11.283 16.126 -25.867 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -9.685 15.814 -26.585 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -10.756 14.454 -26.173 1.00 0.00 H new ATOM 65 N ARG A 6 -11.485 13.810 -23.714 1.00 0.00 N ATOM 66 CA ARG A 6 -12.506 13.284 -22.815 1.00 0.00 C ATOM 67 C ARG A 6 -11.888 12.359 -21.773 1.00 0.00 C ATOM 68 O ARG A 6 -11.869 11.139 -21.943 1.00 0.00 O ATOM 69 CB ARG A 6 -13.577 12.534 -23.609 1.00 0.00 C ATOM 70 CG ARG A 6 -14.943 12.535 -22.941 1.00 0.00 C ATOM 71 CD ARG A 6 -16.056 12.799 -23.943 1.00 0.00 C ATOM 72 NE ARG A 6 -16.295 11.649 -24.810 1.00 0.00 N ATOM 73 CZ ARG A 6 -17.180 11.640 -25.804 1.00 0.00 C ATOM 74 NH1 ARG A 6 -17.911 12.719 -26.059 1.00 0.00 N ATOM 75 NH2 ARG A 6 -17.336 10.552 -26.545 1.00 0.00 N ATOM 0 H ARG A 6 -11.303 13.228 -24.532 1.00 0.00 H new ATOM 0 HA ARG A 6 -12.969 14.125 -22.299 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -13.665 12.983 -24.598 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -13.254 11.503 -23.755 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -15.111 11.574 -22.454 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -14.967 13.296 -22.161 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -16.973 13.047 -23.409 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -15.797 13.665 -24.552 1.00 0.00 H new ATOM 0 HE ARG A 6 -15.751 10.802 -24.644 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -17.795 13.559 -25.492 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -18.588 12.708 -26.822 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -16.777 9.720 -26.354 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -18.015 10.547 -27.306 1.00 0.00 H new ATOM 89 N MET A 7 -11.382 12.946 -20.693 1.00 0.00 N ATOM 90 CA MET A 7 -10.762 12.174 -19.622 1.00 0.00 C ATOM 91 C MET A 7 -11.807 11.371 -18.854 1.00 0.00 C ATOM 92 O MET A 7 -13.000 11.665 -18.918 1.00 0.00 O ATOM 93 CB MET A 7 -10.012 13.103 -18.666 1.00 0.00 C ATOM 94 CG MET A 7 -10.897 14.158 -18.022 1.00 0.00 C ATOM 95 SD MET A 7 -10.058 15.740 -17.822 1.00 0.00 S ATOM 96 CE MET A 7 -11.299 16.865 -18.457 1.00 0.00 C ATOM 0 H MET A 7 -11.389 13.954 -20.536 1.00 0.00 H new ATOM 0 HA MET A 7 -10.055 11.477 -20.072 1.00 0.00 H new ATOM 0 HB2 MET A 7 -9.546 12.505 -17.883 1.00 0.00 H new ATOM 0 HB3 MET A 7 -9.208 13.598 -19.210 1.00 0.00 H new ATOM 0 HG2 MET A 7 -11.790 14.299 -18.631 1.00 0.00 H new ATOM 0 HG3 MET A 7 -11.230 13.802 -17.047 1.00 0.00 H new ATOM 0 HE1 MET A 7 -10.926 17.888 -18.400 1.00 0.00 H new ATOM 0 HE2 MET A 7 -11.518 16.616 -19.495 1.00 0.00 H new ATOM 0 HE3 MET A 7 -12.209 16.776 -17.863 1.00 0.00 H new ATOM 106 N ASN A 8 -11.349 10.357 -18.128 1.00 0.00 N ATOM 107 CA ASN A 8 -12.243 9.511 -17.345 1.00 0.00 C ATOM 108 C ASN A 8 -11.848 9.520 -15.872 1.00 0.00 C ATOM 109 O ASN A 8 -10.666 9.600 -15.537 1.00 0.00 O ATOM 110 CB ASN A 8 -12.224 8.077 -17.885 1.00 0.00 C ATOM 111 CG ASN A 8 -13.586 7.626 -18.375 1.00 0.00 C ATOM 112 OD1 ASN A 8 -14.295 6.895 -17.685 1.00 0.00 O ATOM 113 ND2 ASN A 8 -13.957 8.061 -19.574 1.00 0.00 N ATOM 0 H ASN A 8 -10.364 10.101 -18.065 1.00 0.00 H new ATOM 0 HA ASN A 8 -13.253 9.911 -17.433 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -11.506 8.009 -18.702 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -11.881 7.401 -17.102 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -14.863 7.790 -19.957 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -13.336 8.666 -20.112 1.00 0.00 H new ATOM 120 N ARG A 9 -12.844 9.441 -14.996 1.00 0.00 N ATOM 121 CA ARG A 9 -12.599 9.442 -13.558 1.00 0.00 C ATOM 122 C ARG A 9 -12.041 8.095 -13.100 1.00 0.00 C ATOM 123 O ARG A 9 -12.466 7.044 -13.580 1.00 0.00 O ATOM 124 CB ARG A 9 -13.890 9.756 -12.800 1.00 0.00 C ATOM 125 CG ARG A 9 -14.546 11.057 -13.230 1.00 0.00 C ATOM 126 CD ARG A 9 -15.762 11.377 -12.375 1.00 0.00 C ATOM 127 NE ARG A 9 -15.897 12.811 -12.129 1.00 0.00 N ATOM 128 CZ ARG A 9 -16.995 13.378 -11.635 1.00 0.00 C ATOM 129 NH1 ARG A 9 -18.054 12.638 -11.332 1.00 0.00 N ATOM 130 NH2 ARG A 9 -17.033 14.689 -11.442 1.00 0.00 N ATOM 0 H ARG A 9 -13.828 9.375 -15.256 1.00 0.00 H new ATOM 0 HA ARG A 9 -11.861 10.214 -13.341 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -14.595 8.938 -12.945 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -13.673 9.804 -11.733 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -13.825 11.871 -13.157 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -14.844 10.987 -14.276 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -16.660 11.008 -12.870 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -15.684 10.852 -11.423 1.00 0.00 H new ATOM 0 HE ARG A 9 -15.103 13.413 -12.349 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -18.029 11.629 -11.477 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -18.893 13.078 -10.954 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -16.221 15.262 -11.672 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -17.874 15.125 -11.063 1.00 0.00 H new ATOM 144 N PRO A 10 -11.079 8.108 -12.160 1.00 0.00 N ATOM 145 CA PRO A 10 -10.468 6.881 -11.641 1.00 0.00 C ATOM 146 C PRO A 10 -11.387 6.139 -10.677 1.00 0.00 C ATOM 147 O PRO A 10 -11.639 6.601 -9.564 1.00 0.00 O ATOM 148 CB PRO A 10 -9.228 7.393 -10.910 1.00 0.00 C ATOM 149 CG PRO A 10 -9.594 8.768 -10.470 1.00 0.00 C ATOM 150 CD PRO A 10 -10.511 9.317 -11.530 1.00 0.00 C ATOM 0 HA PRO A 10 -10.250 6.164 -12.432 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -8.978 6.758 -10.060 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -8.358 7.405 -11.566 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -10.089 8.747 -9.499 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -8.706 9.391 -10.362 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -11.289 9.948 -11.099 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -9.969 9.928 -12.252 1.00 0.00 H new ATOM 158 N ALA A 11 -11.887 4.987 -11.112 1.00 0.00 N ATOM 159 CA ALA A 11 -12.778 4.182 -10.286 1.00 0.00 C ATOM 160 C ALA A 11 -12.017 3.525 -9.137 1.00 0.00 C ATOM 161 O ALA A 11 -10.841 3.191 -9.271 1.00 0.00 O ATOM 162 CB ALA A 11 -13.473 3.126 -11.133 1.00 0.00 C ATOM 0 H ALA A 11 -11.690 4.591 -12.031 1.00 0.00 H new ATOM 0 HA ALA A 11 -13.532 4.842 -9.858 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -14.135 2.532 -10.503 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -14.056 3.613 -11.915 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -12.726 2.476 -11.589 1.00 0.00 H new ATOM 168 N PRO A 12 -12.683 3.330 -7.985 1.00 0.00 N ATOM 169 CA PRO A 12 -12.062 2.711 -6.811 1.00 0.00 C ATOM 170 C PRO A 12 -11.818 1.218 -7.005 1.00 0.00 C ATOM 171 O PRO A 12 -12.389 0.598 -7.903 1.00 0.00 O ATOM 172 CB PRO A 12 -13.090 2.943 -5.702 1.00 0.00 C ATOM 173 CG PRO A 12 -14.393 3.053 -6.413 1.00 0.00 C ATOM 174 CD PRO A 12 -14.091 3.699 -7.737 1.00 0.00 C ATOM 0 HA PRO A 12 -11.081 3.135 -6.598 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -13.096 2.119 -4.989 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -12.868 3.850 -5.139 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -14.845 2.071 -6.552 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -15.101 3.651 -5.840 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -14.748 3.329 -8.524 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -14.222 4.780 -7.696 1.00 0.00 H new ATOM 182 N VAL A 13 -10.968 0.646 -6.159 1.00 0.00 N ATOM 183 CA VAL A 13 -10.653 -0.775 -6.239 1.00 0.00 C ATOM 184 C VAL A 13 -10.455 -1.368 -4.849 1.00 0.00 C ATOM 185 O VAL A 13 -9.669 -0.859 -4.052 1.00 0.00 O ATOM 186 CB VAL A 13 -9.387 -1.025 -7.078 1.00 0.00 C ATOM 187 CG1 VAL A 13 -9.193 -2.514 -7.323 1.00 0.00 C ATOM 188 CG2 VAL A 13 -9.459 -0.265 -8.393 1.00 0.00 C ATOM 0 H VAL A 13 -10.486 1.144 -5.411 1.00 0.00 H new ATOM 0 HA VAL A 13 -11.499 -1.262 -6.724 1.00 0.00 H new ATOM 0 HB VAL A 13 -8.526 -0.658 -6.520 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -8.293 -2.671 -7.918 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -9.091 -3.030 -6.368 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -10.056 -2.910 -7.859 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -8.555 -0.454 -8.972 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -10.329 -0.598 -8.959 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -9.544 0.803 -8.192 1.00 0.00 H new ATOM 198 N GLU A 14 -11.178 -2.443 -4.562 1.00 0.00 N ATOM 199 CA GLU A 14 -11.083 -3.098 -3.266 1.00 0.00 C ATOM 200 C GLU A 14 -10.367 -4.442 -3.369 1.00 0.00 C ATOM 201 O GLU A 14 -10.754 -5.308 -4.155 1.00 0.00 O ATOM 202 CB GLU A 14 -12.478 -3.298 -2.671 1.00 0.00 C ATOM 203 CG GLU A 14 -13.357 -4.237 -3.482 1.00 0.00 C ATOM 204 CD GLU A 14 -14.835 -3.947 -3.308 1.00 0.00 C ATOM 205 OE1 GLU A 14 -15.233 -2.774 -3.467 1.00 0.00 O ATOM 206 OE2 GLU A 14 -15.595 -4.893 -3.013 1.00 0.00 O ATOM 0 H GLU A 14 -11.835 -2.878 -5.209 1.00 0.00 H new ATOM 0 HA GLU A 14 -10.498 -2.452 -2.611 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -12.379 -3.690 -1.659 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -12.972 -2.330 -2.591 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -13.096 -4.153 -4.537 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -13.155 -5.266 -3.184 1.00 0.00 H new ATOM 213 N VAL A 15 -9.333 -4.611 -2.554 1.00 0.00 N ATOM 214 CA VAL A 15 -8.562 -5.850 -2.523 1.00 0.00 C ATOM 215 C VAL A 15 -8.900 -6.619 -1.250 1.00 0.00 C ATOM 216 O VAL A 15 -8.892 -6.047 -0.161 1.00 0.00 O ATOM 217 CB VAL A 15 -7.042 -5.573 -2.572 1.00 0.00 C ATOM 218 CG1 VAL A 15 -6.283 -6.796 -3.063 1.00 0.00 C ATOM 219 CG2 VAL A 15 -6.740 -4.367 -3.451 1.00 0.00 C ATOM 0 H VAL A 15 -9.006 -3.900 -1.900 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.824 -6.439 -3.402 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.708 -5.350 -1.559 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.216 -6.576 -3.089 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -6.465 -7.632 -2.388 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -6.624 -7.058 -4.065 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.664 -4.191 -3.470 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -7.095 -4.557 -4.464 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -7.244 -3.488 -3.049 1.00 0.00 H new ATOM 229 N SER A 16 -9.225 -7.903 -1.380 1.00 0.00 N ATOM 230 CA SER A 16 -9.593 -8.697 -0.211 1.00 0.00 C ATOM 231 C SER A 16 -8.877 -10.039 -0.181 1.00 0.00 C ATOM 232 O SER A 16 -8.732 -10.707 -1.203 1.00 0.00 O ATOM 233 CB SER A 16 -11.106 -8.918 -0.181 1.00 0.00 C ATOM 234 OG SER A 16 -11.629 -9.045 -1.492 1.00 0.00 O ATOM 0 H SER A 16 -9.241 -8.408 -2.266 1.00 0.00 H new ATOM 0 HA SER A 16 -9.284 -8.137 0.672 1.00 0.00 H new ATOM 0 HB2 SER A 16 -11.334 -9.816 0.393 1.00 0.00 H new ATOM 0 HB3 SER A 16 -11.589 -8.083 0.327 1.00 0.00 H new ATOM 0 HG SER A 16 -12.598 -9.187 -1.445 1.00 0.00 H new ATOM 240 N TYR A 17 -8.442 -10.427 1.011 1.00 0.00 N ATOM 241 CA TYR A 17 -7.748 -11.690 1.207 1.00 0.00 C ATOM 242 C TYR A 17 -7.911 -12.160 2.651 1.00 0.00 C ATOM 243 O TYR A 17 -7.668 -11.404 3.590 1.00 0.00 O ATOM 244 CB TYR A 17 -6.265 -11.538 0.847 1.00 0.00 C ATOM 245 CG TYR A 17 -5.357 -12.552 1.507 1.00 0.00 C ATOM 246 CD1 TYR A 17 -5.326 -13.874 1.082 1.00 0.00 C ATOM 247 CD2 TYR A 17 -4.532 -12.184 2.559 1.00 0.00 C ATOM 248 CE1 TYR A 17 -4.496 -14.800 1.688 1.00 0.00 C ATOM 249 CE2 TYR A 17 -3.700 -13.100 3.170 1.00 0.00 C ATOM 250 CZ TYR A 17 -3.684 -14.406 2.730 1.00 0.00 C ATOM 251 OH TYR A 17 -2.856 -15.323 3.337 1.00 0.00 O ATOM 0 H TYR A 17 -8.560 -9.878 1.863 1.00 0.00 H new ATOM 0 HA TYR A 17 -8.185 -12.442 0.550 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -6.156 -11.619 -0.234 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -5.936 -10.537 1.126 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -5.960 -14.184 0.265 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -4.541 -11.162 2.907 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -4.484 -15.825 1.347 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -3.065 -12.795 3.989 1.00 0.00 H new ATOM 0 HH TYR A 17 -2.294 -14.869 3.999 1.00 0.00 H new ATOM 261 N LYS A 18 -8.328 -13.408 2.819 1.00 0.00 N ATOM 262 CA LYS A 18 -8.528 -13.980 4.147 1.00 0.00 C ATOM 263 C LYS A 18 -9.634 -13.242 4.907 1.00 0.00 C ATOM 264 O LYS A 18 -10.810 -13.590 4.792 1.00 0.00 O ATOM 265 CB LYS A 18 -7.220 -13.954 4.943 1.00 0.00 C ATOM 266 CG LYS A 18 -6.190 -14.960 4.455 1.00 0.00 C ATOM 267 CD LYS A 18 -6.371 -16.315 5.123 1.00 0.00 C ATOM 268 CE LYS A 18 -5.218 -16.632 6.063 1.00 0.00 C ATOM 269 NZ LYS A 18 -5.461 -16.111 7.435 1.00 0.00 N ATOM 0 H LYS A 18 -8.535 -14.046 2.051 1.00 0.00 H new ATOM 0 HA LYS A 18 -8.841 -15.017 4.023 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -6.792 -12.953 4.889 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -7.439 -14.151 5.992 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -6.274 -15.072 3.374 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -5.188 -14.584 4.659 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -7.308 -16.325 5.679 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -6.444 -17.091 4.361 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -5.070 -17.711 6.105 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -4.299 -16.200 5.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -4.652 -16.348 8.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -5.577 -15.078 7.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -6.324 -16.542 7.822 1.00 0.00 H new ATOM 283 N HIS A 19 -9.258 -12.230 5.693 1.00 0.00 N ATOM 284 CA HIS A 19 -10.234 -11.470 6.470 1.00 0.00 C ATOM 285 C HIS A 19 -10.075 -9.963 6.264 1.00 0.00 C ATOM 286 O HIS A 19 -11.063 -9.232 6.193 1.00 0.00 O ATOM 287 CB HIS A 19 -10.101 -11.809 7.956 1.00 0.00 C ATOM 288 CG HIS A 19 -11.389 -12.237 8.589 1.00 0.00 C ATOM 289 ND1 HIS A 19 -12.439 -12.773 7.873 1.00 0.00 N ATOM 290 CD2 HIS A 19 -11.795 -12.208 9.882 1.00 0.00 C ATOM 291 CE1 HIS A 19 -13.434 -13.055 8.694 1.00 0.00 C ATOM 292 NE2 HIS A 19 -13.069 -12.721 9.919 1.00 0.00 N ATOM 0 H HIS A 19 -8.292 -11.921 5.806 1.00 0.00 H new ATOM 0 HA HIS A 19 -11.226 -11.751 6.118 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -9.365 -12.604 8.075 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -9.717 -10.938 8.486 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -11.224 -11.849 10.725 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -14.384 -13.485 8.412 1.00 0.00 H new ATOM 0 HE2 HIS A 19 -13.641 -12.827 10.757 1.00 0.00 H new ATOM 300 N MET A 20 -8.830 -9.501 6.180 1.00 0.00 N ATOM 301 CA MET A 20 -8.560 -8.073 5.996 1.00 0.00 C ATOM 302 C MET A 20 -8.877 -7.629 4.572 1.00 0.00 C ATOM 303 O MET A 20 -8.803 -8.418 3.630 1.00 0.00 O ATOM 304 CB MET A 20 -7.101 -7.707 6.343 1.00 0.00 C ATOM 305 CG MET A 20 -6.181 -8.892 6.618 1.00 0.00 C ATOM 306 SD MET A 20 -5.787 -9.842 5.135 1.00 0.00 S ATOM 307 CE MET A 20 -5.436 -8.536 3.963 1.00 0.00 C ATOM 0 H MET A 20 -7.997 -10.087 6.236 1.00 0.00 H new ATOM 0 HA MET A 20 -9.215 -7.544 6.688 1.00 0.00 H new ATOM 0 HB2 MET A 20 -6.683 -7.127 5.520 1.00 0.00 H new ATOM 0 HB3 MET A 20 -7.105 -7.059 7.220 1.00 0.00 H new ATOM 0 HG2 MET A 20 -5.256 -8.530 7.066 1.00 0.00 H new ATOM 0 HG3 MET A 20 -6.653 -9.549 7.348 1.00 0.00 H new ATOM 0 HE1 MET A 20 -4.991 -8.963 3.064 1.00 0.00 H new ATOM 0 HE2 MET A 20 -6.362 -8.024 3.701 1.00 0.00 H new ATOM 0 HE3 MET A 20 -4.741 -7.824 4.409 1.00 0.00 H new ATOM 317 N ARG A 21 -9.237 -6.355 4.428 1.00 0.00 N ATOM 318 CA ARG A 21 -9.574 -5.791 3.126 1.00 0.00 C ATOM 319 C ARG A 21 -8.737 -4.548 2.833 1.00 0.00 C ATOM 320 O ARG A 21 -8.122 -3.974 3.732 1.00 0.00 O ATOM 321 CB ARG A 21 -11.062 -5.441 3.069 1.00 0.00 C ATOM 322 CG ARG A 21 -11.973 -6.657 3.029 1.00 0.00 C ATOM 323 CD ARG A 21 -13.340 -6.353 3.624 1.00 0.00 C ATOM 324 NE ARG A 21 -13.642 -7.208 4.767 1.00 0.00 N ATOM 325 CZ ARG A 21 -14.067 -8.465 4.662 1.00 0.00 C ATOM 326 NH1 ARG A 21 -14.239 -9.017 3.467 1.00 0.00 N ATOM 327 NH2 ARG A 21 -14.320 -9.173 5.754 1.00 0.00 N ATOM 0 H ARG A 21 -9.302 -5.693 5.201 1.00 0.00 H new ATOM 0 HA ARG A 21 -9.353 -6.541 2.367 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -11.317 -4.835 3.938 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -11.249 -4.828 2.187 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -12.090 -6.991 1.998 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -11.511 -7.477 3.579 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -13.376 -5.308 3.933 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -14.106 -6.486 2.860 1.00 0.00 H new ATOM 0 HE ARG A 21 -13.520 -6.819 5.702 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -14.045 -8.477 2.623 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -14.565 -9.981 3.392 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -14.189 -8.754 6.675 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -14.646 -10.136 5.673 1.00 0.00 H new ATOM 341 N PHE A 22 -8.718 -4.143 1.567 1.00 0.00 N ATOM 342 CA PHE A 22 -7.958 -2.971 1.143 1.00 0.00 C ATOM 343 C PHE A 22 -8.778 -2.118 0.176 1.00 0.00 C ATOM 344 O PHE A 22 -9.460 -2.647 -0.699 1.00 0.00 O ATOM 345 CB PHE A 22 -6.655 -3.409 0.467 1.00 0.00 C ATOM 346 CG PHE A 22 -5.447 -3.325 1.355 1.00 0.00 C ATOM 347 CD1 PHE A 22 -4.891 -2.097 1.674 1.00 0.00 C ATOM 348 CD2 PHE A 22 -4.862 -4.475 1.863 1.00 0.00 C ATOM 349 CE1 PHE A 22 -3.775 -2.015 2.484 1.00 0.00 C ATOM 350 CE2 PHE A 22 -3.745 -4.398 2.673 1.00 0.00 C ATOM 351 CZ PHE A 22 -3.202 -3.168 2.985 1.00 0.00 C ATOM 0 H PHE A 22 -9.222 -4.611 0.814 1.00 0.00 H new ATOM 0 HA PHE A 22 -7.725 -2.374 2.025 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -6.766 -4.436 0.118 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -6.489 -2.789 -0.414 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -5.335 -1.193 1.285 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -5.283 -5.440 1.623 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -3.351 -1.051 2.725 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -3.297 -5.300 3.062 1.00 0.00 H new ATOM 0 HZ PHE A 22 -2.330 -3.107 3.620 1.00 0.00 H new ATOM 361 N LEU A 23 -8.705 -0.797 0.331 1.00 0.00 N ATOM 362 CA LEU A 23 -9.442 0.110 -0.545 1.00 0.00 C ATOM 363 C LEU A 23 -8.500 1.008 -1.330 1.00 0.00 C ATOM 364 O LEU A 23 -7.525 1.530 -0.793 1.00 0.00 O ATOM 365 CB LEU A 23 -10.413 0.987 0.251 1.00 0.00 C ATOM 366 CG LEU A 23 -11.748 0.336 0.595 1.00 0.00 C ATOM 367 CD1 LEU A 23 -12.404 -0.247 -0.654 1.00 0.00 C ATOM 368 CD2 LEU A 23 -11.551 -0.732 1.657 1.00 0.00 C ATOM 0 H LEU A 23 -8.148 -0.334 1.049 1.00 0.00 H new ATOM 0 HA LEU A 23 -10.006 -0.514 -1.238 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.926 1.290 1.178 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.607 1.895 -0.319 1.00 0.00 H new ATOM 0 HG LEU A 23 -12.416 1.099 0.995 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -13.355 -0.706 -0.385 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -12.577 0.548 -1.379 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -11.748 -1.000 -1.092 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -12.511 -1.190 1.895 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -10.868 -1.495 1.284 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -11.133 -0.279 2.556 1.00 0.00 H new ATOM 380 N ILE A 24 -8.817 1.199 -2.600 1.00 0.00 N ATOM 381 CA ILE A 24 -8.026 2.054 -3.468 1.00 0.00 C ATOM 382 C ILE A 24 -8.894 3.215 -3.958 1.00 0.00 C ATOM 383 O ILE A 24 -9.785 3.020 -4.785 1.00 0.00 O ATOM 384 CB