USER MOD reduce.3.24.130724 H: found=0, std=0, add=1046, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1045 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 120 CYS SG : rot -91:sc= -6.29! USER MOD Set 1.2: A 127 CYS SG : rot 113:sc= -5.72! USER MOD Set 2.1: A 22 TYR OH : rot -140:sc= 0.8 USER MOD Set 2.2: A 105 SER OG : rot 163:sc= 1.99 USER MOD Set 3.1: A 103 LYS NZ :NH3+ -179:sc= 2.02 (180deg=1.95) USER MOD Set 3.2: A 122 MET CE :methyl 174:sc= -0.407 (180deg=-0.489) USER MOD Set 4.1: A 83 THR OG1 : rot -66:sc= 1.08 USER MOD Set 4.2: A 85 THR OG1 : rot 83:sc= 1.22 USER MOD Set 4.3: A 98 GLN : amide:sc= 0.0262 X(o=2.3,f=2.1) USER MOD Set 5.1: A 97 HIS : no HE2:sc= 0.391 K(o=0.39,f=-7.2!) USER MOD Set 5.2: A 106 THR OG1 : rot 180:sc= 0 USER MOD Set 6.1: A 55 LYS NZ :NH3+ -160:sc= 1.26 (180deg=0) USER MOD Set 6.2: A 64 GLN : amide:sc= 1.06 K(o=2.3,f=-6.5!) USER MOD Single : A 5 GLN : amide:sc= 0.128 K(o=0.13,f=-2.2!) USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 MET CE :methyl -170:sc= 0 (180deg=-0.199) USER MOD Single : A 24 LYS NZ :NH3+ 142:sc= 1.13 (180deg=-1.33!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 MET CE :methyl -179:sc= 0 (180deg=-0.000618) USER MOD Single : A 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ -148:sc= 2.43 (180deg=1.58) USER MOD Single : A 43 CYS SG : rot 180:sc= -0.0222 USER MOD Single : A 46 THR OG1 : rot 140:sc= -0.373 USER MOD Single : A 47 CYS SG : rot 41:sc= -1.82 USER MOD Single : A 50 LYS NZ :NH3+ 158:sc= 1.25 (180deg=1.1) USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot -140:sc= 0 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot -167:sc= 0.976 USER MOD Single : A 63 THR OG1 : rot 38:sc= 0.403 USER MOD Single : A 66 SER OG : rot 28:sc= 0.934 USER MOD Single : A 67 CYS SG : rot -43:sc= 0.196 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ -174:sc= 1.17 (180deg=0.99) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot -52:sc= 1.28 USER MOD Single : A 82 LYS NZ :NH3+ -176:sc= 1.1 (180deg=0.994) USER MOD Single : A 84 GLN : amide:sc=-0.00107 K(o=-0.0011,f=-2.3!) USER MOD Single : A 87 CYS SG : rot -150:sc= -2.09 USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 THR OG1 : rot -100:sc= 0.922 USER MOD Single : A 96 GLN : amide:sc= 1.31 K(o=1.3,f=-7.7!) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0.983 (180deg=0.983) USER MOD Single : A 112 LYS NZ :NH3+ 150:sc= 0 (180deg=-0.00495) USER MOD Single : A 115 LYS NZ :NH3+ 166:sc= 1.15 (180deg=1.02) USER MOD Single : A 123 ASN : amide:sc= 0.0547 X(o=0.055,f=0) USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot 180:sc= 0 USER MOD Single : A 131 TYR OH : rot 180:sc= 0.914 USER MOD Single : A 133 LYS NZ :NH3+ -145:sc= 2.22 (180deg=0.0116!) USER MOD ----------------------------------------------------------------- ATOM 14 N VAL A 4 -0.003 -1.310 -2.214 1.00 0.00 N ATOM 15 CA VAL A 4 0.953 -1.470 -3.365 1.00 0.00 C ATOM 16 C VAL A 4 2.239 -2.322 -3.047 1.00 0.00 C ATOM 17 O VAL A 4 2.687 -3.105 -3.890 1.00 0.00 O ATOM 18 CB VAL A 4 1.236 -0.082 -4.038 1.00 0.00 C ATOM 19 CG1 VAL A 4 2.101 0.896 -3.208 1.00 0.00 C ATOM 20 CG2 VAL A 4 1.864 -0.225 -5.442 1.00 0.00 C ATOM 0 HA VAL A 4 0.454 -2.092 -4.108 1.00 0.00 H new ATOM 0 HB VAL A 4 0.240 0.356 -4.110 1.00 0.00 H new ATOM 0 HG11 VAL A 4 2.236 1.824 -3.764 1.00 0.00 H new ATOM 0 HG12 VAL A 4 1.603 1.109 -2.262 1.00 0.00 H new ATOM 0 HG13 VAL A 4 3.074 0.445 -3.013 1.00 0.00 H new ATOM 0 HG21 VAL A 4 2.040 0.764 -5.864 1.00 0.00 H new ATOM 0 HG22 VAL A 4 2.810 -0.760 -5.364 1.00 0.00 H new ATOM 0 HG23 VAL A 4 1.185 -0.780 -6.089 1.00 0.00 H new ATOM 30 N GLN A 5 2.768 -2.231 -1.810 1.00 0.00 N ATOM 31 CA GLN A 5 3.768 -3.172 -1.231 1.00 0.00 C ATOM 32 C GLN A 5 3.511 -4.712 -1.401 1.00 0.00 C ATOM 33 O GLN A 5 4.468 -5.470 -1.566 1.00 0.00 O ATOM 34 CB GLN A 5 3.906 -2.820 0.277 1.00 0.00 C ATOM 35 CG GLN A 5 4.313 -1.364 0.642 1.00 0.00 C ATOM 36 CD GLN A 5 3.129 -0.480 1.047 1.00 0.00 C ATOM 37 OE1 GLN A 5 2.390 0.053 0.224 1.00 0.00 O ATOM 38 NE2 GLN A 5 2.883 -0.354 2.327 1.00 0.00 N ATOM 0 H GLN A 5 2.510 -1.485 -1.164 1.00 0.00 H new ATOM 0 HA GLN A 5 4.680 -3.022 -1.809 1.00 0.00 H new ATOM 0 HB2 GLN A 5 2.953 -3.034 0.760 1.00 0.00 H new ATOM 0 HB3 GLN A 5 4.643 -3.494 0.713 1.00 0.00 H new ATOM 0 HG2 GLN A 5 5.032 -1.391 1.460 1.00 0.00 H new ATOM 0 HG3 GLN A 5 4.818 -0.912 -0.212 1.00 0.00 H new ATOM 0 HE21 GLN A 5 3.497 -0.797 3.010 1.00 0.00 H new ATOM 0 HE22 GLN A 5 2.077 0.187 2.641 1.00 0.00 H new ATOM 47 N GLN A 6 2.242 -5.167 -1.388 1.00 0.00 N ATOM 48 CA GLN A 6 1.867 -6.578 -1.705 1.00 0.00 C ATOM 49 C GLN A 6 2.161 -7.091 -3.164 1.00 0.00 C ATOM 50 O GLN A 6 2.262 -8.305 -3.357 1.00 0.00 O ATOM 51 CB GLN A 6 0.356 -6.764 -1.377 1.00 0.00 C ATOM 52 CG GLN A 6 -0.095 -6.531 0.091 1.00 0.00 C ATOM 53 CD GLN A 6 -1.612 -6.632 0.278 1.00 0.00 C ATOM 54 OE1 GLN A 6 -2.361 -5.697 0.021 1.00 0.00 O ATOM 55 NE2 GLN A 6 -2.123 -7.755 0.724 1.00 0.00 N ATOM 0 H GLN A 6 1.443 -4.576 -1.159 1.00 0.00 H new ATOM 0 HA GLN A 6 2.521 -7.191 -1.086 1.00 0.00 H new ATOM 0 HB2 GLN A 6 -0.212 -6.087 -2.015 1.00 0.00 H new ATOM 0 HB3 GLN A 6 0.074 -7.778 -1.658 1.00 0.00 H new ATOM 0 HG2 GLN A 6 0.394 -7.262 0.735 1.00 0.00 H new ATOM 0 HG3 GLN A 6 0.240 -5.546 0.416 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -1.512 -8.542 0.942 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -3.131 -7.841 0.852 1.00 0.00 H new ATOM 64 N LEU A 7 2.297 -6.210 -4.178 1.00 0.00 N ATOM 65 CA LEU A 7 2.619 -6.616 -5.580 1.00 0.00 C ATOM 66 C LEU A 7 4.098 -7.055 -5.894 1.00 0.00 C ATOM 67 O LEU A 7 4.347 -7.474 -7.026 1.00 0.00 O ATOM 68 CB LEU A 7 2.225 -5.453 -6.546 1.00 0.00 C ATOM 69 CG LEU A 7 0.773 -4.899 -6.564 1.00 0.00 C ATOM 70 CD1 LEU A 7 0.644 -3.836 -7.665 1.00 0.00 C ATOM 71 CD2 LEU A 7 -0.307 -5.969 -6.792 1.00 0.00 C ATOM 0 H LEU A 7 2.189 -5.203 -4.059 1.00 0.00 H new ATOM 0 HA LEU A 7 2.037 -7.526 -5.728 1.00 0.00 H new ATOM 0 HB2 LEU A 7 2.886 -4.615 -6.327 1.00 0.00 H new ATOM 0 HB3 LEU A 7 2.455 -5.784 -7.559 1.00 0.00 H new ATOM 0 HG LEU A 7 0.601 -4.480 -5.572 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -0.374 -3.447 -7.678 1.00 0.00 H new ATOM 0 HD12 LEU A 7 1.341 -3.021 -7.468 1.00 0.00 H new ATOM 0 HD13 LEU A 7 0.874 -4.284 -8.632 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -1.291 -5.499 -6.790 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -0.139 -6.457 -7.752 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -0.258 -6.711 -5.995 1.00 0.00 H new ATOM 83 N GLU A 8 5.071 -6.958 -4.968 1.00 0.00 N ATOM 84 CA GLU A 8 6.512 -7.213 -5.256 1.00 0.00 C ATOM 85 C GLU A 8 6.941 -8.702 -5.495 1.00 0.00 C ATOM 86 O GLU A 8 6.229 -9.647 -5.149 1.00 0.00 O ATOM 87 CB GLU A 8 7.359 -6.507 -4.155 1.00 0.00 C ATOM 88 CG GLU A 8 7.284 -7.022 -2.688 1.00 0.00 C ATOM 89 CD GLU A 8 7.921 -8.376 -2.379 1.00 0.00 C ATOM 90 OE1 GLU A 8 9.164 -8.462 -2.372 1.00 0.00 O ATOM 91 OE2 GLU A 8 7.181 -9.355 -2.131 1.00 0.00 O ATOM 0 H GLU A 8 4.890 -6.701 -3.998 1.00 0.00 H new ATOM 0 HA GLU A 8 6.708 -6.785 -6.239 1.00 0.00 H new ATOM 0 HB2 GLU A 8 8.403 -6.553 -4.465 1.00 0.00 H new ATOM 0 HB3 GLU A 8 7.075 -5.455 -4.148 1.00 0.00 H new ATOM 0 HG2 GLU A 8 7.753 -6.276 -2.046 1.00 0.00 H new ATOM 0 HG3 GLU A 8 6.233 -7.073 -2.403 1.00 0.00 H new ATOM 98 N GLY A 9 8.141 -8.892 -6.072 1.00 0.00 N ATOM 99 CA GLY A 9 8.784 -10.228 -6.197 1.00 0.00 C ATOM 100 C GLY A 9 8.738 -10.857 -7.608 1.00 0.00 C ATOM 101 O GLY A 9 8.221 -10.269 -8.561 1.00 0.00 O ATOM 0 H GLY A 9 8.696 -8.132 -6.466 1.00 0.00 H new ATOM 0 HA2 GLY A 9 9.826 -10.141 -5.891 1.00 0.00 H new ATOM 0 HA3 GLY A 9 8.302 -10.911 -5.497 1.00 0.00 H new ATOM 105 N ARG A 10 9.303 -12.071 -7.737 1.00 0.00 N ATOM 106 CA ARG A 10 9.269 -12.846 -9.014 1.00 0.00 C ATOM 107 C ARG A 10 7.939 -13.652 -9.150 1.00 0.00 C ATOM 108 O ARG A 10 7.593 -14.453 -8.278 1.00 0.00 O ATOM 109 CB ARG A 10 10.528 -13.759 -9.087 1.00 0.00 C ATOM 110 CG ARG A 10 10.678 -14.564 -10.411 1.00 0.00 C ATOM 111 CD ARG A 10 11.903 -15.500 -10.490 1.00 0.00 C ATOM 112 NE ARG A 10 13.151 -14.781 -10.872 1.00 0.00 N ATOM 113 CZ ARG A 10 13.715 -14.774 -12.083 1.00 0.00 C ATOM 114 NH1 ARG A 10 13.217 -15.362 -13.147 1.00 0.00 N ATOM 115 NH2 ARG A 10 14.844 -14.136 -12.219 1.00 0.00 N ATOM 0 H ARG A 10 9.792 -12.546 -6.978 1.00 0.00 H new ATOM 0 HA ARG A 10 9.293 -12.160 -9.861 1.00 0.00 H new ATOM 0 HB2 ARG A 10 11.416 -13.141 -8.952 1.00 0.00 H new ATOM 0 HB3 ARG A 10 10.499 -14.461 -8.253 1.00 0.00 H new ATOM 0 HG2 ARG A 10 9.778 -15.161 -10.556 1.00 0.00 H new ATOM 0 HG3 ARG A 10 10.729 -13.858 -11.240 1.00 0.00 H new ATOM 0 HD2 ARG A 10 12.048 -15.984 -9.524 1.00 0.00 H new ATOM 0 HD3 ARG A 10 11.706 -16.289 -11.216 1.00 0.00 H new ATOM 0 HE ARG A 10 13.618 -14.244 -10.141 1.00 0.00 H new ATOM 0 HH11 ARG A 10 12.336 -15.871 -13.083 1.00 0.00 H new ATOM 0 HH12 ARG A 10 13.712 -15.309 -14.037 1.00 0.00 H new ATOM 0 HH21 ARG A 10 15.264 -13.666 -11.417 1.00 0.00 H new ATOM 0 HH22 ARG A 10 15.307 -14.107 -13.127 1.00 0.00 H new ATOM 129 N TRP A 11 7.230 -13.462 -10.273 1.00 0.00 N ATOM 130 CA TRP A 11 5.904 -14.092 -10.509 1.00 0.00 C ATOM 131 C TRP A 11 5.945 -14.860 -11.873 1.00 0.00 C ATOM 132 O TRP A 11 6.074 -14.229 -12.924 1.00 0.00 O ATOM 133 CB TRP A 11 4.796 -12.998 -10.495 1.00 0.00 C ATOM 134 CG TRP A 11 4.695 -12.050 -9.290 1.00 0.00 C ATOM 135 CD1 TRP A 11 5.191 -10.729 -9.241 1.00 0.00 C ATOM 136 CD2 TRP A 11 4.018 -12.230 -8.101 1.00 0.00 C ATOM 137 NE1 TRP A 11 4.838 -10.084 -8.048 1.00 0.00 N ATOM 138 CE2 TRP A 11 4.120 -11.031 -7.355 1.00 0.00 C ATOM 139 CE3 TRP A 11 3.245 -13.311 -7.613 1.00 0.00 C ATOM 140 CZ2 TRP A 11 3.458 -10.903 -6.116 1.00 0.00 C ATOM 141 CZ3 TRP A 11 2.614 -13.167 -6.376 1.00 0.00 C ATOM 142 CH2 TRP A 11 2.718 -11.984 -5.638 1.00 0.00 C ATOM 0 H TRP A 11 7.549 -12.874 -11.043 1.00 0.00 H new ATOM 0 HA TRP A 11 5.672 -14.806 -9.719 1.00 0.00 H new ATOM 0 HB2 TRP A 11 4.930 -12.384 -11.386 1.00 0.00 H new ATOM 0 HB3 TRP A 11 3.835 -13.503 -10.597 1.00 0.00 H new ATOM 0 HD1 TRP A 11 5.772 -10.271 -10.028 1.00 0.00 H new ATOM 0 HE1 TRP A 11 5.062 -9.132 -7.760 1.00 0.00 H new ATOM 0 HE3 TRP A 11 3.146 -14.223 -8.183 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 3.523 -9.986 -5.549 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 2.033 -13.987 -5.981 1.00 0.00 H new ATOM 0 HH2 TRP A 11 2.218 -11.906 -4.684 1.00 0.00 H new ATOM 153 N ARG A 12 5.842 -16.202 -11.876 1.00 0.00 N ATOM 154 CA ARG A 12 5.915 -17.036 -13.119 1.00 0.00 C ATOM 155 C ARG A 12 4.528 -17.272 -13.801 1.00 0.00 C ATOM 156 O ARG A 12 3.562 -17.642 -13.125 1.00 0.00 O ATOM 157 CB ARG A 12 6.626 -18.389 -12.815 1.00 0.00 C ATOM 158 CG ARG A 12 5.941 -19.350 -11.808 1.00 0.00 C ATOM 159 CD ARG A 12 6.609 -20.732 -11.725 1.00 0.00 C ATOM 160 NE ARG A 12 5.868 -21.492 -10.688 1.00 0.00 N ATOM 161 CZ ARG A 12 5.954 -22.792 -10.443 1.00 0.00 C ATOM 162 NH1 ARG A 12 6.823 -23.581 -11.022 1.00 0.00 N ATOM 163 NH2 ARG A 12 5.127 -23.301 -9.577 1.00 0.00 N ATOM 0 H ARG A 12 5.706 -16.750 -11.026 1.00 0.00 H new ATOM 0 HA ARG A 12 6.503 -16.469 -13.840 1.00 0.00 H new ATOM 0 HB2 ARG A 12 6.750 -18.923 -13.757 1.00 0.00 H new ATOM 0 HB3 ARG A 12 7.625 -18.167 -12.441 1.00 0.00 H new ATOM 0 HG2 ARG A 12 5.948 -18.892 -10.819 1.00 0.00 H new ATOM 0 HG3 ARG A 12 4.897 -19.477 -12.093 1.00 0.00 H new ATOM 0 HD2 ARG A 12 6.566 -21.243 -12.687 1.00 0.00 H new ATOM 0 HD3 ARG A 12 7.662 -20.639 -11.461 1.00 0.00 H new ATOM 0 HE ARG A 12 5.225 -20.958 -10.103 1.00 0.00 H new ATOM 0 HH11 ARG A 12 7.482 -23.202 -11.702 1.00 0.00 H new ATOM 0 HH12 ARG A 12 6.842 -24.575 -10.793 1.00 0.00 H new ATOM 0 HH21 ARG A 12 4.443 -22.704 -9.113 1.00 0.00 H new ATOM 0 HH22 ARG A 12 5.163 -24.297 -9.362 1.00 0.00 H new ATOM 177 N LEU A 13 4.435 -17.128 -15.140 1.00 0.00 N ATOM 178 CA LEU A 13 3.156 -17.350 -15.882 1.00 0.00 C ATOM 179 C LEU A 13 2.698 -18.847 -15.902 1.00 0.00 C ATOM 180 O LEU A 13 3.413 -19.726 -16.392 1.00 0.00 O ATOM 181 CB LEU A 13 3.284 -16.775 -17.323 1.00 0.00 C ATOM 182 CG LEU A 13 1.981 -16.721 -18.177 1.00 0.00 C ATOM 183 CD1 LEU A 13 0.882 -15.840 -17.559 1.00 0.00 C ATOM 184 CD2 LEU A 13 2.271 -16.205 -19.596 1.00 0.00 C ATOM 0 H LEU A 13 5.220 -16.861 -15.734 1.00 0.00 H new ATOM 0 HA LEU A 13 2.372 -16.817 -15.344 1.00 0.00 H new ATOM 0 HB2 LEU A 13 3.685 -15.764 -17.251 1.00 0.00 H new ATOM 0 HB3 LEU A 13 4.019 -17.372 -17.863 1.00 0.00 H new ATOM 0 HG LEU A 13 1.617 -17.748 -18.208 1.00 0.00 H new ATOM 0 HD11 LEU A 13 0.004 -15.847 -18.205 1.00 0.00 H new ATOM 0 HD12 LEU A 13 0.613 -16.229 -16.577 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.249 -14.819 -17.457 1.00 0.00 H new ATOM 0 HD21 LEU A 13 1.345 -16.178 -20.170 1.00 0.00 H new ATOM 0 HD22 LEU A 13 2.692 -15.201 -19.539 1.00 0.00 H new ATOM 0 HD23 LEU A 13 2.982 -16.870 -20.087 1.00 0.00 H new ATOM 196 N VAL A 14 1.486 -19.098 -15.384 1.00 0.00 N ATOM 197 CA VAL A 14 0.870 -20.461 -15.320 1.00 0.00 C ATOM 198 C VAL A 14 -0.379 -20.603 -16.259 1.00 0.00 C ATOM 199 O VAL A 14 -0.381 -21.503 -17.103 1.00 0.00 O ATOM 200 CB VAL A 14 0.653 -20.948 -13.841 1.00 0.00 C ATOM 201 CG1 VAL A 14 1.981 -21.371 -13.168 1.00 0.00 C ATOM 202 CG2 VAL A 14 -0.076 -19.961 -12.896 1.00 0.00 C ATOM 0 H VAL A 14 0.891 -18.368 -14.992 1.00 0.00 H new ATOM 0 HA VAL A 14 1.592 -21.165 -15.734 1.00 0.00 H new ATOM 0 HB VAL A 14 -0.012 -21.801 -13.973 1.00 0.00 H new ATOM 0 HG11 VAL A 14 1.783 -21.700 -12.148 1.00 0.00 H new ATOM 0 HG12 VAL A 14 2.431 -22.188 -13.732 1.00 0.00 H new ATOM 0 HG13 VAL A 14 2.666 -20.523 -13.149 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -0.167 -20.406 -11.905 1.00 0.00 H new ATOM 0 HG22 VAL A 14 0.495 -19.035 -12.827 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -1.069 -19.746 -13.290 1.00 0.00 H new ATOM 212 N ASP A 15 -1.414 -19.741 -16.150 1.00 0.00 N ATOM 213 CA ASP A 15 -2.510 -19.646 -17.164 1.00 0.00 C ATOM 214 C ASP A 15 -2.355 -18.333 -18.009 1.00 0.00 C ATOM 215 O ASP A 15 -2.021 -17.268 -17.480 1.00 0.00 O ATOM 216 CB ASP A 15 -3.877 -19.763 -16.434 1.00 0.00 C ATOM 217 CG ASP A 15 -5.134 -19.761 -17.316 1.00 0.00 C ATOM 218 OD1 ASP A 15 -5.059 -20.167 -18.497 1.00 0.00 O ATOM 219 OD2 ASP A 15 -6.207 -19.342 -16.830 1.00 0.00 O ATOM 0 H ASP A 15 -1.521 -19.094 -15.369 1.00 0.00 H new ATOM 0 HA ASP A 15 -2.453 -20.466 -17.880 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -3.873 -20.683 -15.850 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -3.957 -18.937 -15.727 1.00 0.00 H new ATOM 224 N SER A 16 -2.611 -18.419 -19.327 1.00 0.00 N ATOM 225 CA SER A 16 -2.559 -17.241 -20.246 1.00 0.00 C ATOM 226 C SER A 16 -3.780 -17.261 -21.215 1.00 0.00 C ATOM 227 O SER A 16 -3.712 -17.705 -22.367 1.00 0.00 O ATOM 228 CB SER A 16 -1.190 -17.226 -20.960 1.00 0.00 C ATOM 229 OG SER A 16 -0.929 -15.940 -21.526 1.00 0.00 O ATOM 0 H SER A 16 -2.858 -19.292 -19.792 1.00 0.00 H new ATOM 0 HA SER A 16 -2.640 -16.306 -19.691 1.00 0.00 H new ATOM 0 HB2 SER A 16 -0.402 -17.484 -20.252 1.00 0.00 H new ATOM 0 HB3 SER A 16 -1.175 -17.984 -21.744 1.00 0.00 H new ATOM 0 HG SER A 16 -0.057 -15.950 -21.973 1.00 0.00 H new ATOM 235 N LYS A 17 -4.934 -16.814 -20.703 1.00 0.00 N ATOM 236 CA LYS A 17 -6.261 -17.179 -21.266 1.00 0.00 C ATOM 237 C LYS A 17 -6.806 -16.045 -22.190 1.00 0.00 C ATOM 238 O LYS A 17 -7.302 -15.018 -21.714 1.00 0.00 O ATOM 239 CB LYS A 17 -7.150 -17.533 -20.043 1.00 0.00 C ATOM 240 CG LYS A 17 -8.470 -18.267 -20.371 1.00 0.00 C ATOM 241 CD LYS A 17 -9.152 -18.780 -19.084 1.00 0.00 C ATOM 242 CE LYS A 17 -10.381 -19.665 -19.362 1.00 0.00 C ATOM 243 NZ LYS A 17 -10.946 -20.116 -18.062 1.00 0.00 N ATOM 0 H LYS A 17 -4.986 -16.194 -19.894 1.00 0.00 H new ATOM 0 HA LYS A 17 -6.227 -18.041 -21.932 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -6.569 -18.154 -19.361 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -7.389 -16.612 -19.511 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -9.144 -17.593 -20.900 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -8.268 -19.105 -21.039 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -8.429 -19.347 -18.498 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -9.456 -17.927 -18.477 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -11.129 -19.107 -19.926 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -10.098 -20.524 -19.