USER MOD reduce.3.24.130724 H: found=0, std=0, add=1038, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1040 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 132 GLN : amide:sc= 0.314 K(o=0.94,f=-0.68) USER MOD Set 1.2: A 135 GLN :FLIP amide:sc= 0.624 F(o=-0.27,f=0.94) USER MOD Set 2.1: A 29 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 128 CYS SG : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 133:sc= 0.563 USER MOD Single : A 17 GLN :FLIP amide:sc= -4.71! C(o=-6.8!,f=-4.7!) USER MOD Single : A 19 GLN : amide:sc= -2.2! X(o=-2.2!,f=-2) USER MOD Single : A 23 MET CE :methyl 173:sc= -2.83! (180deg=-3.2!) USER MOD Single : A 25 MET CE :methyl 136:sc= -3.92! (180deg=-5.73!) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 33 GLN : amide:sc= -0.207 X(o=-0.21,f=-0.042) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc=-0.00394 X(o=-0.0039,f=-0.0039) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -0.0323 K(o=-0.032,f=-1.1) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ -139:sc= 0 (180deg=-0.645) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -0.427 X(o=-0.43,f=-0.094) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 154:sc= -0.0936 (180deg=-0.566) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 MET CE :methyl 145:sc= -0.104 (180deg=-2.51) USER MOD Single : A 85 HIS :FLIP no HD1:sc= -0.86 F(o=-2.6!,f=-0.86) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 180:sc= -1.18 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 GLN : amide:sc= 0 K(o=0,f=-0.95) USER MOD Single : A 98 SER OG : rot 138:sc= 1.15 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 104 HIS : no HD1:sc= -0.0536 X(o=-0.054,f=-0.088) USER MOD Single : A 105 GLN :FLIP amide:sc= -0.0529 F(o=-0.82,f=-0.053) USER MOD Single : A 106 GLN : amide:sc= -0.402 X(o=-0.4,f=-0.034) USER MOD Single : A 110 ASN : amide:sc= -0.0966 K(o=-0.097,f=-1.6) USER MOD Single : A 111 LYS NZ :NH3+ 149:sc= -0.0348 (180deg=-0.215) USER MOD Single : A 114 THR OG1 : rot -6:sc= 0.323 USER MOD Single : A 115 SER OG : rot 80:sc= 1.09 USER MOD Single : A 116 TYR OH : rot 165:sc= 0 USER MOD Single : A 119 THR OG1 : rot -52:sc= 1.12 USER MOD Single : A 126 CYS SG : rot 180:sc= 0 USER MOD Single : A 137 ASN : amide:sc= 0.335 X(o=0.33,f=0) USER MOD Single : A 138 SER OG : rot 140:sc= 0 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 104 N SER A 11 -4.393 22.050 -2.205 1.00 0.00 N ATOM 105 CA SER A 11 -3.017 22.350 -2.583 1.00 0.00 C ATOM 106 C SER A 11 -2.164 21.085 -2.583 1.00 0.00 C ATOM 107 O SER A 11 -2.075 20.383 -1.576 1.00 0.00 O ATOM 108 CB SER A 11 -2.417 23.383 -1.626 1.00 0.00 C ATOM 109 OG SER A 11 -1.098 23.728 -2.011 1.00 0.00 O ATOM 0 HA SER A 11 -3.025 22.761 -3.593 1.00 0.00 H new ATOM 0 HB2 SER A 11 -3.041 24.277 -1.613 1.00 0.00 H new ATOM 0 HB3 SER A 11 -2.411 22.983 -0.612 1.00 0.00 H new ATOM 0 HG SER A 11 -0.737 24.390 -1.385 1.00 0.00 H new ATOM 115 N VAL A 12 -1.539 20.800 -3.721 1.00 0.00 N ATOM 116 CA