USER MOD reduce.3.24.130724 H: found=0, std=0, add=1220, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1218 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 126 GLN : amide:sc= -2.52! C(o=-5.5!,f=-12!) USER MOD Set 1.2: A 130 GLN : amide:sc= -3.01! C(o=-5.5!,f=-17!) USER MOD Set 2.1: A 121 GLN : amide:sc= -4.66! C(o=-3.6!,f=-8!) USER MOD Set 2.2: A 122 THR OG1 : rot 80:sc= 1.04 USER MOD Set 3.1: A 100 LYS NZ :NH3+ -144:sc= -1.03 (180deg=-2.46!) USER MOD Set 3.2: A 103 ASN : amide:sc= -0.0417 K(o=-1.1,f=-3.7) USER MOD Set 4.1: A 67 SER OG : rot 171:sc= 0.572 USER MOD Set 4.2: A 70 THR OG1 : rot 150:sc= 1.23 USER MOD Set 5.1: A 28 TYR OH : rot -68:sc= 0.048 USER MOD Set 5.2: A 74 CYS SG : rot -91:sc= -3.34 USER MOD Set 5.3: A 75 SER OG : rot 180:sc= 0 USER MOD Set 6.1: A 25 SER OG : rot 82:sc= 0.132 USER MOD Set 6.2: A 32 HIS : no HE2:sc= -2! K(o=-1.9!,f=-2.4) USER MOD Single : A 19 GLN : amide:sc= -0.864 X(o=-0.86,f=-0.6) USER MOD Single : A 21 THR OG1 : rot 180:sc=0.000499 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 31 CYS SG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 45 GLN :FLIP amide:sc= -0.264 F(o=-1.7,f=-0.26) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 151:sc= -0.122 (180deg=-1.14) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 HIS : no HD1:sc= -2.91 X(o=-2.9,f=-2.8) USER MOD Single : A 64 HIS : no HD1:sc= -2.49! C(o=-2.5!,f=-2.3!) USER MOD Single : A 71 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 GLN : amide:sc= -0.0231 K(o=-0.023,f=-0.84) USER MOD Single : A 77 MET CE :methyl -158:sc= -2.14 (180deg=-3.47!) USER MOD Single : A 79 CYS SG : rot -161:sc= -0.682 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 95:sc= 0.441 USER MOD Single : A 86 TYR OH : rot -128:sc= 0.913 USER MOD Single : A 88 SER OG : rot -44:sc= 0.424 USER MOD Single : A 89 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 ASN :FLIP amide:sc= -8.22! C(o=-8.8!,f=-8.2!) USER MOD Single : A 93 THR OG1 : rot 140:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot -148:sc= 0.414 USER MOD Single : A 109 THR OG1 : rot 76:sc= 0.19 USER MOD Single : A 110 MET CE :methyl -132:sc= 0 (180deg=-1.01) USER MOD Single : A 111 CYS SG : rot 91:sc= -2.35 USER MOD Single : A 112 ASN : amide:sc= -1.25 K(o=-1.3,f=-7.6!) USER MOD Single : A 114 HIS : no HD1:sc= 0 X(o=0,f=-0.0036) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 3:sc= 1.12 USER MOD Single : A 127 LYS NZ :NH3+ -169:sc=-0.00105 (180deg=-0.112) USER MOD Single : A 128 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 MET CE :methyl -153:sc= 0 (180deg=-0.735) USER MOD Single : A 144 ASN : amide:sc= -0.0257 K(o=-0.026,f=-1.5!) USER MOD Single : A 148 ASN :FLIP amide:sc= -2.81! C(o=-4.4!,f=-2.8!) USER MOD Single : A 151 GLN : amide:sc= -0.267 K(o=-0.27,f=-2.2!) USER MOD Single : A 153 ASN : amide:sc= -0.833 K(o=-0.83,f=-4.8!) USER MOD Single : A 154 THR OG1 : rot 180:sc= -1.32 USER MOD Single : A 155 THR OG1 : rot 180:sc= -0.934 USER MOD Single : A 160 MET CE :methyl -123:sc= -2.43! (180deg=-7.66!) USER MOD Single : A 161 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 164 MET CE :methyl -168:sc= 0 (180deg=-0.326) USER MOD Single : A 167 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 171 THR OG1 : rot 180:sc= 0.00964 USER MOD ----------------------------------------------------------------- ATOM 69 N GLU A 13 1.276 -12.445 5.643 1.00 0.00 N ATOM 70 CA GLU A 13 2.415 -11.680 5.148 1.00 0.00 C ATOM 71 C GLU A 13 3.160 -11.007 6.297 1.00 0.00 C ATOM 72 O GLU A 13 4.388 -11.035 6.355 1.00 0.00 O ATOM 73 CB GLU A 13 1.950 -10.625 4.140 1.00 0.00 C ATOM 74 CG GLU A 13 1.355 -11.215 2.873 1.00 0.00 C ATOM 75 CD GLU A 13 1.040 -10.160 1.831 1.00 0.00 C ATOM 76 OE1 GLU A 13 -0.084 -9.616 1.857 1.00 0.00 O ATOM 77 OE2 GLU A 13 1.918 -9.878 0.988 1.00 0.00 O ATOM 0 HA GLU A 13 3.096 -12.372 4.652 1.00 0.00 H new ATOM 0 HB2 GLU A 13 1.208 -9.983 4.615 1.00 0.00 H new ATOM 0 HB3 GLU A 13 2.796 -9.992 3.873 1.00 0.00 H new ATOM 0 HG2 GLU A 13 2.052 -11.940 2.452 1.00 0.00 H new ATOM 0 HG3 GLU A 13 0.443 -11.758 3.123 1.00 0.00 H new ATOM 84 N GLY A 14 2.406 -10.403 7.210 1.00 0.00 N ATOM 85 CA GLY A 14 3.011 -9.731 8.346 1.00 0.00 C ATOM 86 C GLY A 14 4.229 -10.464 8.871 1.00 0.00 C ATOM 87 O GLY A 14 5.349 -9.960 8.786 1.00 0.00 O ATOM 0 H GLY A 14 1.387 -10.367 7.184 1.00 0.00 H new ATOM 0 HA2 GLY A 14 3.296 -8.720 8.056 1.00 0.00 H new ATOM 0 HA3 GLY A 14 2.274 -9.638 9.144 1.00 0.00 H new ATOM 91 N ASP A 15 4.011 -11.655 9.417 1.00 0.00 N ATOM 92 CA ASP A 15 5.100 -12.459 9.959 1.00 0.00 C ATOM 93 C ASP A 15 6.331 -12.383 9.061 1.00 0.00 C ATOM 94 O ASP A 15 7.452 -12.222 9.540 1.00 0.00 O ATOM 95 CB ASP A 15 4.658 -13.914 10.119 1.00 0.00 C ATOM 96 CG ASP A 15 4.922 -14.739 8.874 1.00 0.00 C ATOM 97 OD1 ASP A 15 6.068 -15.205 8.703 1.00 0.00 O ATOM 98 OD2 ASP A 15 3.983 -14.918 8.071 1.00 0.00 O ATOM 0 H ASP A 15 3.090 -12.085 9.496 1.00 0.00 H new ATOM 0 HA ASP A 15 5.362 -12.058 10.938 1.00 0.00 H new ATOM 0 HB2 ASP A 15 5.182 -14.359 10.964 1.00 0.00 H new ATOM 0 HB3 ASP A 15 3.594 -13.944 10.352 1.00 0.00 H new ATOM 103 N ALA A 16 6.112 -12.502 7.755 1.00 0.00 N ATOM 104 CA ALA A 16 7.202 -12.446 6.790 1.00 0.00 C ATOM 105 C ALA A 16 7.899 -11.090 6.826 1.00 0.00 C ATOM 106 O ALA A 16 9.120 -11.011 6.963 1.00 0.00 O ATOM 107 CB ALA A 16 6.683 -12.737 5.390 1.00 0.00 C ATOM 0 H ALA A 16 5.189 -12.638 7.342 1.00 0.00 H new ATOM 0 HA ALA A 16 7.933 -13.208 7.061 1.00 0.00 H new ATOM 0 HB1 ALA A 16 7.508 -12.692 4.679 1.00 0.00 H new ATOM 0 HB2 ALA A 16 6.238 -13.732 5.366 1.00 0.00 H new ATOM 0 HB3 ALA A 16 5.930 -11.996 5.120 1.00 0.00 H new ATOM 113 N LEU A 17 7.115 -10.024 6.702 1.00 0.00 N ATOM 114 CA LEU A 17 7.657 -8.670 6.720 1.00 0.00 C ATOM 115 C LEU A 17 8.430 -8.410 8.009 1.00 0.00 C ATOM 116 O LEU A 17 9.607 -8.049 7.978 1.00 0.00 O ATOM 117 CB LEU A 17 6.530 -7.646 6.571 1.00 0.00 C ATOM 118 CG LEU A 17 5.766 -7.676 5.247 1.00 0.00 C ATOM 119 CD1 LEU A 17 4.604 -6.696 5.279 1.00 0.00 C ATOM 120 CD2 LEU A 17 6.699 -7.363 4.086 1.00 0.00 C ATOM 0 H LEU A 17 6.103 -10.071 6.588 1.00 0.00 H new ATOM 0 HA LEU A 17 8.344 -8.569 5.880 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.818 -7.799 7.382 1.00 0.00 H new ATOM 0 HB3 LEU A 17 6.952 -6.650 6.701 1.00 0.00 H new ATOM 0 HG LEU A 17 5.364 -8.679 5.104 1.00 0.00 H new ATOM 0 HD11 LEU A 17 4.072 -6.731 4.328 1.00 0.00 H new ATOM 0 HD12 LEU A 17 3.923 -6.965 6.086 1.00 0.00 H new ATOM 0 HD13 LEU A 17 4.983 -5.688 5.445 1.00 0.00 H new ATOM 0 HD21 LEU A 17 6.138 -7.389 3.152 1.00 0.00 H new ATOM 0 HD22 LEU A 17 7.131 -6.371 4.223 1.00 0.00 H new ATOM 0 HD23 LEU A 17 7.497 -8.104 4.051 1.00 0.00 H new ATOM 132 N LEU A 18 7.761 -8.596 9.141 1.00 0.00 N ATOM 133 CA LEU A 18 8.385 -8.384 10.443 1.00 0.00 C ATOM 134 C LEU A 18 9.859 -8.773 10.409 1.00 0.00 C ATOM 135 O LEU A 18 10.712 -8.052 10.927 1.00 0.00 O ATOM 136 CB LEU A 18 7.656 -9.193 11.517 1.00 0.00 C ATOM 137 CG LEU A 18 6.481 -8.494 12.202 1.00 0.00 C ATOM 138 CD1 LEU A 18 5.556 -9.514 12.847 1.00 0.00 C ATOM 139 CD2 LEU A 18 6.982 -7.496 13.235 1.00 0.00 C ATOM 0 H LEU A 18 6.786 -8.893 9.184 1.00 0.00 H new ATOM 0 HA LEU A 18 8.314 -7.324 10.685 1.00 0.00 H new ATOM 0 HB2 LEU A 18 7.290 -10.114 11.064 1.00 0.00 H new ATOM 0 HB3 LEU A 18 8.379 -9.479 12.281 1.00 0.00 H new ATOM 0 HG LEU A 18 5.916 -7.949 11.446 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.726 -8.998 13.330 1.00 0.00 H new ATOM 0 HD12 LEU A 18 5.169 -10.189 12.083 1.00 0.00 H new ATOM 0 HD13 LEU A 18 6.109 -10.087 13.591 1.00 0.00 H new ATOM 0 HD21 LEU A 18 6.132 -7.008 13.712 1.00 0.00 H new ATOM 0 HD22 LEU A 18 7.571 -8.018 13.989 1.00 0.00 H new ATOM 0 HD23 LEU A 18 7.603 -6.746 12.745 1.00 0.00 H new ATOM 151 N GLN A 19 10.151 -9.915 9.795 1.00 0.00 N ATOM 152 CA GLN A 19 11.523 -10.398 9.693 1.00 0.00 C ATOM 153 C GLN A 19 12.374 -9.448 8.857 1.00 0.00 C ATOM 154 O GLN A 19 13.459 -9.040 9.273 1.00 0.00 O ATOM 155 CB GLN A 19 11.549 -11.799 9.079 1.00 0.00 C ATOM 156 CG GLN A 19 11.294 -12.909 10.086 1.00 0.00 C ATOM 157 CD GLN A 19 12.166 -12.789 11.320 1.00 0.00 C ATOM 158 OE1 GLN A 19 13.312 -13.241 11.331 1.00 0.00 O ATOM 159 NE2 GLN A 19 11.629 -12.178 12.369 1.00 0.00 N ATOM 0 H GLN A 19 9.456 -10.523 9.361 1.00 0.00 H new ATOM 0 HA GLN A 19 11.941 -10.442 10.699 1.00 0.00 H new ATOM 0 HB2 GLN A 19 10.798 -11.855 8.291 1.00 0.00 H new ATOM 0 HB3 GLN A 19 12.518 -11.962 8.608 1.00 0.00 H new ATOM 0 HG2 GLN A 19 10.246 -12.891 10.383 1.00 0.00 H new ATOM 0 HG3 GLN A 19 11.474 -13.874 9.611 1.00 0.00 H new ATOM 0 HE21 GLN A 19 10.676 -11.818 12.317 1.00 0.00 H new ATOM 0 HE22 GLN A 19 12.169 -12.068 13.227 1.00 0.00 H new ATOM 168 N PHE A 20 11.875 -9.099 7.676 1.00 0.00 N ATOM 169 CA PHE A 20 12.591 -8.198 6.780 1.00 0.00 C ATOM 170 C PHE A 20 12.660 -6.790 7.366 1.00 0.00 C ATOM 171 O PHE A 20 13.744 -6.244 7.574 1.00 0.00 O ATOM 172 CB PHE A 20 11.909 -8.159 5.410 1.00 0.00 C ATOM 173 CG PHE A 20 12.390 -7.038 4.533 1.00 0.00 C ATOM 174 CD1 PHE A 20 13.540 -7.180 3.774 1.00 0.00 C ATOM 175 CD2 PHE A 20 11.692 -5.844 4.468 1.00 0.00 C ATOM 176 CE1 PHE A 20 13.985 -6.151 2.965 1.00 0.00 C ATOM 177 CE2 PHE A 20 12.131 -4.811 3.661 1.00 0.00 C ATOM 178 CZ PHE A 20 13.280 -4.965 2.910 1.00 0.00 C ATOM 0 H PHE A 20 10.978 -9.426 7.317 1.00 0.00 H new ATOM 0 HA PHE A 20 13.607 -8.574 6.662 1.00 0.00 H new ATOM 0 HB2 PHE A 20 12.080 -9.107 4.901 1.00 0.00 H new ATOM 0 HB3 PHE A 20 10.832 -8.063 5.551 1.00 0.00 H new ATOM 0 HD1 PHE A 20 14.095 -8.105 3.815 1.00 0.00 H new ATOM 0 HD2 PHE A 20 10.794 -5.718 5.055 1.00 0.00 H new ATOM 0 HE1 PHE A 20 14.882 -6.275 2.377 1.00 0.00 H new ATOM 0 HE2 PHE A 20 11.577 -3.885 3.618 1.00 0.00 H new ATOM 0 HZ PHE A 20 13.627 -4.159 2.281 1.00 0.00 H new ATOM 188 N THR A 21 11.494 -6.207 7.628 1.00 0.00 N ATOM 189 CA THR A 21 11.421 -4.863 8.188 1.00 0.00 C ATOM 190 C THR A 21 12.354 -4.715 9.385 1.00 0.00 C ATOM 191 O THR A 21 13.159 -3.786 9.445 1.00 0.00 O ATOM 192 CB THR A 21 9.986 -4.514 8.624 1.00 0.00 C ATOM 193 OG1 THR A 21 9.066 -4.816 7.568 1.00 0.00 O ATOM 194 CG2 THR A 21 9.876 -3.042 8.993 1.00 0.00 C ATOM 0 H THR A 21 10.588 -6.644 7.461 1.00 0.00 H new ATOM 0 HA THR A 21 11.731 -4.175 7.402 1.00 0.00 H new ATOM 0 HB THR A 21 9.741 -5.112 9.502 1.00 0.00 H new ATOM 0 HG1 THR A 21 8.155 -4.593 7.854 1.00 0.00 H new ATOM 0 HG21 THR A 21 8.854 -2.819 9.298 1.00 0.00 H new ATOM 0 HG22 THR A 21 10.556 -2.821 9.816 1.00 0.00 H new ATOM 0 HG23 THR A 21 10.139 -2.430 8.130 1.00 0.00 H new ATOM 202 N ALA A 22 12.239 -5.636 10.336 1.00 0.00 N ATOM 203 CA ALA A 22 13.075 -5.608 11.530 1.00 0.00 C ATOM 204 C ALA A 22 14.540 -5.389 11.171 1.00 0.00 C ATOM 205 O ALA A 22 15.183 -4.472 11.681 1.00 0.00 O ATOM 206 CB ALA A 22 12.910 -6.899 12.319 1.00 0.00 C ATOM 0 H ALA A 22 11.576 -6.410 10.303 1.00 0.00 H new ATOM 0 HA ALA A 22 12.752 -4.771 12.150 1.00 0.00 H new ATOM 0 HB1 ALA A 22 13.540 -6.865 13.208 1.00 0.00 H new ATOM 0 HB2 ALA A 22 11.868 -7.013 12.617 1.00 0.00 H new ATOM 0 HB3 ALA A 22 13.204 -7.745 11.698 1.00 0.00 H new ATOM 212 N GLU A 23 15.062 -6.237 10.290 1.00 0.00 N ATOM 213 CA GLU A 23 16.453 -6.135 9.864 1.00 0.00 C ATOM 214 C GLU A 23 16.681 -4.864 9.050 1.00 0.00 C ATOM 215 O GLU A 23 17.453 -3.991 9.446 1.00 0.00 O ATOM 216 CB GLU A 23 16.847 -7.361 9.037 1.00 0.00 C ATOM 217 CG GLU A 23 17.189 -8.579 9.879 1.00 0.00 C ATOM 218 CD GLU A 23 17.939 -9.638 9.095 1.00 0.00 C ATOM 219 OE1 GLU A 23 17.279 -10.486 8.460 1.00 0.00 O ATOM 220 OE2 GLU A 23 19.188 -9.617 9.116 1.00 0.00 O ATOM 0 H GLU A 23 14.543 -7.001 9.858 1.00 0.00 H new ATOM 0 HA GLU A 23 17.078 -6.091 10.756 1.00 0.00 H new ATOM 0 HB2 GLU A 23 16.028 -7.613 8.364 1.00 0.00 H new ATOM 0 HB3 GLU A 23 17.705 -7.108 8.414 1.00 0.00 H new ATOM 0 HG2 GLU A 23 17.792 -8.269 10.732 1.00 0.00 H new ATOM 0 HG3 GLU A 23 16.271 -9.010 10.278 1.00 0.00 H new ATOM 227 N PHE A 24 16.005 -4.769 7.910 1.00 0.00 N ATOM 228 CA PHE A 24 16.134 -3.607 7.039 1.00 0.00 C ATOM 229 C PHE A 24 16.272 -2.327 7.858 1.00 0.00 C ATOM 230 O PHE A 24 17.066 -1.446 7.525 1.00 0.00 O ATOM 231 CB PHE A 24 14.924 -3.503 6.109 1.00 0.00 C ATOM 232 CG PHE A 24 14.984 -2.326 5.177 1.00 0.00 C ATOM 233 CD1 PHE A 24 14.907 -1.033 5.667 1.00 0.00 C ATOM 234 CD2 PHE A 24 15.117 -2.515 3.810 1.00 0.00 C ATOM 235 CE1 PHE A 24 14.962 0.052 4.812 1.00 0.00 C ATOM 236 CE2 PHE A 24 15.173 -1.434 2.951 1.00 0.00 C ATOM 237 CZ PHE A 24 15.095 -0.149 3.452 1.00 0.00 C ATOM 0 H PHE A 24 15.362 -5.483 7.568 1.00 0.00 H new ATOM 0 HA PHE A 24 17.035 -3.732 6.438 1.00 0.00 H new ATOM 0 HB2 PHE A 24 14.847 -4.418 5.522 1.00 0.00 H new ATOM 0 HB3 PHE A 24 14.018 -3.434 6.711 1.00 0.00 H new ATOM 0 HD1 PHE A 24 14.803 -0.870 6.730 1.00 0.00 H new ATOM 0 HD2 PHE A 24 15.177 -3.517 3.412 1.00 0.00 H new ATOM 0 HE1 PHE A 24 14.901 1.055 5.207 1.00 0.00 H new ATOM 0 HE2 PHE A 24 15.278 -1.594 1.888 1.00 0.00 H new ATOM 0 HZ PHE A 24 15.138 0.697 2.782 1.00 0.00 H new ATOM 247 N SER A 25 15.494 -2.230 8.931 1.00 0.00 N ATOM 248 CA SER A 25 15.525 -1.057 9.796 1.00 0.00 C ATOM 249 C SER A 25 16.899 -0.891 10.436 1.00 0.00 C ATOM 250 O SER A 25 17.510 0.175 10.354 1.00 0.00 O ATOM 251 CB SER A 25 14.453 -1.169 10.882 1.00 0.00 C ATOM 252 OG SER A 25 13.168 -0.873 10.363 1.00 0.00 O ATOM 0 H SER A 25 14.834 -2.951 9.222 1.00 0.00 H new ATOM 0 HA SER A 25 15.320 -0.179 9.184 1.00 0.00 H new ATOM 0 HB2 SER A 25 14.457 -2.176 11.299 1.00 0.00 H new ATOM 0 HB3 SER A 25 14.685 -0.485 11.698 1.00 0.00 H new ATOM 0 HG SER A 25 12.803 -1.667 9.920 1.00 0.00 H new ATOM 258 N SER A 26 17.380 -1.953 11.075 1.00 0.00 N ATOM 259 CA SER A 26 18.680 -1.925 11.734 1.00 0.00 C ATOM 260 C SER A 26 19.810 -1.942 10.708 1.00 0.00 C ATOM 261 O SER A 26 20.638 -1.032 10.665 1.00 0.00 O ATOM 262 CB SER A 26 18.820 -3.116 12.683 1.00 0.00 C ATOM 263 OG SER A 26 18.240 -2.834 13.945 1.00 0.00 O ATOM 0 H SER A 26 16.888 -2.844 11.150 1.00 0.00 H new ATOM 0 HA SER A 26 18.748 -1.001 12.309 1.00 0.00 H new ATOM 0 HB2 SER A 26 18.340 -3.991 12.246 1.00 0.00 H new ATOM 0 HB3 SER A 26 19.874 -3.361 12.811 1.00 0.00 H new ATOM 0 HG SER A 26 18.341 -3.612 14.533 1.00 0.00 H new ATOM 269 N ARG A 27 19.836 -2.984 9.884 1.00 0.00 N ATOM 270 CA ARG A 27 20.863 -3.122 8.859 1.00 0.00 C ATOM 271 C ARG A 27 21.179 -1.772 8.220 1.00 0.00 C ATOM 272 O ARG A 27 22.332 -1.478 7.904 1.00 0.00 O ATOM 273 CB ARG A 27 20.412 -4.113 7.784 1.00 0.00 C ATOM 274 CG ARG A 27 19.621 -3.471 6.657 1.00 0.00 C ATOM 275 CD ARG A 27 20.535 -2.968 5.551 1.00 0.00 C ATOM 276 NE ARG A 27 21.006 -4.052 4.694 1.00 0.00 N ATOM 277 CZ ARG A 27 22.127 -3.995 3.984 1.00 0.00 C ATOM 278 NH1 ARG A 27 22.889 -2.910 4.029 1.00 0.00 N ATOM 279 NH2 ARG A 27 22.489 -5.023 3.228 1.00 0.00 N ATOM 0 H ARG A 27 19.157 -3.745 9.906 1.00 0.00 H new ATOM 0 HA ARG A 27 21.767 -3.500 9.336 1.00 0.00 H new ATOM 0 HB2 ARG A 27 21.289 -4.606 7.366 1.00 0.00 H new ATOM 0 HB3 ARG A 27 19.802 -4.888 8.249 1.00 0.00 H new ATOM 0 HG2 ARG A 27 18.917 -4.195 6.247 1.00 0.00 H new ATOM 0 HG3 ARG A 27 19.033 -2.642 7.050 1.00 0.00 H new ATOM 0 HD2 ARG A 27 20.002 -2.234 4.947 1.00 0.00 H new ATOM 0 HD3 ARG A 27 21.391 -2.457 5.992 1.00 0.00 H new ATOM 0 HE ARG A 27 20.443 -4.900 4.637 1.00 0.00 H new ATOM 0 HH11 ARG A 27 22.614 -2.118 4.610 1.00 0.00 H new ATOM 0 HH12 ARG A 27 23.750 -2.868 3.483 1.00 0.00 H new ATOM 0 HH21 ARG A 27 21.906 -5.859 3.191 1.00 0.00 H new ATOM 0 HH22 ARG A 27 23.350 -4.977 2.683 1.00 0.00 H new ATOM 293 N TYR A 28 20.147 -0.956 8.034 1.00 0.00 N ATOM 294 CA TYR A 28 20.314 0.361 7.431 1.00 0.00 C ATOM 295 C TYR A 28 20.481 1.434 8.503 1.00 0.00 C ATOM 296 O TYR A 28 21.534 2.061 8.611 1.00 0.00 O ATOM 297 CB TYR A 28 19.114 0.694 6.544 1.00 0.00 C ATOM 298 CG TYR A 28 19.176 0.054 5.176 1.00 0.00 C ATOM 299 CD1 TYR A 28 20.247 0.291 4.324 1.00 0.00 C ATOM 300 CD2 TYR A 28 18.163 -0.790 4.736 1.00 0.00 C ATOM 301 CE1 TYR A 28 20.307 -0.292 3.072 1.00 0.00 C ATOM 302 CE2 TYR A 28 18.216 -1.379 3.487 1.00 0.00 C ATOM 303 CZ TYR A 28 19.290 -1.126 2.659 1.00 0.00 C ATOM 304 OH TYR A 28 19.347 -1.709 1.414 1.00 0.00 O ATOM 0 H TYR A 28 19.187 -1.183 8.292 1.00 0.00 H new ATOM 0 HA TYR A 28 21.216 0.341 6.819 1.00 0.00 H new ATOM 0 HB2 TYR A 28 18.202 0.372 7.046 1.00 0.00 H new ATOM 0 HB3 TYR A 28 19.048 1.776 6.427 1.00 0.00 H new ATOM 0 HD1 TYR A 28 21.047 0.942 4.645 1.00 0.00 H new ATOM 0 HD2 TYR A 28 17.320 -0.989 5.381 1.00 0.00 H new ATOM 0 HE1 TYR A 28 21.146 -0.095 2.421 1.00 0.00 H new ATOM 0 HE2 TYR A 28 17.421 -2.034 3.161 1.00 0.00 H new ATOM 0 HH TYR A 28 19.253 -1.019 0.725 1.00 0.00 H new ATOM 314 N GLY A 29 19.433 1.638 9.296 1.00 0.00 N ATOM 315 CA GLY A 29 19.484 2.634 10.350 1.00 0.00 C ATOM 316 C GLY A 29 18.109 2.979 10.888 1.00 0.00 C ATOM 317 O GLY A 29 17.108 2.848 10.183 1.00 0.00 O ATOM 0 H GLY A 29 18.550 1.131 9.227 1.00 0.00 H new ATOM 0 HA2 GLY A 29 20.108 2.265 11.164 1.00 0.00 H new ATOM 0 HA3 GLY A 29 19.959 3.538 9.969 1.00 0.00 H new ATOM 321 N ASP A 30 18.059 3.418 12.141 1.00 0.00 N ATOM 322 CA ASP A 30 16.797 3.781 12.774 1.00 0.00 C ATOM 323 C ASP A 30 15.958 4.658 11.849 1.00 0.00 C ATOM 324 O ASP A 30 14.737 4.511 11.777 1.00 0.00 O ATOM 325 CB ASP A 30 17.054 4.510 14.093 1.00 0.00 C ATOM 326 CG ASP A 30 17.485 3.568 15.200 1.00 0.00 C ATOM 327 OD1 ASP A 30 18.387 2.738 14.957 1.00 0.00 O ATOM 328 OD2 ASP A 30 16.921 3.660 16.311 1.00 0.00 O ATOM 0 H ASP A 30 18.878 3.531 12.738 1.00 0.00 H new ATOM 0 HA ASP A 30 16.244 2.864 12.977 1.00 0.00 H new ATOM 0 HB2 ASP A 30 17.824 5.266 13.943 1.00 0.00 H new ATOM 0 HB3 ASP A 30 16.148 5.034 14.398 1.00 0.00 H new ATOM 333 N CYS A 31 16.620 5.570 11.146 1.00 0.00 N ATOM 334 CA CYS A 31 15.935 6.473 10.228 1.00 0.00 C ATOM 335 C CYS A 31 15.287 5.697 9.086 1.00 0.00 C ATOM 336 O CYS A 31 15.969 5.231 8.172 1.00 0.00 O ATOM 337 CB