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -11.778 -20.716 -18.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -10.229 -20.660 -17.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -11.227 -19.288 -17.499 1.00 0.00 H new ATOM 257 N GLY A 18 -6.668 -16.235 -23.515 1.00 0.00 N ATOM 258 CA GLY A 18 -6.888 -15.150 -24.521 1.00 0.00 C ATOM 259 C GLY A 18 -5.651 -14.368 -25.044 1.00 0.00 C ATOM 260 O GLY A 18 -5.811 -13.260 -25.560 1.00 0.00 O ATOM 0 H GLY A 18 -6.404 -17.130 -23.927 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -7.390 -15.592 -25.382 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -7.578 -14.428 -24.085 1.00 0.00 H new ATOM 264 N PHE A 19 -4.433 -14.933 -24.957 1.00 0.00 N ATOM 265 CA PHE A 19 -3.175 -14.227 -25.335 1.00 0.00 C ATOM 266 C PHE A 19 -2.935 -14.060 -26.874 1.00 0.00 C ATOM 267 O PHE A 19 -2.686 -12.934 -27.315 1.00 0.00 O ATOM 268 CB PHE A 19 -2.018 -14.922 -24.563 1.00 0.00 C ATOM 269 CG PHE A 19 -0.704 -14.127 -24.520 1.00 0.00 C ATOM 270 CD1 PHE A 19 -0.588 -13.008 -23.687 1.00 0.00 C ATOM 271 CD2 PHE A 19 0.381 -14.507 -25.315 1.00 0.00 C ATOM 272 CE1 PHE A 19 0.595 -12.274 -23.660 1.00 0.00 C ATOM 273 CE2 PHE A 19 1.563 -13.771 -25.285 1.00 0.00 C ATOM 274 CZ PHE A 19 1.669 -12.655 -24.460 1.00 0.00 C ATOM 0 H PHE A 19 -4.283 -15.886 -24.626 1.00 0.00 H new ATOM 0 HA PHE A 19 -3.244 -13.181 -25.036 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -2.345 -15.112 -23.541 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -1.825 -15.892 -25.022 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -1.419 -12.713 -23.063 1.00 0.00 H new ATOM 0 HD2 PHE A 19 0.303 -15.374 -25.954 1.00 0.00 H new ATOM 0 HE1 PHE A 19 0.679 -11.409 -23.019 1.00 0.00 H new ATOM 0 HE2 PHE A 19 2.398 -14.067 -25.903 1.00 0.00 H new ATOM 0 HZ PHE A 19 2.585 -12.084 -24.440 1.00 0.00 H new ATOM 284 N ASP A 20 -3.049 -15.124 -27.696 1.00 0.00 N ATOM 285 CA ASP A 20 -3.099 -14.997 -29.186 1.00 0.00 C ATOM 286 C ASP A 20 -4.246 -14.106 -29.777 1.00 0.00 C ATOM 287 O ASP A 20 -3.994 -13.356 -30.724 1.00 0.00 O ATOM 288 CB ASP A 20 -3.076 -16.417 -29.822 1.00 0.00 C ATOM 289 CG ASP A 20 -1.707 -16.830 -30.349 1.00 0.00 C ATOM 290 OD1 ASP A 20 -1.272 -16.252 -31.371 1.00 0.00 O ATOM 291 OD2 ASP A 20 -1.076 -17.734 -29.773 1.00 0.00 O ATOM 0 H ASP A 20 -3.109 -16.086 -27.362 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.206 -14.436 -29.461 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.404 -17.144 -29.079 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -3.796 -16.451 -30.640 1.00 0.00 H new ATOM 296 N GLU A 21 -5.467 -14.128 -29.208 1.00 0.00 N ATOM 297 CA GLU A 21 -6.534 -13.130 -29.503 1.00 0.00 C ATOM 298 C GLU A 21 -6.149 -11.635 -29.229 1.00 0.00 C ATOM 299 O GLU A 21 -6.367 -10.778 -30.091 1.00 0.00 O ATOM 300 CB GLU A 21 -7.825 -13.562 -28.752 1.00 0.00 C ATOM 301 CG GLU A 21 -8.377 -14.985 -29.040 1.00 0.00 C ATOM 302 CD GLU A 21 -8.709 -15.277 -30.492 1.00 0.00 C ATOM 303 OE1 GLU A 21 -9.782 -14.874 -30.984 1.00 0.00 O ATOM 304 OE2 GLU A 21 -7.867 -15.880 -31.191 1.00 0.00 O ATOM 0 H GLU A 21 -5.749 -14.835 -28.529 1.00 0.00 H new ATOM 0 HA GLU A 21 -6.699 -13.138 -30.580 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.634 -13.485 -27.682 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.609 -12.842 -28.988 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -7.643 -15.716 -28.699 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -9.277 -15.134 -28.443 1.00 0.00 H new ATOM 311 N TYR A 22 -5.515 -11.328 -28.078 1.00 0.00 N ATOM 312 CA TYR A 22 -4.810 -10.033 -27.860 1.00 0.00 C ATOM 313 C TYR A 22 -3.680 -9.699 -28.893 1.00 0.00 C ATOM 314 O TYR A 22 -3.701 -8.600 -29.451 1.00 0.00 O ATOM 315 CB TYR A 22 -4.342 -9.994 -26.377 1.00 0.00 C ATOM 316 CG TYR A 22 -3.643 -8.706 -25.886 1.00 0.00 C ATOM 317 CD1 TYR A 22 -4.227 -7.453 -26.099 1.00 0.00 C ATOM 318 CD2 TYR A 22 -2.418 -8.782 -25.209 1.00 0.00 C ATOM 319 CE1 TYR A 22 -3.587 -6.297 -25.663 1.00 0.00 C ATOM 320 CE2 TYR A 22 -1.795 -7.620 -24.749 1.00 0.00 C ATOM 321 CZ TYR A 22 -2.387 -6.379 -24.972 1.00 0.00 C ATOM 322 OH TYR A 22 -1.825 -5.222 -24.498 1.00 0.00 O ATOM 0 H TYR A 22 -5.473 -11.959 -27.277 1.00 0.00 H new ATOM 0 HA TYR A 22 -5.515 -9.223 -28.050 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -5.213 -10.167 -25.744 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -3.660 -10.829 -26.217 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -5.179 -7.382 -26.604 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -1.954 -9.743 -25.042 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -4.027 -5.331 -25.864 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -0.855 -7.683 -24.221 1.00 0.00 H new ATOM 0 HH TYR A 22 -0.854 -5.254 -24.625 1.00 0.00 H new ATOM 332 N MET A 23 -2.738 -10.617 -29.185 1.00 0.00 N ATOM 333 CA MET A 23 -1.733 -10.424 -30.276 1.00 0.00 C ATOM 334 C MET A 23 -2.311 -10.252 -31.732 1.00 0.00 C ATOM 335 O MET A 23 -1.788 -9.438 -32.499 1.00 0.00 O ATOM 336 CB MET A 23 -0.634 -11.516 -30.197 1.00 0.00 C ATOM 337 CG MET A 23 0.180 -11.600 -28.885 1.00 0.00 C ATOM 338 SD MET A 23 1.591 -12.717 -29.058 1.00 0.00 S ATOM 339 CE MET A 23 0.780 -14.326 -29.059 1.00 0.00 C ATOM 0 H MET A 23 -2.643 -11.502 -28.687 1.00 0.00 H new ATOM 0 HA MET A 23 -1.288 -9.448 -30.082 1.00 0.00 H new ATOM 0 HB2 MET A 23 -1.106 -12.484 -30.365 1.00 0.00 H new ATOM 0 HB3 MET A 23 0.064 -11.354 -31.019 1.00 0.00 H new ATOM 0 HG2 MET A 23 0.532 -10.606 -28.609 1.00 0.00 H new ATOM 0 HG3 MET A 23 -0.464 -11.946 -28.077 1.00 0.00 H new ATOM 0 HE1 MET A 23 1.531 -15.112 -28.980 1.00 0.00 H new ATOM 0 HE2 MET A 23 0.098 -14.390 -28.212 1.00 0.00 H new ATOM 0 HE3 MET A 23 0.220 -14.451 -29.986 1.00 0.00 H new ATOM 349 N LYS A 24 -3.414 -10.935 -32.101 1.00 0.00 N ATOM 350 CA LYS A 24 -4.268 -10.563 -33.271 1.00 0.00 C ATOM 351 C LYS A 24 -4.819 -9.085 -33.255 1.00 0.00 C ATOM 352 O LYS A 24 -4.577 -8.352 -34.217 1.00 0.00 O ATOM 353 CB LYS A 24 -5.439 -11.588 -33.375 1.00 0.00 C ATOM 354 CG LYS A 24 -5.084 -13.002 -33.898 1.00 0.00 C ATOM 355 CD LYS A 24 -6.109 -14.108 -33.549 1.00 0.00 C ATOM 356 CE LYS A 24 -7.564 -13.845 -33.990 1.00 0.00 C ATOM 357 NZ LYS A 24 -8.419 -14.995 -33.592 1.00 0.00 N ATOM 0 H LYS A 24 -3.746 -11.761 -31.603 1.00 0.00 H new ATOM 0 HA LYS A 24 -3.626 -10.601 -34.151 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -5.887 -11.694 -32.387 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -6.203 -11.166 -34.028 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -4.978 -12.955 -34.982 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -4.113 -13.288 -33.495 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.776 -15.041 -34.003 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -6.099 -14.258 -32.469 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -7.934 -12.928 -33.532 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -7.608 -13.702 -35.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -9.346 -14.645 -33.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -8.547 -15.631 -34.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -7.963 -15.514 -32.815 1.00 0.00 H new ATOM 371 N GLU A 25 -5.525 -8.643 -32.188 1.00 0.00 N ATOM 372 CA GLU A 25 -6.016 -7.232 -32.038 1.00 0.00 C ATOM 373 C GLU A 25 -4.911 -6.116 -31.906 1.00 0.00 C ATOM 374 O GLU A 25 -5.062 -5.037 -32.493 1.00 0.00 O ATOM 375 CB GLU A 25 -7.092 -7.257 -30.909 1.00 0.00 C ATOM 376 CG GLU A 25 -7.794 -5.931 -30.489 1.00 0.00 C ATOM 377 CD GLU A 25 -8.392 -5.005 -31.545 1.00 0.00 C ATOM 378 OE1 GLU A 25 -8.726 -5.443 -32.663 1.00 0.00 O ATOM 379 OE2 GLU A 25 -8.434 -3.778 -31.291 1.00 0.00 O ATOM 0 H GLU A 25 -5.775 -9.244 -31.403 1.00 0.00 H new ATOM 0 HA GLU A 25 -6.464 -6.904 -32.976 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -7.870 -7.956 -31.215 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -6.621 -7.674 -30.018 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -8.597 -6.196 -29.801 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -7.068 -5.348 -29.923 1.00 0.00 H new ATOM 386 N LEU A 26 -3.776 -6.371 -31.222 1.00 0.00 N ATOM 387 CA LEU A 26 -2.510 -5.587 -31.400 1.00 0.00 C ATOM 388 C LEU A 26 -1.965 -5.461 -32.871 1.00 0.00 C ATOM 389 O LEU A 26 -1.512 -4.382 -33.265 1.00 0.00 O ATOM 390 CB LEU A 26 -1.393 -6.206 -30.502 1.00 0.00 C ATOM 391 CG LEU A 26 -1.500 -6.095 -28.959 1.00 0.00 C ATOM 392 CD1 LEU A 26 -0.363 -6.892 -28.294 1.00 0.00 C ATOM 393 CD2 LEU A 26 -1.442 -4.644 -28.461 1.00 0.00 C ATOM 0 H LEU A 26 -3.699 -7.119 -30.532 1.00 0.00 H new ATOM 0 HA LEU A 26 -2.774 -4.570 -31.108 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -1.326 -7.266 -30.749 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -0.448 -5.750 -30.797 1.00 0.00 H new ATOM 0 HG LEU A 26 -2.472 -6.504 -28.684 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -0.446 -6.809 -27.210 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.436 -7.940 -28.584 1.00 0.00 H new ATOM 0 HD13 LEU A 26 0.598 -6.492 -28.616 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -1.522 -4.629 -27.374 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -0.496 -4.194 -28.762 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -2.267 -4.078 -28.893 1.00 0.00 H new ATOM 405 N GLY A 27 -1.961 -6.562 -33.643 1.00 0.00 N ATOM 406 CA GLY A 27 -1.322 -6.630 -34.986 1.00 0.00 C ATOM 407 C GLY A 27 0.111 -7.203 -34.999 1.00 0.00 C ATOM 408 O GLY A 27 1.032 -6.546 -35.484 1.00 0.00 O ATOM 0 H GLY A 27 -2.400 -7.438 -33.359 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -1.947 -7.240 -35.638 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -1.300 -5.627 -35.412 1.00 0.00 H new ATOM 412 N VAL A 28 0.282 -8.427 -34.481 1.00 0.00 N ATOM 413 CA VAL A 28 1.625 -9.049 -34.269 1.00 0.00 C ATOM 414 C VAL A 28 1.964 -10.015 -35.455 1.00 0.00 C ATOM 415 O VAL A 28 1.125 -10.822 -35.878 1.00 0.00 O ATOM 416 CB VAL A 28 1.645 -9.761 -32.867 1.00 0.00 C ATOM 417 CG1 VAL A 28 2.951 -10.520 -32.536 1.00 0.00 C ATOM 418 CG2 VAL A 28 1.409 -8.815 -31.666 1.00 0.00 C ATOM 0 H VAL A 28 -0.494 -9.023 -34.194 1.00 0.00 H new ATOM 0 HA VAL A 28 2.405 -8.288 -34.261 1.00 0.00 H new ATOM 0 HB VAL A 28 0.817 -10.460 -32.987 1.00 0.00 H new ATOM 0 HG11 VAL A 28 2.867 -10.976 -31.550 1.00 0.00 H new ATOM 0 HG12 VAL A 28 3.119 -11.297 -33.282 1.00 0.00 H new ATOM 0 HG13 VAL A 28 3.789 -9.823 -32.543 1.00 0.00 H new ATOM 0 HG21 VAL A 28 1.439 -9.389 -30.740 1.00 0.00 H new ATOM 0 HG22 VAL A 28 2.187 -8.052 -31.646 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.434 -8.337 -31.765 1.00 0.00 H new ATOM 428 N GLY A 29 3.220 -9.981 -35.944 1.00 0.00 N ATOM 429 CA GLY A 29 3.690 -10.922 -37.005 1.00 0.00 C ATOM 430 C GLY A 29 3.727 -12.428 -36.626 1.00 0.00 C ATOM 431 O GLY A 29 3.878 -12.779 -35.457 1.00 0.00 O ATOM 0 H GLY A 29 3.930 -9.320 -35.630 1.00 0.00 H new ATOM 0 HA2 GLY A 29 3.045 -10.805 -37.876 1.00 0.00 H new ATOM 0 HA3 GLY A 29 4.693 -10.621 -37.308 1.00 0.00 H new ATOM 435 N ILE A 30 3.601 -13.330 -37.614 1.00 0.00 N ATOM 436 CA ILE A 30 3.425 -14.806 -37.364 1.00 0.00 C ATOM 437 C ILE A 30 4.534 -15.534 -36.521 1.00 0.00 C ATOM 438 O ILE A 30 4.206 -16.226 -35.551 1.00 0.00 O ATOM 439 CB ILE A 30 3.061 -15.597 -38.673 1.00 0.00 C ATOM 440 CG1 ILE A 30 4.055 -15.426 -39.861 1.00 0.00 C ATOM 441 CG2 ILE A 30 1.606 -15.320 -39.131 1.00 0.00 C ATOM 442 CD1 ILE A 30 4.086 -16.602 -40.852 1.00 0.00 C ATOM 0 H ILE A 30 3.615 -13.080 -38.603 1.00 0.00 H new ATOM 0 HA ILE A 30 2.567 -14.825 -36.693 1.00 0.00 H new ATOM 0 HB ILE A 30 3.152 -16.642 -38.376 1.00 0.00 H new ATOM 0 HG12 ILE A 30 3.796 -14.518 -40.405 1.00 0.00 H new ATOM 0 HG13 ILE A 30 5.058 -15.282 -39.459 1.00 0.00 H new ATOM 0 HG21 ILE A 30 1.396 -15.886 -40.039 1.00 0.00 H new ATOM 0 HG22 ILE A 30 0.913 -15.623 -38.346 1.00 0.00 H new ATOM 0 HG23 ILE A 30 1.484 -14.255 -39.331 1.00 0.00 H new ATOM 0 HD11 ILE A 30 4.806 -16.392 -41.643 1.00 0.00 H new ATOM 0 HD12 ILE A 30 4.378 -17.512 -40.328 1.00 0.00 H new ATOM 0 HD13 ILE A 30 3.096 -16.736 -41.288 1.00 0.00 H new ATOM 454 N ALA A 31 5.827 -15.348 -36.842 1.00 0.00 N ATOM 455 CA ALA A 31 6.949 -15.768 -35.955 1.00 0.00 C ATOM 456 C ALA A 31 7.009 -15.092 -34.541 1.00 0.00 C ATOM 457 O ALA A 31 7.294 -15.774 -33.554 1.00 0.00 O ATOM 458 CB ALA A 31 8.251 -15.563 -36.753 1.00 0.00 C ATOM 0 H ALA A 31 6.131 -14.909 -37.711 1.00 0.00 H new ATOM 0 HA ALA A 31 6.788 -16.814 -35.694 1.00 0.00 H new ATOM 0 HB1 ALA A 31 9.103 -15.859 -36.141 1.00 0.00 H new ATOM 0 HB2 ALA A 31 8.224 -16.173 -37.656 1.00 0.00 H new ATOM 0 HB3 ALA A 31 8.348 -14.513 -37.027 1.00 0.00 H new ATOM 464 N LEU A 32 6.695 -13.787 -34.436 1.00 0.00 N ATOM 465 CA LEU A 32 6.496 -13.088 -33.129 1.00 0.00 C ATOM 466 C LEU A 32 5.249 -13.555 -32.293 1.00 0.00 C ATOM 467 O LEU A 32 5.367 -13.697 -31.074 1.00 0.00 O ATOM 468 CB LEU A 32 6.544 -11.552 -33.381 1.00 0.00 C ATOM 469 CG LEU A 32 7.950 -10.983 -33.737 1.00 0.00 C ATOM 470 CD1 LEU A 32 7.843 -9.635 -34.465 1.00 0.00 C ATOM 471 CD2 LEU A 32 8.839 -10.819 -32.489 1.00 0.00 C ATOM 0 H LEU A 32 6.570 -13.179 -35.246 1.00 0.00 H new ATOM 0 HA LEU A 32 7.316 -13.377 -32.472 1.00 0.00 H new ATOM 0 HB2 LEU A 32 5.856 -11.311 -34.191 1.00 0.00 H new ATOM 0 HB3 LEU A 32 6.178 -11.042 -32.490 1.00 0.00 H new ATOM 0 HG LEU A 32 8.415 -11.711 -34.401 1.00 0.00 H new ATOM 0 HD11 LEU A 32 8.842 -9.267 -34.698 1.00 0.00 H new ATOM 0 HD12 LEU A 32 7.279 -9.764 -35.389 1.00 0.00 H new ATOM 0 HD13 LEU A 32 7.332 -8.916 -33.825 1.00 0.00 H new ATOM 0 HD21 LEU A 32 9.810 -10.420 -32.784 1.00 0.00 H new ATOM 0 HD22 LEU A 32 8.361 -10.133 -31.790 1.00 0.00 H new ATOM 0 HD23 LEU A 32 8.976 -11.788 -32.010 1.00 0.00 H new ATOM 483 N ARG A 33 4.097 -13.873 -32.922 1.00 0.00 N ATOM 484 CA ARG A 33 2.994 -14.660 -32.291 1.00 0.00 C ATOM 485 C ARG A 33 3.410 -16.077 -31.769 1.00 0.00 C ATOM 486 O ARG A 33 3.134 -16.387 -30.608 1.00 0.00 O ATOM 487 CB ARG A 33 1.771 -14.742 -33.253 1.00 0.00 C ATOM 488 CG ARG A 33 0.905 -13.455 -33.320 1.00 0.00 C ATOM 489 CD ARG A 33 -0.435 -13.520 -34.085 1.00 0.00 C ATOM 490 NE ARG A 33 -1.305 -14.612 -33.564 1.00 0.00 N ATOM 491 CZ ARG A 33 -2.140 -15.354 -34.281 1.00 0.00 C ATOM 492 NH1 ARG A 33 -2.483 -15.091 -35.516 1.00 0.00 N ATOM 493 NH2 ARG A 33 -2.637 -16.401 -33.699 1.00 0.00 N ATOM 0 H ARG A 33 3.897 -13.595 -33.883 1.00 0.00 H new ATOM 0 HA ARG A 33 2.715 -14.111 -31.391 1.00 0.00 H new ATOM 0 HB2 ARG A 33 2.131 -14.973 -34.256 1.00 0.00 H new ATOM 0 HB3 ARG A 33 1.138 -15.573 -32.942 1.00 0.00 H new ATOM 0 HG2 ARG A 33 0.691 -13.143 -32.298 1.00 0.00 H new ATOM 0 HG3 ARG A 33 1.510 -12.669 -33.773 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -0.954 -12.565 -33.996 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -0.243 -13.680 -35.146 1.00 0.00 H new ATOM 0 HE ARG A 33 -1.254 -14.807 -32.564 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -2.102 -14.271 -35.987 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -3.131 -15.706 -36.007 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -2.381 -16.619 -32.736 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -3.284 -17.006 -34.204 1.00 0.00 H new ATOM 507 N LYS A 34 4.110 -16.908 -32.570 1.00 0.00 N ATOM 508 CA LYS A 34 4.742 -18.164 -32.077 1.00 0.00 C ATOM 509 C LYS A 34 5.770 -17.984 -30.901 1.00 0.00 C ATOM 510 O LYS A 34 5.642 -18.679 -29.891 1.00 0.00 O ATOM 511 CB LYS A 34 5.303 -18.910 -33.314 1.00 0.00 C ATOM 512 CG LYS A 34 5.755 -20.355 -33.012 1.00 0.00 C ATOM 513 CD LYS A 34 6.280 -21.088 -34.264 1.00 0.00 C ATOM 514 CE LYS A 34 6.855 -22.495 -33.997 1.00 0.00 C ATOM 515 NZ LYS A 34 5.782 -23.473 -33.659 1.00 0.00 N ATOM 0 H LYS A 34 4.256 -16.736 -33.565 1.00 0.00 H new ATOM 0 HA LYS A 34 3.983 -18.775 -31.588 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.540 -18.932 -34.092 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.148 -18.350 -33.713 1.00 0.00 H new ATOM 0 HG2 LYS A 34 6.537 -20.336 -32.253 1.00 0.00 H new ATOM 0 HG3 LYS A 34 4.918 -20.913 -32.593 1.00 0.00 H new ATOM 0 HD2 LYS A 34 5.467 -21.174 -34.985 1.00 0.00 H new ATOM 0 HD3 LYS A 34 7.054 -20.477 -34.728 1.00 0.00 H new ATOM 0 HE2 LYS A 34 7.398 -22.840 -34.877 1.00 0.00 H new ATOM 0 HE3 LYS A 34 7.573 -22.445 -33.