ILE A 24 -7.470 1.257 -4.675 1.00 0.00 C ATOM 385 CG1 ILE A 24 -6.164 0.547 -4.292 1.00 0.00 C ATOM 386 CG2 ILE A 24 -7.260 2.159 -5.883 1.00 0.00 C ATOM 387 CD1 ILE A 24 -4.954 1.462 -4.246 1.00 0.00 C ATOM 0 H ILE A 24 -9.623 0.770 -3.055 1.00 0.00 H new ATOM 0 HA ILE A 24 -7.178 2.442 -2.903 1.00 0.00 H new ATOM 0 HB ILE A 24 -8.207 0.503 -4.950 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -6.290 0.079 -3.316 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -5.974 -0.253 -5.007 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -6.869 1.570 -6.713 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -8.211 2.607 -6.172 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -6.549 2.946 -5.630 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -4.072 0.885 -3.968 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -4.800 1.911 -5.227 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -5.120 2.248 -3.509 1.00 0.00 H new ATOM 399 N THR A 25 -8.655 4.411 -3.430 1.00 0.00 N ATOM 400 CA THR A 25 -9.448 5.576 -3.812 1.00 0.00 C ATOM 401 C THR A 25 -8.580 6.779 -4.174 1.00 0.00 C ATOM 402 O THR A 25 -7.392 6.830 -3.863 1.00 0.00 O ATOM 403 CB THR A 25 -10.405 5.952 -2.679 1.00 0.00 C ATOM 404 OG1 THR A 25 -9.874 5.563 -1.425 1.00 0.00 O ATOM 405 CG2 THR A 25 -11.772 5.319 -2.816 1.00 0.00 C ATOM 0 H THR A 25 -7.926 4.599 -2.742 1.00 0.00 H new ATOM 0 HA THR A 25 -10.014 5.302 -4.702 1.00 0.00 H new ATOM 0 HB THR A 25 -10.517 7.034 -2.742 1.00 0.00 H new ATOM 0 HG1 THR A 25 -10.552 5.063 -0.924 1.00 0.00 H new ATOM 0 HG21 THR A 25 -12.401 5.627 -1.981 1.00 0.00 H new ATOM 0 HG22 THR A 25 -12.229 5.640 -3.752 1.00 0.00 H new ATOM 0 HG23 THR A 25 -11.672 4.234 -2.814 1.00 0.00 H new ATOM 413 N HIS A 26 -9.209 7.747 -4.833 1.00 0.00 N ATOM 414 CA HIS A 26 -8.549 8.976 -5.262 1.00 0.00 C ATOM 415 C HIS A 26 -8.465 9.985 -4.122 1.00 0.00 C ATOM 416 O HIS A 26 -9.286 9.972 -3.206 1.00 0.00 O ATOM 417 CB HIS A 26 -9.272 9.591 -6.464 1.00 0.00 C ATOM 418 CG HIS A 26 -10.723 9.879 -6.227 1.00 0.00 C ATOM 419 ND1 HIS A 26 -11.800 9.056 -6.205 1.00 0.00 N flip ATOM 420 CD2 HIS A 26 -11.210 11.147 -5.995 1.00 0.00 C flip ATOM 421 CE1 HIS A 26 -12.903 9.838 -5.963 1.00 0.00 C flip ATOM 422 NE2 HIS A 26 -12.521 11.095 -5.840 1.00 0.00 N flip ATOM 0 H HIS A 26 -10.196 7.701 -5.086 1.00 0.00 H new ATOM 0 HA HIS A 26 -7.533 8.718 -5.562 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -8.770 10.518 -6.740 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -9.182 8.914 -7.313 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -10.612 12.045 -5.947 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -13.919 9.481 -5.886 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -13.133 11.890 -5.657 1.00 0.00 H new ATOM 430 N ASN A 27 -7.456 10.850 -4.173 1.00 0.00 N ATOM 431 CA ASN A 27 -7.263 11.852 -3.132 1.00 0.00 C ATOM 432 C ASN A 27 -8.461 12.794 -3.094 1.00 0.00 C ATOM 433 O ASN A 27 -9.178 12.939 -4.084 1.00 0.00 O ATOM 434 CB ASN A 27 -5.978 12.642 -3.384 1.00 0.00 C ATOM 435 CG ASN A 27 -5.971 13.320 -4.739 1.00 0.00 C ATOM 436 OD1 ASN A 27 -6.256 12.693 -5.760 1.00 0.00 O ATOM 437 ND2 ASN A 27 -5.644 14.607 -4.757 1.00 0.00 N ATOM 0 H ASN A 27 -6.763 10.877 -4.921 1.00 0.00 H new ATOM 0 HA ASN A 27 -7.175 11.348 -2.169 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -5.859 13.394 -2.604 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -5.122 11.970 -3.313 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -5.622 15.115 -5.641 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -5.415 15.087 -3.887 1.00 0.00 H new ATOM 444 N PRO A 28 -8.723 13.414 -1.931 1.00 0.00 N ATOM 445 CA PRO A 28 -9.877 14.298 -1.756 1.00 0.00 C ATOM 446 C PRO A 28 -9.942 15.423 -2.776 1.00 0.00 C ATOM 447 O PRO A 28 -8.931 16.036 -3.116 1.00 0.00 O ATOM 448 CB PRO A 28 -9.692 14.866 -0.348 1.00 0.00 C ATOM 449 CG PRO A 28 -8.844 13.867 0.359 1.00 0.00 C ATOM 450 CD PRO A 28 -7.946 13.269 -0.687 1.00 0.00 C ATOM 0 HA PRO A 28 -10.810 13.751 -1.896 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -9.211 15.844 -0.376 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -10.650 14.997 0.154 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -8.261 14.340 1.149 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -9.457 13.100 0.831 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -6.993 13.794 -0.746 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -7.721 12.224 -0.473 1.00 0.00 H new ATOM 458 N THR A 29 -11.155 15.687 -3.251 1.00 0.00 N ATOM 459 CA THR A 29 -11.390 16.741 -4.224 1.00 0.00 C ATOM 460 C THR A 29 -11.902 17.991 -3.523 1.00 0.00 C ATOM 461 O THR A 29 -12.614 17.904 -2.523 1.00 0.00 O ATOM 462 CB THR A 29 -12.396 16.281 -5.280 1.00 0.00 C ATOM 463 OG1 THR A 29 -13.676 16.091 -4.704 1.00 0.00 O ATOM 464 CG2 THR A 29 -12.002 14.987 -5.959 1.00 0.00 C ATOM 0 H THR A 29 -11.995 15.179 -2.973 1.00 0.00 H new ATOM 0 HA THR A 29 -10.448 16.972 -4.721 1.00 0.00 H new ATOM 0 HB THR A 29 -12.413 17.074 -6.027 1.00 0.00 H new ATOM 0 HG1 THR A 29 -14.335 15.939 -5.414 1.00 0.00 H new ATOM 0 HG21 THR A 29 -12.759 14.718 -6.696 1.00 0.00 H new ATOM 0 HG22 THR A 29 -11.040 15.115 -6.456 1.00 0.00 H new ATOM 0 HG23 THR A 29 -11.923 14.195 -5.214 1.00 0.00 H new ATOM 472 N ASN A 30 -11.524 19.150 -4.038 1.00 0.00 N ATOM 473 CA ASN A 30 -11.933 20.415 -3.445 1.00 0.00 C ATOM 474 C ASN A 30 -13.417 20.702 -3.667 1.00 0.00 C ATOM 475 O ASN A 30 -13.957 21.643 -3.086 1.00 0.00 O ATOM 476 CB ASN A 30 -11.095 21.559 -4.017 1.00 0.00 C ATOM 477 CG ASN A 30 -11.059 21.549 -5.532 1.00 0.00 C ATOM 478 OD1 ASN A 30 -12.037 21.182 -6.185 1.00 0.00 O ATOM 479 ND2 ASN A 30 -9.928 21.953 -6.101 1.00 0.00 N ATOM 0 H ASN A 30 -10.935 19.242 -4.865 1.00 0.00 H new ATOM 0 HA ASN A 30 -11.768 20.337 -2.370 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -11.501 22.510 -3.672 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -10.078 21.488 -3.632 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -9.845 21.968 -7.118 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -9.143 22.249 -5.521 1.00 0.00 H new ATOM 486 N ALA A 31 -14.079 19.913 -4.515 1.00 0.00 N ATOM 487 CA ALA A 31 -15.494 20.147 -4.785 1.00 0.00 C ATOM 488 C ALA A 31 -16.414 19.319 -3.888 1.00 0.00 C ATOM 489 O ALA A 31 -17.514 19.762 -3.557 1.00 0.00 O ATOM 490 CB ALA A 31 -15.796 19.859 -6.249 1.00 0.00 C ATOM 0 H ALA A 31 -13.668 19.125 -5.015 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.693 21.195 -4.562 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -16.854 20.036 -6.444 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -15.196 20.515 -6.880 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -15.554 18.820 -6.473 1.00 0.00 H new ATOM 496 N THR A 32 -15.976 18.129 -3.477 1.00 0.00 N ATOM 497 CA THR A 32 -16.804 17.297 -2.603 1.00 0.00 C ATOM 498 C THR A 32 -15.984 16.607 -1.515 1.00 0.00 C ATOM 499 O THR A 32 -15.529 15.478 -1.696 1.00 0.00 O ATOM 500 CB THR A 32 -17.549 16.249 -3.429 1.00 0.00 C ATOM 501 OG1 THR A 32 -16.761 15.825 -4.528 1.00 0.00 O ATOM 502 CG2 THR A 32 -18.869 16.746 -3.976 1.00 0.00 C ATOM 0 H THR A 32 -15.073 17.726 -3.728 1.00 0.00 H new ATOM 0 HA THR A 32 -17.518 17.957 -2.110 1.00 0.00 H new ATOM 0 HB THR A 32 -17.746 15.426 -2.742 1.00 0.00 H new ATOM 0 HG1 THR A 32 -15.857 15.608 -4.218 1.00 0.00 H new ATOM 0 HG21 THR A 32 -19.346 15.953 -4.552 1.00 0.00 H new ATOM 0 HG22 THR A 32 -19.519 17.036 -3.150 1.00 0.00 H new ATOM 0 HG23 THR A 32 -18.695 17.608 -4.620 1.00 0.00 H new ATOM 510 N LEU A 33 -15.826 17.269 -0.374 1.00 0.00 N ATOM 511 CA LEU A 33 -15.092 16.686 0.745 1.00 0.00 C ATOM 512 C LEU A 33 -15.967 15.707 1.532 1.00 0.00 C ATOM 513 O LEU A 33 -15.576 14.568 1.790 1.00 0.00 O ATOM 514 CB LEU A 33 -14.546 17.780 1.664 1.00 0.00 C ATOM 515 CG LEU A 33 -13.024 17.950 1.619 1.00 0.00 C ATOM 516 CD1 LEU A 33 -12.332 16.742 2.231 1.00 0.00 C ATOM 517 CD2 LEU A 33 -12.554 18.156 0.187 1.00 0.00 C ATOM 0 H LEU A 33 -16.194 18.204 -0.199 1.00 0.00 H new ATOM 0 HA LEU A 33 -14.250 16.128 0.336 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -15.012 18.728 1.396 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -14.843 17.557 2.689 1.00 0.00 H new ATOM 0 HG LEU A 33 -12.761 18.832 2.203 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -11.252 16.882 2.190 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -12.644 16.631 3.269 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -12.603 15.846 1.673 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -11.471 18.275 0.173 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -12.832 17.291 -0.415 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -13.022 19.050 -0.225 1.00 0.00 H new ATOM 529 N SER A 34 -17.147 16.183 1.930 1.00 0.00 N ATOM 530 CA SER A 34 -18.091 15.386 2.713 1.00 0.00 C ATOM 531 C SER A 34 -18.465 14.080 2.016 1.00 0.00 C ATOM 532 O SER A 34 -18.505 13.021 2.641 1.00 0.00 O ATOM 533 CB SER A 34 -19.357 16.199 2.992 1.00 0.00 C ATOM 534 OG SER A 34 -19.853 15.940 4.293 1.00 0.00 O ATOM 0 H SER A 34 -17.474 17.126 1.720 1.00 0.00 H new ATOM 0 HA SER A 34 -17.597 15.130 3.650 1.00 0.00 H new ATOM 0 HB2 SER A 34 -19.141 17.262 2.887 1.00 0.00 H new ATOM 0 HB3 SER A 34 -20.120 15.954 2.253 1.00 0.00 H new ATOM 0 HG SER A 34 -20.661 16.473 4.447 1.00 0.00 H new ATOM 540 N THR A 35 -18.754 14.156 0.726 1.00 0.00 N ATOM 541 CA THR A 35 -19.138 12.971 -0.031 1.00 0.00 C ATOM 542 C THR A 35 -18.055 11.898 0.040 1.00 0.00 C ATOM 543 O THR A 35 -18.346 10.699 0.001 1.00 0.00 O ATOM 544 CB THR A 35 -19.411 13.339 -1.490 1.00 0.00 C ATOM 545 OG1 THR A 35 -20.151 14.545 -1.572 1.00 0.00 O ATOM 546 CG2 THR A 35 -20.182 12.276 -2.242 1.00 0.00 C ATOM 0 H THR A 35 -18.731 15.019 0.183 1.00 0.00 H new ATOM 0 HA THR A 35 -20.048 12.569 0.414 1.00 0.00 H new ATOM 0 HB THR A 35 -18.428 13.445 -1.950 1.00 0.00 H new ATOM 0 HG1 THR A 35 -20.315 14.765 -2.513 1.00 0.00 H new ATOM 0 HG21 THR A 35 -20.341 12.601 -3.270 1.00 0.00 H new ATOM 0 HG22 THR A 35 -19.615 11.345 -2.239 1.00 0.00 H new ATOM 0 HG23 THR A 35 -21.146 12.115 -1.759 1.00 0.00 H new ATOM 554 N PHE A 36 -16.803 12.332 0.134 1.00 0.00 N ATOM 555 CA PHE A 36 -15.683 11.402 0.191 1.00 0.00 C ATOM 556 C PHE A 36 -15.563 10.730 1.554 1.00 0.00 C ATOM 557 O PHE A 36 -15.408 9.515 1.635 1.00 0.00 O ATOM 558 CB PHE A 36 -14.377 12.118 -0.147 1.00 0.00 C ATOM 559 CG PHE A 36 -13.546 11.414 -1.182 1.00 0.00 C ATOM 560 CD1 PHE A 36 -13.717 10.062 -1.449 1.00 0.00 C ATOM 561 CD2 PHE A 36 -12.584 12.110 -1.881 1.00 0.00 C ATOM 562 CE1 PHE A 36 -12.943 9.425 -2.397 1.00 0.00 C ATOM 563 CE2 PHE A 36 -11.806 11.479 -2.831 1.00 0.00 C ATOM 564 CZ PHE A 36 -11.984 10.134 -3.088 1.00 0.00 C ATOM 0 H PHE A 36 -16.540 13.317 0.172 1.00 0.00 H new ATOM 0 HA PHE A 36 -15.876 10.625 -0.548 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -14.606 13.123 -0.502 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -13.788 12.228 0.764 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -14.465 9.502 -0.908 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -12.437 13.162 -1.683 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -13.088 8.374 -2.597 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -11.058 12.038 -3.374 1.00 0.00 H new ATOM 0 HZ PHE A 36 -11.373 9.639 -3.829 1.00 0.00 H new ATOM 574 N ILE A 37 -15.630 11.511 2.626 1.00 0.00 N ATOM 575 CA ILE A 37 -15.518 10.947 3.964 1.00 0.00 C ATOM 576 C ILE A 37 -16.557 9.856 4.166 1.00 0.00 C ATOM 577 O ILE A 37 -16.291 8.829 4.791 1.00 0.00 O ATOM 578 CB ILE A 37 -15.698 12.014 5.057 1.00 0.00 C ATOM 579 CG1 ILE A 37 -16.895 12.914 4.754 1.00 0.00 C ATOM 580 CG2 ILE A 37 -14.430 12.839 5.216 1.00 0.00 C ATOM 581 CD1 ILE A 37 -17.277 13.820 5.903 1.00 0.00 C ATOM 0 H ILE A 37 -15.759 12.522 2.596 1.00 0.00 H new ATOM 0 HA ILE A 37 -14.514 10.531 4.050 1.00 0.00 H new ATOM 0 HB ILE A 37 -15.894 11.502 5.999 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -16.668 13.525 3.880 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -17.751 12.291 4.493 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -14.578 13.588 5.994 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -13.603 12.185 5.494 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -14.198 13.336 4.274 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -18.134 14.430 5.616 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -17.536 13.216 6.772 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -16.437 14.469 6.150 1.00 0.00 H new ATOM 593 N GLU A 38 -17.741 10.091 3.623 1.00 0.00 N ATOM 594 CA GLU A 38 -18.837 9.139 3.725 1.00 0.00 C ATOM 595 C GLU A 38 -18.520 7.842 2.979 1.00 0.00 C ATOM 596 O GLU A 38 -18.652 6.755 3.538 1.00 0.00 O ATOM 597 CB GLU A 38 -20.125 9.754 3.175 1.00 0.00 C ATOM 598 CG GLU A 38 -20.966 10.451 4.232 1.00 0.00 C ATOM 599 CD GLU A 38 -21.918 9.504 4.937 1.00 0.00 C ATOM 600 OE1 GLU A 38 -21.509 8.896 5.949 1.00 0.00 O ATOM 601 OE2 GLU A 38 -23.072 9.370 4.478 1.00 0.00 O ATOM 0 H GLU A 38 -17.969 10.939 3.104 1.00 0.00 H new ATOM 0 HA GLU A 38 -18.973 8.900 4.780 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -19.871 10.471 2.394 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -20.721 8.970 2.707 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -20.308 10.913 4.968 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -21.537 11.254 3.766 1.00 0.00 H new ATOM 608 N ASP A 39 -18.119 7.958 1.711 1.00 0.00 N ATOM 609 CA ASP A 39 -17.808 6.777 0.900 1.00 0.00 C ATOM 610 C ASP A 39 -16.541 6.067 1.385 1.00 0.00 C ATOM 611 O ASP A 39 -16.538 4.847 1.601 1.00 0.00 O ATOM 612 CB ASP A 39 -17.643 7.179 -0.566 1.00 0.00 C ATOM 613 CG ASP A 39 -18.973 7.300 -1.285 1.00 0.00 C ATOM 614 OD1 ASP A 39 -19.914 7.876 -0.699 1.00 0.00 O ATOM 615 OD2 ASP A 39 -19.074 6.818 -2.433 1.00 0.00 O ATOM 0 H ASP A 39 -18.003 8.848 1.227 1.00 0.00 H new ATOM 0 HA ASP A 39 -18.640 6.081 1.002 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -17.115 8.131 -0.622 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -17.024 6.441 -1.075 1.00 0.00 H new ATOM 620 N LEU A 40 -15.465 6.832 1.562 1.00 0.00 N ATOM 621 CA LEU A 40 -14.198 6.273 2.023 1.00 0.00 C ATOM 622 C LEU A 40 -14.389 5.558 3.353 1.00 0.00 C ATOM 623 O LEU A 40 -13.904 4.444 3.549 1.00 0.00 O ATOM 624 CB LEU A 40 -13.141 7.374 2.158 1.00 0.00 C ATOM 625 CG LEU A 40 -12.866 8.167 0.877 1.00 0.00 C ATOM 626 CD1 LEU A 40 -11.866 9.284 1.135 1.00 0.00 C ATOM 627 CD2 LEU A 40 -12.361 7.248 -0.224 1.00 0.00 C ATOM 0 H LEU A 40 -15.446 7.838 1.393 1.00 0.00 H new ATOM 0 HA LEU A 40 -13.851 5.551 1.284 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -13.458 8.068 2.936 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -12.208 6.922 2.495 1.00 0.00 H new ATOM 0 HG LEU A 40 -13.804 8.616 0.551 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -11.687 9.833 0.210 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -12.265 9.963 1.888 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -10.928 8.858 1.491 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -12.172 7.830 -1.126 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -11.437 6.767 0.098 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -13.112 6.486 -0.435 1.00 0.00 H new ATOM 639 N LYS A 41 -15.124 6.198 4.253 1.00 0.00 N ATOM 640 CA LYS A 41 -15.408 5.619 5.556 1.00 0.00 C ATOM 641 C LYS A 41 -16.494 4.557 5.426 1.00 0.00 C ATOM 642 O LYS A 41 -16.568 3.624 6.227 1.00 0.00 O ATOM 643 CB LYS A 41 -15.850 6.706 6.539 1.00 0.00 C ATOM 644 CG LYS A 41 -15.680 6.312 7.997 1.00 0.00 C ATOM 645 CD LYS A 41 -15.293 7.508 8.855 1.00 0.00 C ATOM 646 CE LYS A 41 -16.052 7.519 10.173 1.00 0.00 C ATOM 647 NZ LYS A 41 -15.201 7.063 11.307 1.00 0.00 N ATOM 0 H LYS A 41 -15.534 7.120 4.103 1.00 0.00 H new ATOM 0 HA LYS A 41 -14.499 5.155 5.939 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -15.277 7.613 6.347 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -16.897 6.946 6.356 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -16.609 5.881 8.369 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -14.915 5.540 8.080 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -14.221 7.484 9.052 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -15.496 8.429 8.309 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -16.416 8.527 10.374 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -16.927 6.874 10.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -15.693 7.243 12.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -15.014 6.044 11.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -14.300 7.583 11.296 1.00 0.00 H new ATOM 661 N LYS A 42 -17.339 4.710 4.406 1.00 0.00 N ATOM 662 CA LYS A 42 -18.428 3.773 4.157 1.00 0.00 C ATOM 663 C LYS A 42 -17.919 2.338 4.088 1.00 0.00 C ATOM 664 O LYS A 42 -18.495 1.445 4.710 1.00 0.00 O ATOM 665 CB LYS A 42 -19.156 4.129 2.860 1.00 0.00 C ATOM 666 CG LYS A 42 -20.583 4.608 3.074 1.00 0.00 C ATOM 667 CD LYS A 42 -21.452 4.327 1.859 1.00 0.00 C ATOM 668 CE LYS A 42 -21.615 5.565 0.992 1.00 0.00 C ATOM 669 NZ LYS A 42 -22.771 5.444 0.062 1.00 0.00 N ATOM 0 H LYS A 42 -17.287 5.479 3.738 1.00 0.00 H new ATOM 0 HA LYS A 42 -19.126 3.849 4.991 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -18.595 4.906 2.340 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -19.169 3.255 2.209 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -21.007 4.114 3.948 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -20.582 5.678 3.282 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -21.007 3.525 1.270 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -22.432 3.978 2.184 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -21.752 6.439 1.629 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -20.703 5.729 0.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -22.847 6.308 -0.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -22.629 4.625 -0.