CYS A 31 16.916 7.505 9.668 1.00 0.00 C ATOM 338 SG CYS A 31 17.106 8.977 10.699 1.00 0.00 S ATOM 0 H CYS A 31 17.630 5.704 11.194 1.00 0.00 H new ATOM 0 HA CYS A 31 15.152 6.991 10.782 1.00 0.00 H new ATOM 0 HB2 CYS A 31 17.891 7.034 9.543 1.00 0.00 H new ATOM 0 HB3 CYS A 31 16.580 7.810 8.677 1.00 0.00 H new ATOM 0 HG CYS A 31 17.956 9.789 10.144 1.00 0.00 H new ATOM 344 N HIS A 32 13.966 5.562 9.144 1.00 0.00 N ATOM 345 CA HIS A 32 13.225 4.842 8.115 1.00 0.00 C ATOM 346 C HIS A 32 11.725 5.088 8.252 1.00 0.00 C ATOM 347 O HIS A 32 11.212 5.350 9.340 1.00 0.00 O ATOM 348 CB HIS A 32 13.518 3.344 8.200 1.00 0.00 C ATOM 349 CG HIS A 32 12.994 2.701 9.447 1.00 0.00 C ATOM 350 ND1 HIS A 32 11.678 2.318 9.601 1.00 0.00 N ATOM 351 CD2 HIS A 32 13.617 2.372 10.603 1.00 0.00 C ATOM 352 CE1 HIS A 32 11.515 1.784 10.798 1.00 0.00 C ATOM 353 NE2 HIS A 32 12.676 1.804 11.426 1.00 0.00 N ATOM 0 H HIS A 32 13.387 5.942 9.893 1.00 0.00 H new ATOM 0 HA HIS A 32 13.548 5.213 7.143 1.00 0.00 H new ATOM 0 HB2 HIS A 32 13.081 2.847 7.334 1.00 0.00 H new ATOM 0 HB3 HIS A 32 14.596 3.189 8.147 1.00 0.00 H new ATOM 0 HD1 HIS A 32 10.945 2.430 8.900 1.00 0.00 H new ATOM 0 HD2 HIS A 32 14.660 2.527 10.835 1.00 0.00 H new ATOM 0 HE1 HIS A 32 10.589 1.397 11.196 1.00 0.00 H new ATOM 361 N PRO A 33 11.005 5.002 7.124 1.00 0.00 N ATOM 362 CA PRO A 33 9.555 5.212 7.093 1.00 0.00 C ATOM 363 C PRO A 33 8.791 4.086 7.782 1.00 0.00 C ATOM 364 O PRO A 33 9.146 2.914 7.657 1.00 0.00 O ATOM 365 CB PRO A 33 9.232 5.239 5.597 1.00 0.00 C ATOM 366 CG PRO A 33 10.323 4.449 4.960 1.00 0.00 C ATOM 367 CD PRO A 33 11.551 4.693 5.792 1.00 0.00 C ATOM 0 HA PRO A 33 9.264 6.119 7.623 1.00 0.00 H new ATOM 0 HB2 PRO A 33 8.255 4.800 5.395 1.00 0.00 H new ATOM 0 HB3 PRO A 33 9.208 6.260 5.216 1.00 0.00 H new ATOM 0 HG2 PRO A 33 10.073 3.388 4.935 1.00 0.00 H new ATOM 0 HG3 PRO A 33 10.482 4.764 3.929 1.00 0.00 H new ATOM 0 HD2 PRO A 33 12.200 3.818 5.817 1.00 0.00 H new ATOM 0 HD3 PRO A 33 12.145 5.519 5.400 1.00 0.00 H new ATOM 375 N VAL A 34 7.740 4.450 8.510 1.00 0.00 N ATOM 376 CA VAL A 34 6.925 3.470 9.218 1.00 0.00 C ATOM 377 C VAL A 34 6.315 2.460 8.251 1.00 0.00 C ATOM 378 O VAL A 34 5.531 2.821 7.373 1.00 0.00 O ATOM 379 CB VAL A 34 5.794 4.149 10.013 1.00 0.00 C ATOM 380 CG1 VAL A 34 4.917 4.982 9.090 1.00 0.00 C ATOM 381 CG2 VAL A 34 4.966 3.111 10.755 1.00 0.00 C ATOM 0 H VAL A 34 7.433 5.416 8.625 1.00 0.00 H new ATOM 0 HA VAL A 34 7.587 2.951 9.912 1.00 0.00 H new ATOM 0 HB VAL A 34 6.242 4.816 10.749 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.124 5.454 9.670 1.00 0.00 H new ATOM 0 HG12 VAL A 34 5.522 5.751 8.610 1.00 0.00 H new ATOM 0 HG13 VAL A 34 4.476 4.339 8.328 1.00 0.00 H new ATOM 0 HG21 VAL A 34 4.172 3.609 11.311 1.00 0.00 H new ATOM 0 HG22 VAL A 34 4.527 2.416 10.039 1.00 0.00 H new ATOM 0 HG23 VAL A 34 5.605 2.563 11.447 1.00 0.00 H new ATOM 391 N PHE A 35 6.680 1.194 8.419 1.00 0.00 N ATOM 392 CA PHE A 35 6.170 0.131 7.561 1.00 0.00 C ATOM 393 C PHE A 35 4.925 -0.508 8.168 1.00 0.00 C ATOM 394 O PHE A 35 4.891 -0.818 9.359 1.00 0.00 O ATOM 395 CB PHE A 35 7.246 -0.934 7.337 1.00 0.00 C ATOM 396 CG PHE A 35 8.480 -0.406 6.663 1.00 0.00 C ATOM 397 CD1 PHE A 35 8.502 -0.196 5.293 1.00 0.00 C ATOM 398 CD2 PHE A 35 9.619 -0.120 7.399 1.00 0.00 C ATOM 399 CE1 PHE A 35 9.637 0.289 4.671 1.00 0.00 C ATOM 400 CE2 PHE A 35 10.756 0.366 6.782 1.00 0.00 C ATOM 401 CZ PHE A 35 10.765 0.571 5.416 1.00 0.00 C ATOM 0 H PHE A 35 7.327 0.879 9.142 1.00 0.00 H new ATOM 0 HA PHE A 35 5.900 0.572 6.601 1.00 0.00 H new ATOM 0 HB2 PHE A 35 7.523 -1.367 8.298 1.00 0.00 H new ATOM 0 HB3 PHE A 35 6.828 -1.740 6.733 1.00 0.00 H new ATOM 0 HD1 PHE A 35 7.623 -0.414 4.705 1.00 0.00 H new ATOM 0 HD2 PHE A 35 9.618 -0.279 8.467 1.00 0.00 H new ATOM 0 HE1 PHE A 35 9.642 0.447 3.603 1.00 0.00 H new ATOM 0 HE2 PHE A 35 11.637 0.585 7.367 1.00 0.00 H new ATOM 0 HZ PHE A 35 11.652 0.951 4.932 1.00 0.00 H new ATOM 411 N PHE A 36 3.903 -0.702 7.341 1.00 0.00 N ATOM 412 CA PHE A 36 2.654 -1.302 7.796 1.00 0.00 C ATOM 413 C PHE A 36 2.792 -2.817 7.918 1.00 0.00 C ATOM 414 O PHE A 36 3.094 -3.504 6.941 1.00 0.00 O ATOM 415 CB PHE A 36 1.517 -0.958 6.833 1.00 0.00 C ATOM 416 CG PHE A 36 0.166 -1.400 7.318 1.00 0.00 C ATOM 417 CD1 PHE A 36 -0.121 -2.746 7.480 1.00 0.00 C ATOM 418 CD2 PHE A 36 -0.818 -0.469 7.611 1.00 0.00 C ATOM 419 CE1 PHE A 36 -1.363 -3.156 7.926 1.00 0.00 C ATOM 420 CE2 PHE A 36 -2.062 -0.873 8.058 1.00 0.00 C ATOM 421 CZ PHE A 36 -2.335 -2.218 8.214 1.00 0.00 C ATOM 0 H PHE A 36 3.915 -0.452 6.352 1.00 0.00 H new ATOM 0 HA PHE A 36 2.422 -0.895 8.780 1.00 0.00 H new ATOM 0 HB2 PHE A 36 1.502 0.120 6.672 1.00 0.00 H new ATOM 0 HB3 PHE A 36 1.717 -1.422 5.867 1.00 0.00 H new ATOM 0 HD1 PHE A 36 0.635 -3.484 7.255 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -0.610 0.584 7.489 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -1.573 -4.208 8.049 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -2.820 -0.138 8.285 1.00 0.00 H new ATOM 0 HZ PHE A 36 -3.307 -2.536 8.561 1.00 0.00 H new ATOM 431 N ILE A 37 2.569 -3.331 9.123 1.00 0.00 N ATOM 432 CA ILE A 37 2.667 -4.764 9.372 1.00 0.00 C ATOM 433 C ILE A 37 1.378 -5.479 8.982 1.00 0.00 C ATOM 434 O ILE A 37 0.329 -5.264 9.586 1.00 0.00 O ATOM 435 CB ILE A 37 2.977 -5.058 10.852 1.00 0.00 C ATOM 436 CG1 ILE A 37 4.293 -4.394 11.262 1.00 0.00 C ATOM 437 CG2 ILE A 37 3.036 -6.559 11.092 1.00 0.00 C ATOM 438 CD1 ILE A 37 5.499 -4.943 10.531 1.00 0.00 C ATOM 0 H ILE A 37 2.319 -2.777 9.942 1.00 0.00 H new ATOM 0 HA ILE A 37 3.486 -5.136 8.757 1.00 0.00 H new ATOM 0 HB ILE A 37 2.177 -4.643 11.465 1.00 0.00 H new ATOM 0 HG12 ILE A 37 4.223 -3.322 11.077 1.00 0.00 H new ATOM 0 HG13 ILE A 37 4.438 -4.524 12.334 1.00 0.00 H new ATOM 0 HG21 ILE A 37 3.256 -6.751 12.142 1.00 0.00 H new ATOM 0 HG22 ILE A 37 2.076 -7.007 10.834 1.00 0.00 H new ATOM 0 HG23 ILE A 37 3.818 -6.996 10.472 1.00 0.00 H new ATOM 0 HD11 ILE A 37 6.397 -4.427 10.871 1.00 0.00 H new ATOM 0 HD12 ILE A 37 5.594 -6.009 10.736 1.00 0.00 H new ATOM 0 HD13 ILE A 37 5.376 -4.789 9.459 1.00 0.00 H new ATOM 450 N GLY A 38 1.466 -6.334 7.967 1.00 0.00 N ATOM 451 CA GLY A 38 0.300 -7.070 7.514 1.00 0.00 C ATOM 452 C GLY A 38 0.390 -7.454 6.050 1.00 0.00 C ATOM 453 O GLY A 38 1.484 -7.591 5.503 1.00 0.00 O ATOM 0 H GLY A 38 2.324 -6.530 7.451 1.00 0.00 H new ATOM 0 HA2 GLY A 38 0.186 -7.971 8.117 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -0.592 -6.465 7.674 1.00 0.00 H new ATOM 457 N SER A 39 -0.765 -7.630 5.415 1.00 0.00 N ATOM 458 CA SER A 39 -0.812 -8.006 4.007 1.00 0.00 C ATOM 459 C SER A 39 -1.116 -6.795 3.131 1.00 0.00 C ATOM 460 O SER A 39 -1.628 -5.781 3.609 1.00 0.00 O ATOM 461 CB SER A 39 -1.869 -9.090 3.782 1.00 0.00 C ATOM 462 OG SER A 39 -1.413 -10.350 4.242 1.00 0.00 O ATOM 0 H SER A 39 -1.679 -7.518 5.853 1.00 0.00 H new ATOM 0 HA SER A 39 0.166 -8.398 3.728 1.00 0.00 H new ATOM 0 HB2 SER A 39 -2.788 -8.820 4.303 1.00 0.00 H new ATOM 0 HB3 SER A 39 -2.110 -9.152 2.721 1.00 0.00 H new ATOM 0 HG SER A 39 -2.107 -11.025 4.088 1.00 0.00 H new ATOM 468 N LEU A 40 -0.796 -6.906 1.847 1.00 0.00 N ATOM 469 CA LEU A 40 -1.034 -5.821 0.902 1.00 0.00 C ATOM 470 C LEU A 40 -2.490 -5.368 0.947 1.00 0.00 C ATOM 471 O LEU A 40 -2.776 -4.172 0.979 1.00 0.00 O ATOM 472 CB LEU A 40 -0.670 -6.264 -0.517 1.00 0.00 C ATOM 473 CG LEU A 40 -0.991 -5.270 -1.633 1.00 0.00 C ATOM 474 CD1 LEU A 40 -0.061 -4.069 -1.563 1.00 0.00 C ATOM 475 CD2 LEU A 40 -0.891 -5.945 -2.993 1.00 0.00 C ATOM 0 H LEU A 40 -0.371 -7.737 1.436 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.402 -4.980 1.187 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.398 -6.480 -0.546 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.190 -7.198 -0.729 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.014 -4.919 -1.497 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.305 -3.373 -2.365 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -0.182 -3.571 -0.601 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.971 -4.401 -1.672 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.123 -5.223 -3.776 1.00 0.00 H new ATOM 0 HD22 LEU A 40 0.121 -6.324 -3.137 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.599 -6.772 -3.042 1.00 0.00 H new ATOM 487 N GLU A 41 -3.404 -6.332 0.953 1.00 0.00 N ATOM 488 CA GLU A 41 -4.830 -6.032 0.997 1.00 0.00 C ATOM 489 C GLU A 41 -5.156 -5.105 2.165 1.00 0.00 C ATOM 490 O GLU A 41 -5.857 -4.107 2.002 1.00 0.00 O ATOM 491 CB GLU A 41 -5.643 -7.323 1.114 1.00 0.00 C ATOM 492 CG GLU A 41 -5.566 -8.205 -0.120 1.00 0.00 C ATOM 493 CD GLU A 41 -6.106 -9.601 0.125 1.00 0.00 C ATOM 494 OE1 GLU A 41 -5.441 -10.375 0.845 1.00 0.00 O ATOM 495 OE2 GLU A 41 -7.192 -9.918 -0.402 1.00 0.00 O ATOM 0 H GLU A 41 -3.183 -7.327 0.928 1.00 0.00 H new ATOM 0 HA GLU A 41 -5.097 -5.526 0.069 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -5.290 -7.888 1.977 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -6.686 -7.070 1.305 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -6.127 -7.740 -0.930 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -4.529 -8.273 -0.449 1.00 0.00 H new ATOM 502 N ALA A 42 -4.641 -5.444 3.342 1.00 0.00 N ATOM 503 CA ALA A 42 -4.875 -4.643 4.537 1.00 0.00 C ATOM 504 C ALA A 42 -4.685 -3.158 4.248 1.00 0.00 C ATOM 505 O ALA A 42 -5.558 -2.342 4.545 1.00 0.00 O ATOM 506 CB ALA A 42 -3.948 -5.087 5.660 1.00 0.00 C ATOM 0 H ALA A 42 -4.059 -6.268 3.494 1.00 0.00 H new ATOM 0 HA ALA A 42 -5.908 -4.796 4.851 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -4.134 -4.480 6.546 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -4.134 -6.136 5.892 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -2.911 -4.964 5.346 1.00 0.00 H new ATOM 512 N ALA A 43 -3.540 -2.814 3.669 1.00 0.00 N ATOM 513 CA ALA A 43 -3.237 -1.427 3.339 1.00 0.00 C ATOM 514 C ALA A 43 -4.463 -0.716 2.777 1.00 0.00 C ATOM 515 O ALA A 43 -4.761 0.419 3.151 1.00 0.00 O ATOM 516 CB ALA A 43 -2.085 -1.360 2.347 1.00 0.00 C ATOM 0 H ALA A 43 -2.806 -3.477 3.419 1.00 0.00 H new ATOM 0 HA ALA A 43 -2.942 -0.917 4.256 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -1.870 -0.318 2.109 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -1.201 -1.823 2.785 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -2.359 -1.891 1.435 1.00 0.00 H new ATOM 522 N PHE A 44 -5.171 -1.389 1.877 1.00 0.00 N ATOM 523 CA PHE A 44 -6.365 -0.821 1.262 1.00 0.00 C ATOM 524 C PHE A 44 -7.285 -0.216 2.318 1.00 0.00 C ATOM 525 O PHE A 44 -7.859 0.854 2.116 1.00 0.00 O ATOM 526 CB PHE A 44 -7.116 -1.892 0.469 1.00 0.00 C ATOM 527 CG PHE A 44 -6.350 -2.408 -0.716 1.00 0.00 C ATOM 528 CD1 PHE A 44 -5.720 -1.532 -1.585 1.00 0.00 C ATOM 529 CD2 PHE A 44 -6.260 -3.769 -0.961 1.00 0.00 C ATOM 530 CE1 PHE A 44 -5.014 -2.003 -2.676 1.00 0.00 C ATOM 531 CE2 PHE A 44 -5.556 -4.246 -2.050 1.00 0.00 C ATOM 532 CZ PHE A 44 -4.933 -3.362 -2.909 1.00 0.00 C ATOM 0 H PHE A 44 -4.939 -2.329 1.557 1.00 0.00 H new ATOM 0 HA PHE A 44 -6.051 -0.029 0.582 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -7.350 -2.726 1.131 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -8.065 -1.480 0.127 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -5.781 -0.468 -1.408 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -6.746 -4.465 -0.293 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -4.526 -1.310 -3.345 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -5.493 -5.309 -2.229 1.00 0.00 H new ATOM 0 HZ PHE A 44 -4.383 -3.733 -3.762 1.00 0.00 H new ATOM 542 N GLN A 45 -7.420 -0.909 3.444 1.00 0.00 N ATOM 543 CA GLN A 45 -8.271 -0.441 4.532 1.00 0.00 C ATOM 544 C GLN A 45 -7.745 0.868 5.110 1.00 0.00 C ATOM 545 O GLN A 45 -8.516 1.704 5.579 1.00 0.00 O ATOM 546 CB GLN A 45 -8.358 -1.501 5.632 1.00 0.00 C ATOM 547 CG GLN A 45 -9.540 -2.444 5.476 1.00 0.00 C ATOM 548 CD GLN A 45 -10.749 -2.001 6.275 1.00 0.00 C ATOM 549 OE1 GLN A 45 -11.203 -0.777 6.033 1.00 0.00 O flip ATOM 550 NE2 GLN A 45 -11.271 -2.751 7.101 1.00 0.00 N flip ATOM 0 H GLN A 45 -6.951 -1.796 3.627 1.00 0.00 H new ATOM 0 HA GLN A 45 -9.268 -0.264 4.129 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -7.437 -2.084 5.637 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -8.426 -1.004 6.600 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -9.810 -2.511 4.422 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -9.246 -3.444 5.793 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -10.889 -3.684 7.255 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -12.085 -2.439 7.631 1.00 0.00 H new ATOM 559 N GLU A 46 -6.427 1.037 5.074 1.00 0.00 N ATOM 560 CA GLU A 46 -5.798 2.245 5.597 1.00 0.00 C ATOM 561 C GLU A 46 -5.281 3.124 4.462 1.00 0.00 C ATOM 562 O GLU A 46 -4.570 4.101 4.694 1.00 0.00 O ATOM 563 CB GLU A 46 -4.649 1.881 6.540 1.00 0.00 C ATOM 564 CG GLU A 46 -4.216 3.026 7.440 1.00 0.00 C ATOM 565 CD GLU A 46 -4.954 3.038 8.764 1.00 0.00 C ATOM 566 OE1 GLU A 46 -5.321 1.948 9.250 1.00 0.00 O ATOM 567 OE2 GLU A 46 -5.166 4.140 9.314 1.00 0.00 O ATOM 0 H GLU A 46 -5.775 0.354 4.689 1.00 0.00 H new ATOM 0 HA GLU A 46 -6.550 2.805 6.153 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -4.952 1.037 7.160 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -3.795 1.552 5.948 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -3.145 2.952 7.626 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -4.385 3.972 6.925 1.00 0.00 H new ATOM 574 N ALA A 47 -5.642 2.767 3.233 1.00 0.00 N ATOM 575 CA ALA A 47 -5.216 3.523 2.062 1.00 0.00 C ATOM 576 C ALA A 47 -6.304 4.490 1.607 1.00 0.00 C ATOM 577 O ALA A 47 -6.136 5.708 1.678 1.00 0.00 O ATOM 578 CB ALA A 47 -4.842 2.577 0.931 1.00 0.00 C ATOM 0 H ALA A 47 -6.228 1.959 3.023 1.00 0.00 H new ATOM 0 HA ALA A 47 -4.338 4.108 2.337 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -4.526 3.155 0.063 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -4.026 1.930 1.253 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -5.706 1.967 0.666 1.00 0.00 H new ATOM 584 N PHE A 48 -7.420 3.941 1.140 1.00 0.00 N ATOM 585 CA PHE A 48 -8.535 4.755 0.672 1.00 0.00 C ATOM 586 C PHE A 48 -9.723 4.650 1.624 1.00 0.00 C ATOM 587 O PHE A 48 -10.424 5.632 1.869 1.00 0.00 O ATOM 588 CB PHE A 48 -8.956 4.322 -0.735 1.00 0.00 C ATOM 589 CG PHE A 48 -7.796 4.055 -1.651 1.00 0.00 C ATOM 590 CD1 PHE A 48 -6.854 5.039 -1.903 1.00 0.00 C ATOM 591 CD2 PHE A 48 -7.647 2.819 -2.260 1.00 0.00 C ATOM 592 CE1 PHE A 48 -5.786 4.796 -2.747 1.00 0.00 C ATOM 593 CE2 PHE A 48 -6.582 2.570 -3.104 1.00 0.00 C ATOM 594 CZ PHE A 48 -5.649 3.560 -3.347 1.00 0.00 C ATOM 0 H PHE A 48 -7.576 2.935 1.076 1.00 0.00 H new ATOM 0 HA PHE A 48 -8.206 5.794 0.642 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -9.566 3.422 -0.662 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -9.584 5.098 -1.173 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -6.955 6.007 -1.435 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -8.372 2.041 -2.072 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -5.060 5.572 -2.937 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -6.479 1.603 -3.573 1.00 0.00 H new ATOM 0 HZ PHE A 48 -4.814 3.367 -4.005 1.00 0.00 H new ATOM 604 N TYR A 49 -9.942 3.454 2.157 1.00 0.00 N ATOM 605 CA TYR A 49 -11.046 3.218 3.080 1.00 0.00 C ATOM 606 C TYR A 49 -11.043 4.248 4.206 1.00 0.00 C ATOM 607 O TYR A 49 -12.094 4.604 4.740 1.00 0.00 O ATOM 608 CB TYR A 49 -10.958 1.808 3.664 1.00 0.00 C ATOM 609 CG TYR A 49 -11.443 0.730 2.721 1.00 0.00 C ATOM 610 CD1 TYR A 49 -11.130 0.771 1.368 1.00 0.00 C ATOM 611 CD2 TYR A 49 -12.215 -0.329 3.183 1.00 0.00 C ATOM 612 CE1 TYR A 49 -11.572 -0.211 0.503 1.00 0.00 C ATOM 613 CE2 TYR A 49 -12.660 -1.316 2.325 1.00 0.00 C ATOM 614 CZ TYR A 49 -12.336 -1.252 0.986 1.00 0.00 C ATOM 615 OH TYR A 49 -12.777 -2.233 0.127 1.00 0.00 O ATOM 0 H TYR A 49 -9.369 2.632 1.966 1.00 0.00 H new ATOM 0 HA TYR A 49 -11.978 3.316 2.524 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -9.923 1.601 3.937 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -11.545 1.767 4.582 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -10.531 1.584 0.986 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -12.472 -0.381 4.231 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -11.320 -0.164 -0.546 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -13.258 -2.133 2.701 1.00 0.00 H new ATOM 0 HH TYR A 49 -13.301 -2.894 0.626 1.00 0.00 H new ATOM 625 N VAL A 50 -9.854 4.724 4.561 1.00 0.00 N ATOM 626 CA VAL A 50 -9.713 5.714 5.622 1.00 0.00 C ATOM 627 C VAL A 50 -10.568 6.945 5.342 1.00 0.00 C ATOM 628 O VAL A 50 -11.181 7.061 4.280 1.00 0.00 O ATOM 629 CB VAL A 50 -8.245 6.151 5.790 1.00 0.00 C ATOM 630 CG1 VAL A 50 -7.404 5.000 6.322 1.00 0.00 C ATOM 631 CG2 VAL A 50 -7.688 6.665 4.471 1.00 0.00 C ATOM 0 H VAL A 50 -8.974 4.440 4.129 1.00 0.00 H new ATOM 0 HA VAL A 50 -10.052 5.241 6.544 1.00 0.00 H new ATOM 0 HB VAL A 50 -8.206 6.964 6.515 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -6.370 5.326 6.434 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -7.792 4.683 7.290 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -7.447 4.165 5.623 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -6.650 6.969 4.608 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -7.738 5.875 3.722 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -8.276 7.520 4.136 1.00 0.00 H new ATOM 641 N LYS A 51 -10.606 7.863 6.302 1.00 0.00 N ATOM 642 CA LYS A 51 -11.385 9.087 6.160 1.00 0.00 C ATOM 643 C LYS A 51 -10.931 9.883 4.941 1.00 0.00 C ATOM 644 O LYS A 51 -9.923 9.556 4.315 1.00 0.00 O ATOM 645 CB LYS A 51 -11.256 9.947 7.420 1.00 0.00 C ATOM 646 CG LYS A 51 -11.726 9.248 8.684 1.00 0.00 C ATOM 647 CD LYS A 51 -13.231 9.037 8.678 1.00 0.00 C ATOM 648 CE LYS A 51 -13.960 10.206 9.322 1.00 0.00 C ATOM 649 NZ LYS A 51 -14.159 11.330 8.366 1.00 0.00 N ATOM 0 H LYS A 51 -10.106 7.782 7.187 1.00 0.00 H new ATOM 0 HA LYS A 51 -12.430 8.809 6.022 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -10.214 10.241 7.544 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -11.832 10.863 7.285 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -11.223 8.285 8.777 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -11.444 9.840 9.555 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -13.578 8.911 7.652 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -13.473 8.118 9.211 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -14.928 9.870 9.694 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -13.392 10.558 10.