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 6.205 -24.407 -33.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 5.281 -23.157 -32.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 5.110 -23.539 -34.450 1.00 0.00 H new ATOM 529 N MET A 35 6.735 -17.045 -31.008 1.00 0.00 N ATOM 530 CA MET A 35 7.593 -16.590 -29.870 1.00 0.00 C ATOM 531 C MET A 35 6.824 -16.173 -28.567 1.00 0.00 C ATOM 532 O MET A 35 7.135 -16.696 -27.494 1.00 0.00 O ATOM 533 CB MET A 35 8.509 -15.472 -30.446 1.00 0.00 C ATOM 534 CG MET A 35 9.657 -14.958 -29.555 1.00 0.00 C ATOM 535 SD MET A 35 9.066 -14.041 -28.110 1.00 0.00 S ATOM 536 CE MET A 35 8.659 -12.441 -28.836 1.00 0.00 C ATOM 0 H MET A 35 6.949 -16.573 -31.887 1.00 0.00 H new ATOM 0 HA MET A 35 8.180 -17.430 -29.499 1.00 0.00 H new ATOM 0 HB2 MET A 35 8.944 -15.840 -31.375 1.00 0.00 H new ATOM 0 HB3 MET A 35 7.878 -14.621 -30.705 1.00 0.00 H new ATOM 0 HG2 MET A 35 10.259 -15.803 -29.222 1.00 0.00 H new ATOM 0 HG3 MET A 35 10.310 -14.315 -30.146 1.00 0.00 H new ATOM 0 HE1 MET A 35 8.299 -11.769 -28.057 1.00 0.00 H new ATOM 0 HE2 MET A 35 9.549 -12.015 -29.300 1.00 0.00 H new ATOM 0 HE3 MET A 35 7.883 -12.571 -29.590 1.00 0.00 H new ATOM 546 N GLY A 36 5.812 -15.286 -28.655 1.00 0.00 N ATOM 547 CA GLY A 36 4.881 -15.004 -27.526 1.00 0.00 C ATOM 548 C GLY A 36 4.070 -16.186 -26.935 1.00 0.00 C ATOM 549 O GLY A 36 4.013 -16.324 -25.712 1.00 0.00 O ATOM 0 H GLY A 36 5.612 -14.747 -29.497 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.462 -14.561 -26.717 1.00 0.00 H new ATOM 0 HA3 GLY A 36 4.172 -14.247 -27.860 1.00 0.00 H new ATOM 553 N ALA A 37 3.459 -17.029 -27.783 1.00 0.00 N ATOM 554 CA ALA A 37 2.738 -18.254 -27.343 1.00 0.00 C ATOM 555 C ALA A 37 3.584 -19.361 -26.622 1.00 0.00 C ATOM 556 O ALA A 37 3.138 -19.868 -25.590 1.00 0.00 O ATOM 557 CB ALA A 37 2.003 -18.785 -28.589 1.00 0.00 C ATOM 0 H ALA A 37 3.446 -16.889 -28.793 1.00 0.00 H new ATOM 0 HA ALA A 37 2.057 -17.971 -26.540 1.00 0.00 H new ATOM 0 HB1 ALA A 37 1.452 -19.689 -28.329 1.00 0.00 H new ATOM 0 HB2 ALA A 37 1.308 -18.028 -28.951 1.00 0.00 H new ATOM 0 HB3 ALA A 37 2.729 -19.014 -29.369 1.00 0.00 H new ATOM 563 N MET A 38 4.785 -19.729 -27.120 1.00 0.00 N ATOM 564 CA MET A 38 5.699 -20.682 -26.406 1.00 0.00 C ATOM 565 C MET A 38 6.579 -20.120 -25.221 1.00 0.00 C ATOM 566 O MET A 38 7.252 -20.902 -24.544 1.00 0.00 O ATOM 567 CB MET A 38 6.508 -21.469 -27.478 1.00 0.00 C ATOM 568 CG MET A 38 7.689 -20.753 -28.149 1.00 0.00 C ATOM 569 SD MET A 38 8.298 -21.799 -29.481 1.00 0.00 S ATOM 570 CE MET A 38 9.265 -20.582 -30.375 1.00 0.00 C ATOM 0 H MET A 38 5.153 -19.389 -28.008 1.00 0.00 H new ATOM 0 HA MET A 38 5.054 -21.350 -25.836 1.00 0.00 H new ATOM 0 HB2 MET A 38 6.888 -22.378 -27.011 1.00 0.00 H new ATOM 0 HB3 MET A 38 5.815 -21.779 -28.260 1.00 0.00 H new ATOM 0 HG2 MET A 38 7.375 -19.785 -28.539 1.00 0.00 H new ATOM 0 HG3 MET A 38 8.480 -20.562 -27.423 1.00 0.00 H new ATOM 0 HE1 MET A 38 9.725 -21.051 -31.245 1.00 0.00 H new ATOM 0 HE2 MET A 38 8.616 -19.770 -30.701 1.00 0.00 H new ATOM 0 HE3 MET A 38 10.043 -20.185 -29.723 1.00 0.00 H new ATOM 580 N ALA A 39 6.573 -18.801 -24.949 1.00 0.00 N ATOM 581 CA ALA A 39 7.311 -18.178 -23.821 1.00 0.00 C ATOM 582 C ALA A 39 6.662 -18.379 -22.410 1.00 0.00 C ATOM 583 O ALA A 39 5.464 -18.132 -22.230 1.00 0.00 O ATOM 584 CB ALA A 39 7.353 -16.672 -24.164 1.00 0.00 C ATOM 0 H ALA A 39 6.052 -18.126 -25.509 1.00 0.00 H new ATOM 0 HA ALA A 39 8.289 -18.650 -23.732 1.00 0.00 H new ATOM 0 HB1 ALA A 39 7.883 -16.134 -23.378 1.00 0.00 H new ATOM 0 HB2 ALA A 39 7.869 -16.529 -25.113 1.00 0.00 H new ATOM 0 HB3 ALA A 39 6.336 -16.288 -24.243 1.00 0.00 H new ATOM 590 N LYS A 40 7.473 -18.713 -21.383 1.00 0.00 N ATOM 591 CA LYS A 40 7.071 -18.528 -19.956 1.00 0.00 C ATOM 592 C LYS A 40 7.716 -17.224 -19.357 1.00 0.00 C ATOM 593 O LYS A 40 8.830 -17.306 -18.825 1.00 0.00 O ATOM 594 CB LYS A 40 7.289 -19.803 -19.087 1.00 0.00 C ATOM 595 CG LYS A 40 8.735 -20.334 -18.856 1.00 0.00 C ATOM 596 CD LYS A 40 9.066 -20.654 -17.367 1.00 0.00 C ATOM 597 CE LYS A 40 10.243 -19.882 -16.730 1.00 0.00 C ATOM 598 NZ LYS A 40 10.022 -18.409 -16.645 1.00 0.00 N ATOM 0 H LYS A 40 8.405 -19.110 -21.505 1.00 0.00 H new ATOM 0 HA LYS A 40 5.991 -18.379 -19.934 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.851 -19.610 -18.108 1.00 0.00 H new ATOM 0 HB3 LYS A 40 6.713 -20.610 -19.540 1.00 0.00 H new ATOM 0 HG2 LYS A 40 8.878 -21.236 -19.451 1.00 0.00 H new ATOM 0 HG3 LYS A 40 9.445 -19.594 -19.224 1.00 0.00 H new ATOM 0 HD2 LYS A 40 8.173 -20.462 -16.772 1.00 0.00 H new ATOM 0 HD3 LYS A 40 9.278 -21.720 -17.288 1.00 0.00 H new ATOM 0 HE2 LYS A 40 10.421 -20.272 -15.728 1.00 0.00 H new ATOM 0 HE3 LYS A 40 11.146 -20.072 -17.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 10.932 -17.915 -16.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 9.383 -18.109 -17.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 9.596 -18.174 -15.726 1.00 0.00 H new ATOM 612 N PRO A 41 7.088 -16.013 -19.369 1.00 0.00 N ATOM 613 CA PRO A 41 7.641 -14.827 -18.670 1.00 0.00 C ATOM 614 C PRO A 41 7.538 -14.885 -17.115 1.00 0.00 C ATOM 615 O PRO A 41 6.499 -15.219 -16.532 1.00 0.00 O ATOM 616 CB PRO A 41 6.823 -13.672 -19.267 1.00 0.00 C ATOM 617 CG PRO A 41 5.501 -14.305 -19.704 1.00 0.00 C ATOM 618 CD PRO A 41 5.880 -15.713 -20.158 1.00 0.00 C ATOM 0 HA PRO A 41 8.716 -14.733 -18.822 1.00 0.00 H new ATOM 0 HB2 PRO A 41 6.659 -12.884 -18.532 1.00 0.00 H new ATOM 0 HB3 PRO A 41 7.341 -13.217 -20.112 1.00 0.00 H new ATOM 0 HG2 PRO A 41 4.784 -14.333 -18.883 1.00 0.00 H new ATOM 0 HG3 PRO A 41 5.038 -13.739 -20.512 1.00 0.00 H new ATOM 0 HD2 PRO A 41 5.082 -16.428 -19.958 1.00 0.00 H new ATOM 0 HD3 PRO A 41 6.080 -15.750 -21.229 1.00 0.00 H new ATOM 626 N ASP A 42 8.640 -14.485 -16.478 1.00 0.00 N ATOM 627 CA ASP A 42 8.683 -14.212 -15.022 1.00 0.00 C ATOM 628 C ASP A 42 8.600 -12.670 -14.808 1.00 0.00 C ATOM 629 O ASP A 42 9.584 -11.941 -14.977 1.00 0.00 O ATOM 630 CB ASP A 42 9.958 -14.830 -14.395 1.00 0.00 C ATOM 631 CG ASP A 42 9.962 -16.335 -14.124 1.00 0.00 C ATOM 632 OD1 ASP A 42 9.085 -17.085 -14.609 1.00 0.00 O ATOM 633 OD2 ASP A 42 10.904 -16.787 -13.440 1.00 0.00 O ATOM 0 H ASP A 42 9.533 -14.338 -16.948 1.00 0.00 H new ATOM 0 HA ASP A 42 7.836 -14.677 -14.518 1.00 0.00 H new ATOM 0 HB2 ASP A 42 10.797 -14.606 -15.053 1.00 0.00 H new ATOM 0 HB3 ASP A 42 10.148 -14.319 -13.451 1.00 0.00 H new ATOM 638 N CYS A 43 7.411 -12.172 -14.432 1.00 0.00 N ATOM 639 CA CYS A 43 7.207 -10.742 -14.097 1.00 0.00 C ATOM 640 C CYS A 43 7.813 -10.412 -12.700 1.00 0.00 C ATOM 641 O CYS A 43 7.343 -10.912 -11.675 1.00 0.00 O ATOM 642 CB CYS A 43 5.688 -10.489 -14.191 1.00 0.00 C ATOM 643 SG CYS A 43 5.266 -8.759 -13.804 1.00 0.00 S ATOM 0 H CYS A 43 6.567 -12.739 -14.350 1.00 0.00 H new ATOM 0 HA CYS A 43 7.725 -10.076 -14.787 1.00 0.00 H new ATOM 0 HB2 CYS A 43 5.340 -10.732 -15.195 1.00 0.00 H new ATOM 0 HB3 CYS A 43 5.165 -11.153 -13.503 1.00 0.00 H new ATOM 0 HG CYS A 43 3.980 -8.595 -13.898 1.00 0.00 H new ATOM 649 N ILE A 44 8.885 -9.609 -12.672 1.00 0.00 N ATOM 650 CA ILE A 44 9.597 -9.247 -11.411 1.00 0.00 C ATOM 651 C ILE A 44 9.194 -7.779 -11.077 1.00 0.00 C ATOM 652 O ILE A 44 9.677 -6.837 -11.716 1.00 0.00 O ATOM 653 CB ILE A 44 11.148 -9.455 -11.519 1.00 0.00 C ATOM 654 CG1 ILE A 44 11.588 -10.892 -11.936 1.00 0.00 C ATOM 655 CG2 ILE A 44 11.882 -9.067 -10.206 1.00 0.00 C ATOM 656 CD1 ILE A 44 12.937 -10.923 -12.670 1.00 0.00 C ATOM 0 H ILE A 44 9.291 -9.188 -13.508 1.00 0.00 H new ATOM 0 HA ILE A 44 9.302 -9.908 -10.596 1.00 0.00 H new ATOM 0 HB ILE A 44 11.440 -8.783 -12.326 1.00 0.00 H new ATOM 0 HG12 ILE A 44 11.652 -11.518 -11.046 1.00 0.00 H new ATOM 0 HG13 ILE A 44 10.822 -11.327 -12.578 1.00 0.00 H new ATOM 0 HG21 ILE A 44 12.953 -9.227 -10.327 1.00 0.00 H new ATOM 0 HG22 ILE A 44 11.695 -8.017 -9.981 1.00 0.00 H new ATOM 0 HG23 ILE A 44 11.513 -9.684 -9.387 1.00 0.00 H new ATOM 0 HD11 ILE A 44 13.185 -11.952 -12.932 1.00 0.00 H new ATOM 0 HD12 ILE A 44 12.871 -10.323 -13.578 1.00 0.00 H new ATOM 0 HD13 ILE A 44 13.713 -10.517 -12.022 1.00 0.00 H new ATOM 668 N ILE A 45 8.321 -7.587 -10.076 1.00 0.00 N ATOM 669 CA ILE A 45 7.872 -6.226 -9.649 1.00 0.00 C ATOM 670 C ILE A 45 8.758 -5.763 -8.445 1.00 0.00 C ATOM 671 O ILE A 45 8.895 -6.458 -7.434 1.00 0.00 O ATOM 672 CB ILE A 45 6.326 -6.210 -9.364 1.00 0.00 C ATOM 673 CG1 ILE A 45 5.484 -6.483 -10.648 1.00 0.00 C ATOM 674 CG2 ILE A 45 5.839 -4.888 -8.705 1.00 0.00 C ATOM 675 CD1 ILE A 45 4.007 -6.843 -10.416 1.00 0.00 C ATOM 0 H ILE A 45 7.905 -8.348 -9.539 1.00 0.00 H new ATOM 0 HA ILE A 45 8.013 -5.499 -10.449 1.00 0.00 H new ATOM 0 HB ILE A 45 6.167 -7.022 -8.654 1.00 0.00 H new ATOM 0 HG12 ILE A 45 5.527 -5.598 -11.283 1.00 0.00 H new ATOM 0 HG13 ILE A 45 5.954 -7.296 -11.202 1.00 0.00 H new ATOM 0 HG21 ILE A 45 4.764 -4.941 -8.535 1.00 0.00 H new ATOM 0 HG22 ILE A 45 6.351 -4.746 -7.753 1.00 0.00 H new ATOM 0 HG23 ILE A 45 6.061 -4.049 -9.365 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.519 -7.012 -11.376 1.00 0.00 H new ATOM 0 HD12 ILE A 45 3.944 -7.748 -9.813 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.510 -6.024 -9.895 1.00 0.00 H new ATOM 687 N THR A 46 9.309 -4.547 -8.547 1.00 0.00 N ATOM 688 CA THR A 46 9.946 -3.836 -7.397 1.00 0.00 C ATOM 689 C THR A 46 9.154 -2.509 -7.168 1.00 0.00 C ATOM 690 O THR A 46 9.154 -1.619 -8.029 1.00 0.00 O ATOM 691 CB THR A 46 11.473 -3.616 -7.627 1.00 0.00 C ATOM 692 OG1 THR A 46 11.729 -3.050 -8.905 1.00 0.00 O ATOM 693 CG2 THR A 46 12.314 -4.900 -7.528 1.00 0.00 C ATOM 0 H THR A 46 9.333 -4.018 -9.419 1.00 0.00 H new ATOM 0 HA THR A 46 9.892 -4.441 -6.492 1.00 0.00 H new ATOM 0 HB THR A 46 11.768 -2.941 -6.823 1.00 0.00 H new ATOM 0 HG1 THR A 46 12.438 -2.377 -8.829 1.00 0.00 H new ATOM 0 HG21 THR A 46 13.364 -4.662 -7.700 1.00 0.00 H new ATOM 0 HG22 THR A 46 12.199 -5.335 -6.535 1.00 0.00 H new ATOM 0 HG23 THR A 46 11.976 -5.615 -8.279 1.00 0.00 H new ATOM 701 N CYS A 47 8.429 -2.401 -6.035 1.00 0.00 N ATOM 702 CA CYS A 47 7.474 -1.285 -5.798 1.00 0.00 C ATOM 703 C CYS A 47 8.039 -0.122 -4.918 1.00 0.00 C ATOM 704 O CYS A 47 8.225 -0.264 -3.705 1.00 0.00 O ATOM 705 CB CYS A 47 6.178 -1.908 -5.235 1.00 0.00 C ATOM 706 SG CYS A 47 6.486 -2.878 -3.719 1.00 0.00 S ATOM 0 H CYS A 47 8.483 -3.070 -5.267 1.00 0.00 H new ATOM 0 HA CYS A 47 7.272 -0.781 -6.743 1.00 0.00 H new ATOM 0 HB2 CYS A 47 5.460 -1.117 -5.019 1.00 0.00 H new ATOM 0 HB3 CYS A 47 5.727 -2.551 -5.991 1.00 0.00 H new ATOM 0 HG CYS A 47 7.344 -2.252 -2.970 1.00 0.00 H new ATOM 712 N ASP A 48 8.247 1.055 -5.538 1.00 0.00 N ATOM 713 CA ASP A 48 8.345 2.351 -4.827 1.00 0.00 C ATOM 714 C ASP A 48 6.907 2.953 -4.583 1.00 0.00 C ATOM 715 O ASP A 48 5.865 2.468 -5.041 1.00 0.00 O ATOM 716 CB ASP A 48 9.297 3.218 -5.722 1.00 0.00 C ATOM 717 CG ASP A 48 9.521 4.685 -5.330 1.00 0.00 C ATOM 718 OD1 ASP A 48 9.663 4.959 -4.121 1.00 0.00 O ATOM 719 OD2 ASP A 48 9.439 5.575 -6.205 1.00 0.00 O ATOM 0 H ASP A 48 8.353 1.138 -6.549 1.00 0.00 H new ATOM 0 HA ASP A 48 8.761 2.284 -3.822 1.00 0.00 H new ATOM 0 HB2 ASP A 48 10.270 2.727 -5.747 1.00 0.00 H new ATOM 0 HB3 ASP A 48 8.906 3.201 -6.739 1.00 0.00 H new ATOM 724 N GLY A 49 6.906 4.091 -3.885 1.00 0.00 N ATOM 725 CA GLY A 49 5.775 5.061 -3.919 1.00 0.00 C ATOM 726 C GLY A 49 5.343 5.645 -5.293 1.00 0.00 C ATOM 727 O GLY A 49 4.141 5.769 -5.536 1.00 0.00 O ATOM 0 H GLY A 49 7.676 4.378 -3.281 1.00 0.00 H new ATOM 0 HA2 GLY A 49 4.906 4.573 -3.478 1.00 0.00 H new ATOM 0 HA3 GLY A 49 6.035 5.897 -3.270 1.00 0.00 H new ATOM 731 N LYS A 50 6.295 5.996 -6.179 1.00 0.00 N ATOM 732 CA LYS A 50 5.989 6.287 -7.615 1.00 0.00 C ATOM 733 C LYS A 50 6.765 5.424 -8.662 1.00 0.00 C ATOM 734 O LYS A 50 6.146 4.963 -9.622 1.00 0.00 O ATOM 735 CB LYS A 50 6.042 7.803 -7.964 1.00 0.00 C ATOM 736 CG LYS A 50 4.887 8.670 -7.398 1.00 0.00 C ATOM 737 CD LYS A 50 4.937 10.174 -7.782 1.00 0.00 C ATOM 738 CE LYS A 50 4.671 10.562 -9.257 1.00 0.00 C ATOM 739 NZ LYS A 50 3.234 10.436 -9.637 1.00 0.00 N ATOM 0 H LYS A 50 7.282 6.088 -5.938 1.00 0.00 H new ATOM 0 HA LYS A 50 4.951 5.966 -7.707 1.00 0.00 H new ATOM 0 HB2 LYS A 50 6.986 8.207 -7.599 1.00 0.00 H new ATOM 0 HB3 LYS A 50 6.050 7.906 -9.049 1.00 0.00 H new ATOM 0 HG2 LYS A 50 3.940 8.255 -7.743 1.00 0.00 H new ATOM 0 HG3 LYS A 50 4.893 8.589 -6.311 1.00 0.00 H new ATOM 0 HD2 LYS A 50 4.210 10.700 -7.163 1.00 0.00 H new ATOM 0 HD3 LYS A 50 5.922 10.554 -7.510 1.00 0.00 H new ATOM 0 HE2 LYS A 50 4.997 11.589 -9.422 1.00 0.00 H new ATOM 0 HE3 LYS A 50 5.272 9.928 -9.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 3.040 11.034 -10.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 3.022 9.445 -9.