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -23.645 5.314 0.610 1.00 0.00 H new ATOM 683 N TYR A 43 -16.846 2.107 3.332 1.00 0.00 N ATOM 684 CA TYR A 43 -16.309 0.757 3.214 1.00 0.00 C ATOM 685 C TYR A 43 -15.809 0.257 4.565 1.00 0.00 C ATOM 686 O TYR A 43 -15.990 -0.912 4.906 1.00 0.00 O ATOM 687 CB TYR A 43 -15.180 0.704 2.189 1.00 0.00 C ATOM 688 CG TYR A 43 -14.832 -0.706 1.771 1.00 0.00 C ATOM 689 CD1 TYR A 43 -14.155 -1.549 2.636 1.00 0.00 C ATOM 690 CD2 TYR A 43 -15.182 -1.195 0.519 1.00 0.00 C ATOM 691 CE1 TYR A 43 -13.831 -2.841 2.273 1.00 0.00 C ATOM 692 CE2 TYR A 43 -14.862 -2.487 0.143 1.00 0.00 C ATOM 693 CZ TYR A 43 -14.186 -3.306 1.025 1.00 0.00 C ATOM 694 OH TYR A 43 -13.867 -4.593 0.656 1.00 0.00 O ATOM 0 H TYR A 43 -16.343 2.820 2.804 1.00 0.00 H new ATOM 0 HA TYR A 43 -17.115 0.107 2.874 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -15.468 1.278 1.308 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -14.294 1.183 2.606 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -13.875 -1.188 3.615 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -15.712 -0.556 -0.172 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -13.303 -3.483 2.962 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -15.139 -2.853 -0.835 1.00 0.00 H new ATOM 0 HH TYR A 43 -14.190 -4.762 -0.254 1.00 0.00 H new ATOM 704 N GLY A 44 -15.195 1.147 5.339 1.00 0.00 N ATOM 705 CA GLY A 44 -14.701 0.763 6.649 1.00 0.00 C ATOM 706 C GLY A 44 -13.642 1.704 7.182 1.00 0.00 C ATOM 707 O GLY A 44 -13.342 2.723 6.561 1.00 0.00 O ATOM 0 H GLY A 44 -15.031 2.121 5.085 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -15.535 0.729 7.350 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -14.289 -0.245 6.595 1.00 0.00 H new ATOM 711 N ALA A 45 -13.102 1.387 8.358 1.00 0.00 N ATOM 712 CA ALA A 45 -12.107 2.253 8.980 1.00 0.00 C ATOM 713 C ALA A 45 -10.839 1.536 9.460 1.00 0.00 C ATOM 714 O ALA A 45 -10.889 0.637 10.299 1.00 0.00 O ATOM 715 CB ALA A 45 -12.752 2.983 10.134 1.00 0.00 C ATOM 0 H ALA A 45 -13.334 0.549 8.891 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.770 2.941 8.205 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -12.018 3.635 10.608 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -13.585 3.582 9.766 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -13.119 2.260 10.862 1.00 0.00 H new ATOM 721 N THR A 46 -9.703 1.999 8.946 1.00 0.00 N ATOM 722 CA THR A 46 -8.379 1.494 9.320 1.00 0.00 C ATOM 723 C THR A 46 -7.332 2.489 8.844 1.00 0.00 C ATOM 724 O THR A 46 -7.678 3.582 8.396 1.00 0.00 O ATOM 725 CB THR A 46 -8.093 0.097 8.765 1.00 0.00 C ATOM 726 OG1 THR A 46 -9.229 -0.729 8.880 1.00 0.00 O ATOM 727 CG2 THR A 46 -6.960 -0.615 9.473 1.00 0.00 C ATOM 0 H THR A 46 -9.672 2.744 8.250 1.00 0.00 H new ATOM 0 HA THR A 46 -8.346 1.394 10.405 1.00 0.00 H new ATOM 0 HB THR A 46 -7.814 0.261 7.724 1.00 0.00 H new ATOM 0 HG1 THR A 46 -9.941 -0.390 8.298 1.00 0.00 H new ATOM 0 HG21 THR A 46 -6.813 -1.599 9.027 1.00 0.00 H new ATOM 0 HG22 THR A 46 -6.045 -0.031 9.373 1.00 0.00 H new ATOM 0 HG23 THR A 46 -7.205 -0.728 10.529 1.00 0.00 H new ATOM 735 N THR A 47 -6.059 2.130 8.928 1.00 0.00 N ATOM 736 CA THR A 47 -5.014 3.032 8.487 1.00 0.00 C ATOM 737 C THR A 47 -5.119 3.250 6.980 1.00 0.00 C ATOM 738 O THR A 47 -5.587 2.381 6.236 1.00 0.00 O ATOM 739 CB THR A 47 -3.637 2.467 8.841 1.00 0.00 C ATOM 740 OG1 THR A 47 -2.612 3.209 8.204 1.00 0.00 O ATOM 741 CG2 THR A 47 -3.465 1.016 8.446 1.00 0.00 C ATOM 0 H THR A 47 -5.732 1.235 9.292 1.00 0.00 H new ATOM 0 HA THR A 47 -5.138 3.988 8.996 1.00 0.00 H new ATOM 0 HB THR A 47 -3.565 2.543 9.926 1.00 0.00 H new ATOM 0 HG1 THR A 47 -1.982 2.594 7.774 1.00 0.00 H new ATOM 0 HG21 THR A 47 -2.467 0.679 8.726 1.00 0.00 H new ATOM 0 HG22 THR A 47 -4.210 0.408 8.959 1.00 0.00 H new ATOM 0 HG23 THR A 47 -3.594 0.915 7.368 1.00 0.00 H new ATOM 749 N VAL A 48 -4.710 4.430 6.541 1.00 0.00 N ATOM 750 CA VAL A 48 -4.775 4.783 5.133 1.00 0.00 C ATOM 751 C VAL A 48 -3.419 5.255 4.629 1.00 0.00 C ATOM 752 O VAL A 48 -2.747 6.041 5.288 1.00 0.00 O ATOM 753 CB VAL A 48 -5.826 5.888 4.890 1.00 0.00 C ATOM 754 CG1 VAL A 48 -5.798 6.368 3.444 1.00 0.00 C ATOM 755 CG2 VAL A 48 -7.212 5.392 5.269 1.00 0.00 C ATOM 0 H VAL A 48 -4.329 5.161 7.142 1.00 0.00 H new ATOM 0 HA VAL A 48 -5.067 3.888 4.584 1.00 0.00 H new ATOM 0 HB VAL A 48 -5.577 6.739 5.525 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -6.549 7.146 3.304 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -4.812 6.770 3.213 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -6.013 5.532 2.779 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -7.942 6.182 5.092 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -7.465 4.522 4.663 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -7.224 5.116 6.323 1.00 0.00 H new ATOM 765 N VAL A 49 -3.020 4.772 3.460 1.00 0.00 N ATOM 766 CA VAL A 49 -1.742 5.166 2.886 1.00 0.00 C ATOM 767 C VAL A 49 -1.934 5.936 1.587 1.00 0.00 C ATOM 768 O VAL A 49 -2.238 5.355 0.539 1.00 0.00 O ATOM 769 CB VAL A 49 -0.841 3.946 2.627 1.00 0.00 C ATOM 770 CG1 VAL A 49 -1.499 2.983 1.650 1.00 0.00 C ATOM 771 CG2 VAL A 49 0.524 4.383 2.122 1.00 0.00 C ATOM 0 H VAL A 49 -3.557 4.113 2.896 1.00 0.00 H new ATOM 0 HA VAL A 49 -1.255 5.814 3.615 1.00 0.00 H new ATOM 0 HB VAL A 49 -0.701 3.421 3.572 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -0.843 2.129 1.483 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -2.447 2.637 2.063 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -1.680 3.492 0.703 1.00 0.00 H new ATOM 0 HG21 VAL A 49 1.145 3.505 1.945 1.00 0.00 H new ATOM 0 HG22 VAL A 49 0.407 4.938 1.191 1.00 0.00 H new ATOM 0 HG23 VAL A 49 1.001 5.020 2.867 1.00 0.00 H new ATOM 781 N ARG A 50 -1.743 7.246 1.651 1.00 0.00 N ATOM 782 CA ARG A 50 -1.876 8.079 0.470 1.00 0.00 C ATOM 783 C ARG A 50 -0.535 8.695 0.102 1.00 0.00 C ATOM 784 O ARG A 50 -0.036 9.570 0.809 1.00 0.00 O ATOM 785 CB ARG A 50 -2.918 9.178 0.703 1.00 0.00 C ATOM 786 CG ARG A 50 -2.492 10.221 1.725 1.00 0.00 C ATOM 787 CD ARG A 50 -3.637 10.591 2.654 1.00 0.00 C ATOM 788 NE ARG A 50 -4.415 11.718 2.146 1.00 0.00 N ATOM 789 CZ ARG A 50 -5.631 12.035 2.584 1.00 0.00 C ATOM 790 NH1 ARG A 50 -6.211 11.312 3.534 1.00 0.00 N ATOM 791 NH2 ARG A 50 -6.269 13.078 2.071 1.00 0.00 N ATOM 0 H ARG A 50 -1.497 7.750 2.503 1.00 0.00 H new ATOM 0 HA ARG A 50 -2.211 7.453 -0.357 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -3.126 9.675 -0.244 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -3.850 8.718 1.033 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -1.656 9.838 2.311 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -2.137 11.114 1.209 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -4.291 9.729 2.784 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -3.239 10.840 3.638 1.00 0.00 H new ATOM 0 HE ARG A 50 -4.002 12.295 1.413 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -5.725 10.509 3.932 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -7.143 11.560 3.866 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -5.828 13.637 1.341 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -7.201 13.321 2.406 1.00 0.00 H new ATOM 805 N VAL A 51 0.042 8.265 -1.013 1.00 0.00 N ATOM 806 CA VAL A 51 1.309 8.830 -1.444 1.00 0.00 C ATOM 807 C VAL A 51 1.065 9.791 -2.589 1.00 0.00 C ATOM 808 O VAL A 51 1.071 9.410 -3.760 1.00 0.00 O ATOM 809 CB VAL A 51 2.302 7.741 -1.896 1.00 0.00 C ATOM 810 CG1 VAL A 51 3.706 8.314 -2.031 1.00 0.00 C ATOM 811 CG2 VAL A 51 2.290 6.567 -0.928 1.00 0.00 C ATOM 0 H VAL A 51 -0.339 7.542 -1.623 1.00 0.00 H new ATOM 0 HA VAL A 51 1.749 9.351 -0.594 1.00 0.00 H new ATOM 0 HB VAL A 51 1.987 7.379 -2.875 1.00 0.00 H new ATOM 0 HG11 VAL A 51 4.390 7.528 -2.351 1.00 0.00 H new ATOM 0 HG12 VAL A 51 3.702 9.115 -2.770 1.00 0.00 H new ATOM 0 HG13 VAL A 51 4.032 8.709 -1.069 1.00 0.00 H new ATOM 0 HG21 VAL A 51 2.998 5.810 -1.266 1.00 0.00 H new ATOM 0 HG22 VAL A 51 2.574 6.912 0.066 1.00 0.00 H new ATOM 0 HG23 VAL A 51 1.289 6.137 -0.890 1.00 0.00 H new ATOM 821 N CYS A 52 0.849 11.043 -2.229 1.00 0.00 N ATOM 822 CA CYS A 52 0.597 12.091 -3.195 1.00 0.00 C ATOM 823 C CYS A 52 0.905 13.442 -2.584 1.00 0.00 C ATOM 824 O CYS A 52 1.141 13.549 -1.380 1.00 0.00 O ATOM 825 CB CYS A 52 -0.855 12.045 -3.674 1.00 0.00 C ATOM 826 SG CYS A 52 -1.076 12.527 -5.404 1.00 0.00 S ATOM 0 H CYS A 52 0.844 11.359 -1.259 1.00 0.00 H new ATOM 0 HA CYS A 52 1.247 11.934 -4.056 1.00 0.00 H new ATOM 0 HB2 CYS A 52 -1.240 11.034 -3.537 1.00 0.00 H new ATOM 0 HB3 CYS A 52 -1.455 12.702 -3.045 1.00 0.00 H new ATOM 0 HG CYS A 52 -2.336 12.454 -5.717 1.00 0.00 H new ATOM 832 N GLU A 53 0.879 14.476 -3.403 1.00 0.00 N ATOM 833 CA GLU A 53 1.133 15.817 -2.912 1.00 0.00 C ATOM 834 C GLU A 53 0.018 16.205 -1.947 1.00 0.00 C ATOM 835 O GLU A 53 -1.163 16.018 -2.241 1.00 0.00 O ATOM 836 CB GLU A 53 1.233 16.809 -4.073 1.00 0.00 C ATOM 837 CG GLU A 53 1.766 16.200 -5.370 1.00 0.00 C ATOM 838 CD GLU A 53 2.843 15.141 -5.153 1.00 0.00 C ATOM 839 OE1 GLU A 53 3.973 15.516 -4.774 1.00 0.00 O ATOM 840 OE2 GLU A 53 2.554 13.935 -5.364 1.00 0.00 O ATOM 0 H GLU A 53 0.686 14.415 -4.403 1.00 0.00 H new ATOM 0 HA GLU A 53 2.087 15.842 -2.385 1.00 0.00 H new ATOM 0 HB2 GLU A 53 0.246 17.232 -4.261 1.00 0.00 H new ATOM 0 HB3 GLU A 53 1.882 17.633 -3.778 1.00 0.00 H new ATOM 0 HG2 GLU A 53 0.937 15.755 -5.920 1.00 0.00 H new ATOM 0 HG3 GLU A 53 2.172 16.996 -5.995 1.00 0.00 H new ATOM 847 N VAL A 54 0.400 16.701 -0.780 1.00 0.00 N ATOM 848 CA VAL A 54 -0.572 17.064 0.249 1.00 0.00 C ATOM 849 C VAL A 54 -1.202 18.431 0.015 1.00 0.00 C ATOM 850 O VAL A 54 -0.509 19.446 -0.049 1.00 0.00 O ATOM 851 CB VAL A 54 0.072 17.050 1.649 1.00 0.00 C ATOM 852 CG1 VAL A 54 0.339 15.623 2.100 1.00 0.00 C ATOM 853 CG2 VAL A 54 1.354 17.868 1.655 1.00 0.00 C ATOM 0 H VAL A 54 1.373 16.862 -0.519 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.359 16.312 0.189 1.00 0.00 H new ATOM 0 HB VAL A 54 -0.625 17.504 2.354 1.00 0.00 H new ATOM 0 HG11 VAL A 54 0.794 15.634 3.091 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.600 15.072 2.138 1.00 0.00 H new ATOM 0 HG13 VAL A 54 1.015 15.139 1.395 1.00 0.00 H new ATOM 0 HG21 VAL A 54 1.795 17.847 2.652 1.00 0.00 H new ATOM 0 HG22 VAL A 54 2.058 17.446 0.938 1.00 0.00 H new ATOM 0 HG23 VAL A 54 1.129 18.898 1.380 1.00 0.00 H new ATOM 863 N THR A 55 -2.531 18.448 -0.086 1.00 0.00 N ATOM 864 CA THR A 55 -3.268 19.691 -0.282 1.00 0.00 C ATOM 865 C THR A 55 -4.250 19.923 0.867 1.00 0.00 C ATOM 866 O THR A 55 -4.312 21.015 1.432 1.00 0.00 O ATOM 867 CB THR A 55 -4.018 19.659 -1.614 1.00 0.00 C ATOM 868 OG1 THR A 55 -4.739 18.449 -1.755 1.00 0.00 O ATOM 869 CG2 THR A 55 -3.109 19.796 -2.815 1.00 0.00 C ATOM 0 H THR A 55 -3.117 17.614 -0.035 1.00 0.00 H new ATOM 0 HA THR A 55 -2.553 20.513 -0.299 1.00 0.00 H new ATOM 0 HB THR A 55 -4.690 20.517 -1.588 1.00 0.00 H new ATOM 0 HG1 THR A 55 -5.698 18.627 -1.660 1.00 0.00 H new ATOM 0 HG21 THR A 55 -3.705 19.765 -3.727 1.00 0.00 H new ATOM 0 HG22 THR A 55 -2.576 20.745 -2.761 1.00 0.00 H new ATOM 0 HG23 THR A 55 -2.391 18.976 -2.823 1.00 0.00 H new ATOM 877 N TYR A 56 -5.011 18.883 1.211 1.00 0.00 N ATOM 878 CA TYR A 56 -5.985 18.969 2.300 1.00 0.00 C ATOM 879 C TYR A 56 -5.826 17.798 3.267 1.00 0.00 C ATOM 880 O TYR A 56 -6.529 16.795 3.153 1.00 0.00 O ATOM 881 CB TYR A 56 -7.416 18.987 1.742 1.00 0.00 C ATOM 882 CG TYR A 56 -7.501 19.338 0.273 1.00 0.00 C ATOM 883 CD1 TYR A 56 -7.372 20.654 -0.151 1.00 0.00 C ATOM 884 CD2 TYR A 56 -7.706 18.355 -0.689 1.00 0.00 C ATOM 885 CE1 TYR A 56 -7.445 20.984 -1.492 1.00 0.00 C ATOM 886 CE2 TYR A 56 -7.779 18.677 -2.031 1.00 0.00 C ATOM 887 CZ TYR A 56 -7.647 19.992 -2.427 1.00 0.00 C ATOM 888 OH TYR A 56 -7.719 20.314 -3.763 1.00 0.00 O ATOM 0 H TYR A 56 -4.972 17.973 0.752 1.00 0.00 H new ATOM 0 HA TYR A 56 -5.800 19.897 2.841 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -7.868 18.007 1.897 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -8.008 19.704 2.311 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -7.212 21.433 0.579 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -7.810 17.325 -0.383 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -7.344 22.013 -1.805 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -7.939 17.903 -2.767 1.00 0.00 H new ATOM 0 HH TYR A 56 -7.863 19.499 -4.288 1.00 0.00 H new ATOM 898 N ASP A 57 -4.902 17.921 4.213 1.00 0.00 N ATOM 899 CA ASP A 57 -4.671 16.855 5.185 1.00 0.00 C ATOM 900 C ASP A 57 -5.712 16.857 6.310 1.00 0.00 C ATOM 901 O ASP A 57 -6.098 15.801 6.809 1.00 0.00 O ATOM 902 CB ASP A 57 -3.269 16.984 5.781 1.00 0.00 C ATOM 903 CG ASP A 57 -2.993 18.377 6.312 1.00 0.00 C ATOM 904 OD1 ASP A 57 -3.404 18.670 7.454 1.00 0.00 O ATOM 905 OD2 ASP A 57 -2.366 19.176 5.585 1.00 0.00 O ATOM 0 H ASP A 57 -4.305 18.740 4.329 1.00 0.00 H new ATOM 0 HA ASP A 57 -4.764 15.908 4.653 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -3.152 16.261 6.588 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -2.529 16.735 5.020 1.00 0.00 H new ATOM 910 N LYS A 58 -6.134 18.047 6.727 1.00 0.00 N ATOM 911 CA LYS A 58 -7.099 18.185 7.821 1.00 0.00 C ATOM 912 C LYS A 58 -8.548 17.941 7.386 1.00 0.00 C ATOM 913 O LYS A 58 -9.291 17.223 8.052 1.00 0.00 O ATOM 914 CB LYS A 58 -6.977 19.576 8.449 1.00 0.00 C ATOM 915 CG LYS A 58 -6.561 19.548 9.910 1.00 0.00 C ATOM 916 CD LYS A 58 -5.107 19.135 10.068 1.00 0.00 C ATOM 917 CE LYS A 58 -4.900 18.286 11.312 1.00 0.00 C ATOM 918 NZ LYS A 58 -5.416 16.901 11.132 1.00 0.00 N ATOM 0 H LYS A 58 -5.825 18.932 6.326 1.00 0.00 H new ATOM 0 HA LYS A 58 -6.855 17.414 8.551 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -6.250 20.158 7.884 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -7.934 20.090 8.362 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -6.710 20.534 10.351 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -7.199 18.854 10.458 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -4.789 18.576 9.188 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -4.479 20.024 10.125 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -3.838 18.249 11.553 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -5.403 18.754 12.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -4.924 16.259 11.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -6.437 16.882 11.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -5.249 16.593 10.153 1.00 0.00 H new ATOM 932 N THR A 59 -8.952 18.579 6.295 1.00 0.00 N ATOM 933 CA THR A 59 -10.325 18.473 5.797 1.00 0.00 C ATOM 934 C THR A 59 -10.848 17.033 5.761 1.00 0.00 C ATOM 935 O THR A 59 -11.895 16.736 6.340 1.00 0.00 O ATOM 936 CB THR A 59 -10.434 19.098 4.404 1.00 0.00 C ATOM 937 OG1 THR A 59 -9.322 19.936 4.141 1.00 0.00 O ATOM 938 CG2 THR A 59 -11.688 19.927 4.221 1.00 0.00 C ATOM 0 H THR A 59 -8.348 19.179 5.733 1.00 0.00 H new ATOM 0 HA THR A 59 -10.950 19.019 6.503 1.00 0.00 H new ATOM 0 HB THR A 59 -10.466 18.258 3.710 1.00 0.00 H new ATOM 0 HG1 THR A 59 -9.571 20.610 3.474 1.00 0.00 H new ATOM 0 HG21 THR A 59 -11.706 20.342 3.213 1.00 0.00 H new ATOM 0 HG22 THR A 59 -12.565 19.297 4.370 1.00 0.00 H new ATOM 0 HG23 THR A 59 -11.697 20.739 4.948 1.00 0.00 H new ATOM 946 N PRO A 60 -10.154 16.124 5.059 1.00 0.00 N ATOM 947 CA PRO A 60 -10.588 14.724 4.932 1.00 0.00 C ATOM 948 C PRO A 60 -10.401 13.893 6.201 1.00 0.00 C ATOM 949 O PRO A 60 -11.265 13.091 6.555 1.00 0.00 O ATOM 950 CB PRO A 60 -9.692 14.186 3.816 1.00 0.00 C ATOM 951 CG PRO A 60 -8.458 15.013 3.899 1.00 0.00 C ATOM 952 CD PRO A 60 -8.911 16.387 4.310 1.00 0.00 C ATOM 0 HA PRO A 60 -11.658 14.664 4.733 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -9.471 13.128 3.959 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -10.170 14.283 2.841 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -7.758 14.599 4.625 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -7.942 15.042 2.939 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -8.167 16.888 4.929 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -9.090 17.027 3.446 1.00 0.00 H new ATOM 960 N LEU A 61 -9.264 14.063 6.864 1.00 0.00 N ATOM 961 CA LEU A 61 -8.965 13.296 8.070 1.00 0.00 C ATOM 962 C LEU A 61 -9.820 13.721 9.260 1.00 0.00 C ATOM 963 O LEU A 61 -10.341 12.879 9.988 1.00 0.00 O ATOM 964 CB LEU A 61 -7.486 13.432 8.422 1.00 0.00 C ATOM 965 CG LEU A 61 -6.518 12.953 7.339 1.00 0.00 C ATOM 966 CD1 LEU A 61 -5.106 12.878 7.892 1.00 0.00 C ATOM 967 CD2 LEU A 61 -6.953 11.601 6.792 1.00 0.00 C ATOM 0 H LEU A 61 -8.535 14.722 6.590 1.00 0.00 H new ATOM 0 HA LEU A 61 -9.203 12.254 7.855 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -7.275 14.479 8.640 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -7.292 12.870 9.336 1.00 0.00 H new ATOM 0 HG LEU A 61 -6.531 13.671 6.519 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -4.427 12.536 7.111 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -4.797 13.865 8.235 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -5.079 12.179 8.728 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -6.252 11.277 6.023 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -6.969 10.870 7.600 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -7.950 11.687 6.361 1.00 0.00 H new ATOM 979 N GLU A 62 -9.951 15.024 9.465 1.00 0.00 N ATOM 980 CA GLU A 62 -10.733 15.538 10.582 1.00 0.00 C ATOM 981 C GLU A 62 -12.193 15.107 10.485 1.00 0.00 C ATOM 982 O GLU A 62 -12.869 14.938 11.499 1.00 0.00 O ATOM 983 CB GLU A 62 -10.645 17.065 10.633 1.00 0.00 C ATOM 984 CG GLU A 62 -9.288 17.582 11.083 1.00 0.00 C ATOM 985 CD GLU A 62 -9.153 17.629 12.593 1.00 0.00 C ATOM 986 OE1 GLU A 62 -8.814 16.587 13.192 1.00 0.00 O ATOM 987 OE2 GLU A 62 -9.388 18.708 13.176 1.00 0.00 O ATOM 0 H GLU A 62 -9.529 15.742 8.876 1.00 0.00 H new ATOM 0 HA GLU A 62 -10.315 15.121 11.498 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -10.868 17.467 9.644 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -11.411 17.442 11.310 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.506 16.944 10.672 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.131 18.581 10.677 1.00 0.00 H new ATOM 994 N LYS A 63 -12.676 14.944 9.260 1.00 0.00 N ATOM 995 CA LYS A 63 -14.060 14.547 9.030 1.00 0.00 C ATOM 996 C LYS A 63 -14.262 13.039 9.177 1.00 0.00 C ATOM 997 O LYS A 63 -15.333 12.590 9.585 1.00 0.00 O ATOM 998 CB LYS A 63 -14.509 14.996 7.640 1.00 0.00 C ATOM 999 CG LYS A 63 -14.894 16.466 7.571 1.00 0.00 C ATOM 1000 CD LYS A 63 -14.968 16.955 6.134 1.00 0.00 C ATOM 1001 CE LYS A 63 -16.000 18.060 5.975 1.00 0.00 C ATOM 1002 NZ LYS A 63 -17.301 17.537 5.477 1.00 0.00 N ATOM 0 H LYS A 63 -12.130 15.081 8.409 1.00 0.00 H new ATOM 0 HA LYS A 63 -14.668 15.035 9.792 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -13.706 14.805 6.928 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -15.361 14.391 7.329 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -15.858 16.614 8.057 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -14.165 17.060 8.122 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -13.990 17.321 5.822 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -15.221 16.122 5.478 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -16.151 18.556 6.934 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -15.622 18.813 5.283 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -17.997 18.309 5.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -17.175 17.146 4.