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -15.019 11.856 8.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -13.339 11.968 8.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -14.259 10.952 7.402 1.00 0.00 H new ATOM 663 N ALA A 52 -11.681 10.929 4.609 1.00 0.00 N ATOM 664 CA ALA A 52 -11.353 11.773 3.467 1.00 0.00 C ATOM 665 C ALA A 52 -10.120 12.624 3.749 1.00 0.00 C ATOM 666 O ALA A 52 -9.295 12.851 2.864 1.00 0.00 O ATOM 667 CB ALA A 52 -12.537 12.658 3.108 1.00 0.00 C ATOM 0 H ALA A 52 -12.520 11.212 5.115 1.00 0.00 H new ATOM 0 HA ALA A 52 -11.128 11.125 2.620 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -12.278 13.283 2.253 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -13.394 12.034 2.855 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -12.788 13.292 3.958 1.00 0.00 H new ATOM 673 N ARG A 53 -10.000 13.092 4.987 1.00 0.00 N ATOM 674 CA ARG A 53 -8.868 13.920 5.385 1.00 0.00 C ATOM 675 C ARG A 53 -7.615 13.071 5.579 1.00 0.00 C ATOM 676 O ARG A 53 -6.498 13.532 5.344 1.00 0.00 O ATOM 677 CB ARG A 53 -9.190 14.676 6.675 1.00 0.00 C ATOM 678 CG ARG A 53 -8.000 15.421 7.258 1.00 0.00 C ATOM 679 CD ARG A 53 -7.919 16.844 6.726 1.00 0.00 C ATOM 680 NE ARG A 53 -7.653 16.877 5.290 1.00 0.00 N ATOM 681 CZ ARG A 53 -8.025 17.876 4.497 1.00 0.00 C ATOM 682 NH1 ARG A 53 -8.675 18.918 4.997 1.00 0.00 N ATOM 683 NH2 ARG A 53 -7.746 17.834 3.200 1.00 0.00 N ATOM 0 H ARG A 53 -10.673 12.912 5.732 1.00 0.00 H new ATOM 0 HA ARG A 53 -8.679 14.639 4.588 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -9.992 15.387 6.479 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -9.564 13.970 7.416 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -8.079 15.442 8.345 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -7.081 14.888 7.015 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -8.855 17.362 6.933 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -7.132 17.384 7.253 1.00 0.00 H new ATOM 0 HE ARG A 53 -7.155 16.090 4.874 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -8.891 18.954 5.993 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -8.959 19.683 4.385 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -7.246 17.034 2.812 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -8.032 18.601 2.592 1.00 0.00 H new ATOM 697 N ASP A 54 -7.809 11.830 6.011 1.00 0.00 N ATOM 698 CA ASP A 54 -6.696 10.916 6.237 1.00 0.00 C ATOM 699 C ASP A 54 -6.404 10.095 4.985 1.00 0.00 C ATOM 700 O ASP A 54 -5.624 9.143 5.023 1.00 0.00 O ATOM 701 CB ASP A 54 -7.002 9.986 7.412 1.00 0.00 C ATOM 702 CG ASP A 54 -7.376 10.745 8.670 1.00 0.00 C ATOM 703 OD1 ASP A 54 -8.562 11.108 8.814 1.00 0.00 O ATOM 704 OD2 ASP A 54 -6.482 10.977 9.510 1.00 0.00 O ATOM 0 H ASP A 54 -8.727 11.434 6.212 1.00 0.00 H new ATOM 0 HA ASP A 54 -5.813 11.510 6.474 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -7.818 9.317 7.139 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -6.132 9.362 7.613 1.00 0.00 H new ATOM 709 N ARG A 55 -7.036 10.469 3.877 1.00 0.00 N ATOM 710 CA ARG A 55 -6.846 9.766 2.614 1.00 0.00 C ATOM 711 C ARG A 55 -5.364 9.668 2.264 1.00 0.00 C ATOM 712 O ARG A 55 -4.582 10.569 2.568 1.00 0.00 O ATOM 713 CB ARG A 55 -7.601 10.479 1.491 1.00 0.00 C ATOM 714 CG ARG A 55 -9.003 9.939 1.260 1.00 0.00 C ATOM 715 CD ARG A 55 -9.750 10.756 0.218 1.00 0.00 C ATOM 716 NE ARG A 55 -11.198 10.621 0.351 1.00 0.00 N ATOM 717 CZ ARG A 55 -11.877 9.555 -0.058 1.00 0.00 C ATOM 718 NH1 ARG A 55 -11.243 8.537 -0.623 1.00 0.00 N ATOM 719 NH2 ARG A 55 -13.194 9.506 0.098 1.00 0.00 N ATOM 0 H ARG A 55 -7.684 11.255 3.829 1.00 0.00 H new ATOM 0 HA ARG A 55 -7.242 8.757 2.725 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -7.664 11.542 1.725 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -7.030 10.390 0.567 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -8.945 8.900 0.936 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -9.557 9.950 2.198 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -9.474 11.806 0.314 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -9.446 10.437 -0.779 1.00 0.00 H new ATOM 0 HE ARG A 55 -11.716 11.387 0.781 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -10.231 8.571 -0.745 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -11.767 7.720 -0.936 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -13.686 10.287 0.532 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -13.715 8.687 -0.216 1.00 0.00 H new ATOM 733 N LYS A 56 -4.985 8.568 1.624 1.00 0.00 N ATOM 734 CA LYS A 56 -3.597 8.351 1.231 1.00 0.00 C ATOM 735 C LYS A 56 -3.515 7.470 -0.012 1.00 0.00 C ATOM 736 O LYS A 56 -4.525 6.941 -0.479 1.00 0.00 O ATOM 737 CB LYS A 56 -2.816 7.706 2.378 1.00 0.00 C ATOM 738 CG LYS A 56 -2.734 8.574 3.621 1.00 0.00 C ATOM 739 CD LYS A 56 -2.026 7.855 4.757 1.00 0.00 C ATOM 740 CE LYS A 56 -2.453 8.398 6.113 1.00 0.00 C ATOM 741 NZ LYS A 56 -1.400 8.199 7.147 1.00 0.00 N ATOM 0 H LYS A 56 -5.619 7.812 1.366 1.00 0.00 H new ATOM 0 HA LYS A 56 -3.156 9.320 0.998 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -3.286 6.757 2.638 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -1.806 7.479 2.036 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -2.204 9.497 3.387 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -3.739 8.855 3.937 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -2.244 6.788 4.706 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -0.948 7.965 4.643 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -2.678 9.461 6.024 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -3.371 7.903 6.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -1.729 8.582 8.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -1.203 7.183 7.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -0.532 8.693 6.858 1.00 0.00 H new ATOM 755 N LEU A 57 -2.308 7.317 -0.544 1.00 0.00 N ATOM 756 CA LEU A 57 -2.093 6.499 -1.733 1.00 0.00 C ATOM 757 C LEU A 57 -1.280 5.253 -1.397 1.00 0.00 C ATOM 758 O LEU A 57 -0.613 5.194 -0.364 1.00 0.00 O ATOM 759 CB LEU A 57 -1.379 7.312 -2.814 1.00 0.00 C ATOM 760 CG LEU A 57 -2.237 8.333 -3.563 1.00 0.00 C ATOM 761 CD1 LEU A 57 -1.374 9.182 -4.483 1.00 0.00 C ATOM 762 CD2 LEU A 57 -3.333 7.632 -4.352 1.00 0.00 C ATOM 0 H LEU A 57 -1.462 7.749 -0.171 1.00 0.00 H new ATOM 0 HA LEU A 57 -3.067 6.185 -2.108 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.544 7.838 -2.352 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.956 6.619 -3.542 1.00 0.00 H new ATOM 0 HG LEU A 57 -2.708 8.990 -2.832 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -2.001 9.903 -5.008 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -0.627 9.713 -3.893 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -0.875 8.540 -5.208 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -3.934 8.374 -4.878 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -2.883 6.951 -5.074 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -3.969 7.068 -3.669 1.00 0.00 H new ATOM 774 N LEU A 58 -1.338 4.260 -2.278 1.00 0.00 N ATOM 775 CA LEU A 58 -0.605 3.015 -2.077 1.00 0.00 C ATOM 776 C LEU A 58 0.591 2.929 -3.019 1.00 0.00 C ATOM 777 O LEU A 58 0.457 3.122 -4.227 1.00 0.00 O ATOM 778 CB LEU A 58 -1.529 1.815 -2.296 1.00 0.00 C ATOM 779 CG LEU A 58 -0.885 0.437 -2.143 1.00 0.00 C ATOM 780 CD1 LEU A 58 -0.588 0.145 -0.681 1.00 0.00 C ATOM 781 CD2 LEU A 58 -1.786 -0.640 -2.731 1.00 0.00 C ATOM 0 H LEU A 58 -1.885 4.293 -3.138 1.00 0.00 H new ATOM 0 HA LEU A 58 -0.237 3.000 -1.051 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -2.358 1.887 -1.592 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -1.954 1.887 -3.297 1.00 0.00 H new ATOM 0 HG LEU A 58 0.057 0.435 -2.691 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -0.130 -0.840 -0.592 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.095 0.899 -0.291 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -1.516 0.166 -0.110 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -1.312 -1.615 -2.614 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.744 -0.637 -2.211 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -1.948 -0.441 -3.790 1.00 0.00 H new ATOM 793 N ALA A 59 1.760 2.636 -2.458 1.00 0.00 N ATOM 794 CA ALA A 59 2.979 2.520 -3.249 1.00 0.00 C ATOM 795 C ALA A 59 3.768 1.275 -2.861 1.00 0.00 C ATOM 796 O ALA A 59 4.315 1.192 -1.761 1.00 0.00 O ATOM 797 CB ALA A 59 3.837 3.765 -3.081 1.00 0.00 C ATOM 0 H ALA A 59 1.888 2.475 -1.459 1.00 0.00 H new ATOM 0 HA ALA A 59 2.696 2.426 -4.297 1.00 0.00 H new ATOM 0 HB1 ALA A 59 4.744 3.665 -3.677 1.00 0.00 H new ATOM 0 HB2 ALA A 59 3.278 4.640 -3.414 1.00 0.00 H new ATOM 0 HB3 ALA A 59 4.104 3.884 -2.031 1.00 0.00 H new ATOM 803 N ILE A 60 3.823 0.308 -3.771 1.00 0.00 N ATOM 804 CA ILE A 60 4.546 -0.933 -3.523 1.00 0.00 C ATOM 805 C ILE A 60 6.050 -0.733 -3.676 1.00 0.00 C ATOM 806 O ILE A 60 6.511 -0.122 -4.640 1.00 0.00 O ATOM 807 CB ILE A 60 4.089 -2.052 -4.478 1.00 0.00 C ATOM 808 CG1 ILE A 60 2.597 -2.334 -4.291 1.00 0.00 C ATOM 809 CG2 ILE A 60 4.906 -3.314 -4.246 1.00 0.00 C ATOM 810 CD1 ILE A 60 1.708 -1.516 -5.202 1.00 0.00 C ATOM 0 H ILE A 60 3.376 0.360 -4.686 1.00 0.00 H new ATOM 0 HA ILE A 60 4.323 -1.228 -2.498 1.00 0.00 H new ATOM 0 HB ILE A 60 4.251 -1.722 -5.504 1.00 0.00 H new ATOM 0 HG12 ILE A 60 2.411 -3.393 -4.470 1.00 0.00 H new ATOM 0 HG13 ILE A 60 2.325 -2.133 -3.255 1.00 0.00 H new ATOM 0 HG21 ILE A 60 4.571 -4.095 -4.928 1.00 0.00 H new ATOM 0 HG22 ILE A 60 5.960 -3.103 -4.426 1.00 0.00 H new ATOM 0 HG23 ILE A 60 4.773 -3.649 -3.217 1.00 0.00 H new ATOM 0 HD11 ILE A 60 0.664 -1.768 -5.014 1.00 0.00 H new ATOM 0 HD12 ILE A 60 1.866 -0.455 -5.008 1.00 0.00 H new ATOM 0 HD13 ILE A 60 1.953 -1.735 -6.241 1.00 0.00 H new ATOM 822 N TYR A 61 6.811 -1.254 -2.719 1.00 0.00 N ATOM 823 CA TYR A 61 8.263 -1.132 -2.747 1.00 0.00 C ATOM 824 C TYR A 61 8.924 -2.506 -2.814 1.00 0.00 C ATOM 825 O TYR A 61 8.958 -3.240 -1.825 1.00 0.00 O ATOM 826 CB TYR A 61 8.756 -0.376 -1.512 1.00 0.00 C ATOM 827 CG TYR A 61 10.263 -0.304 -1.407 1.00 0.00 C ATOM 828 CD1 TYR A 61 10.995 -1.370 -0.897 1.00 0.00 C ATOM 829 CD2 TYR A 61 10.955 0.829 -1.817 1.00 0.00 C ATOM 830 CE1 TYR A 61 12.372 -1.309 -0.799 1.00 0.00 C ATOM 831 CE2 TYR A 61 12.331 0.898 -1.724 1.00 0.00 C ATOM 832 CZ TYR A 61 13.035 -0.173 -1.214 1.00 0.00 C ATOM 833 OH TYR A 61 14.406 -0.107 -1.118 1.00 0.00 O ATOM 0 H TYR A 61 6.446 -1.764 -1.915 1.00 0.00 H new ATOM 0 HA TYR A 61 8.538 -0.573 -3.641 1.00 0.00 H new ATOM 0 HB2 TYR A 61 8.353 0.637 -1.531 1.00 0.00 H new ATOM 0 HB3 TYR A 61 8.361 -0.860 -0.619 1.00 0.00 H new ATOM 0 HD1 TYR A 61 10.479 -2.261 -0.572 1.00 0.00 H new ATOM 0 HD2 TYR A 61 10.407 1.670 -2.215 1.00 0.00 H new ATOM 0 HE1 TYR A 61 12.926 -2.146 -0.400 1.00 0.00 H new ATOM 0 HE2 TYR A 61 12.853 1.786 -2.049 1.00 0.00 H new ATOM 0 HH TYR A 61 14.716 0.760 -1.454 1.00 0.00 H new ATOM 843 N LEU A 62 9.449 -2.846 -3.985 1.00 0.00 N ATOM 844 CA LEU A 62 10.110 -4.131 -4.183 1.00 0.00 C ATOM 845 C LEU A 62 11.560 -4.076 -3.712 1.00 0.00 C ATOM 846 O LEU A 62 12.348 -3.257 -4.188 1.00 0.00 O ATOM 847 CB LEU A 62 10.056 -4.533 -5.658 1.00 0.00 C ATOM 848 CG LEU A 62 8.700 -5.015 -6.173 1.00 0.00 C ATOM 849 CD1 LEU A 62 8.710 -5.114 -7.691 1.00 0.00 C ATOM 850 CD2 LEU A 62 8.340 -6.357 -5.552 1.00 0.00 C ATOM 0 H LEU A 62 9.430 -2.250 -4.812 1.00 0.00 H new ATOM 0 HA LEU A 62 9.583 -4.878 -3.590 1.00 0.00 H new ATOM 0 HB2 LEU A 62 10.367 -3.678 -6.258 1.00 0.00 H new ATOM 0 HB3 LEU A 62 10.788 -5.323 -5.825 1.00 0.00 H new ATOM 0 HG LEU A 62 7.943 -4.287 -5.882 1.00 0.00 H new ATOM 0 HD11 LEU A 62 7.736 -5.459 -8.040 1.00 0.00 H new ATOM 0 HD12 LEU A 62 8.922 -4.134 -8.118 1.00 0.00 H new ATOM 0 HD13 LEU A 62 9.479 -5.821 -8.004 1.00 0.00 H new ATOM 0 HD21 LEU A 62 7.372 -6.685 -5.930 1.00 0.00 H new ATOM 0 HD22 LEU A 62 9.100 -7.094 -5.813 1.00 0.00 H new ATOM 0 HD23 LEU A 62 8.291 -6.255 -4.468 1.00 0.00 H new ATOM 862 N HIS A 63 11.906 -4.953 -2.776 1.00 0.00 N ATOM 863 CA HIS A 63 13.263 -5.006 -2.242 1.00 0.00 C ATOM 864 C HIS A 63 14.039 -6.173 -2.845 1.00 0.00 C ATOM 865 O HIS A 63 13.591 -7.319 -2.802 1.00 0.00 O ATOM 866 CB HIS A 63 13.230 -5.134 -0.719 1.00 0.00 C ATOM 867 CG HIS A 63 14.563 -5.450 -0.115 1.00 0.00 C ATOM 868 ND1 HIS A 63 15.400 -4.486 0.407 1.00 0.00 N ATOM 869 CD2 HIS A 63 15.203 -6.631 0.050 1.00 0.00 C ATOM 870 CE1 HIS A 63 16.498 -5.060 0.865 1.00 0.00 C ATOM 871 NE2 HIS A 63 16.403 -6.362 0.661 1.00 0.00 N ATOM 0 H HIS A 63 11.266 -5.637 -2.371 1.00 0.00 H new ATOM 0 HA HIS A 63 13.769 -4.078 -2.510 1.00 0.00 H new ATOM 0 HB2 HIS A 63 12.859 -4.202 -0.292 1.00 0.00 H new ATOM 0 HB3 HIS A 63 12.521 -5.915 -0.444 1.00 0.00 H new ATOM 0 HD2 HIS A 63 14.838 -7.604 -0.244 1.00 0.00 H new ATOM 0 HE1 HIS A 63 17.331 -4.552 1.327 1.00 0.00 H new ATOM 0 HE2 HIS A 63 17.107 -7.055 0.916 1.00 0.00 H new ATOM 879 N HIS A 64 15.205 -5.873 -3.409 1.00 0.00 N ATOM 880 CA HIS A 64 16.043 -6.897 -4.022 1.00 0.00 C ATOM 881 C HIS A 64 17.483 -6.789 -3.528 1.00 0.00 C ATOM 882 O HIS A 64 18.166 -5.798 -3.788 1.00 0.00 O ATOM 883 CB HIS A 64 16.005 -6.774 -5.546 1.00 0.00 C ATOM 884 CG HIS A 64 16.199 -8.077 -6.257 1.00 0.00 C ATOM 885 ND1 HIS A 64 17.375 -8.795 -6.206 1.00 0.00 N ATOM 886 CD2 HIS A 64 15.357 -8.793 -7.039 1.00 0.00 C ATOM 887 CE1 HIS A 64 17.249 -9.895 -6.927 1.00 0.00 C ATOM 888 NE2 HIS A 64 16.033 -9.918 -7.443 1.00 0.00 N ATOM 0 H HIS A 64 15.590 -4.930 -3.454 1.00 0.00 H new ATOM 0 HA HIS A 64 15.650 -7.872 -3.734 1.00 0.00 H new ATOM 0 HB2 HIS A 64 15.048 -6.346 -5.844 1.00 0.00 H new ATOM 0 HB3 HIS A 64 16.779 -6.076 -5.865 1.00 0.00 H new ATOM 0 HD2 HIS A 64 14.342 -8.528 -7.297 1.00 0.00 H new ATOM 0 HE1 HIS A 64 18.010 -10.647 -7.070 1.00 0.00 H new ATOM 0 HE2 HIS A 64 15.657 -10.652 -8.044 1.00 0.00 H new ATOM 896 N ASP A 65 17.936 -7.812 -2.813 1.00 0.00 N ATOM 897 CA ASP A 65 19.294 -7.832 -2.282 1.00 0.00 C ATOM 898 C ASP A 65 20.320 -7.797 -3.411 1.00 0.00 C ATOM 899 O ASP A 65 21.120 -6.867 -3.506 1.00 0.00 O ATOM 900 CB ASP A 65 19.510 -9.077 -1.420 1.00 0.00 C ATOM 901 CG ASP A 65 20.636 -8.901 -0.420 1.00 0.00 C ATOM 902 OD1 ASP A 65 21.795 -9.207 -0.772 1.00 0.00 O ATOM 903 OD2 ASP A 65 20.359 -8.456 0.713 1.00 0.00 O ATOM 0 H ASP A 65 17.383 -8.639 -2.587 1.00 0.00 H new ATOM 0 HA ASP A 65 19.428 -6.944 -1.664 1.00 0.00 H new ATOM 0 HB2 ASP A 65 18.588 -9.311 -0.887 1.00 0.00 H new ATOM 0 HB3 ASP A 65 19.730 -9.928 -2.065 1.00 0.00 H new ATOM 908 N GLU A 66 20.289 -8.816 -4.264 1.00 0.00 N ATOM 909 CA GLU A 66 21.217 -8.902 -5.385 1.00 0.00 C ATOM 910 C GLU A 66 21.518 -7.516 -5.950 1.00 0.00 C ATOM 911 O GLU A 66 22.674 -7.170 -6.193 1.00 0.00 O ATOM 912 CB GLU A 66 20.644 -9.799 -6.484 1.00 0.00 C ATOM 913 CG GLU A 66 20.616 -11.272 -6.114 1.00 0.00 C ATOM 914 CD GLU A 66 20.288 -12.165 -7.295 1.00 0.00 C ATOM 915 OE1 GLU A 66 19.597 -11.691 -8.221 1.00 0.00 O ATOM 916 OE2 GLU A 66 20.722 -13.335 -7.294 1.00 0.00 O ATOM 0 H GLU A 66 19.631 -9.593 -4.200 1.00 0.00 H new ATOM 0 HA GLU A 66 22.147 -9.337 -5.020 1.00 0.00 H new ATOM 0 HB2 GLU A 66 19.631 -9.472 -6.717 1.00 0.00 H new ATOM 0 HB3 GLU A 66 21.236 -9.672 -7.390 1.00 0.00 H new ATOM 0 HG2 GLU A 66 21.585 -11.558 -5.705 1.00 0.00 H new ATOM 0 HG3 GLU A 66 19.878 -11.431 -5.327 1.00 0.00 H new ATOM 923 N SER A 67 20.468 -6.728 -6.156 1.00 0.00 N ATOM 924 CA SER A 67 20.617 -5.382 -6.697 1.00 0.00 C ATOM 925 C SER A 67 21.470 -4.517 -5.773 1.00 0.00 C ATOM 926 O SER A 67 21.399 -4.638 -4.550 1.00 0.00 O ATOM 927 CB SER A 67 19.246 -4.734 -6.897 1.00 0.00 C ATOM 928 OG SER A 67 19.369 -3.343 -7.140 1.00 0.00 O ATOM 0 H SER A 67 19.505 -6.998 -5.957 1.00 0.00 H new ATOM 0 HA SER A 67 21.119 -5.459 -7.662 1.00 0.00 H new ATOM 0 HB2 SER A 67 18.735 -5.209 -7.735 1.00 0.00 H new ATOM 0 HB3 SER A 67 18.630 -4.899 -6.013 1.00 0.00 H new ATOM 0 HG SER A 67 18.500 -2.980 -7.410 1.00 0.00 H new ATOM 934 N VAL A 68 22.277 -3.644 -6.367 1.00 0.00 N ATOM 935 CA VAL A 68 23.143 -2.758 -5.600 1.00 0.00 C ATOM 936 C VAL A 68 22.425 -1.462 -5.241 1.00 0.00 C ATOM 937 O VAL A 68 22.585 -0.934 -4.140 1.00 0.00 O ATOM 938 CB VAL A 68 24.431 -2.421 -6.375 1.00 0.00 C ATOM 939 CG1 VAL A 68 25.236 -3.682 -6.647 1.00 0.00 C ATOM 940 CG2 VAL A 68 24.097 -1.701 -7.673 1.00 0.00 C ATOM 0 H VAL A 68 22.349 -3.532 -7.378 1.00 0.00 H new ATOM 0 HA VAL A 68 23.407 -3.289 -4.685 1.00 0.00 H new ATOM 0 HB VAL A 68 25.040 -1.756 -5.763 1.00 0.00 H new ATOM 0 HG11 VAL A 68 26.142 -3.424 -7.195 1.00 0.00 H new ATOM 0 HG12 VAL A 68 25.506 -4.153 -5.702 1.00 0.00 H new ATOM 0 HG13 VAL A 68 24.638 -4.375 -7.240 1.00 0.00 H new ATOM 0 HG21 VAL A 68 25.018 -1.470 -8.208 1.00 0.00 H new ATOM 0 HG22 VAL A 68 23.468 -2.340 -8.292 1.00 0.00 H new ATOM 0 HG23 VAL A 68 23.566 -0.776 -7.450 1.00 0.00 H new ATOM 950 N LEU A 69 21.633 -0.953 -6.178 1.00 0.00 N ATOM 951 CA LEU A 69 20.888 0.283 -5.962 1.00 0.00 C ATOM 952 C LEU A 69 20.132 0.238 -4.638 1.00 0.00 C ATOM 953 O LEU A 69 20.175 1.186 -3.853 1.00 0.00 O ATOM 954 CB LEU A 69 19.909 0.520 -7.113 1.00 0.00 C ATOM 955 CG LEU A 69 20.447 1.324 -8.297 1.00 0.00 C ATOM 956 CD1 LEU A 69 19.431 1.354 -9.428 1.00 0.00 C ATOM 