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 2.637 10.741 -8.842 1.00 0.00 H new ATOM 753 N ASN A 51 8.088 5.251 -8.566 1.00 0.00 N ATOM 754 CA ASN A 51 8.926 4.692 -9.671 1.00 0.00 C ATOM 755 C ASN A 51 8.965 3.126 -9.627 1.00 0.00 C ATOM 756 O ASN A 51 9.885 2.509 -9.077 1.00 0.00 O ATOM 757 CB ASN A 51 10.352 5.306 -9.552 1.00 0.00 C ATOM 758 CG ASN A 51 10.460 6.834 -9.653 1.00 0.00 C ATOM 759 OD1 ASN A 51 10.315 7.431 -10.713 1.00 0.00 O ATOM 760 ND2 ASN A 51 10.700 7.507 -8.552 1.00 0.00 N ATOM 0 H ASN A 51 8.621 5.489 -7.730 1.00 0.00 H new ATOM 0 HA ASN A 51 8.491 4.956 -10.635 1.00 0.00 H new ATOM 0 HB2 ASN A 51 10.775 4.998 -8.596 1.00 0.00 H new ATOM 0 HB3 ASN A 51 10.976 4.869 -10.332 1.00 0.00 H new ATOM 0 HD21 ASN A 51 10.765 8.525 -8.580 1.00 0.00 H new ATOM 0 HD22 ASN A 51 10.821 7.012 -7.668 1.00 0.00 H new ATOM 767 N LEU A 52 7.938 2.473 -10.189 1.00 0.00 N ATOM 768 CA LEU A 52 7.682 1.024 -9.977 1.00 0.00 C ATOM 769 C LEU A 52 8.292 0.217 -11.161 1.00 0.00 C ATOM 770 O LEU A 52 7.874 0.355 -12.315 1.00 0.00 O ATOM 771 CB LEU A 52 6.148 0.896 -9.761 1.00 0.00 C ATOM 772 CG LEU A 52 5.616 -0.513 -9.377 1.00 0.00 C ATOM 773 CD1 LEU A 52 4.453 -0.408 -8.374 1.00 0.00 C ATOM 774 CD2 LEU A 52 5.139 -1.291 -10.609 1.00 0.00 C ATOM 0 H LEU A 52 7.259 2.924 -10.802 1.00 0.00 H new ATOM 0 HA LEU A 52 8.167 0.595 -9.100 1.00 0.00 H new ATOM 0 HB2 LEU A 52 5.854 1.596 -8.979 1.00 0.00 H new ATOM 0 HB3 LEU A 52 5.647 1.212 -10.676 1.00 0.00 H new ATOM 0 HG LEU A 52 6.447 -1.049 -8.919 1.00 0.00 H new ATOM 0 HD11 LEU A 52 4.099 -1.407 -8.122 1.00 0.00 H new ATOM 0 HD12 LEU A 52 4.797 0.094 -7.470 1.00 0.00 H new ATOM 0 HD13 LEU A 52 3.639 0.164 -8.819 1.00 0.00 H new ATOM 0 HD21 LEU A 52 4.774 -2.271 -10.302 1.00 0.00 H new ATOM 0 HD22 LEU A 52 4.335 -0.741 -11.098 1.00 0.00 H new ATOM 0 HD23 LEU A 52 5.969 -1.415 -11.305 1.00 0.00 H new ATOM 786 N THR A 53 9.336 -0.580 -10.883 1.00 0.00 N ATOM 787 CA THR A 53 10.160 -1.215 -11.956 1.00 0.00 C ATOM 788 C THR A 53 9.706 -2.685 -12.197 1.00 0.00 C ATOM 789 O THR A 53 9.757 -3.526 -11.292 1.00 0.00 O ATOM 790 CB THR A 53 11.676 -1.021 -11.663 1.00 0.00 C ATOM 791 OG1 THR A 53 11.976 0.372 -11.627 1.00 0.00 O ATOM 792 CG2 THR A 53 12.613 -1.635 -12.719 1.00 0.00 C ATOM 0 H THR A 53 9.638 -0.807 -9.935 1.00 0.00 H new ATOM 0 HA THR A 53 9.993 -0.714 -12.910 1.00 0.00 H new ATOM 0 HB THR A 53 11.849 -1.528 -10.714 1.00 0.00 H new ATOM 0 HG1 THR A 53 12.930 0.496 -11.441 1.00 0.00 H new ATOM 0 HG21 THR A 53 13.650 -1.453 -12.435 1.00 0.00 H new ATOM 0 HG22 THR A 53 12.437 -2.709 -12.781 1.00 0.00 H new ATOM 0 HG23 THR A 53 12.417 -1.178 -13.689 1.00 0.00 H new ATOM 800 N ILE A 54 9.265 -2.966 -13.437 1.00 0.00 N ATOM 801 CA ILE A 54 8.714 -4.293 -13.832 1.00 0.00 C ATOM 802 C ILE A 54 9.737 -4.928 -14.830 1.00 0.00 C ATOM 803 O ILE A 54 9.826 -4.525 -15.996 1.00 0.00 O ATOM 804 CB ILE A 54 7.246 -4.195 -14.395 1.00 0.00 C ATOM 805 CG1 ILE A 54 6.280 -3.411 -13.451 1.00 0.00 C ATOM 806 CG2 ILE A 54 6.681 -5.614 -14.683 1.00 0.00 C ATOM 807 CD1 ILE A 54 4.839 -3.194 -13.940 1.00 0.00 C ATOM 0 H ILE A 54 9.277 -2.287 -14.198 1.00 0.00 H new ATOM 0 HA ILE A 54 8.605 -4.943 -12.964 1.00 0.00 H new ATOM 0 HB ILE A 54 7.306 -3.629 -15.324 1.00 0.00 H new ATOM 0 HG12 ILE A 54 6.237 -3.939 -12.498 1.00 0.00 H new ATOM 0 HG13 ILE A 54 6.720 -2.433 -13.254 1.00 0.00 H new ATOM 0 HG21 ILE A 54 5.666 -5.530 -15.071 1.00 0.00 H new ATOM 0 HG22 ILE A 54 7.311 -6.114 -15.419 1.00 0.00 H new ATOM 0 HG23 ILE A 54 6.669 -6.195 -13.761 1.00 0.00 H new ATOM 0 HD11 ILE A 54 4.280 -2.637 -13.188 1.00 0.00 H new ATOM 0 HD12 ILE A 54 4.852 -2.631 -14.873 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.362 -4.160 -14.106 1.00 0.00 H new ATOM 819 N LYS A 55 10.499 -5.931 -14.361 1.00 0.00 N ATOM 820 CA LYS A 55 11.440 -6.706 -15.213 1.00 0.00 C ATOM 821 C LYS A 55 10.778 -8.060 -15.612 1.00 0.00 C ATOM 822 O LYS A 55 10.700 -8.990 -14.806 1.00 0.00 O ATOM 823 CB LYS A 55 12.783 -6.840 -14.446 1.00 0.00 C ATOM 824 CG LYS A 55 13.934 -7.482 -15.256 1.00 0.00 C ATOM 825 CD LYS A 55 15.171 -7.795 -14.385 1.00 0.00 C ATOM 826 CE LYS A 55 16.385 -8.298 -15.195 1.00 0.00 C ATOM 827 NZ LYS A 55 17.303 -7.181 -15.539 1.00 0.00 N ATOM 0 H LYS A 55 10.486 -6.232 -13.387 1.00 0.00 H new ATOM 0 HA LYS A 55 11.663 -6.203 -16.154 1.00 0.00 H new ATOM 0 HB2 LYS A 55 13.098 -5.849 -14.118 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.614 -7.435 -13.548 1.00 0.00 H new ATOM 0 HG2 LYS A 55 13.578 -8.402 -15.719 1.00 0.00 H new ATOM 0 HG3 LYS A 55 14.224 -6.810 -16.064 1.00 0.00 H new ATOM 0 HD2 LYS A 55 15.457 -6.897 -13.838 1.00 0.00 H new ATOM 0 HD3 LYS A 55 14.902 -8.548 -13.644 1.00 0.00 H new ATOM 0 HE2 LYS A 55 16.924 -9.050 -14.618 1.00 0.00 H new ATOM 0 HE3 LYS A 55 16.040 -8.783 -16.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 17.904 -7.460 -16.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 16.746 -6.342 -15.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 17.901 -6.958 -14.718 1.00 0.00 H new ATOM 841 N THR A 56 10.293 -8.167 -16.858 1.00 0.00 N ATOM 842 CA THR A 56 9.643 -9.414 -17.369 1.00 0.00 C ATOM 843 C THR A 56 10.711 -10.341 -18.029 1.00 0.00 C ATOM 844 O THR A 56 11.101 -10.101 -19.173 1.00 0.00 O ATOM 845 CB THR A 56 8.492 -9.002 -18.335 1.00 0.00 C ATOM 846 OG1 THR A 56 7.581 -8.117 -17.686 1.00 0.00 O ATOM 847 CG2 THR A 56 7.644 -10.156 -18.879 1.00 0.00 C ATOM 0 H THR A 56 10.332 -7.411 -17.542 1.00 0.00 H new ATOM 0 HA THR A 56 9.204 -9.996 -16.559 1.00 0.00 H new ATOM 0 HB THR A 56 9.018 -8.541 -19.171 1.00 0.00 H new ATOM 0 HG1 THR A 56 6.867 -7.868 -18.309 1.00 0.00 H new ATOM 0 HG21 THR A 56 6.873 -9.761 -19.540 1.00 0.00 H new ATOM 0 HG22 THR A 56 8.280 -10.845 -19.435 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.175 -10.685 -18.050 1.00 0.00 H new ATOM 855 N GLU A 57 11.179 -11.378 -17.314 1.00 0.00 N ATOM 856 CA GLU A 57 12.270 -12.277 -17.792 1.00 0.00 C ATOM 857 C GLU A 57 11.733 -13.515 -18.569 1.00 0.00 C ATOM 858 O GLU A 57 11.029 -14.366 -18.015 1.00 0.00 O ATOM 859 CB GLU A 57 13.133 -12.738 -16.580 1.00 0.00 C ATOM 860 CG GLU A 57 14.151 -11.692 -16.060 1.00 0.00 C ATOM 861 CD GLU A 57 15.434 -11.507 -16.864 1.00 0.00 C ATOM 862 OE1 GLU A 57 15.419 -11.591 -18.112 1.00 0.00 O ATOM 863 OE2 GLU A 57 16.469 -11.223 -16.228 1.00 0.00 O ATOM 0 H GLU A 57 10.821 -11.625 -16.391 1.00 0.00 H new ATOM 0 HA GLU A 57 12.880 -11.706 -18.492 1.00 0.00 H new ATOM 0 HB2 GLU A 57 12.466 -13.010 -15.762 1.00 0.00 H new ATOM 0 HB3 GLU A 57 13.675 -13.640 -16.863 1.00 0.00 H new ATOM 0 HG2 GLU A 57 13.646 -10.728 -16.004 1.00 0.00 H new ATOM 0 HG3 GLU A 57 14.427 -11.967 -15.042 1.00 0.00 H new ATOM 870 N SER A 58 12.118 -13.638 -19.847 1.00 0.00 N ATOM 871 CA SER A 58 11.839 -14.846 -20.669 1.00 0.00 C ATOM 872 C SER A 58 13.090 -15.212 -21.520 1.00 0.00 C ATOM 873 O SER A 58 13.759 -14.327 -22.068 1.00 0.00 O ATOM 874 CB SER A 58 10.614 -14.555 -21.566 1.00 0.00 C ATOM 875 OG SER A 58 10.238 -15.719 -22.300 1.00 0.00 O ATOM 0 H SER A 58 12.630 -12.912 -20.347 1.00 0.00 H new ATOM 0 HA SER A 58 11.617 -15.700 -20.028 1.00 0.00 H new ATOM 0 HB2 SER A 58 9.778 -14.221 -20.951 1.00 0.00 H new ATOM 0 HB3 SER A 58 10.847 -13.744 -22.256 1.00 0.00 H new ATOM 0 HG SER A 58 9.983 -15.463 -23.211 1.00 0.00 H new ATOM 881 N THR A 59 13.366 -16.515 -21.737 1.00 0.00 N ATOM 882 CA THR A 59 14.458 -16.967 -22.676 1.00 0.00 C ATOM 883 C THR A 59 14.113 -16.851 -24.217 1.00 0.00 C ATOM 884 O THR A 59 14.426 -17.730 -25.024 1.00 0.00 O ATOM 885 CB THR A 59 14.954 -18.398 -22.292 1.00 0.00 C ATOM 886 OG1 THR A 59 13.920 -19.360 -22.481 1.00 0.00 O ATOM 887 CG2 THR A 59 15.504 -18.564 -20.865 1.00 0.00 C ATOM 0 H THR A 59 12.863 -17.280 -21.287 1.00 0.00 H new ATOM 0 HA THR A 59 15.273 -16.257 -22.538 1.00 0.00 H new ATOM 0 HB THR A 59 15.795 -18.561 -22.966 1.00 0.00 H new ATOM 0 HG1 THR A 59 14.252 -20.249 -22.237 1.00 0.00 H new ATOM 0 HG21 THR A 59 15.817 -19.597 -20.714 1.00 0.00 H new ATOM 0 HG22 THR A 59 16.358 -17.902 -20.725 1.00 0.00 H new ATOM 0 HG23 THR A 59 14.727 -18.311 -20.144 1.00 0.00 H new ATOM 895 N LEU A 60 13.484 -15.731 -24.596 1.00 0.00 N ATOM 896 CA LEU A 60 13.055 -15.373 -25.975 1.00 0.00 C ATOM 897 C LEU A 60 13.017 -13.806 -26.099 1.00 0.00 C ATOM 898 O LEU A 60 13.662 -13.249 -26.993 1.00 0.00 O ATOM 899 CB LEU A 60 11.678 -16.013 -26.343 1.00 0.00 C ATOM 900 CG LEU A 60 11.628 -17.536 -26.637 1.00 0.00 C ATOM 901 CD1 LEU A 60 10.179 -18.018 -26.796 1.00 0.00 C ATOM 902 CD2 LEU A 60 12.416 -17.929 -27.899 1.00 0.00 C ATOM 0 H LEU A 60 13.243 -15.005 -23.921 1.00 0.00 H new ATOM 0 HA LEU A 60 13.774 -15.776 -26.688 1.00 0.00 H new ATOM 0 HB2 LEU A 60 10.988 -15.810 -25.524 1.00 0.00 H new ATOM 0 HB3 LEU A 60 11.294 -15.493 -27.220 1.00 0.00 H new ATOM 0 HG LEU A 60 12.095 -18.018 -25.778 1.00 0.00 H new ATOM 0 HD11 LEU A 60 10.172 -19.088 -27.001 1.00 0.00 H new ATOM 0 HD12 LEU A 60 9.627 -17.821 -25.877 1.00 0.00 H new ATOM 0 HD13 LEU A 60 9.708 -17.487 -27.623 1.00 0.00 H new ATOM 0 HD21 LEU A 60 12.344 -19.006 -28.052 1.00 0.00 H new ATOM 0 HD22 LEU A 60 12.001 -17.411 -28.763 1.00 0.00 H new ATOM 0 HD23 LEU A 60 13.462 -17.649 -27.776 1.00 0.00 H new ATOM 914 N LYS A 61 12.283 -13.086 -25.214 1.00 0.00 N ATOM 915 CA LYS A 61 12.400 -11.609 -25.069 1.00 0.00 C ATOM 916 C LYS A 61 12.244 -11.183 -23.573 1.00 0.00 C ATOM 917 O LYS A 61 11.161 -11.324 -22.995 1.00 0.00 O ATOM 918 CB LYS A 61 11.343 -10.914 -25.977 1.00 0.00 C ATOM 919 CG LYS A 61 11.539 -9.392 -26.210 1.00 0.00 C ATOM 920 CD LYS A 61 12.812 -8.955 -26.975 1.00 0.00 C ATOM 921 CE LYS A 61 12.910 -9.506 -28.412 1.00 0.00 C ATOM 922 NZ LYS A 61 14.100 -8.932 -29.095 1.00 0.00 N ATOM 0 H LYS A 61 11.599 -13.506 -24.585 1.00 0.00 H new ATOM 0 HA LYS A 61 13.393 -11.292 -25.389 1.00 0.00 H new ATOM 0 HB2 LYS A 61 11.342 -11.412 -26.946 1.00 0.00 H new ATOM 0 HB3 LYS A 61 10.358 -11.070 -25.538 1.00 0.00 H new ATOM 0 HG2 LYS A 61 10.672 -9.019 -26.755 1.00 0.00 H new ATOM 0 HG3 LYS A 61 11.542 -8.898 -25.238 1.00 0.00 H new ATOM 0 HD2 LYS A 61 12.843 -7.866 -27.013 1.00 0.00 H new ATOM 0 HD3 LYS A 61 13.688 -9.279 -26.414 1.00 0.00 H new ATOM 0 HE2 LYS A 61 12.982 -10.593 -28.390 1.00 0.00 H new ATOM 0 HE3 LYS A 61 12.006 -9.258 -28.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 14.160 -9.308 -30.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 14.014 -7.896 -29.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 14.960 -9.190 -28.570 1.00 0.00 H new ATOM 936 N THR A 62 13.294 -10.590 -22.973 1.00 0.00 N ATOM 937 CA THR A 62 13.173 -9.872 -21.664 1.00 0.00 C ATOM 938 C THR A 62 12.700 -8.398 -21.914 1.00 0.00 C ATOM 939 O THR A 62 13.387 -7.626 -22.591 1.00 0.00 O ATOM 940 CB THR A 62 14.487 -9.978 -20.821 1.00 0.00 C ATOM 941 OG1 THR A 62 14.663 -11.330 -20.392 1.00 0.00 O ATOM 942 CG2 THR A 62 14.542 -9.111 -19.545 1.00 0.00 C ATOM 0 H THR A 62 14.237 -10.587 -23.362 1.00 0.00 H new ATOM 0 HA THR A 62 12.410 -10.356 -21.054 1.00 0.00 H new ATOM 0 HB THR A 62 15.265 -9.616 -21.493 1.00 0.00 H new ATOM 0 HG1 THR A 62 15.362 -11.367 -19.706 1.00 0.00 H new ATOM 0 HG21 THR A 62 15.497 -9.265 -19.042 1.00 0.00 H new ATOM 0 HG22 THR A 62 14.439 -8.060 -19.815 1.00 0.00 H new ATOM 0 HG23 THR A 62 13.729 -9.395 -18.877 1.00 0.00 H new ATOM 950 N THR A 63 11.540 -8.011 -21.349 1.00 0.00 N ATOM 951 CA THR A 63 11.002 -6.618 -21.467 1.00 0.00 C ATOM 952 C THR A 63 11.048 -5.919 -20.071 1.00 0.00 C ATOM 953 O THR A 63 10.200 -6.183 -19.208 1.00 0.00 O ATOM 954 CB THR A 63 9.569 -6.550 -22.088 1.00 0.00 C ATOM 955 OG1 THR A 63 8.602 -7.138 -21.225 1.00 0.00 O ATOM 956 CG2 THR A 63 9.411 -7.197 -23.472 1.00 0.00 C ATOM 0 H THR A 63 10.947 -8.636 -20.803 1.00 0.00 H new ATOM 0 HA THR A 63 11.645 -6.084 -22.167 1.00 0.00 H new ATOM 0 HB THR A 63 9.405 -5.480 -22.213 1.00 0.00 H new ATOM 0 HG1 THR A 63 8.818 -6.920 -20.294 1.00 0.00 H new ATOM 0 HG21 THR A 63 8.379 -7.092 -23.807 1.00 0.00 H new ATOM 0 HG22 THR A 63 10.075 -6.704 -24.182 1.00 0.00 H new ATOM 0 HG23 THR A 63 9.667 -8.255 -23.410 1.00 0.00 H new ATOM 964 N GLN A 64 12.030 -5.026 -19.858 1.00 0.00 N ATOM 965 CA GLN A 64 12.172 -4.251 -18.594 1.00 0.00 C ATOM 966 C GLN A 64 11.669 -2.783 -18.767 1.00 0.00 C ATOM 967 O GLN A 64 12.112 -2.075 -19.676 1.00 0.00 O ATOM 968 CB GLN A 64 13.667 -4.320 -18.176 1.00 0.00 C ATOM 969 CG GLN A 64 13.984 -3.709 -16.785 1.00 0.00 C ATOM 970 CD GLN A 64 15.464 -3.785 -16.402 1.00 0.00 C ATOM 971 OE1 GLN A 64 15.994 -4.837 -16.055 1.00 0.00 O ATOM 972 NE2 GLN A 64 16.185 -2.690 -16.443 1.00 0.00 N ATOM 0 H GLN A 64 12.750 -4.815 -20.549 1.00 0.00 H new ATOM 0 HA GLN A 64 11.551 -4.679 -17.807 1.00 0.00 H new ATOM 0 HB2 GLN A 64 13.983 -5.363 -18.179 1.00 0.00 H new ATOM 0 HB3 GLN A 64 14.264 -3.804 -18.928 1.00 0.00 H new ATOM 0 HG2 GLN A 64 13.669 -2.666 -16.776 1.00 0.00 H new ATOM 0 HG3 GLN A 64 13.395 -4.227 -16.028 1.00 0.00 H new ATOM 0 HE21 GLN A 64 15.758 -1.809 -16.729 1.00 0.00 H new ATOM 0 HE22 GLN A 64 17.172 -2.720 -16.189 1.00 0.00 H new ATOM 981 N PHE A 65 10.786 -2.311 -17.865 1.00 0.00 N ATOM 982 CA PHE A 65 10.278 -0.906 -17.899 1.00 0.00 C ATOM 983 C PHE A 65 10.025 -0.313 -16.471 1.00 0.00 C ATOM 984 O PHE A 65 9.522 -0.984 -15.562 1.00 0.00 O ATOM 985 CB PHE A 65 9.055 -0.764 -18.856 1.00 0.00 C ATOM 986 CG PHE A 65 7.755 -1.495 -18.472 1.00 0.00 C ATOM 987 CD1 PHE A 65 7.564 -2.833 -18.834 1.00 0.00 C ATOM 988 CD2 PHE A 65 6.756 -0.827 -17.756 1.00 0.00 C ATOM 989 CE1 PHE A 65 6.393 -3.496 -18.477 1.00 0.00 C ATOM 990 CE2 PHE A 65 5.580 -1.487 -17.412 1.00 0.00 C ATOM 991 CZ PHE A 65 5.402 -2.822 -17.769 1.00 0.00 C ATOM 0 H PHE A 65 10.405 -2.872 -17.103 1.00 0.00 H new ATOM 0 HA PHE A 65 11.072 -0.289 -18.319 1.00 0.00 H new ATOM 0 HB2 PHE A 65 8.827 0.297 -18.953 1.00 0.00 H new ATOM 0 HB3 PHE A 65 9.358 -1.116 -19.842 1.00 0.00 H new ATOM 0 HD1 PHE A 65 8.328 -3.353 -19.393 1.00 0.00 H new ATOM 0 HD2 PHE A 65 6.898 0.205 -17.469 1.00 0.00 H new ATOM 0 HE1 PHE A 65 6.254 -4.532 -18.749 1.00 0.00 H new ATOM 0 HE2 PHE A 65 4.806 -0.965 -16.869 1.00 0.00 H new ATOM 0 HZ PHE A 65 4.492 -3.336 -17.495 1.00 0.00 H new ATOM 1001 N SER A 66 10.350 0.980 -16.303 1.00 0.00 N ATOM 1002 CA SER A 66 10.066 1.749 -15.061 1.00 0.00 C ATOM 1003 C SER A 66 8.758 2.581 -15.210 1.00 0.00 C ATOM 1004 O SER A 66 8.760 3.613 -15.895 1.00 0.00 O ATOM 1005 CB SER A 66 11.286 2.653 -14.756 1.00 0.00 C ATOM 1006 OG SER A 66 11.449 3.675 -15.744 1.00 0.00 O ATOM 0 H SER A 66 10.819 1.531 -17.022 1.00 0.00 H new ATOM 0 HA SER A 66 9.908 1.065 -14.227 1.00 0.00 H new ATOM 0 HB2 SER A 66 11.162 3.112 -13.775 1.00 0.00 H new ATOM 0 HB3 SER A 66 12.188 2.043 -14.711 1.00 0.00 H new ATOM 0 HG SER A 66 10.578 3.890 -16.139 1.00 0.00 H new ATOM 1012 N CYS A 67 7.658 2.148 -14.574 1.00 0.00 N ATOM 1013 CA CYS A 67 6.366 2.871 -14.650 1.00 0.00 C ATOM 1014 C CYS A 67 6.192 3.879 -13.476 1.00 0.00 C ATOM 1015 O CYS A 67 6.257 3.516 -12.297 1.00 0.00 O ATOM 1016 CB CYS A 67 5.224 1.843 -14.758 1.00 0.00 C ATOM 1017 SG CYS A 67 5.083 0.759 -13.304 1.00 0.00 S ATOM 0 H CYS A 67 7.631 1.304 -14.002 1.00 0.00 H new ATOM 0 HA CYS A 67 6.344 3.490 -15.547 1.00 0.00 H new ATOM 0 HB2 CYS A 67 4.282 2.372 -14.899 1.00 0.00 H new ATOM 0 HB3 CYS A 67 5.381 1.229 -15.645 1.00 0.00 H new ATOM 0 HG CYS A 67 6.269 0.380 -12.929 1.00 0.00 H new ATOM 1023 N THR A 68 5.984 5.165 -13.806 1.00 0.00 N ATOM 1024 CA THR A 68 5.804 6.240 -12.786 1.00 0.00 C ATOM 1025 C THR A 68 4.298 6.305 -12.355 1.00 0.00 C ATOM 1026 O THR A 68 3.410 6.595 -13.162 1.00 0.00 O ATOM 1027 CB THR A 68 6.360 7.575 -13.363 1.00 0.00 C ATOM 1028 OG1 THR A 68 7.722 7.414 -13.748 1.00 0.00 O ATOM 1029 CG2 THR A 68 6.355 8.744 -12.370 1.00 0.00 C ATOM 0 H THR A 68 5.935 5.497 -14.769 1.00 0.00 H new ATOM 0 HA THR A 68 6.368 6.031 -11.877 1.00 0.00 H new ATOM 0 HB THR A 68 5.696 7.807 -14.196 1.00 0.00 H new ATOM 0 HG1 THR A 68 8.061 8.259 -14.111 1.00 0.00 H new ATOM 0 HG21 THR A 68 6.758 9.634 -12.854 1.00 0.00 H new ATOM 0 HG22 THR A 68 5.334 8.940 -12.043 1.00 0.00 H new ATOM 0 HG23 THR A 68 6.970 8.490 -11.506 1.00 0.00 H new ATOM 1037 N LEU A 69 4.019 6.000 -11.078 1.00 0.00 N ATOM 1038 CA LEU A 69 2.646 5.735 -10.579 1.00 0.00 C ATOM 1039 C LEU A 69 1.815 7.040 -10.376 1.00 0.00 C ATOM 1040 O LEU A 69 2.202 7.937 -9.620 1.00 0.00 O ATOM 1041 CB LEU A 69 2.812 4.933 -9.259 1.00 0.00 C ATOM 1042 CG LEU A 69 1.622 4.073 -8.795 1.00 0.00 C ATOM 1043 CD1 LEU A 69 1.382 2.876 -9.727 1.00 0.00 C ATOM 1044 CD2 LEU A 69 1.897 3.590 -7.359 1.00 0.00 C ATOM 0 H LEU A 69 4.735 5.928 -10.355 1.00 0.00 H new ATOM 0 HA LEU A 69 2.076 5.166 -11.314 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.677 4.279 -9.369 1.00 0.00 H new ATOM 0 HB3 LEU A 69 3.047 5.640 -8.463 1.00 0.00 H new ATOM 0 HG LEU A 69 0.718 4.681 -8.823 1.00 0.00 H new ATOM 0 HD11 LEU A 69 0.534 2.296 -9.363 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.171 3.236 -10.734 1.00 0.00 H new ATOM 0 HD13 LEU A 69 2.271 2.246 -9.746 1.00 