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -17.641 16.789 6.115 1.00 0.00 H new ATOM 1016 N ASP A 64 -13.247 12.256 8.822 1.00 0.00 N ATOM 1017 CA ASP A 64 -13.353 10.799 8.901 1.00 0.00 C ATOM 1018 C ASP A 64 -12.656 10.227 10.138 1.00 0.00 C ATOM 1019 O ASP A 64 -12.832 9.054 10.466 1.00 0.00 O ATOM 1020 CB ASP A 64 -12.775 10.161 7.637 1.00 0.00 C ATOM 1021 CG ASP A 64 -11.310 10.497 7.431 1.00 0.00 C ATOM 1022 OD1 ASP A 64 -10.577 10.609 8.437 1.00 0.00 O ATOM 1023 OD2 ASP A 64 -10.894 10.648 6.263 1.00 0.00 O ATOM 0 H ASP A 64 -12.350 12.600 8.480 1.00 0.00 H new ATOM 0 HA ASP A 64 -14.413 10.559 8.986 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -12.891 9.079 7.695 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -13.346 10.497 6.771 1.00 0.00 H new ATOM 1028 N GLY A 65 -11.874 11.053 10.824 1.00 0.00 N ATOM 1029 CA GLY A 65 -11.174 10.599 12.018 1.00 0.00 C ATOM 1030 C GLY A 65 -10.445 9.279 11.822 1.00 0.00 C ATOM 1031 O GLY A 65 -10.305 8.497 12.762 1.00 0.00 O ATOM 0 H GLY A 65 -11.710 12.029 10.577 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -10.456 11.361 12.322 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -11.890 10.493 12.833 1.00 0.00 H new ATOM 1035 N ILE A 66 -9.975 9.031 10.602 1.00 0.00 N ATOM 1036 CA ILE A 66 -9.252 7.799 10.291 1.00 0.00 C ATOM 1037 C ILE A 66 -7.745 8.023 10.342 1.00 0.00 C ATOM 1038 O ILE A 66 -7.259 9.104 10.009 1.00 0.00 O ATOM 1039 CB ILE A 66 -9.604 7.259 8.892 1.00 0.00 C ATOM 1040 CG1 ILE A 66 -11.090 7.443 8.590 1.00 0.00 C ATOM 1041 CG2 ILE A 66 -9.220 5.791 8.780 1.00 0.00 C ATOM 1042 CD1 ILE A 66 -11.430 7.206 7.136 1.00 0.00 C ATOM 0 H ILE A 66 -10.082 9.667 9.812 1.00 0.00 H new ATOM 0 HA ILE A 66 -9.554 7.072 11.044 1.00 0.00 H new ATOM 0 HB ILE A 66 -9.036 7.829 8.157 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -11.669 6.758 9.209 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -11.389 8.454 8.868 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -9.475 5.423 7.786 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -8.148 5.682 8.944 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -9.762 5.215 9.530 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -12.499 7.352 6.984 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -10.876 7.909 6.514 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -11.160 6.187 6.861 1.00 0.00 H new ATOM 1054 N THR A 67 -7.006 6.992 10.740 1.00 0.00 N ATOM 1055 CA THR A 67 -5.554 7.084 10.806 1.00 0.00 C ATOM 1056 C THR A 67 -4.975 6.939 9.405 1.00 0.00 C ATOM 1057 O THR A 67 -5.358 6.038 8.661 1.00 0.00 O ATOM 1058 CB THR A 67 -4.988 6.001 11.727 1.00 0.00 C ATOM 1059 OG1 THR A 67 -5.412 4.716 11.309 1.00 0.00 O ATOM 1060 CG2 THR A 67 -5.398 6.172 13.174 1.00 0.00 C ATOM 0 H THR A 67 -7.387 6.088 11.020 1.00 0.00 H new ATOM 0 HA THR A 67 -5.277 8.056 11.214 1.00 0.00 H new ATOM 0 HB THR A 67 -3.905 6.101 11.659 1.00 0.00 H new ATOM 0 HG1 THR A 67 -4.794 4.039 11.655 1.00 0.00 H new ATOM 0 HG21 THR A 67 -4.963 5.371 13.772 1.00 0.00 H new ATOM 0 HG22 THR A 67 -5.042 7.134 13.542 1.00 0.00 H new ATOM 0 HG23 THR A 67 -6.485 6.133 13.251 1.00 0.00 H new ATOM 1068 N VAL A 68 -4.079 7.844 9.032 1.00 0.00 N ATOM 1069 CA VAL A 68 -3.493 7.808 7.699 1.00 0.00 C ATOM 1070 C VAL A 68 -2.037 8.261 7.695 1.00 0.00 C ATOM 1071 O VAL A 68 -1.622 9.076 8.521 1.00 0.00 O ATOM 1072 CB VAL A 68 -4.301 8.701 6.734 1.00 0.00 C ATOM 1073 CG1 VAL A 68 -4.298 10.139 7.218 1.00 0.00 C ATOM 1074 CG2 VAL A 68 -3.766 8.614 5.312 1.00 0.00 C ATOM 0 H VAL A 68 -3.746 8.603 9.626 1.00 0.00 H new ATOM 0 HA VAL A 68 -3.526 6.770 7.368 1.00 0.00 H new ATOM 0 HB VAL A 68 -5.328 8.336 6.722 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -4.872 10.757 6.527 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -4.748 10.190 8.210 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -3.272 10.505 7.265 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.359 9.256 4.660 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -2.726 8.940 5.294 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -3.829 7.584 4.962 1.00 0.00 H new ATOM 1084 N VAL A 69 -1.280 7.748 6.733 1.00 0.00 N ATOM 1085 CA VAL A 69 0.118 8.107 6.572 1.00 0.00 C ATOM 1086 C VAL A 69 0.246 9.070 5.402 1.00 0.00 C ATOM 1087 O VAL A 69 -0.319 8.835 4.331 1.00 0.00 O ATOM 1088 CB VAL A 69 1.013 6.872 6.309 1.00 0.00 C ATOM 1089 CG1 VAL A 69 2.461 7.161 6.677 1.00 0.00 C ATOM 1090 CG2 VAL A 69 0.501 5.657 7.070 1.00 0.00 C ATOM 0 H VAL A 69 -1.619 7.074 6.046 1.00 0.00 H new ATOM 0 HA VAL A 69 0.454 8.569 7.500 1.00 0.00 H new ATOM 0 HB VAL A 69 0.970 6.650 5.243 1.00 0.00 H new ATOM 0 HG11 VAL A 69 3.069 6.277 6.483 1.00 0.00 H new ATOM 0 HG12 VAL A 69 2.829 7.994 6.078 1.00 0.00 H new ATOM 0 HG13 VAL A 69 2.523 7.419 7.734 1.00 0.00 H new ATOM 0 HG21 VAL A 69 1.147 4.803 6.868 1.00 0.00 H new ATOM 0 HG22 VAL A 69 0.504 5.870 8.139 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -0.515 5.428 6.748 1.00 0.00 H new ATOM 1100 N ASP A 70 0.977 10.157 5.605 1.00 0.00 N ATOM 1101 CA ASP A 70 1.155 11.148 4.555 1.00 0.00 C ATOM 1102 C ASP A 70 2.505 10.962 3.892 1.00 0.00 C ATOM 1103 O ASP A 70 3.547 11.259 4.475 1.00 0.00 O ATOM 1104 CB ASP A 70 1.036 12.562 5.126 1.00 0.00 C ATOM 1105 CG ASP A 70 -0.355 12.860 5.648 1.00 0.00 C ATOM 1106 OD1 ASP A 70 -1.330 12.638 4.899 1.00 0.00 O ATOM 1107 OD2 ASP A 70 -0.471 13.318 6.804 1.00 0.00 O ATOM 0 H ASP A 70 1.453 10.374 6.481 1.00 0.00 H new ATOM 0 HA ASP A 70 0.372 11.011 3.809 1.00 0.00 H new ATOM 0 HB2 ASP A 70 1.758 12.687 5.933 1.00 0.00 H new ATOM 0 HB3 ASP A 70 1.294 13.286 4.353 1.00 0.00 H new ATOM 1112 N TRP A 71 2.475 10.440 2.675 1.00 0.00 N ATOM 1113 CA TRP A 71 3.693 10.177 1.930 1.00 0.00 C ATOM 1114 C TRP A 71 3.826 11.102 0.721 1.00 0.00 C ATOM 1115 O TRP A 71 3.154 10.911 -0.290 1.00 0.00 O ATOM 1116 CB TRP A 71 3.662 8.735 1.442 1.00 0.00 C ATOM 1117 CG TRP A 71 4.339 7.752 2.339 1.00 0.00 C ATOM 1118 CD1 TRP A 71 4.134 7.547 3.676 1.00 0.00 C ATOM 1119 CD2 TRP A 71 5.331 6.817 1.937 1.00 0.00 C ATOM 1120 NE1 TRP A 71 4.950 6.534 4.124 1.00 0.00 N ATOM 1121 CE2 TRP A 71 5.694 6.073 3.071 1.00 0.00 C ATOM 1122 CE3 TRP A 71 5.949 6.541 0.717 1.00 0.00 C ATOM 1123 CZ2 TRP A 71 6.646 5.068 3.017 1.00 0.00 C ATOM 1124 CZ3 TRP A 71 6.895 5.544 0.666 1.00 0.00 C ATOM 1125 CH2 TRP A 71 7.234 4.818 1.808 1.00 0.00 C ATOM 0 H TRP A 71 1.617 10.190 2.183 1.00 0.00 H new ATOM 0 HA TRP A 71 4.543 10.354 2.589 1.00 0.00 H new ATOM 0 HB2 TRP A 71 2.623 8.432 1.315 1.00 0.00 H new ATOM 0 HB3 TRP A 71 4.130 8.690 0.459 1.00 0.00 H new ATOM 0 HD1 TRP A 71 3.436 8.098 4.288 1.00 0.00 H new ATOM 0 HE1 TRP A 71 4.994 6.185 5.081 1.00 0.00 H new ATOM 0 HE3 TRP A 71 5.690 7.099 -0.170 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 6.914 4.503 3.897 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 7.382 5.320 -0.271 1.00 0.00 H new ATOM 0 HH2 TRP A 71 7.979 4.039 1.735 1.00 0.00 H new ATOM 1136 N PRO A 72 4.691 12.120 0.805 1.00 0.00 N ATOM 1137 CA PRO A 72 4.914 13.071 -0.263 1.00 0.00 C ATOM 1138 C PRO A 72 6.256 12.858 -0.959 1.00 0.00 C ATOM 1139 O PRO A 72 7.264 13.446 -0.568 1.00 0.00 O ATOM 1140 CB PRO A 72 4.921 14.364 0.532 1.00 0.00 C ATOM 1141 CG PRO A 72 5.575 13.997 1.840 1.00 0.00 C ATOM 1142 CD PRO A 72 5.515 12.483 1.958 1.00 0.00 C ATOM 0 HA PRO A 72 4.183 13.016 -1.070 1.00 0.00 H new ATOM 0 HB2 PRO A 72 5.478 15.145 0.015 1.00 0.00 H new ATOM 0 HB3 PRO A 72 3.910 14.742 0.685 1.00 0.00 H new ATOM 0 HG2 PRO A 72 6.608 14.345 1.866 1.00 0.00 H new ATOM 0 HG3 PRO A 72 5.058 14.470 2.675 1.00 0.00 H new ATOM 0 HD2 PRO A 72 6.506 12.031 1.910 1.00 0.00 H new ATOM 0 HD3 PRO A 72 5.064 12.165 2.898 1.00 0.00 H new ATOM 1150 N PHE A 73 6.268 12.015 -1.986 1.00 0.00 N ATOM 1151 CA PHE A 73 7.497 11.731 -2.722 1.00 0.00 C ATOM 1152 C PHE A 73 7.727 12.765 -3.820 1.00 0.00 C ATOM 1153 O PHE A 73 7.189 12.646 -4.920 1.00 0.00 O ATOM 1154 CB PHE A 73 7.442 10.328 -3.331 1.00 0.00 C ATOM 1155 CG PHE A 73 8.757 9.603 -3.299 1.00 0.00 C ATOM 1156 CD1 PHE A 73 9.177 8.951 -2.152 1.00 0.00 C ATOM 1157 CD2 PHE A 73 9.572 9.573 -4.420 1.00 0.00 C ATOM 1158 CE1 PHE A 73 10.386 8.281 -2.122 1.00 0.00 C ATOM 1159 CE2 PHE A 73 10.781 8.906 -4.397 1.00 0.00 C ATOM 1160 CZ PHE A 73 11.189 8.259 -3.245 1.00 0.00 C ATOM 0 H PHE A 73 5.445 11.518 -2.327 1.00 0.00 H new ATOM 0 HA PHE A 73 8.329 11.782 -2.020 1.00 0.00 H new ATOM 0 HB2 PHE A 73 6.699 9.738 -2.795 1.00 0.00 H new ATOM 0 HB3 PHE A 73 7.104 10.403 -4.365 1.00 0.00 H new ATOM 0 HD1 PHE A 73 8.553 8.966 -1.271 1.00 0.00 H new ATOM 0 HD2 PHE A 73 9.258 10.077 -5.322 1.00 0.00 H new ATOM 0 HE1 PHE A 73 10.702 7.776 -1.221 1.00 0.00 H new ATOM 0 HE2 PHE A 73 11.407 8.890 -5.277 1.00 0.00 H new ATOM 0 HZ PHE A 73 12.134 7.737 -3.224 1.00 0.00 H new ATOM 1170 N ASP A 74 8.530 13.778 -3.511 1.00 0.00 N ATOM 1171 CA ASP A 74 8.834 14.833 -4.471 1.00 0.00 C ATOM 1172 C ASP A 74 10.277 14.720 -4.956 1.00 0.00 C ATOM 1173 O ASP A 74 10.930 13.696 -4.758 1.00 0.00 O ATOM 1174 CB ASP A 74 8.597 16.208 -3.841 1.00 0.00 C ATOM 1175 CG ASP A 74 7.274 16.286 -3.105 1.00 0.00 C ATOM 1176 OD1 ASP A 74 7.046 15.456 -2.200 1.00 0.00 O ATOM 1177 OD2 ASP A 74 6.464 17.179 -3.433 1.00 0.00 O ATOM 0 H ASP A 74 8.982 13.891 -2.603 1.00 0.00 H new ATOM 0 HA ASP A 74 8.171 14.718 -5.328 1.00 0.00 H new ATOM 0 HB2 ASP A 74 9.409 16.432 -3.149 1.00 0.00 H new ATOM 0 HB3 ASP A 74 8.622 16.971 -4.619 1.00 0.00 H new ATOM 1182 N ASP A 75 10.769 15.780 -5.592 1.00 0.00 N ATOM 1183 CA ASP A 75 12.136 15.798 -6.103 1.00 0.00 C ATOM 1184 C ASP A 75 13.141 15.489 -4.996 1.00 0.00 C ATOM 1185 O ASP A 75 14.247 15.018 -5.263 1.00 0.00 O ATOM 1186 CB ASP A 75 12.450 17.159 -6.726 1.00 0.00 C ATOM 1187 CG ASP A 75 13.356 17.046 -7.936 1.00 0.00 C ATOM 1188 OD1 ASP A 75 13.143 16.127 -8.755 1.00 0.00 O ATOM 1189 OD2 ASP A 75 14.281 17.877 -8.065 1.00 0.00 O ATOM 0 H ASP A 75 10.242 16.636 -5.765 1.00 0.00 H new ATOM 0 HA ASP A 75 12.220 15.025 -6.867 1.00 0.00 H new ATOM 0 HB2 ASP A 75 11.519 17.646 -7.017 1.00 0.00 H new ATOM 0 HB3 ASP A 75 12.923 17.797 -5.979 1.00 0.00 H new ATOM 1194 N GLY A 76 12.751 15.757 -3.752 1.00 0.00 N ATOM 1195 CA GLY A 76 13.633 15.501 -2.628 1.00 0.00 C ATOM 1196 C GLY A 76 13.100 14.420 -1.707 1.00 0.00 C ATOM 1197 O GLY A 76 13.214 14.525 -0.485 1.00 0.00 O ATOM 0 H GLY A 76 11.841 16.146 -3.504 1.00 0.00 H new ATOM 0 HA2 GLY A 76 14.614 15.206 -3.000 1.00 0.00 H new ATOM 0 HA3 GLY A 76 13.771 16.422 -2.061 1.00 0.00 H new ATOM 1201 N ALA A 77 12.519 13.378 -2.292 1.00 0.00 N ATOM 1202 CA ALA A 77 11.970 12.273 -1.515 1.00 0.00 C ATOM 1203 C ALA A 77 13.046 11.238 -1.199 1.00 0.00 C ATOM 1204 O ALA A 77 14.039 11.127 -1.917 1.00 0.00 O ATOM 1205 CB ALA A 77 10.816 11.624 -2.263 1.00 0.00 C ATOM 0 H ALA A 77 12.416 13.276 -3.302 1.00 0.00 H new ATOM 0 HA ALA A 77 11.598 12.673 -0.572 1.00 0.00 H new ATOM 0 HB1 ALA A 77 10.416 10.801 -1.671 1.00 0.00 H new ATOM 0 HB2 ALA A 77 10.032 12.362 -2.434 1.00 0.00 H new ATOM 0 HB3 ALA A 77 11.171 11.243 -3.221 1.00 0.00 H new ATOM 1211 N PRO A 78 12.864 10.465 -0.113 1.00 0.00 N ATOM 1212 CA PRO A 78 13.827 9.436 0.298 1.00 0.00 C ATOM 1213 C PRO A 78 13.844 8.236 -0.649 1.00 0.00 C ATOM 1214 O PRO A 78 12.891 7.458 -0.694 1.00 0.00 O ATOM 1215 CB PRO A 78 13.329 9.018 1.681 1.00 0.00 C ATOM 1216 CG PRO A 78 11.870 9.312 1.662 1.00 0.00 C ATOM 1217 CD PRO A 78 11.706 10.533 0.799 1.00 0.00 C ATOM 0 HA PRO A 78 14.850 9.813 0.292 1.00 0.00 H new ATOM 0 HB2 PRO A 78 13.517 7.961 1.867 1.00 0.00 H new ATOM 0 HB3 PRO A 78 13.835 9.575 2.469 1.00 0.00 H new ATOM 0 HG2 PRO A 78 11.307 8.470 1.258 1.00 0.00 H new ATOM 0 HG3 PRO A 78 11.495 9.493 2.669 1.00 0.00 H new ATOM 0 HD2 PRO A 78 10.763 10.515 0.253 1.00 0.00 H new ATOM 0 HD3 PRO A 78 11.714 11.448 1.391 1.00 0.00 H new ATOM 1225 N PRO A 79 14.931 8.075 -1.428 1.00 0.00 N ATOM 1226 CA PRO A 79 15.071 6.968 -2.385 1.00 0.00 C ATOM 1227 C PRO A 79 15.026 5.570 -1.748 1.00 0.00 C ATOM 1228 O PRO A 79 14.444 4.653 -2.325 1.00 0.00 O ATOM 1229 CB PRO A 79 16.446 7.209 -3.020 1.00 0.00 C ATOM 1230 CG PRO A 79 16.745 8.645 -2.769 1.00 0.00 C ATOM 1231 CD PRO A 79 16.109 8.964 -1.449 1.00 0.00 C ATOM 0 HA PRO A 79 14.238 6.967 -3.088 1.00 0.00 H new ATOM 0 HB2 PRO A 79 17.204 6.565 -2.574 1.00 0.00 H new ATOM 0 HB3 PRO A 79 16.430 6.991 -4.088 1.00 0.00 H new ATOM 0 HG2 PRO A 79 17.820 8.822 -2.739 1.00 0.00 H new ATOM 0 HG3 PRO A 79 16.340 9.274 -3.562 1.00 0.00 H new ATOM 0 HD2 PRO A 79 16.783 8.762 -0.616 1.00 0.00 H new ATOM 0 HD3 PRO A 79 15.824 10.014 -1.381 1.00 0.00 H new ATOM 1239 N PRO A 80 15.657 5.364 -0.570 1.00 0.00 N ATOM 1240 CA PRO A 80 15.682 4.046 0.078 1.00 0.00 C ATOM 1241 C PRO A 80 14.293 3.485 0.373 1.00 0.00 C ATOM 1242 O PRO A 80 13.371 4.217 0.733 1.00 0.00 O ATOM 1243 CB PRO A 80 16.456 4.278 1.382 1.00 0.00 C ATOM 1244 CG PRO A 80 16.486 5.755 1.575 1.00 0.00 C ATOM 1245 CD PRO A 80 16.412 6.364 0.204 1.00 0.00 C ATOM 0 HA PRO A 80 16.141 3.305 -0.577 1.00 0.00 H new ATOM 0 HB2 PRO A 80 15.967 3.783 2.221 1.00 0.00 H new ATOM 0 HB3 PRO A 80 17.465 3.871 1.316 1.00 0.00 H new ATOM 0 HG2 PRO A 80 15.649 6.083 2.191 1.00 0.00 H new ATOM 0 HG3 PRO A 80 17.398 6.061 2.087 1.00 0.00 H new ATOM 0 HD2 PRO A 80 15.904 7.328 0.219 1.00 0.00 H new ATOM 0 HD3 PRO A 80 17.404 6.532 -0.216 1.00 0.00 H new ATOM 1253 N GLY A 81 14.169 2.170 0.217 1.00 0.00 N ATOM 1254 CA GLY A 81 12.915 1.481 0.465 1.00 0.00 C ATOM 1255 C GLY A 81 12.497 1.516 1.921 1.00 0.00 C ATOM 1256 O GLY A 81 11.327 1.281 2.241 1.00 0.00 O ATOM 0 H GLY A 81 14.930 1.560 -0.082 1.00 0.00 H new ATOM 0 HA2 GLY A 81 12.132 1.934 -0.143 1.00 0.00 H new ATOM 0 HA3 GLY A 81 13.008 0.443 0.144 1.00 0.00 H new ATOM 1260 N LYS A 82 13.459 1.774 2.807 1.00 0.00 N ATOM 1261 CA LYS A 82 13.194 1.798 4.242 1.00 0.00 C ATOM 1262 C LYS A 82 11.999 2.686 4.555 1.00 0.00 C ATOM 1263 O LYS A 82 11.262 2.431 5.508 1.00 0.00 O ATOM 1264 CB LYS A 82 14.423 2.301 5.001 1.00 0.00 C ATOM 1265 CG LYS A 82 14.789 1.447 6.203 1.00 0.00 C ATOM 1266 CD LYS A 82 15.715 2.187 7.158 1.00 0.00 C ATOM 1267 CE LYS A 82 16.987 1.400 7.427 1.00 0.00 C ATOM 1268 NZ LYS A 82 17.761 1.151 6.179 1.00 0.00 N ATOM 0 H LYS A 82 14.428 1.969 2.554 1.00 0.00 H new ATOM 0 HA LYS A 82 12.967 0.781 4.561 1.00 0.00 H new ATOM 0 HB2 LYS A 82 15.272 2.335 4.318 1.00 0.00 H new ATOM 0 HB3 LYS A 82 14.241 3.323 5.334 1.00 0.00 H new ATOM 0 HG2 LYS A 82 13.882 1.153 6.731 1.00 0.00 H new ATOM 0 HG3 LYS A 82 15.272 0.530 5.865 1.00 0.00 H new ATOM 0 HD2 LYS A 82 15.970 3.160 6.737 1.00 0.00 H new ATOM 0 HD3 LYS A 82 15.196 2.373 8.098 1.00 0.00 H new ATOM 0 HE2 LYS A 82 17.608 1.946 8.137 1.00 0.00 H new ATOM 0 HE3 LYS A 82 16.733 0.448 7.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 18.771 1.062 6.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 17.428 0.272 5.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 17.625 1.945 5.522 1.00 0.00 H new ATOM 1282 N VAL A 83 11.776 3.706 3.735 1.00 0.00 N ATOM 1283 CA VAL A 83 10.627 4.571 3.937 1.00 0.00 C ATOM 1284 C VAL A 83 9.370 3.710 3.923 1.00 0.00 C ATOM 1285 O VAL A 83 8.528 3.781 4.824 1.00 0.00 O ATOM 1286 CB VAL A 83 10.522 5.654 2.847 1.00 0.00 C ATOM 1287 CG1 VAL A 83 9.376 6.609 3.148 1.00 0.00 C ATOM 1288 CG2 VAL A 83 11.835 6.409 2.717 1.00 0.00 C ATOM 0 H VAL A 83 12.365 3.949 2.939 1.00 0.00 H new ATOM 0 HA VAL A 83 10.741 5.082 4.893 1.00 0.00 H new ATOM 0 HB VAL A 83 10.314 5.165 1.895 1.00 0.00 H new ATOM 0 HG11 VAL A 83 9.319 7.366 2.366 1.00 0.00 H new ATOM 0 HG12 VAL A 83 8.439 6.053 3.184 1.00 0.00 H new ATOM 0 HG13 VAL A 83 9.548 7.092 4.110 1.00 0.00 H new ATOM 0 HG21 VAL A 83 11.742 7.170 1.942 1.00 0.00 H new ATOM 0 HG22 VAL A 83 12.076 6.886 3.667 1.00 0.00 H new ATOM 0 HG23 VAL A 83 12.630 5.713 2.448 1.00 0.00 H new ATOM 1298 N VAL A 84 9.286 2.853 2.906 1.00 0.00 N ATOM 1299 CA VAL A 84 8.171 1.929 2.773 1.00 0.00 C ATOM 1300 C VAL A 84 8.057 1.107 4.043 1.00 0.00 C ATOM 1301 O VAL A 84 6.960 0.825 4.524 1.00 0.00 O ATOM 1302 CB VAL A 84 8.361 0.998 1.557 1.00 0.00 C ATOM 1303 CG1 VAL A 84 7.252 -0.041 1.487 1.00 0.00 C ATOM 1304 CG2 VAL A 84 8.419 1.812 0.274 1.00 0.00 C ATOM 0 H VAL A 84 9.981 2.783 2.163 1.00 0.00 H new ATOM 0 HA VAL A 84 7.257 2.501 2.615 1.00 0.00 H new ATOM 0 HB VAL A 84 9.307 0.469 1.675 1.00 0.00 H new ATOM 0 HG11 VAL A 84 7.410 -0.684 0.621 1.00 0.00 H new ATOM 0 HG12 VAL A 84 7.262 -0.645 2.394 1.00 0.00 H new ATOM 0 HG13 VAL A 84 6.289 0.461 1.395 1.00 0.00 H new ATOM 0 HG21 VAL A 84 8.553 1.143 -0.576 1.00 0.00 H new ATOM 0 HG22 VAL A 84 7.490 2.369 0.154 1.00 0.00 H new ATOM 0 HG23 VAL A 84 9.256 2.509 0.323 1.00 0.00 H new ATOM 1314 N GLU A 85 9.212 0.761 4.601 1.00 0.00 N ATOM 1315 CA GLU A 85 9.253 0.009 5.844 1.00 0.00 C ATOM 1316 C GLU A 85 8.564 0.812 6.947 1.00 0.00 C ATOM 1317 O GLU A 85 7.958 0.247 7.856 1.00 0.00 O ATOM 1318 CB GLU A 85 10.699 -0.319 6.233 1.00 0.00 C ATOM 1319 CG GLU A 85 11.088 -1.766 5.964 1.00 0.00 C ATOM 1320 CD GLU A 85 12.455 -1.896 5.318 1.00 0.00 C ATOM 1321 OE1 GLU A 85 13.357 -1.110 5.677 1.00 0.00 O ATOM 1322 OE2 GLU A 85 12.625 -2.786 4.456 1.00 0.00 O ATOM 0 H GLU A 85 10.127 0.989 4.212 1.00 0.00 H new ATOM 0 HA GLU A 85 8.724 -0.934 5.707 1.00 0.00 H new ATOM 0 HB2 GLU A 85 11.373 0.338 5.683 1.00 0.00 H new ATOM 0 HB3 GLU A 85 10.839 -0.105 7.292 1.00 0.00 H new ATOM 0 HG2 GLU A 85 11.080 -2.320 6.903 1.00 0.00 H new ATOM 0 HG3 GLU A 85 10.340 -2.224 5.317 1.00 0.00 H new ATOM 1329 N ASP A 86 8.649 2.143 6.848 1.00 0.00 N ATOM 1330 CA ASP A 86 8.017 3.024 7.825 1.00 0.00 C ATOM 1331 C ASP A 86 6.504 2.857 7.784 1.00 0.00 C ATOM 1332 O ASP A 86 5.862 2.638 8.814 1.00 0.00 O ATOM 1333 CB ASP A 86 8.390 4.483 7.554 1.00 0.00 C ATOM 1334 CG ASP A 86 9.880 4.674 7.341 1.00 0.00 C ATOM 1335 OD1 ASP A 86 10.639 3.704 7.551 1.00 0.00 O ATOM 1336 OD2 ASP A 86 10.287 5.793 6.965 1.00 0.00 O ATOM 0 H ASP A 86 9.148 2.629 6.103 1.00 0.00 H new ATOM 0 HA ASP A 86 8.377 2.751 8.817 1.00 0.00 H new ATOM 0 HB2 ASP A 86 7.853 4.834 6.673 1.00 0.00 H new ATOM 0 HB3 ASP A 86 8.065 5.099 8.392 1.00 0.00 H new ATOM 1341 N TRP A 87 5.938 2.931 6.584 1.00 0.00 N ATOM 1342 CA TRP A 87 4.499 2.755 6.427 1.00 0.00 C ATOM 1343 C TRP A 87 4.117 1.317 6.773 1.00 0.00 C ATOM 1344 O TRP A 87 2.999 1.047 7.211 1.00 0.00 O ATOM 1345 CB TRP A 87 4.057 3.123 5.001 1.00 0.00 C ATOM 1346 CG TRP A 87 3.277 2.055 4.289 1.00 0.00 C ATOM 1347 CD1 TRP A 87 3.761 1.173 3.368 1.00 0.00 C ATOM 1348 CD2 TRP A 87 1.879 1.759 4.431 1.00 0.00 C ATOM 1349 NE1 TRP A 87 2.756 0.352 2.926 1.00 0.00 N ATOM 1350 CE2 TRP A 87 1.589 0.691 3.561 1.00 0.00 C ATOM 1351 CE3 TRP A 87 0.842 2.292 5.207 1.00 0.00 C ATOM 1352 CZ2 TRP A 87 0.310 0.149 3.442 1.00 0.00 C ATOM 1353 CZ3 TRP A 87 -0.429 1.750 5.090 1.00 0.00 C ATOM 1354 CH2 TRP A 87 -0.685 0.688 4.211 1.00 0.00 C ATOM 0 H TRP A 87 6.445 3.109 5.717 1.00 0.00 H new ATOM 0 HA TRP A 87 3.980 3.426 7.112 1.00 0.00 H new ATOM 0 HB2 TRP A 87 3.451 4.028 5.046 1.00 0.00 H new ATOM 0 HB3 TRP A 87 4.942 3.361 4.411 1.00 0.00 H new ATOM 0 HD1 TRP A 87 4.787 1.128 3.035 1.00 0.00 H new ATOM 0 HE1 TRP A 87 2.860 -0.392 2.236 1.00 0.00 H new ATOM 0 HE3 TRP A 87 1.029 3.111 5.885 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 0.111 -0.669 2.765 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 -1.235 2.152 5.686 1.00 0.00 H new ATOM 0 HH2 TRP A 87 -1.686 0.288 4.140 1.00 0.00 H new ATOM 1365 N LEU A 88 5.066 0.401 6.586 1.00 0.00 N ATOM 1366 CA LEU A 88 4.842 -1.005 6.893 1.00 0.00 C ATOM 1367 C LEU A 88 4.613 -1.184 8.387 1.00 0.00 C ATOM 1368 O LEU A 88 3.779 -1.986 8.807 1.00 0.00 O ATOM 1369 CB LEU A 88 6.036 -1.846 6.441 1.00 0.00 C ATOM 1370 CG LEU A 88 6.085 -2.147 4.943 1.00 0.00 C ATOM 1371 CD1 LEU A 88 7.438 -2.726 4.560 1.00 0.00 C ATOM 1372 CD2 LEU A 88 4.965 -3.100 4.558 1.00 0.00 C ATOM 0 H LEU A 88 5.996 0.610 6.223 1.00 0.00 H new ATOM 0 HA LEU A 88 3.955 -1.342 6.356 1.00 0.00 H new ATOM 0 HB2 LEU A 88 6.953 -1.328 6.722 1.00 0.00 H new ATOM 0 HB3 LEU A 88 6.023 -2.790 6.986 1.00 0.00 H new ATOM 0 HG LEU A 88 5.946 -1.214 4.397 1.00 0.00 H new ATOM 0 HD11 LEU A 88 7.455 -2.934 3.490 1.00 0.00 H new ATOM 0 HD12 LEU A 88 8.222 -2.009 4.803 1.00 0.00 H new ATOM 0 HD13 LEU A 88 7.608 -3.650 5.112 1.00 0.00 H new ATOM 0 HD21 LEU A 88 5.013 -3.305 3.488 1.00 0.00 H new ATOM 0 HD22 LEU A 88 5.075 -4.033 5.111 1.00 0.00 H new ATOM 0 HD23 LEU A 88 4.003 -2.647 4.798 1.00 0.00 H new ATOM 1384 N SER A 89 5.353 -0.421 9.184 1.00 0.00 N ATOM 1385 CA SER A 89 5.220 -0.482 10.632 1.00 0.00 C ATOM 1386 C SER A 89 3.874 0.093 11.051 1.00 0.00 C ATOM 1387 O SER A 89 3.196 -0.451 11.923 1.00 0.00 O ATOM 1388 CB SER A 89 6.355 0.289 11.307 1.00 0.00 C ATOM 1389 OG SER A 89 7.436 -0.569 11.628 1.00 0.00 O ATOM 0 H SER A 89 6.050 0.245 8.851 1.00 0.00 H new ATOM 0 HA SER A 89 5.277 -1.524 10.946 1.00 0.00 H new ATOM 0 HB2 SER A 89 6.702 1.084 10.647 1.00 0.00 H new ATOM 0 HB3 SER A 89 5.985 0.767 12.214 1.00 0.00 H new ATOM 0 HG SER A 89 8.149 -0.051 12.057 1.00 0.00 H new ATOM 1395 N LEU A 90 3.490 1.193 10.410 1.00 0.00 N ATOM 1396 CA LEU A 90 2.217 1.842 10.698 1.00 0.00 C ATOM 1397 C LEU A 90 1.060 0.880 10.442 1.00 0.00 C ATOM 1398 O LEU A 90 0.197 0.677 11.300 1.00 0.00 O ATOM 1399 CB LEU A 90 2.063 3.092 9.826 1.00 0.00 C ATOM 1400 CG LEU A 90 1.070 4.138 10.340 1.00 0.00 C ATOM 1401 CD1 LEU A 90 -0.359 3.660 10.146 1.00 0.00 C ATOM 1402 CD2 LEU A 90 1.337 4.460 11.802 1.00 0.00 C ATOM 0 H LEU A 90 4.043 1.653 9.687 1.00 0.00 H new ATOM 0 HA LEU A 90 2.200 2.134 11.748 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.040 3.564 9.723 1.00 0.00 H new ATOM 0 HB3 LEU A 90 1.752 2.781 8.828 1.00 0.00 H new ATOM 0 HG LEU A 90 1.205 5.052 9.761 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -1.050 4.417 10.517 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -0.545 3.489 9.086 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -0.510 2.731 10.696 1.00 0.00 H new ATOM 0 HD21 LEU A 90 0.620 5.205 12.147 1.00 0.00 H new ATOM 0 HD22 LEU A 90 1.234 3.554 12.399 1.00 0.00 H new ATOM 0 HD23 LEU A 90 2.348 4.852 11.909 1.00 0.00 H new ATOM 1414 N VAL A 91 1.056 0.279 9.256 1.00 0.00 N ATOM 1415 CA VAL A 91 0.018 -0.670 8.880 1.00 0.00 C ATOM 1416 C VAL A 91 0.174 -1.980 9.647 1.00 0.00 C ATOM 1417 O VAL A 91 -0.814 -2.614 10.018 1.00 0.00 O ATOM 1418 CB VAL A 91 0.041 -0.959 7.365 1.00 0.00 C ATOM 1419 CG1 VAL A 91 1.382 -1.543 6.950 1.00 0.00 C ATOM 1420 CG2 VAL A 91 -1.098 -1.892 6.978 1.00 0.00 C ATOM 0 H VAL A 91 1.763 0.434 8.538 1.00 0.00 H new ATOM 0 HA VAL A 91 -0.939 -0.216 9.135 1.00 0.00 H new ATOM 0 HB VAL A 91 -0.097 -0.016 6.835 1.00 0.00 H new ATOM 0 HG11 VAL A 91 1.377 -1.740 5.878 1.00 0.00 H new ATOM 0 HG12 VAL A 91 2.176 -0.834 7.185 1.00 0.00 H new ATOM 0 HG13 VAL A 91 1.556 -2.474 7.489 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -1.063 -2.083 5.905 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -0.996 -2.834 7.518 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -2.051 -1.428 7.234 1.00 0.00 H new ATOM 1430 N LYS A 92 1.421 -2.376 9.887 1.00 0.00 N ATOM 1431 CA LYS A 92 1.703 -3.608 10.618 1.00 0.00 C ATOM 1432 C LYS A 92 1.023 -3.587 11.982 1.00 0.00 C ATOM 1433 O LYS A 92 0.371 -4.554 12.378 1.00 0.00 O ATOM 1434 CB LYS A 92 3.211 -3.796 10.792 1.00 0.00 C ATOM 1435 CG LYS A 92 3.863 -4.574 9.660 1.00 0.00 C ATOM 1436 CD LYS A 92 4.271 -5.971 10.102 1.00 0.00 C ATOM 1437 CE LYS A 92 5.602 -6.382 9.492 1.00 0.00 C ATOM 1438 NZ LYS A 92 6.451 -7.127 10.463 1.00 0.00 N ATOM 0 H LYS A 92 2.250 -1.863 9.587 1.00 0.00 H new ATOM 0 HA LYS A 92 1.309 -4.444 10.040 1.00 0.00 H new ATOM 0 HB2 LYS A 92 3.684 -2.817 10.868 1.00 0.00 H new ATOM 0 HB3 LYS A 92 3.398 -4.314 11.732 1.00 0.00 H new ATOM 0 HG2 LYS A 92 3.171 -4.645 8.821 1.00 0.00 H new ATOM 0 HG3 LYS A 92 4.740 -4.034 9.305 1.00 0.00 H new ATOM 0 HD2 LYS A 92 4.342 -6.003 11.189 1.00 0.00 H new ATOM 0 HD3 LYS A 92 3.500 -6.685 9.812 1.00 0.00 H new ATOM 0 HE2 LYS A 92 5.423 -7.004 8.615 1.00 0.00 H new ATOM 0 HE3 LYS A 92 6.134 -5.494 9.