USER MOD reduce.3.24.130724 H: found=0, std=0, add=873, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 875 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 163 GLN : amide:sc= -0.121 K(o=-0.16,f=-2.8) USER MOD Set 1.2: A 167 HIS : no HE2:sc= -0.0436 K(o=-0.16,f=-2.6) USER MOD Set 2.1: A 126 LYS NZ :NH3+ -145:sc= 1.24 (180deg=0) USER MOD Set 2.2: A 129 GLN : amide:sc= 0.89 K(o=2.1,f=-8!) USER MOD Set 3.1: A 102 ASN : amide:sc= 0.265 K(o=0.51,f=-4.3) USER MOD Set 3.2: A 104 ASN :FLIP amide:sc= 0.128 F(o=-0.19,f=0.51) USER MOD Set 3.3: A 106 ASN :FLIP amide:sc= 0.115 F(o=-0.38,f=0.51) USER MOD Set 4.1: A 101 ASN : amide:sc= -1.4 X(o=-2.9,f=-3.2!) USER MOD Set 4.2: A 107 GLN : amide:sc= -1.54! C(o=-2.9!,f=-4.1!) USER MOD Single : A 57 SER OG : rot 32:sc= 0.0883 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 66 HIS : no HD1:sc= -0.0589 X(o=-0.059,f=0) USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 150:sc= -0.874 USER MOD Single : A 78 ASN : amide:sc= -0.0553 K(o=-0.055,f=-0.57) USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 80 ASN :FLIP amide:sc= 0 F(o=-1.3,f=0) USER MOD Single : A 82 MET CE :methyl -112:sc= -0.129 (180deg=-0.525) USER MOD Single : A 86 GLN : amide:sc= -0.111 X(o=-0.11,f=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 179:sc= -0.139 (180deg=-0.144) USER MOD Single : A 110 HIS :FLIP no HE2:sc= 0.178 F(o=-0.7,f=0.18) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ 150:sc= 0.916 (180deg=0.259) USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 MET CE :methyl 172:sc= -0.492 (180deg=-0.638) USER MOD Single : A 125 ASN : amide:sc= -0.14 K(o=-0.14,f=-2.5!) USER MOD Single : A 139 ASN : amide:sc= -0.278 X(o=-0.28,f=-0.11) USER MOD Single : A 140 ASN : amide:sc= -1.44 X(o=-1.4,f=-1.5) USER MOD Single : A 143 THR OG1 : rot 160:sc= -0.135 USER MOD Single : A 144 MET CE :methyl 174:sc= -1.22 (180deg=-1.35) USER MOD Single : A 147 HIS : no HD1:sc= 0 X(o=0,f=-0.038) USER MOD Single : A 148 MET CE :methyl -150:sc= -3.5! (180deg=-3.82!) USER MOD Single : A 149 THR OG1 : rot 180:sc= 0 USER MOD Single : A 153 LYS NZ :NH3+ 174:sc= -0.71 (180deg=-0.777) USER MOD Single : A 156 ASN : amide:sc= -1.02 K(o=-1,f=-4.9!) USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 165 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 166 LYS NZ :NH3+ 152:sc= 0.78 (180deg=0.194) USER MOD Single : A 170 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 91 N SER A 57 -2.905 -1.466 -10.826 1.00 0.00 N ATOM 92 CA SER A 57 -2.118 -0.803 -11.871 1.00 0.00 C ATOM 93 C SER A 57 -3.028 -0.369 -13.044 1.00 0.00 C ATOM 94 O SER A 57 -3.494 -1.207 -13.821 1.00 0.00 O ATOM 95 CB SER A 57 -0.994 -1.740 -12.357 1.00 0.00 C ATOM 96 OG SER A 57 -0.161 -2.151 -11.278 1.00 0.00 O ATOM 0 HA SER A 57 -1.662 0.095 -11.455 1.00 0.00 H new ATOM 0 HB2 SER A 57 -1.430 -2.616 -12.837 1.00 0.00 H new ATOM 0 HB3 SER A 57 -0.393 -1.230 -13.110 1.00 0.00 H new ATOM 0 HG SER A 57 -0.693 -2.207 -10.457 1.00 0.00 H new ATOM 102 N VAL A 58 -3.268 0.949 -13.155 1.00 0.00 N ATOM 103 CA VAL A 58 -4.178 1.530 -14.158 1.00 0.00 C ATOM 104 C VAL A 58 -3.387 1.985 -15.391 1.00 0.00 C ATOM 105 O VAL A 58 -2.174 2.236 -15.308 1.00 0.00 O ATOM 106 CB VAL A 58 -4.987 2.756 -13.570 1.00 0.00 C ATOM 107 CG1 VAL A 58 -5.811 2.339 -12.329 1.00 0.00 C ATOM 108 CG2 VAL A 58 -4.063 3.968 -13.242 1.00 0.00 C ATOM 0 H VAL A 58 -2.834 1.645 -12.548 1.00 0.00 H new ATOM 0 HA VAL A 58 -4.890 0.755 -14.442 1.00 0.00 H new ATOM 0 HB VAL A 58 -5.680 3.080 -14.347 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -6.356 3.202 -11.947 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -6.518 1.558 -12.608 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.140 1.963 -11.557 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -4.663 4.785 -12.841 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -3.319 3.669 -12.504 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -3.560 4.299 -14.151 1.00 0.00 H new ATOM 118 N LEU A 59 -4.084 2.084 -16.528 1.00 0.00 N ATOM 119 CA LEU A 59 -3.475 2.472 -17.803 1.00 0.00 C ATOM 120 C LEU A 59 -3.378 4.006 -17.897 1.00 0.00 C ATOM 121 O LEU A 59 -4.399 4.703 -17.814 1.00 0.00 O ATOM 122 CB LEU A 59 -4.306 1.923 -18.997 1.00 0.00 C ATOM 123 CG LEU A 59 -3.726 2.246 -20.418 1.00 0.00 C ATOM 124 CD1 LEU A 59 -2.365 1.560 -20.640 1.00 0.00 C ATOM 125 CD2 LEU A 59 -4.721 1.887 -21.543 1.00 0.00 C ATOM 0 H LEU A 59 -5.085 1.897 -16.589 1.00 0.00 H new ATOM 0 HA LEU A 59 -2.473 2.045 -17.850 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -4.390 0.841 -18.894 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -5.316 2.329 -18.933 1.00 0.00 H new ATOM 0 HG LEU A 59 -3.567 3.324 -20.459 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -1.992 1.805 -21.634 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -1.655 1.909 -19.890 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -2.483 0.480 -20.553 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -4.279 2.127 -22.510 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -4.948 0.822 -21.502 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -5.640 2.459 -21.412 1.00 0.00 H new ATOM 137 N PHE A 60 -2.147 4.518 -18.042 1.00 0.00 N ATOM 138 CA PHE A 60 -1.912 5.931 -18.380 1.00 0.00 C ATOM 139 C PHE A 60 -1.894 6.088 -19.915 1.00 0.00 C ATOM 140 O PHE A 60 -2.533 6.993 -20.470 1.00 0.00 O ATOM 141 CB PHE A 60 -0.587 6.440 -17.743 1.00 0.00 C ATOM 142 CG PHE A 60 -0.155 7.824 -18.242 1.00 0.00 C ATOM 143 CD1 PHE A 60 -0.857 8.969 -17.876 1.00 0.00 C ATOM 144 CD2 PHE A 60 0.930 7.970 -19.108 1.00 0.00 C ATOM 145 CE1 PHE A 60 -0.494 10.205 -18.368 1.00 0.00 C ATOM 146 CE2 PHE A 60 1.296 9.206 -19.591 1.00 0.00 C ATOM 147 CZ PHE A 60 0.584 10.323 -19.222 1.00 0.00 C ATOM 0 H PHE A 60 -1.293 3.971 -17.930 1.00 0.00 H new ATOM 0 HA PHE A 60 -2.719 6.540 -17.972 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -0.705 6.474 -16.660 1.00 0.00 H new ATOM 0 HB3 PHE A 60 0.206 5.723 -17.955 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -1.695 8.888 -17.199 1.00 0.00 H new ATOM 0 HD2 PHE A 60 1.493 7.097 -19.405 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -1.055 11.083 -18.084 1.00 0.00 H new ATOM 0 HE2 PHE A 60 2.140 9.298 -20.258 1.00 0.00 H new ATOM 0 HZ PHE A 60 0.869 11.294 -19.601 1.00 0.00 H new ATOM 157 N GLY A 61 -1.146 5.195 -20.583 1.00 0.00 N ATOM 158 CA GLY A 61 -1.008 5.213 -22.040 1.00 0.00 C ATOM 159 C GLY A 61 -0.056 4.143 -22.539 1.00 0.00 C ATOM 160 O GLY A 61 0.325 3.249 -21.786 1.00 0.00 O ATOM 0 H GLY A 61 -0.624 4.446 -20.127 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -1.987 5.068 -22.498 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -0.650 6.192 -22.357 1.00 0.00 H new ATOM 164 N SER A 62 0.334 4.245 -23.815 1.00 0.00 N ATOM 165 CA SER A 62 1.237 3.294 -24.477 1.00 0.00 C ATOM 166 C SER A 62 2.153 4.039 -25.468 1.00 0.00 C ATOM 167 O SER A 62 1.694 4.899 -26.229 1.00 0.00 O ATOM 168 CB SER A 62 0.414 2.185 -25.188 1.00 0.00 C ATOM 169 OG SER A 62 -0.575 2.737 -26.051 1.00 0.00 O ATOM 0 H SER A 62 0.027 5.002 -24.426 1.00 0.00 H new ATOM 0 HA SER A 62 1.870 2.815 -23.730 1.00 0.00 H new ATOM 0 HB2 SER A 62 1.084 1.546 -25.763 1.00 0.00 H new ATOM 0 HB3 SER A 62 -0.066 1.552 -24.441 1.00 0.00 H new ATOM 0 HG SER A 62 -1.073 2.012 -26.483 1.00 0.00 H new ATOM 175 N LEU A 63 3.453 3.709 -25.423 1.00 0.00 N ATOM 176 CA LEU A 63 4.498 4.341 -26.247 1.00 0.00 C ATOM 177 C LEU A 63 4.730 3.560 -27.549 1.00 0.00 C ATOM 178 O LEU A 63 4.321 2.397 -27.674 1.00 0.00 O ATOM 179 CB LEU A 63 5.816 4.408 -25.443 1.00 0.00 C ATOM 180 CG LEU A 63 5.785 5.257 -24.140 1.00 0.00 C ATOM 181 CD1 LEU A 63 7.074 5.059 -23.309 1.00 0.00 C ATOM 182 CD2 LEU A 63 5.550 6.752 -24.463 1.00 0.00 C ATOM 0 H LEU A 63 3.815 2.984 -24.803 1.00 0.00 H new ATOM 0 HA LEU A 63 4.167 5.346 -26.508 1.00 0.00 H new ATOM 0 HB2 LEU A 63 6.110 3.391 -25.182 1.00 0.00 H new ATOM 0 HB3 LEU A 63 6.594 4.808 -26.094 1.00 0.00 H new ATOM 0 HG LEU A 63 4.949 4.909 -23.533 1.00 0.00 H new ATOM 0 HD11 LEU A 63 7.021 5.666 -22.405 1.00 0.00 H new ATOM 0 HD12 LEU A 63 7.173 4.008 -23.036 1.00 0.00 H new ATOM 0 HD13 LEU A 63 7.938 5.363 -23.900 1.00 0.00 H new ATOM 0 HD21 LEU A 63 5.532 7.326 -23.537 1.00 0.00 H new ATOM 0 HD22 LEU A 63 6.355 7.117 -25.101 1.00 0.00 H new ATOM 0 HD23 LEU A 63 4.597 6.867 -24.980 1.00 0.00 H new ATOM 194 N ARG A 64 5.419 4.219 -28.494 1.00 0.00 N ATOM 195 CA ARG A 64 5.799 3.645 -29.786 1.00 0.00 C ATOM 196 C ARG A 64 7.087 4.352 -30.266 1.00 0.00 C ATOM 197 O ARG A 64 7.052 5.441 -30.851 1.00 0.00 O ATOM 198 CB ARG A 64 4.623 3.756 -30.815 1.00 0.00 C ATOM 199 CG ARG A 64 4.120 5.198 -31.088 1.00 0.00 C ATOM 200 CD ARG A 64 2.999 5.273 -32.136 1.00 0.00 C ATOM 201 NE ARG A 64 1.698 4.818 -31.607 1.00 0.00 N ATOM 202 CZ ARG A 64 0.505 5.225 -32.065 1.00 0.00 C ATOM 203 NH1 ARG A 64 0.409 6.057 -33.091 1.00 0.00 N ATOM 204 NH2 ARG A 64 -0.596 4.785 -31.496 1.00 0.00 N ATOM 0 H ARG A 64 5.731 5.183 -28.375 1.00 0.00 H new ATOM 0 HA ARG A 64 6.004 2.579 -29.688 1.00 0.00 H new ATOM 0 HB2 ARG A 64 4.944 3.315 -31.759 1.00 0.00 H new ATOM 0 HB3 ARG A 64 3.786 3.159 -30.453 1.00 0.00 H new ATOM 0 HG2 ARG A 64 3.762 5.631 -30.154 1.00 0.00 H new ATOM 0 HG3 ARG A 64 4.959 5.809 -31.422 1.00 0.00 H new ATOM 0 HD2 ARG A 64 2.905 6.300 -32.489 1.00 0.00 H new ATOM 0 HD3 ARG A 64 3.270 4.663 -32.998 1.00 0.00 H new ATOM 0 HE ARG A 64 1.707 4.147 -30.839 1.00 0.00 H new ATOM 0 HH11 ARG A 64 1.253 6.401 -33.549 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -0.509 6.354 -33.423 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -0.540 4.137 -30.710 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -1.506 5.092 -31.841 1.00 0.00 H new ATOM 218 N GLY A 65 8.240 3.746 -29.952 1.00 0.00 N ATOM 219 CA GLY A 65 9.547 4.335 -30.255 1.00 0.00 C ATOM 220 C GLY A 65 10.480 3.357 -30.924 1.00 0.00 C ATOM 221 O GLY A 65 10.063 2.258 -31.295 1.00 0.00 O ATOM 0 H GLY A 65 8.291 2.841 -29.485 1.00 0.00 H new ATOM 0 HA2 GLY A 65 9.410 5.202 -30.901 1.00 0.00 H new ATOM 0 HA3 GLY A 65 10.003 4.694 -29.332 1.00 0.00 H new ATOM 225 N HIS A 66 11.751 3.764 -31.086 1.00 0.00 N ATOM 226 CA HIS A 66 12.763 2.969 -31.816 1.00 0.00 C ATOM 227 C HIS A 66 14.019 2.763 -30.950 1.00 0.00 C ATOM 228 O HIS A 66 14.600 3.732 -30.443 1.00 0.00 O ATOM 229 CB HIS A 66 13.130 3.657 -33.160 1.00 0.00 C ATOM 230 CG HIS A 66 11.996 3.699 -34.157 1.00 0.00 C ATOM 231 ND1 HIS A 66 11.839 2.761 -35.153 1.00 0.00 N ATOM 232 CD2 HIS A 66 10.956 4.562 -34.295 1.00 0.00 C ATOM 233 CE1 HIS A 66 10.764 3.046 -35.857 1.00 0.00 C ATOM 234 NE2 HIS A 66 10.208 4.129 -35.357 1.00 0.00 N ATOM 0 H HIS A 66 12.107 4.646 -30.719 1.00 0.00 H new ATOM 0 HA HIS A 66 12.337 1.990 -32.037 1.00 0.00 H new ATOM 0 HB2 HIS A 66 13.460 4.676 -32.957 1.00 0.00 H new ATOM 0 HB3 HIS A 66 13.974 3.132 -33.607 1.00 0.00 H new ATOM 0 HD2 HIS A 66 10.756 5.428 -33.681 1.00 0.00 H new ATOM 0 HE1 HIS A 66 10.399 2.484 -36.704 1.00 0.00 H new ATOM 0 HE2 HIS A 66 9.358 4.574 -35.704 1.00 0.00 H new ATOM 243 N VAL A 67 14.427 1.487 -30.797 1.00 0.00 N ATOM 244 CA VAL A 67 15.614 1.100 -30.007 1.00 0.00 C ATOM 245 C VAL A 67 16.833 0.992 -30.941 1.00 0.00 C ATOM 246 O VAL A 67 16.844 0.161 -31.854 1.00 0.00 O ATOM 247 CB VAL A 67 15.407 -0.276 -29.261 1.00 0.00 C ATOM 248 CG1 VAL A 67 16.570 -0.560 -28.271 1.00 0.00 C ATOM 249 CG2 VAL A 67 14.033 -0.321 -28.554 1.00 0.00 C ATOM 0 H VAL A 67 13.942 0.695 -31.218 1.00 0.00 H new ATOM 0 HA VAL A 67 15.775 1.868 -29.251 1.00 0.00 H new ATOM 0 HB VAL A 67 15.418 -1.069 -30.009 1.00 0.00 H new ATOM 0 HG11 VAL A 67 16.399 -1.514 -27.773 1.00 0.00 H new ATOM 0 HG12 VAL A 67 17.512 -0.600 -28.818 1.00 0.00 H new ATOM 0 HG13 VAL A 67 16.616 0.235 -27.527 1.00 0.00 H new ATOM 0 HG21 VAL A 67 13.915 -1.279 -28.048 1.00 0.00 H new ATOM 0 HG22 VAL A 67 13.973 0.485 -27.823 1.00 0.00 H new ATOM 0 HG23 VAL A 67 13.240 -0.201 -29.292 1.00 0.00 H new ATOM 259 N VAL A 68 17.840 1.849 -30.721 1.00 0.00 N ATOM 260 CA VAL A 68 19.094 1.849 -31.509 1.00 0.00 C ATOM 261 C VAL A 68 20.153 0.929 -30.868 1.00 0.00 C ATOM 262 O VAL A 68 21.104 0.497 -31.532 1.00 0.00 O ATOM 263 CB VAL A 68 19.678 3.303 -31.630 1.00 0.00 C ATOM 264 CG1 VAL A 68 18.668 4.262 -32.309 1.00 0.00 C ATOM 265 CG2 VAL A 68 20.122 3.840 -30.247 1.00 0.00 C ATOM 0 H VAL A 68 17.814 2.564 -29.994 1.00 0.00 H new ATOM 0 HA VAL A 68 18.852 1.474 -32.503 1.00 0.00 H new ATOM 0 HB VAL A 68 20.561 3.254 -32.267 1.00 0.00 H new ATOM 0 HG11 VAL A 68 19.103 5.259 -32.377 1.00 0.00 H new ATOM 0 HG12 VAL A 68 18.437 3.898 -33.310 1.00 0.00 H new ATOM 0 HG13 VAL A 68 17.753 4.305 -31.718 