0.00 H new ATOM 0 HD21 LEU A 69 1.063 2.979 -7.015 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.812 2.997 -7.343 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.011 4.451 -6.701 1.00 0.00 H new ATOM 1056 N GLY A 70 0.705 7.171 -11.112 1.00 0.00 N ATOM 1057 CA GLY A 70 0.108 8.497 -11.421 1.00 0.00 C ATOM 1058 C GLY A 70 0.916 9.360 -12.422 1.00 0.00 C ATOM 1059 O GLY A 70 1.281 10.489 -12.083 1.00 0.00 O ATOM 0 H GLY A 70 0.195 6.382 -11.509 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -0.894 8.343 -11.823 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -0.003 9.054 -10.491 1.00 0.00 H new ATOM 1063 N GLU A 71 1.204 8.804 -13.614 1.00 0.00 N ATOM 1064 CA GLU A 71 1.929 9.500 -14.716 1.00 0.00 C ATOM 1065 C GLU A 71 1.956 8.629 -16.025 1.00 0.00 C ATOM 1066 O GLU A 71 1.849 7.391 -15.990 1.00 0.00 O ATOM 1067 CB GLU A 71 3.366 9.977 -14.312 1.00 0.00 C ATOM 1068 CG GLU A 71 3.570 11.514 -14.379 1.00 0.00 C ATOM 1069 CD GLU A 71 3.565 12.133 -15.772 1.00 0.00 C ATOM 1070 OE1 GLU A 71 2.561 11.990 -16.505 1.00 0.00 O ATOM 1071 OE2 GLU A 71 4.569 12.779 -16.132 1.00 0.00 O ATOM 0 H GLU A 71 0.940 7.847 -13.851 1.00 0.00 H new ATOM 0 HA GLU A 71 1.361 10.407 -14.924 1.00 0.00 H new ATOM 0 HB2 GLU A 71 3.577 9.638 -13.298 1.00 0.00 H new ATOM 0 HB3 GLU A 71 4.093 9.497 -14.967 1.00 0.00 H new ATOM 0 HG2 GLU A 71 2.786 11.990 -13.790 1.00 0.00 H new ATOM 0 HG3 GLU A 71 4.519 11.755 -13.900 1.00 0.00 H new ATOM 1078 N LYS A 72 2.088 9.317 -17.181 1.00 0.00 N ATOM 1079 CA LYS A 72 2.052 8.693 -18.535 1.00 0.00 C ATOM 1080 C LYS A 72 3.449 8.693 -19.244 1.00 0.00 C ATOM 1081 O LYS A 72 4.060 9.742 -19.458 1.00 0.00 O ATOM 1082 CB LYS A 72 0.940 9.396 -19.371 1.00 0.00 C ATOM 1083 CG LYS A 72 0.540 8.627 -20.658 1.00 0.00 C ATOM 1084 CD LYS A 72 -0.865 8.923 -21.227 1.00 0.00 C ATOM 1085 CE LYS A 72 -0.994 10.230 -22.024 1.00 0.00 C ATOM 1086 NZ LYS A 72 -2.425 10.413 -22.394 1.00 0.00 N ATOM 0 H LYS A 72 2.224 10.328 -17.208 1.00 0.00 H new ATOM 0 HA LYS A 72 1.806 7.636 -18.437 1.00 0.00 H new ATOM 0 HB2 LYS A 72 0.056 9.524 -18.746 1.00 0.00 H new ATOM 0 HB3 LYS A 72 1.282 10.393 -19.647 1.00 0.00 H new ATOM 0 HG2 LYS A 72 1.275 8.849 -21.431 1.00 0.00 H new ATOM 0 HG3 LYS A 72 0.607 7.559 -20.452 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -1.159 8.094 -21.871 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -1.574 8.951 -20.400 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -0.645 11.074 -21.429 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -0.372 10.192 -22.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -2.519 11.238 -23.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -2.767 9.564 -22.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -2.989 10.565 -21.534 1.00 0.00 H new ATOM 1100 N PHE A 73 3.927 7.500 -19.640 1.00 0.00 N ATOM 1101 CA PHE A 73 5.267 7.301 -20.284 1.00 0.00 C ATOM 1102 C PHE A 73 5.167 6.504 -21.633 1.00 0.00 C ATOM 1103 O PHE A 73 4.173 5.818 -21.882 1.00 0.00 O ATOM 1104 CB PHE A 73 6.220 6.629 -19.238 1.00 0.00 C ATOM 1105 CG PHE A 73 5.920 5.164 -18.836 1.00 0.00 C ATOM 1106 CD1 PHE A 73 4.891 4.886 -17.932 1.00 0.00 C ATOM 1107 CD2 PHE A 73 6.596 4.103 -19.450 1.00 0.00 C ATOM 1108 CE1 PHE A 73 4.489 3.574 -17.709 1.00 0.00 C ATOM 1109 CE2 PHE A 73 6.210 2.787 -19.204 1.00 0.00 C ATOM 1110 CZ PHE A 73 5.145 2.525 -18.347 1.00 0.00 C ATOM 0 H PHE A 73 3.402 6.633 -19.528 1.00 0.00 H new ATOM 0 HA PHE A 73 5.686 8.266 -20.570 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.235 6.668 -19.634 1.00 0.00 H new ATOM 0 HB3 PHE A 73 6.207 7.236 -18.333 1.00 0.00 H new ATOM 0 HD1 PHE A 73 4.406 5.694 -17.404 1.00 0.00 H new ATOM 0 HD2 PHE A 73 7.421 4.305 -20.117 1.00 0.00 H new ATOM 0 HE1 PHE A 73 3.667 3.368 -17.040 1.00 0.00 H new ATOM 0 HE2 PHE A 73 6.736 1.971 -19.678 1.00 0.00 H new ATOM 0 HZ PHE A 73 4.827 1.507 -18.177 1.00 0.00 H new ATOM 1120 N GLU A 74 6.213 6.509 -22.490 1.00 0.00 N ATOM 1121 CA GLU A 74 6.310 5.511 -23.601 1.00 0.00 C ATOM 1122 C GLU A 74 6.803 4.117 -23.086 1.00 0.00 C ATOM 1123 O GLU A 74 7.985 3.900 -22.799 1.00 0.00 O ATOM 1124 CB GLU A 74 7.176 5.993 -24.801 1.00 0.00 C ATOM 1125 CG GLU A 74 6.424 6.839 -25.861 1.00 0.00 C ATOM 1126 CD GLU A 74 7.044 6.836 -27.255 1.00 0.00 C ATOM 1127 OE1 GLU A 74 8.273 7.017 -27.411 1.00 0.00 O ATOM 1128 OE2 GLU A 74 6.306 6.595 -28.233 1.00 0.00 O ATOM 0 H GLU A 74 6.988 7.171 -22.445 1.00 0.00 H new ATOM 0 HA GLU A 74 5.294 5.402 -23.979 1.00 0.00 H new ATOM 0 HB2 GLU A 74 8.009 6.581 -24.414 1.00 0.00 H new ATOM 0 HB3 GLU A 74 7.604 5.120 -25.293 1.00 0.00 H new ATOM 0 HG2 GLU A 74 5.400 6.472 -25.936 1.00 0.00 H new ATOM 0 HG3 GLU A 74 6.369 7.869 -25.508 1.00 0.00 H new ATOM 1135 N GLU A 75 5.872 3.156 -23.051 1.00 0.00 N ATOM 1136 CA GLU A 75 6.189 1.710 -23.108 1.00 0.00 C ATOM 1137 C GLU A 75 6.513 1.282 -24.581 1.00 0.00 C ATOM 1138 O GLU A 75 5.969 1.836 -25.540 1.00 0.00 O ATOM 1139 CB GLU A 75 4.935 1.021 -22.496 1.00 0.00 C ATOM 1140 CG GLU A 75 4.868 -0.525 -22.545 1.00 0.00 C ATOM 1141 CD GLU A 75 4.271 -1.173 -23.796 1.00 0.00 C ATOM 1142 OE1 GLU A 75 3.757 -0.471 -24.701 1.00 0.00 O ATOM 1143 OE2 GLU A 75 4.265 -2.420 -23.841 1.00 0.00 O ATOM 0 H GLU A 75 4.873 3.352 -22.982 1.00 0.00 H new ATOM 0 HA GLU A 75 7.081 1.424 -22.551 1.00 0.00 H new ATOM 0 HB2 GLU A 75 4.860 1.327 -21.453 1.00 0.00 H new ATOM 0 HB3 GLU A 75 4.055 1.411 -23.007 1.00 0.00 H new ATOM 0 HG2 GLU A 75 5.881 -0.908 -22.420 1.00 0.00 H new ATOM 0 HG3 GLU A 75 4.291 -0.863 -21.685 1.00 0.00 H new ATOM 1150 N THR A 76 7.409 0.299 -24.764 1.00 0.00 N ATOM 1151 CA THR A 76 7.659 -0.323 -26.103 1.00 0.00 C ATOM 1152 C THR A 76 7.186 -1.808 -26.091 1.00 0.00 C ATOM 1153 O THR A 76 7.777 -2.654 -25.411 1.00 0.00 O ATOM 1154 CB THR A 76 9.152 -0.157 -26.521 1.00 0.00 C ATOM 1155 OG1 THR A 76 9.529 1.213 -26.426 1.00 0.00 O ATOM 1156 CG2 THR A 76 9.461 -0.590 -27.968 1.00 0.00 C ATOM 0 H THR A 76 7.978 -0.091 -24.013 1.00 0.00 H new ATOM 0 HA THR A 76 7.074 0.194 -26.864 1.00 0.00 H new ATOM 0 HB THR A 76 9.706 -0.804 -25.841 1.00 0.00 H new ATOM 0 HG1 THR A 76 10.468 1.313 -26.688 1.00 0.00 H new ATOM 0 HG21 THR A 76 10.521 -0.441 -28.174 1.00 0.00 H new ATOM 0 HG22 THR A 76 9.212 -1.644 -28.094 1.00 0.00 H new ATOM 0 HG23 THR A 76 8.869 0.008 -28.661 1.00 0.00 H new ATOM 1164 N THR A 77 6.154 -2.130 -26.894 1.00 0.00 N ATOM 1165 CA THR A 77 5.667 -3.532 -27.064 1.00 0.00 C ATOM 1166 C THR A 77 6.690 -4.405 -27.868 1.00 0.00 C ATOM 1167 O THR A 77 7.253 -3.954 -28.871 1.00 0.00 O ATOM 1168 CB THR A 77 4.251 -3.592 -27.730 1.00 0.00 C ATOM 1169 OG1 THR A 77 4.255 -3.028 -29.036 1.00 0.00 O ATOM 1170 CG2 THR A 77 3.125 -2.891 -26.954 1.00 0.00 C ATOM 0 H THR A 77 5.634 -1.444 -27.441 1.00 0.00 H new ATOM 0 HA THR A 77 5.576 -3.949 -26.061 1.00 0.00 H new ATOM 0 HB THR A 77 4.042 -4.662 -27.745 1.00 0.00 H new ATOM 0 HG1 THR A 77 4.653 -2.133 -29.005 1.00 0.00 H new ATOM 0 HG21 THR A 77 2.188 -2.992 -27.502 1.00 0.00 H new ATOM 0 HG22 THR A 77 3.021 -3.349 -25.970 1.00 0.00 H new ATOM 0 HG23 THR A 77 3.366 -1.834 -26.839 1.00 0.00 H new ATOM 1178 N ALA A 78 6.908 -5.667 -27.444 1.00 0.00 N ATOM 1179 CA ALA A 78 7.928 -6.580 -28.052 1.00 0.00 C ATOM 1180 C ALA A 78 7.971 -6.797 -29.608 1.00 0.00 C ATOM 1181 O ALA A 78 9.047 -7.053 -30.156 1.00 0.00 O ATOM 1182 CB ALA A 78 7.765 -7.926 -27.317 1.00 0.00 C ATOM 0 H ALA A 78 6.390 -6.091 -26.674 1.00 0.00 H new ATOM 0 HA ALA A 78 8.884 -6.075 -27.917 1.00 0.00 H new ATOM 0 HB1 ALA A 78 8.483 -8.645 -27.712 1.00 0.00 H new ATOM 0 HB2 ALA A 78 7.944 -7.783 -26.251 1.00 0.00 H new ATOM 0 HB3 ALA A 78 6.753 -8.303 -27.468 1.00 0.00 H new ATOM 1188 N ASP A 79 6.824 -6.687 -30.294 1.00 0.00 N ATOM 1189 CA ASP A 79 6.740 -6.666 -31.782 1.00 0.00 C ATOM 1190 C ASP A 79 6.973 -5.261 -32.462 1.00 0.00 C ATOM 1191 O ASP A 79 7.477 -5.247 -33.589 1.00 0.00 O ATOM 1192 CB ASP A 79 5.410 -7.410 -32.095 1.00 0.00 C ATOM 1193 CG ASP A 79 4.823 -7.313 -33.502 1.00 0.00 C ATOM 1194 OD1 ASP A 79 4.118 -6.315 -33.760 1.00 0.00 O ATOM 1195 OD2 ASP A 79 4.949 -8.261 -34.306 1.00 0.00 O ATOM 0 H ASP A 79 5.915 -6.609 -29.838 1.00 0.00 H new ATOM 0 HA ASP A 79 7.578 -7.179 -32.254 1.00 0.00 H new ATOM 0 HB2 ASP A 79 5.564 -8.466 -31.874 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.656 -7.045 -31.398 1.00 0.00 H new ATOM 1200 N GLY A 80 6.653 -4.103 -31.838 1.00 0.00 N ATOM 1201 CA GLY A 80 6.986 -2.778 -32.444 1.00 0.00 C ATOM 1202 C GLY A 80 6.270 -1.500 -31.948 1.00 0.00 C ATOM 1203 O GLY A 80 6.900 -0.440 -31.925 1.00 0.00 O ATOM 0 H GLY A 80 6.177 -4.050 -30.938 1.00 0.00 H new ATOM 0 HA2 GLY A 80 8.057 -2.621 -32.313 1.00 0.00 H new ATOM 0 HA3 GLY A 80 6.804 -2.857 -33.516 1.00 0.00 H new ATOM 1207 N ARG A 81 4.969 -1.555 -31.616 1.00 0.00 N ATOM 1208 CA ARG A 81 4.172 -0.343 -31.239 1.00 0.00 C ATOM 1209 C ARG A 81 4.619 0.271 -29.874 1.00 0.00 C ATOM 1210 O ARG A 81 4.668 -0.439 -28.860 1.00 0.00 O ATOM 1211 CB ARG A 81 2.657 -0.690 -31.157 1.00 0.00 C ATOM 1212 CG ARG A 81 1.966 -1.122 -32.482 1.00 0.00 C ATOM 1213 CD ARG A 81 0.826 -2.156 -32.303 1.00 0.00 C ATOM 1214 NE ARG A 81 1.314 -3.447 -31.739 1.00 0.00 N ATOM 1215 CZ ARG A 81 2.062 -4.329 -32.394 1.00 0.00 C ATOM 1216 NH1 ARG A 81 2.199 -4.367 -33.691 1.00 0.00 N ATOM 1217 NH2 ARG A 81 2.724 -5.204 -31.715 1.00 0.00 N ATOM 0 H ARG A 81 4.433 -2.422 -31.597 1.00 0.00 H new ATOM 0 HA ARG A 81 4.352 0.396 -32.020 1.00 0.00 H new ATOM 0 HB2 ARG A 81 2.531 -1.492 -30.430 1.00 0.00 H new ATOM 0 HB3 ARG A 81 2.129 0.180 -30.766 1.00 0.00 H new ATOM 0 HG2 ARG A 81 1.563 -0.236 -32.972 1.00 0.00 H new ATOM 0 HG3 ARG A 81 2.719 -1.541 -33.150 1.00 0.00 H new ATOM 0 HD2 ARG A 81 0.062 -1.741 -31.645 1.00 0.00 H new ATOM 0 HD3 ARG A 81 0.351 -2.340 -33.267 1.00 0.00 H new ATOM 0 HE ARG A 81 1.054 -3.670 -30.778 1.00 0.00 H new ATOM 0 HH11 ARG A 81 1.712 -3.687 -34.275 1.00 0.00 H new ATOM 0 HH12 ARG A 81 2.793 -5.077 -34.121 1.00 0.00 H new ATOM 0 HH21 ARG A 81 2.667 -5.209 -30.697 1.00 0.00 H new ATOM 0 HH22 ARG A 81 3.305 -5.891 -32.197 1.00 0.00 H new ATOM 1231 N LYS A 82 4.905 1.585 -29.855 1.00 0.00 N ATOM 1232 CA LYS A 82 5.167 2.331 -28.594 1.00 0.00 C ATOM 1233 C LYS A 82 3.860 2.994 -28.063 1.00 0.00 C ATOM 1234 O LYS A 82 3.136 3.664 -28.807 1.00 0.00 O ATOM 1235 CB LYS A 82 6.312 3.363 -28.770 1.00 0.00 C ATOM 1236 CG LYS A 82 7.709 2.724 -28.949 1.00 0.00 C ATOM 1237 CD LYS A 82 8.920 3.662 -28.761 1.00 0.00 C ATOM 1238 CE LYS A 82 9.239 4.596 -29.942 1.00 0.00 C ATOM 1239 NZ LYS A 82 8.482 5.872 -29.823 1.00 0.00 N ATOM 0 H LYS A 82 4.962 2.160 -30.696 1.00 0.00 H new ATOM 0 HA LYS A 82 5.502 1.616 -27.842 1.00 0.00 H new ATOM 0 HB2 LYS A 82 6.095 3.987 -29.637 1.00 0.00 H new ATOM 0 HB3 LYS A 82 6.332 4.020 -27.901 1.00 0.00 H new ATOM 0 HG2 LYS A 82 7.801 1.900 -28.241 1.00 0.00 H new ATOM 0 HG3 LYS A 82 7.762 2.293 -29.949 1.00 0.00 H new ATOM 0 HD2 LYS A 82 8.746 4.274 -27.876 1.00 0.00 H new ATOM 0 HD3 LYS A 82 9.800 3.051 -28.559 1.00 0.00 H new ATOM 0 HE2 LYS A 82 10.309 4.803 -29.970 1.00 0.00 H new ATOM 0 HE3 LYS A 82 8.986 4.103 -30.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 8.658 6.460 -30.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 7.465 5.667 -29.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 8.793 6.382 -28.972 1.00 0.00 H new ATOM 1253 N THR A 83 3.548 2.761 -26.778 1.00 0.00 N ATOM 1254 CA THR A 83 2.199 3.052 -26.212 1.00 0.00 C ATOM 1255 C THR A 83 2.287 4.075 -25.039 1.00 0.00 C ATOM 1256 O THR A 83 2.999 3.852 -24.050 1.00 0.00 O ATOM 1257 CB THR A 83 1.435 1.748 -25.814 1.00 0.00 C ATOM 1258 OG1 THR A 83 1.948 1.132 -24.631 1.00 0.00 O ATOM 1259 CG2 THR A 83 1.337 0.677 -26.911 1.00 0.00 C ATOM 0 H THR A 83 4.205 2.372 -26.102 1.00 0.00 H new ATOM 0 HA THR A 83 1.607 3.520 -26.999 1.00 0.00 H new ATOM 0 HB THR A 83 0.428 2.125 -25.633 1.00 0.00 H new ATOM 0 HG1 THR A 83 2.858 0.809 -24.799 1.00 0.00 H new ATOM 0 HG21 THR A 83 0.788 -0.185 -26.530 1.00 0.00 H new ATOM 0 HG22 THR A 83 0.814 1.088 -27.775 1.00 0.00 H new ATOM 0 HG23 THR A 83 2.339 0.367 -27.207 1.00 0.00 H new ATOM 1267 N GLN A 84 1.516 5.180 -25.121 1.00 0.00 N ATOM 1268 CA GLN A 84 1.396 6.174 -24.016 1.00 0.00 C ATOM 1269 C GLN A 84 0.657 5.566 -22.784 1.00 0.00 C ATOM 1270 O GLN A 84 -0.558 5.362 -22.782 1.00 0.00 O ATOM 1271 CB GLN A 84 0.680 7.454 -24.533 1.00 0.00 C ATOM 1272 CG GLN A 84 1.563 8.553 -25.166 1.00 0.00 C ATOM 1273 CD GLN A 84 2.513 9.278 -24.204 1.00 0.00 C ATOM 1274 OE1 GLN A 84 2.120 10.174 -23.466 1.00 0.00 O ATOM 1275 NE2 GLN A 84 3.776 8.929 -24.173 1.00 0.00 N ATOM 0 H GLN A 84 0.961 5.413 -25.944 1.00 0.00 H new ATOM 0 HA GLN A 84 2.397 6.448 -23.683 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -0.062 7.150 -25.271 1.00 0.00 H new ATOM 0 HB3 GLN A 84 0.137 7.897 -23.698 1.00 0.00 H new ATOM 0 HG2 GLN A 84 2.156 8.103 -25.963 1.00 0.00 H new ATOM 0 HG3 GLN A 84 0.912 9.293 -25.632 1.00 0.00 H new ATOM 0 HE21 GLN A 84 4.115 8.185 -24.783 1.00 0.00 H new ATOM 0 HE22 GLN A 84 4.420 9.402 -23.539 1.00 0.00 H new ATOM 1284 N THR A 85 1.428 5.224 -21.753 1.00 0.00 N ATOM 1285 CA THR A 85 1.007 4.245 -20.726 1.00 0.00 C ATOM 1286 C THR A 85 0.862 4.964 -19.360 1.00 0.00 C ATOM 1287 O THR A 85 1.859 5.237 -18.685 1.00 0.00 O ATOM 1288 CB THR A 85 2.033 3.079 -20.765 1.00 0.00 C ATOM 1289 OG1 THR A 85 1.972 2.424 -22.031 1.00 0.00 O ATOM 1290 CG2 THR A 85 1.756 1.980 -19.742 1.00 0.00 C ATOM 0 H THR A 85 2.359 5.610 -21.597 1.00 0.00 H new ATOM 0 HA THR A 85 0.024 3.812 -20.913 1.00 0.00 H new ATOM 0 HB THR A 85 2.996 3.545 -20.556 1.00 0.00 H new ATOM 0 HG1 THR A 85 2.513 2.918 -22.682 1.00 0.00 H new ATOM 0 HG21 THR A 85 2.514 1.202 -19.830 1.00 0.00 H new ATOM 0 HG22 THR A 85 1.785 2.402 -18.738 1.00 0.00 H new ATOM 0 HG23 THR A 85 0.771 1.550 -19.927 1.00 0.00 H new ATOM 1298 N VAL A 86 -0.386 5.276 -18.959 1.00 0.00 N ATOM 1299 CA VAL A 86 -0.671 5.869 -17.620 1.00 0.00 C ATOM 1300 C VAL A 86 -0.856 4.742 -16.556 1.00 0.00 C ATOM 1301 O VAL A 86 -1.870 4.032 -16.538 1.00 0.00 O ATOM 1302 CB VAL A 86 -1.754 7.000 -17.655 1.00 0.00 C ATOM 1303 CG1 VAL A 86 -3.177 6.596 -18.076 1.00 0.00 C ATOM 1304 CG2 VAL A 86 -1.845 7.774 -16.320 1.00 0.00 C ATOM 0 H VAL A 86 -1.216 5.131 -19.534 1.00 0.00 H new ATOM 0 HA VAL A 86 0.202 6.429 -17.284 1.00 0.00 H new ATOM 0 HB VAL A 86 -1.371 7.633 -18.456 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -3.825 7.473 -18.057 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.155 6.183 -19.084 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.562 5.846 -17.385 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -2.610 8.546 -16.399 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -2.106 7.085 -15.517 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -0.883 8.238 -16.102 1.00 0.00 H new ATOM 1314 N CYS A 87 0.158 4.574 -15.683 1.00 0.00 N ATOM 1315 CA CYS A 87 0.128 3.530 -14.623 1.00 0.00 C ATOM 1316 C CYS A 87 -0.460 4.091 -13.300 1.00 0.00 C ATOM 1317 O CYS A 87 0.061 5.060 -12.745 1.00 0.00 O ATOM 1318 CB CYS A 87 1.547 2.963 -14.446 1.00 0.00 C ATOM 1319 SG CYS A 87 1.947 1.896 -15.872 1.00 0.00 S ATOM 0 H CYS A 87 1.006 5.141 -15.686 1.00 0.00 H new ATOM 0 HA CYS A 87 -0.533 2.716 -14.922 1.00 0.00 H new ATOM 0 HB2 CYS A 87 2.270 3.775 -14.370 1.00 0.00 H new ATOM 0 HB3 CYS A 87 1.611 2.392 -13.520 1.00 0.00 H new ATOM 0 HG CYS A 87 2.769 0.961 -15.497 1.00 0.00 H new ATOM 1325 N ASN A 88 -1.557 3.497 -12.806 1.00 0.00 N ATOM 1326 CA ASN A 88 -2.324 4.044 -11.650 1.00 0.00 C ATOM 1327 C ASN A 88 -2.797 2.904 -10.694 1.00 0.00 C ATOM 1328 O ASN A 88 -3.432 