VAL A 12 -0.693 19.620 -3.853 1.00 0.00 C ATOM 117 C VAL A 12 0.180 19.429 -2.618 1.00 0.00 C ATOM 118 O VAL A 12 0.546 18.306 -2.271 1.00 0.00 O ATOM 119 CB VAL A 12 0.211 19.715 -5.097 1.00 0.00 C ATOM 120 CG1 VAL A 12 1.166 18.532 -5.155 1.00 0.00 C ATOM 121 CG2 VAL A 12 -0.631 19.793 -6.362 1.00 0.00 C ATOM 0 H VAL A 12 -1.603 21.370 -4.564 1.00 0.00 H new ATOM 0 HA VAL A 12 -1.358 18.763 -3.960 1.00 0.00 H new ATOM 0 HB VAL A 12 0.804 20.627 -5.025 1.00 0.00 H new ATOM 0 HG11 VAL A 12 1.796 18.616 -6.040 1.00 0.00 H new ATOM 0 HG12 VAL A 12 1.792 18.526 -4.263 1.00 0.00 H new ATOM 0 HG13 VAL A 12 0.595 17.605 -5.204 1.00 0.00 H new ATOM 0 HG21 VAL A 12 0.023 19.860 -7.231 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -1.251 18.900 -6.442 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -1.270 20.675 -6.320 1.00 0.00 H new ATOM 131 N LYS A 13 0.511 20.533 -1.957 1.00 0.00 N ATOM 132 CA LYS A 13 1.340 20.488 -0.759 1.00 0.00 C ATOM 133 C LYS A 13 0.831 19.431 0.216 1.00 0.00 C ATOM 134 O LYS A 13 1.605 18.623 0.728 1.00 0.00 O ATOM 135 CB LYS A 13 1.360 21.858 -0.076 1.00 0.00 C ATOM 136 CG LYS A 13 2.121 22.915 -0.858 1.00 0.00 C ATOM 137 CD LYS A 13 2.318 24.180 -0.038 1.00 0.00 C ATOM 138 CE LYS A 13 3.300 25.130 -0.707 1.00 0.00 C ATOM 139 NZ LYS A 13 3.473 26.387 0.072 1.00 0.00 N ATOM 0 H LYS A 13 0.217 21.471 -2.231 1.00 0.00 H new ATOM 0 HA LYS A 13 2.354 20.223 -1.059 1.00 0.00 H new ATOM 0 HB2 LYS A 13 0.334 22.196 0.073 1.00 0.00 H new ATOM 0 HB3 LYS A 13 1.808 21.756 0.912 1.00 0.00 H new ATOM 0 HG2 LYS A 13 3.092 22.519 -1.157 1.00 0.00 H new ATOM 0 HG3 LYS A 13 1.578 23.154 -1.773 1.00 0.00 H new ATOM 0 HD2 LYS A 13 1.359 24.681 0.096 1.00 0.00 H new ATOM 0 HD3 LYS A 13 2.683 23.918 0.955 1.00 0.00 H new ATOM 0 HE2 LYS A 13 4.265 24.636 -0.818 1.00 0.00 H new ATOM 0 HE3 LYS A 13 2.947 25.370 -1.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 4.149 27.008 -0.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 2.557 26.872 0.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 3.834 26.161 1.021 1.00 0.00 H new ATOM 153 N GLU A 14 -0.474 19.442 0.465 1.00 0.00 N ATOM 154 CA GLU A 14 -1.085 18.482 1.378 1.00 0.00 C ATOM 155 C GLU A 14 -0.946 17.059 0.844 1.00 0.00 C ATOM 156 O GLU A 14 -0.234 16.236 1.419 1.00 0.00 O ATOM 157 CB GLU A 14 -2.563 18.817 1.591 1.00 0.00 C ATOM 158 CG GLU A 14 -2.790 20.109 2.359 1.00 0.00 C ATOM 159 CD GLU A 14 -2.855 21.322 1.452 1.00 0.00 C ATOM 160 OE1 GLU A 14 -3.745 21.363 0.577 1.00 0.00 O ATOM 161 OE2 GLU A 14 -2.016 22.232 1.618 1.00 0.00 O ATOM 0 H GLU A 14 -1.129 20.104 0.048 1.00 0.00 H new ATOM 0 HA GLU A 14 -0.564 18.545 2.333 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -3.054 18.890 0.620 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -3.039 17.997 2.128 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -3.719 20.033 2.925 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -1.986 20.243 3.083 1.00 0.00 H new ATOM 168 N SER