1.00 0.00 H new ATOM 0 HG21 VAL A 68 20.522 4.848 -30.359 1.00 0.00 H new ATOM 0 HG22 VAL A 68 19.265 3.863 -29.573 1.00 0.00 H new ATOM 0 HG23 VAL A 68 20.891 3.188 -29.833 1.00 0.00 H new ATOM 275 N GLY A 69 19.952 0.647 -29.566 1.00 0.00 N ATOM 276 CA GLY A 69 20.912 -0.070 -28.742 1.00 0.00 C ATOM 277 C GLY A 69 21.102 -1.536 -29.128 1.00 0.00 C ATOM 278 O GLY A 69 22.064 -2.144 -28.684 1.00 0.00 O ATOM 0 H GLY A 69 19.107 0.918 -29.063 1.00 0.00 H new ATOM 0 HA2 GLY A 69 21.875 0.437 -28.802 1.00 0.00 H new ATOM 0 HA3 GLY A 69 20.590 -0.019 -27.702 1.00 0.00 H new ATOM 282 N LEU A 70 20.152 -2.085 -29.919 1.00 0.00 N ATOM 283 CA LEU A 70 20.067 -3.530 -30.299 1.00 0.00 C ATOM 284 C LEU A 70 21.432 -4.143 -30.685 1.00 0.00 C ATOM 285 O LEU A 70 21.785 -5.240 -30.238 1.00 0.00 O ATOM 286 CB LEU A 70 19.088 -3.687 -31.483 1.00 0.00 C ATOM 287 CG LEU A 70 17.671 -3.097 -31.276 1.00 0.00 C ATOM 288 CD1 LEU A 70 16.863 -3.169 -32.570 1.00 0.00 C ATOM 289 CD2 LEU A 70 16.924 -3.792 -30.117 1.00 0.00 C ATOM 0 H LEU A 70 19.400 -1.528 -30.325 1.00 0.00 H new ATOM 0 HA LEU A 70 19.714 -4.069 -29.420 1.00 0.00 H new ATOM 0 HB2 LEU A 70 19.531 -3.216 -32.360 1.00 0.00 H new ATOM 0 HB3 LEU A 70 18.988 -4.749 -31.708 1.00 0.00 H new ATOM 0 HG LEU A 70 17.788 -2.049 -31.001 1.00 0.00 H new ATOM 0 HD11 LEU A 70 15.871 -2.750 -32.403 1.00 0.00 H new ATOM 0 HD12 LEU A 70 17.371 -2.600 -33.348 1.00 0.00 H new ATOM 0 HD13 LEU A 70 16.769 -4.209 -32.883 1.00 0.00 H new ATOM 0 HD21 LEU A 70 15.934 -3.349 -30.005 1.00 0.00 H new ATOM 0 HD22 LEU A 70 16.823 -4.855 -30.335 1.00 0.00 H new ATOM 0 HD23 LEU A 70 17.486 -3.663 -29.192 1.00 0.00 H new ATOM 301 N ARG A 71 22.220 -3.375 -31.451 1.00 0.00 N ATOM 302 CA ARG A 71 23.552 -3.781 -31.954 1.00 0.00 C ATOM 303 C ARG A 71 24.616 -3.977 -30.827 1.00 0.00 C ATOM 304 O ARG A 71 25.796 -4.176 -31.128 1.00 0.00 O ATOM 305 CB ARG A 71 24.045 -2.742 -33.006 1.00 0.00 C ATOM 306 CG ARG A 71 24.186 -1.298 -32.470 1.00 0.00 C ATOM 307 CD ARG A 71 24.807 -0.338 -33.506 1.00 0.00 C ATOM 308 NE ARG A 71 24.919 1.048 -32.998 1.00 0.00 N ATOM 309 CZ ARG A 71 26.016 1.596 -32.439 1.00 0.00 C ATOM 310 NH1 ARG A 71 27.121 0.880 -32.252 1.00 0.00 N ATOM 311 NH2 ARG A 71 25.989 2.866 -32.059 1.00 0.00 N ATOM 0 H ARG A 71 21.950 -2.437 -31.747 1.00 0.00 H new ATOM 0 HA ARG A 71 23.435 -4.760 -32.418 1.00 0.00 H new ATOM 0 HB2 ARG A 71 25.011 -3.067 -33.393 1.00 0.00 H new ATOM 0 HB3 ARG A 71 23.350 -2.737 -33.846 1.00 0.00 H new ATOM 0 HG2 ARG A 71 23.204 -0.925 -32.178 1.00 0.00 H new ATOM 0 HG3 ARG A 71 24.804 -1.307 -31.572 1.00 0.00 H new ATOM 0 HD2 ARG A 71 25.796 -0.700 -33.785 1.00 0.00 H new ATOM 0 HD3 ARG A 71 24.199 -0.342 -34.411 1.00 0.00 H new ATOM 0 HE ARG A 71 24.093 1.641 -33.078 1.00 0.00 H new ATOM 0 HH11 ARG A 71 27.147 -0.100 -32.533 1.00 0.00 H new ATOM 0 HH12 ARG A 71 27.942 1.311 -31.827 1.00 0.00 H new ATOM 0 HH21 ARG A 71 25.143 3.420 -32.191 1.00 0.00 H new ATOM 0 HH22 ARG A 71 26.815 3.289 -31.635 1.00 0.00 H new ATOM 325 N TYR A 72 24.181 -3.909 -29.549 1.00 0.00 N ATOM 326 CA TYR A 72 25.004 -4.181 -28.357 1.00 0.00 C ATOM 327 C TYR A 72 25.705 -5.551 -28.462 1.00 0.00 C ATOM 328 O TYR A 72 26.931 -5.616 -28.595 1.00 0.00 O ATOM 329 CB TYR A 72 24.099 -4.123 -27.094 1.00 0.00 C ATOM 330 CG TYR A 72 24.849 -4.254 -25.764 1.00 0.00 C ATOM 331 CD1 TYR A 72 25.656 -3.215 -25.298 1.00 0.00 C ATOM 332 CD2 TYR A 72 24.759 -5.409 -24.976 1.00 0.00 C ATOM 333 CE1 TYR A 72 26.340 -3.319 -24.105 1.00 0.00 C ATOM 334 CE2 TYR A 72 25.443 -5.512 -23.778 1.00 0.00 C ATOM 335 CZ TYR A 72 26.234 -4.466 -23.349 1.00 0.00 C ATOM 336 OH TYR A 72 26.921 -4.566 -22.157 1.00 0.00 O ATOM 0 H TYR A 72 23.221 -3.656 -29.316 1.00 0.00 H new ATOM 0 HA TYR A 72 25.784 -3.423 -28.284 1.00 0.00 H new ATOM 0 HB2 TYR A 72 23.554 -3.179 -27.097 1.00 0.00 H new ATOM 0 HB3 TYR A 72 23.358 -4.919 -27.158 1.00 0.00 H new ATOM 0 HD1 TYR A 72 25.747 -2.312 -25.883 1.00 0.00 H new ATOM 0 HD2 TYR A 72 24.145 -6.233 -25.309 1.00 0.00 H new ATOM 0 HE1 TYR A 72 26.958 -2.502 -23.764 1.00 0.00 H new ATOM 0 HE2 TYR A 72 25.358 -6.408 -23.181 1.00 0.00 H new ATOM 0 HH TYR A 72 26.738 -5.437 -21.746 1.00 0.00 H new ATOM 346 N TYR A 73 24.918 -6.640 -28.420 1.00 0.00 N ATOM 347 CA TYR A 73 25.458 -8.005 -28.542 1.00 0.00 C ATOM 348 C TYR A 73 24.966 -8.643 -29.850 1.00 0.00 C ATOM 349 O TYR A 73 25.753 -8.888 -30.765 1.00 0.00 O ATOM 350 CB TYR A 73 25.067 -8.875 -27.310 1.00 0.00 C ATOM 351 CG TYR A 73 25.707 -10.278 -27.317 1.00 0.00 C ATOM 352 CD1 TYR A 73 27.049 -10.449 -26.970 1.00 0.00 C ATOM 353 CD2 TYR A 73 24.985 -11.423 -27.688 1.00 0.00 C ATOM 354 CE1 TYR A 73 27.644 -11.696 -26.991 1.00 0.00 C ATOM 355 CE2 TYR A 73 25.583 -12.672 -27.713 1.00 0.00 C ATOM 356 CZ TYR A 73 26.910 -12.802 -27.362 1.00 0.00 C ATOM 357 OH TYR A 73 27.512 -14.045 -27.389 1.00 0.00 O ATOM 0 H TYR A 73 23.906 -6.601 -28.302 1.00 0.00 H new ATOM 0 HA TYR A 73 26.546 -7.950 -28.568 1.00 0.00 H new ATOM 0 HB2 TYR A 73 25.363 -8.354 -26.399 1.00 0.00 H new ATOM 0 HB3 TYR A 73 23.982 -8.980 -27.279 1.00 0.00 H new ATOM 0 HD1 TYR A 73 27.634 -9.589 -26.679 1.00 0.00 H new ATOM 0 HD2 TYR A 73 23.944 -11.328 -27.959 1.00 0.00 H new ATOM 0 HE1 TYR A 73 28.683 -11.804 -26.717 1.00 0.00 H new ATOM 0 HE2 TYR A 73 25.012 -13.541 -28.006 1.00 0.00 H new ATOM 0 HH TYR A 73 26.858 -14.719 -27.670 1.00 0.00 H new ATOM 367 N THR A 74 23.646 -8.890 -29.933 1.00 0.00 N ATOM 368 CA THR A 74 23.028 -9.548 -31.098 1.00 0.00 C ATOM 369 C THR A 74 21.899 -8.688 -31.704 1.00 0.00 C ATOM 370 O THR A 74 21.830 -8.514 -32.923 1.00 0.00 O ATOM 371 CB THR A 74 22.503 -10.977 -30.720 1.00 0.00 C ATOM 372 OG1 THR A 74 21.860 -11.582 -31.849 1.00 0.00 O ATOM 373 CG2 THR A 74 21.538 -10.974 -29.510 1.00 0.00 C ATOM 0 H THR A 74 22.982 -8.641 -29.200 1.00 0.00 H new ATOM 0 HA THR A 74 23.800 -9.659 -31.860 1.00 0.00 H new ATOM 0 HB THR A 74 23.377 -11.559 -30.427 1.00 0.00 H new ATOM 0 HG1 THR A 74 21.964 -12.555 -31.802 1.00 0.00 H new ATOM 0 HG21 THR A 74 21.212 -11.993 -29.302 1.00 0.00 H new ATOM 0 HG22 THR A 74 22.051 -10.571 -28.637 1.00 0.00 H new ATOM 0 HG23 THR A 74 20.670 -10.355 -29.738 1.00 0.00 H new ATOM 381 N GLY A 75 21.028 -8.142 -30.841 1.00 0.00 N ATOM 382 CA GLY A 75 19.864 -7.366 -31.280 1.00 0.00 C ATOM 383 C GLY A 75 18.611 -8.200 -31.491 1.00 0.00 C ATOM 384 O GLY A 75 17.507 -7.649 -31.499 1.00 0.00 O ATOM 0 H GLY A 75 21.112 -8.226 -29.828 1.00 0.00 H new ATOM 0 HA2 GLY A 75 19.654 -6.594 -30.540 1.00 0.00 H new ATOM 0 HA3 GLY A 75 20.110 -6.856 -32.211 1.00 0.00 H new ATOM 388 N VAL A 76 18.782 -9.529 -31.648 1.00 0.00 N ATOM 389 CA VAL A 76 17.669 -10.451 -31.911 1.00 0.00 C ATOM 390 C VAL A 76 16.944 -10.807 -30.600 1.00 0.00 C ATOM 391 O VAL A 76 17.568 -10.886 -29.529 1.00 0.00 O ATOM 392 CB VAL A 76 18.135 -11.762 -32.665 1.00 0.00 C ATOM 393 CG1 VAL A 76 18.990 -11.408 -33.909 1.00 0.00 C ATOM 394 CG2 VAL A 76 18.888 -12.755 -31.738 1.00 0.00 C ATOM 0 H VAL A 76 19.692 -9.987 -31.596 1.00 0.00 H new ATOM 0 HA VAL A 76 16.974 -9.935 -32.573 1.00 0.00 H new ATOM 0 HB VAL A 76 17.230 -12.271 -32.996 1.00 0.00 H new ATOM 0 HG11 VAL A 76 19.299 -12.325 -34.411 1.00 0.00 H new ATOM 0 HG12 VAL A 76 18.400 -10.800 -34.595 1.00 0.00 H new ATOM 0 HG13 VAL A 76 19.873 -10.850 -33.597 1.00 0.00 H new ATOM 0 HG21 VAL A 76 19.183 -13.635 -32.310 1.00 0.00 H new ATOM 0 HG22 VAL A 76 19.777 -12.271 -31.332 1.00 0.00 H new ATOM 0 HG23 VAL A 76 18.234 -13.057 -30.920 1.00 0.00 H new ATOM 404 N VAL A 77 15.622 -10.983 -30.701 1.00 0.00 N ATOM 405 CA VAL A 77 14.748 -11.341 -29.569 1.00 0.00 C ATOM 406 C VAL A 77 13.762 -12.445 -30.002 1.00 0.00 C ATOM 407 O VAL A 77 13.883 -12.980 -31.108 1.00 0.00 O ATOM 408 CB VAL A 77 13.967 -10.082 -29.029 1.00 0.00 C ATOM 409 CG1 VAL A 77 14.910 -9.001 -28.446 1.00 0.00 C ATOM 410 CG2 VAL A 77 13.036 -9.485 -30.109 1.00 0.00 C ATOM 0 H VAL A 77 15.118 -10.880 -31.582 1.00 0.00 H new ATOM 0 HA VAL A 77 15.371 -11.715 -28.757 1.00 0.00 H new ATOM 0 HB VAL A 77 13.346 -10.436 -28.206 1.00 0.00 H new ATOM 0 HG11 VAL A 77 14.319 -8.157 -28.089 1.00 0.00 H new ATOM 0 HG12 VAL A 77 15.478 -9.423 -27.617 1.00 0.00 H new ATOM 0 HG13 VAL A 77 15.597 -8.661 -29.221 1.00 0.00 H new ATOM 0 HG21 VAL A 77 12.514 -8.619 -29.701 1.00 0.00 H new ATOM 0 HG22 VAL A 77 13.628 -9.179 -30.971 1.00 0.00 H new ATOM 0 HG23 VAL A 77 12.308 -10.235 -30.417 1.00 0.00 H new ATOM 420 N ASN A 78 12.807 -12.802 -29.116 1.00 0.00 N ATOM 421 CA ASN A 78 11.740 -13.782 -29.431 1.00 0.00 C ATOM 422 C ASN A 78 10.728 -13.183 -30.434 1.00 0.00 C ATOM 423 O ASN A 78 10.515 -11.958 -30.451 1.00 0.00 O ATOM 424 CB ASN A 78 11.004 -14.215 -28.130 1.00 0.00 C ATOM 425 CG ASN A 78 9.906 -15.278 -28.335 1.00 0.00 C ATOM 426 OD1 ASN A 78 10.033 -16.173 -29.170 1.00 0.00 O ATOM 427 ND2 ASN A 78 8.815 -15.176 -27.581 1.00 0.00 N ATOM 0 H ASN A 78 12.752 -12.424 -28.170 1.00 0.00 H new ATOM 0 HA ASN A 78 12.204 -14.658 -29.885 1.00 0.00 H new ATOM 0 HB2 ASN A 78 11.739 -14.603 -27.425 1.00 0.00 H new ATOM 0 HB3 ASN A 78 10.556 -13.333 -27.671 1.00 0.00 H new ATOM 0 HD21 ASN A 78 8.057 -15.850 -27.687 1.00 0.00 H new ATOM 0 HD22 ASN A 78 8.737 -14.424 -26.897 1.00 0.00 H new ATOM 434 N ASN A 79 10.118 -14.076 -31.252 1.00 0.00 N ATOM 435 CA ASN A 79 9.037 -13.753 -32.224 1.00 0.00 C ATOM 436 C ASN A 79 7.989 -12.793 -31.613 1.00 0.00 C ATOM 437 O ASN A 79 7.660 -11.757 -32.199 1.00 0.00 O ATOM 438 CB ASN A 79 8.361 -15.079 -32.692 1.00 0.00 C ATOM 439 CG ASN A 79 7.138 -14.889 -33.605 1.00 0.00 C ATOM 440 OD1 ASN A 79 6.005 -14.776 -33.137 1.00 0.00 O ATOM 441 ND2 ASN A 79 7.352 -14.876 -34.912 1.00 0.00 N ATOM 0 H ASN A 79 10.368 -15.065 -31.256 1.00 0.00 H new ATOM 0 HA ASN A 79 9.478 -13.242 -33.080 1.00 0.00 H new ATOM 0 HB2 ASN A 79 9.101 -15.682 -33.219 1.00 0.00 H new ATOM 0 HB3 ASN A 79 8.056 -15.646 -31.812 1.00 0.00 H new ATOM 0 HD21 ASN A 79 6.568 -14.771 -35.556 1.00 0.00 H new ATOM 0 HD22 ASN A 79 8.301 -14.971 -35.274 1.00 0.00 H new ATOM 448 N ASN A 80 7.487 -13.155 -30.421 1.00 0.00 N ATOM 449 CA ASN A 80 6.608 -12.294 -29.614 1.00 0.00 C ATOM 450 C ASN A 80 7.280 -12.072 -28.257 1.00 0.00 C ATOM 451 O ASN A 80 6.895 -12.658 -27.237 1.00 0.00 O ATOM 452 CB ASN A 80 5.185 -12.915 -29.467 1.00 0.00 C ATOM 453 CG ASN A 80 4.452 -13.135 -30.801 1.00 0.00 C ATOM 454 OD1 ASN A 80 4.654 -12.249 -31.768 1.00 0.00 O flip ATOM 455 ND2 ASN A 80 3.694 -14.093 -30.954 1.00 0.00 N flip ATOM 0 H ASN A 80 7.681 -14.058 -29.988 1.00 0.00 H new ATOM 0 HA ASN A 80 6.466 -11.334 -30.110 1.00 0.00 H new ATOM 0 HB2 ASN A 80 5.270 -13.871 -28.950 1.00 0.00 H new ATOM 0 HB3 ASN A 80 4.580 -12.264 -28.836 1.00 0.00 H new ATOM 0 HD21 ASN A 80 3.556 -14.760 -30.195 1.00 0.00 H new ATOM 0 HD22 ASN A 80 3.204 -14.219 -31.840 1.00 0.00 H new ATOM 462 N GLU A 81 8.360 -11.284 -28.304 1.00 0.00 N ATOM 463 CA GLU A 81 9.126 -10.872 -27.126 1.00 0.00 C ATOM 464 C GLU A 81 8.350 -9.848 -26.277 1.00 0.00 C ATOM 465 O GLU A 81 7.480 -9.139 -26.785 1.00 0.00 O ATOM 466 CB GLU A 81 10.466 -10.249 -27.596 1.00 0.00 C ATOM 467 CG GLU A 81 11.447 -9.854 -26.477 1.00 0.00 C ATOM 468 CD GLU A 81 11.908 -11.051 -25.640 1.00 0.00 C ATOM 469 OE1 GLU A 81 12.753 -11.833 -26.119 1.00 0.00 O ATOM 470 OE2 GLU A 81 11.436 -11.207 -24.499 1.00 0.00 O ATOM 0 H GLU A 81 8.731 -10.909 -29.177 1.00 0.00 H new ATOM 0 HA GLU A 81 9.308 -11.749 -26.505 1.00 0.00 H new ATOM 0 HB2 GLU A 81 10.964 -10.959 -28.257 1.00 0.00 H new ATOM 0 HB3 GLU A 81 10.245 -9.362 -28.190 1.00 0.00 H new ATOM 0 HG2 GLU A 81 12.317 -9.369 -26.918 1.00 0.00 H new ATOM 0 HG3 GLU A 81 10.971 -9.122 -25.824 1.00 0.00 H new ATOM 477 N MET A 82 8.675 -9.802 -24.975 1.00 0.00 N ATOM 478 CA MET A 82 8.307 -8.708 -24.071 1.00 0.00 C ATOM 479 C MET A 82 9.571 -8.256 -23.349 1.00 0.00 C ATOM 480 O MET A 82 10.206 -9.046 -22.651 1.00 0.00 O ATOM 481 CB MET A 82 7.221 -9.129 -23.048 1.00 0.00 C ATOM 482 CG MET A 82 5.871 -9.467 -23.682 1.00 0.00 C ATOM 483 SD MET A 82 4.574 -9.793 -22.461 1.00 0.00 S ATOM 484 CE MET A 82 4.380 -8.173 -21.712 1.00 0.00 C ATOM 0 H MET A 82 9.211 -10.539 -24.516 1.00 0.00 H new ATOM 0 HA MET A 82 7.878 -7.894 -24.655 1.00 0.00 H new ATOM 0 HB2 MET A 82 7.577 -9.996 -22.491 1.00 0.00 H new ATOM 0 HB3 MET A 82 7.082 -8.323 -22.328 1.00 0.00 H new ATOM 0 HG2 MET A 82 5.560 -8.641 -24.322 1.00 0.00 H new ATOM 0 HG3 MET A 82 5.986 -10.341 -24.323 1.00 0.00 H new ATOM 0 HE1 MET A 82 4.732 -8.204 -20.681 1.00 0.00 H new ATOM 0 HE2 MET A 82 4.962 -7.441 -22.272 1.00 0.00 H new ATOM 0 HE3 MET A 82 3.328 -7.889 -21.728 1.00 0.00 H new ATOM 494 N VAL A 83 9.941 -6.994 -23.552 1.00 0.00 N ATOM 495 CA