957 CD2 LEU A 69 20.805 2.738 -7.862 1.00 0.00 C ATOM 0 H LEU A 69 21.490 -1.377 -7.095 1.00 0.00 H new ATOM 0 HA LEU A 69 21.601 1.106 -5.925 1.00 0.00 H new ATOM 0 HB2 LEU A 69 19.571 -0.449 -7.481 1.00 0.00 H new ATOM 0 HB3 LEU A 69 19.033 1.035 -6.718 1.00 0.00 H new ATOM 0 HG LEU A 69 21.351 0.837 -8.662 1.00 0.00 H new ATOM 0 HD11 LEU A 69 19.832 1.931 -10.262 1.00 0.00 H new ATOM 0 HD12 LEU A 69 19.223 0.336 -9.758 1.00 0.00 H new ATOM 0 HD13 LEU A 69 18.509 1.817 -9.077 1.00 0.00 H new ATOM 0 HD21 LEU A 69 21.186 3.296 -8.717 1.00 0.00 H new ATOM 0 HD22 LEU A 69 19.917 3.234 -7.471 1.00 0.00 H new ATOM 0 HD23 LEU A 69 21.569 2.697 -7.085 1.00 0.00 H new ATOM 969 N THR A 70 19.439 -0.871 -4.394 1.00 0.00 N ATOM 970 CA THR A 70 18.675 -1.040 -3.165 1.00 0.00 C ATOM 971 C THR A 70 19.350 -0.332 -1.996 1.00 0.00 C ATOM 972 O THR A 70 18.682 0.176 -1.097 1.00 0.00 O ATOM 973 CB THR A 70 18.496 -2.529 -2.816 1.00 0.00 C ATOM 974 OG1 THR A 70 17.896 -3.222 -3.916 1.00 0.00 O ATOM 975 CG2 THR A 70 17.632 -2.694 -1.574 1.00 0.00 C ATOM 0 H THR A 70 19.392 -1.665 -5.032 1.00 0.00 H new ATOM 0 HA THR A 70 17.695 -0.595 -3.338 1.00 0.00 H new ATOM 0 HB THR A 70 19.480 -2.952 -2.614 1.00 0.00 H new ATOM 0 HG1 THR A 70 18.205 -4.152 -3.925 1.00 0.00 H new ATOM 0 HG21 THR A 70 17.520 -3.754 -1.347 1.00 0.00 H new ATOM 0 HG22 THR A 70 18.106 -2.191 -0.731 1.00 0.00 H new ATOM 0 HG23 THR A 70 16.650 -2.255 -1.753 1.00 0.00 H new ATOM 983 N ASN A 71 20.678 -0.304 -2.015 1.00 0.00 N ATOM 984 CA ASN A 71 21.444 0.342 -0.955 1.00 0.00 C ATOM 985 C ASN A 71 21.323 1.860 -1.045 1.00 0.00 C ATOM 986 O ASN A 71 20.760 2.503 -0.158 1.00 0.00 O ATOM 987 CB ASN A 71 22.915 -0.069 -1.037 1.00 0.00 C ATOM 988 CG ASN A 71 23.742 0.510 0.095 1.00 0.00 C ATOM 989 OD1 ASN A 71 24.457 1.495 -0.085 1.00 0.00 O ATOM 990 ND2 ASN A 71 23.646 -0.102 1.270 1.00 0.00 N ATOM 0 H ASN A 71 21.246 -0.721 -2.752 1.00 0.00 H new ATOM 0 HA ASN A 71 21.036 0.018 0.003 1.00 0.00 H new ATOM 0 HB2 ASN A 71 22.987 -1.156 -1.016 1.00 0.00 H new ATOM 0 HB3 ASN A 71 23.329 0.260 -1.990 1.00 0.00 H new ATOM 0 HD21 ASN A 71 24.178 0.242 2.069 1.00 0.00 H new ATOM 0 HD22 ASN A 71 23.040 -0.916 1.373 1.00 0.00 H new ATOM 997 N VAL A 72 21.855 2.429 -2.122 1.00 0.00 N ATOM 998 CA VAL A 72 21.806 3.871 -2.329 1.00 0.00 C ATOM 999 C VAL A 72 20.366 4.363 -2.430 1.00 0.00 C ATOM 1000 O VAL A 72 19.986 5.340 -1.785 1.00 0.00 O ATOM 1001 CB VAL A 72 22.567 4.281 -3.604 1.00 0.00 C ATOM 1002 CG1 VAL A 72 24.028 3.867 -3.510 1.00 0.00 C ATOM 1003 CG2 VAL A 72 21.910 3.675 -4.835 1.00 0.00 C ATOM 0 H VAL A 72 22.325 1.912 -2.865 1.00 0.00 H new ATOM 0 HA VAL A 72 22.285 4.331 -1.465 1.00 0.00 H new ATOM 0 HB VAL A 72 22.527 5.366 -3.697 1.00 0.00 H new ATOM 0 HG11 VAL A 72 24.550 4.165 -4.419 1.00 0.00 H new ATOM 0 HG12 VAL A 72 24.490 4.354 -2.651 1.00 0.00 H new ATOM 0 HG13 VAL A 72 24.093 2.785 -3.392 1.00 0.00 H new ATOM 0 HG21 VAL A 72 22.461 3.975 -5.726 1.00 0.00 H new ATOM 0 HG22 VAL A 72 21.917 2.588 -4.753 1.00 0.00 H new ATOM 0 HG23 VAL A 72 20.881 4.027 -4.909 1.00 0.00 H new ATOM 1013 N PHE A 73 19.568 3.678 -3.242 1.00 0.00 N ATOM 1014 CA PHE A 73 18.169 4.045 -3.428 1.00 0.00 C ATOM 1015 C PHE A 73 17.533 4.453 -2.102 1.00 0.00 C ATOM 1016 O PHE A 73 16.956 5.535 -1.986 1.00 0.00 O ATOM 1017 CB PHE A 73 17.391 2.880 -4.043 1.00 0.00 C ATOM 1018 CG PHE A 73 15.928 3.165 -4.225 1.00 0.00 C ATOM 1019 CD1 PHE A 73 15.102 3.344 -3.127 1.00 0.00 C ATOM 1020 CD2 PHE A 73 15.379 3.255 -5.494 1.00 0.00 C ATOM 1021 CE1 PHE A 73 13.755 3.607 -3.292 1.00 0.00 C ATOM 1022 CE2 PHE A 73 14.033 3.518 -5.665 1.00 0.00 C ATOM 1023 CZ PHE A 73 13.220 3.695 -4.563 1.00 0.00 C ATOM 0 H PHE A 73 19.866 2.866 -3.782 1.00 0.00 H new ATOM 0 HA PHE A 73 18.130 4.897 -4.107 1.00 0.00 H new ATOM 0 HB2 PHE A 73 17.828 2.633 -5.011 1.00 0.00 H new ATOM 0 HB3 PHE A 73 17.505 2.002 -3.408 1.00 0.00 H new ATOM 0 HD1 PHE A 73 15.515 3.277 -2.131 1.00 0.00 H new ATOM 0 HD2 PHE A 73 16.010 3.118 -6.360 1.00 0.00 H new ATOM 0 HE1 PHE A 73 13.121 3.744 -2.428 1.00 0.00 H new ATOM 0 HE2 PHE A 73 13.617 3.585 -6.660 1.00 0.00 H new ATOM 0 HZ PHE A 73 12.168 3.902 -4.694 1.00 0.00 H new ATOM 1033 N CYS A 74 17.643 3.580 -1.107 1.00 0.00 N ATOM 1034 CA CYS A 74 17.078 3.848 0.210 1.00 0.00 C ATOM 1035 C CYS A 74 17.966 4.805 0.999 1.00 0.00 C ATOM 1036 O CYS A 74 17.489 5.790 1.560 1.00 0.00 O ATOM 1037 CB CYS A 74 16.900 2.542 0.986 1.00 0.00 C ATOM 1038 SG CYS A 74 18.437 1.630 1.260 1.00 0.00 S ATOM 0 H CYS A 74 18.118 2.681 -1.187 1.00 0.00 H new ATOM 0 HA CYS A 74 16.104 4.317 0.072 1.00 0.00 H new ATOM 0 HB2 CYS A 74 16.445 2.765 1.951 1.00 0.00 H new ATOM 0 HB3 CYS A 74 16.202 1.903 0.445 1.00 0.00 H new ATOM 0 HG CYS A 74 18.626 0.795 0.282 1.00 0.00 H new ATOM 1044 N SER A 75 19.261 4.506 1.037 1.00 0.00 N ATOM 1045 CA SER A 75 20.216 5.337 1.762 1.00 0.00 C ATOM 1046 C SER A 75 20.243 6.753 1.195 1.00 0.00 C ATOM 1047 O SER A 75 20.788 7.668 1.811 1.00 0.00 O ATOM 1048 CB SER A 75 21.615 4.721 1.693 1.00 0.00 C ATOM 1049 OG SER A 75 21.762 3.682 2.646 1.00 0.00 O ATOM 0 H SER A 75 19.673 3.695 0.575 1.00 0.00 H new ATOM 0 HA SER A 75 19.900 5.387 2.804 1.00 0.00 H new ATOM 0 HB2 SER A 75 21.794 4.329 0.692 1.00 0.00 H new ATOM 0 HB3 SER A 75 22.365 5.492 1.872 1.00 0.00 H new ATOM 0 HG SER A 75 22.664 3.303 2.581 1.00 0.00 H new ATOM 1055 N GLN A 76 19.651 6.924 0.018 1.00 0.00 N ATOM 1056 CA GLN A 76 19.607 8.229 -0.633 1.00 0.00 C ATOM 1057 C GLN A 76 18.188 8.786 -0.641 1.00 0.00 C ATOM 1058 O GLN A 76 17.980 9.983 -0.445 1.00 0.00 O ATOM 1059 CB GLN A 76 20.136 8.126 -2.064 1.00 0.00 C ATOM 1060 CG GLN A 76 21.565 7.614 -2.150 1.00 0.00 C ATOM 1061 CD GLN A 76 22.584 8.656 -1.734 1.00 0.00 C ATOM 1062 OE1 GLN A 76 22.417 9.846 -2.001 1.00 0.00 O ATOM 1063 NE2 GLN A 76 23.649 8.213 -1.075 1.00 0.00 N ATOM 0 H GLN A 76 19.195 6.176 -0.505 1.00 0.00 H new ATOM 0 HA GLN A 76 20.241 8.911 -0.067 1.00 0.00 H new ATOM 0 HB2 GLN A 76 19.487 7.463 -2.636 1.00 0.00 H new ATOM 0 HB3 GLN A 76 20.082 9.108 -2.534 1.00 0.00 H new ATOM 0 HG2 GLN A 76 21.671 6.734 -1.515 1.00 0.00 H new ATOM 0 HG3 GLN A 76 21.772 7.296 -3.172 1.00 0.00 H new ATOM 0 HE21 GLN A 76 23.747 7.218 -0.875 1.00 0.00 H new ATOM 0 HE22 GLN A 76 24.368 8.868 -0.769 1.00 0.00 H new ATOM 1072 N MET A 77 17.215 7.910 -0.869 1.00 0.00 N ATOM 1073 CA MET A 77 15.814 8.315 -0.902 1.00 0.00 C ATOM 1074 C MET A 77 15.136 8.035 0.436 1.00 0.00 C ATOM 1075 O MET A 77 14.608 8.944 1.078 1.00 0.00 O ATOM 1076 CB MET A 77 15.076 7.584 -2.024 1.00 0.00 C ATOM 1077 CG MET A 77 15.744 7.722 -3.382 1.00 0.00 C ATOM 1078 SD MET A 77 14.877 6.819 -4.679 1.00 0.00 S ATOM 1079 CE MET A 77 16.232 6.421 -5.780 1.00 0.00 C ATOM 0 H MET A 77 17.371 6.915 -1.034 1.00 0.00 H new ATOM 0 HA MET A 77 15.776 9.388 -1.091 1.00 0.00 H new ATOM 0 HB2 MET A 77 15.002 6.526 -1.770 1.00 0.00 H new ATOM 0 HB3 MET A 77 14.058 7.968 -2.088 1.00 0.00 H new ATOM 0 HG2 MET A 77 15.795 8.777 -3.652 1.00 0.00 H new ATOM 0 HG3 MET A 77 16.770 7.360 -3.316 1.00 0.00 H new ATOM 0 HE1 MET A 77 15.843 6.224 -6.779 1.00 0.00 H new ATOM 0 HE2 MET A 77 16.927 7.260 -5.820 1.00 0.00 H new ATOM 0 HE3 MET A 77 16.752 5.536 -5.412 1.00 0.00 H new ATOM 1089 N LEU A 78 15.152 6.773 0.849 1.00 0.00 N ATOM 1090 CA LEU A 78 14.538 6.373 2.111 1.00 0.00 C ATOM 1091 C LEU A 78 15.391 6.815 3.296 1.00 0.00 C ATOM 1092 O LEU A 78 15.168 6.385 4.428 1.00 0.00 O ATOM 1093 CB LEU A 78 14.341 4.857 2.147 1.00 0.00 C ATOM 1094 CG LEU A 78 13.347 4.285 1.136 1.00 0.00 C ATOM 1095 CD1 LEU A 78 13.415 2.766 1.121 1.00 0.00 C ATOM 1096 CD2 LEU A 78 11.935 4.755 1.451 1.00 0.00 C ATOM 0 H LEU A 78 15.583 6.009 0.329 1.00 0.00 H new ATOM 0 HA LEU A 78 13.566 6.861 2.185 1.00 0.00 H new ATOM 0 HB2 LEU A 78 15.308 4.381 1.985 1.00 0.00 H new ATOM 0 HB3 LEU A 78 14.012 4.577 3.148 1.00 0.00 H new ATOM 0 HG LEU A 78 13.616 4.650 0.145 1.00 0.00 H new ATOM 0 HD11 LEU A 78 12.701 2.377 0.396 1.00 0.00 H new ATOM 0 HD12 LEU A 78 14.421 2.450 0.845 1.00 0.00 H new ATOM 0 HD13 LEU A 78 13.172 2.381 2.111 1.00 0.00 H new ATOM 0 HD21 LEU A 78 11.241 4.338 0.721 1.00 0.00 H new ATOM 0 HD22 LEU A 78 11.655 4.421 2.450 1.00 0.00 H new ATOM 0 HD23 LEU A 78 11.896 5.843 1.408 1.00 0.00 H new ATOM 1108 N CYS A 79 16.364 7.678 3.028 1.00 0.00 N ATOM 1109 CA CYS A 79 17.250 8.180 4.073 1.00 0.00 C ATOM 1110 C CYS A 79 16.789 9.548 4.565 1.00 0.00 C ATOM 1111 O CYS A 79 17.051 9.929 5.705 1.00 0.00 O ATOM 1112 CB CYS A 79 18.686 8.268 3.554 1.00 0.00 C ATOM 1113 SG CYS A 79 19.058 9.800 2.668 1.00 0.00 S ATOM 0 H CYS A 79 16.560 8.045 2.097 1.00 0.00 H new ATOM 0 HA CYS A 79 17.216 7.483 4.910 1.00 0.00 H new ATOM 0 HB2 CYS A 79 19.372 8.172 4.396 1.00 0.00 H new ATOM 0 HB3 CYS A 79 18.874 7.423 2.892 1.00 0.00 H new ATOM 0 HG CYS A 79 20.114 9.629 1.929 1.00 0.00 H new ATOM 1119 N ALA A 80 16.103 10.284 3.696 1.00 0.00 N ATOM 1120 CA ALA A 80 15.605 11.609 4.043 1.00 0.00 C ATOM 1121 C ALA A 80 14.359 11.517 4.916 1.00 0.00 C ATOM 1122 O ALA A 80 13.423 10.783 4.601 1.00 0.00 O ATOM 1123 CB ALA A 80 15.311 12.408 2.782 1.00 0.00 C ATOM 0 H ALA A 80 15.880 9.985 2.747 1.00 0.00 H new ATOM 0 HA ALA A 80 16.378 12.123 4.614 1.00 0.00 H new ATOM 0 HB1 ALA A 80 14.940 13.396 3.055 1.00 0.00 H new ATOM 0 HB2 ALA A 80 16.224 12.513 2.197 1.00 0.00 H new ATOM 0 HB3 ALA A 80 14.558 11.889 2.189 1.00 0.00 H new ATOM 1129 N GLU A 81 14.355 12.265 6.015 1.00 0.00 N ATOM 1130 CA GLU A 81 13.223 12.265 6.934 1.00 0.00 C ATOM 1131 C GLU A 81 11.989 12.878 6.277 1.00 0.00 C ATOM 1132 O GLU A 81 10.857 12.521 6.605 1.00 0.00 O ATOM 1133 CB GLU A 81 13.572 13.037 8.208 1.00 0.00 C ATOM 1134 CG GLU A 81 13.512 14.546 8.041 1.00 0.00 C ATOM 1135 CD GLU A 81 14.831 15.136 7.581 1.00 0.00 C ATOM 1136 OE1 GLU A 81 15.234 14.861 6.431 1.00 0.00 O ATOM 1137 OE2 GLU A 81 15.461 15.871 8.370 1.00 0.00 O ATOM 0 H GLU A 81 15.122 12.878 6.290 1.00 0.00 H new ATOM 0 HA GLU A 81 12.999 11.230 7.194 1.00 0.00 H new ATOM 0 HB2 GLU A 81 12.887 12.740 9.002 1.00 0.00 H new ATOM 0 HB3 GLU A 81 14.574 12.755 8.530 1.00 0.00 H new ATOM 0 HG2 GLU A 81 12.735 14.797 7.319 1.00 0.00 H new ATOM 0 HG3 GLU A 81 13.226 15.001 8.989 1.00 0.00 H new ATOM 1144 N SER A 82 12.217 13.802 5.349 1.00 0.00 N ATOM 1145 CA SER A 82 11.124 14.467 4.649 1.00 0.00 C ATOM 1146 C SER A 82 10.413 13.500 3.708 1.00 0.00 C ATOM 1147 O SER A 82 9.186 13.400 3.714 1.00 0.00 O ATOM 1148 CB SER A 82 11.652 15.668 3.862 1.00 0.00 C ATOM 1149 OG SER A 82 12.328 16.578 4.712 1.00 0.00 O ATOM 0 H SER A 82 13.148 14.107 5.065 1.00 0.00 H new ATOM 0 HA SER A 82 10.407 14.815 5.392 1.00 0.00 H new ATOM 0 HB2 SER A 82 12.329 15.325 3.080 1.00 0.00 H new ATOM 0 HB3 SER A 82 10.824 16.175 3.367 1.00 0.00 H new ATOM 0 HG SER A 82 12.657 17.336 4.185 1.00 0.00 H new ATOM 1155 N ILE A 83 11.193 12.791 2.899 1.00 0.00 N ATOM 1156 CA ILE A 83 10.639 11.831 1.952 1.00 0.00 C ATOM 1157 C ILE A 83 9.924 10.695 2.676 1.00 0.00 C ATOM 1158 O ILE A 83 8.795 10.342 2.336 1.00 0.00 O ATOM 1159 CB ILE A 83 11.734 11.239 1.045 1.00 0.00 C ATOM 1160 CG1 ILE A 83 12.458 12.354 0.288 1.00 0.00 C ATOM 1161 CG2 ILE A 83 11.131 10.236 0.073 1.00 0.00 C ATOM 1162 CD1 ILE A 83 11.553 13.152 -0.624 1.00 0.00 C ATOM 0 H ILE A 83 12.210 12.863 2.880 1.00 0.00 H new ATOM 0 HA ILE A 83 9.922 12.373 1.335 1.00 0.00 H new ATOM 0 HB ILE A 83 12.461 10.719 1.669 1.00 0.00 H new ATOM 0 HG12 ILE A 83 12.922 13.029 1.008 1.00 0.00 H new ATOM 0 HG13 ILE A 83 13.263 11.917 -0.304 1.00 0.00 H new ATOM 0 HG21 ILE A 83 11.917 9.826 -0.561 1.00 0.00 H new ATOM 0 HG22 ILE A 83 10.657 9.428 0.631 1.00 0.00 H new ATOM 0 HG23 ILE A 83 10.386 10.734 -0.548 1.00 0.00 H new ATOM 0 HD11 ILE A 83 12.134 13.925 -1.128 1.00 0.00 H new ATOM 0 HD12 ILE A 83 11.109 12.489 -1.367 1.00 0.00 H new ATOM 0 HD13 ILE A 83 10.763 13.618 -0.035 1.00 0.00 H new ATOM 1174 N VAL A 84 10.589 10.127 3.677 1.00 0.00 N ATOM 1175 CA VAL A 84 10.017 9.033 4.451 1.00 0.00 C ATOM 1176 C VAL A 84 8.762 9.481 5.192 1.00 0.00 C ATOM 1177 O VAL A 84 7.778 8.746 5.269 1.00 0.00 O ATOM 1178 CB VAL A 84 11.029 8.476 5.469 1.00 0.00 C ATOM 1179 CG1 VAL A 84 12.239 7.893 4.756 1.00 0.00 C ATOM 1180 CG2 VAL A 84 11.450 9.561 6.450 1.00 0.00 C ATOM 0 H VAL A 84 11.525 10.407 3.971 1.00 0.00 H new ATOM 0 HA VAL A 84 9.756 8.247 3.742 1.00 0.00 H new ATOM 0 HB VAL A 84 10.548 7.675 6.031 1.00 0.00 H new ATOM 0 HG11 VAL A 84 12.943 7.504 5.492 1.00 0.00 H new ATOM 0 HG12 VAL A 84 11.919 7.085 4.098 1.00 0.00 H new ATOM 0 HG13 VAL A 84 12.724 8.671 4.166 1.00 0.00 H new ATOM 0 HG21 VAL A 84 12.165 9.150 7.162 1.00 0.00 H new ATOM 0 HG22 VAL A 84 11.912 10.384 5.906 1.00 0.00 H new ATOM 0 HG23 VAL A 84 10.574 9.927 6.986 1.00 0.00 H new ATOM 1190 N SER A 85 8.804 10.693 5.735 1.00 0.00 N ATOM 1191 CA SER A 85 7.671 11.240 6.474 1.00 0.00 C ATOM 1192 C SER A 85 6.509 11.548 5.535 1.00 0.00 C ATOM 1193 O SER A 85 5.368 11.164 5.794 1.00 0.00 O ATOM 1194 CB SER A 85 8.087 12.507 7.222 1.00 0.00 C ATOM 1195 OG SER A 85 8.767 12.190 8.424 1.00 0.00 O ATOM 0 H SER A 85 9.610 11.315 5.678 1.00 0.00 H new ATOM 0 HA SER A 85 7.344 10.492 7.196 1.00 0.00 H new ATOM 0 HB2 SER A 85 8.731 13.114 6.585 1.00 0.00 H new ATOM 0 HB3 SER A 85 7.205 13.106 7.447 1.00 0.00 H new ATOM 0 HG SER A 85 9.734 12.197 8.264 1.00 0.00 H new ATOM 1201 N TYR A 86 6.807 12.244 4.443 1.00 0.00 N ATOM 1202 CA TYR A 86 5.787 12.607 3.466 1.00 0.00 C ATOM 1203 C TYR A 86 5.206 11.364 2.799 1.00 0.00 C ATOM 1204 O TYR A 86 3.991 11.244 2.635 1.00 0.00 O ATOM 1205 CB TYR A 86 6.376 13.540 2.407 1.00 0.00 C ATOM 1206 CG TYR A 86 5.331 14.218 1.549 1.00 0.00 C ATOM 1207 CD1 TYR A 86 4.441 13.473 0.785 1.00 0.00 C ATOM 1208 CD2 TYR A 86 5.234 15.603 1.502 1.00 0.00 C ATOM 1209 CE1 TYR A 86 3.485 14.087 0.000 1.00 0.00 C ATOM 1210 CE2 TYR A 86 4.281 16.226 0.721 1.00 0.00 C ATOM 1211 CZ TYR A 86 3.409 15.464 -0.029 1.00 0.00 C ATOM 1212 OH TYR A 86 2.458 16.081 -0.810 1.00 0.00 O ATOM 0 H TYR A 86 7.746 12.568 4.212 1.00 0.00 H new ATOM 0 HA TYR A 86 4.984 13.125 3.991 1.00 0.00 H new ATOM 0 HB2 TYR A 86 6.979 14.302 2.901 1.00 0.00 H new ATOM 0 HB3 TYR A 86 7.047 12.970 1.765 1.00 0.00 H new ATOM 0 HD1 TYR A 86 4.498 12.395 0.805 1.00 0.00 H new ATOM 0 HD2 TYR A 86 5.916 16.203 2.087 1.00 0.00 H new ATOM 0 HE1 TYR A 86 2.801 13.493 -0.588 1.00 0.00 H new ATOM 0 HE2 TYR A 86 4.218 17.304 0.697 1.00 0.00 H new ATOM 0 HH TYR A 86 2.888 16.751 -1.381 1.00 0.00 H new ATOM 1222 N LEU A 87 6.082 10.442 2.415 1.00 0.00 N ATOM 1223 CA LEU A 87 5.657 9.207 1.766 1.00 0.00 C ATOM 1224 C LEU A 87 4.801 8.364 2.705 1.00 0.00 C ATOM 1225 O LEU A 87 3.793 7.789 2.295 1.00 0.00 O ATOM 1226 CB LEU A 87 6.876 8.403 1.309 1.00 0.00 C ATOM 1227 CG LEU A 87 6.612 6.948 0.917 1.00 0.00 C ATOM 1228 CD1 LEU A 87 6.037 6.870 -0.488 1.00 0.00 C ATOM 1229 CD2 LEU A 87 7.890 6.128 1.019 1.00 0.00 C ATOM 0 H LEU A 87 7.091 10.526 2.542 1.00 0.00 H new ATOM 0 HA LEU A 87 5.056 9.471 0.896 1.00 0.00 H new ATOM 0 HB2 LEU A 87 7.323 8.913 0.456 1.00 0.00 H new ATOM 0 HB3 LEU A 87 7.615 8.414 2.110 1.00 0.00 H new ATOM 0 HG LEU A 87 5.881 6.532 1.610 1.00 0.00 H new ATOM 0 HD11 LEU A 87 5.856 5.828 -0.750 1.00 0.00 H new ATOM 0 HD12 LEU A 87 5.098 7.423 -0.528 1.00 0.00 H new ATOM 0 HD13 LEU A 87 6.744 7.304 -1.195 1.00 0.00 H new ATOM 0 HD21 LEU A 87 7.683 5.096 0.737 1.00 0.00 H new ATOM 0 HD22 LEU A 87 8.643 6.544 0.350 1.00 0.00 H new ATOM 0 HD23 LEU A 87 8.260 6.157 2.044 1.00 0.00 H new ATOM 1241 N SER A 88 5.208 8.297 3.969 1.00 0.00 N ATOM 1242 CA SER A 88 4.478 7.523 4.967 1.00 0.00 C ATOM 1243 C SER A 88 3.181 8.225 5.356 1.00 0.00 C ATOM 1244 O SER A 88 2.153 7.581 5.564 1.00 0.00 O ATOM 1245 CB SER A 88 5.346 7.306 6.208 1.00 0.00 C ATOM 1246 OG SER A 88 5.392 8.474 7.010 1.00 0.00 O ATOM 0 H SER A 88 6.039 8.769 4.326 1.00 0.00 H new ATOM 0 HA SER A 88 4.230 6.555 4.531 1.00 0.00 H new ATOM 0 HB2 SER A 88 4.949 6.476 6.792 1.00 0.00 H new ATOM 0 HB3 SER A 88 6.356 7.029 5.905 1.00 0.00 H new ATOM 0 HG SER A 88 5.522 9.259 6.438 1.00 0.00 H new ATOM 1252 N GLN A 89 3.238 9.549 5.453 1.00 0.00 N ATOM 1253 CA GLN A 89 2.067 10.339 5.818 1.00 0.00 C ATOM 1254 C GLN A 89 1.092 10.438 4.650 1.00 0.00 C ATOM 1255 O GLN A 89 -0.048 9.983 4.740 1.00 0.00 O ATOM 1256 CB GLN A 89 2.490 11.739 6.266 1.00 0.00 C ATOM 1257 CG GLN A 89 2.918 11.809 7.723 1.00 0.00 C ATOM 1258 CD GLN A 89 2.913 13.224 8.266 1.00 0.00 C ATOM 1259 OE1 GLN A 89 3.967 13.832 8.457 1.00 0.00 O ATOM 1260 NE2 GLN A 89 1.723 13.758 8.517 1.00 0.00 N ATOM 0 H GLN A 89 4.081 10.097 5.284 1.00 0.00 H new ATOM 0 HA GLN A 89 1.564 9.837 6.645 1.00 0.00 H new ATOM 0 HB2 GLN A 89 3.313 12.079 5.638 1.00 0.00 H new ATOM 0 HB3 GLN A 89 1.661 12.428 6.106 1.00 0.00 H new ATOM 0 HG2 GLN A 89 2.251 11.191 8.324 1.00 0.00 H new ATOM 0 HG3 GLN A 89 3.919 11.389 7.824 1.00 0.00 H new ATOM 0 HE21 GLN A 89 0.875 13.218 8.344 1.00 0.00 H new ATOM 0 HE22 GLN A 89 1.657 14.708 8.883 1.00 0.00 H new ATOM 1269 N ASN A 90 1.547 11.037 3.555 1.00 0.00 N ATOM 1270 CA ASN A 90 0.714 11.197 2.369 1.00 0.00 C ATOM 1271 C ASN A 90 0.388 9.843 1.746 1.00 0.00 C ATOM 1272 O ASN A 90 -0.768 9.551 1.440 1.00 0.00 O ATOM 1273 CB ASN A 90 1.417 12.087 1.342 1.00 0.00 C ATOM 1274 CG ASN A 90 1.495 13.535 1.788 1.00 0.00 C ATOM 1275 OD1 ASN A 90 2.426 13.826 2.689 1.00 0.00 O flip ATOM 1276 ND2 ASN A 90 0.728 14.380 1.327 1.00 0.00 N flip ATOM 0 H ASN A 90 2.488 11.420 3.464 1.00 0.00 H new ATOM 0 HA ASN A 90 -0.219 11.671 2.673 1.00 0.00 H new ATOM 0 HB2 ASN A 90 2.424 11.709 1.167 1.00 0.00 H new ATOM 0 HB3 ASN A 90 0.886 12.030 0.392 1.00 0.00 H new ATOM 0 HD21 ASN A 90 0.028 14.110 0.636 1.00 0.00 H new ATOM 0 HD22 ASN A 90 0.793 15.350 1.636 1.00 0.00 H new ATOM 1283 N PHE A 91 1.415 9.020 1.561 1.00 0.00 N ATOM 1284 CA PHE A 91 1.238 7.697 0.975 1.00 0.00 C ATOM 1285 C PHE A 91 1.426 6.607 2.026 1.00 