A 15 -1.633 16.778 -0.258 1.00 0.00 N ATOM 169 CA SER A 15 -1.591 15.454 -0.868 1.00 0.00 C ATOM 170 C SER A 15 -0.201 14.838 -0.734 1.00 0.00 C ATOM 171 O SER A 15 -0.059 13.675 -0.354 1.00 0.00 O ATOM 172 CB SER A 15 -1.985 15.536 -2.344 1.00 0.00 C ATOM 173 OG SER A 15 -1.229 16.527 -3.019 1.00 0.00 O ATOM 0 H SER A 15 -2.225 17.449 -0.747 1.00 0.00 H new ATOM 0 HA SER A 15 -2.304 14.817 -0.344 1.00 0.00 H new ATOM 0 HB2 SER A 15 -1.829 14.568 -2.820 1.00 0.00 H new ATOM 0 HB3 SER A 15 -3.047 15.765 -2.428 1.00 0.00 H new ATOM 0 HG SER A 15 -0.891 16.162 -3.863 1.00 0.00 H new ATOM 179 N LEU A 16 0.821 15.626 -1.050 1.00 0.00 N ATOM 180 CA LEU A 16 2.200 15.160 -0.965 1.00 0.00 C ATOM 181 C LEU A 16 2.679 15.135 0.483 1.00 0.00 C ATOM 182 O LEU A 16 3.399 14.225 0.892 1.00 0.00 O ATOM 183 CB LEU A 16 3.114 16.058 -1.801 1.00 0.00 C ATOM 184 CG LEU A 16 3.192 15.733 -3.293 1.00 0.00 C ATOM 185 CD1 LEU A 16 3.791 16.900 -4.063 1.00 0.00 C ATOM 186 CD2 LEU A 16 4.006 14.468 -3.522 1.00 0.00 C ATOM 0 H LEU A 16 0.720 16.590 -1.367 1.00 0.00 H new ATOM 0 HA LEU A 16 2.239 14.144 -1.358 1.00 0.00 H new ATOM 0 HB2 LEU A 16 2.777 17.089 -1.691 1.00 0.00 H new ATOM 0 HB3 LEU A 16 4.120 16.006 -1.385 1.00 0.00 H new ATOM 0 HG LEU A 16 2.180 15.562 -3.661 1.00 0.00 H new ATOM 0 HD11 LEU A 16 3.839 16.650 -5.123 1.00 0.00 H new ATOM 0 HD12 LEU A 16 3.168 17.784 -3.926 1.00 0.00 H new ATOM 0 HD13 LEU A 16 4.796 17.103 -3.693 1.00 0.00 H new ATOM 0 HD21 LEU A 16 4.051 14.252 -4.590 1.00 0.00 H new ATOM 0 HD22 LEU A 16 5.016 14.611 -3.138 1.00 0.00 H new ATOM 0 HD23 LEU A 16 3.535 13.633 -3.003 1.00 0.00 H new ATOM 198 N GLN A 17 2.272 16.139 1.253 1.00 0.00 N ATOM 199 CA GLN A 17 2.658 16.231 2.656 1.00 0.00 C ATOM 200 C GLN A 17 2.138 15.033 3.443 1.00 0.00 C ATOM 201 O GLN A 17 2.913 14.286 4.042 1.00 0.00 O ATOM 202 CB GLN A 17 2.129 17.528 3.269 1.00 0.00 C ATOM 203 CG GLN A 17 1.792 17.409 4.747 1.00 0.00 C ATOM 204 CD GLN A 17 2.814 16.595 5.515 1.00 0.00 C ATOM 205 OE1 GLN A 17 2.370 15.490 6.102 1.00 0.00 O flip ATOM 206 NE2 GLN A 17 3.990 16.955 5.579 1.00 0.00 N flip ATOM 0 H GLN A 17 1.675 16.900 0.929 1.00 0.00 H new ATOM 0 HA GLN A 17 3.747 16.232 2.708 1.00 0.00 H new ATOM 0 HB2 GLN A 17 2.874 18.313 3.137 1.00 0.00 H new ATOM 0 HB3 GLN A 17 1.237 17.840 2.725 1.00 0.00 H new ATOM 0 HG2 GLN A 17 1.726 18.406 5.182 1.00 0.00 H new ATOM 0 HG3 GLN A 17 0.810 16.948 4.856 1.00 0.00 H new ATOM 0 HE21 GLN A 17 4.287 17.812 5.112 1.00 0.00 H new ATOM 0 HE22 GLN A 17 4.667 16.396 6.099 1.00 0.00 H new ATOM 215 N LEU A 18 0.822 14.855 3.438 1.00 0.00 N ATOM 216 CA LEU A 18 0.197 13.747 4.152 1.00 0.00 C ATOM 217 C LEU A 18 0.829 12.417 3.754 1.00 0.00 C ATOM 218 O LEU A 18 0.920 11.495 4.565 1.00 0.00 O ATOM 219 CB LEU A 18 -1.306 13.715 3.870 1.00 0.00 C ATOM 220 CG LEU A 18 -2.185 14.528 4.821 1.00 0.00 C ATOM 221 CD1 LEU A 18 -1.729 15.978 4.861 1.00 0.00 C ATOM 222 CD2 LEU A 18 -3.646 14.438 4.405 1.00 0.00 C ATOM 0 H LEU