VAL A 83 11.126 -6.383 -22.930 1.00 0.00 C ATOM 496 C VAL A 83 10.696 -5.474 -21.768 1.00 0.00 C ATOM 497 O VAL A 83 9.514 -5.186 -21.608 1.00 0.00 O ATOM 498 CB VAL A 83 11.983 -5.570 -23.976 1.00 0.00 C ATOM 499 CG1 VAL A 83 12.492 -6.479 -25.125 1.00 0.00 C ATOM 500 CG2 VAL A 83 11.210 -4.348 -24.534 1.00 0.00 C ATOM 0 H VAL A 83 9.425 -6.356 -24.158 1.00 0.00 H new ATOM 0 HA VAL A 83 11.756 -7.186 -22.547 1.00 0.00 H new ATOM 0 HB VAL A 83 12.853 -5.188 -23.442 1.00 0.00 H new ATOM 0 HG11 VAL A 83 13.078 -5.885 -25.826 1.00 0.00 H new ATOM 0 HG12 VAL A 83 13.115 -7.273 -24.712 1.00 0.00 H new ATOM 0 HG13 VAL A 83 11.641 -6.919 -25.645 1.00 0.00 H new ATOM 0 HG21 VAL A 83 11.837 -3.817 -25.250 1.00 0.00 H new ATOM 0 HG22 VAL A 83 10.301 -4.688 -25.030 1.00 0.00 H new ATOM 0 HG23 VAL A 83 10.948 -3.678 -23.715 1.00 0.00 H new ATOM 510 N ALA A 84 11.667 -4.992 -20.996 1.00 0.00 N ATOM 511 CA ALA A 84 11.428 -4.214 -19.778 1.00 0.00 C ATOM 512 C ALA A 84 12.558 -3.205 -19.608 1.00 0.00 C ATOM 513 O ALA A 84 13.740 -3.554 -19.740 1.00 0.00 O ATOM 514 CB ALA A 84 11.312 -5.138 -18.548 1.00 0.00 C ATOM 0 H ALA A 84 12.657 -5.132 -21.200 1.00 0.00 H new ATOM 0 HA ALA A 84 10.482 -3.680 -19.866 1.00 0.00 H new ATOM 0 HB1 ALA A 84 11.135 -4.536 -17.656 1.00 0.00 H new ATOM 0 HB2 ALA A 84 10.482 -5.830 -18.690 1.00 0.00 H new ATOM 0 HB3 ALA A 84 12.237 -5.701 -18.428 1.00 0.00 H new ATOM 520 N LEU A 85 12.187 -1.946 -19.345 1.00 0.00 N ATOM 521 CA LEU A 85 13.139 -0.851 -19.186 1.00 0.00 C ATOM 522 C LEU A 85 13.706 -0.865 -17.754 1.00 0.00 C ATOM 523 O LEU A 85 12.952 -0.879 -16.776 1.00 0.00 O ATOM 524 CB LEU A 85 12.472 0.518 -19.523 1.00 0.00 C ATOM 525 CG LEU A 85 12.207 0.816 -21.047 1.00 0.00 C ATOM 526 CD1 LEU A 85 11.108 -0.094 -21.652 1.00 0.00 C ATOM 527 CD2 LEU A 85 11.885 2.316 -21.267 1.00 0.00 C ATOM 0 H LEU A 85 11.213 -1.662 -19.237 1.00 0.00 H new ATOM 0 HA LEU A 85 13.963 -0.988 -19.886 1.00 0.00 H new ATOM 0 HB2 LEU A 85 11.520 0.573 -18.994 1.00 0.00 H new ATOM 0 HB3 LEU A 85 13.104 1.312 -19.125 1.00 0.00 H new ATOM 0 HG LEU A 85 13.127 0.581 -21.582 1.00 0.00 H new ATOM 0 HD11 LEU A 85 10.967 0.155 -22.704 1.00 0.00 H new ATOM 0 HD12 LEU A 85 11.410 -1.137 -21.564 1.00 0.00 H new ATOM 0 HD13 LEU A 85 10.172 0.059 -21.115 1.00 0.00 H new ATOM 0 HD21 LEU A 85 11.706 2.498 -22.327 1.00 0.00 H new ATOM 0 HD22 LEU A 85 10.996 2.585 -20.697 1.00 0.00 H new ATOM 0 HD23 LEU A 85 12.727 2.922 -20.932 1.00 0.00 H new ATOM 539 N GLN A 86 15.039 -0.910 -17.667 1.00 0.00 N ATOM 540 CA GLN A 86 15.803 -0.823 -16.413 1.00 0.00 C ATOM 541 C GLN A 86 16.656 0.453 -16.458 1.00 0.00 C ATOM 542 O GLN A 86 17.059 0.872 -17.540 1.00 0.00 O ATOM 543 CB GLN A 86 16.716 -2.083 -16.273 1.00 0.00 C ATOM 544 CG GLN A 86 17.599 -2.115 -15.009 1.00 0.00 C ATOM 545 CD GLN A 86 18.556 -3.305 -14.953 1.00 0.00 C ATOM 546 OE1 GLN A 86 18.218 -4.372 -14.434 1.00 0.00 O ATOM 547 NE2 GLN A 86 19.761 -3.136 -15.481 1.00 0.00 N ATOM 0 H GLN A 86 15.635 -1.011 -18.488 1.00 0.00 H new ATOM 0 HA GLN A 86 15.131 -0.785 -15.555 1.00 0.00 H new ATOM 0 HB2 GLN A 86 16.085 -2.972 -16.279 1.00 0.00 H new ATOM 0 HB3 GLN A 86 17.361 -2.144 -17.149 1.00 0.00 H new ATOM 0 HG2 GLN A 86 18.178 -1.193 -14.959 1.00 0.00 H new ATOM 0 HG3 GLN A 86 16.956 -2.136 -14.129 1.00 0.00 H new ATOM 0 HE21 GLN A 86 20.012 -2.242 -15.903 1.00 0.00 H new ATOM 0 HE22 GLN A 86 20.437 -3.900 -15.465 1.00 0.00 H new ATOM 556 N ARG A 87 16.923 1.072 -15.292 1.00 0.00 N ATOM 557 CA ARG A 87 17.877 2.208 -15.198 1.00 0.00 C ATOM 558 C ARG A 87 19.323 1.732 -15.495 1.00 0.00 C ATOM 559 O ARG A 87 19.566 0.528 -15.688 1.00 0.00 O ATOM 560 CB ARG A 87 17.804 2.896 -13.793 1.00 0.00 C ATOM 561 CG ARG A 87 18.573 2.200 -12.631 1.00 0.00 C ATOM 562 CD ARG A 87 18.042 0.803 -12.279 1.00 0.00 C ATOM 563 NE ARG A 87 18.895 0.115 -11.289 1.00 0.00 N ATOM 564 CZ ARG A 87 18.861 -1.205 -11.028 1.00 0.00 C ATOM 565 NH1 ARG A 87 17.987 -1.993 -11.635 1.00 0.00 N ATOM 566 NH2 ARG A 87 19.704 -1.731 -10.149 1.00 0.00 N ATOM 0 H ARG A 87 16.497 0.811 -14.403 1.00 0.00 H new ATOM 0 HA ARG A 87 17.592 2.946 -15.948 1.00 0.00 H new ATOM 0 HB2 ARG A 87 18.185 3.912 -13.892 1.00 0.00 H new ATOM 0 HB3 ARG A 87 16.755 2.975 -13.507 1.00 0.00 H new ATOM 0 HG2 ARG A 87 19.626 2.120 -12.903 1.00 0.00 H new ATOM 0 HG3 ARG A 87 18.520 2.832 -11.744 1.00 0.00 H new ATOM 0 HD2 ARG A 87 17.029 0.890 -11.886 1.00 0.00 H new ATOM 0 HD3 ARG A 87 17.981 0.200 -13.185 1.00 0.00 H new ATOM 0 HE ARG A 87 19.560 0.683 -10.764 1.00 0.00 H new ATOM 0 HH11 ARG A 87 17.329 -1.601 -12.309 1.00 0.00 H new ATOM 0 HH12 ARG A 87 17.971 -2.992 -11.428 1.00 0.00 H new ATOM 0 HH21 ARG A 87 20.379 -1.135 -9.670 1.00 0.00 H new ATOM 0 HH22 ARG A 87 19.677 -2.731 -9.952 1.00 0.00 H new ATOM 580 N ASP A 88 20.275 2.676 -15.521 1.00 0.00 N ATOM 581 CA ASP A 88 21.695 2.354 -15.660 1.00 0.00 C ATOM 582 C ASP A 88 22.210 1.592 -14.407 1.00 0.00 C ATOM 583 O ASP A 88 22.076 2.085 -13.278 1.00 0.00 O ATOM 584 CB ASP A 88 22.528 3.629 -15.879 1.00 0.00 C ATOM 585 CG ASP A 88 24.021 3.310 -15.986 1.00 0.00 C ATOM 586 OD1 ASP A 88 24.504 3.015 -17.099 1.00 0.00 O ATOM 587 OD2 ASP A 88 24.699 3.271 -14.936 1.00 0.00 O ATOM 0 H ASP A 88 20.081 3.675 -15.447 1.00 0.00 H new ATOM 0 HA ASP A 88 21.808 1.711 -16.533 1.00 0.00 H new ATOM 0 HB2 ASP A 88 22.196 4.131 -16.788 1.00 0.00 H new ATOM 0 HB3 ASP A 88 22.361 4.321 -15.054 1.00 0.00 H new ATOM 592 N PRO A 89 22.786 0.371 -14.600 1.00 0.00 N ATOM 593 CA PRO A 89 23.420 -0.414 -13.524 1.00 0.00 C ATOM 594 C PRO A 89 24.977 -0.336 -13.486 1.00 0.00 C ATOM 595 O PRO A 89 25.585 -0.944 -12.602 1.00 0.00 O ATOM 596 CB PRO A 89 22.958 -1.823 -13.920 1.00 0.00 C ATOM 597 CG PRO A 89 23.094 -1.822 -15.421 1.00 0.00 C ATOM 598 CD PRO A 89 22.784 -0.400 -15.873 1.00 0.00 C ATOM 0 HA PRO A 89 23.143 -0.067 -12.528 1.00 0.00 H new ATOM 0 HB2 PRO A 89 23.577 -2.594 -13.460 1.00 0.00 H new ATOM 0 HB3 PRO A 89 21.931 -2.012 -13.609 1.00 0.00 H new ATOM 0 HG2 PRO A 89 24.100 -2.116 -15.721 1.00 0.00 H new ATOM 0 HG3 PRO A 89 22.405 -2.534 -15.875 1.00 0.00 H new ATOM 0 HD2 PRO A 89 23.534 -0.027 -16.571 1.00 0.00 H new ATOM 0 HD3 PRO A 89 21.820 -0.340 -16.379 1.00 0.00 H new ATOM 681 N LYS A 95 24.076 7.998 -15.833 1.00 0.00 N ATOM 682 CA LYS A 95 22.959 7.269 -15.183 1.00 0.00 C ATOM 683 C LYS A 95 21.629 7.354 -15.973 1.00 0.00 C ATOM 684 O LYS A 95 20.684 6.608 -15.684 1.00 0.00 O ATOM 685 CB LYS A 95 22.738 7.791 -13.733 1.00 0.00 C ATOM 686 CG LYS A 95 22.263 9.263 -13.630 1.00 0.00 C ATOM 687 CD LYS A 95 21.847 9.644 -12.189 1.00 0.00 C ATOM 688 CE LYS A 95 21.300 11.079 -12.066 1.00 0.00 C ATOM 689 NZ LYS A 95 20.735 11.331 -10.713 1.00 0.00 N ATOM 0 HA LYS A 95 23.254 6.220 -15.163 1.00 0.00 H new ATOM 0 HB2 LYS A 95 22.003 7.153 -13.242 1.00 0.00 H new ATOM 0 HB3 LYS A 95 23.671 7.687 -13.180 1.00 0.00 H new ATOM 0 HG2 LYS A 95 23.063 9.925 -13.962 1.00 0.00 H new ATOM 0 HG3 LYS A 95 21.420 9.419 -14.303 1.00 0.00 H new ATOM 0 HD2 LYS A 95 21.088 8.943 -11.841 1.00 0.00 H new ATOM 0 HD3 LYS A 95 22.708 9.534 -11.530 1.00 0.00 H new ATOM 0 HE2 LYS A 95 22.099 11.793 -12.267 1.00 0.00 H new ATOM 0 HE3 LYS A 95 20.530 11.242 -12.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 20.375 12.306 -10.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 19.957 10.665 -10.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 21.477 11.199 -9.997 1.00 0.00 H new ATOM 703 N ASN A 96 21.562 8.267 -16.964 1.00 0.00 N ATOM 704 CA ASN A 96 20.346 8.472 -17.793 1.00 0.00 C ATOM 705 C ASN A 96 20.241 7.401 -18.904 1.00 0.00 C ATOM 706 O ASN A 96 19.281 7.406 -19.689 1.00 0.00 O ATOM 707 CB ASN A 96 20.340 9.900 -18.406 1.00 0.00 C ATOM 708 CG ASN A 96 20.472 10.998 -17.345 1.00 0.00 C ATOM 709 OD1 ASN A 96 19.480 11.483 -16.803 1.00 0.00 O ATOM 710 ND2 ASN A 96 21.703 11.404 -17.038 1.00 0.00 N ATOM 0 H ASN A 96 22.338 8.879 -17.214 1.00 0.00 H new ATOM 0 HA ASN A 96 19.475 8.369 -17.146 1.00 0.00 H new ATOM 0 HB2 ASN A 96 21.160 9.989 -19.119 1.00 0.00 H new ATOM 0 HB3 ASN A 96 19.415 10.048 -18.964 1.00 0.00 H new ATOM 0 HD21 ASN A 96 21.840 12.134 -16.339 1.00 0.00 H new ATOM 0 HD22 ASN A 96 22.509 10.985 -17.502 1.00 0.00 H new ATOM 717 N ALA A 97 21.244 6.495 -18.966 1.00 0.00 N ATOM 718 CA ALA A 97 21.223 5.337 -19.864 1.00 0.00 C ATOM 719 C ALA A 97 20.185 4.319 -19.353 1.00 0.00 C ATOM 720 O ALA A 97 20.430 3.619 -18.369 1.00 0.00 O ATOM 721 CB ALA A 97 22.634 4.703 -19.922 1.00 0.00 C ATOM 0 H ALA A 97 22.085 6.554 -18.392 1.00 0.00 H new ATOM 0 HA ALA A 97 20.943 5.648 -20.871 1.00 0.00 H new ATOM 0 HB1 ALA A 97 22.619 3.842 -20.590 1.00 0.00 H new ATOM 0 HB2 ALA A 97 23.348 5.438 -20.294 1.00 0.00 H new ATOM 0 HB3 ALA A 97 22.930 4.382 -18.923 1.00 0.00 H new ATOM 727 N ILE A 98 19.017 4.256 -20.009 1.00 0.00 N ATOM 728 CA ILE A 98 17.971 3.284 -19.656 1.00 0.00 C ATOM 729 C ILE A 98 18.186 2.017 -20.496 1.00 0.00 C ATOM 730 O ILE A 98 17.939 2.015 -21.704 1.00 0.00 O ATOM 731 CB ILE A 98 16.532 3.880 -19.888 1.00 0.00 C ATOM 732 CG1 ILE A 98 16.334 5.168 -19.025 1.00 0.00 C ATOM 733 CG2 ILE A 98 15.423 2.837 -19.592 1.00 0.00 C ATOM 734 CD1 ILE A 98 14.979 5.836 -19.186 1.00 0.00 C ATOM 0 H ILE A 98 18.772 4.867 -20.788 1.00 0.00 H new ATOM 0 HA ILE A 98 18.042 3.041 -18.596 1.00 0.00 H new ATOM 0 HB ILE A 98 16.447 4.148 -20.941 1.00 0.00 H new ATOM 0 HG12 ILE A 98 16.475 4.911 -17.975 1.00 0.00 H new ATOM 0 HG13 ILE A 98 17.112 5.886 -19.285 1.00 0.00 H new ATOM 0 HG21 ILE A 98 14.445 3.287 -19.764 1.00 0.00 H new ATOM 0 HG22 ILE A 98 15.547 1.977 -20.250 1.00 0.00 H new ATOM 0 HG23 ILE A 98 15.496 2.513 -18.554 1.00 0.00 H new ATOM 0 HD11 ILE A 98 14.931 6.720 -18.550 1.00 0.00 H new ATOM 0 HD12 ILE A 98 14.839 6.129 -20.227 1.00 0.00 H new ATOM 0 HD13 ILE A 98 14.193 5.139 -18.897 1.00 0.00 H new ATOM 746 N LYS A 99 18.653 0.947 -19.839 1.00 0.00 N ATOM 747 CA LYS A 99 19.037 -0.298 -20.510 1.00 0.00 C ATOM 748 C LYS A 99 17.807 -1.211 -20.690 1.00 0.00 C ATOM 749 O LYS A 99 17.128 -1.549 -19.719 1.00 0.00 O ATOM 750 CB LYS A 99 20.156 -1.016 -19.712 1.00 0.00 C ATOM 751 CG LYS A 99 20.828 -2.177 -20.481 1.00 0.00 C ATOM 752 CD LYS A 99 21.975 -2.853 -19.692 1.00 0.00 C ATOM 753 CE LYS A 99 21.484 -3.588 -18.432 1.00 0.00 C ATOM 754 NZ LYS A 99 22.585 -4.320 -17.757 1.00 0.00 N ATOM 0 H LYS A 99 18.775 0.922 -18.827 1.00 0.00 H new ATOM 0 HA LYS A 99 19.428 -0.060 -21.499 1.00 0.00 H new ATOM 0 HB2 LYS A 99 20.918 -0.287 -19.437 1.00 0.00 H new ATOM 0 HB3 LYS A 99 19.736 -1.403 -18.784 1.00 0.00 H new ATOM 0 HG2 LYS A 99 20.074 -2.926 -20.725 1.00 0.00 H new ATOM 0 HG3 LYS A 99 21.220 -1.799 -21.425 1.00 0.00 H new ATOM 0 HD2 LYS A 99 22.488 -3.561 -20.342 1.00 0.00 H new ATOM 0 HD3 LYS A 99 22.706 -2.097 -19.404 1.00 0.00 H new ATOM 0 HE2 LYS A 99 21.047 -2.869 -17.739 1.00 0.00 H new ATOM 0 HE3 LYS A 99 20.695 -4.289 -18.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 22.219 -4.788 -16.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 22.974 -5.035 -18.