0.00 C ATOM 1286 O PHE A 91 1.776 6.889 3.173 1.00 0.00 O ATOM 1287 CB PHE A 91 2.227 7.489 -0.174 1.00 0.00 C ATOM 1288 CG PHE A 91 2.054 8.469 -1.299 1.00 0.00 C ATOM 1289 CD1 PHE A 91 2.182 9.830 -1.075 1.00 0.00 C ATOM 1290 CD2 PHE A 91 1.763 8.028 -2.580 1.00 0.00 C ATOM 1291 CE1 PHE A 91 2.024 10.734 -2.108 1.00 0.00 C ATOM 1292 CE2 PHE A 91 1.604 8.928 -3.617 1.00 0.00 C ATOM 1293 CZ PHE A 91 1.734 10.283 -3.381 1.00 0.00 C ATOM 0 H PHE A 91 2.378 9.246 1.809 1.00 0.00 H new ATOM 0 HA PHE A 91 0.221 7.632 0.587 1.00 0.00 H new ATOM 0 HB2 PHE A 91 3.243 7.568 0.213 1.00 0.00 H new ATOM 0 HB3 PHE A 91 2.112 6.477 -0.563 1.00 0.00 H new ATOM 0 HD1 PHE A 91 2.408 10.189 -0.082 1.00 0.00 H new ATOM 0 HD2 PHE A 91 1.659 6.970 -2.770 1.00 0.00 H new ATOM 0 HE1 PHE A 91 2.127 11.793 -1.920 1.00 0.00 H new ATOM 0 HE2 PHE A 91 1.378 8.572 -4.611 1.00 0.00 H new ATOM 0 HZ PHE A 91 1.609 10.988 -4.190 1.00 0.00 H new ATOM 1303 N ILE A 92 1.189 5.362 1.627 1.00 0.00 N ATOM 1304 CA ILE A 92 1.332 4.229 2.534 1.00 0.00 C ATOM 1305 C ILE A 92 2.612 3.452 2.245 1.00 0.00 C ATOM 1306 O ILE A 92 2.773 2.878 1.167 1.00 0.00 O ATOM 1307 CB ILE A 92 0.130 3.272 2.433 1.00 0.00 C ATOM 1308 CG1 ILE A 92 -1.147 3.971 2.908 1.00 0.00 C ATOM 1309 CG2 ILE A 92 0.385 2.013 3.248 1.00 0.00 C ATOM 1310 CD1 ILE A 92 -1.137 4.311 4.382 1.00 0.00 C ATOM 0 H ILE A 92 0.897 5.112 0.682 1.00 0.00 H new ATOM 0 HA ILE A 92 1.377 4.637 3.544 1.00 0.00 H new ATOM 0 HB ILE A 92 -0.001 2.985 1.390 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -1.286 4.887 2.333 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -2.003 3.330 2.697 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -0.474 1.347 3.166 1.00 0.00 H new ATOM 0 HG22 ILE A 92 1.273 1.508 2.869 1.00 0.00 H new ATOM 0 HG23 ILE A 92 0.538 2.281 4.293 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -2.072 4.804 4.648 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -1.030 3.397 4.966 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -0.302 4.978 4.596 1.00 0.00 H new ATOM 1322 N THR A 93 3.520 3.435 3.216 1.00 0.00 N ATOM 1323 CA THR A 93 4.785 2.728 3.066 1.00 0.00 C ATOM 1324 C THR A 93 4.598 1.225 3.240 1.00 0.00 C ATOM 1325 O THR A 93 4.343 0.745 4.344 1.00 0.00 O ATOM 1326 CB THR A 93 5.830 3.224 4.084 1.00 0.00 C ATOM 1327 OG1 THR A 93 5.932 4.651 4.024 1.00 0.00 O ATOM 1328 CG2 THR A 93 7.191 2.602 3.810 1.00 0.00 C ATOM 0 H THR A 93 3.402 3.903 4.115 1.00 0.00 H new ATOM 0 HA THR A 93 5.144 2.933 2.058 1.00 0.00 H new ATOM 0 HB THR A 93 5.505 2.924 5.080 1.00 0.00 H new ATOM 0 HG1 THR A 93 6.021 5.011 4.931 1.00 0.00 H new ATOM 0 HG21 THR A 93 7.912 2.967 4.541 1.00 0.00 H new ATOM 0 HG22 THR A 93 7.117 1.517 3.884 1.00 0.00 H new ATOM 0 HG23 THR A 93 7.521 2.875 2.808 1.00 0.00 H new ATOM 1336 N TRP A 94 4.728 0.487 2.143 1.00 0.00 N ATOM 1337 CA TRP A 94 4.574 -0.963 2.175 1.00 0.00 C ATOM 1338 C TRP A 94 5.589 -1.638 1.259 1.00 0.00 C ATOM 1339 O TRP A 94 5.513 -1.517 0.037 1.00 0.00 O ATOM 1340 CB TRP A 94 3.154 -1.355 1.760 1.00 0.00 C ATOM 1341 CG TRP A 94 2.830 -2.791 2.038 1.00 0.00 C ATOM 1342 CD1 TRP A 94 2.430 -3.325 3.230 1.00 0.00 C ATOM 1343 CD2 TRP A 94 2.879 -3.877 1.106 1.00 0.00 C ATOM 1344 NE1 TRP A 94 2.228 -4.678 3.095 1.00 0.00 N ATOM 1345 CE2 TRP A 94 2.495 -5.040 1.802 1.00 0.00 C ATOM 1346 CE3 TRP A 94 3.207 -3.979 -0.248 1.00 0.00 C ATOM 1347 CZ2 TRP A 94 2.434 -6.288 1.187 1.00 0.00 C ATOM 1348 CZ3 TRP A 94 3.145 -5.218 -0.856 1.00 0.00 C ATOM 1349 CH2 TRP A 94 2.761 -6.359 -0.140 1.00 0.00 C ATOM 0 H TRP A 94 4.940 0.869 1.221 1.00 0.00 H new ATOM 0 HA TRP A 94 4.753 -1.300 3.196 1.00 0.00 H new ATOM 0 HB2 TRP A 94 2.441 -0.720 2.286 1.00 0.00 H new ATOM 0 HB3 TRP A 94 3.028 -1.161 0.695 1.00 0.00 H new ATOM 0 HD1 TRP A 94 2.293 -2.766 4.144 1.00 0.00 H new ATOM 0 HE1 TRP A 94 1.928 -5.310 3.838 1.00 0.00 H new ATOM 0 HE3 TRP A 94 3.504 -3.105 -0.809 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 2.139 -7.169 1.738 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 3.397 -5.308 -1.902 1.00 0.00 H new ATOM 0 HH2 TRP A 94 2.722 -7.313 -0.645 1.00 0.00 H new ATOM 1360 N ALA A 95 6.538 -2.350 1.858 1.00 0.00 N ATOM 1361 CA ALA A 95 7.566 -3.047 1.095 1.00 0.00 C ATOM 1362 C ALA A 95 7.274 -4.541 1.017 1.00 0.00 C ATOM 1363 O ALA A 95 6.421 -5.055 1.740 1.00 0.00 O ATOM 1364 CB ALA A 95 8.936 -2.806 1.713 1.00 0.00 C ATOM 0 H ALA A 95 6.616 -2.459 2.869 1.00 0.00 H new ATOM 0 HA ALA A 95 7.562 -2.650 0.080 1.00 0.00 H new ATOM 0 HB1 ALA A 95 9.694 -3.332 1.133 1.00 0.00 H new ATOM 0 HB2 ALA A 95 9.154 -1.738 1.710 1.00 0.00 H new ATOM 0 HB3 ALA A 95 8.943 -3.175 2.739 1.00 0.00 H new ATOM 1370 N TRP A 96 7.987 -5.233 0.136 1.00 0.00 N ATOM 1371 CA TRP A 96 7.803 -6.670 -0.037 1.00 0.00 C ATOM 1372 C TRP A 96 9.091 -7.330 -0.517 1.00 0.00 C ATOM 1373 O TRP A 96 9.462 -7.210 -1.685 1.00 0.00 O ATOM 1374 CB TRP A 96 6.673 -6.944 -1.030 1.00 0.00 C ATOM 1375 CG TRP A 96 6.525 -8.395 -1.375 1.00 0.00 C ATOM 1376 CD1 TRP A 96 6.994 -9.024 -2.493 1.00 0.00 C ATOM 1377 CD2 TRP A 96 5.861 -9.397 -0.597 1.00 0.00 C ATOM 1378 NE1 TRP A 96 6.661 -10.357 -2.457 1.00 0.00 N ATOM 1379 CE2 TRP A 96 5.967 -10.611 -1.304 1.00 0.00 C ATOM 1380 CE3 TRP A 96 5.189 -9.388 0.628 1.00 0.00 C ATOM 1381 CZ2 TRP A 96 5.425 -11.801 -0.825 1.00 0.00 C ATOM 1382 CZ3 TRP A 96 4.651 -10.569 1.102 1.00 0.00 C ATOM 1383 CH2 TRP A 96 4.772 -11.762 0.378 1.00 0.00 C ATOM 0 H TRP A 96 8.698 -4.823 -0.470 1.00 0.00 H new ATOM 0 HA TRP A 96 7.538 -7.097 0.930 1.00 0.00 H new ATOM 0 HB2 TRP A 96 5.735 -6.580 -0.611 1.00 0.00 H new ATOM 0 HB3 TRP A 96 6.856 -6.378 -1.943 1.00 0.00 H new ATOM 0 HD1 TRP A 96 7.545 -8.544 -3.288 1.00 0.00 H new ATOM 0 HE1 TRP A 96 6.893 -11.045 -3.173 1.00 0.00 H new ATOM 0 HE3 TRP A 96 5.092 -8.474 1.195 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 5.516 -12.722 -1.382 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 4.128 -10.572 2.047 1.00 0.00 H new ATOM 0 HH2 TRP A 96 4.342 -12.669 0.776 1.00 0.00 H new ATOM 1394 N ASP A 97 9.768 -8.026 0.390 1.00 0.00 N ATOM 1395 CA ASP A 97 11.014 -8.706 0.057 1.00 0.00 C ATOM 1396 C ASP A 97 10.760 -9.871 -0.894 1.00 0.00 C ATOM 1397 O ASP A 97 10.271 -10.925 -0.486 1.00 0.00 O ATOM 1398 CB ASP A 97 11.700 -9.210 1.328 1.00 0.00 C ATOM 1399 CG ASP A 97 10.715 -9.778 2.331 1.00 0.00 C ATOM 1400 OD1 ASP A 97 10.422 -10.989 2.253 1.00 0.00 O ATOM 1401 OD2 ASP A 97 10.237 -9.011 3.194 1.00 0.00 O ATOM 0 H ASP A 97 9.475 -8.134 1.361 1.00 0.00 H new ATOM 0 HA ASP A 97 11.668 -7.990 -0.441 1.00 0.00 H new ATOM 0 HB2 ASP A 97 12.429 -9.977 1.065 1.00 0.00 H new ATOM 0 HB3 ASP A 97 12.252 -8.391 1.789 1.00 0.00 H new ATOM 1406 N LEU A 98 11.095 -9.674 -2.165 1.00 0.00 N ATOM 1407 CA LEU A 98 10.902 -10.708 -3.176 1.00 0.00 C ATOM 1408 C LEU A 98 12.242 -11.262 -3.649 1.00 0.00 C ATOM 1409 O LEU A 98 12.328 -11.893 -4.704 1.00 0.00 O ATOM 1410 CB LEU A 98 10.121 -10.147 -4.365 1.00 0.00 C ATOM 1411 CG LEU A 98 10.936 -9.366 -5.396 1.00 0.00 C ATOM 1412 CD1 LEU A 98 10.221 -9.345 -6.738 1.00 0.00 C ATOM 1413 CD2 LEU A 98 11.198 -7.949 -4.907 1.00 0.00 C ATOM 0 H LEU A 98 11.501 -8.808 -2.520 1.00 0.00 H new ATOM 0 HA LEU A 98 10.332 -11.520 -2.726 1.00 0.00 H new ATOM 0 HB2 LEU A 98 9.628 -10.976 -4.873 1.00 0.00 H new ATOM 0 HB3 LEU A 98 9.336 -9.495 -3.983 1.00 0.00 H new ATOM 0 HG LEU A 98 11.895 -9.867 -5.527 1.00 0.00 H new ATOM 0 HD11 LEU A 98 10.816 -8.785 -7.459 1.00 0.00 H new ATOM 0 HD12 LEU A 98 10.086 -10.366 -7.095 1.00 0.00 H new ATOM 0 HD13 LEU A 98 9.247 -8.869 -6.624 1.00 0.00 H new ATOM 0 HD21 LEU A 98 11.779 -7.408 -5.654 1.00 0.00 H new ATOM 0 HD22 LEU A 98 10.249 -7.438 -4.746 1.00 0.00 H new ATOM 0 HD23 LEU A 98 11.754 -7.984 -3.970 1.00 0.00 H new ATOM 1425 N THR A 99 13.287 -11.025 -2.862 1.00 0.00 N ATOM 1426 CA THR A 99 14.622 -11.502 -3.199 1.00 0.00 C ATOM 1427 C THR A 99 14.593 -12.965 -3.625 1.00 0.00 C ATOM 1428 O THR A 99 15.170 -13.337 -4.647 1.00 0.00 O ATOM 1429 CB THR A 99 15.592 -11.343 -2.013 1.00 0.00 C ATOM 1430 OG1 THR A 99 15.537 -10.003 -1.512 1.00 0.00 O ATOM 1431 CG2 THR A 99 17.016 -11.676 -2.430 1.00 0.00 C ATOM 0 H THR A 99 13.234 -10.505 -1.986 1.00 0.00 H new ATOM 0 HA THR A 99 14.974 -10.892 -4.031 1.00 0.00 H new ATOM 0 HB THR A 99 15.289 -12.037 -1.229 1.00 0.00 H new ATOM 0 HG1 THR A 99 16.155 -9.910 -0.757 1.00 0.00 H new ATOM 0 HG21 THR A 99 17.683 -11.556 -1.576 1.00 0.00 H new ATOM 0 HG22 THR A 99 17.060 -12.706 -2.783 1.00 0.00 H new ATOM 0 HG23 THR A 99 17.327 -11.004 -3.230 1.00 0.00 H new ATOM 1439 N LYS A 100 13.916 -13.792 -2.835 1.00 0.00 N ATOM 1440 CA LYS A 100 13.809 -15.216 -3.131 1.00 0.00 C ATOM 1441 C LYS A 100 12.838 -15.462 -4.282 1.00 0.00 C ATOM 1442 O LYS A 100 11.908 -14.685 -4.498 1.00 0.00 O ATOM 1443 CB LYS A 100 13.348 -15.982 -1.889 1.00 0.00 C ATOM 1444 CG LYS A 100 14.483 -16.367 -0.956 1.00 0.00 C ATOM 1445 CD LYS A 100 14.934 -15.189 -0.110 1.00 0.00 C ATOM 1446 CE LYS A 100 14.082 -15.043 1.142 1.00 0.00 C ATOM 1447 NZ LYS A 100 12.759 -14.426 0.844 1.00 0.00 N ATOM 0 H LYS A 100 13.433 -13.501 -1.985 1.00 0.00 H new ATOM 0 HA LYS A 100 14.795 -15.575 -3.428 1.00 0.00 H new ATOM 0 HB2 LYS A 100 12.630 -15.371 -1.342 1.00 0.00 H new ATOM 0 HB3 LYS A 100 12.825 -16.885 -2.203 1.00 0.00 H new ATOM 0 HG2 LYS A 100 14.161 -17.180 -0.306 1.00 0.00 H new ATOM 0 HG3 LYS A 100 15.324 -16.740 -1.540 1.00 0.00 H new ATOM 0 HD2 LYS A 100 15.978 -15.321 0.173 1.00 0.00 H new ATOM 0 HD3 LYS A 100 14.877 -14.274 -0.699 1.00 0.00 H new ATOM 0 HE2 LYS A 100 13.932 -16.023 1.595 1.00 0.00 H new ATOM 0 HE3 LYS A 100 14.612 -14.431 1.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 12.478 -13.809 1.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 12.827 -13.864 -0.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 12.047 -15.174 0.720 1.00 0.00 H new ATOM 1461 N ASP A 101 13.060 -16.547 -5.015 1.00 0.00 N ATOM 1462 CA ASP A 101 12.204 -16.896 -6.143 1.00 0.00 C ATOM 1463 C ASP A 101 10.757 -17.072 -5.692 1.00 0.00 C ATOM 1464 O ASP A 101 9.856 -16.393 -6.184 1.00 0.00 O ATOM 1465 CB ASP A 101 12.702 -18.177 -6.812 1.00 0.00 C ATOM 1466 CG ASP A 101 14.078 -18.012 -7.427 1.00 0.00 C ATOM 1467 OD1 ASP A 101 14.194 -17.279 -8.431 1.00 0.00 O ATOM 1468 OD2 ASP A 101 15.038 -18.616 -6.905 1.00 0.00 O ATOM 0 H ASP A 101 13.825 -17.200 -4.849 1.00 0.00 H new ATOM 0 HA ASP A 101 12.245 -16.080 -6.864 1.00 0.00 H new ATOM 0 HB2 ASP A 101 12.730 -18.980 -6.076 1.00 0.00 H new ATOM 0 HB3 ASP A 101 11.995 -18.478 -7.585 1.00 0.00 H new ATOM 1473 N SER A 102 10.543 -17.988 -4.753 1.00 0.00 N ATOM 1474 CA SER A 102 9.205 -18.258 -4.239 1.00 0.00 C ATOM 1475 C SER A 102 8.389 -16.972 -4.148 1.00 0.00 C ATOM 1476 O SER A 102 7.280 -16.889 -4.674 1.00 0.00 O ATOM 1477 CB SER A 102 9.288 -18.921 -2.863 1.00 0.00 C ATOM 1478 OG SER A 102 8.012 -18.987 -2.251 1.00 0.00 O ATOM 0 H SER A 102 11.279 -18.556 -4.333 1.00 0.00 H new ATOM 0 HA SER A 102 8.707 -18.936 -4.931 1.00 0.00 H new ATOM 0 HB2 SER A 102 9.699 -19.926 -2.964 1.00 0.00 H new ATOM 0 HB3 SER A 102 9.972 -18.360 -2.226 1.00 0.00 H new ATOM 0 HG SER A 102 8.112 -18.916 -1.279 1.00 0.00 H new ATOM 1484 N ASN A 103 8.947 -15.970 -3.476 1.00 0.00 N ATOM 1485 CA ASN A 103 8.272 -14.688 -3.314 1.00 0.00 C ATOM 1486 C ASN A 103 8.234 -13.923 -4.634 1.00 0.00 C ATOM 1487 O ASN A 103 7.218 -13.323 -4.986 1.00 0.00 O ATOM 1488 CB ASN A 103 8.976 -13.848 -2.246 1.00 0.00 C ATOM 1489 CG ASN A 103 9.278 -14.644 -0.991 1.00 0.00 C ATOM 1490 OD1 ASN A 103 10.217 -15.440 -0.957 1.00 0.00 O ATOM 1491 ND2 ASN A 103 8.479 -14.433 0.049 1.00 0.00 N ATOM 0 H ASN A 103 9.865 -16.022 -3.035 1.00 0.00 H new ATOM 0 HA ASN A 103 7.248 -14.883 -2.997 1.00 0.00 H new ATOM 0 HB2 ASN A 103 9.906 -13.451 -2.654 1.00 0.00 H new ATOM 0 HB3 ASN A 103 8.350 -12.993 -1.989 1.00 0.00 H new ATOM 0 HD21 ASN A 103 8.632 -14.940 0.921 1.00 0.00 H new ATOM 0 HD22 ASN A 103 7.713 -13.764 -0.024 1.00 0.00 H new ATOM 1498 N ARG A 104 9.347 -13.951 -5.360 1.00 0.00 N ATOM 1499 CA ARG A 104 9.440 -13.260 -6.641 1.00 0.00 C ATOM 1500 C ARG A 104 8.207 -13.533 -7.497 1.00 0.00 C ATOM 1501 O ARG A 104 7.533 -12.606 -7.945 1.00 0.00 O ATOM 1502 CB ARG A 104 10.701 -13.698 -7.389 1.00 0.00 C ATOM 1503 CG ARG A 104 11.017 -12.840 -8.603 1.00 0.00 C ATOM 1504 CD ARG A 104 12.476 -12.970 -9.013 1.00 0.00 C ATOM 1505 NE ARG A 104 12.977 -11.753 -9.646 1.00 0.00 N ATOM 1506 CZ ARG A 104 13.892 -11.749 -10.609 1.00 0.00 C ATOM 1507 NH1 ARG A 104 14.402 -12.891 -11.048 1.00 0.00 N ATOM 1508 NH2 ARG A 104 14.298 -10.601 -11.135 1.00 0.00 N ATOM 0 H ARG A 104 10.196 -14.444 -5.084 1.00 0.00 H new ATOM 0 HA ARG A 104 9.495 -12.189 -6.445 1.00 0.00 H new ATOM 0 HB2 ARG A 104 11.548 -13.669 -6.704 1.00 0.00 H new ATOM 0 HB3 ARG A 104 10.583 -14.734 -7.707 1.00 0.00 H new ATOM 0 HG2 ARG A 104 10.377 -13.134 -9.435 1.00 0.00 H new ATOM 0 HG3 ARG A 104 10.792 -11.797 -8.381 1.00 0.00 H new ATOM 0 HD2 ARG A 104 13.080 -13.197 -8.135 1.00 0.00 H new ATOM 0 HD3 ARG A 104 12.586 -13.808 -9.701 1.00 0.00 H new ATOM 0 HE ARG A 104 12.604 -10.857 -9.332 1.00 0.00 H new ATOM 0 HH11 ARG A 104 14.092 -13.776 -10.646 1.00 0.00 H new ATOM 0 HH12 ARG A 104 15.104 -12.885 -11.788 1.00 0.00 H new ATOM 0 HH21 ARG A 104 13.908 -9.720 -10.800 1.00 0.00 H new ATOM 0 HH22 ARG A 104 15.001 -10.599 -11.874 1.00 0.00 H new ATOM 1522 N ALA A 105 7.920 -14.811 -7.721 1.00 0.00 N ATOM 1523 CA ALA A 105 6.768 -15.206 -8.522 1.00 0.00 C ATOM 1524 C ALA A 105 5.463 -14.909 -7.791 1.00 0.00 C ATOM 1525 O ALA A 105 4.477 -14.496 -8.403 1.00 0.00 O ATOM 1526 CB ALA A 105 6.852 -16.683 -8.876 1.00 0.00 C ATOM 0 H ALA A 105 8.469 -15.590 -7.359 1.00 0.00 H new ATOM 0 HA ALA A 105 6.780 -14.622 -9.442 1.00 0.00 H new ATOM 0 HB1 ALA A 105 5.985 -16.964 -9.474 1.00 0.00 H new ATOM 0 HB2 ALA A 105 7.762 -16.869 -9.446 1.00 0.00 H new ATOM 0 HB3 ALA A 105 6.869 -17.276 -7.962 1.00 0.00 H new ATOM 1532 N ARG A 106 5.463 -15.122 -6.479 1.00 0.00 N ATOM 1533 CA ARG A 106 4.279 -14.878 -5.665 1.00 0.00 C ATOM 1534 C ARG A 106 3.712 -13.487 -5.932 1.00 0.00 C ATOM 1535 O ARG A 106 2.497 -13.306 -6.017 1.00 0.00 O ATOM 1536 CB ARG A 106 4.615 -15.028 -4.180 1.00 0.00 C ATOM 1537 CG ARG A 106 3.407 -15.342 -3.311 1.00 0.00 C ATOM 1538 CD ARG A 106 3.811 -15.591 -1.867 1.00 0.00 C ATOM 1539 NE ARG A 106 4.695 -16.747 -1.737 1.00 0.00 N ATOM 1540 CZ ARG A 106 4.749 -17.512 -0.653 1.00 0.00 C ATOM 1541 NH1 ARG A 106 3.974 -17.247 0.390 1.00 0.00 N ATOM 1542 NH2 ARG A 106 5.579 -18.546 -0.610 1.00 0.00 N ATOM 0 H ARG A 106 6.270 -15.463 -5.957 1.00 0.00 H new ATOM 0 HA ARG A 106 3.524 -15.616 -5.936 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.353 -15.821 -4.061 1.00 0.00 H new ATOM 0 HB3 ARG A 106 5.077 -14.107 -3.826 1.00 0.00 H new ATOM 0 HG2 ARG A 106 2.700 -14.513 -3.355 1.00 0.00 H new ATOM 0 HG3 ARG A 106 2.893 -16.220 -3.703 1.00 0.00 H new ATOM 0 HD2 ARG A 106 4.311 -14.706 -1.473 1.00 0.00 H new ATOM 0 HD3 ARG A 106 2.918 -15.748 -1.263 1.00 0.00 H new ATOM 0 HE ARG A 106 5.304 -16.979 -2.522 1.00 0.00 H new ATOM 0 HH11 ARG A 106 3.334 -16.453 0.361 1.00 0.00 H new ATOM 0 HH12 ARG A 106 4.018 -17.837 1.221 1.00 0.00 H new ATOM 0 HH21 ARG A 106 6.176 -18.754 -1.410 1.00 0.00 H new ATOM 0 HH22 ARG A 106 5.620 -19.133 0.223 1.00 0.00 H new ATOM 1556 N PHE A 107 4.600 -12.507 -6.062 1.00 0.00 N ATOM 1557 CA PHE A 107 4.189 -11.131 -6.318 1.00 0.00 C ATOM 1558 C PHE A 107 3.614 -10.988 -7.724 1.00 0.00 C ATOM 1559 O PHE A 107 2.583 -10.343 -7.922 1.00 0.00 O ATOM 1560 CB PHE A 107 5.375 -10.181 -6.140 1.00 0.00 C ATOM 1561 CG PHE A 107 5.079 -8.769 -6.557 1.00 0.00 C ATOM 1562 CD1 PHE A 107 4.307 -7.943 -5.756 1.00 0.00 C ATOM 1563 CD2 PHE A 107 5.573 -8.267 -7.751 1.00 0.00 C ATOM 1564 CE1 PHE A 107 4.033 -6.644 -6.138 1.00 0.00 C ATOM 1565 CE2 PHE A 107 5.303 -6.968 -8.138 1.00 0.00 C ATOM 1566 CZ PHE A 107 4.532 -6.155 -7.330 1.00 0.00 C ATOM 0 H PHE A 107 5.609 -12.640 -5.994 1.00 0.00 H new ATOM 0 HA PHE A 107 3.412 -10.870 -5.599 1.00 0.00 H new ATOM 0 HB2 PHE A 107 5.681 -10.186 -5.094 1.00 0.00 H new ATOM 0 HB3 PHE A 107 6.219 -10.554 -6.720 1.00 0.00 H new ATOM 0 HD1 PHE A 107 3.915 -8.319 -4.822 1.00 0.00 H new ATOM 0 HD2 PHE A 107 6.176 -8.899 -8.386 1.00 0.00 H new ATOM 0 HE1 PHE A 107 3.429 -6.011 -5.505 1.00 0.00 H new ATOM 0 HE2 PHE A 107 5.694 -6.589 -9.071 1.00 0.00 H new ATOM 0 HZ PHE A 107 4.320 -5.139 -7.629 1.00 0.00 H new ATOM 1576 N LEU A 108 4.287 -11.592 -8.696 1.00 0.00 N ATOM 1577 CA LEU A 108 3.844 -11.532 -10.085 1.00 0.00 C ATOM 1578 C LEU A 108 2.465 -12.163 -10.244 1.00 0.00 C ATOM 1579 O LEU A 108 1.558 -11.563 -10.824 1.00 0.00 O ATOM 1580 CB LEU A 108 4.850 -12.242 -10.993 1.00 0.00 C ATOM 1581 CG LEU A 108 6.178 -11.519 -11.218 1.00 0.00 C ATOM 1582 CD1 LEU A 108 7.166 -12.426 -11.935 1.00 0.00 C ATOM 1583 CD2 LEU A 108 5.960 -10.236 -12.007 1.00 0.00 C ATOM 0 H LEU A 108 5.142 -12.129 -8.549 1.00 0.00 H new ATOM 0 HA LEU A 108 3.779 -10.483 -10.375 1.00 0.00 H new ATOM 0 HB2 LEU A 108 5.061 -13.224 -10.570 1.00 0.00 H new ATOM 0 HB3 LEU A 108 4.380 -12.407 -11.963 1.00 0.00 H new ATOM 0 HG LEU A 108 6.596 -11.258 -10.246 1.00 0.00 H new ATOM 0 HD11 LEU A 108 8.105 -11.894 -12.086 1.00 0.00 H new ATOM 0 HD12 LEU A 108 7.346 -13.316 -11.332 1.00 0.00 H new ATOM 0 HD13 LEU A 108 6.756 -12.719 -12.901 1.00 0.00 H new ATOM 0 HD21 LEU A 108 6.916 -9.735 -12.158 1.00 0.00 H new ATOM 0 HD22 LEU A 108 5.519 -10.475 -12.975 1.00 0.00 H new ATOM 0 HD23 LEU A 108 5.289 -9.579 -11.454 1.00 0.00 H new ATOM 1595 N THR A 109 2.311 -13.377 -9.725 1.00 0.00 N ATOM 1596 CA THR A 109 1.042 -14.089 -9.809 1.00 0.00 C ATOM 1597 C THR A 109 -0.067 -13.320 -9.101 1.00 0.00 C ATOM 1598 O THR A 109 -1.017 -12.858 -9.734 1.00 0.00 O ATOM 1599 CB THR A 109 1.147 -15.498 -9.194 1.00 0.00 C ATOM 1600 OG1 THR A 109 2.266 -16.194 -9.754 1.00 0.00 