A 18 0.167 15.464 2.947 1.00 0.00 H new ATOM 0 HA LEU A 18 0.357 13.899 5.219 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -1.473 14.076 2.855 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -1.639 12.677 3.898 1.00 0.00 H new ATOM 0 HG LEU A 18 -2.087 14.110 5.823 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -2.366 16.541 5.543 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -0.696 16.025 5.207 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -1.797 16.409 3.862 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -4.257 15.023 5.093 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -3.761 14.830 3.395 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.968 13.397 4.429 1.00 0.00 H new ATOM 234 N GLN A 19 1.265 12.326 2.502 1.00 0.00 N ATOM 235 CA GLN A 19 1.889 11.109 1.997 1.00 0.00 C ATOM 236 C GLN A 19 3.160 10.786 2.777 1.00 0.00 C ATOM 237 O GLN A 19 3.606 9.638 2.808 1.00 0.00 O ATOM 238 CB GLN A 19 2.213 11.256 0.509 1.00 0.00 C ATOM 239 CG GLN A 19 1.019 11.016 -0.400 1.00 0.00 C ATOM 240 CD GLN A 19 1.218 11.591 -1.788 1.00 0.00 C ATOM 241 OE1 GLN A 19 2.294 11.470 -2.375 1.00 0.00 O ATOM 242 NE2 GLN A 19 0.178 12.222 -2.323 1.00 0.00 N ATOM 0 H GLN A 19 1.198 13.080 1.819 1.00 0.00 H new ATOM 0 HA GLN A 19 1.185 10.288 2.128 1.00 0.00 H new ATOM 0 HB2 GLN A 19 2.602 12.258 0.328 1.00 0.00 H new ATOM 0 HB3 GLN A 19 3.005 10.555 0.247 1.00 0.00 H new ATOM 0 HG2 GLN A 19 0.836 9.944 -0.478 1.00 0.00 H new ATOM 0 HG3 GLN A 19 0.130 11.460 0.049 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -0.695 12.299 -1.801 1.00 0.00 H new ATOM 0 HE22 GLN A 19 0.253 12.629 -3.255 1.00 0.00 H new ATOM 251 N LEU A 20 3.738 11.804 3.404 1.00 0.00 N ATOM 252 CA LEU A 20 4.958 11.628 4.184 1.00 0.00 C ATOM 253 C LEU A 20 4.638 11.140 5.594 1.00 0.00 C ATOM 254 O LEU A 20 5.251 10.194 6.089 1.00 0.00 O ATOM 255 CB LEU A 20 5.737 12.943 4.253 1.00 0.00 C ATOM 256 CG LEU A 20 6.225 13.504 2.916 1.00 0.00 C ATOM 257 CD1 LEU A 20 7.056 14.759 3.136 1.00 0.00 C ATOM 258 CD2 LEU A 20 7.028 12.456 2.160 1.00 0.00 C ATOM 0 H LEU A 20 3.382 12.760 3.388 1.00 0.00 H new ATOM 0 HA LEU A 20 5.570 10.875 3.689 1.00 0.00 H new ATOM 0 HB2 LEU A 20 5.105 13.692 4.730 1.00 0.00 H new ATOM 0 HB3 LEU A 20 6.602 12.797 4.900 1.00 0.00 H new ATOM 0 HG LEU A 20 5.355 13.770 2.315 1.00 0.00 H new ATOM 0 HD11 LEU A 20 7.395 15.144 2.174 1.00 0.00 H new ATOM 0 HD12 LEU A 20 6.449 15.514 3.636 1.00 0.00 H new ATOM 0 HD13 LEU A 20 7.920 14.519 3.755 1.00 0.00 H new ATOM 0 HD21 LEU A 20 7.367 12.872 1.211 1.00 0.00 H new ATOM 0 HD22 LEU A 20 7.891 12.160 2.756 1.00 0.00 H new ATOM 0 HD23 LEU A 20 6.401 11.584 1.971 1.00 0.00 H new ATOM 270 N LEU A 21 3.672 11.790 6.234 1.00 0.00 N ATOM 271 CA LEU A 21 3.268 11.421 7.586 1.00 0.00 C ATOM 272 C LEU A 21 2.869 9.950 7.653 1.00 0.00 C ATOM 273 O LEU A 21 3.059 9.292 8.675 1.00 0.00 O ATOM 274 CB LEU A 21 2.104 12.299 8.049 1.00 0.00 C ATOM 275 CG LEU A 21 0.702 11.763 7.758 