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 23.334 -3.650 -17.490 1.00 0.00 H new ATOM 768 N VAL A 100 17.525 -1.571 -21.951 1.00 0.00 N ATOM 769 CA VAL A 100 16.405 -2.447 -22.327 1.00 0.00 C ATOM 770 C VAL A 100 16.823 -3.931 -22.201 1.00 0.00 C ATOM 771 O VAL A 100 17.705 -4.405 -22.936 1.00 0.00 O ATOM 772 CB VAL A 100 15.925 -2.127 -23.798 1.00 0.00 C ATOM 773 CG1 VAL A 100 14.789 -3.072 -24.262 1.00 0.00 C ATOM 774 CG2 VAL A 100 15.496 -0.640 -23.923 1.00 0.00 C ATOM 0 H VAL A 100 18.076 -1.257 -22.750 1.00 0.00 H new ATOM 0 HA VAL A 100 15.573 -2.263 -21.648 1.00 0.00 H new ATOM 0 HB VAL A 100 16.773 -2.301 -24.460 1.00 0.00 H new ATOM 0 HG11 VAL A 100 14.493 -2.813 -25.279 1.00 0.00 H new ATOM 0 HG12 VAL A 100 15.141 -4.103 -24.238 1.00 0.00 H new ATOM 0 HG13 VAL A 100 13.932 -2.966 -23.596 1.00 0.00 H new ATOM 0 HG21 VAL A 100 15.169 -0.440 -24.943 1.00 0.00 H new ATOM 0 HG22 VAL A 100 14.676 -0.439 -23.233 1.00 0.00 H new ATOM 0 HG23 VAL A 100 16.341 0.004 -23.680 1.00 0.00 H new ATOM 784 N ASN A 101 16.193 -4.637 -21.245 1.00 0.00 N ATOM 785 CA ASN A 101 16.422 -6.075 -20.986 1.00 0.00 C ATOM 786 C ASN A 101 15.159 -6.852 -21.364 1.00 0.00 C ATOM 787 O ASN A 101 14.066 -6.424 -21.018 1.00 0.00 O ATOM 788 CB ASN A 101 16.742 -6.309 -19.485 1.00 0.00 C ATOM 789 CG ASN A 101 18.057 -5.671 -19.032 1.00 0.00 C ATOM 790 OD1 ASN A 101 18.106 -4.502 -18.642 1.00 0.00 O ATOM 791 ND2 ASN A 101 19.131 -6.443 -19.065 1.00 0.00 N ATOM 0 H ASN A 101 15.501 -4.222 -20.621 1.00 0.00 H new ATOM 0 HA ASN A 101 17.268 -6.418 -21.581 1.00 0.00 H new ATOM 0 HB2 ASN A 101 15.927 -5.909 -18.882 1.00 0.00 H new ATOM 0 HB3 ASN A 101 16.783 -7.381 -19.294 1.00 0.00 H new ATOM 0 HD21 ASN A 101 20.033 -6.075 -18.762 1.00 0.00 H new ATOM 0 HD22 ASN A 101 19.057 -7.406 -19.393 1.00 0.00 H new ATOM 798 N ASN A 102 15.302 -8.002 -22.056 1.00 0.00 N ATOM 799 CA ASN A 102 14.140 -8.819 -22.488 1.00 0.00 C ATOM 800 C ASN A 102 13.553 -9.615 -21.294 1.00 0.00 C ATOM 801 O ASN A 102 14.090 -9.541 -20.179 1.00 0.00 O ATOM 802 CB ASN A 102 14.525 -9.751 -23.676 1.00 0.00 C ATOM 803 CG ASN A 102 15.275 -11.040 -23.300 1.00 0.00 C ATOM 804 OD1 ASN A 102 16.031 -11.086 -22.346 1.00 0.00 O ATOM 805 ND2 ASN A 102 15.043 -12.108 -24.047 1.00 0.00 N ATOM 0 H ASN A 102 16.206 -8.388 -22.329 1.00 0.00 H new ATOM 0 HA ASN A 102 13.360 -8.147 -22.846 1.00 0.00 H new ATOM 0 HB2 ASN A 102 13.614 -10.025 -24.208 1.00 0.00 H new ATOM 0 HB3 ASN A 102 15.142 -9.184 -24.373 1.00 0.00 H new ATOM 0 HD21 ASN A 102 15.501 -12.993 -23.828 1.00 0.00 H new ATOM 0 HD22 ASN A 102 14.406 -12.046 -24.841 1.00 0.00 H new ATOM 812 N VAL A 103 12.474 -10.394 -21.537 1.00 0.00 N ATOM 813 CA VAL A 103 11.768 -11.157 -20.479 1.00 0.00 C ATOM 814 C VAL A 103 12.691 -12.198 -19.792 1.00 0.00 C ATOM 815 O VAL A 103 12.499 -12.535 -18.620 1.00 0.00 O ATOM 816 CB VAL A 103 10.484 -11.868 -21.064 1.00 0.00 C ATOM 817 CG1 VAL A 103 10.839 -13.082 -21.958 1.00 0.00 C ATOM 818 CG2 VAL A 103 9.494 -12.259 -19.948 1.00 0.00 C ATOM 0 H VAL A 103 12.069 -10.512 -22.466 1.00 0.00 H new ATOM 0 HA VAL A 103 11.462 -10.438 -19.719 1.00 0.00 H new ATOM 0 HB VAL A 103 9.988 -11.139 -21.705 1.00 0.00 H new ATOM 0 HG11 VAL A 103 9.923 -13.536 -22.336 1.00 0.00 H new ATOM 0 HG12 VAL A 103 11.452 -12.750 -22.796 1.00 0.00 H new ATOM 0 HG13 VAL A 103 11.393 -13.816 -21.372 1.00 0.00 H new ATOM 0 HG21 VAL A 103 8.623 -12.745 -20.388 1.00 0.00 H new ATOM 0 HG22 VAL A 103 9.980 -12.944 -19.254 1.00 0.00 H new ATOM 0 HG23 VAL A 103 9.178 -11.364 -19.412 1.00 0.00 H new ATOM 828 N ASN A 104 13.692 -12.691 -20.549 1.00 0.00 N ATOM 829 CA ASN A 104 14.673 -13.671 -20.052 1.00 0.00 C ATOM 830 C ASN A 104 15.764 -12.981 -19.203 1.00 0.00 C ATOM 831 O ASN A 104 16.359 -13.607 -18.325 1.00 0.00 O ATOM 832 CB ASN A 104 15.297 -14.457 -21.238 1.00 0.00 C ATOM 833 CG ASN A 104 16.248 -15.599 -20.818 1.00 0.00 C ATOM 834 OD1 ASN A 104 15.975 -16.261 -19.696 1.00 0.00 O flip ATOM 835 ND2 ASN A 104 17.205 -15.906 -21.523 1.00 0.00 N flip ATOM 0 H ASN A 104 13.841 -12.420 -21.521 1.00 0.00 H new ATOM 0 HA ASN A 104 14.156 -14.381 -19.406 1.00 0.00 H new ATOM 0 HB2 ASN A 104 14.493 -14.875 -21.844 1.00 0.00 H new ATOM 0 HB3 ASN A 104 15.845 -13.760 -21.872 1.00 0.00 H new ATOM 0 HD21 ASN A 104 17.396 -15.385 -22.379 1.00 0.00 H new ATOM 0 HD22 ASN A 104 17.809 -16.682 -21.253 1.00 0.00 H new ATOM 842 N GLY A 105 16.009 -11.687 -19.473 1.00 0.00 N ATOM 843 CA GLY A 105 16.980 -10.884 -18.709 1.00 0.00 C ATOM 844 C GLY A 105 18.128 -10.351 -19.558 1.00 0.00 C ATOM 845 O GLY A 105 18.854 -9.454 -19.117 1.00 0.00 O ATOM 0 H GLY A 105 15.544 -11.172 -20.220 1.00 0.00 H new ATOM 0 HA2 GLY A 105 16.461 -10.045 -18.245 1.00 0.00 H new ATOM 0 HA3 GLY A 105 17.387 -11.492 -17.901 1.00 0.00 H new ATOM 849 N ASN A 106 18.298 -10.911 -20.773 1.00 0.00 N ATOM 850 CA ASN A 106 19.350 -10.492 -21.724 1.00 0.00 C ATOM 851 C ASN A 106 19.168 -9.021 -22.141 1.00 0.00 C ATOM 852 O ASN A 106 18.144 -8.663 -22.736 1.00 0.00 O ATOM 853 CB ASN A 106 19.347 -11.399 -22.987 1.00 0.00 C ATOM 854 CG ASN A 106 19.710 -12.859 -22.692 1.00 0.00 C ATOM 855 OD1 ASN A 106 18.715 -13.682 -22.403 1.00 0.00 O flip ATOM 856 ND2 ASN A 106 20.878 -13.248 -22.733 1.00 0.00 N flip ATOM 0 H ASN A 106 17.710 -11.667 -21.123 1.00 0.00 H new ATOM 0 HA ASN A 106 20.309 -10.594 -21.216 1.00 0.00 H new ATOM 0 HB2 ASN A 106 18.360 -11.364 -23.447 1.00 0.00 H new ATOM 0 HB3 ASN A 106 20.052 -10.997 -23.715 1.00 0.00 H new ATOM 0 HD21 ASN A 106 21.626 -12.592 -22.958 1.00 0.00 H new ATOM 0 HD22 ASN A 106 21.097 -14.226 -22.542 1.00 0.00 H new ATOM 863 N GLN A 107 20.153 -8.176 -21.781 1.00 0.00 N ATOM 864 CA GLN A 107 20.212 -6.777 -22.235 1.00 0.00 C ATOM 865 C GLN A 107 20.421 -6.727 -23.755 1.00 0.00 C ATOM 866 O GLN A 107 21.508 -7.027 -24.267 1.00 0.00 O ATOM 867 CB GLN A 107 21.295 -5.941 -21.478 1.00 0.00 C ATOM 868 CG GLN A 107 22.722 -6.539 -21.387 1.00 0.00 C ATOM 869 CD GLN A 107 22.879 -7.656 -20.347 1.00 0.00 C ATOM 870 OE1 GLN A 107 22.168 -7.690 -19.342 1.00 0.00 O ATOM 871 NE2 GLN A 107 23.810 -8.566 -20.574 1.00 0.00 N ATOM 0 H GLN A 107 20.925 -8.444 -21.171 1.00 0.00 H new ATOM 0 HA GLN A 107 19.256 -6.312 -21.995 1.00 0.00 H new ATOM 0 HB2 GLN A 107 21.368 -4.967 -21.962 1.00 0.00 H new ATOM 0 HB3 GLN A 107 20.937 -5.767 -20.463 1.00 0.00 H new ATOM 0 HG2 GLN A 107 23.002 -6.929 -22.366 1.00 0.00 H new ATOM 0 HG3 GLN A 107 23.423 -5.739 -21.151 1.00 0.00 H new ATOM 0 HE21 GLN A 107 24.383 -8.510 -21.416 1.00 0.00 H new ATOM 0 HE22 GLN A 107 23.956 -9.324 -19.907 1.00 0.00 H new ATOM 880 N VAL A 108 19.333 -6.390 -24.465 1.00 0.00 N ATOM 881 CA VAL A 108 19.319 -6.313 -25.932 1.00 0.00 C ATOM 882 C VAL A 108 19.999 -5.008 -26.386 1.00 0.00 C ATOM 883 O VAL A 108 20.748 -4.992 -27.369 1.00 0.00 O ATOM 884 CB VAL A 108 17.847 -6.386 -26.490 1.00 0.00 C ATOM 885 CG1 VAL A 108 17.836 -6.559 -28.029 1.00 0.00 C ATOM 886 CG2 VAL A 108 17.038 -7.511 -25.791 1.00 0.00 C ATOM 0 H VAL A 108 18.436 -6.163 -24.035 1.00 0.00 H new ATOM 0 HA VAL A 108 19.869 -7.166 -26.330 1.00 0.00 H new ATOM 0 HB VAL A 108 17.360 -5.438 -26.263 1.00 0.00 H new ATOM 0 HG11 VAL A 108 16.806 -6.606 -28.383 1.00 0.00 H new ATOM 0 HG12 VAL A 108 18.341 -5.712 -28.494 1.00 0.00 H new ATOM 0 HG13 VAL A 108 18.353 -7.481 -28.295 1.00 0.00 H new ATOM 0 HG21 VAL A 108 16.027 -7.537 -26.196 1.00 0.00 H new ATOM 0 HG22 VAL A 108 17.524 -8.471 -25.965 1.00 0.00 H new ATOM 0 HG23 VAL A 108 16.994 -7.316 -24.719 1.00 0.00 H new ATOM 896 N GLY A 109 19.746 -3.927 -25.627 1.00 0.00 N ATOM 897 CA GLY A 109 20.276 -2.607 -25.946 1.00 0.00 C ATOM 898 C GLY A 109 19.927 -1.563 -24.905 1.00 0.00 C ATOM 899 O GLY A 109 19.774 -1.892 -23.730 1.00 0.00 O ATOM 0 H GLY A 109 19.172 -3.952 -24.784 1.00 0.00 H new ATOM 0 HA2 GLY A 109 21.360 -2.670 -26.041 1.00 0.00 H new ATOM 0 HA3 GLY A 109 19.889 -2.290 -26.915 1.00 0.00 H new ATOM 903 N HIS A 110 19.815 -0.294 -25.342 1.00 0.00 N ATOM 904 CA HIS A 110 19.483 0.844 -24.464 1.00 0.00 C ATOM 905 C HIS A 110 18.581 1.857 -25.202 1.00 0.00 C ATOM 906 O HIS A 110 18.395 1.775 -26.423 1.00 0.00 O ATOM 907 CB HIS A 110 20.777 1.539 -23.932 1.00 0.00 C ATOM 908 CG HIS A 110 21.624 2.220 -24.992 1.00 0.00 C ATOM 909 ND1 HIS A 110 21.587 3.483 -25.500 1.00 0.00 N flip ATOM 910 CD2 HIS A 110 22.659 1.592 -25.643 1.00 0.00 C flip ATOM 911 CE1 HIS A 110 22.578 3.575 -26.437 1.00 0.00 C flip ATOM 912 NE2 HIS A 110 23.206 2.422 -26.504 1.00 0.00 N flip ATOM 0 H HIS A 110 19.953 -0.029 -26.317 1.00 0.00 H new ATOM 0 HA HIS A 110 18.933 0.458 -23.606 1.00 0.00 H new ATOM 0 HB2 HIS A 110 20.492 2.280 -23.185 1.00 0.00 H new ATOM 0 HB3 HIS A 110 21.389 0.793 -23.424 1.00 0.00 H new ATOM 0 HD1 HIS A 110 20.939 4.224 -25.231 1.00 0.00 H new ATOM 0 HD2 HIS A 110 22.975 0.573 -25.473 1.00 0.00 H new ATOM 0 HE1 HIS A 110 22.807 4.451 -27.026 1.00 0.00 H new ATOM 921 N LEU A 111 18.073 2.830 -24.433 1.00 0.00 N ATOM 922 CA LEU A 111 17.158 3.885 -24.903 1.00 0.00 C ATOM 923 C LEU A 111 17.984 5.105 -25.374 1.00 0.00 C ATOM 924 O LEU A 111 19.095 5.313 -24.871 1.00 0.00 O ATOM 925 CB LEU A 111 16.213 4.294 -23.718 1.00 0.00 C ATOM 926 CG LEU A 111 14.773 4.751 -24.106 1.00 0.00 C ATOM 927 CD1 LEU A 111 13.929 3.549 -24.588 1.00 0.00 C ATOM 928 CD2 LEU A 111 14.072 5.497 -22.948 1.00 0.00 C ATOM 0 H LEU A 111 18.292 2.909 -23.440 1.00 0.00 H new ATOM 0 HA LEU A 111 16.558 3.523 -25.738 1.00 0.00 H new ATOM 0 HB2 LEU A 111 16.131 3.446 -23.038 1.00 0.00 H new ATOM 0 HB3 LEU A 111 16.690 5.102 -23.164 1.00 0.00 H new ATOM 0 HG LEU A 111 14.865 5.458 -24.931 1.00 0.00 H new ATOM 0 HD11 LEU A 111 12.928 3.890 -24.853 1.00 0.00 H new ATOM 0 HD12 LEU A 111 14.402 3.099 -25.461 1.00 0.00 H new ATOM 0 HD13 LEU A 111 13.860 2.809 -23.790 1.00 0.00 H new ATOM 0 HD21 LEU A 111 13.072 5.797 -23.261 1.00 0.00 H new ATOM 0 HD22 LEU A 111 13.999 4.838 -22.083 1.00 0.00 H new ATOM 0 HD23 LEU A 111 14.650 6.382 -22.683 1.00 0.00 H new ATOM 940 N LYS A 112 17.446 5.907 -26.321 1.00 0.00 N ATOM 941 CA LYS A 112 18.081 7.188 -26.730 1.00 0.00 C ATOM 942 C LYS A 112 18.077 8.169 -25.548 1.00 0.00 C ATOM 943 O LYS A 112 17.049 8.330 -24.905 1.00 0.00 O ATOM 944 CB LYS A 112 17.347 7.830 -27.939 1.00 0.00 C ATOM 945 CG LYS A 112 17.500 7.075 -29.278 1.00 0.00 C ATOM 946 CD LYS A 112 18.953 7.094 -29.798 1.00 0.00 C ATOM 947 CE LYS A 112 19.467 8.505 -30.118 1.00 0.00 C ATOM 948 NZ LYS A 112 20.907 8.496 -30.471 1.00 0.00 N ATOM 0 H LYS A 112 16.579 5.695 -26.815 1.00 0.00 H new ATOM 0 HA LYS A 112 19.106 6.972 -27.032 1.00 0.00 H new ATOM 0 HB2 LYS A 112 16.286 7.904 -27.701 1.00 0.00 H new ATOM 0 HB3 LYS A 112 17.717 8.847 -28.070 1.00 0.00 H new ATOM 0 HG2 LYS A 112 17.176 6.042 -29.149 1.00 0.00 H new ATOM 0 HG3 LYS A 112 16.844 7.525 -30.023 1.00 0.00 H new ATOM 0 HD2 LYS A 112 19.604 6.639 -29.052 1.00 0.00 H new ATOM 0 HD3 LYS A 112 19.018 6.479 -30.696 1.00 0.00 H new ATOM 0 HE2 LYS A 112 18.892 8.923 -30.944 1.00 0.00 H new ATOM 0 HE3 LYS A 112 19.307 9.155 -29.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 21.219 9.466 -30.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 21.458 8.120 -29.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 21.056 7.896 -31.307 1.00 0.00 H new ATOM 962 N LYS A 113 19.221 8.827 -25.305 1.00 0.00 N ATOM 963 CA LYS A 113 19.441 9.684 -24.118 1.00 0.00 C ATOM 964 C LYS A 113 18.562 10.957 -24.141 1.00 0.00 C ATOM 965 O LYS A 113 18.268 11.527 -23.086 1.00 0.00 O ATOM 966 CB LYS A 113 20.947 10.050 -24.003 1.00 0.00 C ATOM 967 CG LYS A 113 21.499 10.895 -25.175 1.00 0.00 C ATOM 968 CD LYS A 113 23.024 11.115 -25.083 1.00 0.00 C ATOM 969 CE LYS A 113 23.569 12.014 -26.206 1.00 0.00 C ATOM 970 NZ LYS A 113 22.943 13.365 -26.209 1.00 0.00 N ATOM 0 H LYS A 113 20.028 8.782 -25.928 1.00 0.00 H new ATOM 0 HA LYS A 113 19.142 9.116 -23.237 1.00 0.00 H new ATOM 0 HB2 LYS A 113 21.104 10.597 -23.073 1.00 0.00 H new ATOM 0 HB3 LYS A 113 21.526 9.129 -23.933 1.00 0.00 H new ATOM 0 HG2 LYS A 113 21.263 10.400 -26.117 1.00 0.00 H new ATOM 0 HG3 LYS A 113 20.996 11.862 -25.189 1.00 0.00 H new ATOM 0 HD2 LYS A 113 23.264 11.562 -24.118 1.00 0.00 H new ATOM 0 HD3 LYS A 113 23.528 10.149 -25.121 1.00 0.00 H new ATOM 0 HE2 LYS A 113 24.648 12.117 -26.093 1.00 0.00 H new ATOM 0 HE3 LYS A 113 23.394 11.534 -27.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 23.621 14.061 -26.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 22.095 13.354 -26.