O ATOM 1601 CG2 THR A 109 -0.127 -16.292 -9.442 1.00 0.00 C ATOM 0 H THR A 109 3.050 -13.888 -9.242 1.00 0.00 H new ATOM 0 HA THR A 109 0.799 -14.179 -10.868 1.00 0.00 H new ATOM 0 HB THR A 109 1.287 -15.392 -8.118 1.00 0.00 H new ATOM 0 HG1 THR A 109 3.095 -15.851 -9.360 1.00 0.00 H new ATOM 0 HG21 THR A 109 -0.030 -17.283 -8.999 1.00 0.00 H new ATOM 0 HG22 THR A 109 -0.973 -15.774 -8.990 1.00 0.00 H new ATOM 0 HG23 THR A 109 -0.292 -16.389 -10.515 1.00 0.00 H new ATOM 1609 N MET A 110 0.059 -13.185 -7.785 1.00 0.00 N ATOM 1610 CA MET A 110 -0.934 -12.469 -6.992 1.00 0.00 C ATOM 1611 C MET A 110 -1.303 -11.144 -7.650 1.00 0.00 C ATOM 1612 O MET A 110 -2.463 -10.731 -7.628 1.00 0.00 O ATOM 1613 CB MET A 110 -0.404 -12.219 -5.578 1.00 0.00 C ATOM 1614 CG MET A 110 0.795 -11.287 -5.534 1.00 0.00 C ATOM 1615 SD MET A 110 0.323 -9.556 -5.356 1.00 0.00 S ATOM 1616 CE MET A 110 0.165 -9.430 -3.576 1.00 0.00 C ATOM 0 H MET A 110 0.838 -13.562 -7.245 1.00 0.00 H new ATOM 0 HA MET A 110 -1.830 -13.087 -6.933 1.00 0.00 H new ATOM 0 HB2 MET A 110 -1.204 -11.798 -4.968 1.00 0.00 H new ATOM 0 HB3 MET A 110 -0.129 -13.173 -5.128 1.00 0.00 H new ATOM 0 HG2 MET A 110 1.441 -11.571 -4.703 1.00 0.00 H new ATOM 0 HG3 MET A 110 1.378 -11.408 -6.447 1.00 0.00 H new ATOM 0 HE1 MET A 110 -0.775 -8.937 -3.328 1.00 0.00 H new ATOM 0 HE2 MET A 110 0.178 -10.428 -3.138 1.00 0.00 H new ATOM 0 HE3 MET A 110 0.996 -8.848 -3.177 1.00 0.00 H new ATOM 1626 N CYS A 111 -0.311 -10.483 -8.236 1.00 0.00 N ATOM 1627 CA CYS A 111 -0.532 -9.203 -8.900 1.00 0.00 C ATOM 1628 C CYS A 111 -1.440 -9.371 -10.114 1.00 0.00 C ATOM 1629 O CYS A 111 -2.517 -8.780 -10.183 1.00 0.00 O ATOM 1630 CB CYS A 111 0.802 -8.589 -9.326 1.00 0.00 C ATOM 1631 SG CYS A 111 1.659 -7.698 -8.006 1.00 0.00 S ATOM 0 H CYS A 111 0.654 -10.812 -8.265 1.00 0.00 H new ATOM 0 HA CYS A 111 -1.022 -8.534 -8.193 1.00 0.00 H new ATOM 0 HB2 CYS A 111 1.452 -9.381 -9.697 1.00 0.00 H new ATOM 0 HB3 CYS A 111 0.626 -7.905 -10.157 1.00 0.00 H new ATOM 0 HG CYS A 111 2.459 -8.511 -7.382 1.00 0.00 H new ATOM 1637 N ASN A 112 -0.995 -10.179 -11.071 1.00 0.00 N ATOM 1638 CA ASN A 112 -1.767 -10.423 -12.285 1.00 0.00 C ATOM 1639 C ASN A 112 -3.246 -10.611 -11.961 1.00 0.00 C ATOM 1640 O ASN A 112 -4.114 -10.298 -12.775 1.00 0.00 O ATOM 1641 CB ASN A 112 -1.232 -11.656 -13.015 1.00 0.00 C ATOM 1642 CG ASN A 112 -2.253 -12.255 -13.963 1.00 0.00 C ATOM 1643 OD1 ASN A 112 -2.474 -11.742 -15.059 1.00 0.00 O ATOM 1644 ND2 ASN A 112 -2.880 -13.348 -13.543 1.00 0.00 N ATOM 0 H ASN A 112 -0.105 -10.676 -11.030 1.00 0.00 H new ATOM 0 HA ASN A 112 -1.664 -9.552 -12.933 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -0.337 -11.384 -13.574 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -0.935 -12.407 -12.284 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -3.577 -13.796 -14.138 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -2.665 -13.739 -12.626 1.00 0.00 H new ATOM 1651 N ARG A 113 -3.523 -11.125 -10.767 1.00 0.00 N ATOM 1652 CA ARG A 113 -4.897 -11.356 -10.336 1.00 0.00 C ATOM 1653 C ARG A 113 -5.583 -10.040 -9.978 1.00 0.00 C ATOM 1654 O ARG A 113 -6.689 -9.759 -10.440 1.00 0.00 O ATOM 1655 CB ARG A 113 -4.924 -12.301 -9.133 1.00 0.00 C ATOM 1656 CG ARG A 113 -5.016 -13.769 -9.514 1.00 0.00 C ATOM 1657 CD ARG A 113 -5.769 -14.571 -8.465 1.00 0.00 C ATOM 1658 NE ARG A 113 -7.176 -14.186 -8.387 1.00 0.00 N ATOM 1659 CZ ARG A 113 -8.080 -14.847 -7.673 1.00 0.00 C ATOM 1660 NH1 ARG A 113 -7.727 -15.920 -6.979 1.00 0.00 N ATOM 1661 NH2 ARG A 113 -9.341 -14.435 -7.653 1.00 0.00 N ATOM 0 H ARG A 113 -2.815 -11.389 -10.082 1.00 0.00 H new ATOM 0 HA ARG A 113 -5.439 -11.815 -11.163 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -4.024 -12.144 -8.538 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -5.773 -12.045 -8.499 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -5.518 -13.865 -10.477 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -4.013 -14.178 -9.635 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -5.696 -15.633 -8.700 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -5.299 -14.427 -7.492 1.00 0.00 H new ATOM 0 HE ARG A 113 -7.481 -13.365 -8.909 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -6.759 -16.240 -6.992 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -8.424 -16.425 -6.432 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -9.617 -13.610 -8.186 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -10.035 -14.943 -7.105 1.00 0.00 H new ATOM 1675 N HIS A 114 -4.919 -9.238 -9.152 1.00 0.00 N ATOM 1676 CA HIS A 114 -5.464 -7.952 -8.732 1.00 0.00 C ATOM 1677 C HIS A 114 -5.307 -6.909 -9.835 1.00 0.00 C ATOM 1678 O HIS A 114 -6.293 -6.422 -10.388 1.00 0.00 O ATOM 1679 CB HIS A 114 -4.771 -7.472 -7.457 1.00 0.00 C ATOM 1680 CG HIS A 114 -5.327 -8.081 -6.207 1.00 0.00 C ATOM 1681 ND1 HIS A 114 -5.601 -7.350 -5.070 1.00 0.00 N ATOM 1682 CD2 HIS A 114 -5.662 -9.361 -5.919 1.00 0.00 C ATOM 1683 CE1 HIS A 114 -6.079 -8.154 -4.137 1.00 0.00 C ATOM 1684 NE2 HIS A 114 -6.126 -9.380 -4.627 1.00 0.00 N ATOM 0 H HIS A 114 -4.003 -9.456 -8.760 1.00 0.00 H new ATOM 0 HA HIS A 114 -6.527 -8.084 -8.530 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -3.708 -7.703 -7.522 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -4.858 -6.387 -7.393 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -5.580 -10.209 -6.582 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -6.380 -7.859 -3.143 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -6.454 -10.206 -4.127 1.00 0.00 H new ATOM 1692 N PHE A 115 -4.061 -6.570 -10.148 1.00 0.00 N ATOM 1693 CA PHE A 115 -3.774 -5.584 -11.183 1.00 0.00 C ATOM 1694 C PHE A 115 -3.970 -6.182 -12.574 1.00 0.00 C ATOM 1695 O PHE A 115 -4.895 -5.811 -13.296 1.00 0.00 O ATOM 1696 CB PHE A 115 -2.343 -5.062 -11.038 1.00 0.00 C ATOM 1697 CG PHE A 115 -1.969 -4.727 -9.622 1.00 0.00 C ATOM 1698 CD1 PHE A 115 -2.260 -3.480 -9.091 1.00 0.00 C ATOM 1699 CD2 PHE A 115 -1.325 -5.658 -8.823 1.00 0.00 C ATOM 1700 CE1 PHE A 115 -1.916 -3.169 -7.789 1.00 0.00 C ATOM 1701 CE2 PHE A 115 -0.979 -5.352 -7.520 1.00 0.00 C ATOM 1702 CZ PHE A 115 -1.276 -4.107 -7.002 1.00 0.00 C ATOM 0 H PHE A 115 -3.234 -6.964 -9.700 1.00 0.00 H new ATOM 0 HA PHE A 115 -4.470 -4.754 -11.061 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -1.650 -5.812 -11.421 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -2.224 -4.173 -11.657 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -2.761 -2.743 -9.701 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -1.091 -6.634 -9.223 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -2.147 -2.194 -7.387 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -0.477 -6.086 -6.908 1.00 0.00 H new ATOM 0 HZ PHE A 115 -1.009 -3.867 -5.984 1.00 0.00 H new ATOM 1712 N GLY A 116 -3.092 -7.109 -12.942 1.00 0.00 N ATOM 1713 CA GLY A 116 -3.184 -7.743 -14.244 1.00 0.00 C ATOM 1714 C GLY A 116 -1.829 -8.146 -14.791 1.00 0.00 C ATOM 1715 O GLY A 116 -0.798 -7.642 -14.345 1.00 0.00 O ATOM 0 H GLY A 116 -2.318 -7.433 -12.362 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -3.820 -8.625 -14.171 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -3.666 -7.060 -14.944 1.00 0.00 H new ATOM 1719 N SER A 117 -1.830 -9.058 -15.758 1.00 0.00 N ATOM 1720 CA SER A 117 -0.591 -9.532 -16.362 1.00 0.00 C ATOM 1721 C SER A 117 0.192 -8.375 -16.976 1.00 0.00 C ATOM 1722 O SER A 117 1.407 -8.271 -16.802 1.00 0.00 O ATOM 1723 CB SER A 117 -0.890 -10.584 -17.432 1.00 0.00 C ATOM 1724 OG SER A 117 0.306 -11.091 -17.998 1.00 0.00 O ATOM 0 H SER A 117 -2.675 -9.483 -16.140 1.00 0.00 H new ATOM 0 HA SER A 117 0.016 -9.984 -15.578 1.00 0.00 H new ATOM 0 HB2 SER A 117 -1.463 -11.401 -16.993 1.00 0.00 H new ATOM 0 HB3 SER A 117 -1.509 -10.145 -18.215 1.00 0.00 H new ATOM 0 HG SER A 117 0.087 -11.762 -18.678 1.00 0.00 H new ATOM 1730 N VAL A 118 -0.513 -7.507 -17.694 1.00 0.00 N ATOM 1731 CA VAL A 118 0.114 -6.356 -18.333 1.00 0.00 C ATOM 1732 C VAL A 118 1.079 -5.657 -17.382 1.00 0.00 C ATOM 1733 O VAL A 118 2.096 -5.107 -17.806 1.00 0.00 O ATOM 1734 CB VAL A 118 -0.938 -5.341 -18.817 1.00 0.00 C ATOM 1735 CG1 VAL A 118 -1.790 -5.941 -19.925 1.00 0.00 C ATOM 1736 CG2 VAL A 118 -1.806 -4.879 -17.656 1.00 0.00 C ATOM 0 H VAL A 118 -1.519 -7.579 -17.848 1.00 0.00 H new ATOM 0 HA VAL A 118 0.667 -6.734 -19.193 1.00 0.00 H new ATOM 0 HB VAL A 118 -0.419 -4.472 -19.221 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -2.527 -5.209 -20.254 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -1.153 -6.217 -20.765 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -2.301 -6.828 -19.551 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -2.544 -4.162 -18.016 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -2.317 -5.737 -17.220 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -1.180 -4.406 -16.899 1.00 0.00 H new ATOM 1746 N VAL A 119 0.755 -5.684 -16.094 1.00 0.00 N ATOM 1747 CA VAL A 119 1.594 -5.054 -15.081 1.00 0.00 C ATOM 1748 C VAL A 119 2.765 -5.953 -14.701 1.00 0.00 C ATOM 1749 O VAL A 119 3.904 -5.498 -14.608 1.00 0.00 O ATOM 1750 CB VAL A 119 0.786 -4.718 -13.813 1.00 0.00 C ATOM 1751 CG1 VAL A 119 1.686 -4.096 -12.756 1.00 0.00 C ATOM 1752 CG2 VAL A 119 -0.373 -3.792 -14.150 1.00 0.00 C ATOM 0 H VAL A 119 -0.083 -6.135 -15.727 1.00 0.00 H new ATOM 0 HA VAL A 119 1.975 -4.130 -15.515 1.00 0.00 H new ATOM 0 HB VAL A 119 0.376 -5.643 -13.408 1.00 0.00 H new ATOM 0 HG11 VAL A 119 1.098 -3.865 -11.868 1.00 0.00 H new ATOM 0 HG12 VAL A 119 2.479 -4.797 -12.495 1.00 0.00 H new ATOM 0 HG13 VAL A 119 2.127 -3.179 -13.147 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -0.933 -3.565 -13.243 1.00 0.00 H new ATOM 0 HG22 VAL A 119 0.013 -2.867 -14.579 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -1.031 -4.279 -14.870 1.00 0.00 H new ATOM 1762 N ALA A 120 2.476 -7.232 -14.483 1.00 0.00 N ATOM 1763 CA ALA A 120 3.505 -8.196 -14.116 1.00 0.00 C ATOM 1764 C ALA A 120 4.571 -8.302 -15.202 1.00 0.00 C ATOM 1765 O ALA A 120 5.763 -8.164 -14.929 1.00 0.00 O ATOM 1766 CB ALA A 120 2.882 -9.558 -13.851 1.00 0.00 C ATOM 0 H ALA A 120 1.537 -7.624 -14.554 1.00 0.00 H new ATOM 0 HA ALA A 120 3.987 -7.845 -13.203 1.00 0.00 H new ATOM 0 HB1 ALA A 120 3.662 -10.268 -13.578 1.00 0.00 H new ATOM 0 HB2 ALA A 120 2.164 -9.477 -13.035 1.00 0.00 H new ATOM 0 HB3 ALA A 120 2.373 -9.906 -14.750 1.00 0.00 H new ATOM 1772 N GLN A 121 4.132 -8.547 -16.432 1.00 0.00 N ATOM 1773 CA GLN A 121 5.050 -8.673 -17.559 1.00 0.00 C ATOM 1774 C GLN A 121 6.052 -7.524 -17.575 1.00 0.00 C ATOM 1775 O GLN A 121 7.261 -7.740 -17.664 1.00 0.00 O ATOM 1776 CB GLN A 121 4.272 -8.707 -18.876 1.00 0.00 C ATOM 1777 CG GLN A 121 5.161 -8.654 -20.108 1.00 0.00 C ATOM 1778 CD GLN A 121 5.485 -7.235 -20.533 1.00 0.00 C ATOM 1779 OE1 GLN A 121 5.044 -6.271 -19.908 1.00 0.00 O ATOM 1780 NE2 GLN A 121 6.261 -7.100 -21.602 1.00 0.00 N ATOM 0 H GLN A 121 3.148 -8.662 -16.674 1.00 0.00 H new ATOM 0 HA GLN A 121 5.599 -9.608 -17.446 1.00 0.00 H new ATOM 0 HB2 GLN A 121 3.671 -9.616 -18.910 1.00 0.00 H new ATOM 0 HB3 GLN A 121 3.579 -7.866 -18.901 1.00 0.00 H new ATOM 0 HG2 GLN A 121 6.089 -9.189 -19.905 1.00 0.00 H new ATOM 0 HG3 GLN A 121 4.667 -9.172 -20.930 1.00 0.00 H new ATOM 0 HE21 GLN A 121 6.605 -7.927 -22.090 1.00 0.00 H new ATOM 0 HE22 GLN A 121 6.513 -6.169 -21.935 1.00 0.00 H new ATOM 1789 N THR A 122 5.542 -6.299 -17.491 1.00 0.00 N ATOM 1790 CA THR A 122 6.391 -5.115 -17.498 1.00 0.00 C ATOM 1791 C THR A 122 7.582 -5.287 -16.562 1.00 0.00 C ATOM 1792 O THR A 122 8.732 -5.113 -16.966 1.00 0.00 O ATOM 1793 CB THR A 122 5.605 -3.857 -17.083 1.00 0.00 C ATOM 1794 OG1 THR A 122 4.440 -3.715 -17.903 1.00 0.00 O ATOM 1795 CG2 THR A 122 6.471 -2.612 -17.206 1.00 0.00 C ATOM 0 H THR A 122 4.544 -6.101 -17.417 1.00 0.00 H new ATOM 0 HA THR A 122 6.750 -4.990 -18.520 1.00 0.00 H new ATOM 0 HB THR A 122 5.305 -3.971 -16.041 1.00 0.00 H new ATOM 0 HG1 THR A 122 3.733 -4.307 -17.572 1.00 0.00 H new ATOM 0 HG21 THR A 122 5.894 -1.737 -16.908 1.00 0.00 H new ATOM 0 HG22 THR A 122 7.343 -2.710 -16.559 1.00 0.00 H new ATOM 0 HG23 THR A 122 6.797 -2.496 -18.240 1.00 0.00 H new ATOM 1803 N ILE A 123 7.300 -5.631 -15.309 1.00 0.00 N ATOM 1804 CA ILE A 123 8.349 -5.828 -14.317 1.00 0.00 C ATOM 1805 C ILE A 123 9.257 -6.991 -14.701 1.00 0.00 C ATOM 1806 O ILE A 123 10.480 -6.897 -14.598 1.00 0.00 O ATOM 1807 CB ILE A 123 7.759 -6.092 -12.919 1.00 0.00 C ATOM 1808 CG1 ILE A 123 6.888 -4.913 -12.478 1.00 0.00 C ATOM 1809 CG2 ILE A 123 8.872 -6.341 -11.913 1.00 0.00 C ATOM 1810 CD1 ILE A 123 6.016 -5.220 -11.281 1.00 0.00 C ATOM 0 H ILE A 123 6.354 -5.779 -14.958 1.00 0.00 H new ATOM 0 HA ILE A 123 8.933 -4.908 -14.288 1.00 0.00 H new ATOM 0 HB ILE A 123 7.133 -6.983 -12.967 1.00 0.00 H new ATOM 0 HG12 ILE A 123 7.531 -4.065 -12.241 1.00 0.00 H new ATOM 0 HG13 ILE A 123 6.254 -4.609 -13.311 1.00 0.00 H new ATOM 0 HG21 ILE A 123 8.439 -6.526 -10.930 1.00 0.00 H new ATOM 0 HG22 ILE A 123 9.454 -7.209 -12.222 1.00 0.00 H new ATOM 0 HG23 ILE A 123 9.521 -5.467 -11.865 1.00 0.00 H new ATOM 0 HD11 ILE A 123 5.427 -4.340 -11.025 1.00 0.00 H new ATOM 0 HD12 ILE A 123 5.347 -6.047 -11.520 1.00 0.00 H new ATOM 0 HD13 ILE A 123 6.644 -5.495 -10.434 1.00 0.00 H new ATOM 1822 N ARG A 124 8.650 -8.087 -15.145 1.00 0.00 N ATOM 1823 CA ARG A 124 9.403 -9.269 -15.545 1.00 0.00 C ATOM 1824 C ARG A 124 10.400 -8.930 -16.650 1.00 0.00 C ATOM 1825 O ARG A 124 11.482 -9.513 -16.726 1.00 0.00 O ATOM 1826 CB ARG A 124 8.453 -10.369 -16.021 1.00 0.00 C ATOM 1827 CG ARG A 124 9.048 -11.765 -15.940 1.00 0.00 C ATOM 1828 CD ARG A 124 8.399 -12.707 -16.943 1.00 0.00 C ATOM 1829 NE ARG A 124 8.457 -14.098 -16.504 1.00 0.00 N ATOM 1830 CZ ARG A 124 7.600 -15.031 -16.904 1.00 0.00 C ATOM 1831 NH1 ARG A 124 6.626 -14.723 -17.748 1.00 0.00 N ATOM 1832 NH2 ARG A 124 7.718 -16.276 -16.460 1.00 0.00 N ATOM 0 H ARG A 124 7.638 -8.181 -15.237 1.00 0.00 H new ATOM 0 HA ARG A 124 9.956 -9.627 -14.677 1.00 0.00 H new ATOM 0 HB2 ARG A 124 7.543 -10.336 -15.422 1.00 0.00 H new ATOM 0 HB3 ARG A 124 8.163 -10.166 -17.052 1.00 0.00 H new ATOM 0 HG2 ARG A 124 10.121 -11.716 -16.127 1.00 0.00 H new ATOM 0 HG3 ARG A 124 8.918 -12.159 -14.932 1.00 0.00 H new ATOM 0 HD2 ARG A 124 7.359 -12.417 -17.092 1.00 0.00 H new ATOM 0 HD3 ARG A 124 8.898 -12.610 -17.907 1.00 0.00 H new ATOM 0 HE ARG A 124 9.196 -14.368 -15.855 1.00 0.00 H new ATOM 0 HH11 ARG A 124 6.533 -13.767 -18.092 1.00 0.00 H new ATOM 0 HH12 ARG A 124 5.970 -15.442 -18.053 1.00 0.00 H new ATOM 0 HH21 ARG A 124 8.467 -16.517 -15.811 1.00 0.00 H new ATOM 0 HH22 ARG A 124 7.060 -16.992 -16.768 1.00 0.00 H new ATOM 1846 N THR A 125 10.028 -7.983 -17.506 1.00 0.00 N ATOM 1847 CA THR A 125 10.887 -7.568 -18.607 1.00 0.00 C ATOM 1848 C THR A 125 11.941 -6.572 -18.137 1.00 0.00 C ATOM 1849 O THR A 125 12.577 -5.899 -18.947 1.00 0.00 O ATOM 1850 CB THR A 125 10.070 -6.932 -19.748 1.00 0.00 C ATOM 1851 OG1 THR A 125 9.287 -5.845 -19.243 1.00 0.00 O ATOM 1852 CG2 THR A 125 9.159 -7.962 -20.399 1.00 0.00 C ATOM 0 H THR A 125 9.137 -7.489 -17.457 1.00 0.00 H new ATOM 0 HA THR A 125 11.380 -8.466 -18.979 1.00 0.00 H new ATOM 0 HB THR A 125 10.765 -6.559 -20.500 1.00 0.00 H new ATOM 0 HG1 THR A 125 9.477 -5.720 -18.290 1.00 0.00 H new ATOM 0 HG21 THR A 125 8.592 -7.491 -21.202 1.00 0.00 H new ATOM 0 HG22 THR A 125 9.761 -8.773 -20.808 1.00 0.00 H new ATOM 0 HG23 THR A 125 8.470 -8.361 -19.654 1.00 0.00 H new ATOM 1860 N GLN A 126 12.121 -6.485 -16.823 1.00 0.00 N ATOM 1861 CA GLN A 126 13.099 -5.571 -16.245 1.00 0.00 C ATOM 1862 C GLN A 126 14.313 -6.331 -15.721 1.00 0.00 C ATOM 1863 O GLN A 126 14.241 -7.533 -15.463 1.00 0.00 O ATOM 1864 CB GLN A 126 12.464 -4.759 -15.115 1.00 0.00 C ATOM 1865 CG GLN A 126 11.255 -3.948 -15.553 1.00 0.00 C ATOM 1866 CD GLN A 126 11.629 -2.566 -16.051 1.00 0.00 C ATOM 1867 OE1 GLN A 126 12.421 -2.422 -16.983 1.00 0.00 O ATOM 1868 NE2 GLN A 126 11.059 -1.539 -15.432 1.00 0.00 N ATOM 0 H GLN A 126 11.603 -7.036 -16.139 1.00 0.00 H new ATOM 0 HA GLN A 126 13.431 -4.891 -17.030 1.00 0.00 H new ATOM 0 HB2 GLN A 126 12.166 -5.437 -14.315 1.00 0.00 H new ATOM 0 HB3 GLN A 126 13.212 -4.084 -14.699 1.00 0.00 H new ATOM 0 HG2 GLN A 126 10.729 -4.485 -16.343 1.00 0.00 H new ATOM 0 HG3 GLN A 126 10.563 -3.854 -14.716 1.00 0.00 H new ATOM 0 HE21 GLN A 126 10.408 -1.704 -14.664 1.00 0.00 H new ATOM 0 HE22 GLN A 126 11.272 -0.585 -15.724 1.00 0.00 H new ATOM 1877 N LYS A 127 15.427 -5.624 -15.567 1.00 0.00 N ATOM 1878 CA LYS A 127 16.657 -6.231 -15.072 1.00 0.00 C ATOM 1879 C LYS A 127 16.685 -6.239 -13.547 1.00 0.00 C ATOM 1880 O LYS A 127 15.849 -5.611 -12.897 1.00 0.00 O ATOM 1881 CB LYS A 127 17.874 -5.478 -15.612 1.00 0.00 C ATOM 1882 CG LYS A 127 17.948 -5.447 -17.129 1.00 0.00 C ATOM 1883 CD LYS A 127 18.319 -6.806 -17.697 1.00 0.00 C ATOM 1884 CE LYS A 127 18.261 -6.810 -19.217 1.00 0.00 C ATOM 1885 NZ LYS A 127 16.862 -6.717 -19.718 1.00 0.00 N ATOM 0 H LYS A 127 15.504 -4.629 -15.778 1.00 0.00 H new ATOM 0 HA LYS A 127 16.691 -7.262 -15.423 1.00 0.00 H new ATOM 0 HB2 LYS A 127 17.853 -4.455 -15.237 1.00 0.00 H new ATOM 0 HB3 LYS A 127 18.780 -5.942 -15.222 1.00 0.00 H new ATOM 0 HG2 LYS A 127 16.986 -5.132 -17.535 1.00 0.00 H new ATOM 0 HG3 LYS A 127 18.684 -4.707 -17.443 1.00 0.00 H new ATOM 0 HD2 LYS A 127 19.323 -7.077 -17.370 1.00 0.00 H new ATOM 0 HD3 LYS A 127 17.641 -7.563 -17.304 1.00 0.00 H new ATOM 0 HE2 LYS A 127 18.842 -5.973 -19.605 1.00 0.00 H new ATOM 0 HE3 LYS A 127 18.723 -7.722 -19.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 16.846 -6.909 -20.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 16.270 -7.415 -19.