1.00 0.00 C ATOM 276 CD1 LEU A 21 0.368 10.607 8.688 1.00 0.00 C ATOM 277 CD2 LEU A 21 -0.331 12.873 7.891 1.00 0.00 C ATOM 0 H LEU A 21 3.154 12.575 5.838 1.00 0.00 H new ATOM 0 HA LEU A 21 4.119 11.578 8.249 1.00 0.00 H new ATOM 0 HB2 LEU A 21 2.196 12.453 9.124 1.00 0.00 H new ATOM 0 HB3 LEU A 21 2.203 13.277 7.577 1.00 0.00 H new ATOM 0 HG LEU A 21 0.680 11.394 6.732 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -0.634 10.239 8.466 1.00 0.00 H new ATOM 0 HD12 LEU A 21 1.090 9.803 8.544 1.00 0.00 H new ATOM 0 HD13 LEU A 21 0.408 10.949 9.722 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -1.323 12.474 7.680 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -0.308 13.272 8.905 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -0.103 13.669 7.183 1.00 0.00 H new ATOM 289 N GLU A 22 2.316 9.442 6.556 1.00 0.00 N ATOM 290 CA GLU A 22 1.891 8.049 6.491 1.00 0.00 C ATOM 291 C GLU A 22 3.087 7.125 6.276 1.00 0.00 C ATOM 292 O GLU A 22 3.105 5.994 6.760 1.00 0.00 O ATOM 293 CB GLU A 22 0.874 7.855 5.364 1.00 0.00 C ATOM 294 CG GLU A 22 1.382 8.300 4.002 1.00 0.00 C ATOM 295 CD GLU A 22 0.663 7.612 2.858 1.00 0.00 C ATOM 296 OE1 GLU A 22 0.204 6.466 3.048 1.00 0.00 O ATOM 297 OE2 GLU A 22 0.558 8.221 1.773 1.00 0.00 O ATOM 0 H GLU A 22 2.152 9.974 5.701 1.00 0.00 H new ATOM 0 HA GLU A 22 1.422 7.794 7.442 1.00 0.00 H new ATOM 0 HB2 GLU A 22 0.597 6.802 5.313 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -0.032 8.411 5.604 1.00 0.00 H new ATOM 0 HG2 GLU A 22 1.259 9.379 3.907 1.00 0.00 H new ATOM 0 HG3 GLU A 22 2.450 8.094 3.932 1.00 0.00 H new ATOM 304 N MET A 23 4.083 7.617 5.547 1.00 0.00 N ATOM 305 CA MET A 23 5.283 6.836 5.269 1.00 0.00 C ATOM 306 C MET A 23 5.922 6.340 6.563 1.00 0.00 C ATOM 307 O MET A 23 6.081 5.137 6.764 1.00 0.00 O ATOM 308 CB MET A 23 6.290 7.673 4.478 1.00 0.00 C ATOM 309 CG MET A 23 6.013 7.706 2.984 1.00 0.00 C ATOM 310 SD MET A 23 6.877 6.401 2.088 1.00 0.00 S ATOM 311 CE MET A 23 6.255 4.945 2.927 1.00 0.00 C ATOM 0 H MET A 23 4.083 8.552 5.138 1.00 0.00 H new ATOM 0 HA MET A 23 4.993 5.971 4.673 1.00 0.00 H new ATOM 0 HB2 MET A 23 6.284 8.693 4.863 1.00 0.00 H new ATOM 0 HB3 MET A 23 7.291 7.275 4.645 1.00 0.00 H new ATOM 0 HG2 MET A 23 4.941 7.609 2.815 1.00 0.00 H new ATOM 0 HG3 MET A 23 6.312 8.675 2.584 1.00 0.00 H new ATOM 0 HE1 MET A 23 6.600 4.051 2.408 1.00 0.00 H new ATOM 0 HE2 MET A 23 6.621 4.932 3.954 1.00 0.00 H new ATOM 0 HE3 MET A 23 5.165 4.965 2.931 1.00 0.00 H new ATOM 321 N GLU A 24 6.284 7.276 7.435 1.00 0.00 N ATOM 322 CA GLU A 24 6.906 6.932 8.708 1.00 0.00 C ATOM 323 C GLU A 24 6.066 5.907 9.465 1.00 0.00 C ATOM 324 O GLU A 24 6.600 5.027 10.139 1.00 0.00 O ATOM 325 CB GLU A 24 7.094 8.186 9.564 1.00 0.00 C ATOM 326 CG GLU A 24 5.814 8.667 10.228 1.00 0.00 C ATOM 327 CD GLU A 24 6.031 9.894 11.092 1.00 0.00 C ATOM 328 OE1 GLU A 24 6.022 11.016 10.543 1.00 0.00 O ATOM 329 OE2 GLU A 24 6.209 9.732 12.317 1.00 0.00 O ATOM 0 H GLU A 24 6.157 8.277 