1.940 -11.130 1.00 0.00 O ATOM 1329 CB ASN A 88 -3.470 4.972 -12.153 1.00 0.00 C ATOM 1330 CG ASN A 88 -4.592 4.362 -13.010 1.00 0.00 C ATOM 1331 OD1 ASN A 88 -5.642 3.971 -12.516 1.00 0.00 O ATOM 1332 ND2 ASN A 88 -4.427 4.268 -14.309 1.00 0.00 N ATOM 0 H ASN A 88 -1.944 2.632 -13.184 1.00 0.00 H new ATOM 0 HA ASN A 88 -1.669 4.670 -11.044 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -3.933 5.429 -11.278 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -3.014 5.777 -12.729 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -5.167 3.874 -14.890 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -3.559 4.589 -14.737 1.00 0.00 H new ATOM 1339 N PHE A 89 -2.493 3.007 -9.388 1.00 0.00 N ATOM 1340 CA PHE A 89 -2.950 2.011 -8.380 1.00 0.00 C ATOM 1341 C PHE A 89 -4.308 2.434 -7.732 1.00 0.00 C ATOM 1342 O PHE A 89 -4.411 3.504 -7.123 1.00 0.00 O ATOM 1343 CB PHE A 89 -1.815 1.808 -7.338 1.00 0.00 C ATOM 1344 CG PHE A 89 -2.063 0.663 -6.343 1.00 0.00 C ATOM 1345 CD1 PHE A 89 -1.782 -0.662 -6.694 1.00 0.00 C ATOM 1346 CD2 PHE A 89 -2.614 0.938 -5.087 1.00 0.00 C ATOM 1347 CE1 PHE A 89 -2.046 -1.696 -5.799 1.00 0.00 C ATOM 1348 CE2 PHE A 89 -2.877 -0.097 -4.195 1.00 0.00 C ATOM 1349 CZ PHE A 89 -2.587 -1.412 -4.550 1.00 0.00 C ATOM 0 H PHE A 89 -1.934 3.766 -8.998 1.00 0.00 H new ATOM 0 HA PHE A 89 -3.149 1.054 -8.863 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.882 1.617 -7.868 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.680 2.735 -6.780 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -1.359 -0.884 -7.663 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -2.836 1.958 -4.809 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -1.831 -2.718 -6.075 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -3.306 0.119 -3.228 1.00 0.00 H new ATOM 0 HZ PHE A 89 -2.783 -2.214 -3.853 1.00 0.00 H new ATOM 1359 N THR A 90 -5.321 1.558 -7.820 1.00 0.00 N ATOM 1360 CA THR A 90 -6.612 1.723 -7.087 1.00 0.00 C ATOM 1361 C THR A 90 -7.088 0.343 -6.536 1.00 0.00 C ATOM 1362 O THR A 90 -7.019 -0.674 -7.232 1.00 0.00 O ATOM 1363 CB THR A 90 -7.681 2.455 -7.960 1.00 0.00 C ATOM 1364 OG1 THR A 90 -8.771 2.883 -7.143 1.00 0.00 O ATOM 1365 CG2 THR A 90 -8.260 1.688 -9.162 1.00 0.00 C ATOM 0 H THR A 90 -5.281 0.716 -8.394 1.00 0.00 H new ATOM 0 HA THR A 90 -6.457 2.374 -6.226 1.00 0.00 H new ATOM 0 HB THR A 90 -7.117 3.281 -8.393 1.00 0.00 H new ATOM 0 HG1 THR A 90 -9.513 2.248 -7.228 1.00 0.00 H new ATOM 0 HG21 THR A 90 -8.988 2.315 -9.677 1.00 0.00 H new ATOM 0 HG22 THR A 90 -7.455 1.428 -9.849 1.00 0.00 H new ATOM 0 HG23 THR A 90 -8.747 0.778 -8.812 1.00 0.00 H new ATOM 1373 N ASP A 91 -7.603 0.305 -5.292 1.00 0.00 N ATOM 1374 CA ASP A 91 -8.432 -0.846 -4.787 1.00 0.00 C ATOM 1375 C ASP A 91 -7.725 -2.259 -4.728 1.00 0.00 C ATOM 1376 O ASP A 91 -8.336 -3.296 -5.013 1.00 0.00 O ATOM 1377 CB ASP A 91 -9.813 -0.890 -5.521 1.00 0.00 C ATOM 1378 CG ASP A 91 -10.607 0.416 -5.592 1.00 0.00 C ATOM 1379 OD1 ASP A 91 -10.364 1.205 -6.536 1.00 0.00 O ATOM 1380 OD2 ASP A 91 -11.446 0.669 -4.704 1.00 0.00 O ATOM 0 H ASP A 91 -7.469 1.049 -4.607 1.00 0.00 H new ATOM 0 HA ASP A 91 -8.590 -0.629 -3.731 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -9.644 -1.239 -6.540 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -10.435 -1.637 -5.028 1.00 0.00 H new ATOM 1385 N GLY A 92 -6.424 -2.311 -4.377 1.00 0.00 N ATOM 1386 CA GLY A 92 -5.592 -3.536 -4.589 1.00 0.00 C ATOM 1387 C GLY A 92 -5.093 -3.881 -6.023 1.00 0.00 C ATOM 1388 O GLY A 92 -4.620 -5.003 -6.224 1.00 0.00 O ATOM 0 H GLY A 92 -5.921 -1.533 -3.949 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -4.714 -3.450 -3.949 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -6.167 -4.389 -4.229 1.00 0.00 H new ATOM 1392 N ALA A 93 -5.190 -2.961 -7.002 1.00 0.00 N ATOM 1393 CA ALA A 93 -4.961 -3.257 -8.436 1.00 0.00 C ATOM 1394 C ALA A 93 -4.102 -2.165 -9.148 1.00 0.00 C ATOM 1395 O ALA A 93 -4.452 -0.980 -9.161 1.00 0.00 O ATOM 1396 CB ALA A 93 -6.354 -3.367 -9.090 1.00 0.00 C ATOM 0 H ALA A 93 -5.430 -1.986 -6.823 1.00 0.00 H new ATOM 0 HA ALA A 93 -4.394 -4.183 -8.534 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -6.241 -3.585 -10.152 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -6.918 -4.169 -8.613 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -6.889 -2.425 -8.968 1.00 0.00 H new ATOM 1402 N LEU A 94 -2.997 -2.579 -9.793 1.00 0.00 N ATOM 1403 CA LEU A 94 -2.178 -1.689 -10.665 1.00 0.00 C ATOM 1404 C LEU A 94 -2.740 -1.664 -12.122 1.00 0.00 C ATOM 1405 O LEU A 94 -2.577 -2.622 -12.885 1.00 0.00 O ATOM 1406 CB LEU A 94 -0.705 -2.174 -10.558 1.00 0.00 C ATOM 1407 CG LEU A 94 0.348 -1.546 -11.506 1.00 0.00 C ATOM 1408 CD1 LEU A 94 0.540 -0.045 -11.250 1.00 0.00 C ATOM 1409 CD2 LEU A 94 1.697 -2.263 -11.340 1.00 0.00 C ATOM 0 H LEU A 94 -2.640 -3.533 -9.731 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.223 -0.650 -10.340 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.373 -2.004 -9.534 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -0.698 -3.252 -10.721 1.00 0.00 H new ATOM 0 HG LEU A 94 -0.023 -1.668 -12.524 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.287 0.349 -11.939 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.406 0.474 -11.405 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.875 0.109 -10.224 1.00 0.00 H new ATOM 0 HD21 LEU A 94 2.432 -1.816 -12.010 1.00 0.00 H new ATOM 0 HD22 LEU A 94 2.038 -2.163 -10.309 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.580 -3.319 -11.583 1.00 0.00 H new ATOM 1421 N VAL A 95 -3.376 -0.547 -12.504 1.00 0.00 N ATOM 1422 CA VAL A 95 -4.025 -0.375 -13.834 1.00 0.00 C ATOM 1423 C VAL A 95 -2.999 0.287 -14.813 1.00 0.00 C ATOM 1424 O VAL A 95 -2.691 1.480 -14.710 1.00 0.00 O ATOM 1425 CB VAL A 95 -5.358 0.442 -13.673 1.00 0.00 C ATOM 1426 CG1 VAL A 95 -6.094 0.675 -15.013 1.00 0.00 C ATOM 1427 CG2 VAL A 95 -6.394 -0.201 -12.718 1.00 0.00 C ATOM 0 H VAL A 95 -3.461 0.273 -11.904 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.307 -1.336 -14.263 1.00 0.00 H new ATOM 0 HB VAL A 95 -5.002 1.382 -13.251 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -7.006 1.244 -14.833 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -5.447 1.231 -15.692 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -6.349 -0.286 -15.460 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -7.282 0.429 -12.667 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -6.670 -1.187 -13.091 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -5.960 -0.298 -11.723 1.00 0.00 H new ATOM 1437 N GLN A 96 -2.497 -0.493 -15.784 1.00 0.00 N ATOM 1438 CA GLN A 96 -1.629 0.013 -16.881 1.00 0.00 C ATOM 1439 C GLN A 96 -2.501 0.376 -18.131 1.00 0.00 C ATOM 1440 O GLN A 96 -2.811 -0.494 -18.949 1.00 0.00 O ATOM 1441 CB GLN A 96 -0.562 -1.096 -17.121 1.00 0.00 C ATOM 1442 CG GLN A 96 0.451 -0.798 -18.254 1.00 0.00 C ATOM 1443 CD GLN A 96 1.546 -1.836 -18.523 1.00 0.00 C ATOM 1444 OE1 GLN A 96 2.011 -2.562 -17.650 1.00 0.00 O ATOM 1445 NE2 GLN A 96 2.039 -1.916 -19.736 1.00 0.00 N ATOM 0 H GLN A 96 -2.677 -1.496 -15.838 1.00 0.00 H new ATOM 0 HA GLN A 96 -1.114 0.942 -16.638 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -0.011 -1.255 -16.194 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -1.076 -2.030 -17.350 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -0.111 -0.657 -19.177 1.00 0.00 H new ATOM 0 HG3 GLN A 96 0.937 0.151 -18.028 1.00 0.00 H new ATOM 0 HE21 GLN A 96 1.668 -1.322 -20.478 1.00 0.00 H new ATOM 0 HE22 GLN A 96 2.793 -2.572 -19.938 1.00 0.00 H new ATOM 1454 N HIS A 97 -2.894 1.656 -18.277 1.00 0.00 N ATOM 1455 CA HIS A 97 -3.760 2.121 -19.402 1.00 0.00 C ATOM 1456 C HIS A 97 -2.888 2.594 -20.615 1.00 0.00 C ATOM 1457 O HIS A 97 -2.330 3.694 -20.609 1.00 0.00 O ATOM 1458 CB HIS A 97 -4.647 3.253 -18.817 1.00 0.00 C ATOM 1459 CG HIS A 97 -5.738 3.800 -19.739 1.00 0.00 C ATOM 1460 ND1 HIS A 97 -5.636 4.902 -20.575 1.00 0.00 N ATOM 1461 CD2 HIS A 97 -6.959 3.149 -19.963 1.00 0.00 C ATOM 1462 CE1 HIS A 97 -6.806 4.786 -21.283 1.00 0.00 C ATOM 1463 NE2 HIS A 97 -7.686 3.798 -20.943 1.00 0.00 N ATOM 0 H HIS A 97 -2.628 2.399 -17.630 1.00 0.00 H new ATOM 0 HA HIS A 97 -4.387 1.322 -19.797 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -5.121 2.882 -17.908 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -3.999 4.079 -18.525 1.00 0.00 H new ATOM 0 HD1 HIS A 97 -4.898 5.603 -20.644 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -7.287 2.262 -19.441 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -7.027 5.464 -22.094 1.00 0.00 H new ATOM 1472 N GLN A 98 -2.791 1.744 -21.641 1.00 0.00 N ATOM 1473 CA GLN A 98 -1.897 1.934 -22.819 1.00 0.00 C ATOM 1474 C GLN A 98 -2.653 2.617 -24.000 1.00 0.00 C ATOM 1475 O GLN A 98 -3.693 2.114 -24.426 1.00 0.00 O ATOM 1476 CB GLN A 98 -1.388 0.540 -23.287 1.00 0.00 C ATOM 1477 CG GLN A 98 -0.639 -0.332 -22.249 1.00 0.00 C ATOM 1478 CD GLN A 98 -0.127 -1.658 -22.815 1.00 0.00 C ATOM 1479 OE1 GLN A 98 -0.777 -2.696 -22.759 1.00 0.00 O ATOM 1480 NE2 GLN A 98 1.058 -1.666 -23.369 1.00 0.00 N ATOM 0 H GLN A 98 -3.336 0.883 -21.690 1.00 0.00 H new ATOM 0 HA GLN A 98 -1.067 2.576 -22.525 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -2.246 -0.028 -23.647 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -0.726 0.692 -24.139 1.00 0.00 H new ATOM 0 HG2 GLN A 98 0.204 0.234 -21.853 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -1.306 -0.538 -21.412 1.00 0.00 H new ATOM 0 HE21 GLN A 98 1.604 -0.806 -23.419 1.00 0.00 H new ATOM 0 HE22 GLN A 98 1.436 -2.533 -23.751 1.00 0.00 H new ATOM 1489 N GLU A 99 -2.130 3.729 -24.536 1.00 0.00 N ATOM 1490 CA GLU A 99 -2.865 4.598 -25.507 1.00 0.00 C ATOM 1491 C GLU A 99 -2.028 4.788 -26.812 1.00 0.00 C ATOM 1492 O GLU A 99 -0.885 5.261 -26.762 1.00 0.00 O ATOM 1493 CB GLU A 99 -3.119 5.976 -24.827 1.00 0.00 C ATOM 1494 CG GLU A 99 -4.104 5.985 -23.626 1.00 0.00 C ATOM 1495 CD GLU A 99 -3.938 7.145 -22.653 1.00 0.00 C ATOM 1496 OE1 GLU A 99 -3.748 8.303 -23.084 1.00 0.00 O ATOM 1497 OE2 GLU A 99 -4.005 6.897 -21.430 1.00 0.00 O ATOM 0 H GLU A 99 -1.191 4.063 -24.319 1.00 0.00 H new ATOM 0 HA GLU A 99 -3.811 4.132 -25.781 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -2.162 6.370 -24.486 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -3.496 6.665 -25.583 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -5.123 6.001 -24.014 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -3.987 5.052 -23.075 1.00 0.00 H new ATOM 1504 N TRP A 100 -2.577 4.430 -27.992 1.00 0.00 N ATOM 1505 CA TRP A 100 -1.849 4.569 -29.292 1.00 0.00 C ATOM 1506 C TRP A 100 -2.847 4.637 -30.500 1.00 0.00 C ATOM 1507 O TRP A 100 -3.595 3.685 -30.747 1.00 0.00 O ATOM 1508 CB TRP A 100 -0.734 3.480 -29.431 1.00 0.00 C ATOM 1509 CG TRP A 100 -1.171 2.065 -29.823 1.00 0.00 C ATOM 1510 CD1 TRP A 100 -1.161 1.547 -31.135 1.00 0.00 C ATOM 1511 CD2 TRP A 100 -1.701 1.068 -29.029 1.00 0.00 C ATOM 1512 NE1 TRP A 100 -1.666 0.236 -31.181 1.00 0.00 N ATOM 1513 CE2 TRP A 100 -1.973 -0.044 -29.860 1.00 0.00 C ATOM 1514 CE3 TRP A 100 -1.981 1.014 -27.638 1.00 0.00 C ATOM 1515 CZ2 TRP A 100 -2.491 -1.228 -29.303 1.00 0.00 C ATOM 1516 CZ3 TRP A 100 -2.502 -0.166 -27.112 1.00 0.00 C ATOM 1517 CH2 TRP A 100 -2.754 -1.272 -27.930 1.00 0.00 C ATOM 0 H TRP A 100 -3.517 4.043 -28.082 1.00 0.00 H new ATOM 0 HA TRP A 100 -1.324 5.524 -29.304 1.00 0.00 H new ATOM 0 HB2 TRP A 100 -0.015 3.828 -30.173 1.00 0.00 H new ATOM 0 HB3 TRP A 100 -0.205 3.417 -28.480 1.00 0.00 H new ATOM 0 HD1 TRP A 100 -0.808 2.091 -31.999 1.00 0.00 H new ATOM 0 HE1 TRP A 100 -1.780 -0.367 -31.996 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -1.794 1.867 -27.003 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -2.682 -2.089 -29.926 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 -2.715 -0.228 -26.055 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -3.158 -2.174 -27.495 1.00 0.00 H new ATOM 1528 N ASP A 101 -2.846 5.751 -31.261 1.00 0.00 N ATOM 1529 CA ASP A 101 -3.561 5.874 -32.580 1.00 0.00 C ATOM 1530 C ASP A 101 -5.038 5.330 -32.678 1.00 0.00 C ATOM 1531 O ASP A 101 -5.379 4.528 -33.555 1.00 0.00 O ATOM 1532 CB ASP A 101 -2.622 5.358 -33.709 1.00 0.00 C ATOM 1533 CG ASP A 101 -1.382 6.215 -33.977 1.00 0.00 C ATOM 1534 OD1 ASP A 101 -1.457 7.137 -34.816 1.00 0.00 O ATOM 1535 OD2 ASP A 101 -0.338 5.973 -33.334 1.00 0.00 O ATOM 0 H ASP A 101 -2.352 6.602 -30.991 1.00 0.00 H new ATOM 0 HA ASP A 101 -3.760 6.938 -32.705 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -2.297 4.349 -33.455 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -3.198 5.284 -34.632 1.00 0.00 H new ATOM 1540 N GLY A 102 -5.914 5.747 -31.745 1.00 0.00 N ATOM 1541 CA GLY A 102 -7.285 5.166 -31.625 1.00 0.00 C ATOM 1542 C GLY A 102 -7.462 3.918 -30.724 1.00 0.00 C ATOM 1543 O GLY A 102 -8.450 3.827 -29.995 1.00 0.00 O ATOM 0 H GLY A 102 -5.709 6.478 -31.063 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -7.948 5.946 -31.251 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -7.629 4.908 -32.627 1.00 0.00 H new ATOM 1547 N LYS A 103 -6.539 2.949 -30.802 1.00 0.00 N ATOM 1548 CA LYS A 103 -6.567 1.716 -29.971 1.00 0.00 C ATOM 1549 C LYS A 103 -6.033 1.931 -28.518 1.00 0.00 C ATOM 1550 O LYS A 103 -5.049 2.647 -28.291 1.00 0.00 O ATOM 1551 CB LYS A 103 -5.722 0.646 -30.719 1.00 0.00 C ATOM 1552 CG LYS A 103 -6.427 0.021 -31.946 1.00 0.00 C ATOM 1553 CD LYS A 103 -5.530 -0.958 -32.729 1.00 0.00 C ATOM 1554 CE LYS A 103 -6.278 -1.734 -33.833 1.00 0.00 C ATOM 1555 NZ LYS A 103 -6.782 -3.060 -33.364 1.00 0.00 N ATOM 0 H LYS A 103 -5.746 2.989 -31.442 1.00 0.00 H new ATOM 0 HA LYS A 103 -7.602 1.397 -29.845 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -4.787 1.101 -31.045 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -5.463 -0.149 -30.020 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -7.323 -0.504 -31.614 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -6.754 0.818 -32.614 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -4.708 -0.402 -33.180 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -5.089 -1.670 -32.032 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -7.117 -1.135 -34.187 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -5.611 -1.883 -34.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -7.261 -3.546 -34.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -5.983 -3.638 -33.