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 7.349 -7.389 10.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 6.643 -6.525 11.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 5.954 -7.987 10.770 1.00 0.00 H new ATOM 1452 N ALA A 93 1.172 -2.474 12.692 1.00 0.00 N ATOM 1453 CA ALA A 93 0.565 -2.321 14.005 1.00 0.00 C ATOM 1454 C ALA A 93 -0.954 -2.300 13.895 1.00 0.00 C ATOM 1455 O ALA A 93 -1.652 -2.946 14.676 1.00 0.00 O ATOM 1456 CB ALA A 93 1.067 -1.050 14.676 1.00 0.00 C ATOM 0 H ALA A 93 1.709 -1.665 12.378 1.00 0.00 H new ATOM 0 HA ALA A 93 0.852 -3.175 14.618 1.00 0.00 H new ATOM 0 HB1 ALA A 93 0.604 -0.949 15.658 1.00 0.00 H new ATOM 0 HB2 ALA A 93 2.150 -1.102 14.789 1.00 0.00 H new ATOM 0 HB3 ALA A 93 0.807 -0.188 14.062 1.00 0.00 H new ATOM 1462 N LYS A 94 -1.459 -1.555 12.918 1.00 0.00 N ATOM 1463 CA LYS A 94 -2.898 -1.454 12.702 1.00 0.00 C ATOM 1464 C LYS A 94 -3.475 -2.782 12.216 1.00 0.00 C ATOM 1465 O LYS A 94 -4.664 -3.052 12.392 1.00 0.00 O ATOM 1466 CB LYS A 94 -3.206 -0.347 11.690 1.00 0.00 C ATOM 1467 CG LYS A 94 -3.616 0.967 12.333 1.00 0.00 C ATOM 1468 CD LYS A 94 -5.128 1.089 12.441 1.00 0.00 C ATOM 1469 CE LYS A 94 -5.554 1.556 13.824 1.00 0.00 C ATOM 1470 NZ LYS A 94 -5.443 3.034 13.969 1.00 0.00 N ATOM 0 H LYS A 94 -0.895 -1.013 12.264 1.00 0.00 H new ATOM 0 HA LYS A 94 -3.365 -1.207 13.655 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -2.326 -0.179 11.069 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -4.004 -0.683 11.028 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -3.172 1.041 13.326 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -3.224 1.798 11.746 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -5.491 1.792 11.691 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -5.588 0.125 12.224 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -6.583 1.249 14.010 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -4.935 1.070 14.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -5.868 3.327 14.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -4.440 3.310 13.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -5.943 3.498 13.184 1.00 0.00 H new ATOM 1484 N PHE A 95 -2.631 -3.608 11.602 1.00 0.00 N ATOM 1485 CA PHE A 95 -3.066 -4.904 11.089 1.00 0.00 C ATOM 1486 C PHE A 95 -3.095 -5.953 12.196 1.00 0.00 C ATOM 1487 O PHE A 95 -4.103 -6.633 12.390 1.00 0.00 O ATOM 1488 CB PHE A 95 -2.146 -5.361 9.957 1.00 0.00 C ATOM 1489 CG PHE A 95 -2.679 -5.035 8.591 1.00 0.00 C ATOM 1490 CD1 PHE A 95 -3.142 -3.761 8.306 1.00 0.00 C ATOM 1491 CD2 PHE A 95 -2.719 -5.998 7.596 1.00 0.00 C ATOM 1492 CE1 PHE A 95 -3.637 -3.454 7.054 1.00 0.00 C ATOM 1493 CE2 PHE A 95 -3.212 -5.695 6.341 1.00 0.00 C ATOM 1494 CZ PHE A 95 -3.672 -4.421 6.071 1.00 0.00 C ATOM 0 H PHE A 95 -1.644 -3.403 11.448 1.00 0.00 H new ATOM 0 HA PHE A 95 -4.079 -4.790 10.702 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -1.170 -4.892 10.080 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -1.995 -6.438 10.033 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -3.116 -2.999 9.071 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -2.361 -6.996 7.803 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -3.997 -2.457 6.845 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -3.238 -6.453 5.572 1.00 0.00 H new ATOM 0 HZ PHE A 95 -4.059 -4.182 5.091 1.00 0.00 H new ATOM 1504 N CYS A 96 -1.987 -6.081 12.916 1.00 0.00 N ATOM 1505 CA CYS A 96 -1.891 -7.051 14.001 1.00 0.00 C ATOM 1506 C CYS A 96 -2.875 -6.721 15.117 1.00 0.00 C ATOM 1507 O CYS A 96 -3.492 -7.614 15.699 1.00 0.00 O ATOM 1508 CB CYS A 96 -0.465 -7.087 14.555 1.00 0.00 C ATOM 1509 SG CYS A 96 -0.149 -8.460 15.690 1.00 0.00 S ATOM 0 H CYS A 96 -1.144 -5.527 12.769 1.00 0.00 H new ATOM 0 HA CYS A 96 -2.143 -8.033 13.600 1.00 0.00 H new ATOM 0 HB2 CYS A 96 0.236 -7.149 13.722 1.00 0.00 H new ATOM 0 HB3 CYS A 96 -0.263 -6.149 15.072 1.00 0.00 H new ATOM 0 HG CYS A 96 1.082 -8.407 16.103 1.00 0.00 H new ATOM 1515 N GLU A 97 -3.015 -5.434 15.415 1.00 0.00 N ATOM 1516 CA GLU A 97 -3.921 -4.985 16.466 1.00 0.00 C ATOM 1517 C GLU A 97 -5.374 -5.036 16.002 1.00 0.00 C ATOM 1518 O GLU A 97 -6.282 -5.264 16.802 1.00 0.00 O ATOM 1519 CB GLU A 97 -3.564 -3.563 16.903 1.00 0.00 C ATOM 1520 CG GLU A 97 -4.066 -3.211 18.294 1.00 0.00 C ATOM 1521 CD GLU A 97 -2.947 -3.129 19.314 1.00 0.00 C ATOM 1522 OE1 GLU A 97 -2.588 -4.179 19.887 1.00 0.00 O ATOM 1523 OE2 GLU A 97 -2.429 -2.015 19.539 1.00 0.00 O ATOM 0 H GLU A 97 -2.512 -4.682 14.943 1.00 0.00 H new ATOM 0 HA GLU A 97 -3.809 -5.660 17.314 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -2.481 -3.444 16.876 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -3.980 -2.856 16.186 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -4.589 -2.256 18.256 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -4.791 -3.959 18.615 1.00 0.00 H new ATOM 1530 N ALA A 98 -5.591 -4.816 14.709 1.00 0.00 N ATOM 1531 CA ALA A 98 -6.937 -4.833 14.147 1.00 0.00 C ATOM 1532 C ALA A 98 -7.051 -5.830 12.997 1.00 0.00 C ATOM 1533 O ALA A 98 -6.840 -5.478 11.837 1.00 0.00 O ATOM 1534 CB ALA A 98 -7.328 -3.440 13.678 1.00 0.00 C ATOM 0 H ALA A 98 -4.853 -4.624 14.032 1.00 0.00 H new ATOM 0 HA ALA A 98 -7.623 -5.151 14.932 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -8.335 -3.466 13.261 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -7.303 -2.751 14.523 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -6.627 -3.103 12.914 1.00 0.00 H new ATOM 1540 N PRO A 99 -7.391 -7.095 13.305 1.00 0.00 N ATOM 1541 CA PRO A 99 -7.534 -8.142 12.292 1.00 0.00 C ATOM 1542 C PRO A 99 -8.852 -8.033 11.531 1.00 0.00 C ATOM 1543 O PRO A 99 -9.909 -7.830 12.129 1.00 0.00 O ATOM 1544 CB PRO A 99 -7.499 -9.425 13.118 1.00 0.00 C ATOM 1545 CG PRO A 99 -8.068 -9.035 14.439 1.00 0.00 C ATOM 1546 CD PRO A 99 -7.662 -7.601 14.665 1.00 0.00 C ATOM 0 HA PRO A 99 -6.760 -8.086 11.527 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -8.087 -10.214 12.650 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -6.482 -9.803 13.220 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -9.153 -9.137 14.441 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -7.686 -9.677 15.232 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -8.454 -7.033 15.153 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -6.780 -7.530 15.302 1.00 0.00 H new ATOM 1554 N GLY A 100 -8.784 -8.168 10.211 1.00 0.00 N ATOM 1555 CA GLY A 100 -9.981 -8.080 9.394 1.00 0.00 C ATOM 1556 C GLY A 100 -10.611 -6.702 9.436 1.00 0.00 C ATOM 1557 O GLY A 100 -11.823 -6.570 9.605 1.00 0.00 O ATOM 0 H GLY A 100 -7.922 -8.337 9.692 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -9.733 -8.331 8.363 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -10.706 -8.818 9.736 1.00 0.00 H new ATOM 1561 N SER A 101 -9.783 -5.671 9.289 1.00 0.00 N ATOM 1562 CA SER A 101 -10.262 -4.294 9.316 1.00 0.00 C ATOM 1563 C SER A 101 -10.383 -3.725 7.902 1.00 0.00 C ATOM 1564 O SER A 101 -10.165 -4.434 6.919 1.00 0.00 O ATOM 1565 CB SER A 101 -9.324 -3.433 10.161 1.00 0.00 C ATOM 1566 OG SER A 101 -9.980 -2.265 10.623 1.00 0.00 O ATOM 0 H SER A 101 -8.777 -5.764 9.150 1.00 0.00 H new ATOM 0 HA SER A 101 -11.255 -4.284 9.765 1.00 0.00 H new ATOM 0 HB2 SER A 101 -8.962 -4.011 11.011 1.00 0.00 H new ATOM 0 HB3 SER A 101 -8.451 -3.154 9.571 1.00 0.00 H new ATOM 0 HG SER A 101 -9.602 -1.479 10.176 1.00 0.00 H new ATOM 1572 N CYS A 102 -10.746 -2.446 7.805 1.00 0.00 N ATOM 1573 CA CYS A 102 -10.910 -1.791 6.508 1.00 0.00 C ATOM 1574 C CYS A 102 -9.843 -0.721 6.265 1.00 0.00 C ATOM 1575 O CYS A 102 -9.816 0.303 6.943 1.00 0.00 O ATOM 1576 CB CYS A 102 -12.299 -1.167 6.462 1.00 0.00 C ATOM 1577 SG CYS A 102 -13.565 -2.304 5.841 1.00 0.00 S ATOM 0 H CYS A 102 -10.932 -1.844 8.607 1.00 0.00 H new ATOM 0 HA CYS A 102 -10.794 -2.536 5.721 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -12.576 -0.835 7.463 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -12.272 -0.280 5.828 1.00 0.00 H new ATOM 0 HG CYS A 102 -14.406 -1.651 5.095 1.00 0.00 H new ATOM 1583 N VAL A 103 -8.981 -0.960 5.276 1.00 0.00 N ATOM 1584 CA VAL A 103 -7.904 -0.019 4.941 1.00 0.00 C ATOM 1585 C VAL A 103 -8.231 0.817 3.709 1.00 0.00 C ATOM 1586 O VAL A 103 -8.948 0.373 2.815 1.00 0.00 O ATOM 1587 CB VAL A 103 -6.568 -0.767 4.696 1.00 0.00 C ATOM 1588 CG1 VAL A 103 -5.546 0.127 3.991 1.00 0.00 C ATOM 1589 CG2 VAL A 103 -6.008 -1.293 6.009 1.00 0.00 C ATOM 0 H VAL A 103 -9.005 -1.796 4.692 1.00 0.00 H new ATOM 0 HA VAL A 103 -7.804 0.648 5.798 1.00 0.00 H new ATOM 0 HB VAL A 103 -6.773 -1.612 4.039 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -4.622 -0.430 3.835 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -5.944 0.445 3.028 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -5.343 1.003 4.607 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -5.070 -1.816 5.821 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.829 -0.459 6.688 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -6.723 -1.981 6.460 1.00 0.00 H new ATOM 1599 N ALA A 104 -7.673 2.027 3.667 1.00 0.00 N ATOM 1600 CA ALA A 104 -7.876 2.928 2.534 1.00 0.00 C ATOM 1601 C ALA A 104 -6.530 3.305 1.913 1.00 0.00 C ATOM 1602 O ALA A 104 -5.539 3.469 2.621 1.00 0.00 O ATOM 1603 CB ALA A 104 -8.653 4.165 2.968 1.00 0.00 C ATOM 0 H ALA A 104 -7.078 2.405 4.404 1.00 0.00 H new ATOM 0 HA ALA A 104 -8.467 2.415 1.775 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -8.795 4.825 2.112 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -9.625 3.865 3.360 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -8.096 4.691 3.743 1.00 0.00 H new ATOM 1609 N VAL A 105 -6.485 3.403 0.587 1.00 0.00 N ATOM 1610 CA VAL A 105 -5.236 3.719 -0.111 1.00 0.00 C ATOM 1611 C VAL A 105 -5.458 4.671 -1.290 1.00 0.00 C ATOM 1612 O VAL A 105 -6.588 4.893 -1.718 1.00 0.00 O ATOM 1613 CB VAL A 105 -4.551 2.433 -0.624 1.00 0.00 C ATOM 1614 CG1 VAL A 105 -3.069 2.670 -0.879 1.00 0.00 C ATOM 1615 CG2 VAL A 105 -4.747 1.287 0.359 1.00 0.00 C ATOM 0 H VAL A 105 -7.291 3.270 -0.024 1.00 0.00 H new ATOM 0 HA VAL A 105 -4.592 4.215 0.616 1.00 0.00 H new ATOM 0 HB VAL A 105 -5.019 2.158 -1.569 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -2.610 1.749 -1.239 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -2.949 3.453 -1.628 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -2.585 2.978 0.048 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -4.256 0.392 -0.023 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -4.313 1.556 1.322 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -5.812 1.092 0.483 1.00 0.00 H new ATOM 1625 N HIS A 106 -4.360 5.224 -1.812 1.00 0.00 N ATOM 1626 CA HIS A 106 -4.416 6.147 -2.949 1.00 0.00 C ATOM 1627 C HIS A 106 -4.869 5.414 -4.219 1.00 0.00 C ATOM 1628 O HIS A 106 -4.753 4.194 -4.318 1.00 0.00 O ATOM 1629 CB HIS A 106 -3.047 6.806 -3.173 1.00 0.00 C ATOM 1630 CG HIS A 106 -2.808 7.252 -4.586 1.00 0.00 C ATOM 1631 ND1 HIS A 106 -2.586 6.536 -5.715 1.00 0.00 N flip ATOM 1632 CD2 HIS A 106 -2.797 8.575 -4.969 1.00 0.00 C flip ATOM 1633 CE1 HIS A 106 -2.451 7.430 -6.749 1.00 0.00 C flip ATOM 1634 NE2 HIS A 106 -2.583 8.655 -6.270 1.00 0.00 N flip ATOM 0 H HIS A 106 -3.418 5.048 -1.464 1.00 0.00 H new ATOM 0 HA HIS A 106 -5.144 6.926 -2.722 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -2.957 7.667 -2.511 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -2.265 6.102 -2.888 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -2.941 9.417 -4.308 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -2.267 7.174 -7.782 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -2.529 9.517 -6.813 1.00 0.00 H new ATOM 1642 N CYS A 107 -5.421 6.170 -5.172 1.00 0.00 N ATOM 1643 CA CYS A 107 -5.935 5.595 -6.416 1.00 0.00 C ATOM 1644 C CYS A 107 -4.824 5.039 -7.305 1.00 0.00 C ATOM 1645 O CYS A 107 -4.169 5.773 -8.049 1.00 0.00 O ATOM 1646 CB CYS A 107 -6.730 6.647 -7.194 1.00 0.00 C ATOM 1647 SG CYS A 107 -8.491 6.270 -7.354 1.00 0.00 S ATOM 0 H CYS A 107 -5.523 7.183 -5.105 1.00 0.00 H new ATOM 0 HA CYS A 107 -6.584 4.764 -6.137 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -6.619 7.611 -6.698 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -6.299 6.750 -8.190 1.00 0.00 H new ATOM 0 HG CYS A 107 -8.665 5.408 -8.311 1.00 0.00 H new ATOM 1653 N VAL A 108 -4.645 3.724 -7.224 1.00 0.00 N ATOM 1654 CA VAL A 108 -3.651 3.007 -8.013 1.00 0.00 C ATOM 1655 C VAL A 108 -4.087 2.845 -9.475 1.00 0.00 C ATOM 1656 O VAL A 108 -3.374 2.243 -10.276 1.00 0.00 O ATOM 1657 CB VAL A 108 -3.369 1.616 -7.405 1.00 0.00 C ATOM 1658 CG1 VAL A 108 -4.567 0.690 -7.581 1.00 0.00 C ATOM 1659 CG2 VAL A 108 -2.119 1.003 -8.017 1.00 0.00 C ATOM 0 H VAL A 108 -5.189 3.123 -6.605 1.00 0.00 H new ATOM 0 HA VAL A 108 -2.740 3.605 -7.992 1.00 0.00 H new ATOM 0 HB VAL A 108 -3.197 1.745 -6.336 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -4.342 -0.283 -7.144 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -5.436 1.120 -7.082 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -4.781 0.570 -8.643 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -1.940 0.023 -7.574 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -2.256 0.895 -9.093 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -1.264 1.651 -7.824 1.00 0.00 H new ATOM 1669 N ALA A 109 -5.271 3.359 -9.818 1.00 0.00 N ATOM 1670 CA ALA A 109 -5.792 3.230 -11.181 1.00 0.00 C ATOM 1671 C ALA A 109 -4.876 3.890 -12.212 1.00 0.00 C ATOM 1672 O ALA A 109 -5.061 3.717 -13.417 1.00 0.00 O ATOM 1673 CB ALA A 109 -7.188 3.826 -11.264 1.00 0.00 C ATOM 0 H ALA A 109 -5.882 3.864 -9.177 1.00 0.00 H new ATOM 0 HA ALA A 109 -5.835 2.166 -11.416 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -7.567 3.725 -12.281 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -7.850 3.299 -10.577 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -7.150 4.881 -10.994 1.00 0.00 H new ATOM 1679 N GLY A 110 -3.873 4.620 -11.739 1.00 0.00 N ATOM 1680 CA GLY A 110 -2.932 5.259 -12.636 1.00 0.00 C ATOM 1681 C GLY A 110 -1.516 4.823 -12.333 1.00 0.00 C ATOM 1682 O GLY A 110 -1.228 3.626 -12.292 1.00 0.00 O ATOM 0 H GLY A 110 -3.695 4.780 -10.747 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -3.180 5.010 -13.668 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -3.011 6.342 -12.541 1.00 0.00 H new ATOM 1686 N LEU A 111 -0.644 5.790 -12.088 1.00 0.00 N ATOM 1687 CA LEU A 111 0.743 5.505 -11.744 1.00 0.00 C ATOM 1688 C LEU A 111 1.110 6.271 -10.479 1.00 0.00 C ATOM 1689 O LEU A 111 0.901 7.482 -10.403 1.00 0.00 O ATOM 1690 CB LEU A 111 1.684 5.900 -12.890 1.00 0.00 C ATOM 1691 CG LEU A 111 1.673 4.972 -14.113 1.00 0.00 C ATOM 1692 CD1 LEU A 111 2.881 5.243 -14.997 1.00 0.00 C ATOM 1693 CD2 LEU A 111 1.651 3.512 -13.690 1.00 0.00 C ATOM 0 H LEU A 111 -0.873 6.783 -12.121 1.00 0.00 H new ATOM 0 HA LEU A 111 0.853 4.434 -11.573 1.00 0.00 H new ATOM 0 HB2 LEU A 111 1.424 6.906 -13.219 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.701 5.945 -12.501 1.00 0.00 H new ATOM 0 HG LEU A 111 0.766 5.177 -14.682 1.00 0.00 H new ATOM 0 HD11 LEU A 111 2.858 4.577 -15.859 1.00 0.00 H new ATOM 0 HD12 LEU A 111 2.858 6.278 -15.338 1.00 0.00 H new ATOM 0 HD13 LEU A 111 3.794 5.069 -14.428 1.00 0.00 H new ATOM 0 HD21 LEU A 111 1.644 2.877 -14.576 1.00 0.00 H new ATOM 0 HD22 LEU A 111 2.537 3.293 -13.093 1.00 0.00 H new ATOM 0 HD23 LEU A 111 0.757 3.318 -13.097 1.00 0.00 H new ATOM 1705 N GLY A 112 1.640 5.571 -9.481 1.00 0.00 N ATOM 1706 CA GLY A 112 1.995 6.236 -8.243 1.00 0.00 C ATOM 1707 C GLY A 112 2.883 5.409 -7.338 1.00 0.00 C ATOM 1708 O GLY A 112 3.762 4.683 -7.802 1.00 0.00 O ATOM 0 H GLY A 112 1.828 4.569 -9.506 1.00 0.00 H new ATOM 0 HA2 GLY A 112 2.502 7.172 -8.477 1.00 0.00 H new ATOM 0 HA3 GLY A 112 1.083 6.493 -7.705 1.00 0.00 H new ATOM 1712 N ARG A 113 2.663 5.549 -6.033 1.00 0.00 N ATOM 1713 CA ARG A 113 3.457 4.845 -5.031 1.00 0.00 C ATOM 1714 C ARG A 113 2.583 3.969 -4.117 1.00 0.00 C ATOM 1715 O ARG A 113 3.072 3.030 -3.475 1.00 0.00 O ATOM 1716 CB ARG A 113 4.232 5.878 -4.209 1.00 0.00 C ATOM 1717 CG ARG A 113 4.892 6.964 -5.059 1.00 0.00 C ATOM 1718 CD ARG A 113 3.962 8.152 -5.319 1.00 0.00 C ATOM 1719 NE ARG A 113 4.589 9.423 -4.936 1.00 0.00 N ATOM 1720 CZ ARG A 113 4.017 10.627 -5.069 1.00 0.00 C ATOM 1721 NH1 ARG A 113 2.800 10.756 -5.577 1.00 0.00 N ATOM 1722 NH2 ARG A 113 4.673 11.713 -4.689 1.00 0.00 N ATOM 0 H ARG A 113 1.936 6.148 -5.643 1.00 0.00 H new ATOM 0 HA ARG A 113 4.149 4.173 -5.539 1.00 0.00 H new ATOM 0 HB2 ARG A 113 3.553 6.348 -3.497 1.00 0.00 H new ATOM 0 HB3 ARG A 113 4.999 5.366 -3.628 1.00 0.00 H new ATOM 0 HG2 ARG A 113 5.793 7.316 -4.557 1.00 0.00 H new ATOM 0 HG3 ARG A 113 5.204 6.536 -6.012 1.00 0.00 H new ATOM 0 HD2 ARG A 113 3.695 8.181 -6.375 1.00 0.00 H new ATOM 0 HD3 ARG A 113 3.036 8.019 -4.759 1.00 0.00 H new ATOM 0 HE ARG A 113 5.528 9.387 -4.540 1.00 0.00 H new ATOM 0 HH11 ARG A 113 2.281 9.930 -5.875 1.00 0.00 H new ATOM 0 