7.283 1.00 0.00 H new ATOM 0 HA GLU A 24 7.882 6.493 8.500 1.00 0.00 H new ATOM 0 HB2 GLU A 24 7.838 7.982 10.334 1.00 0.00 H new ATOM 0 HB3 GLU A 24 7.492 8.986 8.940 1.00 0.00 H new ATOM 0 HG2 GLU A 24 5.074 8.894 9.461 1.00 0.00 H new ATOM 0 HG3 GLU A 24 5.403 7.864 10.840 1.00 0.00 H new ATOM 336 N MET A 25 4.748 6.029 9.347 1.00 0.00 N ATOM 337 CA MET A 25 3.833 5.113 10.020 1.00 0.00 C ATOM 338 C MET A 25 3.900 3.723 9.396 1.00 0.00 C ATOM 339 O MET A 25 3.838 2.713 10.098 1.00 0.00 O ATOM 340 CB MET A 25 2.401 5.647 9.952 1.00 0.00 C ATOM 341 CG MET A 25 2.163 6.862 10.833 1.00 0.00 C ATOM 342 SD MET A 25 0.454 6.990 11.393 1.00 0.00 S ATOM 343 CE MET A 25 -0.236 8.060 10.133 1.00 0.00 C ATOM 0 H MET A 25 4.290 6.752 8.793 1.00 0.00 H new ATOM 0 HA MET A 25 4.136 5.038 11.064 1.00 0.00 H new ATOM 0 HB2 MET A 25 2.167 5.906 8.919 1.00 0.00 H new ATOM 0 HB3 MET A 25 1.712 4.855 10.246 1.00 0.00 H new ATOM 0 HG2 MET A 25 2.822 6.812 11.700 1.00 0.00 H new ATOM 0 HG3 MET A 25 2.429 7.764 10.281 1.00 0.00 H new ATOM 0 HE1 MET A 25 -1.206 7.674 9.819 1.00 0.00 H new ATOM 0 HE2 MET A 25 -0.359 9.065 10.536 1.00 0.00 H new ATOM 0 HE3 MET A 25 0.436 8.093 9.275 1.00 0.00 H new ATOM 353 N LEU A 26 4.026 3.678 8.074 1.00 0.00 N ATOM 354 CA LEU A 26 4.101 2.411 7.355 1.00 0.00 C ATOM 355 C LEU A 26 5.365 1.644 7.733 1.00 0.00 C ATOM 356 O LEU A 26 5.322 0.440 7.986 1.00 0.00 O ATOM 357 CB LEU A 26 4.071 2.655 5.846 1.00 0.00 C ATOM 358 CG LEU A 26 2.696 2.932 5.238 1.00 0.00 C ATOM 359 CD1 LEU A 26 2.836 3.646 3.903 1.00 0.00 C ATOM 360 CD2 LEU A 26 1.915 1.636 5.072 1.00 0.00 C ATOM 0 H LEU A 26 4.078 4.504 7.478 1.00 0.00 H new ATOM 0 HA LEU A 26 3.236 1.811 7.636 1.00 0.00 H new ATOM 0 HB2 LEU A 26 4.722 3.500 5.622 1.00 0.00 H new ATOM 0 HB3 LEU A 26 4.497 1.784 5.349 1.00 0.00 H new ATOM 0 HG LEU A 26 2.144 3.581 5.918 1.00 0.00 H new ATOM 0 HD11 LEU A 26 1.847 3.835 3.486 1.00 0.00 H new ATOM 0 HD12 LEU A 26 3.355 4.593 4.050 1.00 0.00 H new ATOM 0 HD13 LEU A 26 3.407 3.023 3.215 1.00 0.00 H new ATOM 0 HD21 LEU A 26 0.939 1.852 4.638 1.00 0.00 H new ATOM 0 HD22 LEU A 26 2.464 0.962 4.414 1.00 0.00 H new ATOM 0 HD23 LEU A 26 1.783 1.164 6.045 1.00 0.00 H new ATOM 372 N PHE A 27 6.490 2.351 7.770 1.00 0.00 N ATOM 373 CA PHE A 27 7.767 1.738 8.118 1.00 0.00 C ATOM 374 C PHE A 27 7.678 1.023 9.463 1.00 0.00 C ATOM 375 O PHE A 27 8.046 -0.146 9.582 1.00 0.00 O ATOM 376 CB PHE A 27 8.870 2.797 8.163 1.00 0.00 C ATOM 377 CG PHE A 27 9.313 3.260 6.805 1.00 0.00 C ATOM 378 CD1 PHE A 27 9.746 2.348 5.855 1.00 0.00 C ATOM 379 CD2 PHE A 27 9.296 4.606 6.477 1.00 0.00 C ATOM 380 CE1 PHE A 27 10.154 2.770 4.604 1.00 0.00 C ATOM 381 CE2 PHE A 27 9.702 5.034 5.227 1.00 0.00 C ATOM 382 CZ PHE A 27 10.133 4.115 4.290 1.00 0.00 C ATOM 0 H PHE A 27 6.543 3.348 7.563 1.00 0.00 H new ATOM 0 HA PHE A 27 8.010 1.003 7.351 1.00 0.00 H new ATOM 0 HB2 PHE A 27 8.515 3.656 8.733 1.00 0.00 H new ATOM 0 HB3 PHE A 27 9.729 2.393 8.698 1.00 0.00 H new