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -7.453 -2.919 -32.582 1.00 0.00 H new ATOM 1569 N GLU A 104 -6.666 1.255 -27.538 1.00 0.00 N ATOM 1570 CA GLU A 104 -6.178 1.240 -26.133 1.00 0.00 C ATOM 1571 C GLU A 104 -6.267 -0.172 -25.469 1.00 0.00 C ATOM 1572 O GLU A 104 -7.250 -0.906 -25.615 1.00 0.00 O ATOM 1573 CB GLU A 104 -6.810 2.356 -25.251 1.00 0.00 C ATOM 1574 CG GLU A 104 -8.337 2.292 -24.985 1.00 0.00 C ATOM 1575 CD GLU A 104 -8.788 3.196 -23.849 1.00 0.00 C ATOM 1576 OE1 GLU A 104 -8.629 4.431 -23.941 1.00 0.00 O ATOM 1577 OE2 GLU A 104 -9.230 2.670 -22.804 1.00 0.00 O ATOM 0 H GLU A 104 -7.516 0.711 -27.688 1.00 0.00 H new ATOM 0 HA GLU A 104 -5.116 1.477 -26.196 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -6.302 2.348 -24.287 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -6.592 3.316 -25.719 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -8.869 2.570 -25.895 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -8.616 1.264 -24.754 1.00 0.00 H new ATOM 1584 N SER A 105 -5.216 -0.514 -24.705 1.00 0.00 N ATOM 1585 CA SER A 105 -5.151 -1.760 -23.894 1.00 0.00 C ATOM 1586 C SER A 105 -4.958 -1.422 -22.389 1.00 0.00 C ATOM 1587 O SER A 105 -4.082 -0.645 -22.010 1.00 0.00 O ATOM 1588 CB SER A 105 -4.014 -2.661 -24.412 1.00 0.00 C ATOM 1589 OG SER A 105 -3.957 -3.865 -23.646 1.00 0.00 O ATOM 0 H SER A 105 -4.379 0.064 -24.626 1.00 0.00 H new ATOM 0 HA SER A 105 -6.092 -2.300 -23.994 1.00 0.00 H new ATOM 0 HB2 SER A 105 -4.176 -2.897 -25.464 1.00 0.00 H new ATOM 0 HB3 SER A 105 -3.062 -2.133 -24.347 1.00 0.00 H new ATOM 0 HG SER A 105 -3.436 -4.538 -24.132 1.00 0.00 H new ATOM 1595 N THR A 106 -5.782 -2.009 -21.519 1.00 0.00 N ATOM 1596 CA THR A 106 -5.767 -1.714 -20.061 1.00 0.00 C ATOM 1597 C THR A 106 -5.399 -3.014 -19.292 1.00 0.00 C ATOM 1598 O THR A 106 -6.120 -4.014 -19.369 1.00 0.00 O ATOM 1599 CB THR A 106 -7.137 -1.095 -19.682 1.00 0.00 C ATOM 1600 OG1 THR A 106 -7.392 0.063 -20.469 1.00 0.00 O ATOM 1601 CG2 THR A 106 -7.241 -0.660 -18.220 1.00 0.00 C ATOM 0 H THR A 106 -6.480 -2.701 -21.791 1.00 0.00 H new ATOM 0 HA THR A 106 -5.009 -0.981 -19.783 1.00 0.00 H new ATOM 0 HB THR A 106 -7.861 -1.890 -19.863 1.00 0.00 H new ATOM 0 HG1 THR A 106 -8.261 0.443 -20.220 1.00 0.00 H new ATOM 0 HG21 THR A 106 -8.229 -0.238 -18.035 1.00 0.00 H new ATOM 0 HG22 THR A 106 -7.088 -1.523 -17.572 1.00 0.00 H new ATOM 0 HG23 THR A 106 -6.480 0.091 -18.009 1.00 0.00 H new ATOM 1609 N ILE A 107 -4.259 -3.009 -18.576 1.00 0.00 N ATOM 1610 CA ILE A 107 -3.702 -4.246 -17.945 1.00 0.00 C ATOM 1611 C ILE A 107 -3.759 -4.080 -16.393 1.00 0.00 C ATOM 1612 O ILE A 107 -2.957 -3.355 -15.796 1.00 0.00 O ATOM 1613 CB ILE A 107 -2.312 -4.659 -18.559 1.00 0.00 C ATOM 1614 CG1 ILE A 107 -2.358 -4.756 -20.119 1.00 0.00 C ATOM 1615 CG2 ILE A 107 -1.803 -5.975 -17.914 1.00 0.00 C ATOM 1616 CD1 ILE A 107 -1.137 -5.323 -20.852 1.00 0.00 C ATOM 0 H ILE A 107 -3.699 -2.172 -18.414 1.00 0.00 H new ATOM 0 HA ILE A 107 -4.316 -5.115 -18.181 1.00 0.00 H new ATOM 0 HB ILE A 107 -1.599 -3.868 -18.325 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -3.220 -5.367 -20.388 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -2.543 -3.755 -20.508 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -0.841 -6.246 -18.350 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -1.687 -5.833 -16.840 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -2.523 -6.773 -18.099 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -1.325 -5.324 -21.926 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -0.265 -4.706 -20.637 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -0.952 -6.343 -20.515 1.00 0.00 H new ATOM 1628 N THR A 108 -4.721 -4.771 -15.757 1.00 0.00 N ATOM 1629 CA THR A 108 -5.061 -4.589 -14.318 1.00 0.00 C ATOM 1630 C THR A 108 -4.410 -5.731 -13.473 1.00 0.00 C ATOM 1631 O THR A 108 -4.900 -6.865 -13.453 1.00 0.00 O ATOM 1632 CB THR A 108 -6.616 -4.509 -14.204 1.00 0.00 C ATOM 1633 OG1 THR A 108 -7.103 -3.383 -14.933 1.00 0.00 O ATOM 1634 CG2 THR A 108 -7.153 -4.327 -12.777 1.00 0.00 C ATOM 0 H THR A 108 -5.292 -5.477 -16.221 1.00 0.00 H new ATOM 0 HA THR A 108 -4.655 -3.663 -13.911 1.00 0.00 H new ATOM 0 HB THR A 108 -6.958 -5.469 -14.591 1.00 0.00 H new ATOM 0 HG1 THR A 108 -8.079 -3.342 -14.857 1.00 0.00 H new ATOM 0 HG21 THR A 108 -8.242 -4.282 -12.801 1.00 0.00 H new ATOM 0 HG22 THR A 108 -6.838 -5.168 -12.160 1.00 0.00 H new ATOM 0 HG23 THR A 108 -6.761 -3.401 -12.356 1.00 0.00 H new ATOM 1642 N ARG A 109 -3.307 -5.422 -12.769 1.00 0.00 N ATOM 1643 CA ARG A 109 -2.547 -6.425 -11.969 1.00 0.00 C ATOM 1644 C ARG A 109 -2.995 -6.391 -10.476 1.00 0.00 C ATOM 1645 O ARG A 109 -2.620 -5.471 -9.739 1.00 0.00 O ATOM 1646 CB ARG A 109 -1.016 -6.184 -12.085 1.00 0.00 C ATOM 1647 CG ARG A 109 -0.411 -6.139 -13.506 1.00 0.00 C ATOM 1648 CD ARG A 109 1.132 -6.169 -13.471 1.00 0.00 C ATOM 1649 NE ARG A 109 1.733 -6.228 -14.834 1.00 0.00 N ATOM 1650 CZ ARG A 109 1.868 -5.184 -15.655 1.00 0.00 C ATOM 1651 NH1 ARG A 109 1.438 -3.982 -15.377 1.00 0.00 N ATOM 1652 NH2 ARG A 109 2.453 -5.357 -16.803 1.00 0.00 N ATOM 0 H ARG A 109 -2.912 -4.482 -12.732 1.00 0.00 H new ATOM 0 HA ARG A 109 -2.766 -7.414 -12.372 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -0.785 -5.241 -11.590 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -0.508 -6.970 -11.527 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -0.778 -6.986 -14.085 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -0.746 -5.236 -14.016 1.00 0.00 H new ATOM 0 HD2 ARG A 109 1.498 -5.282 -12.954 1.00 0.00 H new ATOM 0 HD3 ARG A 109 1.462 -7.033 -12.894 1.00 0.00 H new ATOM 0 HE ARG A 109 2.066 -7.134 -15.164 1.00 0.00 H new ATOM 0 HH11 ARG A 109 0.969 -3.801 -14.490 1.00 0.00 H new ATOM 0 HH12 ARG A 109 1.572 -3.225 -16.047 1.00 0.00 H new ATOM 0 HH21 ARG A 109 2.801 -6.280 -17.064 1.00 0.00 H new ATOM 0 HH22 ARG A 109 2.564 -4.570 -17.442 1.00 0.00 H new ATOM 1666 N LYS A 110 -3.793 -7.379 -10.032 1.00 0.00 N ATOM 1667 CA LYS A 110 -4.336 -7.423 -8.639 1.00 0.00 C ATOM 1668 C LYS A 110 -3.933 -8.701 -7.842 1.00 0.00 C ATOM 1669 O LYS A 110 -3.777 -9.795 -8.396 1.00 0.00 O ATOM 1670 CB LYS A 110 -5.864 -7.141 -8.627 1.00 0.00 C ATOM 1671 CG LYS A 110 -6.804 -8.055 -9.447 1.00 0.00 C ATOM 1672 CD LYS A 110 -8.289 -7.678 -9.221 1.00 0.00 C ATOM 1673 CE LYS A 110 -9.267 -8.307 -10.233 1.00 0.00 C ATOM 1674 NZ LYS A 110 -9.277 -7.525 -11.498 1.00 0.00 N ATOM 0 H LYS A 110 -4.084 -8.166 -10.612 1.00 0.00 H new ATOM 0 HA LYS A 110 -3.855 -6.613 -8.090 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -6.196 -7.174 -7.589 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -6.012 -6.119 -8.976 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -6.562 -7.973 -10.507 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -6.643 -9.095 -9.163 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -8.580 -7.983 -8.216 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -8.387 -6.593 -9.266 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -8.976 -9.337 -10.437 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -10.270 -8.337 -9.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -9.940 -7.961 -12.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -9.576 -6.549 -11.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -8.322 -7.518 -11.909 1.00 0.00 H new ATOM 1688 N LEU A 111 -3.762 -8.546 -6.515 1.00 0.00 N ATOM 1689 CA LEU A 111 -3.201 -9.614 -5.642 1.00 0.00 C ATOM 1690 C LEU A 111 -4.327 -10.504 -5.026 1.00 0.00 C ATOM 1691 O LEU A 111 -5.100 -10.053 -4.175 1.00 0.00 O ATOM 1692 CB LEU A 111 -2.271 -8.948 -4.580 1.00 0.00 C ATOM 1693 CG LEU A 111 -0.937 -9.665 -4.252 1.00 0.00 C ATOM 1694 CD1 LEU A 111 -1.112 -11.040 -3.587 1.00 0.00 C ATOM 1695 CD2 LEU A 111 -0.008 -9.780 -5.472 1.00 0.00 C ATOM 0 H LEU A 111 -4.003 -7.690 -6.015 1.00 0.00 H new ATOM 0 HA LEU A 111 -2.597 -10.305 -6.230 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -2.037 -7.940 -4.922 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -2.836 -8.847 -3.653 1.00 0.00 H new ATOM 0 HG LEU A 111 -0.461 -9.015 -3.517 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.133 -11.476 -3.390 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -1.653 -10.924 -2.648 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -1.674 -11.696 -4.251 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.911 -10.290 -5.183 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -0.507 -10.348 -6.257 1.00 0.00 H new ATOM 0 HD23 LEU A 111 0.232 -8.783 -5.842 1.00 0.00 H new ATOM 1707 N LYS A 112 -4.443 -11.760 -5.491 1.00 0.00 N ATOM 1708 CA LYS A 112 -5.543 -12.687 -5.087 1.00 0.00 C ATOM 1709 C LYS A 112 -4.951 -14.106 -4.823 1.00 0.00 C ATOM 1710 O LYS A 112 -4.232 -14.637 -5.674 1.00 0.00 O ATOM 1711 CB LYS A 112 -6.630 -12.750 -6.202 1.00 0.00 C ATOM 1712 CG LYS A 112 -7.471 -11.466 -6.423 1.00 0.00 C ATOM 1713 CD LYS A 112 -8.348 -11.447 -7.698 1.00 0.00 C ATOM 1714 CE LYS A 112 -9.556 -12.407 -7.744 1.00 0.00 C ATOM 1715 NZ LYS A 112 -9.183 -13.746 -8.281 1.00 0.00 N ATOM 0 H LYS A 112 -3.786 -12.171 -6.155 1.00 0.00 H new ATOM 0 HA LYS A 112 -6.011 -12.318 -4.174 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -6.140 -13.003 -7.142 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -7.311 -13.568 -5.968 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -8.118 -11.325 -5.557 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -6.794 -10.612 -6.458 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -8.719 -10.432 -7.836 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -7.707 -11.671 -8.551 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -9.968 -12.520 -6.741 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -10.341 -11.973 -8.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -9.794 -14.473 -7.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -9.305 -13.752 -9.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -8.190 -13.949 -8.048 1.00 0.00 H new ATOM 1729 N ASP A 113 -5.251 -14.734 -3.663 1.00 0.00 N ATOM 1730 CA ASP A 113 -4.707 -16.086 -3.279 1.00 0.00 C ATOM 1731 C ASP A 113 -3.133 -16.200 -3.235 1.00 0.00 C ATOM 1732 O ASP A 113 -2.539 -17.141 -3.770 1.00 0.00 O ATOM 1733 CB ASP A 113 -5.448 -17.165 -4.129 1.00 0.00 C ATOM 1734 CG ASP A 113 -5.201 -18.628 -3.764 1.00 0.00 C ATOM 1735 OD1 ASP A 113 -5.140 -18.966 -2.565 1.00 0.00 O ATOM 1736 OD2 ASP A 113 -5.073 -19.453 -4.696 1.00 0.00 O ATOM 0 H ASP A 113 -5.872 -14.333 -2.961 1.00 0.00 H new ATOM 0 HA ASP A 113 -4.927 -16.268 -2.227 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -6.519 -16.975 -4.058 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -5.168 -17.025 -5.173 1.00 0.00 H new ATOM 1741 N GLY A 114 -2.444 -15.199 -2.644 1.00 0.00 N ATOM 1742 CA GLY A 114 -0.970 -15.019 -2.824 1.00 0.00 C ATOM 1743 C GLY A 114 -0.377 -14.977 -4.265 1.00 0.00 C ATOM 1744 O GLY A 114 0.749 -15.433 -4.468 1.00 0.00 O ATOM 0 H GLY A 114 -2.875 -14.501 -2.038 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -0.690 -14.090 -2.327 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -0.473 -15.828 -2.289 1.00 0.00 H new ATOM 1748 N LYS A 115 -1.141 -14.486 -5.257 1.00 0.00 N ATOM 1749 CA LYS A 115 -0.821 -14.629 -6.706 1.00 0.00 C ATOM 1750 C LYS A 115 -1.173 -13.307 -7.450 1.00 0.00 C ATOM 1751 O LYS A 115 -2.112 -12.579 -7.104 1.00 0.00 O ATOM 1752 CB LYS A 115 -1.593 -15.825 -7.337 1.00 0.00 C ATOM 1753 CG LYS A 115 -1.197 -17.224 -6.807 1.00 0.00 C ATOM 1754 CD LYS A 115 -2.320 -18.264 -6.955 1.00 0.00 C ATOM 1755 CE LYS A 115 -1.985 -19.574 -6.212 1.00 0.00 C ATOM 1756 NZ LYS A 115 -3.181 -20.452 -6.128 1.00 0.00 N ATOM 0 H LYS A 115 -2.006 -13.974 -5.084 1.00 0.00 H new ATOM 0 HA LYS A 115 0.245 -14.830 -6.807 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.659 -15.678 -7.165 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -1.439 -15.807 -8.416 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -0.314 -17.573 -7.343 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -0.921 -17.143 -5.756 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -3.251 -17.852 -6.565 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -2.483 -18.476 -8.012 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -1.180 -20.096 -6.730 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -1.624 -19.347 -5.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -2.890 -21.409 -5.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -3.844 -20.069 -5.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -3.648 -20.493 -7.057 1.00 0.00 H new ATOM 1770 N LEU A 116 -0.418 -13.025 -8.518 1.00 0.00 N ATOM 1771 CA LEU A 116 -0.607 -11.808 -9.345 1.00 0.00 C ATOM 1772 C LEU A 116 -1.567 -12.120 -10.536 1.00 0.00 C ATOM 1773 O LEU A 116 -1.204 -12.790 -11.510 1.00 0.00 O ATOM 1774 CB LEU A 116 0.806 -11.339 -9.780 1.00 0.00 C ATOM 1775 CG LEU A 116 0.879 -9.969 -10.501 1.00 0.00 C ATOM 1776 CD1 LEU A 116 0.835 -8.811 -9.488 1.00 0.00 C ATOM 1777 CD2 LEU A 116 2.155 -9.881 -11.354 1.00 0.00 C ATOM 0 H LEU A 116 0.341 -13.626 -8.840 1.00 0.00 H new ATOM 0 HA LEU A 116 -1.085 -10.997 -8.796 1.00 0.00 H new ATOM 0 HB2 LEU A 116 1.440 -11.295 -8.895 1.00 0.00 H new ATOM 0 HB3 LEU A 116 1.231 -12.096 -10.439 1.00 0.00 H new ATOM 0 HG LEU A 116 0.011 -9.883 -11.155 1.00 0.00 H new ATOM 0 HD11 LEU A 116 0.888 -7.861 -10.019 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -0.095 -8.859 -8.921 1.00 0.00 H new ATOM 0 HD13 LEU A 116 1.681 -8.892 -8.805 1.00 0.00 H new ATOM 0 HD21 LEU A 116 2.192 -8.913 -11.854 1.00 0.00 H new ATOM 0 HD22 LEU A 116 3.030 -9.992 -10.713 1.00 0.00 H new ATOM 0 HD23 LEU A 116 2.149 -10.675 -12.100 1.00 0.00 H new ATOM 1789 N VAL A 117 -2.806 -11.620 -10.439 1.00 0.00 N ATOM 1790 CA VAL A 117 -3.862 -11.845 -11.467 1.00 0.00 C ATOM 1791 C VAL A 117 -3.803 -10.638 -12.458 1.00 0.00 C ATOM 1792 O VAL A 117 -4.195 -9.515 -12.118 1.00 0.00 O ATOM 1793 CB VAL A 117 -5.245 -12.063 -10.760 1.00 0.00 C ATOM 1794 CG1 VAL A 117 -6.430 -12.177 -11.743 1.00 0.00 C ATOM 1795 CG2 VAL A 117 -5.275 -13.328 -9.867 1.00 0.00 C ATOM 0 H VAL A 117 -3.116 -11.048 -9.653 1.00 0.00 H new ATOM 0 HA VAL A 117 -3.705 -12.751 -12.052 1.00 0.00 H new ATOM 0 HB VAL A 117 -5.358 -11.166 -10.151 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -7.354 -12.327 -11.184 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.505 -11.262 -12.330 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -6.269 -13.024 -12.410 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -6.258 -13.424 -9.405 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -5.073 -14.209 -10.477 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -4.516 -13.243 -9.090 1.00 0.00 H new ATOM 1805 N VAL A 118 -3.272 -10.879 -13.668 1.00 0.00 N ATOM 1806 CA VAL A 118 -2.958 -9.810 -14.659 1.00 0.00 C ATOM 1807 C VAL A 118 -4.086 -9.831 -15.736 1.00 0.00 C ATOM 1808 O VAL A 118 -4.005 -10.536 -16.749 1.00 0.00 O ATOM 1809 CB VAL A 118 -1.497 -10.015 -15.203 1.00 0.00 C ATOM 1810 CG1 VAL A 118 -1.093 -9.056 -16.345 1.00 0.00 C ATOM 1811 CG2 VAL A 118 -0.406 -9.939 -14.113 1.00 0.00 C ATOM 0 H VAL A 118 -3.044 -11.817 -13.997 1.00 0.00 H new ATOM 0 HA VAL A 118 -2.953 -8.809 -14.227 1.00 0.00 H new ATOM 0 HB VAL A 118 -1.546 -11.029 -15.599 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.071 -9.271 -16.656 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -1.766 -9.194 -17.191 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -1.157 -8.026 -15.995 1.00 0.00 H new ATOM 0 HG21 VAL A 118 0.573 -10.090 -14.567 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -0.437 -8.960 -13.635 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -0.583 -10.713 -13.366 1.00 0.00 H new ATOM 1821 N GLU A 119 -5.145 -9.042 -15.501 1.00 0.00 N ATOM 1822 CA GLU A 119 -6.310 -8.950 -16.415 1.00 0.00 C ATOM 1823 C GLU A 119 -6.058 -7.855 -17.493 1.00 0.00 C ATOM 1824 O GLU A 119 -6.315 -6.661 -17.305 1.00 0.00 O ATOM 1825 CB GLU A 119 -7.579 -8.714 -15.556 1.00 0.00 C ATOM 1826 CG GLU A 119 -8.075 -9.982 -14.807 1.00 0.00 C ATOM 1827 CD GLU A 119 -9.083 -9.771 -13.687 1.00 0.00 C ATOM 1828 OE1 GLU A 119 -9.863 -8.795 -13.712 1.00 0.00 O ATOM 1829 OE2 GLU A 119 -9.051 -10.543 -12.708 1.00 0.00 O ATOM 0 H GLU A 119 -5.225 -8.448 -14.676 1.00 0.00 H new ATOM 0 HA GLU A 119 -6.460 -9.875 -16.972 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -7.372 -7.931 -14.827 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -8.379 -8.348 -16.199 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -8.518 -10.657 -15.539 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -7.206 -10.491 -14.390 1.00 0.00 H new ATOM 1836 N CYS A 120 -5.528 -8.304 -18.638 1.00 0.00 N ATOM 1837 CA CYS A 120 -5.402 -7.480 -19.860 1.00 0.00 C ATOM 1838 C CYS A 120 -6.742 -7.411 -20.653 1.00 0.00 C ATOM 1839 O CYS A 120 -7.432 -8.416 -20.838 1.00 0.00 O ATOM 1840 CB CYS A 120 -4.215 -8.080 -20.642 1.00 0.00 C ATOM 1841 SG CYS A 120 -4.128 -7.446 -22.319 1.00 0.00 S ATOM 0 H CYS A 120 -5.171 -9.253 -18.749 1.00 0.00 H new ATOM 0 HA CYS A 120 -5.198 -6.432 -19.640 1.00 0.00 H new ATOM 0 HB2 CYS A 120 -3.285 -7.854 -20.120 1.00 0.00 H new ATOM 0 HB3 CYS A 120 -4.310 -9.166 -20.669 1.00 0.00 H new ATOM 0 HG CYS A 120 -4.805 -8.222 -23.112 1.00 0.00 H new ATOM 1846 N VAL A 121 -7.112 -6.210 -21.118 1.00 0.00 N ATOM 1847 CA VAL A 121 -8.342 -6.005 -21.943 1.00 0.00 C ATOM 1848 C VAL A 121 -8.067 -4.915 -23.023 1.00 0.00 C ATOM 1849 O VAL A 121 -7.705 -3.780 -22.696 1.00 0.00 O ATOM 1850 CB VAL A 121 -9.633 -5.767 -21.081 1.00 0.00 C ATOM 1851 CG1 VAL A 121 -9.633 -4.490 -20.209 1.00 0.00 C ATOM 1852 CG2 VAL A 121 -10.922 -5.791 -21.936 1.00 0.00 C ATOM 0 H VAL A 121 -6.585 -5.354 -20.944 1.00 0.00 H new ATOM 0 HA VAL A 121 -8.571 -6.930 -22.472 1.00 0.00 H new ATOM 0 HB VAL A 121 -9.619 -6.611 -20.392 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -10.571 -4.426 -19.657 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -8.801 -4.529 -19.506 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -9.527 -3.613 -20.848 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -11.787 -5.622 -21.295 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -10.872 -5.007 -22.692 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -11.017 -6.761 -22.425 1.00 0.00 H new ATOM 1862 N MET A 122 -8.263 -5.262 -24.307 1.00 0.00 N ATOM 1863 CA MET A 122 -8.128 -4.300 -25.432 1.00 0.00 C ATOM 1864 C MET A 122 -9.492 -4.131 -26.155 1.00 0.00 C ATOM 1865 O MET A 122 -9.924 -5.012 -26.907 1.00 0.00 O ATOM 1866 CB MET A 122 -6.992 -4.802 -26.350 1.00 0.00 C ATOM 1867 CG MET A 122 -6.586 -3.787 -27.427 1.00 0.00 C ATOM 1868 SD MET A 122 -5.232 -4.431 -28.413 1.00 0.00 S ATOM 1869 CE MET A 122 -5.300 -3.162 -29.679 1.00 0.00 C ATOM 0 H MET A 122 -8.517 -6.205 -24.600 1.00 0.00 H new ATOM 0 HA MET A 122 -7.858 -3.303 -25.082 1.00 0.00 H new ATOM 0 HB2 MET A 122 -6.121 -5.042 -25.740 1.00 0.00 H new ATOM 0 HB3 MET A 122 -7.307 -5.727 -26.833 1.00 0.00 H new ATOM 0 HG2 MET A 122 -7.439 -3.567 -28.069 1.00 0.00 H new ATOM 0 HG3 MET A 122 -6.289 -2.849 -26.958 1.00 0.00 H new ATOM 0 HE1 MET A 122 -4.465 -3.290 -30.368 1.00 0.00 H new ATOM 0 HE2 MET A 122 -6.239 -3.245 -30.227 1.00 0.00 H new ATOM 0 HE3 MET A 122 -5.238 -2.179 -29.212 1.00 0.00 H new ATOM 1879 N ASN A 123 -10.180 -2.998 -25.906 1.00 0.00 N ATOM 1880 CA ASN A 123 -11.555 -2.725 -26.430 1.00 0.00 C ATOM 1881 C ASN A 123 -12.611 -3.702 -25.798 1.00 0.00 C ATOM 1882 O ASN A 123 -13.089 -3.454 -24.688 1.00 0.00 O ATOM 1883 CB ASN A 123 -11.581 -2.543 -27.986 1.00 0.00 C ATOM 1884 CG ASN A 123 -10.712 -1.402 -28.539 1.00 0.00 C ATOM 1885 OD1 ASN A 123 -10.853 -0.245 -28.162 1.00 0.00 O ATOM 1886 ND2 ASN A 123 -9.802 -1.662 -29.450 1.00 0.00 N ATOM 0 H ASN A 123 -9.807 -2.239 -25.336 1.00 0.00 H new ATOM 0 HA ASN A 123 -11.883 -1.744 -26.087 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -11.259 -3.476 -28.448 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -12.612 -2.373 -28.296 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -9.230 -0.908 -29.829 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -9.668 -2.618 -29.778 1.00 0.00 H new ATOM 1893 N ASN A 124 -12.911 -4.833 -26.459 1.00 0.00 N ATOM 1894 CA ASN A 124 -13.587 -6.013 -25.832 1.00 0.00 C ATOM 1895 C ASN A 124 -12.721 -7.322 -25.674 1.00 0.00 C ATOM 1896 O ASN A 124 -13.248 -8.334 -25.203 1.00 0.00 O ATOM 1897 CB ASN A 124 -14.915 -6.267 -26.607 1.00 0.00 C ATOM 1898 CG ASN A 124 -14.799 -6.752 -28.063 1.00 0.00 C ATOM 1899 OD1 ASN A 124 -14.688 -5.972 -29.001 1.00 0.00 O ATOM 1900 ND2 ASN A 124 -14.799 -8.043 -28.298 1.00 0.00 N ATOM 0 H ASN A 124 -12.696 -4.968 -27.447 1.00 0.00 H new ATOM 0 HA ASN A 124 -13.776 -5.752 -24.791 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -15.495 -7.004 -26.051 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -15.490 -5.341 -26.604 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -14.707 -8.387 -29.254 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -14.891 -8.702 -27.525 1.00 0.00 H new ATOM 1907 N VAL A 125 -11.437 -7.346 -26.083 1.00 0.00 N ATOM 1908 CA VAL A 125 -10.634 -8.597 -26.226 1.00 0.00 C ATOM 1909 C VAL A 125 -9.855 -8.848 -24.894 1.00 0.00 C ATOM 1910 O VAL A 125 -8.874 -8.161 -24.591 1.00 0.00 O ATOM 1911 CB VAL A 125 -9.728 -8.499 -27.505 1.00 0.00 C ATOM 1912 CG1 VAL A 125 -8.789 -9.712 -27.689 1.00 0.00 C ATOM 1913 CG2 VAL A 125 -10.530 -8.361 -28.825 1.00 0.00 C ATOM 0 H VAL A 125 -10.918 -6.502 -26.326 1.00 0.00 H new ATOM 0 HA VAL A 125 -11.268 -9.469 -26.383 1.00 0.00 H new ATOM 0 HB VAL A 125 -9.148 -7.595 -27.319 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -8.193 -9.577 -28.592 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -8.128 -9.794 -26.826 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -9.383 -10.622 -27.779 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -9.839 -8.299 -29.666 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -11.177 -9.230 -28.950 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -11.139 -7.458 -28.788 1.00 0.00 H new ATOM 1923 N THR A 126 -10.315 -9.835 -24.106 1.00 0.00 N ATOM 1924 CA THR A 126 -9.760 -10.133 -22.752 1.00 0.00 C ATOM 1925 C THR A 126 -8.597 -11.181 -22.784 1.00 0.00 C ATOM 1926 O THR A 126 -8.626 -12.179 -23.509 1.00 0.00 O ATOM 1927 CB THR A 126 -10.881 -10.555 -21.750 1.00 0.00 C ATOM 1928 OG1 THR A 126 -11.631 -11.666 -22.227 1.00 0.00 O ATOM 1929 CG2 THR A 126 -11.885 -9.443 -21.404 1.00 0.00 C ATOM 0 H THR A 126 -11.079 -10.453 -24.378 1.00 0.00 H new ATOM 0 HA THR A 126 -9.323 -9.201 -22.393 1.00 0.00 H new ATOM 0 HB THR A 126 -10.326 -10.810 -20.847 1.00 0.00 H new ATOM 0 HG1 THR A 126 -12.321 -11.901 -21.572 1.00 0.00 H new ATOM 0 HG21 THR A 126 -12.626 -9.827 -20.703 1.00 0.00 H new ATOM 0 HG22 THR A 126 -11.357 -8.604 -20.951 1.00 0.00 H new ATOM 0 HG23 THR A 126 -12.385 -9.108 -22.313 1.00 0.00 H new ATOM 1937 N CYS A 127 -7.572 -10.927 -21.956 1.00 0.00 N ATOM 1938 CA CYS A 127 -6.312 -11.709 -21.909 1.00 0.00 C ATOM 1939 C CYS A 127 -5.955 -11.938 -20.400 1.00 0.00 C ATOM 1940 O CYS A 127 -5.214 -11.162 -19.788 1.00 0.00 O ATOM 1941 CB CYS A 127 -5.217 -10.975 -22.748 1.00 0.00 C ATOM 1942 SG CYS A 127 -5.707 -9.335 -23.335 1.00 0.00 S ATOM 0 H CYS A 127 -7.589 -10.159 -21.285 1.00 0.00 H new ATOM 0 HA CYS A 127 -6.404 -12.695 -22.366 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -4.316 -10.877 -22.142 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -4.958 -11.594 -23.607 1.00 0.00 H new ATOM 0 HG CYS A 127 -4.989 -8.429 -22.740 1.00 0.00 H new ATOM 1947 N THR A 128 -6.520 -12.987 -19.768 1.00 0.00 N ATOM 1948 CA THR A 128 -6.395 -13.197 -18.290 1.00 0.00 C ATOM 1949 C THR A 128 -5.120 -14.035 -17.969 1.00 0.00 C ATOM 1950 O THR A 128 -5.035 -15.223 -18.295 1.00 0.00 O ATOM 1951 CB THR A 128 -7.712 -13.804 -17.725 1.00 0.00 C ATOM 1952 OG1 THR A 128 -8.811 -12.960 -18.055 1.00 0.00 O ATOM 1953 CG2 THR A 128 -7.743 -13.955 -16.195 1.00 0.00 C ATOM 0 H THR A 128 -7.066 -13.704 -20.245 1.00 0.00 H new ATOM 0 HA THR A 128 -6.259 -12.242 -17.783 1.00 0.00 H new ATOM 0 HB THR A 128 -7.773 -14.795 -18.174 1.00 0.00 H new ATOM 0 HG1 THR A 128 -9.638 -13.346 -17.699 1.00 0.00 H new ATOM 0 HG21 THR A 128 -8.697 -14.385 -15.891 1.00 0.00 H new ATOM 0 HG22 THR A 128 -6.932 -14.610 -15.878 1.00 0.00 H new ATOM 0 HG23 THR A 128 -7.622 -12.977 -15.730 1.00 0.00 H new ATOM 1961 N ARG A 129 -4.117 -13.389 -17.357 1.00 0.00 N ATOM 1962 CA ARG A 129 -2.754 -13.960 -17.212 1.00 0.00 C ATOM 1963 C ARG A 129 -2.469 -14.205 -15.700 1.00 0.00 C ATOM 1964 O ARG A 129 -2.296 -13.264 -14.920 1.00 0.00 O ATOM 1965 CB ARG A 129 -1.753 -12.978 -17.878 1.00 0.00 C ATOM 1966 CG ARG A 129 -1.834 -12.845 -19.422 1.00 0.00 C ATOM 1967 CD ARG A 129 -1.376 -11.486 -19.986 1.00 0.00 C ATOM 1968 NE ARG A 129 0.083 -11.253 -19.793 1.00 0.00 N ATOM 1969 CZ ARG A 129 0.753 -10.188 -20.227 1.00 0.00 C ATOM 1970 NH1 ARG A 129 0.210 -9.231 -20.938 1.00 0.00 N ATOM 1971 NH2 ARG A 129 2.015 -10.095 -19.932 1.00 0.00 N ATOM 0 H ARG A 129 -4.218 -12.460 -16.948 1.00 0.00 H new ATOM 0 HA ARG A 129 -2.653 -14.924 -17.710 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -1.904 -11.990 -17.443 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -0.743 -13.291 -17.615 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -1.226 -13.631 -19.871 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -2.864 -13.021 -19.733 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -1.611 -11.439 -21.049 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -1.936 -10.687 -19.500 1.00 0.00 H new ATOM 0 HE ARG A 129 0.610 -11.966 -19.288 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -0.778 -9.279 -21.187 1.00 0.00 H new ATOM 0 HH12 ARG A 129 0.775 -8.438 -21.242 1.00 0.00 H new ATOM 0 HH21 ARG A 129 2.465 -10.826 -19.382 1.00 0.00 H new ATOM 0 HH22 ARG A 129 2.555 -9.291 -20.250 1.00 0.00 H new ATOM 1985 N ILE A 130 -2.443 -15.476 -15.273 1.00 0.00 N ATOM 1986 CA ILE A 130 -2.249 -15.843 -13.838 1.00 0.00 C ATOM 1987 C ILE A 130 -0.722 -16.069 -13.604 1.00 0.00 C ATOM 1988 O ILE A 130 -0.126 -16.999 -14.160 1.00 0.00 O ATOM 1989 CB ILE A 130 -3.142 -17.067 -13.419 1.00 0.00 C ATOM 1990 CG1 ILE A 130 -4.659 -16.953 -13.771 1.00 0.00 C ATOM 1991 CG2 ILE A 130 -2.993 -17.430 -11.917 1.00 0.00 C ATOM 1992 CD1 ILE A 130 -5.421 -15.740 -13.206 1.00 0.00 C ATOM 0 H ILE A 130 -2.553 -16.278 -15.893 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.583 -15.034 -13.188 1.00 0.00 H new ATOM 0 HB ILE A 130 -2.742 -17.871 -14.038 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -4.754 -16.936 -14.857 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -5.156 -17.858 -13.421 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -3.632 -18.282 -11.683 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -1.955 -17.686 -11.706 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -3.288 -16.577 -11.306 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -6.462 -15.783 -13.526 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -5.375 -15.756 -12.117 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -4.966 -14.821 -13.575 1.00 0.00 H new ATOM 2004 N TYR A 131 -0.104 -15.209 -12.780 1.00 0.00 N ATOM 2005 CA TYR A 131 1.347 -15.276 -12.475 1.00 0.00 C ATOM 2006 C TYR A 131 1.554 -15.577 -10.948 1.00 0.00 C ATOM 2007 O TYR A 131 1.208 -14.755 -10.094 1.00 0.00 O ATOM 2008 CB TYR A 131 2.007 -13.927 -12.880 1.00 0.00 C ATOM 2009 CG TYR A 131 2.225 -13.560 -14.362 1.00 0.00 C ATOM 2010 CD1 TYR A 131 1.261 -12.834 -15.062 1.00 0.00 C ATOM 2011 CD2 TYR A 131 3.482 -13.757 -14.948 1.00 0.00 C ATOM 2012 CE1 TYR A 131 1.556 -12.277 -16.308 1.00 0.00 C ATOM 2013 CE2 TYR A 131 3.773 -13.214 -16.195 1.00 0.00 C ATOM 2014 CZ TYR A 131 2.813 -12.480 -16.878 1.00 0.00 C ATOM 2015 OH TYR A 131 3.110 -11.984 -18.120 1.00 0.00 O ATOM 0 H TYR A 131 -0.588 -14.447 -12.304 1.00 0.00 H new ATOM 0 HA TYR A 131 1.817 -16.080 -13.041 1.00 0.00 H new ATOM 0 HB2 TYR A 131 1.404 -13.132 -12.440 1.00 0.00 H new ATOM 0 HB3 TYR A 131 2.983 -13.892 -12.396 1.00 0.00 H new ATOM 0 HD1 TYR A 131 0.277 -12.702 -14.636 1.00 0.00 H new ATOM 0 HD2 TYR A 131 4.231 -14.335 -14.427 1.00 0.00 H new ATOM 0 HE1 TYR A 131 0.813 -11.691 -16.829 1.00 0.00 H new ATOM 0 HE2 TYR A 131 4.749 -13.364 -16.633 1.00 0.00 H new ATOM 0 HH TYR A 131 4.031 -12.221 -18.355 1.00 0.00 H new ATOM 2025 N GLU A 132 2.120 -16.744 -10.593 1.00 0.00 N ATOM 2026 CA GLU A 132 2.286 -17.189 -9.170 1.00 0.00 C ATOM 2027 C GLU A 132 3.754 -17.070 -8.628 1.00 0.00 C ATOM 2028 O GLU A 132 4.722 -17.052 -9.394 1.00 0.00 O ATOM 2029 CB GLU A 132 1.609 -18.581 -9.011 1.00 0.00 C ATOM 2030 CG GLU A 132 2.133 -19.780 -9.842 1.00 0.00 C ATOM 2031 CD GLU A 132 3.170 -20.661 -9.177 1.00 0.00 C ATOM 2032 OE1 GLU A 132 4.313 -20.210 -8.984 1.00 0.00 O ATOM 2033 OE2 GLU A 132 2.905 -21.858 -8.950 1.00 0.00 O ATOM 0 H GLU A 132 2.479 -17.415 -11.272 1.00 0.00 H new ATOM 0 HA GLU A 132 1.769 -16.497 -8.506 1.00 0.00 H new ATOM 0 HB2 GLU A 132 1.674 -18.858 -7.959 1.00 0.00 H new ATOM 0 HB3 GLU A 132 0.551 -18.459 -9.243 1.00 0.00 H new ATOM 0 HG2 GLU A 132 1.282 -20.403 -10.117 1.00 0.00 H new ATOM 0 HG3 GLU A 132 2.557 -19.393 -10.769 1.00 0.00 H new ATOM 2040 N LYS A 133 3.927 -16.887 -7.300 1.00 0.00 N ATOM 2041 CA LYS A 133 5.201 -16.359 -6.722 1.00 0.00 C ATOM 2042 C LYS A 133 6.360 -17.406 -6.629 1.00 0.00 C ATOM 2043 O LYS A 133 6.204 -18.476 -6.034 1.00 0.00 O ATOM 2044 CB LYS A 133 4.930 -15.690 -5.338 1.00 0.00 C ATOM 2045 CG LYS A 133 5.803 -14.434 -5.079 1.00 0.00 C ATOM 2046 CD LYS A 133 5.554 -13.766 -3.707 1.00 0.00 C ATOM 2047 CE LYS A 133 5.999 -12.283 -3.667 1.00 0.00 C ATOM 2048 NZ LYS A 133 6.787 -11.938 -2.458 1.00 0.00 N ATOM 0 H LYS A 133 3.210 -17.093 -6.605 1.00 0.00 H new ATOM 0 HA LYS A 133 5.560 -15.610 -7.428 1.00 0.00 H new ATOM 0 HB2 LYS A 133 3.878 -15.411 -5.278 1.00 0.00 H new ATOM 0 HB3 LYS A 133 5.112 -16.419 -4.548 1.00 0.00 H new ATOM 0 HG2 LYS A 133 6.854 -14.714 -5.150 1.00 0.00 H new ATOM 0 HG3 LYS A 133 5.614 -13.704 -5.866 1.00 0.00 H new ATOM 0 HD2 LYS A 133 4.493 -13.828 -3.466 1.00 0.00 H new ATOM 0 HD3 LYS A 133 6.089 -14.321 -2.936 1.00 0.00 H new ATOM 0 HE2 LYS A 133 6.594 -12.066 -4.554 1.00 0.00 H new ATOM 0 HE3 LYS A 133 5.116 -11.645 -3.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 6.564 -10.965 -2.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 6.548 -12.595 -1.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 7.802 -12.011 -2.673 1.00 0.00 H new ATOM 2062 N VAL A 134 7.541 -17.061 -7.174 1.00 0.00 N ATOM 2063 CA VAL A 134 8.751 -17.940 -7.129 1.00 0.00 C ATOM 2064 C VAL A 134 9.617 -17.544 -5.884 1.00 0.00 C ATOM 2065 O VAL A 134 10.532 -16.718 -5.984 1.00 0.00 O ATOM 2066 CB VAL A 134 9.541 -17.871 -8.485 1.00 0.00 C ATOM 2067 CG1 VAL A 134 10.761 -18.822 -8.529 1.00 0.00 C ATOM 2068 CG2 VAL A 134 8.702 -18.186 -9.744 1.00 0.00 C ATOM 0 H VAL A 134 7.695 -16.176 -7.657 1.00 0.00 H new ATOM 0 HA VAL A 134 8.460 -18.984 -7.012 1.00 0.00 H new ATOM 0 HB VAL A 134 9.853 -16.827 -8.509 1.00 0.00 H new ATOM 0 HG11 VAL A 134 11.263 -18.726 -9.492 1.00 0.00 H new ATOM 0 HG12 VAL A 134 11.455 -18.561 -7.730 1.00 0.00 H new ATOM 0 HG13 VAL A 134 10.426 -19.851 -8.396 1.00 0.00 H new ATOM 0 HG21 VAL A 134 9.333 -18.113 -10.630 1.00 0.00 H new ATOM 0 HG22 VAL A 134 8.298 -19.195 -9.669 1.00 0.00 H new ATOM 0 HG23 VAL A 134 7.882 -17.472 -9.823 1.00 0.00 H new ATOM 2078 N GLU A 135 9.309 -18.138 -4.720 1.00 0.00 N ATOM 2079 CA GLU A 135 10.042 -17.900 -3.446 1.00 0.00 C ATOM 2080 C GLU A 135 10.108 -19.233 -2.657 1.00 0.00 C ATOM 2081 O GLU A 135 11.235 -19.701 -2.376 1.00 0.00 O ATOM 2082 CB GLU A 135 9.397 -16.766 -2.603 1.00 0.00 C ATOM 2083 CG GLU A 135 9.598 -15.332 -3.155 1.00 0.00 C ATOM 2084 CD GLU A 135 8.945 -14.186 -2.389 1.00 0.00 C ATOM 2085 OE1 GLU A 135 8.148 -14.394 -1.450 1.00 0.00 O ATOM 2086 OE2 GLU A 135 9.178 -13.025 -2.785 1.00 0.00 O ATOM 2087 OXT GLU A 135 9.050 -19.815 -2.310 1.00 0.00 O ATOM 0 H GLU A 135 8.541 -18.803 -4.626 1.00 0.00 H new ATOM 0 HA GLU A 135 11.053 -17.562 -3.675 1.00 0.00 H new ATOM 0 HB2 GLU A 135 8.327 -16.960 -2.522 1.00 0.00 H new ATOM 0 HB3 GLU A 135 9.806 -16.809 -1.593 1.00 0.00 H new ATOM 0 HG2 GLU A 135 10.669 -15.137 -3.204 1.00 0.00 H new ATOM 0 HG3 GLU A 135 9.223 -15.310 -4.178 1.00 0.00 H new