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 22.674 13.625 -25.239 1.00 0.00 H new ATOM 984 N GLU A 114 18.147 11.384 -25.353 1.00 0.00 N ATOM 985 CA GLU A 114 17.257 12.552 -25.548 1.00 0.00 C ATOM 986 C GLU A 114 15.872 12.245 -24.959 1.00 0.00 C ATOM 987 O GLU A 114 15.360 12.979 -24.112 1.00 0.00 O ATOM 988 CB GLU A 114 17.107 12.904 -27.063 1.00 0.00 C ATOM 989 CG GLU A 114 18.378 13.429 -27.775 1.00 0.00 C ATOM 990 CD GLU A 114 19.524 12.408 -27.939 1.00 0.00 C ATOM 991 OE1 GLU A 114 19.255 11.195 -28.111 1.00 0.00 O ATOM 992 OE2 GLU A 114 20.700 12.819 -27.932 1.00 0.00 O ATOM 0 H GLU A 114 18.419 10.930 -26.225 1.00 0.00 H new ATOM 0 HA GLU A 114 17.702 13.407 -25.039 1.00 0.00 H new ATOM 0 HB2 GLU A 114 16.764 12.013 -27.589 1.00 0.00 H new ATOM 0 HB3 GLU A 114 16.324 13.655 -27.164 1.00 0.00 H new ATOM 0 HG2 GLU A 114 18.095 13.791 -28.763 1.00 0.00 H new ATOM 0 HG3 GLU A 114 18.757 14.286 -27.218 1.00 0.00 H new ATOM 999 N LEU A 115 15.311 11.106 -25.399 1.00 0.00 N ATOM 1000 CA LEU A 115 13.973 10.644 -24.997 1.00 0.00 C ATOM 1001 C LEU A 115 13.994 10.182 -23.522 1.00 0.00 C ATOM 1002 O LEU A 115 13.062 10.444 -22.753 1.00 0.00 O ATOM 1003 CB LEU A 115 13.488 9.497 -25.930 1.00 0.00 C ATOM 1004 CG LEU A 115 13.171 9.842 -27.432 1.00 0.00 C ATOM 1005 CD1 LEU A 115 12.131 10.968 -27.545 1.00 0.00 C ATOM 1006 CD2 LEU A 115 14.443 10.151 -28.248 1.00 0.00 C ATOM 0 H LEU A 115 15.778 10.475 -26.050 1.00 0.00 H new ATOM 0 HA LEU A 115 13.271 11.473 -25.090 1.00 0.00 H new ATOM 0 HB2 LEU A 115 14.249 8.717 -25.921 1.00 0.00 H new ATOM 0 HB3 LEU A 115 12.588 9.069 -25.490 1.00 0.00 H new ATOM 0 HG LEU A 115 12.733 8.947 -27.874 1.00 0.00 H new ATOM 0 HD11 LEU A 115 11.937 11.180 -28.596 1.00 0.00 H new ATOM 0 HD12 LEU A 115 11.205 10.658 -27.060 1.00 0.00 H new ATOM 0 HD13 LEU A 115 12.512 11.866 -27.059 1.00 0.00 H new ATOM 0 HD21 LEU A 115 14.168 10.382 -29.277 1.00 0.00 H new ATOM 0 HD22 LEU A 115 14.958 11.005 -27.809 1.00 0.00 H new ATOM 0 HD23 LEU A 115 15.103 9.284 -28.235 1.00 0.00 H new ATOM 1018 N ALA A 116 15.100 9.515 -23.153 1.00 0.00 N ATOM 1019 CA ALA A 116 15.412 9.124 -21.765 1.00 0.00 C ATOM 1020 C ALA A 116 15.591 10.367 -20.873 1.00 0.00 C ATOM 1021 O ALA A 116 15.502 10.269 -19.662 1.00 0.00 O ATOM 1022 CB ALA A 116 16.666 8.230 -21.722 1.00 0.00 C ATOM 0 H ALA A 116 15.815 9.227 -23.821 1.00 0.00 H new ATOM 0 HA ALA A 116 14.572 8.549 -21.375 1.00 0.00 H new ATOM 0 HB1 ALA A 116 16.880 7.952 -20.690 1.00 0.00 H new ATOM 0 HB2 ALA A 116 16.491 7.330 -22.311 1.00 0.00 H new ATOM 0 HB3 ALA A 116 17.515 8.775 -22.134 1.00 0.00 H new ATOM 1028 N GLY A 117 15.868 11.532 -21.504 1.00 0.00 N ATOM 1029 CA GLY A 117 15.910 12.829 -20.811 1.00 0.00 C ATOM 1030 C GLY A 117 14.624 13.151 -20.050 1.00 0.00 C ATOM 1031 O GLY A 117 14.633 13.977 -19.144 1.00 0.00 O ATOM 0 H GLY A 117 16.067 11.593 -22.503 1.00 0.00 H new ATOM 0 HA2 GLY A 117 16.747 12.833 -20.113 1.00 0.00 H new ATOM 0 HA3 GLY A 117 16.099 13.617 -21.540 1.00 0.00 H new ATOM 1035 N ALA A 118 13.498 12.529 -20.463 1.00 0.00 N ATOM 1036 CA ALA A 118 12.231 12.562 -19.708 1.00 0.00 C ATOM 1037 C ALA A 118 12.075 11.276 -18.875 1.00 0.00 C ATOM 1038 O ALA A 118 11.949 11.339 -17.653 1.00 0.00 O ATOM 1039 CB ALA A 118 11.042 12.743 -20.664 1.00 0.00 C ATOM 0 H ALA A 118 13.444 11.991 -21.328 1.00 0.00 H new ATOM 0 HA ALA A 118 12.250 13.412 -19.026 1.00 0.00 H new ATOM 0 HB1 ALA A 118 10.115 12.765 -20.091 1.00 0.00 H new ATOM 0 HB2 ALA A 118 11.154 13.680 -21.210 1.00 0.00 H new ATOM 0 HB3 ALA A 118 11.013 11.913 -21.370 1.00 0.00 H new ATOM 1045 N LEU A 119 12.137 10.108 -19.566 1.00 0.00 N ATOM 1046 CA LEU A 119 11.783 8.777 -18.989 1.00 0.00 C ATOM 1047 C LEU A 119 12.677 8.351 -17.797 1.00 0.00 C ATOM 1048 O LEU A 119 12.267 7.500 -17.009 1.00 0.00 O ATOM 1049 CB LEU A 119 11.772 7.660 -20.086 1.00 0.00 C ATOM 1050 CG LEU A 119 10.508 7.592 -21.012 1.00 0.00 C ATOM 1051 CD1 LEU A 119 10.380 8.824 -21.933 1.00 0.00 C ATOM 1052 CD2 LEU A 119 10.491 6.272 -21.828 1.00 0.00 C ATOM 0 H LEU A 119 12.434 10.059 -20.541 1.00 0.00 H new ATOM 0 HA LEU A 119 10.775 8.898 -18.592 1.00 0.00 H new ATOM 0 HB2 LEU A 119 12.650 7.796 -20.718 1.00 0.00 H new ATOM 0 HB3 LEU A 119 11.882 6.696 -19.590 1.00 0.00 H new ATOM 0 HG LEU A 119 9.635 7.603 -20.360 1.00 0.00 H new ATOM 0 HD11 LEU A 119 9.488 8.725 -22.552 1.00 0.00 H new ATOM 0 HD12 LEU A 119 10.301 9.726 -21.326 1.00 0.00 H new ATOM 0 HD13 LEU A 119 11.260 8.893 -22.573 1.00 0.00 H new ATOM 0 HD21 LEU A 119 9.605 6.248 -22.463 1.00 0.00 H new ATOM 0 HD22 LEU A 119 11.384 6.217 -22.450 1.00 0.00 H new ATOM 0 HD23 LEU A 119 10.471 5.422 -21.145 1.00 0.00 H new ATOM 1064 N ALA A 120 13.889 8.928 -17.687 1.00 0.00 N ATOM 1065 CA ALA A 120 14.835 8.631 -16.578 1.00 0.00 C ATOM 1066 C ALA A 120 14.293 9.137 -15.230 1.00 0.00 C ATOM 1067 O ALA A 120 14.615 8.586 -14.181 1.00 0.00 O ATOM 1068 CB ALA A 120 16.227 9.234 -16.863 1.00 0.00 C ATOM 0 H ALA A 120 14.245 9.610 -18.357 1.00 0.00 H new ATOM 0 HA ALA A 120 14.937 7.548 -16.514 1.00 0.00 H new ATOM 0 HB1 ALA A 120 16.900 9.003 -16.037 1.00 0.00 H new ATOM 0 HB2 ALA A 120 16.625 8.810 -17.785 1.00 0.00 H new ATOM 0 HB3 ALA A 120 16.140 10.315 -16.968 1.00 0.00 H new ATOM 1074 N TYR A 121 13.470 10.196 -15.288 1.00 0.00 N ATOM 1075 CA TYR A 121 12.800 10.780 -14.109 1.00 0.00 C ATOM 1076 C TYR A 121 11.543 9.972 -13.722 1.00 0.00 C ATOM 1077 O TYR A 121 11.175 9.919 -12.549 1.00 0.00 O ATOM 1078 CB TYR A 121 12.457 12.265 -14.385 1.00 0.00 C ATOM 1079 CG TYR A 121 13.709 13.134 -14.591 1.00 0.00 C ATOM 1080 CD1 TYR A 121 14.437 13.609 -13.494 1.00 0.00 C ATOM 1081 CD2 TYR A 121 14.183 13.454 -15.868 1.00 0.00 C ATOM 1082 CE1 TYR A 121 15.579 14.371 -13.662 1.00 0.00 C ATOM 1083 CE2 TYR A 121 15.329 14.211 -16.036 1.00 0.00 C ATOM 1084 CZ TYR A 121 16.020 14.668 -14.934 1.00 0.00 C ATOM 1085 OH TYR A 121 17.167 15.416 -15.106 1.00 0.00 O ATOM 0 H TYR A 121 13.247 10.677 -16.160 1.00 0.00 H new ATOM 0 HA TYR A 121 13.481 10.733 -13.259 1.00 0.00 H new ATOM 0 HB2 TYR A 121 11.825 12.329 -15.271 1.00 0.00 H new ATOM 0 HB3 TYR A 121 11.878 12.661 -13.551 1.00 0.00 H new ATOM 0 HD1 TYR A 121 14.100 13.376 -12.495 1.00 0.00 H new ATOM 0 HD2 TYR A 121 13.645 13.104 -16.737 1.00 0.00 H new ATOM 0 HE1 TYR A 121 16.122 14.731 -12.801 1.00 0.00 H new ATOM 0 HE2 TYR A 121 15.682 14.444 -17.030 1.00 0.00 H new ATOM 0 HH TYR A 121 17.340 15.535 -16.063 1.00 0.00 H new ATOM 1095 N ILE A 122 10.889 9.344 -14.722 1.00 0.00 N ATOM 1096 CA ILE A 122 9.771 8.401 -14.481 1.00 0.00 C ATOM 1097 C ILE A 122 10.331 7.101 -13.854 1.00 0.00 C ATOM 1098 O ILE A 122 9.708 6.496 -12.978 1.00 0.00 O ATOM 1099 CB ILE A 122 8.946 8.072 -15.801 1.00 0.00 C ATOM 1100 CG1 ILE A 122 8.170 9.324 -16.342 1.00 0.00 C ATOM 1101 CG2 ILE A 122 7.948 6.907 -15.576 1.00 0.00 C ATOM 1102 CD1 ILE A 122 9.002 10.405 -16.985 1.00 0.00 C ATOM 0 H ILE A 122 11.116 9.472 -15.708 1.00 0.00 H new ATOM 0 HA ILE A 122 9.073 8.880 -13.795 1.00 0.00 H new ATOM 0 HB ILE A 122 9.681 7.772 -16.548 1.00 0.00 H new ATOM 0 HG12 ILE A 122 7.434 8.981 -17.070 1.00 0.00 H new ATOM 0 HG13 ILE A 122 7.617 9.767 -15.514 1.00 0.00 H new ATOM 0 HG21 ILE A 122 7.403 6.711 -16.499 1.00 0.00 H new ATOM 0 HG22 ILE A 122 8.495 6.011 -15.281 1.00 0.00 H new ATOM 0 HG23 ILE A 122 7.244 7.178 -14.790 1.00 0.00 H new ATOM 0 HD11 ILE A 122 8.352 11.215 -17.318 1.00 0.00 H new ATOM 0 HD12 ILE A 122 9.720 10.790 -16.261 1.00 0.00 H new ATOM 0 HD13 ILE A 122 9.535 9.993 -17.842 1.00 0.00 H new ATOM 1114 N MET A 123 11.530 6.720 -14.313 1.00 0.00 N ATOM 1115 CA MET A 123 12.265 5.537 -13.829 1.00 0.00 C ATOM 1116 C MET A 123 12.746 5.760 -12.380 1.00 0.00 C ATOM 1117 O MET A 123 12.597 4.887 -11.518 1.00 0.00 O ATOM 1118 CB MET A 123 13.480 5.268 -14.762 1.00 0.00 C ATOM 1119 CG MET A 123 14.324 4.036 -14.400 1.00 0.00 C ATOM 1120 SD MET A 123 13.417 2.480 -14.567 1.00 0.00 S ATOM 1121 CE MET A 123 13.040 2.463 -16.324 1.00 0.00 C ATOM 0 H MET A 123 12.027 7.231 -15.043 1.00 0.00 H new ATOM 0 HA MET A 123 11.601 4.673 -13.841 1.00 0.00 H new ATOM 0 HB2 MET A 123 13.115 5.151 -15.782 1.00 0.00 H new ATOM 0 HB3 MET A 123 14.126 6.146 -14.753 1.00 0.00 H new ATOM 0 HG2 MET A 123 15.206 4.006 -15.040 1.00 0.00 H new ATOM 0 HG3 MET A 123 14.678 4.135 -13.374 1.00 0.00 H new ATOM 0 HE1 MET A 123 12.610 1.499 -16.594 1.00 0.00 H new ATOM 0 HE2 MET A 123 12.327 3.255 -16.551 1.00 0.00 H new ATOM 0 HE3 MET A 123 13.955 2.625 -16.894 1.00 0.00 H new ATOM 1131 N ASP A 124 13.303 6.960 -12.137 1.00 0.00 N ATOM 1132 CA ASP A 124 13.891 7.341 -10.840 1.00 0.00 C ATOM 1133 C ASP A 124 12.804 7.449 -9.761 1.00 0.00 C ATOM 1134 O ASP A 124 12.870 6.780 -8.723 1.00 0.00 O ATOM 1135 CB ASP A 124 14.656 8.690 -10.974 1.00 0.00 C ATOM 1136 CG ASP A 124 15.341 9.145 -9.670 1.00 0.00 C ATOM 1137 OD1 ASP A 124 16.296 8.476 -9.231 1.00 0.00 O ATOM 1138 OD2 ASP A 124 14.926 10.161 -9.072 1.00 0.00 O ATOM 0 H ASP A 124 13.358 7.697 -12.840 1.00 0.00 H new ATOM 0 HA ASP A 124 14.595 6.565 -10.539 1.00 0.00 H new ATOM 0 HB2 ASP A 124 15.410 8.594 -11.756 1.00 0.00 H new ATOM 0 HB3 ASP A 124 13.958 9.463 -11.297 1.00 0.00 H new ATOM 1143 N ASN A 125 11.791 8.285 -10.040 1.00 0.00 N ATOM 1144 CA ASN A 125 10.697 8.576 -9.093 1.00 0.00 C ATOM 1145 C ASN A 125 9.659 7.428 -9.034 1.00 0.00 C ATOM 1146 O ASN A 125 8.847 7.388 -8.102 1.00 0.00 O ATOM 1147 CB ASN A 125 9.989 9.907 -9.472 1.00 0.00 C ATOM 1148 CG ASN A 125 10.895 11.147 -9.470 1.00 0.00 C ATOM 1149 OD1 ASN A 125 12.084 11.075 -9.758 1.00 0.00 O ATOM 1150 ND2 ASN A 125 10.327 12.305 -9.156 1.00 0.00 N ATOM 0 H ASN A 125 11.705 8.779 -10.928 1.00 0.00 H new ATOM 0 HA ASN A 125 11.146 8.672 -8.104 1.00 0.00 H new ATOM 0 HB2 ASN A 125 9.550 9.798 -10.464 1.00 0.00 H new ATOM 0 HB3 ASN A 125 9.167 10.075 -8.776 1.00 0.00 H new ATOM 0 HD21 ASN A 125 10.882 13.161 -9.151 1.00 0.00 H new ATOM 0 HD22 ASN A 125 9.335 12.339 -8.920 1.00 0.00 H new ATOM 1157 N LYS A 126 9.705 6.508 -10.029 1.00 0.00 N ATOM 1158 CA LYS A 126 8.754 5.372 -10.162 1.00 0.00 C ATOM 1159 C LYS A 126 7.309 5.879 -10.383 1.00 0.00 C ATOM 1160 O LYS A 126 6.364 5.470 -9.695 1.00 0.00 O ATOM 1161 CB LYS A 126 8.869 4.381 -8.957 1.00 0.00 C ATOM 1162 CG LYS A 126 10.227 3.637 -8.855 1.00 0.00 C ATOM 1163 CD LYS A 126 10.510 2.698 -10.054 1.00 0.00 C ATOM 1164 CE LYS A 126 9.444 1.599 -10.222 1.00 0.00 C ATOM 1165 NZ LYS A 126 9.770 0.673 -11.333 1.00 0.00 N ATOM 0 H LYS A 126 10.408 6.532 -10.768 1.00 0.00 H new ATOM 0 HA LYS A 126 9.028 4.804 -11.051 1.00 0.00 H new ATOM 0 HB2 LYS A 126 8.703 4.934 -8.033 1.00 0.00 H new ATOM 0 HB3 LYS A 126 8.071 3.643 -9.034 1.00 0.00 H new ATOM 0 HG2 LYS A 126 11.029 4.371 -8.782 1.00 0.00 H new ATOM 0 HG3 LYS A 126 10.244 3.053 -7.935 1.00 0.00 H new ATOM 0 HD2 LYS A 126 10.561 3.290 -10.968 1.00 0.00 H new ATOM 0 HD3 LYS A 126 11.486 2.232 -9.921 1.00 0.00 H new ATOM 0 HE2 LYS A 126 9.356 1.034 -9.294 1.00 0.00 H new ATOM 0 HE3 LYS A 126 8.474 2.060 -10.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 8.892 0.370 -11.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 10.380 1.158 -12.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 10.266 -0.160 -10.957 1.00 0.00 H new ATOM 1179 N LEU A 127 7.168 6.776 -11.377 1.00 0.00 N ATOM 1180 CA LEU A 127 5.881 7.412 -11.732 1.00 0.00 C ATOM 1181 C LEU A 127 4.986 6.444 -12.524 1.00 0.00 C ATOM 1182 O LEU A 127 3.757 6.533 -12.469 1.00 0.00 O ATOM 1183 CB LEU A 127 6.138 8.703 -12.559 1.00 0.00 C ATOM 1184 CG LEU A 127 7.065 9.757 -11.884 1.00 0.00 C ATOM 1185 CD1 LEU A 127 7.286 10.988 -12.794 1.00 0.00 C ATOM 1186 CD2 LEU A 127 6.528 10.154 -10.487 1.00 0.00 C ATOM 0 H LEU A 127 7.946 7.083 -11.960 1.00 0.00 H new ATOM 0 HA LEU A 127 5.362 7.674 -10.810 1.00 0.00 H new ATOM 0 HB2 LEU A 127 6.576 8.420 -13.516 1.00 0.00 H new ATOM 0 HB3 LEU A 127 5.178 9.173 -12.774 1.00 0.00 H new ATOM 0 HG LEU A 127 8.043 9.298 -11.738 1.00 0.00 H new ATOM 0 HD11 LEU A 127 7.938 11.701 -12.289 1.00 0.00 H new ATOM 0 HD12 LEU A 127 7.749 10.671 -13.728 1.00 0.00 H new ATOM 0 HD13 LEU A 127 6.327 11.460 -13.007 1.00 0.00 H new ATOM 0 HD21 LEU A 127 7.193 10.891 -10.037 1.00 0.00 H new ATOM 0 HD22 LEU A 127 5.530 10.580 -10.589 1.00 0.00 H new ATOM 0 HD23 LEU A 127 6.482 9.270 -9.850 1.00 0.00 H new ATOM 1198 N ALA A 128 5.622 5.527 -13.260 1.00 0.00 N ATOM 1199 CA ALA A 128 4.927 4.516 -14.069 1.00 0.00 C ATOM 1200 C ALA A 128 5.889 3.374 -14.424 1.00 0.00 C ATOM 1201 O ALA A 128 7.112 3.561 -14.460 1.00 0.00 O ATOM 1202 CB ALA A 128 4.319 5.148 -15.339 1.00 0.00 C ATOM 0 H ALA A 128 6.639 5.463 -13.313 1.00 0.00 H new ATOM 0 HA ALA A 128 4.105 4.105 -13.483 1.00 0.00 H new ATOM 0 HB1 ALA A 128 3.810 4.379 -15.920 1.00 0.00 H new ATOM 0 HB2 ALA A 128 3.604 5.920 -15.055 1.00 0.00 H new ATOM 0 HB3 ALA A 128 5.113 5.592 -15.940 1.00 0.00 H new ATOM 1208 N GLN A 129 5.312 2.192 -14.659 1.00 0.00 N ATOM 1209 CA GLN A 129 6.043 0.978 -15.026 1.00 0.00 C ATOM 1210 C GLN A 129 6.048 0.868 -16.557 1.00 0.00 C ATOM 1211 O GLN A 129 4.998 0.588 -17.161 1.00 0.00 O ATOM 1212 CB GLN A 129 5.364 -0.279 -14.386 1.00 0.00 C ATOM 1213 CG GLN A 129 4.973 -0.123 -12.896 1.00 0.00 C ATOM 1214 CD GLN A 129 6.139 0.186 -11.957 1.00 0.00 C ATOM 1215 OE1 GLN A 129 7.263 -0.257 -12.169 1.00 0.00 O ATOM 1216 NE2 GLN A 129 5.882 0.973 -10.918 1.00 0.00 N ATOM 0 H GLN A 129 4.304 2.051 -14.598 1.00 0.00 H new ATOM 0 HA GLN A 129 7.066 1.028 -14.654 1.00 0.00 H new ATOM 0 HB2 GLN A 129 4.468 -0.520 -14.958 1.00 0.00 H new ATOM 0 HB3 GLN A 129 6.041 -1.128 -14.482 1.00 0.00 H new ATOM 0 HG2 GLN A 129 4.234 0.674 -12.810 1.00 0.00 H new ATOM 0 HG3 GLN A 129 4.490 -1.042 -12.563 1.00 0.00 H new ATOM 0 HE21 GLN A 129 4.937 1.326 -10.767 1.00 0.00 H new ATOM 0 HE22 GLN A 129 6.630 1.224 -10.271 1.00 0.00 H new ATOM 1225 N ILE A 130 7.212 1.139 -17.179 1.00 0.00 N ATOM 1226 CA ILE A 130 7.355 1.099 -18.643 1.00 0.00 C ATOM 1227 C ILE A 130 7.833 -0.305 -19.040 1.00 0.00 C ATOM 1228 O ILE A 130 8.936 -0.728 -18.643 1.00 0.00 O ATOM 1229 CB ILE A 130 8.369 2.173 -19.238 1.00 0.00 C ATOM 1230 CG1 ILE A 130 8.230 3.590 -18.565 1.00 0.00 C ATOM 1231 CG2 ILE A 130 8.179 2.282 -20.774 1.00 0.00 C ATOM 1232 CD1 ILE A 130 8.981 3.751 -17.250 1.00 0.00 C ATOM 0 H ILE A 130 8.069 1.389 -16.685 1.00 0.00 H new ATOM 0 HA ILE A 130 6.378 1.343 -19.059 1.00 0.00 H new ATOM 0 HB ILE A 130 9.376 1.822 -19.013 1.00 0.00 H new ATOM 0 HG12 ILE A 130 8.587 4.345 -19.265 1.00 0.00 H