ATOM 0 HD1 PHE A 27 9.765 1.295 6.095 1.00 0.00 H new ATOM 0 HD2 PHE A 27 8.962 5.329 7.206 1.00 0.00 H new ATOM 0 HE1 PHE A 27 10.489 2.049 3.873 1.00 0.00 H new ATOM 0 HE2 PHE A 27 9.682 6.086 4.983 1.00 0.00 H new ATOM 0 HZ PHE A 27 10.453 4.448 3.314 1.00 0.00 H new ATOM 392 N SER A 28 7.188 1.733 10.474 1.00 0.00 N ATOM 393 CA SER A 28 7.054 1.169 11.812 1.00 0.00 C ATOM 394 C SER A 28 6.370 -0.193 11.761 1.00 0.00 C ATOM 395 O SER A 28 6.878 -1.176 12.300 1.00 0.00 O ATOM 396 CB SER A 28 6.260 2.118 12.712 1.00 0.00 C ATOM 397 OG SER A 28 6.157 1.604 14.028 1.00 0.00 O ATOM 0 H SER A 28 6.877 2.701 10.392 1.00 0.00 H new ATOM 0 HA SER A 28 8.054 1.039 12.226 1.00 0.00 H new ATOM 0 HB2 SER A 28 6.746 3.093 12.736 1.00 0.00 H new ATOM 0 HB3 SER A 28 5.263 2.269 12.298 1.00 0.00 H new ATOM 0 HG SER A 28 5.647 2.229 14.584 1.00 0.00 H new ATOM 403 N MET A 29 5.213 -0.243 11.108 1.00 0.00 N ATOM 404 CA MET A 29 4.458 -1.485 10.985 1.00 0.00 C ATOM 405 C MET A 29 5.310 -2.578 10.349 1.00 0.00 C ATOM 406 O MET A 29 5.238 -3.743 10.741 1.00 0.00 O ATOM 407 CB MET A 29 3.194 -1.259 10.154 1.00 0.00 C ATOM 408 CG MET A 29 2.041 -0.670 10.949 1.00 0.00 C ATOM 409 SD MET A 29 0.449 -0.889 10.131 1.00 0.00 S ATOM 410 CE MET A 29 0.631 0.217 8.734 1.00 0.00 C ATOM 0 H MET A 29 4.778 0.562 10.656 1.00 0.00 H new ATOM 0 HA MET A 29 4.172 -1.808 11.986 1.00 0.00 H new ATOM 0 HB2 MET A 29 3.429 -0.593 9.324 1.00 0.00 H new ATOM 0 HB3 MET A 29 2.879 -2.209 9.722 1.00 0.00 H new ATOM 0 HG2 MET A 29 2.007 -1.138 11.933 1.00 0.00 H new ATOM 0 HG3 MET A 29 2.220 0.393 11.108 1.00 0.00 H new ATOM 0 HE1 MET A 29 -0.276 0.192 8.130 1.00 0.00 H new ATOM 0 HE2 MET A 29 0.800 1.232 9.093 1.00 0.00 H new ATOM 0 HE3 MET A 29 1.480 -0.099 8.128 1.00 0.00 H new ATOM 420 N PHE A 30 6.117 -2.196 9.365 1.00 0.00 N ATOM 421 CA PHE A 30 6.983 -3.144 8.674 1.00 0.00 C ATOM 422 C PHE A 30 8.448 -2.900 9.025 1.00 0.00 C ATOM 423 O PHE A 30 9.194 -2.267 8.278 1.00 0.00 O ATOM 424 CB PHE A 30 6.785 -3.038 7.160 1.00 0.00 C ATOM 425 CG PHE A 30 5.348 -3.144 6.735 1.00 0.00 C ATOM 426 CD1 PHE A 30 4.708 -4.372 6.709 1.00 0.00 C ATOM 427 CD2 PHE A 30 4.639 -2.014 6.359 1.00 0.00 C ATOM 428 CE1 PHE A 30 3.385 -4.472 6.319 1.00 0.00 C ATOM 429 CE2 PHE A 30 3.316 -2.108 5.968 1.00 0.00 C ATOM 430 CZ PHE A 30 2.689 -3.339 5.947 1.00 0.00 C ATOM 0 H PHE A 30 6.189 -1.236 9.028 1.00 0.00 H new ATOM 0 HA PHE A 30 6.713 -4.148 9.000 1.00 0.00 H new ATOM 0 HB2 PHE A 30 7.189 -2.086 6.814 1.00 0.00 H new ATOM 0 HB3 PHE A 30 7.359 -3.824 6.670 1.00 0.00 H new ATOM 0 HD1 PHE A 30 5.248 -5.262 6.997 1.00 0.00 H new ATOM 0 HD2 PHE A 30 5.125 -1.050 6.372 1.00 0.00 H new ATOM 0 HE1 PHE A 30 2.897 -5.435 6.305 1.00 0.00 H new ATOM 0 HE2 PHE A 30 2.773 -1.220 5.679 1.00 0.00 H new ATOM 0 HZ PHE A 30 1.656 -3.415 5.640 1.00 0.00 H new ATOM 440 N PRO A 31 8.870 -3.414 10.189 1.00 0.00 N ATOM 441 CA PRO A 31 10.248 -3.265 10.667 1.00 0.00 C ATOM 442 C PRO A 31 11.239 -4.075 9.838 