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 16.492 -5.762 -19.539 1.00 0.00 H new ATOM 1899 N THR A 128 17.654 -6.952 -12.982 1.00 0.00 N ATOM 1900 CA THR A 128 17.791 -7.041 -11.533 1.00 0.00 C ATOM 1901 C THR A 128 18.213 -5.703 -10.938 1.00 0.00 C ATOM 1902 O THR A 128 17.546 -5.170 -10.051 1.00 0.00 O ATOM 1903 CB THR A 128 18.820 -8.116 -11.132 1.00 0.00 C ATOM 1904 OG1 THR A 128 18.536 -9.344 -11.811 1.00 0.00 O ATOM 1905 CG2 THR A 128 18.803 -8.346 -9.628 1.00 0.00 C ATOM 0 H THR A 128 18.355 -7.476 -13.505 1.00 0.00 H new ATOM 0 HA THR A 128 16.813 -7.319 -11.139 1.00 0.00 H new ATOM 0 HB THR A 128 19.811 -7.764 -11.419 1.00 0.00 H new ATOM 0 HG1 THR A 128 19.195 -10.021 -11.552 1.00 0.00 H new ATOM 0 HG21 THR A 128 19.537 -9.109 -9.368 1.00 0.00 H new ATOM 0 HG22 THR A 128 19.049 -7.416 -9.115 1.00 0.00 H new ATOM 0 HG23 THR A 128 17.811 -8.678 -9.322 1.00 0.00 H new ATOM 1913 N ASP A 129 19.322 -5.164 -11.431 1.00 0.00 N ATOM 1914 CA ASP A 129 19.832 -3.886 -10.948 1.00 0.00 C ATOM 1915 C ASP A 129 18.720 -2.844 -10.894 1.00 0.00 C ATOM 1916 O ASP A 129 18.561 -2.145 -9.893 1.00 0.00 O ATOM 1917 CB ASP A 129 20.967 -3.393 -11.848 1.00 0.00 C ATOM 1918 CG ASP A 129 20.464 -2.553 -13.006 1.00 0.00 C ATOM 1919 OD1 ASP A 129 20.144 -3.134 -14.064 1.00 0.00 O ATOM 1920 OD2 ASP A 129 20.392 -1.315 -12.854 1.00 0.00 O ATOM 0 H ASP A 129 19.886 -5.592 -12.165 1.00 0.00 H new ATOM 0 HA ASP A 129 20.217 -4.033 -9.939 1.00 0.00 H new ATOM 0 HB2 ASP A 129 21.668 -2.806 -11.255 1.00 0.00 H new ATOM 0 HB3 ASP A 129 21.517 -4.250 -12.237 1.00 0.00 H new ATOM 1925 N GLN A 130 17.954 -2.745 -11.976 1.00 0.00 N ATOM 1926 CA GLN A 130 16.858 -1.786 -12.051 1.00 0.00 C ATOM 1927 C GLN A 130 16.208 -1.595 -10.685 1.00 0.00 C ATOM 1928 O GLN A 130 15.925 -0.470 -10.272 1.00 0.00 O ATOM 1929 CB GLN A 130 15.813 -2.253 -13.066 1.00 0.00 C ATOM 1930 CG GLN A 130 16.167 -1.912 -14.504 1.00 0.00 C ATOM 1931 CD GLN A 130 14.947 -1.808 -15.397 1.00 0.00 C ATOM 1932 OE1 GLN A 130 13.819 -1.699 -14.916 1.00 0.00 O ATOM 1933 NE2 GLN A 130 15.166 -1.842 -16.706 1.00 0.00 N ATOM 0 H GLN A 130 18.072 -3.317 -12.812 1.00 0.00 H new ATOM 0 HA GLN A 130 17.267 -0.829 -12.375 1.00 0.00 H new ATOM 0 HB2 GLN A 130 15.689 -3.332 -12.977 1.00 0.00 H new ATOM 0 HB3 GLN A 130 14.852 -1.801 -12.820 1.00 0.00 H new ATOM 0 HG2 GLN A 130 16.710 -0.967 -14.526 1.00 0.00 H new ATOM 0 HG3 GLN A 130 16.838 -2.675 -14.899 1.00 0.00 H new ATOM 0 HE21 GLN A 130 16.118 -1.933 -17.062 1.00 0.00 H new ATOM 0 HE22 GLN A 130 14.383 -1.777 -17.356 1.00 0.00 H new ATOM 1942 N PHE A 131 15.972 -2.701 -9.987 1.00 0.00 N ATOM 1943 CA PHE A 131 15.354 -2.656 -8.667 1.00 0.00 C ATOM 1944 C PHE A 131 16.132 -1.735 -7.733 1.00 0.00 C ATOM 1945 O PHE A 131 17.319 -1.469 -7.929 1.00 0.00 O ATOM 1946 CB PHE A 131 15.276 -4.062 -8.068 1.00 0.00 C ATOM 1947 CG PHE A 131 14.122 -4.871 -8.586 1.00 0.00 C ATOM 1948 CD1 PHE A 131 14.056 -5.234 -9.921 1.00 0.00 C ATOM 1949 CD2 PHE A 131 13.102 -5.270 -7.736 1.00 0.00 C ATOM 1950 CE1 PHE A 131 12.995 -5.978 -10.400 1.00 0.00 C ATOM 1951 CE2 PHE A 131 12.038 -6.015 -8.209 1.00 0.00 C ATOM 1952 CZ PHE A 131 11.985 -6.370 -9.543 1.00 0.00 C ATOM 0 H PHE A 131 16.200 -3.640 -10.314 1.00 0.00 H new ATOM 0 HA PHE A 131 14.344 -2.261 -8.780 1.00 0.00 H new ATOM 0 HB2 PHE A 131 16.205 -4.591 -8.281 1.00 0.00 H new ATOM 0 HB3 PHE A 131 15.196 -3.982 -6.984 1.00 0.00 H new ATOM 0 HD1 PHE A 131 14.843 -4.932 -10.596 1.00 0.00 H new ATOM 0 HD2 PHE A 131 13.139 -4.996 -6.692 1.00 0.00 H new ATOM 0 HE1 PHE A 131 12.955 -6.253 -11.444 1.00 0.00 H new ATOM 0 HE2 PHE A 131 11.249 -6.319 -7.537 1.00 0.00 H new ATOM 0 HZ PHE A 131 11.155 -6.953 -9.915 1.00 0.00 H new ATOM 1962 N PRO A 132 15.450 -1.234 -6.692 1.00 0.00 N ATOM 1963 CA PRO A 132 14.038 -1.543 -6.449 1.00 0.00 C ATOM 1964 C PRO A 132 13.118 -0.905 -7.485 1.00 0.00 C ATOM 1965 O PRO A 132 13.574 -0.186 -8.375 1.00 0.00 O ATOM 1966 CB PRO A 132 13.778 -0.948 -5.063 1.00 0.00 C ATOM 1967 CG PRO A 132 14.788 0.138 -4.922 1.00 0.00 C ATOM 1968 CD PRO A 132 16.005 -0.328 -5.672 1.00 0.00 C ATOM 0 HA PRO A 132 13.838 -2.613 -6.513 1.00 0.00 H new ATOM 0 HB2 PRO A 132 12.763 -0.558 -4.984 1.00 0.00 H new ATOM 0 HB3 PRO A 132 13.893 -1.699 -4.282 1.00 0.00 H new ATOM 0 HG2 PRO A 132 14.412 1.076 -5.332 1.00 0.00 H new ATOM 0 HG3 PRO A 132 15.022 0.320 -3.873 1.00 0.00 H new ATOM 0 HD2 PRO A 132 16.542 0.506 -6.124 1.00 0.00 H new ATOM 0 HD3 PRO A 132 16.708 -0.843 -5.017 1.00 0.00 H new ATOM 1976 N LEU A 133 11.823 -1.170 -7.362 1.00 0.00 N ATOM 1977 CA LEU A 133 10.838 -0.620 -8.287 1.00 0.00 C ATOM 1978 C LEU A 133 9.709 0.074 -7.532 1.00 0.00 C ATOM 1979 O LEU A 133 8.899 -0.575 -6.871 1.00 0.00 O ATOM 1980 CB LEU A 133 10.268 -1.728 -9.174 1.00 0.00 C ATOM 1981 CG LEU A 133 11.054 -2.039 -10.449 1.00 0.00 C ATOM 1982 CD1 LEU A 133 10.551 -3.326 -11.085 1.00 0.00 C ATOM 1983 CD2 LEU A 133 10.955 -0.882 -11.432 1.00 0.00 C ATOM 0 H LEU A 133 11.430 -1.762 -6.631 1.00 0.00 H new ATOM 0 HA LEU A 133 11.338 0.118 -8.914 1.00 0.00 H new ATOM 0 HB2 LEU A 133 10.199 -2.641 -8.582 1.00 0.00 H new ATOM 0 HB3 LEU A 133 9.251 -1.453 -9.456 1.00 0.00 H new ATOM 0 HG LEU A 133 12.102 -2.175 -10.183 1.00 0.00 H new ATOM 0 HD11 LEU A 133 11.122 -3.531 -11.991 1.00 0.00 H new ATOM 0 HD12 LEU A 133 10.674 -4.151 -10.383 1.00 0.00 H new ATOM 0 HD13 LEU A 133 9.496 -3.219 -11.337 1.00 0.00 H new ATOM 0 HD21 LEU A 133 11.520 -1.121 -12.333 1.00 0.00 H new ATOM 0 HD22 LEU A 133 9.910 -0.714 -11.693 1.00 0.00 H new ATOM 0 HD23 LEU A 133 11.364 0.019 -10.975 1.00 0.00 H new ATOM 1995 N PHE A 134 9.661 1.398 -7.637 1.00 0.00 N ATOM 1996 CA PHE A 134 8.630 2.181 -6.965 1.00 0.00 C ATOM 1997 C PHE A 134 7.466 2.471 -7.908 1.00 0.00 C ATOM 1998 O PHE A 134 7.638 3.108 -8.948 1.00 0.00 O ATOM 1999 CB PHE A 134 9.217 3.494 -6.442 1.00 0.00 C ATOM 2000 CG PHE A 134 8.367 4.155 -5.395 1.00 0.00 C ATOM 2001 CD1 PHE A 134 7.140 4.707 -5.726 1.00 0.00 C ATOM 2002 CD2 PHE A 134 8.795 4.224 -4.079 1.00 0.00 C ATOM 2003 CE1 PHE A 134 6.357 5.317 -4.764 1.00 0.00 C ATOM 2004 CE2 PHE A 134 8.016 4.832 -3.112 1.00 0.00 C ATOM 2005 CZ PHE A 134 6.795 5.378 -3.456 1.00 0.00 C ATOM 0 H PHE A 134 10.324 1.951 -8.181 1.00 0.00 H new ATOM 0 HA PHE A 134 8.256 1.597 -6.124 1.00 0.00 H new ATOM 0 HB2 PHE A 134 10.206 3.301 -6.027 1.00 0.00 H new ATOM 0 HB3 PHE A 134 9.351 4.181 -7.277 1.00 0.00 H new ATOM 0 HD1 PHE A 134 6.791 4.660 -6.747 1.00 0.00 H new ATOM 0 HD2 PHE A 134 9.749 3.798 -3.805 1.00 0.00 H new ATOM 0 HE1 PHE A 134 5.403 5.746 -5.035 1.00 0.00 H new ATOM 0 HE2 PHE A 134 8.362 4.880 -2.090 1.00 0.00 H new ATOM 0 HZ PHE A 134 6.183 5.852 -2.703 1.00 0.00 H new ATOM 2015 N LEU A 135 6.281 1.999 -7.537 1.00 0.00 N ATOM 2016 CA LEU A 135 5.087 2.206 -8.349 1.00 0.00 C ATOM 2017 C LEU A 135 3.976 2.854 -7.529 1.00 0.00 C ATOM 2018 O LEU A 135 3.689 2.428 -6.409 1.00 0.00 O ATOM 2019 CB LEU A 135 4.601 0.875 -8.926 1.00 0.00 C ATOM 2020 CG LEU A 135 5.659 0.018 -9.620 1.00 0.00 C ATOM 2021 CD1 LEU A 135 6.413 -0.827 -8.604 1.00 0.00 C ATOM 2022 CD2 LEU A 135 5.019 -0.866 -10.680 1.00 0.00 C ATOM 0 H LEU A 135 6.121 1.470 -6.679 1.00 0.00 H new ATOM 0 HA LEU A 135 5.347 2.877 -9.168 1.00 0.00 H new ATOM 0 HB2 LEU A 135 4.162 0.290 -8.118 1.00 0.00 H new ATOM 0 HB3 LEU A 135 3.804 1.081 -9.640 1.00 0.00 H new ATOM 0 HG LEU A 135 6.371 0.682 -10.110 1.00 0.00 H new ATOM 0 HD11 LEU A 135 7.162 -1.430 -9.117 1.00 0.00 H new ATOM 0 HD12 LEU A 135 6.905 -0.175 -7.882 1.00 0.00 H new ATOM 0 HD13 LEU A 135 5.713 -1.482 -8.084 1.00 0.00 H new ATOM 0 HD21 LEU A 135 5.788 -1.469 -11.163 1.00 0.00 H new ATOM 0 HD22 LEU A 135 4.285 -1.522 -10.212 1.00 0.00 H new ATOM 0 HD23 LEU A 135 4.526 -0.242 -11.425 1.00 0.00 H new ATOM 2034 N ILE A 136 3.354 3.883 -8.094 1.00 0.00 N ATOM 2035 CA ILE A 136 2.272 4.586 -7.416 1.00 0.00 C ATOM 2036 C ILE A 136 0.914 4.013 -7.805 1.00 0.00 C ATOM 2037 O ILE A 136 0.436 4.224 -8.920 1.00 0.00 O ATOM 2038 CB ILE A 136 2.292 6.092 -7.737 1.00 0.00 C ATOM 2039 CG1 ILE A 136 3.640 6.702 -7.346 1.00 0.00 C ATOM 2040 CG2 ILE A 136 1.154 6.802 -7.019 1.00 0.00 C ATOM 2041 CD1 ILE A 136 3.952 7.993 -8.070 1.00 0.00 C ATOM 0 H ILE A 136 3.581 4.248 -9.019 1.00 0.00 H new ATOM 0 HA ILE A 136 2.428 4.448 -6.346 1.00 0.00 H new ATOM 0 HB ILE A 136 2.155 6.221 -8.811 1.00 0.00 H new ATOM 0 HG12 ILE A 136 3.648 6.886 -6.272 1.00 0.00 H new ATOM 0 HG13 ILE A 136 4.430 5.980 -7.552 1.00 0.00 H new ATOM 0 HG21 ILE A 136 1.182 7.866 -7.256 1.00 0.00 H new ATOM 0 HG22 ILE A 136 0.201 6.383 -7.343 1.00 0.00 H new ATOM 0 HG23 ILE A 136 1.262 6.667 -5.943 1.00 0.00 H new ATOM 0 HD11 ILE A 136 4.922 8.368 -7.743 1.00 0.00 H new ATOM 0 HD12 ILE A 136 3.976 7.811 -9.144 1.00 0.00 H new ATOM 0 HD13 ILE A 136 3.183 8.732 -7.845 1.00 0.00 H new ATOM 2053 N ILE A 137 0.297 3.288 -6.878 1.00 0.00 N ATOM 2054 CA ILE A 137 -1.008 2.686 -7.123 1.00 0.00 C ATOM 2055 C ILE A 137 -2.117 3.482 -6.443 1.00 0.00 C ATOM 2056 O ILE A 137 -2.320 3.374 -5.234 1.00 0.00 O ATOM 2057 CB ILE A 137 -1.059 1.229 -6.627 1.00 0.00 C ATOM 2058 CG1 ILE A 137 0.032 0.398 -7.305 1.00 0.00 C ATOM 2059 CG2 ILE A 137 -2.431 0.627 -6.890 1.00 0.00 C ATOM 2060 CD1 ILE A 137 -0.245 0.111 -8.764 1.00 0.00 C ATOM 0 H ILE A 137 0.680 3.103 -5.951 1.00 0.00 H new ATOM 0 HA ILE A 137 -1.163 2.699 -8.202 1.00 0.00 H new ATOM 0 HB ILE A 137 -0.881 1.221 -5.552 1.00 0.00 H new ATOM 0 HG12 ILE A 137 0.983 0.924 -7.221 1.00 0.00 H new ATOM 0 HG13 ILE A 137 0.142 -0.546 -6.772 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -2.451 -0.403 -6.534 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -3.190 1.207 -6.365 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -2.637 0.645 -7.960 1.00 0.00 H new ATOM 0 HD11 ILE A 137 0.570 -0.482 -9.179 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -1.179 -0.443 -8.855 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -0.325 1.051 -9.311 1.00 0.00 H new ATOM 2072 N MET A 138 -2.833 4.280 -7.229 1.00 0.00 N ATOM 2073 CA MET A 138 -3.924 5.092 -6.703 1.00 0.00 C ATOM 2074 C MET A 138 -5.269 4.413 -6.938 1.00 0.00 C ATOM 2075 O MET A 138 -6.119 4.373 -6.049 1.00 0.00 O ATOM 2076 CB MET A 138 -3.917 6.477 -7.353 1.00 0.00 C ATOM 2077 CG MET A 138 -5.100 7.343 -6.951 1.00 0.00 C ATOM 2078 SD MET A 138 -4.844 9.087 -7.329 1.00 0.00 S ATOM 2079 CE MET A 138 -5.681 9.219 -8.907 1.00 0.00 C ATOM 0 H MET A 138 -2.677 4.381 -8.232 1.00 0.00 H new ATOM 0 HA MET A 138 -3.776 5.203 -5.629 1.00 0.00 H new ATOM 0 HB2 MET A 138 -2.994 6.990 -7.085 1.00 0.00 H new ATOM 0 HB3 MET A 138 -3.914 6.361 -8.437 1.00 0.00 H new ATOM 0 HG2 MET A 138 -5.994 6.991 -7.465 1.00 0.00 H new ATOM 0 HG3 MET A 138 -5.282 7.230 -5.882 1.00 0.00 H new ATOM 0 HE1 MET A 138 -5.238 10.029 -9.487 1.00 0.00 H new ATOM 0 HE2 MET A 138 -5.577 8.282 -9.454 1.00 0.00 H new ATOM 0 HE3 MET A 138 -6.738 9.427 -8.742 1.00 0.00 H new ATOM 2164 N ASN A 144 -8.658 -0.683 -9.731 1.00 0.00 N ATOM 2165 CA ASN A 144 -7.323 -0.146 -9.492 1.00 0.00 C ATOM 2166 C ASN A 144 -6.514 -0.105 -10.785 1.00 0.00 C ATOM 2167 O ASN A 144 -6.823 -0.811 -11.744 1.00 0.00 O ATOM 2168 CB ASN A 144 -6.591 -0.989 -8.446 1.00 0.00 C ATOM 2169 CG ASN A 144 -7.080 -0.714 -7.037 1.00 0.00 C ATOM 2170 OD1 ASN A 144 -7.862 0.209 -6.808 1.00 0.00 O ATOM 2171 ND2 ASN A 144 -6.621 -1.517 -6.084 1.00 0.00 N ATOM 0 HA ASN A 144 -7.430 0.872 -9.118 1.00 0.00 H new ATOM 0 HB2 ASN A 144 -6.727 -2.046 -8.675 1.00 0.00 H new ATOM 0 HB3 ASN A 144 -5.522 -0.786 -8.503 1.00 0.00 H new ATOM 0 HD21 ASN A 144 -6.915 -1.381 -5.117 1.00 0.00 H new ATOM 0 HD22 ASN A 144 -5.974 -2.270 -6.319 1.00 0.00 H new ATOM 2178 N GLU A 145 -5.477 0.726 -10.802 1.00 0.00 N ATOM 2179 CA GLU A 145 -4.624 0.859 -11.977 1.00 0.00 C ATOM 2180 C GLU A 145 -3.303 1.534 -11.618 1.00 0.00 C ATOM 2181 O GLU A 145 -3.128 2.026 -10.503 1.00 0.00 O ATOM 2182 CB GLU A 145 -5.339 1.661 -13.066 1.00 0.00 C ATOM 2183 CG GLU A 145 -5.543 3.124 -12.711 1.00 0.00 C ATOM 2184 CD GLU A 145 -6.630 3.780 -13.540 1.00 0.00 C ATOM 2185 OE1 GLU A 145 -6.373 4.082 -14.724 1.00 0.00 O ATOM 2186 OE2 GLU A 145 -7.738 3.992 -13.003 1.00 0.00 O ATOM 0 H GLU A 145 -5.207 1.317 -10.016 1.00 0.00 H new ATOM 0 HA GLU A 145 -4.410 -0.141 -12.353 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -4.763 1.597 -13.989 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -6.309 1.205 -13.263 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -5.798 3.205 -11.654 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -4.607 3.663 -12.855 1.00 0.00 H new ATOM 2193 N VAL A 146 -2.376 1.553 -12.571 1.00 0.00 N ATOM 2194 CA VAL A 146 -1.072 2.168 -12.356 1.00 0.00 C ATOM 2195 C VAL A 146 -0.963 3.498 -13.094 1.00 0.00 C ATOM 2196 O VAL A 146 -1.324 3.601 -14.267 1.00 0.00 O ATOM 2197 CB VAL A 146 0.068 1.242 -12.819 1.00 0.00 C ATOM 2198 CG1 VAL A 146 1.414 1.932 -12.663 1.00 0.00 C ATOM 2199 CG2 VAL A 146 0.038 -0.067 -12.045 1.00 0.00 C ATOM 0 H VAL A 146 -2.504 1.150 -13.499 1.00 0.00 H new ATOM 0 HA VAL A 146 -0.977 2.342 -11.284 1.00 0.00 H new ATOM 0 HB VAL A 146 -0.077 1.017 -13.876 1.00 0.00 H new ATOM 0 HG11 VAL A 146 2.207 1.262 -12.995 1.00 0.00 H new ATOM 0 HG12 VAL A 146 1.430 2.840 -13.266 1.00 0.00 H new ATOM 0 HG13 VAL A 146 1.572 2.189 -11.616 1.00 0.00 H new ATOM 0 HG21 VAL A 146 0.850 -0.709 -12.385 1.00 0.00 H new ATOM 0 HG22 VAL A 146 0.157 0.137 -10.981 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -0.915 -0.568 -12.214 1.00 0.00 H new ATOM 2209 N LEU A 147 -0.463 4.514 -12.399 1.00 0.00 N ATOM 2210 CA LEU A 147 -0.305 5.839 -12.988 1.00 0.00 C ATOM 2211 C LEU A 147 1.126 6.055 -13.468 1.00 0.00 C ATOM 2212 O LEU A 147 1.382 6.144 -14.668 1.00 0.00 O ATOM 2213 CB LEU A 147 -0.683 6.919 -11.973 1.00 0.00 C ATOM 2214 CG LEU A 147 -2.045 6.756 -11.296 1.00 0.00 C ATOM 2215 CD1 LEU A 147 -2.356 7.965 -10.426 1.00 0.00 C ATOM 2216 CD2 LEU A 147 -3.136 6.551 -12.336 1.00 0.00 C ATOM 0 H LEU A 147 -0.160 4.446 -11.427 1.00 0.00 H new ATOM 0 HA LEU A 147 -0.971 5.908 -13.848 1.00 0.00 H new ATOM 0 HB2 LEU A 147 0.084 6.947 -11.199 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -0.663 7.886 -12.476 1.00 0.00 H new ATOM 0 HG LEU A 147 -2.009 5.873 -10.657 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -3.329 7.832 -9.952 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -1.589 8.068 -9.658 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -2.373 8.863 -11.044 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -4.098 6.437 -11.836 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -3.172 7.414 -13.000 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -2.921 5.655 -12.918 1.00 0.00 H new ATOM 2228 N ASN A 148 2.056 6.136 -12.522 1.00 0.00 N ATOM 2229 CA ASN A 148 3.463 6.340 -12.848 1.00 0.00 C ATOM 2230 C ASN A 148 4.308 5.164 -12.368 1.00 0.00 C ATOM 2231 O ASN A 148 3.982 4.516 -11.373 1.00 0.00 O ATOM 2232 CB ASN A 148 3.971 7.638 -12.219 1.00 0.00 C ATOM 2233 CG ASN A 148 3.757 8.840 -13.119 1.00 0.00 C ATOM 2234 OD1 ASN A 148 3.979 10.032 -12.578 1.00 0.00 O flip ATOM 2235 ND2 ASN A 148 3.397 8.697 -14.288 1.00 0.00 N flip ATOM 0 H ASN A 148 1.861 6.064 -11.523 1.00 0.00 H new ATOM 0 HA ASN A 148 3.553 6.411 -13.932 1.00 0.00 H new ATOM 0 HB2 ASN A 148 3.460 7.803 -11.270 1.00 0.00 H new ATOM 0 HB3 ASN A 148 5.033 7.539 -11.996 1.00 0.00 H new ATOM 0 HD21 ASN A 148 3.238 7.761 -14.662 1.00 0.00 H new ATOM 0 HD22 ASN A 148 3.258 9.514 -14.882 1.00 0.00 H new ATOM 2242 N VAL A 149 5.397 4.894 -13.082 1.00 0.00 N ATOM 2243 CA VAL A 149 6.290 3.798 -12.728 1.00 0.00 C ATOM 2244 C VAL A 149 7.746 4.252 -12.733 1.00 0.00 C ATOM 2245 O VAL A 149 8.316 4.529 -13.789 1.00 0.00 O ATOM 2246 CB VAL A 149 6.131 2.610 -13.695 1.00 0.00 C ATOM 2247 CG1 VAL A 149 7.112 1.501 -13.345 1.00 0.00 C ATOM 2248 CG2 VAL A 149 4.700 2.093 -13.674 1.00 0.00 C ATOM 0 H VAL A 149 5.681 5.420 -13.909 1.00 0.00 H new ATOM 0 HA VAL A 149 6.016 3.478 -11.723 1.00 0.00 H new ATOM 0 HB VAL A 149 6.354 2.954 -14.705 1.00 0.00 H new ATOM 0 HG11 VAL A 149 6.985 0.670 -14.039 1.00 0.00 H new ATOM 0 HG12 VAL A 149 8.131 1.881 -13.417 1.00 0.00 H new ATOM 0 HG13 VAL A 149 6.924 1.156 -12.328 1.00 0.00 H new ATOM 0 HG21 VAL A 149 4.606 1.254 -14.363 1.00 0.00 H new ATOM 0 HG22 VAL A 149 4.446 1.765 -12.666 1.00 0.00 H new ATOM 0 HG23 VAL A 149 4.021 2.890 -13.978 1.00 0.00 H new ATOM 2258 N ILE A 150 8.341 4.325 -11.548 1.00 0.00 N ATOM 2259 CA ILE A 150 9.731 4.744 -11.416 1.00 0.00 C ATOM 2260 C ILE A 150 10.662 3.539 -11.329 1.00 0.00 C ATOM 2261 O ILE A 150 10.574 2.741 -10.396 1.00 0.00 O ATOM 2262 CB ILE A 150 9.937 5.628 -10.172 1.00 0.00 C ATOM 2263 CG1 ILE A 150 9.100 6.904 -10.283 1.00 0.00 C ATOM 2264 CG2 ILE A 150 11.410 5.968 -10.002 1.00 0.00 C ATOM 2265 CD1 ILE A 150 8.773 7.530 -8.945 1.00 0.00 C ATOM 0 H ILE A 150 7.883 4.100 -10.665 1.00 0.00 H new ATOM 0 HA ILE A 150 9.972 5.323 -12.307 1.00 0.00 H new ATOM 0 HB ILE A 150 9.608 5.075 -9.292 1.00 0.00 H new ATOM 0 HG12 ILE A 150 9.638 7.630 -10.893 1.00 0.00 H new ATOM 0 HG13 ILE A 150 8.171 6.675 -10.805 1.00 0.00 H new ATOM 0 HG21 ILE A 150 11.539 6.593 -9.119 1.00 0.00 H new ATOM 0 HG22 ILE A 150 11.984 5.049 -9.884 1.00 0.00 H new ATOM 0 HG23 ILE A 150 11.763 6.506 -10.882 1.00 0.00 H new ATOM 0 HD11 ILE A 150 8.178 8.430 -9.100 1.00 0.00 H new ATOM 0 HD12 ILE A 150 8.208 6.821 -8.340 1.00 0.00 H new ATOM 0 HD13 ILE A 150 9.697 7.791 -8.430 1.00 0.00 H new ATOM 2277 N GLN A 151 11.555 3.416 -12.306 1.00 0.00 N ATOM 2278 CA GLN A 151 12.503 2.310 -12.339 1.00 0.00 C ATOM 2279 C GLN A 151 13.207 2.156 -10.995 1.00 0.00 C ATOM 2280 O GLN A 151 12.989 1.182 -10.276 1.00 0.00 O ATOM 2281 CB GLN A 151 13.535 2.528 -13.447 1.00 0.00 C ATOM 2282 CG GLN A 151 13.122 1.942 -14.787 1.00 0.00 C ATOM 2283 CD GLN A 151 14.252 1.944 -15.798 1.00 0.00 C ATOM 2284 OE1 GLN A 151 15.155 1.110 -15.739 1.00 0.00 O ATOM 2285 NE2 GLN A 151 14.206 2.884 -16.735 1.00 0.00 N ATOM 0 H GLN A 151 11.641 4.069 -13.085 1.00 0.00 H new ATOM 0 HA GLN A 151 11.948 1.395 -12.544 1.00 0.00 H new ATOM 0 HB2 GLN A 