new ATOM 0 HG13 ILE A 130 7.173 3.791 -18.390 1.00 0.00 H new ATOM 0 HG21 ILE A 130 8.875 3.018 -21.175 1.00 0.00 H new ATOM 0 HG22 ILE A 130 8.371 1.313 -21.234 1.00 0.00 H new ATOM 0 HG23 ILE A 130 7.157 2.592 -20.993 1.00 0.00 H new ATOM 0 HD11 ILE A 130 8.826 4.758 -16.863 1.00 0.00 H new ATOM 0 HD12 ILE A 130 8.610 3.024 -16.528 1.00 0.00 H new ATOM 0 HD13 ILE A 130 10.046 3.587 -17.417 1.00 0.00 H new ATOM 1244 N GLU A 131 6.995 -1.031 -19.794 1.00 0.00 N ATOM 1245 CA GLU A 131 7.321 -2.386 -20.278 1.00 0.00 C ATOM 1246 C GLU A 131 6.935 -2.516 -21.756 1.00 0.00 C ATOM 1247 O GLU A 131 5.816 -2.161 -22.135 1.00 0.00 O ATOM 1248 CB GLU A 131 6.611 -3.455 -19.405 1.00 0.00 C ATOM 1249 CG GLU A 131 7.054 -4.910 -19.682 1.00 0.00 C ATOM 1250 CD GLU A 131 6.595 -5.906 -18.599 1.00 0.00 C ATOM 1251 OE1 GLU A 131 7.045 -5.776 -17.436 1.00 0.00 O ATOM 1252 OE2 GLU A 131 5.799 -6.821 -18.897 1.00 0.00 O ATOM 0 H GLU A 131 6.075 -0.700 -20.086 1.00 0.00 H new ATOM 0 HA GLU A 131 8.395 -2.553 -20.193 1.00 0.00 H new ATOM 0 HB2 GLU A 131 6.794 -3.227 -18.355 1.00 0.00 H new ATOM 0 HB3 GLU A 131 5.535 -3.380 -19.565 1.00 0.00 H new ATOM 0 HG2 GLU A 131 6.657 -5.225 -20.647 1.00 0.00 H new ATOM 0 HG3 GLU A 131 8.141 -4.943 -19.758 1.00 0.00 H new ATOM 1259 N GLY A 132 7.880 -3.008 -22.573 1.00 0.00 N ATOM 1260 CA GLY A 132 7.709 -3.097 -24.017 1.00 0.00 C ATOM 1261 C GLY A 132 7.360 -4.501 -24.492 1.00 0.00 C ATOM 1262 O GLY A 132 7.491 -5.471 -23.747 1.00 0.00 O ATOM 0 H GLY A 132 8.781 -3.353 -22.243 1.00 0.00 H new ATOM 0 HA2 GLY A 132 6.922 -2.409 -24.327 1.00 0.00 H new ATOM 0 HA3 GLY A 132 8.627 -2.772 -24.506 1.00 0.00 H new ATOM 1266 N VAL A 133 6.904 -4.587 -25.752 1.00 0.00 N ATOM 1267 CA VAL A 133 6.581 -5.839 -26.455 1.00 0.00 C ATOM 1268 C VAL A 133 7.149 -5.732 -27.876 1.00 0.00 C ATOM 1269 O VAL A 133 6.888 -4.730 -28.580 1.00 0.00 O ATOM 1270 CB VAL A 133 5.021 -6.113 -26.546 1.00 0.00 C ATOM 1271 CG1 VAL A 133 4.715 -7.418 -27.331 1.00 0.00 C ATOM 1272 CG2 VAL A 133 4.359 -6.150 -25.147 1.00 0.00 C ATOM 0 H VAL A 133 6.745 -3.760 -26.328 1.00 0.00 H new ATOM 0 HA VAL A 133 7.017 -6.667 -25.895 1.00 0.00 H new ATOM 0 HB VAL A 133 4.588 -5.278 -27.096 1.00 0.00 H new ATOM 0 HG11 VAL A 133 3.637 -7.573 -27.373 1.00 0.00 H new ATOM 0 HG12 VAL A 133 5.109 -7.334 -28.344 1.00 0.00 H new ATOM 0 HG13 VAL A 133 5.184 -8.264 -26.828 1.00 0.00 H new ATOM 0 HG21 VAL A 133 3.291 -6.340 -25.255 1.00 0.00 H new ATOM 0 HG22 VAL A 133 4.811 -6.944 -24.552 1.00 0.00 H new ATOM 0 HG23 VAL A 133 4.509 -5.192 -24.648 1.00 0.00 H new ATOM 1282 N VAL A 134 7.937 -6.743 -28.290 1.00 0.00 N ATOM 1283 CA VAL A 134 8.454 -6.861 -29.665 1.00 0.00 C ATOM 1284 C VAL A 134 7.730 -8.026 -30.385 1.00 0.00 C ATOM 1285 O VAL A 134 8.147 -9.184 -30.255 1.00 0.00 O ATOM 1286 CB VAL A 134 10.013 -7.117 -29.713 1.00 0.00 C ATOM 1287 CG1 VAL A 134 10.543 -7.084 -31.170 1.00 0.00 C ATOM 1288 CG2 VAL A 134 10.783 -6.136 -28.806 1.00 0.00 C ATOM 0 H VAL A 134 8.233 -7.503 -27.677 1.00 0.00 H new ATOM 0 HA VAL A 134 8.262 -5.911 -30.164 1.00 0.00 H new ATOM 0 HB VAL A 134 10.190 -8.118 -29.321 1.00 0.00 H new ATOM 0 HG11 VAL A 134 11.618 -7.263 -31.170 1.00 0.00 H new ATOM 0 HG12 VAL A 134 10.046 -7.857 -31.756 1.00 0.00 H new ATOM 0 HG13 VAL A 134 10.338 -6.108 -31.610 1.00 0.00 H new ATOM 0 HG21 VAL A 134 11.851 -6.345 -28.867 1.00 0.00 H new ATOM 0 HG22 VAL A 134 10.594 -5.114 -29.133 1.00 0.00 H new ATOM 0 HG23 VAL A 134 10.449 -6.255 -27.775 1.00 0.00 H new ATOM 1298 N PRO A 135 6.606 -7.758 -31.122 1.00 0.00 N ATOM 1299 CA PRO A 135 5.983 -8.755 -32.022 1.00 0.00 C ATOM 1300 C PRO A 135 6.756 -8.869 -33.361 1.00 0.00 C ATOM 1301 O PRO A 135 6.477 -9.752 -34.175 1.00 0.00 O ATOM 1302 CB PRO A 135 4.535 -8.222 -32.224 1.00 0.00 C ATOM 1303 CG PRO A 135 4.421 -6.996 -31.350 1.00 0.00 C ATOM 1304 CD PRO A 135 5.828 -6.499 -31.135 1.00 0.00 C ATOM 0 HA PRO A 135 5.995 -9.764 -31.609 1.00 0.00 H new ATOM 0 HB2 PRO A 135 4.352 -7.975 -33.270 1.00 0.00 H new ATOM 0 HB3 PRO A 135 3.799 -8.974 -31.940 1.00 0.00 H new ATOM 0 HG2 PRO A 135 3.808 -6.233 -31.829 1.00 0.00 H new ATOM 0 HG3 PRO A 135 3.945 -7.238 -30.400 1.00 0.00 H new ATOM 0 HD2 PRO A 135 6.150 -5.830 -31.933 1.00 0.00 H new ATOM 0 HD3 PRO A 135 5.927 -5.950 -30.199 1.00 0.00 H new ATOM 1312 N PHE A 136 7.709 -7.935 -33.559 1.00 0.00 N ATOM 1313 CA PHE A 136 8.561 -7.842 -34.759 1.00 0.00 C ATOM 1314 C PHE A 136 9.586 -8.998 -34.808 1.00 0.00 C ATOM 1315 O PHE A 136 10.076 -9.359 -35.882 1.00 0.00 O ATOM 1316 CB PHE A 136 9.308 -6.476 -34.759 1.00 0.00 C ATOM 1317 CG PHE A 136 8.403 -5.273 -34.450 1.00 0.00 C ATOM 1318 CD1 PHE A 136 7.548 -4.754 -35.417 1.00 0.00 C ATOM 1319 CD2 PHE A 136 8.387 -4.689 -33.177 1.00 0.00 C ATOM 1320 CE1 PHE A 136 6.711 -3.691 -35.130 1.00 0.00 C ATOM 1321 CE2 PHE A 136 7.543 -3.629 -32.891 1.00 0.00 C ATOM 1322 CZ PHE A 136 6.707 -3.130 -33.867 1.00 0.00 C ATOM 0 H PHE A 136 7.911 -7.208 -32.872 1.00 0.00 H new ATOM 0 HA PHE A 136 7.924 -7.917 -35.640 1.00 0.00 H new ATOM 0 HB2 PHE A 136 10.112 -6.512 -34.024 1.00 0.00 H new ATOM 0 HB3 PHE A 136 9.774 -6.327 -35.733 1.00 0.00 H new ATOM 0 HD1 PHE A 136 7.538 -5.187 -36.406 1.00 0.00 H new ATOM 0 HD2 PHE A 136 9.042 -5.071 -32.408 1.00 0.00 H new ATOM 0 HE1 PHE A 136 6.058 -3.298 -35.895 1.00 0.00 H new ATOM 0 HE2 PHE A 136 7.540 -3.193 -31.903 1.00 0.00 H new ATOM 0 HZ PHE A 136 6.050 -2.302 -33.645 1.00 0.00 H new ATOM 1332 N GLY A 137 9.928 -9.529 -33.614 1.00 0.00 N ATOM 1333 CA GLY A 137 10.877 -10.639 -33.467 1.00 0.00 C ATOM 1334 C GLY A 137 12.349 -10.240 -33.592 1.00 0.00 C ATOM 1335 O GLY A 137 13.231 -11.063 -33.321 1.00 0.00 O ATOM 0 H GLY A 137 9.550 -9.195 -32.728 1.00 0.00 H new ATOM 0 HA2 GLY A 137 10.722 -11.106 -32.494 1.00 0.00 H new ATOM 0 HA3 GLY A 137 10.653 -11.393 -34.222 1.00 0.00 H new ATOM 1339 N ALA A 138 12.600 -8.964 -33.970 1.00 0.00 N ATOM 1340 CA ALA A 138 13.938 -8.437 -34.303 1.00 0.00 C ATOM 1341 C ALA A 138 14.606 -9.272 -35.411 1.00 0.00 C ATOM 1342 O ALA A 138 15.446 -10.148 -35.146 1.00 0.00 O ATOM 1343 CB ALA A 138 14.835 -8.314 -33.062 1.00 0.00 C ATOM 0 H ALA A 138 11.864 -8.263 -34.052 1.00 0.00 H new ATOM 0 HA ALA A 138 13.801 -7.427 -34.690 1.00 0.00 H new ATOM 0 HB1 ALA A 138 15.809 -7.922 -33.355 1.00 0.00 H new ATOM 0 HB2 ALA A 138 14.372 -7.637 -32.344 1.00 0.00 H new ATOM 0 HB3 ALA A 138 14.961 -9.296 -32.605 1.00 0.00 H new ATOM 1349 N ASN A 139 14.186 -9.017 -36.661 1.00 0.00 N ATOM 1350 CA ASN A 139 14.724 -9.706 -37.857 1.00 0.00 C ATOM 1351 C ASN A 139 15.977 -8.987 -38.409 1.00 0.00 C ATOM 1352 O ASN A 139 16.391 -9.238 -39.547 1.00 0.00 O ATOM 1353 CB ASN A 139 13.611 -9.837 -38.941 1.00 0.00 C ATOM 1354 CG ASN A 139 12.981 -8.500 -39.349 1.00 0.00 C ATOM 1355 OD1 ASN A 139 13.457 -7.826 -40.261 1.00 0.00 O ATOM 1356 ND2 ASN A 139 11.892 -8.117 -38.685 1.00 0.00 N ATOM 0 H ASN A 139 13.465 -8.329 -36.876 1.00 0.00 H new ATOM 0 HA ASN A 139 15.040 -10.708 -37.567 1.00 0.00 H new ATOM 0 HB2 ASN A 139 14.033 -10.313 -39.826 1.00 0.00 H new ATOM 0 HB3 ASN A 139 12.829 -10.497 -38.566 1.00 0.00 H new ATOM 0 HD21 ASN A 139 11.428 -7.242 -38.928 1.00 0.00 H new ATOM 0 HD22 ASN A 139 11.522 -8.699 -37.933 1.00 0.00 H new ATOM 1363 N ASN A 140 16.595 -8.125 -37.571 1.00 0.00 N ATOM 1364 CA ASN A 140 17.794 -7.351 -37.928 1.00 0.00 C ATOM 1365 C ASN A 140 18.440 -6.772 -36.647 1.00 0.00 C ATOM 1366 O ASN A 140 17.738 -6.506 -35.665 1.00 0.00 O ATOM 1367 CB ASN A 140 17.411 -6.221 -38.927 1.00 0.00 C ATOM 1368 CG ASN A 140 18.603 -5.450 -39.492 1.00 0.00 C ATOM 1369 OD1 ASN A 140 19.712 -5.966 -39.597 1.00 0.00 O ATOM 1370 ND2 ASN A 140 18.374 -4.212 -39.885 1.00 0.00 N ATOM 0 H ASN A 140 16.269 -7.949 -36.621 1.00 0.00 H new ATOM 0 HA ASN A 140 18.522 -8.001 -38.413 1.00 0.00 H new ATOM 0 HB2 ASN A 140 16.851 -6.658 -39.754 1.00 0.00 H new ATOM 0 HB3 ASN A 140 16.744 -5.519 -38.426 1.00 0.00 H new ATOM 0 HD21 ASN A 140 19.129 -3.657 -40.289 1.00 0.00 H new ATOM 0 HD22 ASN A 140 17.442 -3.809 -39.785 1.00 0.00 H new ATOM 1377 N ALA A 141 19.779 -6.590 -36.672 1.00 0.00 N ATOM 1378 CA ALA A 141 20.555 -6.043 -35.530 1.00 0.00 C ATOM 1379 C ALA A 141 20.468 -4.506 -35.459 1.00 0.00 C ATOM 1380 O ALA A 141 20.749 -3.904 -34.413 1.00 0.00 O ATOM 1381 CB ALA A 141 22.028 -6.476 -35.637 1.00 0.00 C ATOM 0 H ALA A 141 20.355 -6.817 -37.483 1.00 0.00 H new ATOM 0 HA ALA A 141 20.119 -6.444 -34.615 1.00 0.00 H new ATOM 0 HB1 ALA A 141 22.589 -6.070 -34.795 1.00 0.00 H new ATOM 0 HB2 ALA A 141 22.089 -7.564 -35.623 1.00 0.00 H new ATOM 0 HB3 ALA A 141 22.451 -6.101 -36.569 1.00 0.00 H new ATOM 1387 N PHE A 142 20.107 -3.886 -36.595 1.00 0.00 N ATOM 1388 CA PHE A 142 19.931 -2.426 -36.706 1.00 0.00 C ATOM 1389 C PHE A 142 18.596 -2.001 -36.037 1.00 0.00 C ATOM 1390 O PHE A 142 17.818 -2.856 -35.604 1.00 0.00 O ATOM 1391 CB PHE A 142 20.002 -2.024 -38.212 1.00 0.00 C ATOM 1392 CG PHE A 142 20.199 -0.533 -38.485 1.00 0.00 C ATOM 1393 CD1 PHE A 142 21.422 0.083 -38.217 1.00 0.00 C ATOM 1394 CD2 PHE A 142 19.171 0.251 -39.018 1.00 0.00 C ATOM 1395 CE1 PHE A 142 21.603 1.433 -38.453 1.00 0.00 C ATOM 1396 CE2 PHE A 142 19.356 1.601 -39.251 1.00 0.00 C ATOM 1397 CZ PHE A 142 20.576 2.189 -38.978 1.00 0.00 C ATOM 0 H PHE A 142 19.928 -4.385 -37.467 1.00 0.00 H new ATOM 0 HA PHE A 142 20.728 -1.900 -36.180 1.00 0.00 H new ATOM 0 HB2 PHE A 142 20.820 -2.572 -38.679 1.00 0.00 H new ATOM 0 HB3 PHE A 142 19.083 -2.347 -38.700 1.00 0.00 H new ATOM 0 HD1 PHE A 142 22.238 -0.503 -37.820 1.00 0.00 H new ATOM 0 HD2 PHE A 142 18.220 -0.204 -39.251 1.00 0.00 H new ATOM 0 HE1 PHE A 142 22.551 1.897 -38.226 1.00 0.00 H new ATOM 0 HE2 PHE A 142 18.546 2.196 -39.647 1.00 0.00 H new ATOM 0 HZ PHE A 142 20.725 3.240 -39.176 1.00 0.00 H new ATOM 1407 N THR A 143 18.320 -0.687 -36.021 1.00 0.00 N ATOM 1408 CA THR A 143 17.235 -0.081 -35.238 1.00 0.00 C ATOM 1409 C THR A 143 15.837 -0.517 -35.738 1.00 0.00 C ATOM 1410 O THR A 143 15.522 -0.396 -36.929 1.00 0.00 O ATOM 1411 CB THR A 143 17.363 1.476 -35.327 1.00 0.00 C ATOM 1412 OG1 THR A 143 18.684 1.874 -34.914 1.00 0.00 O ATOM 1413 CG2 THR A 143 16.310 2.214 -34.477 1.00 0.00 C ATOM 0 H THR A 143 18.854 -0.006 -36.561 1.00 0.00 H new ATOM 0 HA THR A 143 17.329 -0.421 -34.207 1.00 0.00 H new ATOM 0 HB THR A 143 17.186 1.754 -36.366 1.00 0.00 H new ATOM 0 HG1 THR A 143 18.879 2.770 -35.260 1.00 0.00 H new ATOM 0 HG21 THR A 143 16.449 3.290 -34.579 1.00 0.00 H new ATOM 0 HG22 THR A 143 15.311 1.943 -34.819 1.00 0.00 H new ATOM 0 HG23 THR A 143 16.424 1.931 -33.431 1.00 0.00 H new ATOM 1421 N MET A 144 15.023 -1.036 -34.795 1.00 0.00 N ATOM 1422 CA MET A 144 13.629 -1.462 -35.042 1.00 0.00 C ATOM 1423 C MET A 144 12.680 -0.659 -34.116 1.00 0.00 C ATOM 1424 O MET A 144 13.148 -0.054 -33.136 1.00 0.00 O ATOM 1425 CB MET A 144 13.469 -2.999 -34.777 1.00 0.00 C ATOM 1426 CG MET A 144 13.400 -3.399 -33.294 1.00 0.00 C ATOM 1427 SD MET A 144 13.384 -5.182 -33.040 1.00 0.00 S ATOM 1428 CE MET A 144 13.656 -5.277 -31.268 1.00 0.00 C ATOM 0 H MET A 144 15.319 -1.173 -33.829 1.00 0.00 H new ATOM 0 HA MET A 144 13.374 -1.268 -36.084 1.00 0.00 H new ATOM 0 HB2 MET A 144 12.563 -3.346 -35.274 1.00 0.00 H new ATOM 0 HB3 MET A 144 14.306 -3.521 -35.240 1.00 0.00 H new ATOM 0 HG2 MET A 144 14.254 -2.971 -32.769 1.00 0.00 H new ATOM 0 HG3 MET A 144 12.504 -2.967 -32.849 1.00 0.00 H new ATOM 0 HE1 MET A 144 13.566 -6.313 -30.941 1.00 0.00 H new ATOM 0 HE2 MET A 144 14.654 -4.908 -31.033 1.00 0.00 H new ATOM 0 HE3 MET A 144 12.913 -4.668 -30.753 1.00 0.00 H new ATOM 1438 N PRO A 145 11.343 -0.618 -34.414 1.00 0.00 N ATOM 1439 CA PRO A 145 10.331 -0.072 -33.475 1.00 0.00 C ATOM 1440 C PRO A 145 10.047 -1.007 -32.266 1.00 0.00 C ATOM 1441 O PRO A 145 10.495 -2.160 -32.227 1.00 0.00 O ATOM 1442 CB PRO A 145 9.087 0.101 -34.378 1.00 0.00 C ATOM 1443 CG PRO A 145 9.233 -0.955 -35.424 1.00 0.00 C ATOM 1444 CD PRO A 145 10.716 -1.050 -35.701 1.00 0.00 C ATOM 0 HA PRO A 145 10.660 0.853 -33.002 1.00 0.00 H new ATOM 0 HB2 PRO A 145 8.165 -0.027 -33.811 1.00 0.00 H new ATOM 0 HB3 PRO A 145 9.054 1.096 -34.821 1.00 0.00 H new ATOM 0 HG2 PRO A 145 8.837 -1.909 -35.076 1.00 0.00 H new ATOM 0 HG3 PRO A 145 8.682 -0.692 -36.327 1.00 0.00 H new ATOM 0 HD2 PRO A 145 11.009 -2.065 -35.969 1.00 0.00 H new ATOM 0 HD3 PRO A 145 11.012 -0.404 -36.528 1.00 0.00 H new ATOM 1452 N LEU A 146 9.288 -0.478 -31.295 1.00 0.00 N ATOM 1453 CA LEU A 146 8.944 -1.163 -30.032 1.00 0.00 C ATOM 1454 C LEU A 146 7.662 -0.532 -29.452 1.00 0.00 C ATOM 1455 O LEU A 146 7.497 0.693 -29.496 1.00 0.00 O ATOM 1456 CB LEU A 146 10.127 -1.043 -29.018 1.00 0.00 C ATOM 1457 CG LEU A 146 9.873 -1.574 -27.565 1.00 0.00 C ATOM 1458 CD1 LEU A 146 9.519 -3.063 -27.559 1.00 0.00 C ATOM 1459 CD2 LEU A 146 11.077 -1.285 -26.634 1.00 0.00 C ATOM 0 H LEU A 146 8.886 0.457 -31.363 1.00 0.00 H new ATOM 0 HA LEU A 146 8.767 -2.222 -30.222 1.00 0.00 H new ATOM 0 HB2 LEU A 146 10.982 -1.578 -29.430 1.00 0.00 H new ATOM 0 HB3 LEU A 146 10.411 0.007 -28.951 1.00 0.00 H new ATOM 0 HG LEU A 146 9.013 -1.030 -27.174 1.00 0.00 H new ATOM 0 HD11 LEU A 146 9.350 -3.393 -26.534 1.00 0.00 H new ATOM 0 HD12 LEU A 146 8.614 -3.224 -28.145 1.00 0.00 H new ATOM 0 HD13 LEU A 146 10.340 -3.634 -27.993 1.00 0.00 H new ATOM 0 HD21 LEU A 146 10.865 -1.667 -25.636 1.00 0.00 H new ATOM 0 HD22 LEU A 146 11.968 -1.775 -27.028 1.00 0.00 H new ATOM 0 HD23 LEU A 146 11.247 -0.210 -26.582 1.00 0.00 H new ATOM 1471 N HIS A 147 6.754 -1.373 -28.917 1.00 0.00 N ATOM 1472 CA HIS A 147 5.488 -0.912 -28.297 1.00 0.00 C ATOM 1473 C HIS A 147 5.574 -1.059 -26.773 1.00 0.00 C ATOM 1474 O HIS A 147 5.574 -2.178 -26.270 1.00 0.00 O ATOM 1475 CB HIS A 147 4.282 -1.721 -28.840 1.00 0.00 C ATOM 1476 CG HIS A 147 4.046 -1.592 -30.321 1.00 0.00 C ATOM 1477 ND1 HIS A 147 4.594 -0.593 -31.102 1.00 0.00 N ATOM 1478 CD2 HIS A 147 3.303 -2.350 -31.159 1.00 0.00 C ATOM 1479 CE1 HIS A 147 4.196 -0.746 -32.346 1.00 0.00 C ATOM 1480 NE2 HIS A 147 3.415 -1.802 -32.407 1.00 0.00 N ATOM 0 H HIS A 147 6.873 -2.386 -28.901 1.00 0.00 H new ATOM 0 HA HIS A 147 5.339 0.137 -28.552 1.00 0.00 H new ATOM 0 HB2 HIS A 147 4.433 -2.774 -28.601 1.00 0.00 H new ATOM 0 HB3 HIS A 147 3.382 -1.401 -28.314 1.00 0.00 H new ATOM 0 HD2 HIS A 147 2.728 -3.225 -30.892 1.00 0.00 H new ATOM 0 HE1 HIS A 147 4.465 -0.111 -33.177 1.00 0.00 H new ATOM 0 HE2 HIS A 147 2.964 -2.156 -33.251 1.00 0.00 H new ATOM 1489 N MET A 148 5.653 0.073 -26.052 1.00 0.00 N ATOM 1490 CA MET A 148 5.740 0.101 -24.570 1.00 0.00 C ATOM 1491 C MET A 148 4.369 0.480 -23.998 1.00 0.00 C ATOM 1492 O MET A 148 3.495 0.936 -24.739 1.00 0.00 O ATOM 1493 CB MET A 148 6.824 1.098 -24.050 1.00 0.00 C ATOM 1494 CG MET A 148 8.121 1.149 -24.862 1.00 0.00 C ATOM 1495 SD MET A 148 7.835 1.787 -26.530 1.00 0.00 S ATOM 1496 CE MET A 148 9.504 2.043 -27.110 1.00 0.00 C ATOM 0 H MET A 148 5.659 1.001 -26.476 1.00 0.00 H new ATOM 0 HA MET A 148 6.037 -0.893 -24.235 1.00 0.00 H new ATOM 0 HB2 MET A 148 6.391 2.098 -24.028 1.00 0.00 H new ATOM 0 HB3 MET A 148 7.071 0.834 -23.022 1.00 0.00 H new ATOM 0 HG2 MET A 148 8.847 1.780 -24.350 1.00 0.00 H new ATOM 0 HG3 MET A 148 8.553 0.150 -24.923 1.00 0.00 H new ATOM 0 HE1 MET A 148 9.519 2.869 -27.821 1.00 0.00 H new ATOM 0 HE2 MET A 148 10.150 2.280 -26.265 1.00 0.00 H new ATOM 0 HE3 MET A 148 9.863 1.137 -27.598 1.00 0.00 H new ATOM 1506 N THR A 149 4.166 0.247 -22.690 1.00 0.00 N ATOM 1507 CA THR A 149 2.927 0.626 -21.990 1.00 0.00 C ATOM 1508 C THR A 149 3.242 1.118 -20.562 1.00 0.00 C ATOM 1509 O THR A 149 4.156 0.602 -19.910 1.00 0.00 O ATOM 1510 CB THR A 149 1.921 -0.572 -21.945 1.00 0.00 C ATOM 1511 OG1 THR A 149 1.644 -1.019 -23.277 1.00 0.00 O ATOM 1512 CG2 THR A 149 0.596 -0.200 -21.264 1.00 0.00 C ATOM 0 H THR A 149 4.854 -0.208 -22.090 1.00 0.00 H new ATOM 0 HA THR A 149 2.461 1.441 -22.544 1.00 0.00 H new ATOM 0 HB THR A 149 2.391 -1.362 -21.359 1.00 0.00 H new ATOM 0 HG1 THR A 149 1.015 -1.770 -23.246 1.00 0.00 H new ATOM 0 HG21 THR A 149 -0.066 -1.066 -21.259 1.00 0.00 H new ATOM 0 HG22 THR A 149 0.790 0.115 -20.239 1.00 0.00 H new ATOM 0 HG23 THR A 149 0.123 0.616 -21.810 1.00 0.00 H new ATOM 1520 N PHE A 150 2.481 2.137 -20.117 1.00 0.00 N ATOM 1521 CA PHE A 150 2.537 2.685 -18.753 1.00 0.00 C ATOM 1522 C PHE A 150 1.425 2.062 -17.882 1.00 0.00 C ATOM 1523 O PHE A 150 0.229 2.223 -18.187 1.00 0.00 O ATOM 1524 CB PHE A 150 2.318 4.220 -18.767 1.00 0.00 C ATOM 1525 CG PHE A 150 3.405 5.047 -19.444 1.00 0.00 C ATOM 1526 CD1 PHE A 150 4.664 5.165 -18.867 1.00 0.00 C ATOM 1527 CD2 PHE A 150 3.150 5.744 -20.624 1.00 0.00 C ATOM 1528 CE1 PHE A 150 5.635 5.958 -19.441 1.00 0.00 C ATOM 1529 CE2 PHE A 150 4.121 6.531 -21.198 1.00 0.00 C ATOM 1530 CZ PHE A 150 5.365 6.639 -20.607 1.00 0.00 C ATOM 0 H PHE A 150 1.798 2.609 -20.709 1.00 0.00 H new ATOM 0 HA PHE A 150 3.521 2.451 -18.346 1.00 0.00 H new ATOM 0 HB2 PHE A 150 1.370 4.427 -19.264 1.00 0.00 H new ATOM 0 HB3 PHE A 150 2.219 4.562 -17.737 1.00 0.00 H new ATOM 0 HD1 PHE A 150 4.885 4.628 -17.956 1.00 0.00 H new ATOM 0 HD2 PHE A 150 2.180 5.665 -21.092 1.00 0.00 H new ATOM 0 HE1 PHE A 150 6.606 6.045 -18.977 1.00 0.00 H new ATOM 0 HE2 PHE A 150 3.911 7.066 -22.113 1.00 0.00 H new ATOM 0 HZ PHE A 150 6.126 7.258 -21.060 1.00 0.00 H new ATOM 1540 N TRP A 151 1.827 1.363 -16.812 1.00 0.00 N ATOM 1541 CA TRP A 151 0.919 0.928 -15.731 1.00 0.00 C ATOM 1542 C TRP A 151 1.346 1.627 -14.431 1.00 0.00 C ATOM 1543 O TRP A 151 2.531 1.651 -14.113 1.00 0.00 O ATOM 1544 CB TRP A 151 0.963 -0.611 -15.556 1.00 0.00 C ATOM 1545 CG TRP A 151 0.404 -1.383 -16.728 1.00 0.00 C ATOM 1546 CD1 TRP A 151 -0.915 -1.498 -17.077 1.00 0.00 C ATOM 1547 CD2 TRP A 151 1.137 -2.146 -17.700 1.00 0.00 C ATOM 1548 NE1 TRP A 151 -1.044 -2.293 -18.185 1.00 0.00 N ATOM 1549 CE2 TRP A 151 0.197 -2.700 -18.589 1.00 0.00 C ATOM 1550 CE3 TRP A 151 2.496 -2.411 -17.904 1.00 0.00 C ATOM 1551 CZ2 TRP A 151 0.567 -3.509 -19.662 1.00 0.00 C ATOM 1552 CZ3 TRP A 151 2.862 -3.217 -18.969 1.00 0.00 C ATOM 1553 CH2 TRP A 151 1.902 -3.754 -19.839 1.00 0.00 C ATOM 0 H TRP A 151 2.796 1.080 -16.667 1.00 0.00 H new ATOM 0 HA TRP A 151 -0.106 1.199 -15.984 1.00 0.00 H new ATOM 0 HB2 TRP A 151 1.996 -0.918 -15.393 1.00 0.00 H new ATOM 0 HB3 TRP A 151 0.405 -0.880 -14.659 1.00 0.00 H new ATOM 0 HD1 TRP A 151 -1.736 -1.029 -16.554 1.00 0.00 H new ATOM 0 HE1 TRP A 151 -1.924 -2.541 -18.636 1.00 0.00 H new ATOM 0 HE3 TRP A 151 3.244 -1.996 -17.245 1.00 0.00 H new ATOM 0 HZ2 TRP A 151 -0.172 -3.927 -20.329 1.00 0.00 H new ATOM 0 HZ3 TRP A 151 3.907 -3.436 -19.133 1.00 0.00 H new ATOM 0 HH2 TRP A 151 2.222 -4.373 -20.664 1.00 0.00 H new ATOM 1564 N GLY A 152 0.392 2.199 -13.692 1.00 0.00 N ATOM 1565 CA GLY A 152 0.709 2.945 -12.471 1.00 0.00 C ATOM 1566 C GLY A 152 -0.518 3.179 -11.612 1.00 0.00 C ATOM 1567 O GLY A 152 -1.314 2.269 -11.412 1.00 0.00 O ATOM 0 H GLY A 152 -0.602 2.160 -13.916 1.00 0.00 H new ATOM 0 HA2 GLY A 152 1.455 2.397 -11.895 1.00 0.00 H new ATOM 0 HA3 GLY A 152 1.153 3.904 -12.737 1.00 0.00 H new ATOM 1571 N LYS A 153 -0.669 4.402 -11.100 1.00 0.00 N ATOM 1572 CA LYS A 153 -1.825 4.802 -10.280 1.00 0.00 C ATOM 1573 C LYS A 153 -2.140 6.290 -10.531 1.00 0.00 C ATOM 1574 O LYS A 153 -1.302 7.002 -11.085 1.00 0.00 O ATOM 1575 CB LYS A 153 -1.518 4.497 -8.794 1.00 0.00 C ATOM 1576 CG LYS A 153 -0.328 5.283 -8.193 1.00 0.00 C ATOM 1577 CD LYS A 153 0.231 4.643 -6.895 1.00 0.00 C ATOM 1578 CE LYS A 153 -0.848 4.369 -5.836 1.00 0.00 C ATOM 1579 NZ LYS A 153 -1.502 5.607 -5.356 1.00 0.00 N ATOM 0 H LYS A 153 0.009 5.151 -11.241 1.00 0.00 H new ATOM 0 HA LYS A 153 -2.714 4.235 -10.555 1.00 0.00 H new ATOM 0 HB2 LYS A 153 -2.409 4.711 -8.204 1.00 0.00 H new ATOM 0 HB3 LYS A 153 -1.317 3.431 -8.692 1.00 0.00 H new ATOM 0 HG2 LYS A 153 0.470 5.345 -8.933 1.00 0.00 H new ATOM 0 HG3 LYS A 153 -0.645 6.304 -7.980 1.00 0.00 H new ATOM 0 HD2 LYS A 153 0.729 3.707 -7.146 1.00 0.00 H new ATOM 0 HD3 LYS A 153 0.987 5.303 -6.470 1.00 0.00 H new ATOM 0 HE2 LYS A 153 -1.602 3.703 -6.255 1.00 0.00 H new ATOM 0 HE3 LYS A 153 -0.398 3.849 -4.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 -2.288 5.361 -4.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 -0.810 6.188 -4.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 -1.868 6.144 -6.168 1.00 0.00 H new ATOM 1593 N GLU A 154 -3.336 6.754 -10.113 1.00 0.00 N ATOM 1594 CA GLU A 154 -3.890 8.058 -10.554 1.00 0.00 C ATOM 1595 C GLU A 154 -3.080 9.277 -10.053 1.00 0.00 C ATOM 1596 O GLU A 154 -2.982 10.289 -10.759 1.00 0.00 O ATOM 1597 CB GLU A 154 -5.380 8.208 -10.143 1.00 0.00 C ATOM 1598 CG GLU A 154 -6.311 7.096 -10.672 1.00 0.00 C ATOM 1599 CD GLU A 154 -7.810 7.416 -10.488 1.00 0.00 C ATOM 1600 OE1 GLU A 154 -8.271 7.523 -9.333 1.00 0.00 O ATOM 1601 OE2 GLU A 154 -8.537 7.564 -11.502 1.00 0.00 O ATOM 0 H GLU A 154 -3.941 6.245 -9.468 1.00 0.00 H new ATOM 0 HA GLU A 154 -3.813 8.051 -11.641 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -5.442 8.228 -9.055 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -5.746 9.170 -10.501 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -6.108 6.935 -11.731 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -6.080 6.163 -10.158 1.00 0.00 H new ATOM 1608 N GLU A 155 -2.505 9.188 -8.842 1.00 0.00 N ATOM 1609 CA GLU A 155 -1.642 10.271 -8.304 1.00 0.00 C ATOM 1610 C GLU A 155 -0.302 10.336 -9.075 1.00 0.00 C ATOM 1611 O GLU A 155 0.263 11.416 -9.267 1.00 0.00 O ATOM 1612 CB GLU A 155 -1.406 10.090 -6.780 1.00 0.00 C ATOM 1613 CG GLU A 155 -0.732 8.764 -6.386 1.00 0.00 C ATOM 1614 CD GLU A 155 -0.465 8.638 -4.882 1.00 0.00 C ATOM 1615 OE1 GLU A 155 -1.367 8.192 -4.146 1.00 0.00 O ATOM 1616 OE2 GLU A 155 0.648 8.979 -4.430 1.00 0.00 O ATOM 0 H GLU A 155 -2.616 8.389 -8.217 1.00 0.00 H new ATOM 0 HA GLU A 155 -2.158 11.220 -8.447 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -0.791 10.915 -6.421 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -2.365 10.161 -6.267 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -1.364 7.935 -6.706 1.00 0.00 H new ATOM 0 HG3 GLU A 155 0.212 8.671 -6.924 1.00 0.00 H new ATOM 1623 N ASN A 156 0.172 9.165 -9.540 1.00 0.00 N ATOM 1624 CA ASN A 156 1.439 9.039 -10.288 1.00 0.00 C ATOM 1625 C ASN A 156 1.242 9.324 -11.792 1.00 0.00 C ATOM 1626 O ASN A 156 2.201 9.719 -12.470 1.00 0.00 O ATOM 1627 CB ASN A 156 2.054 7.626 -10.091 1.00 0.00 C ATOM 1628 CG ASN A 156 2.626 7.373 -8.693 1.00 0.00 C ATOM 1629 OD1 ASN A 156 2.154 7.913 -7.700 1.00 0.00 O ATOM 1630 ND2 ASN A 156 3.662 6.548 -8.609 1.00 0.00 N ATOM 0 H ASN A 156 -0.313 8.277 -9.408 1.00 0.00 H new ATOM 0 HA ASN A 156 2.127 9.785 -9.890 1.00 0.00 H new ATOM 0 HB2 ASN A 156 1.288 6.878 -10.298 1.00 0.00 H new ATOM 0 HB3 ASN A 156 2.846 7.483 -10.826 1.00 0.00 H new ATOM 0 HD21 ASN A 156 4.084 6.351 -7.702 1.00 0.00 H new ATOM 0 HD22 ASN A 156 4.036 6.111 -9.452 1.00 0.00 H new ATOM 1637 N ARG A 157 -0.002 9.129 -12.310 1.00 0.00 N ATOM 1638 CA ARG A 157 -0.304 9.326 -13.751 1.00 0.00 C ATOM 1639 C ARG A 157 -0.221 10.827 -14.102 1.00 0.00 C ATOM 1640 O ARG A 157 0.120 11.194 -15.223 1.00 0.00 O ATOM 1641 CB ARG A 157 -1.690 8.739 -14.173 1.00 0.00 C ATOM 1642 CG ARG A 157 -2.899 9.641 -13.861 1.00 0.00 C ATOM 1643 CD ARG A 157 -4.243 9.053 -14.292 1.00 0.00 C ATOM 1644 NE ARG A 157 -5.355 9.922 -13.861 1.00 0.00 N ATOM 1645 CZ ARG A 157 -6.609 9.517 -13.641 1.00 0.00 C ATOM 1646 NH1 ARG A 157 -6.973 8.275 -13.921 1.00 0.00 N ATOM 1647 NH2 ARG A 157 -7.499 10.375 -13.179 1.00 0.00 N ATOM 0 H ARG A 157 -0.805 8.837 -11.753 1.00 0.00 H new ATOM 0 HA ARG A 157 0.447 8.772 -14.315 1.00 0.00 H new ATOM 0 HB2 ARG A 157 -1.672 8.538 -15.244 1.00 0.00 H new ATOM 0 HB3 ARG A 157 -1.831 7.782 -13.671 1.00 0.00 H new ATOM 0 HG2 ARG A 157 -2.927 9.836 -12.789 1.00 0.00 H new ATOM 0 HG3 ARG A 157 -2.759 10.602 -14.356 1.00 0.00 H new ATOM 0 HD2 ARG A 157 -4.264 8.937 -15.376 1.00 0.00 H new ATOM 0 HD3 ARG A 157 -4.365 8.058 -13.863 1.00 0.00 H new ATOM 0 HE ARG A 157 -5.150 10.911 -13.720 1.00 0.00 H new ATOM 0 HH11 ARG A 157 -6.294 7.619 -14.308 1.00 0.00 H new ATOM 0 HH12 ARG A 157 -7.932 7.974 -13.750 1.00 0.00 H new ATOM 0 HH21 ARG A 157 -7.228 11.340 -12.992 1.00 0.00 H new ATOM 0 HH22 ARG A 157 -8.458 10.073 -13.009 1.00 0.00 H new ATOM 1661 N LYS A 158 -0.544 11.670 -13.104 1.00 0.00 N ATOM 1662 CA LYS A 158 -0.426 13.134 -13.190 1.00 0.00 C ATOM 1663 C LYS A 158 1.046 13.551 -13.357 1.00 0.00 C ATOM 1664 O LYS A 158 1.357 14.466 -14.115 1.00 0.00 O ATOM 1665 CB LYS A 158 -1.024 13.775 -11.907 1.00 0.00 C ATOM 1666 CG LYS A 158 -0.853 15.311 -11.791 1.00 0.00 C ATOM 1667 CD LYS A 158 -1.333 15.863 -10.426 1.00 0.00 C ATOM 1668 CE LYS A 158 -1.023 17.358 -10.250 1.00 0.00 C ATOM 1669 NZ LYS A 158 -1.743 18.208 -11.233 1.00 0.00 N ATOM 0 H LYS A 158 -0.899 11.347 -12.204 1.00 0.00 H new ATOM 0 HA LYS A 158 -0.978 13.484 -14.062 1.00 0.00 H new ATOM 0 HB2 LYS A 158 -2.088 13.541 -11.866 1.00 0.00 H new ATOM 0 HB3 LYS A 158 -0.561 13.308 -11.038 1.00 0.00 H new ATOM 0 HG2 LYS A 158 0.197 15.568 -11.934 1.00 0.00 H new ATOM 0 HG3 LYS A 158 -1.411 15.796 -12.592 1.00 0.00 H new ATOM 0 HD2 LYS A 158 -2.407 15.705 -10.332 1.00 0.00 H new ATOM 0 HD3 LYS A 158 -0.857 15.300 -9.623 1.00 0.00 H new ATOM 0 HE2 LYS A 158 -1.295 17.666 -9.240 1.00 0.00 H new ATOM 0 HE3 LYS A 158 0.050 17.518 -10.