HH12 ARG A 113 2.382 11.682 -5.670 1.00 0.00 H new ATOM 0 HH21 ARG A 113 5.611 11.631 -4.296 1.00 0.00 H new ATOM 0 HH22 ARG A 113 4.240 12.631 -4.789 1.00 0.00 H new ATOM 1736 N ALA A 114 1.290 4.282 -4.064 1.00 0.00 N ATOM 1737 CA ALA A 114 0.341 3.538 -3.238 1.00 0.00 C ATOM 1738 C ALA A 114 0.398 2.027 -3.490 1.00 0.00 C ATOM 1739 O ALA A 114 0.368 1.240 -2.543 1.00 0.00 O ATOM 1740 CB ALA A 114 -1.070 4.052 -3.478 1.00 0.00 C ATOM 0 H ALA A 114 0.873 5.052 -4.588 1.00 0.00 H new ATOM 0 HA ALA A 114 0.624 3.701 -2.198 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -1.771 3.493 -2.859 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -1.121 5.110 -3.219 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -1.331 3.923 -4.529 1.00 0.00 H new ATOM 1746 N PRO A 115 0.444 1.589 -4.765 1.00 0.00 N ATOM 1747 CA PRO A 115 0.460 0.163 -5.109 1.00 0.00 C ATOM 1748 C PRO A 115 1.538 -0.623 -4.364 1.00 0.00 C ATOM 1749 O PRO A 115 1.251 -1.674 -3.790 1.00 0.00 O ATOM 1750 CB PRO A 115 0.752 0.150 -6.621 1.00 0.00 C ATOM 1751 CG PRO A 115 1.099 1.560 -6.981 1.00 0.00 C ATOM 1752 CD PRO A 115 0.421 2.428 -5.968 1.00 0.00 C ATOM 0 HA PRO A 115 -0.480 -0.315 -4.833 1.00 0.00 H new ATOM 0 HB2 PRO A 115 1.574 -0.527 -6.855 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -0.115 -0.195 -7.184 1.00 0.00 H new ATOM 0 HG2 PRO A 115 2.178 1.712 -6.964 1.00 0.00 H new ATOM 0 HG3 PRO A 115 0.759 1.799 -7.989 1.00 0.00 H new ATOM 0 HD2 PRO A 115 0.953 3.368 -5.818 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -0.596 2.682 -6.267 1.00 0.00 H new ATOM 1760 N VAL A 116 2.768 -0.119 -4.352 1.00 0.00 N ATOM 1761 CA VAL A 116 3.841 -0.808 -3.644 1.00 0.00 C ATOM 1762 C VAL A 116 3.524 -0.877 -2.158 1.00 0.00 C ATOM 1763 O VAL A 116 3.665 -1.922 -1.525 1.00 0.00 O ATOM 1764 CB VAL A 116 5.211 -0.120 -3.821 1.00 0.00 C ATOM 1765 CG1 VAL A 116 6.300 -0.897 -3.095 1.00 0.00 C ATOM 1766 CG2 VAL A 116 5.563 0.023 -5.289 1.00 0.00 C ATOM 0 H VAL A 116 3.043 0.747 -4.815 1.00 0.00 H new ATOM 0 HA VAL A 116 3.905 -1.807 -4.075 1.00 0.00 H new ATOM 0 HB VAL A 116 5.142 0.877 -3.386 1.00 0.00 H new ATOM 0 HG11 VAL A 116 7.258 -0.395 -3.232 1.00 0.00 H new ATOM 0 HG12 VAL A 116 6.065 -0.946 -2.032 1.00 0.00 H new ATOM 0 HG13 VAL A 116 6.358 -1.907 -3.500 1.00 0.00 H new ATOM 0 HG21 VAL A 116 6.533 0.511 -5.385 1.00 0.00 H new ATOM 0 HG22 VAL A 116 5.606 -0.963 -5.751 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.803 0.625 -5.788 1.00 0.00 H new ATOM 1776 N LEU A 117 3.102 0.253 -1.606 1.00 0.00 N ATOM 1777 CA LEU A 117 2.776 0.328 -0.189 1.00 0.00 C ATOM 1778 C LEU A 117 1.672 -0.660 0.198 1.00 0.00 C ATOM 1779 O LEU A 117 1.748 -1.302 1.246 1.00 0.00 O ATOM 1780 CB LEU A 117 2.371 1.757 0.177 1.00 0.00 C ATOM 1781 CG LEU A 117 3.434 2.824 -0.110 1.00 0.00 C ATOM 1782 CD1 LEU A 117 3.133 4.097 0.660 1.00 0.00 C ATOM 1783 CD2 LEU A 117 4.826 2.312 0.239 1.00 0.00 C ATOM 0 H LEU A 117 2.978 1.127 -2.116 1.00 0.00 H new ATOM 0 HA LEU A 117 3.667 0.050 0.374 1.00 0.00 H new ATOM 0 HB2 LEU A 117 1.464 2.013 -0.370 1.00 0.00 H new ATOM 0 HB3 LEU A 117 2.123 1.788 1.238 1.00 0.00 H new ATOM 0 HG LEU A 117 3.409 3.047 -1.177 1.00 0.00 H new ATOM 0 HD11 LEU A 117 3.898 4.843 0.444 1.00 0.00 H new ATOM 0 HD12 LEU A 117 2.158 4.481 0.361 1.00 0.00 H new ATOM 0 HD13 LEU A 117 3.127 3.883 1.729 1.00 0.00 H new ATOM 0 HD21 LEU A 117 5.563 3.087 0.027 1.00 0.00 H new ATOM 0 HD22 LEU A 117 4.864 2.055 1.298 1.00 0.00 H new ATOM 0 HD23 LEU A 117 5.048 1.427 -0.357 1.00 0.00 H new ATOM 1795 N VAL A 118 0.645 -0.780 -0.638 1.00 0.00 N ATOM 1796 CA VAL A 118 -0.462 -1.692 -0.349 1.00 0.00 C ATOM 1797 C VAL A 118 0.011 -3.142 -0.265 1.00 0.00 C ATOM 1798 O VAL A 118 -0.220 -3.819 0.737 1.00 0.00 O ATOM 1799 CB VAL A 118 -1.579 -1.578 -1.408 1.00 0.00 C ATOM 1800 CG1 VAL A 118 -2.608 -2.689 -1.241 1.00 0.00 C ATOM 1801 CG2 VAL A 118 -2.248 -0.219 -1.318 1.00 0.00 C ATOM 0 H VAL A 118 0.554 -0.264 -1.513 1.00 0.00 H new ATOM 0 HA VAL A 118 -0.863 -1.397 0.621 1.00 0.00 H new ATOM 0 HB VAL A 118 -1.126 -1.685 -2.394 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -3.383 -2.584 -2.000 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -2.120 -3.657 -1.352 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -3.059 -2.622 -0.251 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -3.034 -0.150 -2.070 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -2.682 -0.092 -0.326 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -1.509 0.563 -1.493 1.00 0.00 H new ATOM 1811 N ALA A 119 0.665 -3.617 -1.319 1.00 0.00 N ATOM 1812 CA ALA A 119 1.158 -4.989 -1.351 1.00 0.00 C ATOM 1813 C ALA A 119 2.110 -5.256 -0.189 1.00 0.00 C ATOM 1814 O ALA A 119 1.938 -6.215 0.571 1.00 0.00 O ATOM 1815 CB ALA A 119 1.847 -5.272 -2.679 1.00 0.00 C ATOM 0 H ALA A 119 0.866 -3.075 -2.159 1.00 0.00 H new ATOM 0 HA ALA A 119 0.305 -5.659 -1.249 1.00 0.00 H new ATOM 0 HB1 ALA A 119 2.210 -6.300 -2.689 1.00 0.00 H new ATOM 0 HB2 ALA A 119 1.138 -5.130 -3.494 1.00 0.00 H new ATOM 0 HB3 ALA A 119 2.687 -4.589 -2.806 1.00 0.00 H new ATOM 1821 N LEU A 120 3.113 -4.398 -0.055 1.00 0.00 N ATOM 1822 CA LEU A 120 4.098 -4.530 1.011 1.00 0.00 C ATOM 1823 C LEU A 120 3.412 -4.610 2.371 1.00 0.00 C ATOM 1824 O LEU A 120 3.905 -5.266 3.284 1.00 0.00 O ATOM 1825 CB LEU A 120 5.080 -3.359 0.968 1.00 0.00 C ATOM 1826 CG LEU A 120 6.256 -3.532 0.000 1.00 0.00 C ATOM 1827 CD1 LEU A 120 7.195 -4.623 0.484 1.00 0.00 C ATOM 1828 CD2 LEU A 120 5.768 -3.848 -1.407 1.00 0.00 C ATOM 0 H LEU A 120 3.266 -3.601 -0.673 1.00 0.00 H new ATOM 0 HA LEU A 120 4.654 -5.455 0.859 1.00 0.00 H new ATOM 0 HB2 LEU A 120 4.534 -2.457 0.694 1.00 0.00 H new ATOM 0 HB3 LEU A 120 5.476 -3.200 1.971 1.00 0.00 H new ATOM 0 HG LEU A 120 6.801 -2.588 -0.030 1.00 0.00 H new ATOM 0 HD11 LEU A 120 8.022 -4.729 -0.218 1.00 0.00 H new ATOM 0 HD12 LEU A 120 7.585 -4.358 1.467 1.00 0.00 H new ATOM 0 HD13 LEU A 120 6.653 -5.566 0.551 1.00 0.00 H new ATOM 0 HD21 LEU A 120 6.624 -3.965 -2.071 1.00 0.00 H new ATOM 0 HD22 LEU A 120 5.190 -4.772 -1.393 1.00 0.00 H new ATOM 0 HD23 LEU A 120 5.139 -3.033 -1.766 1.00 0.00 H new ATOM 1840 N ALA A 121 2.263 -3.957 2.496 1.00 0.00 N ATOM 1841 CA ALA A 121 1.511 -3.989 3.743 1.00 0.00 C ATOM 1842 C ALA A 121 0.873 -5.356 3.934 1.00 0.00 C ATOM 1843 O ALA A 121 0.889 -5.917 5.029 1.00 0.00 O ATOM 1844 CB ALA A 121 0.452 -2.900 3.761 1.00 0.00 C ATOM 0 H ALA A 121 1.834 -3.403 1.755 1.00 0.00 H new ATOM 0 HA ALA A 121 2.200 -3.805 4.568 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -0.098 -2.942 4.701 1.00 0.00 H new ATOM 0 HB2 ALA A 121 0.931 -1.925 3.664 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -0.238 -3.050 2.931 1.00 0.00 H new ATOM 1850 N LEU A 122 0.322 -5.893 2.851 1.00 0.00 N ATOM 1851 CA LEU A 122 -0.310 -7.204 2.885 1.00 0.00 C ATOM 1852 C LEU A 122 0.731 -8.296 3.122 1.00 0.00 C ATOM 1853 O LEU A 122 0.391 -9.436 3.440 1.00 0.00 O ATOM 1854 CB LEU A 122 -1.060 -7.465 1.575 1.00 0.00 C ATOM 1855 CG LEU A 122 -1.959 -8.705 1.571 1.00 0.00 C ATOM 1856 CD1 LEU A 122 -2.583 -8.924 2.940 1.00 0.00 C ATOM 1857 CD2 LEU A 122 -3.041 -8.568 0.509 1.00 0.00 C ATOM 0 H LEU A 122 0.301 -5.439 1.938 1.00 0.00 H new ATOM 0 HA LEU A 122 -1.023 -7.221 3.709 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -1.672 -6.592 1.346 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -0.330 -7.563 0.771 1.00 0.00 H new ATOM 0 HG LEU A 122 -1.345 -9.574 1.335 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -3.217 -9.810 2.913 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -1.796 -9.064 3.681 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -3.184 -8.055 3.209 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.673 -9.456 0.517 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -3.649 -7.688 0.720 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -2.577 -8.461 -0.472 1.00 0.00 H new ATOM 1869 N ILE A 123 2.000 -7.935 2.965 1.00 0.00 N ATOM 1870 CA ILE A 123 3.102 -8.868 3.157 1.00 0.00 C ATOM 1871 C ILE A 123 3.070 -9.475 4.564 1.00 0.00 C ATOM 1872 O ILE A 123 3.481 -10.617 4.767 1.00 0.00 O ATOM 1873 CB ILE A 123 4.453 -8.151 2.880 1.00 0.00 C ATOM 1874 CG1 ILE A 123 4.676 -8.082 1.361 1.00 0.00 C ATOM 1875 CG2 ILE A 123 5.639 -8.811 3.596 1.00 0.00 C ATOM 1876 CD1 ILE A 123 6.114 -7.868 0.944 1.00 0.00 C ATOM 0 H ILE A 123 2.292 -6.993 2.703 1.00 0.00 H new ATOM 0 HA ILE A 123 2.995 -9.690 2.449 1.00 0.00 H new ATOM 0 HB ILE A 123 4.395 -7.142 3.289 1.00 0.00 H new ATOM 0 HG12 ILE A 123 4.315 -9.007 0.912 1.00 0.00 H new ATOM 0 HG13 ILE A 123 4.069 -7.273 0.955 1.00 0.00 H new ATOM 0 HG21 ILE A 123 6.554 -8.265 3.364 1.00 0.00 H new ATOM 0 HG22 ILE A 123 5.470 -8.794 4.673 1.00 0.00 H new ATOM 0 HG23 ILE A 123 5.737 -9.844 3.261 1.00 0.00 H new ATOM 0 HD11 ILE A 123 6.176 -7.832 -0.144 1.00 0.00 H new ATOM 0 HD12 ILE A 123 6.477 -6.928 1.359 1.00 0.00 H new ATOM 0 HD13 ILE A 123 6.727 -8.689 1.316 1.00 0.00 H new ATOM 1888 N GLU A 124 2.572 -8.712 5.526 1.00 0.00 N ATOM 1889 CA GLU A 124 2.487 -9.185 6.906 1.00 0.00 C ATOM 1890 C GLU A 124 1.444 -10.298 7.073 1.00 0.00 C ATOM 1891 O GLU A 124 1.430 -10.991 8.090 1.00 0.00 O ATOM 1892 CB GLU A 124 2.161 -8.020 7.846 1.00 0.00 C ATOM 1893 CG GLU A 124 0.723 -7.530 7.749 1.00 0.00 C ATOM 1894 CD GLU A 124 0.471 -6.298 8.594 1.00 0.00 C ATOM 1895 OE1 GLU A 124 0.383 -6.437 9.832 1.00 0.00 O ATOM 1896 OE2 GLU A 124 0.362 -5.195 8.019 1.00 0.00 O ATOM 0 H GLU A 124 2.221 -7.765 5.381 1.00 0.00 H new ATOM 0 HA GLU A 124 3.460 -9.603 7.165 1.00 0.00 H new ATOM 0 HB2 GLU A 124 2.361 -8.328 8.872 1.00 0.00 H new ATOM 0 HB3 GLU A 124 2.832 -7.190 7.626 1.00 0.00 H new ATOM 0 HG2 GLU A 124 0.488 -7.307 6.708 1.00 0.00 H new ATOM 0 HG3 GLU A 124 0.049 -8.327 8.064 1.00 0.00 H new ATOM 1903 N SER A 125 0.547 -10.440 6.097 1.00 0.00 N ATOM 1904 CA SER A 125 -0.518 -11.442 6.176 1.00 0.00 C ATOM 1905 C SER A 125 -0.084 -12.839 5.714 1.00 0.00 C ATOM 1906 O SER A 125 -0.925 -13.721 5.548 1.00 0.00 O ATOM 1907 CB SER A 125 -1.726 -10.986 5.358 1.00 0.00 C ATOM 1908 OG SER A 125 -2.157 -9.696 5.761 1.00 0.00 O ATOM 0 H SER A 125 0.536 -9.877 5.246 1.00 0.00 H new ATOM 0 HA SER A 125 -0.779 -11.527 7.231 1.00 0.00 H new ATOM 0 HB2 SER A 125 -1.468 -10.972 4.299 1.00 0.00 H new ATOM 0 HB3 SER A 125 -2.541 -11.699 5.478 1.00 0.00 H new ATOM 0 HG SER A 125 -3.123 -9.615 5.619 1.00 0.00 H new ATOM 1914 N GLY A 126 1.215 -13.051 5.521 1.00 0.00 N ATOM 1915 CA GLY A 126 1.686 -14.365 5.096 1.00 0.00 C ATOM 1916 C GLY A 126 2.315 -14.357 3.715 1.00 0.00 C ATOM 1917 O GLY A 126 3.465 -13.948 3.561 1.00 0.00 O ATOM 0 H GLY A 126 1.944 -12.349 5.648 1.00 0.00 H new ATOM 0 HA2 GLY A 126 2.415 -14.733 5.818 1.00 0.00 H new ATOM 0 HA3 GLY A 126 0.849 -15.063 5.103 1.00 0.00 H new ATOM 1921 N MET A 127 1.562 -14.809 2.708 1.00 0.00 N ATOM 1922 CA MET A 127 2.063 -14.841 1.335 1.00 0.00 C ATOM 1923 C MET A 127 2.363 -13.422 0.876 1.00 0.00 C ATOM 1924 O MET A 127 1.570 -12.798 0.180 1.00 0.00 O ATOM 1925 CB MET A 127 1.047 -15.504 0.396 1.00 0.00 C ATOM 1926 CG MET A 127 -0.377 -14.987 0.556 1.00 0.00 C ATOM 1927 SD MET A 127 -1.461 -15.528 -0.784 1.00 0.00 S ATOM 1928 CE MET A 127 -2.643 -14.182 -0.852 1.00 0.00 C ATOM 0 H MET A 127 0.609 -15.155 2.819 1.00 0.00 H new ATOM 0 HA MET A 127 2.978 -15.433 1.306 1.00 0.00 H new ATOM 0 HB2 MET A 127 1.365 -15.348 -0.635 1.00 0.00 H new ATOM 0 HB3 MET A 127 1.054 -16.580 0.572 1.00 0.00 H new ATOM 0 HG2 MET A 127 -0.781 -15.332 1.508 1.00 0.00 H new ATOM 0 HG3 MET A 127 -0.363 -13.898 0.591 1.00 0.00 H new ATOM 0 HE1 MET A 127 -3.654 -14.581 -0.769 1.00 0.00 H new ATOM 0 HE2 MET A 127 -2.456 -13.492 -0.029 1.00 0.00 H new ATOM 0 HE3 MET A 127 -2.539 -13.654 -1.800 1.00 0.00 H new ATOM 1938 N LYS A 128 3.493 -12.908 1.332 1.00 0.00 N ATOM 1939 CA LYS A 128 3.898 -11.538 1.043 1.00 0.00 C ATOM 1940 C LYS A 128 4.358 -11.299 -0.393 1.00 0.00 C ATOM 1941 O LYS A 128 3.709 -10.570 -1.143 1.00 0.00 O ATOM 1942 CB LYS A 128 5.015 -11.128 2.004 1.00 0.00 C ATOM 1943 CG LYS A 128 6.036 -12.221 2.299 1.00 0.00 C ATOM 1944 CD LYS A 128 5.932 -12.711 3.735 1.00 0.00 C ATOM 1945 CE LYS A 128 7.043 -12.140 4.601 1.00 0.00 C ATOM 1946 NZ LYS A 128 7.185 -12.882 5.884 1.00 0.00 N ATOM 0 H LYS A 128 4.155 -13.425 1.911 1.00 0.00 H new ATOM 0 HA LYS A 128 3.005 -10.928 1.178 1.00 0.00 H new ATOM 0 HB2 LYS A 128 5.536 -10.266 1.587 1.00 0.00 H new ATOM 0 HB3 LYS A 128 4.567 -10.805 2.944 1.00 0.00 H new ATOM 0 HG2 LYS A 128 5.882 -13.057 1.617 1.00 0.00 H new ATOM 0 HG3 LYS A 128 7.041 -11.840 2.116 1.00 0.00 H new ATOM 0 HD2 LYS A 128 4.964 -12.426 4.148 1.00 0.00 H new ATOM 0 HD3 LYS A 128 5.978 -13.800 3.753 1.00 0.00 H new ATOM 0 HE2 LYS A 128 7.985 -12.177 4.054 1.00 0.00 H new ATOM 0 HE3 LYS A 128 6.837 -11.090 4.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 7.953 -12.461 6.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 6.295 -12.825 6.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 7.407 -13.879 5.686 1.00 0.00 H new ATOM 1960 N TYR A 129 5.487 -11.880 -0.765 1.00 0.00 N ATOM 1961 CA TYR A 129 6.036 -11.687 -2.099 1.00 0.00 C ATOM 1962 C TYR A 129 5.133 -12.304 -3.161 1.00 0.00 C ATOM 1963 O TYR A 129 5.019 -11.787 -4.273 1.00 0.00 O ATOM 1964 CB TYR A 129 7.446 -12.276 -2.161 1.00 0.00 C ATOM 1965 CG TYR A 129 8.242 -11.889 -3.392 1.00 0.00 C ATOM 1966 CD1 TYR A 129 8.061 -10.657 -4.010 1.00 0.00 C ATOM 1967 CD2 TYR A 129 9.185 -12.757 -3.930 1.00 0.00 C ATOM 1968 CE1 TYR A 129 8.796 -10.305 -5.128 1.00 0.00 C ATOM 1969 CE2 TYR A 129 9.921 -12.411 -5.046 1.00 0.00 C ATOM 1970 CZ TYR A 129 9.722 -11.186 -5.641 1.00 0.00 C ATOM 1971 OH TYR A 129 10.456 -10.837 -6.752 1.00 0.00 O ATOM 0 H TYR A 129 6.041 -12.489 -0.163 1.00 0.00 H new ATOM 0 HA TYR A 129 6.091 -10.618 -2.307 1.00 0.00 H new ATOM 0 HB2 TYR A 129 7.996 -11.959 -1.275 1.00 0.00 H new ATOM 0 HB3 TYR A 129 7.373 -13.363 -2.119 1.00 0.00 H new ATOM 0 HD1 TYR A 129 7.335 -9.964 -3.611 1.00 0.00 H new ATOM 0 HD2 TYR A 129 9.345 -13.719 -3.467 1.00 0.00 H new ATOM 0 HE1 TYR A 129 8.644 -9.344 -5.596 1.00 0.00 H new ATOM 0 HE2 TYR A 129 10.649 -13.098 -5.450 1.00 0.00 H new ATOM 0 HH TYR A 129 11.065 -11.569 -6.985 1.00 0.00 H new ATOM 1981 N GLU A 130 4.488 -13.408 -2.811 1.00 0.00 N ATOM 1982 CA GLU A 130 3.591 -14.091 -3.733 1.00 0.00 C ATOM 1983 C GLU A 130 2.298 -13.304 -3.934 1.00 0.00 C ATOM 1984 O GLU A 130 1.895 -13.042 -5.068 1.00 0.00 O ATOM 1985 CB GLU A 130 3.277 -15.497 -3.224 1.00 0.00 C ATOM 1986 CG GLU A 130 4.516 -16.311 -2.887 1.00 0.00 C ATOM 1987 CD GLU A 130 4.709 -16.489 -1.393 1.00 0.00 C ATOM 1988 OE1 GLU A 130 3.863 -17.154 -0.760 1.00 0.00 O ATOM 1989 OE2 GLU A 130 5.705 -15.961 -0.857 1.00 0.00 O ATOM 0 H GLU A 130 4.569 -13.850 -1.895 1.00 0.00 H new ATOM 0 HA GLU A 130 4.095 -14.165 -4.697 1.00 0.00 H new ATOM 0 HB2 GLU A 130 2.649 -15.422 -2.336 1.00 0.00 H new ATOM 0 HB3 GLU A 130 2.698 -16.028 -3.980 1.00 0.00 H new ATOM 0 HG2 GLU A 130 4.442 -17.291 -3.359 1.00 0.00 H new ATOM 0 HG3 GLU A 130 5.394 -15.820 -3.307 1.00 0.00 H new ATOM 1996 N ASP A 131 1.644 -12.930 -2.835 1.00 0.00 N ATOM 1997 CA ASP A 131 0.396 -12.177 -2.919 1.00 0.00 C ATOM 1998 C ASP A 131 0.645 -10.763 -3.413 1.00 0.00 C ATOM 1999 O ASP A 131 -0.162 -10.202 -4.145 1.00 0.00 O ATOM 2000 CB ASP A 131 -0.307 -12.121 -1.565 1.00 0.00 C ATOM 2001 CG ASP A 131 -1.687 -11.502 -1.659 1.00 0.00 C ATOM 2002 OD1 ASP A 131 -2.358 -11.701 -2.693 1.00 0.00 O ATOM 2003 OD2 ASP A 131 -2.097 -10.819 -0.697 1.00 0.00 O ATOM 0 H ASP A 131 1.955 -13.134 -1.885 1.00 0.00 H new ATOM 0 HA ASP A 131 -0.246 -12.697 -3.631 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -0.390 -13.129 -1.159 1.00 0.00 H new ATOM 0 HB3 ASP A 131 0.300 -11.545 -0.866 1.00 0.00 H new ATOM 2008 N ALA A 132 1.759 -10.179 -3.009 1.00 0.00 N ATOM 2009 CA ALA A 132 2.079 -8.826 -3.427 1.00 0.00 C ATOM 2010 C ALA A 132 2.215 -8.750 -4.939 1.00 0.00 C ATOM 2011 O ALA A 132 1.611 -7.896 -5.577 1.00 0.00 O ATOM 2012 CB ALA A 132 3.349 -8.341 -2.748 1.00 0.00 C ATOM 0 H ALA A 132 2.450 -10.615 -2.399 1.00 0.00 H new ATOM 0 HA ALA A 132 1.261 -8.172 -3.125 1.00 0.00 H new ATOM 0 HB1 ALA A 132 3.571 -7.325 -3.075 1.00 0.00 H new ATOM 0 HB2 ALA A 132 3.211 -8.352 -1.667 1.00 0.00 H new ATOM 0 HB3 ALA A 132 4.177 -8.997 -3.015 1.00 0.00 H new ATOM 2018 N ILE A 133 3.002 -9.650 -5.509 1.00 0.00 N ATOM 2019 CA ILE A 133 3.202 -9.672 -6.951 1.00 0.00 C ATOM 2020 C ILE A 133 1.977 -10.226 -7.679 1.00 0.00 C ATOM 2021 O ILE A 133 1.625 -9.757 -8.762 1.00 0.00 O ATOM 2022 CB ILE A 133 4.446 -10.503 -7.327 1.00 0.00 C ATOM 2023 CG1 ILE A 133 5.667 -10.009 -6.547 1.00 0.00 C ATOM 2024 CG2 ILE A 133 4.706 -10.435 -8.825 1.00 0.00 C ATOM 2025 CD1 ILE A 133 6.110 -8.615 -6.934 1.00 0.00 C ATOM 0 H ILE A 133 3.511 -10.372 -4.998 1.00 0.00 H new ATOM 0 HA ILE A 133 3.356 -8.640 -7.266 1.00 0.00 H new ATOM 0 HB ILE A 133 4.260 -11.544 -7.062 1.00 0.00 H new ATOM 0 HG12 ILE A 133 5.438 -10.026 -5.481 1.00 0.00 H new ATOM 0 HG13 ILE A 133 6.494 -10.701 -6.706 1.00 0.00 H new ATOM 0 HG21 ILE A 133 5.588 -11.028 -9.069 1.00 0.00 H new ATOM 0 HG22 ILE A 133 3.844 -10.830 -9.362 1.00 0.00 H new ATOM 0 HG23 ILE A 133 4.873 -9.399 -9.119 1.00 0.00 H new ATOM 0 HD11 ILE A 133 6.979 -8.332 -6.341 1.00 0.00 H new ATOM 0 HD12 ILE A 133 6.371 -8.597 -7.992 1.00 0.00 H new ATOM 0 HD13 ILE A 133 5.299 -7.911 -6.748 1.00 0.00 H new ATOM 2037 N GLN A 134 1.336 -11.232 -7.089 1.00 0.00 N ATOM 2038 CA GLN A 134 0.162 -11.855 -7.699 1.00 0.00 C ATOM 2039 C GLN A 134 -1.087 -10.974 -7.600 1.00 0.00 C ATOM 2040 O GLN A 134 -1.778 -10.754 -8.597 1.00 0.00 O ATOM 2041 CB GLN A 134 -0.112 -13.210 -7.045 1.00 0.00 C ATOM 2042 CG GLN A 134 -1.035 -14.103 -7.860 1.00 0.00 C ATOM 2043 CD GLN A 134 -0.965 -15.556 -7.433 1.00 0.00 C ATOM 2044 OE1 GLN A 134 -0.293 -15.897 -6.459 1.00 0.00 O ATOM 2045 NE2 GLN A 134 -1.661 -16.421 -8.161 1.00 0.00 N ATOM 0 H GLN A 134 1.608 -11.633 -6.191 1.00 0.00 H new ATOM 0 HA GLN A 134 0.385 -11.989 -8.757 1.00 0.00 H new ATOM 0 HB2 GLN A 134 0.835 -13.727 -6.888 1.00 0.00 H new ATOM 0 HB3 GLN A 134 -0.553 -13.047 -6.061 1.00 0.00 H new ATOM 0 HG2 GLN A 134 -2.061 -13.747 -7.760 1.00 0.00 H new ATOM 0 HG3 GLN A 134 -0.772 -14.025 -8.915 1.00 0.00 H new ATOM 0 HE21 GLN A 134 -2.204 -16.094 -8.960 1.00 0.00 H new ATOM 0 HE22 GLN A 134 -1.653 -17.412 -7.921 1.00 0.00 H new ATOM 2054 N PHE A 135 -1.379 -10.474 -6.401 1.00 0.00 N ATOM 2055 CA PHE A 135 -2.555 -9.629 -6.204 1.00 0.00 C ATOM 2056 C PHE A 135 -2.367 -8.284 -6.896 1.00 0.00 C ATOM 2057 O PHE A 135 -3.317 -7.722 -7.442 1.00 0.00 O ATOM 2058 CB PHE A 135 -2.849 -9.430 -4.706 1.00 0.00 C ATOM 2059 CG PHE A 135 -4.229 -9.857 -4.269 1.00 0.00 C ATOM 2060 CD1 PHE A 135 -4.964 -10.791 -4.989 1.00 0.00 C ATOM 2061 CD2 PHE A 135 -4.789 -9.317 -3.124 1.00 0.00 C ATOM 2062 CE1 PHE A 135 -6.227 -11.170 -4.572 1.00 0.00 C ATOM 2063 CE2 PHE A 135 -6.051 -9.691 -2.706 1.00 0.00 C ATOM 2064 CZ PHE A 135 -6.772 -10.616 -3.430 1.00 0.00 C ATOM 0 H PHE A 135 -0.825 -10.637 -5.560 1.00 0.00 H new ATOM 0 HA PHE A 135 -3.412 -10.133 -6.651 1.00 0.00 H new ATOM 0 HB2 PHE A 135 -2.112 -9.988 -4.128 1.00 0.00 H new ATOM 0 HB3 PHE A 135 -2.716 -8.376 -4.461 1.00 0.00 H new ATOM 0 HD1 PHE A 135 -4.544 -11.226 -5.884 1.00 0.00 H new ATOM 0 HD2 PHE A 135 -4.231 -8.593 -2.549 1.00 0.00 H new ATOM 0 HE1 PHE A 135 -6.787 -11.899 -5.139 1.00 0.00 H new ATOM 0 HE2 PHE A 135 -6.473 -9.258 -1.811 1.00 0.00 H new ATOM 0 HZ PHE A 135 -7.760 -10.907 -3.105 1.00 0.00 H new ATOM 2074 N ILE A 136 -1.138 -7.778 -6.887 1.00 0.00 N ATOM 2075 CA ILE A 136 -0.846 -6.509 -7.536 