151 13.708 3.598 -13.565 1.00 0.00 H new ATOM 0 HB3 GLN A 151 14.482 2.084 -13.142 1.00 0.00 H new ATOM 0 HG2 GLN A 151 12.773 0.920 -14.640 1.00 0.00 H new ATOM 0 HG3 GLN A 151 12.282 2.512 -15.185 1.00 0.00 H new ATOM 0 HE21 GLN A 151 13.438 3.556 -16.746 1.00 0.00 H new ATOM 0 HE22 GLN A 151 14.938 2.934 -17.443 1.00 0.00 H new ATOM 2294 N GLY A 152 14.054 3.125 -10.662 1.00 0.00 N ATOM 2295 CA GLY A 152 14.778 3.078 -9.405 1.00 0.00 C ATOM 2296 C GLY A 152 15.966 4.019 -9.384 1.00 0.00 C ATOM 2297 O GLY A 152 16.437 4.412 -8.318 1.00 0.00 O ATOM 0 H GLY A 152 14.252 3.942 -11.240 1.00 0.00 H new ATOM 0 HA2 GLY A 152 14.101 3.334 -8.590 1.00 0.00 H new ATOM 0 HA3 GLY A 152 15.122 2.059 -9.225 1.00 0.00 H new ATOM 2301 N ASN A 153 16.454 4.380 -10.567 1.00 0.00 N ATOM 2302 CA ASN A 153 17.597 5.279 -10.681 1.00 0.00 C ATOM 2303 C ASN A 153 17.163 6.733 -10.520 1.00 0.00 C ATOM 2304 O ASN A 153 17.917 7.655 -10.831 1.00 0.00 O ATOM 2305 CB ASN A 153 18.290 5.087 -12.031 1.00 0.00 C ATOM 2306 CG ASN A 153 17.368 5.375 -13.200 1.00 0.00 C ATOM 2307 OD1 ASN A 153 16.299 5.962 -13.032 1.00 0.00 O ATOM 2308 ND2 ASN A 153 17.778 4.962 -14.394 1.00 0.00 N ATOM 0 H ASN A 153 16.076 4.064 -11.460 1.00 0.00 H new ATOM 0 HA ASN A 153 18.299 5.038 -9.883 1.00 0.00 H new ATOM 0 HB2 ASN A 153 19.159 5.743 -12.087 1.00 0.00 H new ATOM 0 HB3 ASN A 153 18.658 4.064 -12.105 1.00 0.00 H new ATOM 0 HD21 ASN A 153 17.199 5.128 -15.217 1.00 0.00 H new ATOM 0 HD22 ASN A 153 18.672 4.479 -14.487 1.00 0.00 H new ATOM 2315 N THR A 154 15.943 6.930 -10.031 1.00 0.00 N ATOM 2316 CA THR A 154 15.408 8.271 -9.829 1.00 0.00 C ATOM 2317 C THR A 154 16.167 9.005 -8.730 1.00 0.00 C ATOM 2318 O THR A 154 17.061 8.444 -8.096 1.00 0.00 O ATOM 2319 CB THR A 154 13.912 8.230 -9.466 1.00 0.00 C ATOM 2320 OG1 THR A 154 13.368 9.555 -9.480 1.00 0.00 O ATOM 2321 CG2 THR A 154 13.705 7.607 -8.094 1.00 0.00 C ATOM 0 H THR A 154 15.306 6.178 -9.767 1.00 0.00 H new ATOM 0 HA THR A 154 15.531 8.806 -10.771 1.00 0.00 H new ATOM 0 HB THR A 154 13.398 7.618 -10.207 1.00 0.00 H new ATOM 0 HG1 THR A 154 12.416 9.520 -9.250 1.00 0.00 H new ATOM 0 HG21 THR A 154 12.641 7.589 -7.859 1.00 0.00 H new ATOM 0 HG22 THR A 154 14.094 6.589 -8.094 1.00 0.00 H new ATOM 0 HG23 THR A 154 14.232 8.196 -7.344 1.00 0.00 H new ATOM 2329 N THR A 155 15.805 10.265 -8.508 1.00 0.00 N ATOM 2330 CA THR A 155 16.452 11.077 -7.485 1.00 0.00 C ATOM 2331 C THR A 155 15.435 11.614 -6.484 1.00 0.00 C ATOM 2332 O THR A 155 14.278 11.857 -6.829 1.00 0.00 O ATOM 2333 CB THR A 155 17.216 12.261 -8.107 1.00 0.00 C ATOM 2334 OG1 THR A 155 16.312 13.099 -8.835 1.00 0.00 O ATOM 2335 CG2 THR A 155 18.317 11.767 -9.034 1.00 0.00 C ATOM 0 H THR A 155 15.067 10.745 -9.023 1.00 0.00 H new ATOM 0 HA THR A 155 17.159 10.428 -6.968 1.00 0.00 H new ATOM 0 HB THR A 155 17.672 12.835 -7.300 1.00 0.00 H new ATOM 0 HG1 THR A 155 16.805 13.850 -9.226 1.00 0.00 H new ATOM 0 HG21 THR A 155 18.843 12.621 -9.462 1.00 0.00 H new ATOM 0 HG22 THR A 155 19.019 11.153 -8.470 1.00 0.00 H new ATOM 0 HG23 THR A 155 17.878 11.173 -9.835 1.00 0.00 H new ATOM 2343 N VAL A 156 15.873 11.796 -5.242 1.00 0.00 N ATOM 2344 CA VAL A 156 15.000 12.306 -4.191 1.00 0.00 C ATOM 2345 C VAL A 156 14.098 13.418 -4.716 1.00 0.00 C ATOM 2346 O VAL A 156 12.881 13.382 -4.533 1.00 0.00 O ATOM 2347 CB VAL A 156 15.813 12.841 -2.997 1.00 0.00 C ATOM 2348 CG1 VAL A 156 14.905 13.564 -2.014 1.00 0.00 C ATOM 2349 CG2 VAL A 156 16.561 11.708 -2.311 1.00 0.00 C ATOM 0 H VAL A 156 16.827 11.598 -4.939 1.00 0.00 H new ATOM 0 HA VAL A 156 14.385 11.470 -3.858 1.00 0.00 H new ATOM 0 HB VAL A 156 16.546 13.556 -3.370 1.00 0.00 H new ATOM 0 HG11 VAL A 156 15.497 13.935 -1.177 1.00 0.00 H new ATOM 0 HG12 VAL A 156 14.420 14.402 -2.515 1.00 0.00 H new ATOM 0 HG13 VAL A 156 14.146 12.874 -1.644 1.00 0.00 H new ATOM 0 HG21 VAL A 156 17.130 12.104 -1.470 1.00 0.00 H new ATOM 0 HG22 VAL A 156 15.848 10.967 -1.950 1.00 0.00 H new ATOM 0 HG23 VAL A 156 17.242 11.239 -3.021 1.00 0.00 H new ATOM 2359 N ASP A 157 14.703 14.403 -5.371 1.00 0.00 N ATOM 2360 CA ASP A 157 13.954 15.525 -5.925 1.00 0.00 C ATOM 2361 C ASP A 157 12.786 15.033 -6.773 1.00 0.00 C ATOM 2362 O ASP A 157 11.681 15.569 -6.696 1.00 0.00 O ATOM 2363 CB ASP A 157 14.873 16.413 -6.766 1.00 0.00 C ATOM 2364 CG ASP A 157 15.532 17.505 -5.946 1.00 0.00 C ATOM 2365 OD1 ASP A 157 14.925 17.945 -4.948 1.00 0.00 O ATOM 2366 OD2 ASP A 157 16.654 17.920 -6.304 1.00 0.00 O ATOM 0 H ASP A 157 15.709 14.447 -5.531 1.00 0.00 H new ATOM 0 HA ASP A 157 13.556 16.109 -5.096 1.00 0.00 H new ATOM 0 HB2 ASP A 157 15.643 15.797 -7.231 1.00 0.00 H new ATOM 0 HB3 ASP A 157 14.297 16.866 -7.573 1.00 0.00 H new ATOM 2371 N GLU A 158 13.039 14.009 -7.583 1.00 0.00 N ATOM 2372 CA GLU A 158 12.008 13.446 -8.447 1.00 0.00 C ATOM 2373 C GLU A 158 10.850 12.891 -7.622 1.00 0.00 C ATOM 2374 O GLU A 158 9.684 13.040 -7.988 1.00 0.00 O ATOM 2375 CB GLU A 158 12.596 12.343 -9.328 1.00 0.00 C ATOM 2376 CG GLU A 158 13.518 12.861 -10.419 1.00 0.00 C ATOM 2377 CD GLU A 158 12.832 13.850 -11.342 1.00 0.00 C ATOM 2378 OE1 GLU A 158 12.191 13.403 -12.317 1.00 0.00 O ATOM 2379 OE2 GLU A 158 12.935 15.068 -11.090 1.00 0.00 O ATOM 0 H GLU A 158 13.948 13.553 -7.659 1.00 0.00 H new ATOM 0 HA GLU A 158 11.628 14.245 -9.084 1.00 0.00 H new ATOM 0 HB2 GLU A 158 13.148 11.643 -8.700 1.00 0.00 H new ATOM 0 HB3 GLU A 158 11.781 11.784 -9.788 1.00 0.00 H new ATOM 0 HG2 GLU A 158 14.384 13.338 -9.961 1.00 0.00 H new ATOM 0 HG3 GLU A 158 13.890 12.020 -11.005 1.00 0.00 H new ATOM 2386 N LEU A 159 11.181 12.249 -6.507 1.00 0.00 N ATOM 2387 CA LEU A 159 10.170 11.670 -5.629 1.00 0.00 C ATOM 2388 C LEU A 159 9.219 12.744 -5.111 1.00 0.00 C ATOM 2389 O LEU A 159 8.000 12.580 -5.154 1.00 0.00 O ATOM 2390 CB LEU A 159 10.837 10.953 -4.454 1.00 0.00 C ATOM 2391 CG LEU A 159 11.748 9.779 -4.813 1.00 0.00 C ATOM 2392 CD1 LEU A 159 12.338 9.157 -3.557 1.00 0.00 C ATOM 2393 CD2 LEU A 159 10.985 8.738 -5.619 1.00 0.00 C ATOM 0 H LEU A 159 12.141 12.116 -6.190 1.00 0.00 H new ATOM 0 HA LEU A 159 9.593 10.948 -6.207 1.00 0.00 H new ATOM 0 HB2 LEU A 159 11.422 11.683 -3.894 1.00 0.00 H new ATOM 0 HB3 LEU A 159 10.056 10.590 -3.786 1.00 0.00 H new ATOM 0 HG LEU A 159 12.567 10.155 -5.426 1.00 0.00 H new ATOM 0 HD11 LEU A 159 12.984 8.323 -3.833 1.00 0.00 H new ATOM 0 HD12 LEU A 159 12.921 9.905 -3.020 1.00 0.00 H new ATOM 0 HD13 LEU A 159 11.533 8.796 -2.917 1.00 0.00 H new ATOM 0 HD21 LEU A 159 11.650 7.910 -5.865 1.00 0.00 H new ATOM 0 HD22 LEU A 159 10.145 8.367 -5.032 1.00 0.00 H new ATOM 0 HD23 LEU A 159 10.613 9.191 -6.538 1.00 0.00 H new ATOM 2405 N MET A 160 9.785 13.843 -4.624 1.00 0.00 N ATOM 2406 CA MET A 160 8.986 14.946 -4.101 1.00 0.00 C ATOM 2407 C MET A 160 7.860 15.306 -5.064 1.00 0.00 C ATOM 2408 O MET A 160 6.682 15.201 -4.723 1.00 0.00 O ATOM 2409 CB MET A 160 9.870 16.169 -3.850 1.00 0.00 C ATOM 2410 CG MET A 160 10.409 16.249 -2.431 1.00 0.00 C ATOM 2411 SD MET A 160 9.137 16.680 -1.228 1.00 0.00 S ATOM 2412 CE MET A 160 8.555 15.054 -0.752 1.00 0.00 C ATOM 0 H MET A 160 10.793 13.994 -4.580 1.00 0.00 H new ATOM 0 HA MET A 160 8.544 14.627 -3.157 1.00 0.00 H new ATOM 0 HB2 MET A 160 10.707 16.151 -4.547 1.00 0.00 H new ATOM 0 HB3 MET A 160 9.297 17.071 -4.064 1.00 0.00 H new ATOM 0 HG2 MET A 160 10.850 15.290 -2.160 1.00 0.00 H new ATOM 0 HG3 MET A 160 11.207 16.990 -2.391 1.00 0.00 H new ATOM 0 HE1 MET A 160 7.483 14.984 -0.934 1.00 0.00 H new ATOM 0 HE2 MET A 160 9.073 14.296 -1.339 1.00 0.00 H new ATOM 0 HE3 MET A 160 8.755 14.892 0.307 1.00 0.00 H new ATOM 2422 N MET A 161 8.230 15.731 -6.268 1.00 0.00 N ATOM 2423 CA MET A 161 7.250 16.106 -7.280 1.00 0.00 C ATOM 2424 C MET A 161 6.411 14.902 -7.697 1.00 0.00 C ATOM 2425 O MET A 161 5.190 14.998 -7.823 1.00 0.00 O ATOM 2426 CB MET A 161 7.950 16.702 -8.503 1.00 0.00 C ATOM 2427 CG MET A 161 9.074 15.833 -9.043 1.00 0.00 C ATOM 2428 SD MET A 161 8.547 14.792 -10.419 1.00 0.00 S ATOM 2429 CE MET A 161 9.213 15.705 -11.808 1.00 0.00 C ATOM 0 H MET A 161 9.201 15.824 -6.566 1.00 0.00 H new ATOM 0 HA MET A 161 6.588 16.856 -6.848 1.00 0.00 H new ATOM 0 HB2 MET A 161 7.214 16.861 -9.291 1.00 0.00 H new ATOM 0 HB3 MET A 161 8.352 17.680 -8.240 1.00 0.00 H new ATOM 0 HG2 MET A 161 9.896 16.470 -9.369 1.00 0.00 H new ATOM 0 HG3 MET A 161 9.458 15.202 -8.241 1.00 0.00 H new ATOM 0 HE1 MET A 161 8.969 15.186 -12.735 1.00 0.00 H new ATOM 0 HE2 MET A 161 8.780 16.705 -11.827 1.00 0.00 H new ATOM 0 HE3 MET A 161 10.296 15.780 -11.708 1.00 0.00 H new ATOM 2439 N ARG A 162 7.073 13.770 -7.909 1.00 0.00 N ATOM 2440 CA ARG A 162 6.388 12.548 -8.313 1.00 0.00 C ATOM 2441 C ARG A 162 5.204 12.259 -7.394 1.00 0.00 C ATOM 2442 O ARG A 162 4.113 11.925 -7.857 1.00 0.00 O ATOM 2443 CB ARG A 162 7.359 11.365 -8.299 1.00 0.00 C ATOM 2444 CG ARG A 162 8.214 11.264 -9.551 1.00 0.00 C ATOM 2445 CD ARG A 162 7.470 10.566 -10.679 1.00 0.00 C ATOM 2446 NE ARG A 162 8.284 10.459 -11.887 1.00 0.00 N ATOM 2447 CZ ARG A 162 7.774 10.340 -13.108 1.00 0.00 C ATOM 2448 NH1 ARG A 162 6.460 10.314 -13.282 1.00 0.00 N ATOM 2449 NH2 ARG A 162 8.579 10.249 -14.159 1.00 0.00 N ATOM 0 H ARG A 162 8.083 13.673 -7.808 1.00 0.00 H new ATOM 0 HA ARG A 162 6.013 12.690 -9.327 1.00 0.00 H new ATOM 0 HB2 ARG A 162 8.011 11.452 -7.430 1.00 0.00 H new ATOM 0 HB3 ARG A 162 6.792 10.442 -8.181 1.00 0.00 H new ATOM 0 HG2 ARG A 162 8.510 12.263 -9.872 1.00 0.00 H new ATOM 0 HG3 ARG A 162 9.129 10.717 -9.325 1.00 0.00 H new ATOM 0 HD2 ARG A 162 7.171 9.570 -10.354 1.00 0.00 H new ATOM 0 HD3 ARG A 162 6.556 11.115 -10.905 1.00 0.00 H new ATOM 0 HE ARG A 162 9.299 10.477 -11.788 1.00 0.00 H new ATOM 0 HH11 ARG A 162 5.837 10.385 -12.477 1.00 0.00 H new ATOM 0 HH12 ARG A 162 6.072 10.223 -14.221 1.00 0.00 H new ATOM 0 HH21 ARG A 162 9.591 10.270 -14.030 1.00 0.00 H new ATOM 0 HH22 ARG A 162 8.186 10.158 -15.096 1.00 0.00 H new ATOM 2463 N LEU A 163 5.428 12.390 -6.091 1.00 0.00 N ATOM 2464 CA LEU A 163 4.380 12.143 -5.107 1.00 0.00 C ATOM 2465 C LEU A 163 3.379 13.294 -5.076 1.00 0.00 C ATOM 2466 O LEU A 163 2.168 13.076 -5.070 1.00 0.00 O ATOM 2467 CB LEU A 163 4.993 11.948 -3.719 1.00 0.00 C ATOM 2468 CG LEU A 163 5.870 10.708 -3.540 1.00 0.00 C ATOM 2469 CD1 LEU A 163 6.775 10.865 -2.328 1.00 0.00 C ATOM 2470 CD2 LEU A 163 5.008 9.461 -3.407 1.00 0.00 C ATOM 0 H LEU A 163 6.325 12.666 -5.692 1.00 0.00 H new ATOM 0 HA LEU A 163 3.852 11.234 -5.396 1.00 0.00 H new ATOM 0 HB2 LEU A 163 5.590 12.828 -3.481 1.00 0.00 H new ATOM 0 HB3 LEU A 163 4.184 11.905 -2.990 1.00 0.00 H new ATOM 0 HG LEU A 163 6.498 10.599 -4.424 1.00 0.00 H new ATOM 0 HD11 LEU A 163 7.392 9.973 -2.216 1.00 0.00 H new ATOM 0 HD12 LEU A 163 7.417 11.735 -2.464 1.00 0.00 H new ATOM 0 HD13 LEU A 163 6.166 10.999 -1.434 1.00 0.00 H new ATOM 0 HD21 LEU A 163 5.648 8.588 -3.280 1.00 0.00 H new ATOM 0 HD22 LEU A 163 4.355 9.561 -2.540 1.00 0.00 H new ATOM 0 HD23 LEU A 163 4.403 9.340 -4.305 1.00 0.00 H new ATOM 2482 N MET A 164 3.894 14.519 -5.059 1.00 0.00 N ATOM 2483 CA MET A 164 3.045 15.704 -5.033 1.00 0.00 C ATOM 2484 C MET A 164 2.001 15.649 -6.144 1.00 0.00 C ATOM 2485 O MET A 164 0.799 15.708 -5.882 1.00 0.00 O ATOM 2486 CB MET A 164 3.893 16.969 -5.178 1.00 0.00 C ATOM 2487 CG MET A 164 4.685 17.315 -3.927 1.00 0.00 C ATOM 2488 SD MET A 164 3.759 18.357 -2.784 1.00 0.00 S ATOM 2489 CE MET A 164 5.036 18.784 -1.604 1.00 0.00 C ATOM 0 H MET A 164 4.895 14.717 -5.063 1.00 0.00 H new ATOM 0 HA MET A 164 2.529 15.729 -4.073 1.00 0.00 H new ATOM 0 HB2 MET A 164 4.583 16.840 -6.012 1.00 0.00 H new ATOM 0 HB3 MET A 164 3.242 17.806 -5.430 1.00 0.00 H new ATOM 0 HG2 MET A 164 4.975 16.395 -3.420 1.00 0.00 H new ATOM 0 HG3 MET A 164 5.605 17.825 -4.214 1.00 0.00 H new ATOM 0 HE1 MET A 164 4.582 19.244 -0.727 1.00 0.00 H new ATOM 0 HE2 MET A 164 5.571 17.883 -1.305 1.00 0.00 H new ATOM 0 HE3 MET A 164 5.734 19.486 -2.061 1.00 0.00 H new ATOM 2499 N ALA A 165 2.467 15.536 -7.383 1.00 0.00 N ATOM 2500 CA ALA A 165 1.572 15.472 -8.533 1.00 0.00 C ATOM 2501 C ALA A 165 0.445 14.473 -8.296 1.00 0.00 C ATOM 2502 O ALA A 165 -0.732 14.812 -8.412 1.00 0.00 O ATOM 2503 CB ALA A 165 2.351 15.104 -9.787 1.00 0.00 C ATOM 0 H ALA A 165 3.459 15.487 -7.617 1.00 0.00 H new ATOM 0 HA ALA A 165 1.126 16.457 -8.671 1.00 0.00 H new ATOM 0 HB1 ALA A 165 1.671 15.060 -10.638 1.00 0.00 H new ATOM 0 HB2 ALA A 165 3.117 15.857 -9.973 1.00 0.00 H new ATOM 0 HB3 ALA A 165 2.824 14.132 -9.649 1.00 0.00 H new ATOM 2509 N ALA A 166 0.813 13.240 -7.964 1.00 0.00 N ATOM 2510 CA ALA A 166 -0.167 12.192 -7.709 1.00 0.00 C ATOM 2511 C ALA A 166 -1.177 12.629 -6.653 1.00 0.00 C ATOM 2512 O ALA A 166 -2.377 12.696 -6.918 1.00 0.00 O ATOM 2513 CB ALA A 166 0.530 10.910 -7.278 1.00 0.00 C ATOM 0 H ALA A 166 1.784 12.942 -7.865 1.00 0.00 H new ATOM 0 HA ALA A 166 -0.709 12.003 -8.636 1.00 0.00 H new ATOM 0 HB1 ALA A 166 -0.215 10.136 -7.091 1.00 0.00 H new ATOM 0 HB2 ALA A 166 1.206 10.580 -8.067 1.00 0.00 H new ATOM 0 HB3 ALA A 166 1.099 11.094 -6.367 1.00 0.00 H new ATOM 2519 N MET A 167 -0.682 12.925 -5.456 1.00 0.00 N ATOM 2520 CA MET A 167 -1.542 13.357 -4.360 1.00 0.00 C ATOM 2521 C MET A 167 -2.578 14.364 -4.846 1.00 0.00 C ATOM 2522 O MET A 167 -3.760 14.258 -4.520 1.00 0.00 O ATOM 2523 CB MET A 167 -0.703 13.972 -3.237 1.00 0.00 C ATOM 2524 CG MET A 167 -1.300 13.772 -1.854 1.00 0.00 C ATOM 2525 SD MET A 167 -2.434 15.094 -1.389 1.00 0.00 S ATOM 2526 CE MET A 167 -3.850 14.146 -0.836 1.00 0.00 C ATOM 0 H MET A 167 0.309 12.874 -5.220 1.00 0.00 H new ATOM 0 HA MET A 167 -2.065 12.482 -3.975 1.00 0.00 H new ATOM 0 HB2 MET A 167 0.295 13.535 -3.259 1.00 0.00 H new ATOM 0 HB3 MET A 167 -0.588 15.040 -3.423 1.00 0.00 H new ATOM 0 HG2 MET A 167 -1.828 12.819 -1.825 1.00 0.00 H new ATOM 0 HG3 MET A 167 -0.496 13.714 -1.120 1.00 0.00 H new ATOM 0 HE1 MET A 167 -4.640 14.825 -0.515 1.00 0.00 H new ATOM 0 HE2 MET A 167 -4.215 13.526 -1.655 1.00 0.00 H new ATOM 0 HE3 MET A 167 -3.558 13.509 -0.001 1.00 0.00 H new ATOM 2536 N GLU A 168 -2.127 15.341 -5.627 1.00 0.00 N ATOM 2537 CA GLU A 168 -3.017 16.368 -6.156 1.00 0.00 C ATOM 2538 C GLU A 168 -4.053 15.757 -7.096 1.00 0.00 C ATOM 2539 O GLU A 168 -5.257 15.842 -6.849 1.00 0.00 O ATOM 2540 CB GLU A 168 -2.213 17.441 -6.894 1.00 0.00 C ATOM 2541 CG GLU A 168 -1.224 18.177 -6.006 1.00 0.00 C ATOM 2542 CD GLU A 168 -1.837 19.388 -5.330 1.00 0.00 C ATOM 2543 OE1 GLU A 168 -1.855 20.471 -5.953 1.00 0.00 O ATOM 2544 OE2 GLU A 168 -2.299 19.253 -4.177 1.00 0.00 O ATOM 0 H GLU A 168 -1.151 15.443 -5.907 1.00 0.00 H new ATOM 0 HA GLU A 168 -3.539 16.828 -5.317 1.00 0.00 H new ATOM 0 HB2 GLU A 168 -1.672 16.976 -7.718 1.00 0.00 H new ATOM 0 HB3 GLU A 168 -2.902 18.163 -7.332 1.00 0.00 H new ATOM 0 HG2 GLU A 168 -0.846 17.494 -5.246 1.00 0.00 H new ATOM 0 HG3 GLU A 168 -0.369 18.493 -6.604 1.00 0.00 H new ATOM 2551 N ILE A 169 -3.577 15.144 -8.174 1.00 0.00 N ATOM 2552 CA ILE A 169 -4.461 14.519 -9.150 1.00 0.00 C ATOM 2553 C ILE A 169 -5.620 13.805 -8.464 1.00 0.00 C ATOM 2554 O ILE A 169 -6.778 13.961 -8.853 1.00 0.00 O ATOM 2555 CB ILE A 169 -3.702 13.512 -10.033 1.00 0.00 C ATOM 2556 CG1 ILE A 169 -2.606 14.222 -10.830 1.00 0.00 C ATOM 2557 CG2 ILE A 169 -4.665 12.797 -10.969 1.00 0.00 C ATOM 2558 CD1 ILE A 169 -1.626 13.276 -11.488 1.00 0.00 C ATOM 0 H ILE A 169 -2.584 15.067 -8.394 1.00 0.00 H new ATOM 0 HA ILE A 169 -4.852 15.319 -9.779 1.00 0.00 H new ATOM 0 HB ILE A 169 -3.233 12.769 -9.388 1.00 0.00 H new ATOM 0 HG12 ILE A 169 -3.070 14.842 -11.597 1.00 0.00 H new ATOM 0 HG13 ILE A 169 -2.061 14.892 -10.165 1.00 0.00 H new ATOM 0 HG21 ILE A 169 -4.113 12.088 -11.587 1.00 0.00 H new ATOM 0 HG22 ILE A 169 -5.412 12.262 -10.383 1.00 0.00 H new ATOM 0 HG23 ILE A 169 -5.160 13.527 -11.609 1.00 0.00 H new ATOM 0 HD11 ILE A 169 -0.878 13.850 -12.035 1.00 0.00 H new ATOM 0 HD12 ILE A 169 -1.134 12.673 -10.725 1.00 0.00 H new ATOM 0 HD13 ILE A 169 -2.159 12.623 -12.179 1.00 0.00 H new ATOM 2570 N PHE A 170 -5.302 13.021 -7.439 1.00 0.00 N ATOM 2571 CA PHE A 170 -6.317 12.283 -6.697 1.00 0.00 C ATOM 2572 C PHE A 170 -7.522 13.168 -6.395 1.00 0.00 C ATOM 2573 O PHE A 170 -8.642 12.880 -6.818 1.00 0.00 O ATOM 2574 CB PHE A 170 -5.730 11.738 -5.393 1.00 0.00 C ATOM 2575 CG PHE A 170 -6.728 10.997 -4.550 1.00 0.00 C ATOM 2576 CD1 PHE A 170 -7.768 11.672 -3.931 1.00 0.00 C ATOM 2577 CD2 PHE A 170 -6.627 9.627 -4.377 1.00 0.00 C ATOM 2578 CE1 PHE A 170 -8.688 10.993 -3.154 1.00 0.00 C ATOM 2579 CE2 PHE A 170 -7.544 8.942 -3.601 1.00 0.00 C ATOM 2580 CZ PHE A 170 -8.576 9.627 -2.990 1.00 0.00 C ATOM 0 H PHE A 170 -4.349 12.881 -7.103 1.00 0.00 H new ATOM 0 HA PHE A 170 -6.648 11.449 -7.315 1.00 0.00 H new ATOM 0 HB2 PHE A 170 -4.899 11.072 -5.628 1.00 0.00 H new ATOM 0 HB3 PHE A 170 -5.321 12.566 -4.814 1.00 0.00 H new ATOM 0 HD1 PHE A 170 -7.861 12.741 -4.057 1.00 0.00 H new ATOM 0 HD2 PHE A 170 -5.822 9.087 -4.854 1.00 0.00 H new ATOM 0 HE1 PHE A 170 -9.493 11.531 -2.676 1.00 0.00 H new ATOM 0 HE2 PHE A 170 -7.453 7.873 -3.473 1.00 0.00 H new ATOM 0 HZ PHE A 170 -9.295 9.094 -2.385 1.00 0.00 H new ATOM 2590 N THR A 171 -7.284 14.250 -5.659 1.00 0.00 N ATOM 2591 CA THR A 171 -8.349 15.178 -5.298 1.00 0.00 C ATOM 2592 C THR A 171 -9.291 15.417 -6.472 1.00 0.00 C ATOM 2593 O THR A 171 -10.510 15.443 -6.306 1.00 0.00 O ATOM 2594 CB THR A 171 -7.780 16.529 -4.827 1.00 0.00 C ATOM 2595 OG1 THR A 171 -6.712 16.314 -3.897 1.00 0.00 O ATOM 2596 CG2 THR A 171 -8.864 17.375 -4.176 1.00 0.00 C ATOM 0 H THR A 171 -6.363 14.505 -5.302 1.00 0.00 H new ATOM 0 HA THR A 171 -8.904 14.720 -4.479 1.00 0.00 H new ATOM 0 HB THR A 171 -7.400 17.062 -5.699 1.00 0.00 H new ATOM 0 HG1 THR A 171 -6.355 17.178 -3.604 1.00 0.00 H new ATOM 0 HG21 THR A 171 -8.439 18.325 -3.851 1.00 0.00 H new ATOM 0 HG22 THR A 171 -9.661 17.562 -4.896 1.00 0.00 H new ATOM 0 HG23 THR A 171 -9.270 16.846 -3.314 1.00 0.00 H new