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 -1.500 19.206 -11.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 -1.465 17.935 -12.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 -2.769 18.078 -11.119 1.00 0.00 H new ATOM 1683 N ALA A 159 1.935 12.853 -12.636 1.00 0.00 N ATOM 1684 CA ALA A 159 3.369 13.170 -12.594 1.00 0.00 C ATOM 1685 C ALA A 159 4.099 12.710 -13.874 1.00 0.00 C ATOM 1686 O ALA A 159 4.973 13.424 -14.383 1.00 0.00 O ATOM 1687 CB ALA A 159 3.995 12.555 -11.340 1.00 0.00 C ATOM 0 H ALA A 159 1.678 12.049 -12.063 1.00 0.00 H new ATOM 0 HA ALA A 159 3.480 14.253 -12.548 1.00 0.00 H new ATOM 0 HB1 ALA A 159 5.059 12.791 -11.311 1.00 0.00 H new ATOM 0 HB2 ALA A 159 3.509 12.962 -10.454 1.00 0.00 H new ATOM 0 HB3 ALA A 159 3.864 11.473 -11.361 1.00 0.00 H new ATOM 1693 N VAL A 160 3.753 11.505 -14.390 1.00 0.00 N ATOM 1694 CA VAL A 160 4.314 11.008 -15.674 1.00 0.00 C ATOM 1695 C VAL A 160 3.781 11.857 -16.851 1.00 0.00 C ATOM 1696 O VAL A 160 4.525 12.142 -17.792 1.00 0.00 O ATOM 1697 CB VAL A 160 4.057 9.460 -15.909 1.00 0.00 C ATOM 1698 CG1 VAL A 160 2.571 9.097 -15.823 1.00 0.00 C ATOM 1699 CG2 VAL A 160 4.648 8.965 -17.257 1.00 0.00 C ATOM 0 H VAL A 160 3.096 10.865 -13.944 1.00 0.00 H new ATOM 0 HA VAL A 160 5.397 11.121 -15.618 1.00 0.00 H new ATOM 0 HB VAL A 160 4.578 8.948 -15.100 1.00 0.00 H new ATOM 0 HG11 VAL A 160 2.448 8.027 -15.991 1.00 0.00 H new ATOM 0 HG12 VAL A 160 2.190 9.356 -14.835 1.00 0.00 H new ATOM 0 HG13 VAL A 160 2.017 9.650 -16.582 1.00 0.00 H new ATOM 0 HG21 VAL A 160 4.447 7.900 -17.373 1.00 0.00 H new ATOM 0 HG22 VAL A 160 4.188 9.513 -18.079 1.00 0.00 H new ATOM 0 HG23 VAL A 160 5.725 9.134 -17.266 1.00 0.00 H new ATOM 1709 N SER A 161 2.509 12.303 -16.750 1.00 0.00 N ATOM 1710 CA SER A 161 1.897 13.235 -17.720 1.00 0.00 C ATOM 1711 C SER A 161 2.705 14.537 -17.752 1.00 0.00 C ATOM 1712 O SER A 161 3.261 14.899 -18.784 1.00 0.00 O ATOM 1713 CB SER A 161 0.421 13.528 -17.347 1.00 0.00 C ATOM 1714 OG SER A 161 -0.229 14.309 -18.335 1.00 0.00 O ATOM 0 H SER A 161 1.880 12.027 -15.996 1.00 0.00 H new ATOM 0 HA SER A 161 1.909 12.775 -18.708 1.00 0.00 H new ATOM 0 HB2 SER A 161 -0.114 12.587 -17.218 1.00 0.00 H new ATOM 0 HB3 SER A 161 0.385 14.049 -16.390 1.00 0.00 H new ATOM 0 HG SER A 161 -1.157 14.471 -18.065 1.00 0.00 H new ATOM 1720 N ASP A 162 2.804 15.165 -16.574 1.00 0.00 N ATOM 1721 CA ASP A 162 3.561 16.408 -16.328 1.00 0.00 C ATOM 1722 C ASP A 162 4.939 16.386 -17.019 1.00 0.00 C ATOM 1723 O ASP A 162 5.258 17.290 -17.774 1.00 0.00 O ATOM 1724 CB ASP A 162 3.733 16.607 -14.789 1.00 0.00 C ATOM 1725 CG ASP A 162 4.702 17.741 -14.387 1.00 0.00 C ATOM 1726 OD1 ASP A 162 4.273 18.911 -14.308 1.00 0.00 O ATOM 1727 OD2 ASP A 162 5.904 17.463 -14.130 1.00 0.00 O ATOM 0 H ASP A 162 2.345 14.813 -15.734 1.00 0.00 H new ATOM 0 HA ASP A 162 3.000 17.241 -16.752 1.00 0.00 H new ATOM 0 HB2 ASP A 162 2.756 16.811 -14.352 1.00 0.00 H new ATOM 0 HB3 ASP A 162 4.088 15.673 -14.353 1.00 0.00 H new ATOM 1732 N GLN A 163 5.694 15.295 -16.793 1.00 0.00 N ATOM 1733 CA GLN A 163 7.087 15.162 -17.264 1.00 0.00 C ATOM 1734 C GLN A 163 7.161 15.009 -18.808 1.00 0.00 C ATOM 1735 O GLN A 163 8.061 15.569 -19.447 1.00 0.00 O ATOM 1736 CB GLN A 163 7.786 13.956 -16.564 1.00 0.00 C ATOM 1737 CG GLN A 163 9.332 14.009 -16.585 1.00 0.00 C ATOM 1738 CD GLN A 163 9.896 15.152 -15.734 1.00 0.00 C ATOM 1739 OE1 GLN A 163 10.092 16.263 -16.215 1.00 0.00 O ATOM 1740 NE2 GLN A 163 10.140 14.893 -14.455 1.00 0.00 N ATOM 0 H GLN A 163 5.357 14.481 -16.279 1.00 0.00 H new ATOM 0 HA GLN A 163 7.612 16.079 -16.998 1.00 0.00 H new ATOM 0 HB2 GLN A 163 7.451 13.910 -15.528 1.00 0.00 H new ATOM 0 HB3 GLN A 163 7.460 13.034 -17.046 1.00 0.00 H new ATOM 0 HG2 GLN A 163 9.729 13.061 -16.222 1.00 0.00 H new ATOM 0 HG3 GLN A 163 9.674 14.125 -17.614 1.00 0.00 H new ATOM 0 HE21 GLN A 163 9.968 13.960 -14.082 1.00 0.00 H new ATOM 0 HE22 GLN A 163 10.500 15.628 -13.846 1.00 0.00 H new ATOM 1749 N LEU A 164 6.207 14.248 -19.391 1.00 0.00 N ATOM 1750 CA LEU A 164 6.151 13.995 -20.856 1.00 0.00 C ATOM 1751 C LEU A 164 5.709 15.255 -21.641 1.00 0.00 C ATOM 1752 O LEU A 164 6.133 15.452 -22.776 1.00 0.00 O ATOM 1753 CB LEU A 164 5.209 12.800 -21.182 1.00 0.00 C ATOM 1754 CG LEU A 164 5.667 11.402 -20.652 1.00 0.00 C ATOM 1755 CD1 LEU A 164 4.620 10.315 -20.966 1.00 0.00 C ATOM 1756 CD2 LEU A 164 7.057 11.011 -21.205 1.00 0.00 C ATOM 0 H LEU A 164 5.459 13.794 -18.868 1.00 0.00 H new ATOM 0 HA LEU A 164 7.162 13.740 -21.174 1.00 0.00 H new ATOM 0 HB2 LEU A 164 4.223 13.017 -20.771 1.00 0.00 H new ATOM 0 HB3 LEU A 164 5.096 12.737 -22.264 1.00 0.00 H new ATOM 0 HG LEU A 164 5.755 11.479 -19.568 1.00 0.00 H new ATOM 0 HD11 LEU A 164 4.967 9.355 -20.585 1.00 0.00 H new ATOM 0 HD12 LEU A 164 3.674 10.573 -20.491 1.00 0.00 H new ATOM 0 HD13 LEU A 164 4.478 10.248 -22.045 1.00 0.00 H new ATOM 0 HD21 LEU A 164 7.342 10.034 -20.815 1.00 0.00 H new ATOM 0 HD22 LEU A 164 7.017 10.970 -22.293 1.00 0.00 H new ATOM 0 HD23 LEU A 164 7.793 11.753 -20.897 1.00 0.00 H new ATOM 1768 N LYS A 165 4.845 16.084 -21.026 1.00 0.00 N ATOM 1769 CA LYS A 165 4.366 17.363 -21.616 1.00 0.00 C ATOM 1770 C LYS A 165 5.462 18.443 -21.493 1.00 0.00 C ATOM 1771 O LYS A 165 5.706 19.221 -22.426 1.00 0.00 O ATOM 1772 CB LYS A 165 3.048 17.846 -20.908 1.00 0.00 C ATOM 1773 CG LYS A 165 1.723 17.202 -21.407 1.00 0.00 C ATOM 1774 CD LYS A 165 1.713 15.658 -21.338 1.00 0.00 C ATOM 1775 CE LYS A 165 0.315 15.052 -21.527 1.00 0.00 C ATOM 1776 NZ LYS A 165 -0.298 15.437 -22.827 1.00 0.00 N ATOM 0 H LYS A 165 4.454 15.892 -20.104 1.00 0.00 H new ATOM 0 HA LYS A 165 4.146 17.196 -22.670 1.00 0.00 H new ATOM 0 HB2 LYS A 165 3.142 17.651 -19.840 1.00 0.00 H new ATOM 0 HB3 LYS A 165 2.970 18.926 -21.029 1.00 0.00 H new ATOM 0 HG2 LYS A 165 0.896 17.588 -20.811 1.00 0.00 H new ATOM 0 HG3 LYS A 165 1.545 17.511 -22.437 1.00 0.00 H new ATOM 0 HD2 LYS A 165 2.380 15.262 -22.104 1.00 0.00 H new ATOM 0 HD3 LYS A 165 2.112 15.341 -20.374 1.00 0.00 H new ATOM 0 HE2 LYS A 165 0.382 13.966 -21.467 1.00 0.00 H new ATOM 0 HE3 LYS A 165 -0.332 15.377 -20.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 165 -1.240 15.004 -22.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 165 -0.387 16.472 -22.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 165 0.304 15.104 -23.607 1.00 0.00 H new ATOM 1790 N LYS A 166 6.113 18.453 -20.319 1.00 0.00 N ATOM 1791 CA LYS A 166 7.115 19.464 -19.927 1.00 0.00 C ATOM 1792 C LYS A 166 8.391 19.335 -20.776 1.00 0.00 C ATOM 1793 O LYS A 166 8.860 20.312 -21.364 1.00 0.00 O ATOM 1794 CB LYS A 166 7.422 19.292 -18.415 1.00 0.00 C ATOM 1795 CG LYS A 166 8.411 20.293 -17.781 1.00 0.00 C ATOM 1796 CD LYS A 166 8.461 20.144 -16.237 1.00 0.00 C ATOM 1797 CE LYS A 166 7.103 20.454 -15.572 1.00 0.00 C ATOM 1798 NZ LYS A 166 7.091 20.129 -14.120 1.00 0.00 N ATOM 0 H LYS A 166 5.957 17.746 -19.600 1.00 0.00 H new ATOM 0 HA LYS A 166 6.719 20.464 -20.105 1.00 0.00 H new ATOM 0 HB2 LYS A 166 6.481 19.355 -17.869 1.00 0.00 H new ATOM 0 HB3 LYS A 166 7.813 18.286 -18.261 1.00 0.00 H new ATOM 0 HG2 LYS A 166 9.407 20.134 -18.195 1.00 0.00 H new ATOM 0 HG3 LYS A 166 8.117 21.310 -18.040 1.00 0.00 H new ATOM 0 HD2 LYS A 166 8.764 19.128 -15.982 1.00 0.00 H new ATOM 0 HD3 LYS A 166 9.221 20.814 -15.834 1.00 0.00 H new ATOM 0 HE2 LYS A 166 6.869 21.510 -15.706 1.00 0.00 H new ATOM 0 HE3 LYS A 166 6.319 19.888 -16.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 166 6.411 20.746 -13.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 166 6.813 19.135 -13.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 166 8.041 20.278 -13.723 1.00 0.00 H new ATOM 1812 N HIS A 167 8.925 18.107 -20.843 1.00 0.00 N ATOM 1813 CA HIS A 167 10.146 17.796 -21.612 1.00 0.00 C ATOM 1814 C HIS A 167 9.821 17.573 -23.100 1.00 0.00 C ATOM 1815 O HIS A 167 10.641 17.873 -23.969 1.00 0.00 O ATOM 1816 CB HIS A 167 10.855 16.549 -21.022 1.00 0.00 C ATOM 1817 CG HIS A 167 11.522 16.780 -19.692 1.00 0.00 C ATOM 1818 ND1 HIS A 167 12.582 16.025 -19.252 1.00 0.00 N ATOM 1819 CD2 HIS A 167 11.291 17.696 -18.718 1.00 0.00 C ATOM 1820 CE1 HIS A 167 12.970 16.459 -18.074 1.00 0.00 C ATOM 1821 NE2 HIS A 167 12.209 17.474 -17.726 1.00 0.00 N ATOM 0 H HIS A 167 8.525 17.299 -20.367 1.00 0.00 H new ATOM 0 HA HIS A 167 10.819 18.650 -21.536 1.00 0.00 H new ATOM 0 HB2 HIS A 167 10.123 15.749 -20.913 1.00 0.00 H new ATOM 0 HB3 HIS A 167 11.604 16.202 -21.734 1.00 0.00 H new ATOM 0 HD1 HIS A 167 13.003 15.248 -19.761 1.00 0.00 H new ATOM 0 HD2 HIS A 167 10.526 18.458 -18.724 1.00 0.00 H new ATOM 0 HE1 HIS A 167 13.780 16.050 -17.488 1.00 0.00 H new ATOM 1830 N GLY A 168 8.623 17.019 -23.373 1.00 0.00 N ATOM 1831 CA GLY A 168 8.189 16.713 -24.745 1.00 0.00 C ATOM 1832 C GLY A 168 8.764 15.402 -25.285 1.00 0.00 C ATOM 1833 O GLY A 168 8.427 14.990 -26.398 1.00 0.00 O ATOM 0 H GLY A 168 7.939 16.775 -22.657 1.00 0.00 H new ATOM 0 HA2 GLY A 168 7.101 16.662 -24.771 1.00 0.00 H new ATOM 0 HA3 GLY A 168 8.486 17.530 -25.403 1.00 0.00 H new ATOM 1837 N PHE A 169 9.620 14.740 -24.478 1.00 0.00 N ATOM 1838 CA PHE A 169 10.345 13.518 -24.863 1.00 0.00 C ATOM 1839 C PHE A 169 9.579 12.270 -24.412 1.00 0.00 C ATOM 1840 O PHE A 169 9.153 12.189 -23.262 1.00 0.00 O ATOM 1841 CB PHE A 169 11.765 13.526 -24.244 1.00 0.00 C ATOM 1842 CG PHE A 169 12.700 14.574 -24.840 1.00 0.00 C ATOM 1843 CD1 PHE A 169 13.157 14.438 -26.151 1.00 0.00 C ATOM 1844 CD2 PHE A 169 13.131 15.676 -24.105 1.00 0.00 C ATOM 1845 CE1 PHE A 169 14.012 15.368 -26.703 1.00 0.00 C ATOM 1846 CE2 PHE A 169 13.990 16.608 -24.661 1.00 0.00 C ATOM 1847 CZ PHE A 169 14.430 16.452 -25.960 1.00 0.00 C ATOM 0 H PHE A 169 9.827 15.047 -23.528 1.00 0.00 H new ATOM 0 HA PHE A 169 10.431 13.494 -25.949 1.00 0.00 H new ATOM 0 HB2 PHE A 169 11.681 13.698 -23.171 1.00 0.00 H new ATOM 0 HB3 PHE A 169 12.212 12.540 -24.374 1.00 0.00 H new ATOM 0 HD1 PHE A 169 12.837 13.593 -26.742 1.00 0.00 H new ATOM 0 HD2 PHE A 169 12.790 15.805 -23.088 1.00 0.00 H new ATOM 0 HE1 PHE A 169 14.355 15.247 -27.720 1.00 0.00 H new ATOM 0 HE2 PHE A 169 14.316 17.457 -24.079 1.00 0.00 H new ATOM 0 HZ PHE A 169 15.101 17.178 -26.394 1.00 0.00 H new ATOM 1857 N LYS A 170 9.425 11.308 -25.340 1.00 0.00 N ATOM 1858 CA LYS A 170 8.756 10.020 -25.095 1.00 0.00 C ATOM 1859 C LYS A 170 9.150 9.018 -26.202 1.00 0.00 C ATOM 1860 O LYS A 170 8.880 9.259 -27.386 1.00 0.00 O ATOM 1861 CB LYS A 170 7.205 10.209 -25.004 1.00 0.00 C ATOM 1862 CG LYS A 170 6.575 11.057 -26.142 1.00 0.00 C ATOM 1863 CD LYS A 170 5.055 11.298 -25.963 1.00 0.00 C ATOM 1864 CE LYS A 170 4.243 9.998 -25.884 1.00 0.00 C ATOM 1865 NZ LYS A 170 2.788 10.261 -25.755 1.00 0.00 N ATOM 0 H LYS A 170 9.768 11.407 -26.296 1.00 0.00 H new ATOM 0 HA LYS A 170 9.083 9.617 -24.136 1.00 0.00 H new ATOM 0 HB2 LYS A 170 6.735 9.226 -25.002 1.00 0.00 H new ATOM 0 HB3 LYS A 170 6.967 10.678 -24.049 1.00 0.00 H new ATOM 0 HG2 LYS A 170 7.084 12.019 -26.192 1.00 0.00 H new ATOM 0 HG3 LYS A 170 6.746 10.556 -27.095 1.00 0.00 H new ATOM 0 HD2 LYS A 170 4.890 11.878 -25.055 1.00 0.00 H new ATOM 0 HD3 LYS A 170 4.688 11.898 -26.796 1.00 0.00 H new ATOM 0 HE2 LYS A 170 4.426 9.401 -26.777 1.00 0.00 H new ATOM 0 HE3 LYS A 170 4.582 9.409 -25.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 170 2.275 9.358 -25.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 170 2.610 10.809 -24.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 170 2.458 10.801 -26.581 1.00 0.00 H new ATOM 1879 N LEU A 171 9.835 7.920 -25.813 1.00 0.00 N ATOM 1880 CA LEU A 171 10.243 6.847 -26.751 1.00 0.00 C ATOM 1881 C LEU A 171 9.295 5.655 -26.546 1.00 0.00 C ATOM 1882 O LEU A 171 9.483 4.914 -25.559 1.00 0.00 O ATOM 1883 CB LEU A 171 11.748 6.453 -26.526 1.00 0.00 C ATOM 1884 CG LEU A 171 12.491 5.741 -27.725 1.00 0.00 C ATOM 1885 CD1 LEU A 171 14.014 5.997 -27.687 1.00 0.00 C ATOM 1886 CD2 LEU A 171 12.221 4.227 -27.757 1.00 0.00 C ATOM 1887 OXT LEU A 171 8.344 5.501 -27.342 1.00 0.00 O ATOM 0 H LEU A 171 10.120 7.752 -24.848 1.00 0.00 H new ATOM 0 HA LEU A 171 10.169 7.190 -27.783 1.00 0.00 H new ATOM 0 HB2 LEU A 171 12.301 7.358 -26.275 1.00 0.00 H new ATOM 0 HB3 LEU A 171 11.800 5.796 -25.658 1.00 0.00 H new ATOM 0 HG LEU A 171 12.085 6.180 -28.636 1.00 0.00 H new ATOM 0 HD11 LEU A 171 14.489 5.491 -28.527 1.00 0.00 H new ATOM 0 HD12 LEU A 171 14.205 7.068 -27.753 1.00 0.00 H new ATOM 0 HD13 LEU A 171 14.424 5.613 -26.753 1.00 0.00 H new ATOM 0 HD21 LEU A 171 12.752 3.780 -28.598 1.00 0.00 H new ATOM 0 HD22 LEU A 171 12.568 3.776 -26.827 1.00 0.00 H new ATOM 0 HD23 LEU A 171 11.151 4.050 -27.869 1.00 0.00 H new