1.00 0.00 C ATOM 2076 C ILE A 136 -0.836 -6.682 -9.054 1.00 0.00 C ATOM 2077 O ILE A 136 -1.125 -5.745 -9.795 1.00 0.00 O ATOM 2078 CB ILE A 136 0.497 -5.912 -7.058 1.00 0.00 C ATOM 2079 CG1 ILE A 136 0.471 -4.389 -7.176 1.00 0.00 C ATOM 2080 CG2 ILE A 136 1.672 -6.490 -7.841 1.00 0.00 C ATOM 2081 CD1 ILE A 136 1.251 -3.688 -6.084 1.00 0.00 C ATOM 0 H ILE A 136 -0.336 -8.224 -6.441 1.00 0.00 H new ATOM 0 HA ILE A 136 -1.634 -5.809 -7.258 1.00 0.00 H new ATOM 0 HB ILE A 136 0.632 -6.182 -6.011 1.00 0.00 H new ATOM 0 HG12 ILE A 136 0.877 -4.100 -8.145 1.00 0.00 H new ATOM 0 HG13 ILE A 136 -0.564 -4.048 -7.150 1.00 0.00 H new ATOM 0 HG21 ILE A 136 2.601 -6.049 -7.480 1.00 0.00 H new ATOM 0 HG22 ILE A 136 1.705 -7.571 -7.703 1.00 0.00 H new ATOM 0 HG23 ILE A 136 1.550 -6.263 -8.900 1.00 0.00 H new ATOM 0 HD11 ILE A 136 1.190 -2.609 -6.229 1.00 0.00 H new ATOM 0 HD12 ILE A 136 0.831 -3.948 -5.112 1.00 0.00 H new ATOM 0 HD13 ILE A 136 2.294 -4.001 -6.124 1.00 0.00 H new ATOM 2093 N ARG A 137 -0.509 -7.891 -9.507 1.00 0.00 N ATOM 2094 CA ARG A 137 -0.474 -8.189 -10.934 1.00 0.00 C ATOM 2095 C ARG A 137 -1.873 -8.087 -11.537 1.00 0.00 C ATOM 2096 O ARG A 137 -2.081 -7.391 -12.531 1.00 0.00 O ATOM 2097 CB ARG A 137 0.095 -9.589 -11.176 1.00 0.00 C ATOM 2098 CG ARG A 137 1.536 -9.586 -11.661 1.00 0.00 C ATOM 2099 CD ARG A 137 1.970 -10.970 -12.118 1.00 0.00 C ATOM 2100 NE ARG A 137 2.931 -10.908 -13.217 1.00 0.00 N ATOM 2101 CZ ARG A 137 2.591 -10.715 -14.489 1.00 0.00 C ATOM 2102 NH1 ARG A 137 1.317 -10.562 -14.829 1.00 0.00 N ATOM 2103 NH2 ARG A 137 3.528 -10.676 -15.426 1.00 0.00 N ATOM 0 H ARG A 137 -0.265 -8.678 -8.906 1.00 0.00 H new ATOM 0 HA ARG A 137 0.173 -7.457 -11.418 1.00 0.00 H new ATOM 0 HB2 ARG A 137 0.033 -10.162 -10.251 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -0.526 -10.102 -11.911 1.00 0.00 H new ATOM 0 HG2 ARG A 137 1.643 -8.879 -12.484 1.00 0.00 H new ATOM 0 HG3 ARG A 137 2.191 -9.244 -10.859 1.00 0.00 H new ATOM 0 HD2 ARG A 137 2.413 -11.506 -11.279 1.00 0.00 H new ATOM 0 HD3 ARG A 137 1.095 -11.538 -12.433 1.00 0.00 H new ATOM 0 HE ARG A 137 3.921 -11.019 -12.996 1.00 0.00 H new ATOM 0 HH11 ARG A 137 0.591 -10.592 -14.113 1.00 0.00 H new ATOM 0 HH12 ARG A 137 1.064 -10.414 -15.806 1.00 0.00 H new ATOM 0 HH21 ARG A 137 4.509 -10.794 -15.172 1.00 0.00 H new ATOM 0 HH22 ARG A 137 3.268 -10.528 -16.401 1.00 0.00 H new ATOM 2117 N GLN A 138 -2.830 -8.784 -10.928 1.00 0.00 N ATOM 2118 CA GLN A 138 -4.209 -8.767 -11.407 1.00 0.00 C ATOM 2119 C GLN A 138 -4.769 -7.347 -11.384 1.00 0.00 C ATOM 2120 O GLN A 138 -5.396 -6.898 -12.344 1.00 0.00 O ATOM 2121 CB GLN A 138 -5.080 -9.690 -10.550 1.00 0.00 C ATOM 2122 CG GLN A 138 -5.837 -10.732 -11.357 1.00 0.00 C ATOM 2123 CD GLN A 138 -6.728 -10.115 -12.418 1.00 0.00 C ATOM 2124 OE1 GLN A 138 -7.711 -9.444 -12.104 1.00 0.00 O ATOM 2125 NE2 GLN A 138 -6.388 -10.341 -13.681 1.00 0.00 N ATOM 0 H GLN A 138 -2.676 -9.366 -10.104 1.00 0.00 H new ATOM 0 HA GLN A 138 -4.219 -9.127 -12.436 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -4.449 -10.196 -9.819 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -5.794 -9.086 -9.991 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -5.124 -11.405 -11.833 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -6.445 -11.336 -10.684 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -5.564 -10.903 -13.895 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -6.950 -9.952 -14.438 1.00 0.00 H new ATOM 2134 N LYS A 139 -4.524 -6.645 -10.283 1.00 0.00 N ATOM 2135 CA LYS A 139 -4.986 -5.271 -10.125 1.00 0.00 C ATOM 2136 C LYS A 139 -4.034 -4.310 -10.828 1.00 0.00 C ATOM 2137 O LYS A 139 -2.850 -4.602 -10.977 1.00 0.00 O ATOM 2138 CB LYS A 139 -5.092 -4.912 -8.641 1.00 0.00 C ATOM 2139 CG LYS A 139 -6.128 -5.732 -7.890 1.00 0.00 C ATOM 2140 CD LYS A 139 -7.543 -5.278 -8.218 1.00 0.00 C ATOM 2141 CE LYS A 139 -8.459 -6.460 -8.495 1.00 0.00 C ATOM 2142 NZ LYS A 139 -9.433 -6.164 -9.581 1.00 0.00 N ATOM 0 H LYS A 139 -4.005 -7.007 -9.483 1.00 0.00 H new ATOM 0 HA LYS A 139 -5.973 -5.183 -10.578 1.00 0.00 H new ATOM 0 HB2 LYS A 139 -4.119 -5.053 -8.171 1.00 0.00 H new ATOM 0 HB3 LYS A 139 -5.341 -3.855 -8.548 1.00 0.00 H new ATOM 0 HG2 LYS A 139 -6.014 -6.786 -8.145 1.00 0.00 H new ATOM 0 HG3 LYS A 139 -5.956 -5.644 -6.817 1.00 0.00 H new ATOM 0 HD2 LYS A 139 -7.941 -4.695 -7.387 1.00 0.00 H new ATOM 0 HD3 LYS A 139 -7.523 -4.621 -9.087 1.00 0.00 H new ATOM 0 HE2 LYS A 139 -7.859 -7.327 -8.771 1.00 0.00 H new ATOM 0 HE3 LYS A 139 -8.998 -6.723 -7.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 -10.039 -6.994 -9.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 -10.023 -5.352 -9.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 -8.919 -5.938 -10.456 1.00 0.00 H new ATOM 2156 N ARG A 140 -4.549 -3.168 -11.270 1.00 0.00 N ATOM 2157 CA ARG A 140 -3.714 -2.193 -11.959 1.00 0.00 C ATOM 2158 C ARG A 140 -2.785 -1.499 -10.971 1.00 0.00 C ATOM 2159 O ARG A 140 -3.233 -0.818 -10.050 1.00 0.00 O ATOM 2160 CB ARG A 140 -4.580 -1.155 -12.674 1.00 0.00 C ATOM 2161 CG ARG A 140 -3.950 -0.607 -13.946 1.00 0.00 C ATOM 2162 CD ARG A 140 -2.767 0.303 -13.644 1.00 0.00 C ATOM 2163 NE ARG A 140 -2.967 1.653 -14.168 1.00 0.00 N ATOM 2164 CZ ARG A 140 -3.162 1.927 -15.457 1.00 0.00 C ATOM 2165 NH1 ARG A 140 -3.130 0.958 -16.363 1.00 0.00 N ATOM 2166 NH2 ARG A 140 -3.380 3.176 -15.843 1.00 0.00 N ATOM 0 H ARG A 140 -5.527 -2.897 -11.165 1.00 0.00 H new ATOM 0 HA ARG A 140 -3.114 -2.720 -12.700 1.00 0.00 H new ATOM 0 HB2 ARG A 140 -5.542 -1.604 -12.920 1.00 0.00 H new ATOM 0 HB3 ARG A 140 -4.779 -0.328 -11.992 1.00 0.00 H new ATOM 0 HG2 ARG A 140 -3.621 -1.435 -14.574 1.00 0.00 H new ATOM 0 HG3 ARG A 140 -4.699 -0.054 -14.513 1.00 0.00 H new ATOM 0 HD2 ARG A 140 -2.613 0.352 -12.566 1.00 0.00 H new ATOM 0 HD3 ARG A 140 -1.862 -0.123 -14.076 1.00 0.00 H new ATOM 0 HE ARG A 140 -2.957 2.431 -13.508 1.00 0.00 H new ATOM 0 HH11 ARG A 140 -2.955 -0.005 -16.074 1.00 0.00 H new ATOM 0 HH12 ARG A 140 -3.280 1.176 -17.348 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -3.398 3.927 -15.153 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -3.529 3.386 -16.830 1.00 0.00 H new ATOM 2180 N ARG A 141 -1.484 -1.687 -11.171 1.00 0.00 N ATOM 2181 CA ARG A 141 -0.478 -1.092 -10.302 1.00 0.00 C ATOM 2182 C ARG A 141 0.364 -0.071 -11.056 1.00 0.00 C ATOM 2183 O ARG A 141 0.386 -0.058 -12.287 1.00 0.00 O ATOM 2184 CB ARG A 141 0.422 -2.181 -9.715 1.00 0.00 C ATOM 2185 CG ARG A 141 1.306 -2.868 -10.747 1.00 0.00 C ATOM 2186 CD ARG A 141 0.816 -4.273 -11.057 1.00 0.00 C ATOM 2187 NE ARG A 141 1.603 -4.907 -12.113 1.00 0.00 N ATOM 2188 CZ ARG A 141 1.438 -4.662 -13.410 1.00 0.00 C ATOM 2189 NH1 ARG A 141 0.518 -3.796 -13.818 1.00 0.00 N ATOM 2190 NH2 ARG A 141 2.196 -5.283 -14.303 1.00 0.00 N ATOM 0 H ARG A 141 -1.102 -2.250 -11.931 1.00 0.00 H new ATOM 0 HA ARG A 141 -0.994 -0.577 -9.492 1.00 0.00 H new ATOM 0 HB2 ARG A 141 1.054 -1.741 -8.944 1.00 0.00 H new ATOM 0 HB3 ARG A 141 -0.201 -2.931 -9.227 1.00 0.00 H new ATOM 0 HG2 ARG A 141 1.323 -2.278 -11.663 1.00 0.00 H new ATOM 0 HG3 ARG A 141 2.330 -2.913 -10.377 1.00 0.00 H new ATOM 0 HD2 ARG A 141 0.865 -4.881 -10.154 1.00 0.00 H new ATOM 0 HD3 ARG A 141 -0.231 -4.234 -11.359 1.00 0.00 H new ATOM 0 HE ARG A 141 2.321 -5.577 -11.839 1.00 0.00 H new ATOM 0 HH11 ARG A 141 -0.067 -3.314 -13.135 1.00 0.00 H new ATOM 0 HH12 ARG A 141 0.396 -3.612 -14.814 1.00 0.00 H new ATOM 0 HH21 ARG A 141 2.905 -5.948 -13.995 1.00 0.00 H new ATOM 0 HH22 ARG A 141 2.070 -5.095 -15.298 1.00 0.00 H new ATOM 2204 N GLY A 142 1.070 0.772 -10.311 1.00 0.00 N ATOM 2205 CA GLY A 142 1.920 1.772 -10.931 1.00 0.00 C ATOM 2206 C GLY A 142 2.986 1.129 -11.793 1.00 0.00 C ATOM 2207 O GLY A 142 2.876 -0.048 -12.137 1.00 0.00 O ATOM 0 H GLY A 142 1.069 0.781 -9.291 1.00 0.00 H new ATOM 0 HA2 GLY A 142 1.313 2.442 -11.539 1.00 0.00 H new ATOM 0 HA3 GLY A 142 2.391 2.381 -10.159 1.00 0.00 H new ATOM 2211 N ALA A 143 4.026 1.880 -12.143 1.00 0.00 N ATOM 2212 CA ALA A 143 5.090 1.320 -12.962 1.00 0.00 C ATOM 2213 C ALA A 143 6.177 0.706 -12.085 1.00 0.00 C ATOM 2214 O ALA A 143 7.045 1.408 -11.567 1.00 0.00 O ATOM 2215 CB ALA A 143 5.683 2.393 -13.864 1.00 0.00 C ATOM 0 H ALA A 143 4.152 2.857 -11.878 1.00 0.00 H new ATOM 0 HA ALA A 143 4.666 0.533 -13.586 1.00 0.00 H new ATOM 0 HB1 ALA A 143 6.478 1.960 -14.471 1.00 0.00 H new ATOM 0 HB2 ALA A 143 4.905 2.791 -14.515 1.00 0.00 H new ATOM 0 HB3 ALA A 143 6.091 3.198 -13.252 1.00 0.00 H new ATOM 2221 N ILE A 144 6.125 -0.615 -11.934 1.00 0.00 N ATOM 2222 CA ILE A 144 7.108 -1.336 -11.133 1.00 0.00 C ATOM 2223 C ILE A 144 8.315 -1.736 -11.974 1.00 0.00 C ATOM 2224 O ILE A 144 8.212 -2.612 -12.832 1.00 0.00 O ATOM 2225 CB ILE A 144 6.486 -2.592 -10.486 1.00 0.00 C ATOM 2226 CG1 ILE A 144 6.017 -3.585 -11.559 1.00 0.00 C ATOM 2227 CG2 ILE A 144 5.326 -2.189 -9.585 1.00 0.00 C ATOM 2228 CD1 ILE A 144 5.138 -4.696 -11.023 1.00 0.00 C ATOM 0 H ILE A 144 5.411 -1.208 -12.357 1.00 0.00 H new ATOM 0 HA ILE A 144 7.438 -0.662 -10.343 1.00 0.00 H new ATOM 0 HB ILE A 144 7.247 -3.087 -9.883 1.00 0.00 H new ATOM 0 HG12 ILE A 144 5.470 -3.041 -12.329 1.00 0.00 H new ATOM 0 HG13 ILE A 144 6.891 -4.026 -12.039 1.00 0.00 H new ATOM 0 HG21 ILE A 144 4.891 -3.080 -9.131 1.00 0.00 H new ATOM 0 HG22 ILE A 144 5.688 -1.523 -8.802 1.00 0.00 H new ATOM 0 HG23 ILE A 144 4.567 -1.676 -10.176 1.00 0.00 H new ATOM 0 HD11 ILE A 144 4.847 -5.356 -11.840 1.00 0.00 H new ATOM 0 HD12 ILE A 144 5.688 -5.266 -10.274 1.00 0.00 H new ATOM 0 HD13 ILE A 144 4.245 -4.266 -10.568 1.00 0.00 H new ATOM 2240 N ASN A 145 9.462 -1.100 -11.744 1.00 0.00 N ATOM 2241 CA ASN A 145 10.651 -1.436 -12.518 1.00 0.00 C ATOM 2242 C ASN A 145 11.747 -2.077 -11.664 1.00 0.00 C ATOM 2243 O ASN A 145 11.963 -3.288 -11.722 1.00 0.00 O ATOM 2244 CB ASN A 145 11.199 -0.183 -13.207 1.00 0.00 C ATOM 2245 CG ASN A 145 11.196 -0.306 -14.719 1.00 0.00 C ATOM 2246 OD1 ASN A 145 10.154 -0.538 -15.332 1.00 0.00 O ATOM 2247 ND2 ASN A 145 12.366 -0.152 -15.327 1.00 0.00 N ATOM 0 H ASN A 145 9.591 -0.368 -11.046 1.00 0.00 H new ATOM 0 HA ASN A 145 10.349 -2.171 -13.264 1.00 0.00 H new ATOM 0 HB2 ASN A 145 10.601 0.680 -12.914 1.00 0.00 H new ATOM 0 HB3 ASN A 145 12.216 0.002 -12.862 1.00 0.00 H new ATOM 0 HD21 ASN A 145 12.426 -0.225 -16.343 1.00 0.00 H new ATOM 0 HD22 ASN A 145 13.204 0.039 -14.779 1.00 0.00 H new ATOM 2254 N SER A 146 12.455 -1.253 -10.895 1.00 0.00 N ATOM 2255 CA SER A 146 13.551 -1.741 -10.057 1.00 0.00 C ATOM 2256 C SER A 146 13.175 -1.924 -8.586 1.00 0.00 C ATOM 2257 O SER A 146 13.309 -3.014 -8.029 1.00 0.00 O ATOM 2258 CB SER A 146 14.742 -0.787 -10.160 1.00 0.00 C ATOM 2259 OG SER A 146 15.968 -1.500 -10.157 1.00 0.00 O ATOM 0 H SER A 146 12.291 -0.248 -10.834 1.00 0.00 H new ATOM 0 HA SER A 146 13.806 -2.730 -10.437 1.00 0.00 H new ATOM 0 HB2 SER A 146 14.662 -0.198 -11.074 1.00 0.00 H new ATOM 0 HB3 SER A 146 14.723 -0.086 -9.326 1.00 0.00 H new ATOM 0 HG SER A 146 16.714 -0.868 -10.225 1.00 0.00 H new ATOM 2265 N LYS A 147 12.776 -0.827 -7.948 1.00 0.00 N ATOM 2266 CA LYS A 147 12.461 -0.826 -6.519 1.00 0.00 C ATOM 2267 C LYS A 147 11.375 -1.819 -6.111 1.00 0.00 C ATOM 2268 O LYS A 147 11.566 -2.572 -5.171 1.00 0.00 O ATOM 2269 CB LYS A 147 12.050 0.578 -6.069 1.00 0.00 C ATOM 2270 CG LYS A 147 12.374 0.872 -4.608 1.00 0.00 C ATOM 2271 CD LYS A 147 11.191 0.572 -3.695 1.00 0.00 C ATOM 2272 CE LYS A 147 11.340 1.257 -2.341 1.00 0.00 C ATOM 2273 NZ LYS A 147 10.745 0.448 -1.235 1.00 0.00 N ATOM 0 H LYS A 147 12.662 0.080 -8.401 1.00 0.00 H new ATOM 0 HA LYS A 147 13.377 -1.145 -6.021 1.00 0.00 H new ATOM 0 HB2 LYS A 147 12.552 1.313 -6.698 1.00 0.00 H new ATOM 0 HB3 LYS A 147 10.979 0.701 -6.226 1.00 0.00 H new ATOM 0 HG2 LYS A 147 13.232 0.276 -4.299 1.00 0.00 H new ATOM 0 HG3 LYS A 147 12.659 1.919 -4.502 1.00 0.00 H new ATOM 0 HD2 LYS A 147 10.269 0.904 -4.172 1.00 0.00 H new ATOM 0 HD3 LYS A 147 11.105 -0.505 -3.551 1.00 0.00 H new ATOM 0 HE2 LYS A 147 12.397 1.429 -2.136 1.00 0.00 H new ATOM 0 HE3 LYS A 147 10.859 2.234 -2.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 10.511 1.071 -0.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 9.880 -0.020 -1.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 11.429 -0.271 -0.924 1.00 0.00 H new ATOM 2287 N GLN A 148 10.228 -1.794 -6.773 1.00 0.00 N ATOM 2288 CA GLN A 148 9.124 -2.675 -6.388 1.00 0.00 C ATOM 2289 C GLN A 148 9.506 -4.155 -6.378 1.00 0.00 C ATOM 2290 O GLN A 148 9.269 -4.854 -5.389 1.00 0.00 O ATOM 2291 CB GLN A 148 7.930 -2.463 -7.315 1.00 0.00 C ATOM 2292 CG GLN A 148 6.589 -2.612 -6.614 1.00 0.00 C ATOM 2293 CD GLN A 148 6.160 -4.059 -6.472 1.00 0.00 C ATOM 2294 OE1 GLN A 148 6.147 -4.786 -7.584 1.00 0.00 O flip ATOM 2295 NE2 GLN A 148 5.843 -4.519 -5.375 1.00 0.00 N flip ATOM 0 H GLN A 148 10.034 -1.185 -7.568 1.00 0.00 H new ATOM 0 HA GLN A 148 8.861 -2.405 -5.365 1.00 0.00 H new ATOM 0 HB2 GLN A 148 7.993 -1.468 -7.755 1.00 0.00 H new ATOM 0 HB3 GLN A 148 7.985 -3.179 -8.135 1.00 0.00 H new ATOM 0 HG2 GLN A 148 6.648 -2.156 -5.626 1.00 0.00 H new ATOM 0 HG3 GLN A 148 5.829 -2.065 -7.172 1.00 0.00 H new ATOM 0 HE21 GLN A 148 5.867 -3.925 -4.546 1.00 0.00 H new ATOM 0 HE22 GLN A 148 5.556 -5.494 -5.295 1.00 0.00 H new ATOM 2304 N LEU A 149 10.076 -4.640 -7.471 1.00 0.00 N ATOM 2305 CA LEU A 149 10.449 -6.048 -7.563 1.00 0.00 C ATOM 2306 C LEU A 149 11.704 -6.362 -6.753 1.00 0.00 C ATOM 2307 O LEU A 149 11.748 -7.356 -6.029 1.00 0.00 O ATOM 2308 CB LEU A 149 10.640 -6.450 -9.023 1.00 0.00 C ATOM 2309 CG LEU A 149 9.337 -6.605 -9.812 1.00 0.00 C ATOM 2310 CD1 LEU A 149 8.528 -7.779 -9.281 1.00 0.00 C ATOM 2311 CD2 LEU A 149 8.521 -5.321 -9.743 1.00 0.00 C ATOM 0 H LEU A 149 10.290 -4.087 -8.301 1.00 0.00 H new ATOM 0 HA LEU A 149 9.634 -6.632 -7.136 1.00 0.00 H new ATOM 0 HB2 LEU A 149 11.262 -5.702 -9.515 1.00 0.00 H new ATOM 0 HB3 LEU A 149 11.187 -7.392 -9.059 1.00 0.00 H new ATOM 0 HG LEU A 149 9.585 -6.803 -10.855 1.00 0.00 H new ATOM 0 HD11 LEU A 149 7.605 -7.874 -9.854 1.00 0.00 H new ATOM 0 HD12 LEU A 149 9.110 -8.695 -9.377 1.00 0.00 H new ATOM 0 HD13 LEU A 149 8.288 -7.610 -8.231 1.00 0.00 H new ATOM 0 HD21 LEU A 149 7.598 -5.446 -10.308 1.00 0.00 H new ATOM 0 HD22 LEU A 149 8.282 -5.097 -8.703 1.00 0.00 H new ATOM 0 HD23 LEU A 149 9.098 -4.500 -10.168 1.00 0.00 H new ATOM 2323 N THR A 150 12.721 -5.520 -6.877 1.00 0.00 N ATOM 2324 CA THR A 150 13.971 -5.728 -6.151 1.00 0.00 C ATOM 2325 C THR A 150 13.766 -5.574 -4.646 1.00 0.00 C ATOM 2326 O THR A 150 14.423 -6.244 -3.848 1.00 0.00 O ATOM 2327 CB THR A 150 15.034 -4.741 -6.634 1.00 0.00 C ATOM 2328 OG1 THR A 150 15.213 -4.843 -8.036 1.00 0.00 O ATOM 2329 CG2 THR A 150 16.384 -4.948 -5.983 1.00 0.00 C ATOM 0 H THR A 150 12.708 -4.690 -7.470 1.00 0.00 H new ATOM 0 HA THR A 150 14.309 -6.745 -6.349 1.00 0.00 H new ATOM 0 HB THR A 150 14.661 -3.756 -6.354 1.00 0.00 H new ATOM 0 HG1 THR A 150 14.597 -4.231 -8.490 1.00 0.00 H new ATOM 0 HG21 THR A 150 17.091 -4.215 -6.371 1.00 0.00 H new ATOM 0 HG22 THR A 150 16.290 -4.826 -4.904 1.00 0.00 H new ATOM 0 HG23 THR A 150 16.745 -5.952 -6.205 1.00 0.00 H new ATOM 2337 N TYR A 151 12.858 -4.683 -4.266 1.00 0.00 N ATOM 2338 CA TYR A 151 12.570 -4.427 -2.863 1.00 0.00 C ATOM 2339 C TYR A 151 11.882 -5.623 -2.214 1.00 0.00 C ATOM 2340 O TYR A 151 12.314 -6.101 -1.161 1.00 0.00 O ATOM 2341 CB TYR A 151 11.691 -3.185 -2.761 1.00 0.00 C ATOM 2342 CG TYR A 151 11.059 -2.954 -1.417 1.00 0.00 C ATOM 2343 CD1 TYR A 151 11.670 -3.371 -0.246 1.00 0.00 C ATOM 2344 CD2 TYR A 151 9.842 -2.305 -1.333 1.00 0.00 C ATOM 2345 CE1 TYR A 151 11.078 -3.146 0.978 1.00 0.00 C ATOM 2346 CE2 TYR A 151 9.242 -2.071 -0.122 1.00 0.00 C ATOM 2347 CZ TYR A 151 9.863 -2.494 1.039 1.00 0.00 C ATOM 2348 OH TYR A 151 9.271 -2.266 2.259 1.00 0.00 O ATOM 0 H TYR A 151 12.306 -4.123 -4.916 1.00 0.00 H new ATOM 0 HA TYR A 151 13.507 -4.262 -2.330 1.00 0.00 H new ATOM 0 HB2 TYR A 151 12.292 -2.312 -3.016 1.00 0.00 H new ATOM 0 HB3 TYR A 151 10.901 -3.257 -3.508 1.00 0.00 H new ATOM 0 HD1 TYR A 151 12.622 -3.879 -0.293 1.00 0.00 H new ATOM 0 HD2 TYR A 151 9.354 -1.976 -2.238 1.00 0.00 H new ATOM 0 HE1 TYR A 151 11.562 -3.478 1.885 1.00 0.00 H new ATOM 0 HE2 TYR A 151 8.292 -1.560 -0.075 1.00 0.00 H new ATOM 0 HH TYR A 151 9.686 -1.486 2.683 1.00 0.00 H new ATOM 2358 N LEU A 152 10.818 -6.116 -2.840 1.00 0.00 N ATOM 2359 CA LEU A 152 10.110 -7.256 -2.286 1.00 0.00 C ATOM 2360 C LEU A 152 10.953 -8.514 -2.409 1.00 0.00 C ATOM 2361 O LEU A 152 10.935 -9.375 -1.527 1.00 0.00 O ATOM 2362 CB LEU A 152 8.746 -7.447 -2.943 1.00 0.00 C ATOM 2363 CG LEU A 152 7.618 -7.683 -1.941 1.00 0.00 C ATOM 2364 CD1 LEU A 152 6.264 -7.667 -2.624 1.00 0.00 C ATOM 2365 CD2 LEU A 152 7.837 -8.994 -1.203 1.00 0.00 C ATOM 0 H LEU A 152 10.436 -5.751 -3.713 1.00 0.00 H new ATOM 0 HA LEU A 152 9.934 -7.057 -1.229 1.00 0.00 H new ATOM 0 HB2 LEU A 152 8.512 -6.566 -3.541 1.00 0.00 H new ATOM 0 HB3 LEU A 152 8.796 -8.293 -3.628 1.00 0.00 H new ATOM 0 HG LEU A 152 7.630 -6.869 -1.216 1.00 0.00 H new ATOM 0 HD11 LEU A 152 5.481 -7.838 -1.885 1.00 0.00 H new ATOM 0 HD12 LEU A 152 6.108 -6.699 -3.100 1.00 0.00 H new ATOM 0 HD13 LEU A 152 6.228 -8.453 -3.379 1.00 0.00 H new ATOM 0 HD21 LEU A 152 7.026 -9.151 -0.492 1.00 0.00 H new ATOM 0 HD22 LEU A 152 7.856 -9.816 -1.919 1.00 0.00 H new ATOM 0 HD23 LEU A 152 8.786 -8.957 -0.669 1.00 0.00 H new ATOM 2377 N GLU A 153 11.725 -8.605 -3.488 1.00 0.00 N ATOM 2378 CA GLU A 153 12.603 -9.747 -3.685 1.00 0.00 C ATOM 2379 C GLU A 153 13.582 -9.819 -2.518 1.00 0.00 C ATOM 2380 O GLU A 153 13.926 -10.900 -2.038 1.00 0.00 O ATOM 2381 CB GLU A 153 13.365 -9.624 -5.008 1.00 0.00 C ATOM 2382 CG GLU A 153 14.077 -10.901 -5.420 1.00 0.00 C ATOM 2383 CD GLU A 153 15.574 -10.836 -5.186 1.00 0.00 C ATOM 2384 OE1 GLU A 153 15.985 -10.664 -4.018 1.00 0.00 O ATOM 2385 OE2 GLU A 153 16.334 -10.956 -6.169 1.00 0.00 O ATOM 0 H GLU A 153 11.759 -7.907 -4.231 1.00 0.00 H new ATOM 0 HA GLU A 153 12.007 -10.658 -3.726 1.00 0.00 H new ATOM 0 HB2 GLU A 153 12.667 -9.337 -5.794 1.00 0.00 H new ATOM 0 HB3 GLU A 153 14.097 -8.821 -4.923 1.00 0.00 H new ATOM 0 HG2 GLU A 153 13.662 -11.740 -4.862 1.00 0.00 H new ATOM 0 HG3 GLU A 153 13.886 -11.095 -6.476 1.00 0.00 H new ATOM 2392 N LYS A 154 14.000 -8.642 -2.051 1.00 0.00 N ATOM 2393 CA LYS A 154 14.910 -8.532 -0.916 1.00 0.00 C ATOM 2394 C LYS A 154 14.162 -8.852 0.377 1.00 0.00 C ATOM 2395 O LYS A 154 14.756 -9.290 1.362 1.00 0.00 O ATOM 2396 CB LYS A 154 15.511 -7.118 -0.859 1.00 0.00 C ATOM 2397 CG LYS A 154 15.852 -6.631 0.546 1.00 0.00 C ATOM 2398 CD LYS A 154 14.633 -6.048 1.247 1.00 0.00 C ATOM 2399 CE LYS A 154 14.954 -4.724 1.927 1.00 0.00 C ATOM 2400 NZ LYS A 154 14.258 -4.584 3.240 1.00 0.00 N ATOM 0 H LYS A 154 13.718 -7.745 -2.447 1.00 0.00 H new ATOM 0 HA LYS A 154 15.724 -9.247 -1.035 1.00 0.00 H new ATOM 0 HB2 LYS A 154 16.416 -7.097 -1.467 1.00 0.00 H new ATOM 0 HB3 LYS A 154 14.807 -6.419 -1.311 1.00 0.00 H new ATOM 0 HG2 LYS A 154 16.249 -7.460 1.133 1.00 0.00 H new ATOM 0 HG3 LYS A 154 16.636 -5.876 0.490 1.00 0.00 H new ATOM 0 HD2 LYS A 154 13.832 -5.900 0.522 1.00 0.00 H new ATOM 0 HD3 LYS A 154 14.265 -6.758 1.988 1.00 0.00 H new ATOM 0 HE2 LYS A 154 16.031 -4.646 2.078 1.00 0.00 H new ATOM 0 HE3 LYS A 154 14.663 -3.901 1.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 13.745 -3.680 3.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 13.585 -5.368 3.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 14.958 -4.607 4.008 1.00 0.00 H new ATOM 2414 N TYR A 155 12.851 -8.628 0.357 1.00 0.00 N ATOM 2415 CA TYR A 155 12.005 -8.889 1.515 1.00 0.00 C ATOM 2416 C TYR A 155 11.960 -10.383 1.816 1.00 0.00 C ATOM 2417 O TYR A 155 11.947 -10.794 2.976 1.00 0.00 O ATOM 2418 CB TYR A 155 10.588 -8.378 1.239 1.00 0.00 C ATOM 2419 CG TYR A 155 9.975 -7.570 2.362 1.00 0.00 C ATOM 2420 CD1 TYR A 155 10.403 -7.709 3.677 1.00 0.00 C ATOM 2421 CD2 TYR A 155 8.955 -6.668 2.097 1.00 0.00 C ATOM 2422 CE1 TYR A 155 9.829 -6.968 4.695 1.00 0.00 C ATOM 2423 CE2 TYR A 155 8.377 -5.924 3.105 1.00 0.00 C ATOM 2424 CZ TYR A 155 8.816 -6.077 4.403 1.00 0.00 C ATOM 2425 OH TYR A 155 8.243 -5.338 5.412 1.00 0.00 O ATOM 0 H TYR A 155 12.350 -8.264 -0.454 1.00 0.00 H new ATOM 0 HA TYR A 155 12.421 -8.370 2.379 1.00 0.00 H new ATOM 0 HB2 TYR A 155 10.607 -7.765 0.338 1.00 0.00 H new ATOM 0 HB3 TYR A 155 9.943 -9.232 1.031 1.00 0.00 H new ATOM 0 HD1 TYR A 155 11.195 -8.406 3.908 1.00 0.00 H new ATOM 0 HD2 TYR A 155 8.607 -6.546 1.082 1.00 0.00 H new ATOM 0 HE1 TYR A 155 10.172 -7.086 5.712 1.00 0.00 H new ATOM 0 HE2 TYR A 155 7.585 -5.226 2.878 1.00 0.00 H new ATOM 0 HH TYR A 155 8.919 -4.752 5.812 1.00 0.00 H new ATOM 2435 N ARG A 156 11.941 -11.189 0.759 1.00 0.00 N ATOM 2436 CA ARG A 156 11.901 -12.639 0.905 1.00 0.00 C ATOM 2437 C ARG A 156 13.254 -13.253 0.549 1.00 0.00 C ATOM 2438 O ARG A 156 13.479 -13.664 -0.589 1.00 0.00 O ATOM 2439 CB ARG A 156 10.806 -13.233 0.017 1.00 0.00 C ATOM 2440 CG ARG A 156 10.010 -14.339 0.690 1.00 0.00 C ATOM 2441 CD ARG A 156 10.688 -15.690 0.533 1.00 0.00 C ATOM 2442 NE ARG A 156 11.429 -16.073 1.731 1.00 0.00 N ATOM 2443 CZ ARG A 156 11.807 -17.321 2.003 1.00 0.00 C ATOM 2444 NH1 ARG A 156 11.517 -18.306 1.164 1.00 0.00 N ATOM 2445 NH2 ARG A 156 12.478 -17.581 3.116 1.00 0.00 N ATOM 0 H ARG A 156 11.953 -10.862 -0.207 1.00 0.00 H new ATOM 0 HA ARG A 156 11.676 -12.872 1.946 1.00 0.00 H new ATOM 0 HB2 ARG A 156 10.124 -12.438 -0.285 1.00 0.00 H new ATOM 0 HB3 ARG A 156 11.261 -13.626 -0.892 1.00 0.00 H new ATOM 0 HG2 ARG A 156 9.893 -14.111 1.749 1.00 0.00 H new ATOM 0 HG3 ARG A 156 9.009 -14.381 0.260 1.00 0.00 H new ATOM 0 HD2 ARG A 156 9.937 -16.449 0.313 1.00 0.00 H new ATOM 0 HD3 ARG A 156 11.368 -15.658 -0.319 1.00 0.00 H new ATOM 0 HE ARG A 156 11.672 -15.342 2.399 1.00 0.00 H new ATOM 0 HH11 ARG A 156 11.002 -18.110 0.306 1.00 0.00 H new ATOM 0 HH12 ARG A 156 11.809 -19.260 1.377 1.00 0.00 H new ATOM 0 HH21 ARG A 156 12.704 -16.826 3.763 1.00 0.00 H new ATOM 0 HH22 ARG A 156 12.768 -18.536 3.325 1.00 0.00 H new ATOM 2459 N PRO A 157 14.178 -13.319 1.524 1.00 0.00 N ATOM 2460 CA PRO A 157 15.515 -13.882 1.309 1.00 0.00 C ATOM 2461 C PRO A 157 15.486 -15.393 1.108 1.00 0.00 C ATOM 2462 O PRO A 157 14.604 -16.081 1.621 1.00 0.00 O ATOM 2463 CB PRO A 157 16.261 -13.530 2.598 1.00 0.00 C ATOM 2464 CG PRO A 157 15.194 -13.395 3.628 1.00 0.00 C ATOM 2465 CD PRO A 157 13.992 -12.848 2.910 1.00 0.00 C ATOM 0 HA PRO A 157 15.981 -13.485 0.407 1.00 0.00 H new ATOM 0 HB2 PRO A 157 16.975 -14.308 2.867 1.00 0.00 H new ATOM 0 HB3 PRO A 157 16.825 -12.604 2.489 1.00 0.00 H new ATOM 0 HG2 PRO A 157 14.970 -14.358 4.086 1.00 0.00 H new ATOM 0 HG3 PRO A 157 15.508 -12.726 4.429 1.00 0.00 H new ATOM 0 HD2 PRO A 157 13.063 -13.222 3.340 1.00 0.00 H new ATOM 0 HD3 PRO A 157 13.953 -11.760 2.963 1.00 0.00 H new ATOM 2473 N LYS A 158 16.460 -15.902 0.363 1.00 0.00 N ATOM 2474 CA LYS A 158 16.555 -17.329 0.097 1.00 0.00 C ATOM 2475 C LYS A 158 18.014 -17.752 -0.028 1.00 0.00 C ATOM 2476 O LYS A 158 18.759 -17.218 -0.849 1.00 0.00 O ATOM 2477 CB LYS A 158 15.791 -17.683 -1.182 1.00 0.00 C ATOM 2478 CG LYS A 158 14.740 -18.763 -0.982 1.00 0.00 C ATOM 2479 CD LYS A 158 13.976 -19.041 -2.266 1.00 0.00 C ATOM 2480 CE LYS A 158 12.660 -18.281 -2.306 1.00 0.00 C ATOM 2481 NZ LYS A 158 12.870 -16.813 -2.441 1.00 0.00 N ATOM 0 H LYS A 158 17.197 -15.344 -0.068 1.00 0.00 H new ATOM 0 HA LYS A 158 16.108 -17.867 0.933 1.00 0.00 H new ATOM 0 HB2 LYS A 158 15.309 -16.785 -1.568 1.00 0.00 H new ATOM 0 HB3 LYS A 158 16.501 -18.014 -1.940 1.00 0.00 H new ATOM 0 HG2 LYS A 158 15.219 -19.679 -0.637 1.00 0.00 H new ATOM 0 HG3 LYS A 158 14.043 -18.454 -0.202 1.00 0.00 H new ATOM 0 HD2 LYS A 158 14.587 -18.758 -3.123 1.00 0.00 H new ATOM 0 HD3 LYS A 158 13.783 -20.110 -2.352 1.00 0.00 H new ATOM 0 HE2 LYS A 158 12.059 -18.640 -3.141 1.00 0.00 H new ATOM 0 HE3 LYS A 158 12.095 -18.485 -1.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 11.981 -16.361 -2.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 13.174 -16.420 -1.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 13.603 -16.631 -3.156 1.00 0.00 H new ATOM 2495 N GLN A 159 18.410 -18.713 0.793 1.00 0.00 N ATOM 2496 CA GLN A 159 19.779 -19.216 0.781 1.00 0.00 C ATOM 2497 C GLN A 159 20.100 -19.912 -0.539 1.00 0.00 C ATOM 2498 O GLN A 159 21.267 -20.067 -0.900 1.00 0.00 O ATOM 2499 CB GLN A 159 19.999 -20.180 1.949 1.00 0.00 C ATOM 2500 CG GLN A 159 21.332 -19.988 2.653 1.00 0.00 C ATOM 2501 CD GLN A 159 21.483 -20.879 3.871 1.00 0.00 C ATOM 2502 OE1 GLN A 159 21.281 -22.091 3.795 1.00 0.00 O ATOM 2503 NE2 GLN A 159 21.840 -20.281 5.002 1.00 0.00 N ATOM 0 H GLN A 159 17.802 -19.162 1.478 1.00 0.00 H new ATOM 0 HA GLN A 159 20.451 -18.364 0.888 1.00 0.00 H new ATOM 0 HB2 GLN A 159 19.194 -20.051 2.672 1.00 0.00 H new ATOM 0 HB3 GLN A 159 19.936 -21.204 1.581 1.00 0.00 H new ATOM 0 HG2 GLN A 159 22.141 -20.196 1.953 1.00 0.00 H new ATOM 0 HG3 GLN A 159 21.432 -18.946 2.956 1.00 0.00 H new ATOM 0 HE21 GLN A 159 21.997 -19.273 5.019 1.00 0.00 H new ATOM 0 HE22 GLN A 159 21.957 -20.829 5.854 1.00 0.00 H new ATOM 2512 N ARG A 160 19.061 -20.333 -1.256 1.00 0.00 N ATOM 2513 CA ARG A 160 19.240 -21.013 -2.533 1.00 0.00 C ATOM 2514 C ARG A 160 19.998 -20.131 -3.520 1.00 0.00 C ATOM 2515 O ARG A 160 20.722 -20.628 -4.383 1.00 0.00 O ATOM 2516 CB ARG A 160 17.881 -21.404 -3.120 1.00 0.00 C ATOM 2517 CG ARG A 160 17.413 -22.789 -2.698 1.00 0.00 C ATOM 2518 CD ARG A 160 16.066 -22.735 -1.994 1.00 0.00 C ATOM 2519 NE ARG A 160 16.197 -22.891 -0.547 1.00 0.00 N ATOM 2520 CZ ARG A 160 16.373 -24.063 0.060 1.00 0.00 C ATOM 2521 NH1 ARG A 160 16.437 -25.182 -0.650 1.00 0.00 N ATOM 2522 NH2 ARG A 160 16.484 -24.115 1.380 1.00 0.00 N ATOM 0 H ARG A 160 18.088 -20.215 -0.974 1.00 0.00 H new ATOM 0 HA ARG A 160 19.827 -21.915 -2.357 1.00 0.00 H new ATOM 0 HB2 ARG A 160 17.137 -20.669 -2.814 1.00 0.00 H new ATOM 0 HB3 ARG A 160 17.939 -21.365 -4.208 1.00 0.00 H new ATOM 0 HG2 ARG A 160 17.340 -23.432 -3.575 1.00 0.00 H new ATOM 0 HG3 ARG A 160 18.153 -23.237 -2.035 1.00 0.00 H new ATOM 0 HD2 ARG A 160 15.580 -21.784 -2.213 1.00 0.00 H new ATOM 0 HD3 ARG A 160 15.420 -23.521 -2.386 1.00 0.00 H new ATOM 0 HE ARG A 160 16.151 -22.053 0.032 1.00 0.00 H new ATOM 0 HH11 ARG A 160 16.351 -25.147 -1.666 1.00 0.00 H new ATOM 0 HH12 ARG A 160 16.572 -26.077 -0.180 1.00 0.00 H new ATOM 0 HH21 ARG A 160 16.435 -23.257 1.930 1.00 0.00 H new ATOM 0 HH22 ARG A 160 16.619 -25.013 1.845 1.00 0.00 H new ATOM 2536 N LEU A 161 19.829 -18.820 -3.386 1.00 0.00 N ATOM 2537 CA LEU A 161 20.499 -17.869 -4.267 1.00 0.00 C ATOM 2538 C LEU A 161 22.005 -17.874 -4.028 1.00 0.00 C ATOM 2539 O LEU A 161 22.794 -17.944 -4.971 1.00 0.00 O ATOM 2540 CB LEU A 161 19.941 -16.460 -4.051 1.00 0.00 C ATOM 2541 CG LEU A 161 18.503 -16.253 -4.527 1.00 0.00 C ATOM 2542 CD1 LEU A 161 17.788 -15.244 -3.642 1.00 0.00 C ATOM 2543 CD2 LEU A 161 18.484 -15.799 -5.980 1.00 0.00 C ATOM 0 H LEU A 161 19.234 -18.391 -2.677 1.00 0.00 H new ATOM 0 HA LEU A 161 20.312 -18.172 -5.297 1.00 0.00 H new ATOM 0 HB2 LEU A 161 19.993 -16.224 -2.988 1.00 0.00 H new ATOM 0 HB3 LEU A 161 20.585 -15.748 -4.567 1.00 0.00 H new ATOM 0 HG LEU A 161 17.976 -17.204 -4.457 1.00 0.00 H new ATOM 0 HD11 LEU A 161 16.766 -15.109 -3.996 1.00 0.00 H new ATOM 0 HD12 LEU A 161 17.771 -15.608 -2.615 1.00 0.00 H new ATOM 0 HD13 LEU A 161 18.314 -14.290 -3.680 1.00 0.00 H new ATOM 0 HD21 LEU A 161 17.453 -15.656 -6.303 1.00 0.00 H new ATOM 0 HD22 LEU A 161 19.027 -14.859 -6.075 1.00 0.00 H new ATOM 0 HD23 LEU A 161 18.958 -16.556 -6.604 1.00 0.00 H new ATOM 2555 N ARG A 162 22.398 -17.799 -2.760 1.00 0.00 N ATOM 2556 CA ARG A 162 23.810 -17.795 -2.395 1.00 0.00 C ATOM 2557 C ARG A 162 24.121 -18.919 -1.412 1.00 0.00 C ATOM 2558 O ARG A 162 23.475 -19.043 -0.370 1.00 0.00 O ATOM 2559 CB ARG A 162 24.197 -16.444 -1.788 1.00 0.00 C ATOM 2560 CG ARG A 162 25.442 -15.832 -2.411 1.00 0.00 C ATOM 2561 CD ARG A 162 26.580 -15.733 -1.409 1.00 0.00 C ATOM 2562 NE ARG A 162 26.484 -14.528 -0.589 1.00 0.00 N ATOM 2563 CZ ARG A 162 26.833 -13.314 -1.011 1.00 0.00 C ATOM 2564 NH1 ARG A 162 27.300 -13.140 -2.241 1.00 0.00 N ATOM 2565 NH2 ARG A 162 26.714 -12.271 -0.201 1.00 0.00 N ATOM 0 H ARG A 162 21.758 -17.740 -1.968 1.00 0.00 H new ATOM 0 HA ARG A 162 24.395 -17.958 -3.300 1.00 0.00 H new ATOM 0 HB2 ARG A 162 23.364 -15.751 -1.904 1.00 0.00 H new ATOM 0 HB3 ARG A 162 24.360 -16.569 -0.718 1.00 0.00 H new ATOM 0 HG2 ARG A 162 25.758 -16.436 -3.262 1.00 0.00 H new ATOM 0 HG3 ARG A 162 25.207 -14.839 -2.794 1.00 0.00 H new ATOM 0 HD2 ARG A 162 26.573 -16.612 -0.764 1.00 0.00 H new ATOM 0 HD3 ARG A 162 27.532 -15.735 -1.940 1.00 0.00 H new ATOM 0 HE ARG A 162 26.129 -14.622 0.363 1.00 0.00 H new ATOM 0 HH11 ARG A 162 27.393 -13.938 -2.869 1.00 0.00 H new ATOM 0 HH12 ARG A 162 27.566 -12.208 -2.559 1.00 0.00 H new ATOM 0 HH21 ARG A 162 26.355 -12.398 0.745 1.00 0.00 H new ATOM 0 HH22 ARG A 162 26.981 -11.341 -0.524 1.00 0.00 H new ATOM 2579 N PHE A 163 25.112 -19.738 -1.750 1.00 0.00 N ATOM 2580 CA PHE A 163 25.506 -20.853 -0.897 1.00 0.00 C ATOM 2581 C PHE A 163 26.342 -20.367 0.283 1.00 0.00 C ATOM 2582 O PHE A 163 25.962 -20.545 1.440 1.00 0.00 O ATOM 2583 CB PHE A 163 26.294 -21.886 -1.706 1.00 0.00 C ATOM 2584 CG PHE A 163 25.896 -23.305 -1.416 1.00 0.00 C ATOM 2585 CD1 PHE A 163 24.599 -23.735 -1.649 1.00 0.00 C ATOM 2586 CD2 PHE A 163 26.817 -24.209 -0.911 1.00 0.00 C ATOM 2587 CE1 PHE A 163 24.229 -25.041 -1.384 1.00 0.00 C ATOM 2588 CE2 PHE A 163 26.454 -25.514 -0.643 1.00 0.00 C ATOM 2589 CZ PHE A 163 25.158 -25.931 -0.881 1.00 0.00 C ATOM 0 H PHE A 163 25.656 -19.650 -2.608 1.00 0.00 H new ATOM 0 HA PHE A 163 24.601 -21.319 -0.509 1.00 0.00 H new ATOM 0 HB2 PHE A 163 26.153 -21.688 -2.769 1.00 0.00 H new ATOM 0 HB3 PHE A 163 27.357 -21.765 -1.497 1.00 0.00 H new ATOM 0 HD1 PHE A 163 23.869 -23.042 -2.042 1.00 0.00 H new ATOM 0 HD2 PHE A 163 27.831 -23.889 -0.725 1.00 0.00 H new ATOM 0 HE1 PHE A 163 23.216 -25.364 -1.570 1.00 0.00 H new ATOM 0 HE2 PHE A 163 27.182 -26.208 -0.248 1.00 0.00 H new ATOM 0 HZ PHE A 163 24.872 -26.952 -0.674 1.00 0.00 H new ATOM 2599 N LYS A 164 27.482 -19.753 -0.017 1.00 0.00 N ATOM 2600 CA LYS A 164 28.371 -19.242 1.020 1.00 0.00 C ATOM 2601 C LYS A 164 27.688 -18.144 1.829 1.00 0.00 C ATOM 2602 O LYS A 164 27.305 -17.106 1.288 1.00 0.00 O ATOM 2603 CB LYS A 164 29.662 -18.707 0.395 1.00 0.00 C ATOM 2604 CG LYS A 164 30.819 -19.691 0.455 1.00 0.00 C ATOM 2605 CD LYS A 164 31.753 -19.527 -0.733 1.00 0.00 C ATOM 2606 CE LYS A 164 33.186 -19.878 -0.367 1.00 0.00 C ATOM 2607 NZ LYS A 164 33.472 -21.325 -0.574 1.00 0.00 N ATOM 0 H LYS A 164 27.812 -19.597 -0.970 1.00 0.00 H new ATOM 0 HA LYS A 164 28.616 -20.064 1.693 1.00 0.00 H new ATOM 0 HB2 LYS A 164 29.471 -18.446 -0.646 1.00 0.00 H new ATOM 0 HB3 LYS A 164 29.950 -17.788 0.906 1.00 0.00 H new ATOM 0 HG2 LYS A 164 31.376 -19.543 1.380 1.00 0.00 H new ATOM 0 HG3 LYS A 164 30.431 -20.709 0.476 1.00 0.00 H new ATOM 0 HD2 LYS A 164 31.419 -20.165 -1.551 1.00 0.00 H new ATOM 0 HD3 LYS A 164 31.709 -18.499 -1.092 1.00 0.00 H new ATOM 0 HE2 LYS A 164 33.871 -19.282 -0.970 1.00 0.00 H new ATOM 0 HE3 LYS A 164 33.369 -19.617 0.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 34.459 -21.525 -0.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 32.835 -21.893 0.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 33.322 -21.569 -1.574 1.00 0.00 H new ATOM 2621 N ASP A 165 27.540 -18.380 3.128 1.00 0.00 N ATOM 2622 CA ASP A 165 26.905 -17.411 4.015 1.00 0.00 C ATOM 2623 C ASP A 165 27.949 -16.512 4.678 1.00 0.00 C ATOM 2624 O ASP A 165 28.631 -16.930 5.613 1.00 0.00 O ATOM 2625 CB ASP A 165 26.087 -18.133 5.086 1.00 0.00 C ATOM 2626 CG ASP A 165 24.807 -17.397 5.431 1.00 0.00 C ATOM 2627 OD1 ASP A 165 23.991 -17.163 4.514 1.00 0.00 O ATOM 2628 OD2 ASP A 165 24.619 -17.055 6.617 1.00 0.00 O ATOM 0 H ASP A 165 27.851 -19.234 3.591 1.00 0.00 H new ATOM 0 HA ASP A 165 26.242 -16.787 3.416 1.00 0.00 H new ATOM 0 HB2 ASP A 165 25.843 -19.137 4.738 1.00 0.00 H new ATOM 0 HB3 ASP A 165 26.691 -18.246 5.986 1.00 0.00 H new ATOM 2633 N PRO A 166 28.089 -15.259 4.205 1.00 0.00 N ATOM 2634 CA PRO A 166 29.058 -14.311 4.764 1.00 0.00 C ATOM 2635 C PRO A 166 28.683 -13.865 6.173 1.00 0.00 C ATOM 2636 O PRO A 166 27.644 -14.258 6.705 1.00 0.00 O ATOM 2637 CB PRO A 166 28.999 -13.126 3.796 1.00 0.00 C ATOM 2638 CG PRO A 166 27.647 -13.206 3.180 1.00 0.00 C ATOM 2639 CD PRO A 166 27.318 -14.671 3.093 1.00 0.00 C ATOM 0 HA PRO A 166 30.050 -14.752 4.858 1.00 0.00 H new ATOM 0 HB2 PRO A 166 29.140 -12.180 4.319 1.00 0.00 H new ATOM 0 HB3 PRO A 166 29.782 -13.192 3.041 1.00 0.00 H new ATOM 0 HG2 PRO A 166 26.911 -12.676 3.784 1.00 0.00 H new ATOM 0 HG3 PRO A 166 27.640 -12.745 2.192 1.00 0.00 H new ATOM 0 HD2 PRO A 166 26.249 -14.850 3.206 1.00 0.00 H new ATOM 0 HD3 PRO A 166 27.612 -15.093 2.132 1.00 0.00 H new ATOM 2647 N HIS A 167 29.538 -13.044 6.776 1.00 0.00 N ATOM 2648 CA HIS A 167 29.297 -12.545 8.124 1.00 0.00 C ATOM 2649 C HIS A 167 29.736 -11.089 8.253 1.00 0.00 C ATOM 2650 O HIS A 167 30.284 -10.511 7.314 1.00 0.00 O ATOM 2651 CB HIS A 167 30.040 -13.405 9.148 1.00 0.00 C ATOM 2652 CG HIS A 167 29.330 -13.518 10.462 1.00 0.00 C ATOM 2653 ND1 HIS A 167 29.666 -12.766 11.567 1.00 0.00 N ATOM 2654 CD2 HIS A 167 28.294 -14.302 10.845 1.00 0.00 C ATOM 2655 CE1 HIS A 167 28.872 -13.082 12.574 1.00 0.00 C ATOM 2656 NE2 HIS A 167 28.029 -14.012 12.162 1.00 0.00 N ATOM 0 H HIS A 167 30.404 -12.711 6.352 1.00 0.00 H new ATOM 0 HA HIS A 167 28.226 -12.601 8.319 1.00 0.00 H new ATOM 0 HB2 HIS A 167 30.185 -14.403 8.735 1.00 0.00 H new ATOM 0 HB3 HIS A 167 31.031 -12.982 9.315 1.00 0.00 H new ATOM 0 HD2 HIS A 167 27.773 -15.021 10.230 1.00 0.00 H new ATOM 0 HE1 HIS A 167 28.906 -12.653 13.565 1.00 0.00 H new ATOM 0 HE2 HIS A 167 27.300 -14.445 12.729 1.00 0.00 H new ATOM 2664 N THR A 168 29.490 -10.503 9.419 1.00 0.00 N ATOM 2665 CA THR A 168 29.860 -9.114 9.670 1.00 0.00 C ATOM 2666 C THR A 168 30.980 -9.028 10.701 1.00 0.00 C ATOM 2667 O THR A 168 30.932 -9.682 11.743 1.00 0.00 O ATOM 2668 CB THR A 168 28.644 -8.321 10.153 1.00 0.00 C ATOM 2669 OG1 THR A 168 27.500 -8.636 9.379 1.00 0.00 O ATOM 2670 CG2 THR A 168 28.844 -6.823 10.089 1.00 0.00 C ATOM 0 H THR A 168 29.036 -10.967 10.206 1.00 0.00 H new ATOM 0 HA THR A 168 30.218 -8.684 8.735 1.00 0.00 H new ATOM 0 HB THR A 168 28.506 -8.609 11.195 1.00 0.00 H new ATOM 0 HG1 THR A 168 26.733 -8.120 9.704 1.00 0.00 H new ATOM 0 HG21 THR A 168 27.945 -6.320 10.445 1.00 0.00 H new ATOM 0 HG22 THR A 168 29.690 -6.542 10.716 1.00 0.00 H new ATOM 0 HG23 THR A 168 29.042 -6.526 9.059 1.00 0.00 H new ATOM 2678 N HIS A 169 31.989 -8.215 10.402 1.00 0.00 N ATOM 2679 CA HIS A 169 33.123 -8.042 11.303 1.00 0.00 C ATOM 2680 C HIS A 169 33.103 -6.658 11.942 1.00 0.00 C ATOM 2681 O HIS A 169 32.339 -5.784 11.531 1.00 0.00 O ATOM 2682 CB HIS A 169 34.437 -8.251 10.548 1.00 0.00 C ATOM 2683 CG HIS A 169 34.979 -9.642 10.661 1.00 0.00 C ATOM 2684 ND1 HIS A 169 35.152 -10.287 11.868 1.00 0.00 N ATOM 2685 CD2 HIS A 169 35.387 -10.516 9.710 1.00 0.00 C ATOM 2686 CE1 HIS A 169 35.644 -11.494 11.656 1.00 0.00 C ATOM 2687 NE2 HIS A 169 35.794 -11.659 10.355 1.00 0.00 N ATOM 0 H HIS A 169 32.044 -7.666 9.544 1.00 0.00 H new ATOM 0 HA HIS A 169 33.045 -8.788 12.094 1.00 0.00 H new ATOM 0 HB2 HIS A 169 34.283 -8.015 9.495 1.00 0.00 H new ATOM 0 HB3 HIS A 169 35.180 -7.549 10.927 1.00 0.00 H new ATOM 0 HD2 HIS A 169 35.392 -10.346 8.643 1.00 0.00 H new ATOM 0 HE1 HIS A 169 35.883 -12.222 12.417 1.00 0.00 H new ATOM 0 HE2 HIS A 169 36.154 -12.499 9.902 1.00 0.00 H new ATOM 2695 N LYS A 170 33.947 -6.464 12.951 1.00 0.00 N ATOM 2696 CA LYS A 170 34.026 -5.185 13.646 1.00 0.00 C ATOM 2697 C LYS A 170 35.218 -5.156 14.598 1.00 0.00 C ATOM 2698 O LYS A 170 35.138 -5.649 15.724 1.00 0.00 O ATOM 2699 CB LYS A 170 32.730 -4.920 14.418 1.00 0.00 C ATOM 2700 CG LYS A 170 32.031 -3.635 14.008 1.00 0.00 C ATOM 2701 CD LYS A 170 30.840 -3.338 14.905 1.00 0.00 C ATOM 2702 CE LYS A 170 30.562 -1.845 14.985 1.00 0.00 C ATOM 2703 NZ LYS A 170 29.442 -1.441 14.089 1.00 0.00 N ATOM 0 H LYS A 170 34.585 -7.176 13.305 1.00 0.00 H new ATOM 0 HA LYS A 170 34.162 -4.401 12.901 1.00 0.00 H new ATOM 0 HB2 LYS A 170 32.049 -5.758 14.268 1.00 0.00 H new ATOM 0 HB3 LYS A 170 32.954 -4.878 15.484 1.00 0.00 H new ATOM 0 HG2 LYS A 170 32.737 -2.806 14.052 1.00 0.00 H new ATOM 0 HG3 LYS A 170 31.698 -3.715 12.973 1.00 0.00 H new ATOM 0 HD2 LYS A 170 29.958 -3.854 14.524 1.00 0.00 H new ATOM 0 HD3 LYS A 170 31.030 -3.728 15.905 1.00 0.00 H new ATOM 0 HE2 LYS A 170 30.320 -1.575 16.013 1.00 0.00 H new ATOM 0 HE3 LYS A 170 31.462 -1.293 14.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 170 29.283 -0.417 14.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 170 29.683 -1.675 13.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 170 28.577 -1.949 14.364 1.00 0.00 H new ATOM 2717 N THR A 171 36.322 -4.577 14.139 1.00 0.00 N ATOM 2718 CA THR A 171 37.531 -4.483 14.948 1.00 0.00 C ATOM 2719 C THR A 171 37.993 -3.035 15.074 1.00 0.00 C ATOM 2720 O THR A 171 38.443 -2.431 14.100 1.00 0.00 O ATOM 2721 CB THR A 171 38.645 -5.335 14.339 1.00 0.00 C ATOM 2722 OG1 THR A 171 38.163 -6.622 13.996 1.00 0.00 O ATOM 2723 CG2 THR A 171 39.831 -5.520 15.262 1.00 0.00 C ATOM 0 H THR A 171 36.404 -4.165 13.209 1.00 0.00 H new ATOM 0 HA THR A 171 37.300 -4.858 15.945 1.00 0.00 H new ATOM 0 HB THR A 171 38.975 -4.789 13.455 1.00 0.00 H new ATOM 0 HG1 THR A 171 38.890 -7.151 13.607 1.00 0.00 H new ATOM 0 HG21 THR A 171 40.584 -6.134 14.768 1.00 0.00 H new ATOM 0 HG22 THR A 171 40.258 -4.547 15.505 1.00 0.00 H new ATOM 0 HG23 THR A 171 39.506 -6.012 16.178 1.00 0.00 H new ATOM 2731 N ARG A 172 37.878 -2.485 16.277 1.00 0.00 N ATOM 2732 CA ARG A 172 38.284 -1.107 16.529 1.00 0.00 C ATOM 2733 C ARG A 172 39.795 -1.008 16.706 1.00 0.00 C ATOM 2734 O ARG A 172 40.455 -2.068 16.759 1.00 0.00 O ATOM 2735 CB ARG A 172 37.578 -0.565 17.774 1.00 0.00 C ATOM 2736 CG ARG A 172 36.079 -0.388 17.593 1.00 0.00 C ATOM 2737 CD ARG A 172 35.409 0.057 18.883 1.00 0.00 C ATOM 2738 NE ARG A 172 35.367 -1.014 19.877 1.00 0.00 N ATOM 2739 CZ ARG A 172 36.334 -1.250 20.762 1.00 0.00 C ATOM 2740 NH1 ARG A 172 37.430 -0.498 20.780 1.00 0.00 N ATOM 2741 NH2 ARG A 172 36.207 -2.242 21.632 1.00 0.00 N ATOM 2742 OXT ARG A 172 40.308 0.128 16.787 1.00 0.00 O ATOM 0 H ARG A 172 37.507 -2.972 17.093 1.00 0.00 H new ATOM 0 HA ARG A 172 37.997 -0.507 15.665 1.00 0.00 H new ATOM 0 HB2 ARG A 172 37.758 -1.244 18.608 1.00 0.00 H new ATOM 0 HB3 ARG A 172 38.019 0.395 18.043 1.00 0.00 H new ATOM 0 HG2 ARG A 172 35.891 0.348 16.812 1.00 0.00 H new ATOM 0 HG3 ARG A 172 35.639 -1.327 17.259 1.00 0.00 H new ATOM 0 HD2 ARG A 172 35.946 0.912 19.294 1.00 0.00 H new ATOM 0 HD3 ARG A 172 34.394 0.391 18.668 1.00 0.00 H new ATOM 0 HE ARG A 172 34.546 -1.619 19.894 1.00 0.00 H new ATOM 0 HH11 ARG A 172 37.535 0.266 20.113 1.00 0.00 H new ATOM 0 HH12 ARG A 172 38.166 -0.685 21.461 1.00 0.00 H new ATOM 0 HH21 ARG A 172 35.369 -2.824 21.623 1.00 0.00 H new ATOM 0 HH22 ARG A 172 36.947 -2.424 22.310 1.00 0.00 H new TER 2756 ARG A 172