1.00 0.00 C ATOM 443 O PRO A 31 12.344 -3.615 9.551 1.00 0.00 O ATOM 444 CB PRO A 31 10.186 -3.800 12.100 1.00 0.00 C ATOM 445 CG PRO A 31 9.033 -4.744 12.103 1.00 0.00 C ATOM 446 CD PRO A 31 8.035 -4.180 11.130 1.00 0.00 C ATOM 0 HA PRO A 31 10.595 -2.234 10.597 1.00 0.00 H new ATOM 0 HB2 PRO A 31 11.112 -4.305 12.374 1.00 0.00 H new ATOM 0 HB3 PRO A 31 10.039 -2.993 12.818 1.00 0.00 H new ATOM 0 HG2 PRO A 31 9.347 -5.744 11.805 1.00 0.00 H new ATOM 0 HG3 PRO A 31 8.601 -4.829 13.100 1.00 0.00 H new ATOM 0 HD2 PRO A 31 7.478 -4.968 10.623 1.00 0.00 H new ATOM 0 HD3 PRO A 31 7.304 -3.543 11.628 1.00 0.00 H new ATOM 454 N ASN A 32 10.837 -5.282 9.456 1.00 0.00 N ATOM 455 CA ASN A 32 11.691 -6.156 8.659 1.00 0.00 C ATOM 456 C ASN A 32 11.906 -5.580 7.263 1.00 0.00 C ATOM 457 O ASN A 32 10.950 -5.235 6.569 1.00 0.00 O ATOM 458 CB ASN A 32 11.074 -7.552 8.558 1.00 0.00 C ATOM 459 CG ASN A 32 11.120 -8.302 9.876 1.00 0.00 C ATOM 460 OD1 ASN A 32 12.163 -8.374 10.525 1.00 0.00 O ATOM 461 ND2 ASN A 32 9.985 -8.864 10.276 1.00 0.00 N ATOM 0 H ASN A 32 9.925 -5.678 9.685 1.00 0.00 H new ATOM 0 HA ASN A 32 12.659 -6.229 9.155 1.00 0.00 H new ATOM 0 HB2 ASN A 32 10.039 -7.466 8.228 1.00 0.00 H new ATOM 0 HB3 ASN A 32 11.604 -8.126 7.798 1.00 0.00 H new ATOM 0 HD21 ASN A 32 9.954 -9.381 11.154 1.00 0.00 H new ATOM 0 HD22 ASN A 32 9.144 -8.778 9.705 1.00 0.00 H new ATOM 468 N GLN A 33 13.168 -5.481 6.858 1.00 0.00 N ATOM 469 CA GLN A 33 13.509 -4.947 5.545 1.00 0.00 C ATOM 470 C GLN A 33 12.830 -5.748 4.439 1.00 0.00 C ATOM 471 O GLN A 33 12.328 -6.847 4.673 1.00 0.00 O ATOM 472 CB GLN A 33 15.025 -4.960 5.343 1.00 0.00 C ATOM 473 CG GLN A 33 15.717 -3.705 5.848 1.00 0.00 C ATOM 474 CD GLN A 33 16.113 -3.803 7.308 1.00 0.00 C ATOM 475 OE1 GLN A 33 15.742 -2.957 8.122 1.00 0.00 O ATOM 476 NE2 GLN A 33 16.870 -4.840 7.648 1.00 0.00 N ATOM 0 H GLN A 33 13.971 -5.764 7.420 1.00 0.00 H new ATOM 0 HA GLN A 33 13.152 -3.918 5.495 1.00 0.00 H new ATOM 0 HB2 GLN A 33 15.444 -5.827 5.855 1.00 0.00 H new ATOM 0 HB3 GLN A 33 15.241 -5.082 4.281 1.00 0.00 H new ATOM 0 HG2 GLN A 33 16.606 -3.518 5.246 1.00 0.00 H new ATOM 0 HG3 GLN A 33 15.055 -2.850 5.712 1.00 0.00 H new ATOM 0 HE21 GLN A 33 17.154 -5.517 6.941 1.00 0.00 H new ATOM 0 HE22 GLN A 33 17.167 -4.959 8.617 1.00 0.00 H new ATOM 485 N GLY A 34 12.818 -5.190 3.232 1.00 0.00 N ATOM 486 CA GLY A 34 12.198 -5.866 2.108 1.00 0.00 C ATOM 487 C GLY A 34 10.712 -5.585 2.010 1.00 0.00 C ATOM 488 O GLY A 34 10.203 -5.266 0.936 1.00 0.00 O ATOM 0 H GLY A 34 13.227 -4.282 3.013 1.00 0.00 H new ATOM 0 HA2 GLY A 34 12.686 -5.552 1.185 1.00 0.00 H new ATOM 0 HA3 GLY A 34 12.356 -6.940 2.202 1.00 0.00 H new ATOM 492 N GLU A 35 10.013 -5.706 3.135 1.00 0.00 N ATOM 493 CA GLU A 35 8.575 -5.464 3.170 1.00 0.00 C ATOM 494 C GLU A 35 8.206 -4.252 2.321 1.00 0.00 C ATOM 495 O GLU A 35 7.465 -4.366 1.345 1.00 0.00 O ATOM 496 CB GLU A 35 8.106 -5.253 4.611 1.00 0.00 C ATOM 497 CG GLU A 35 7.761 -6.544 5.334 1.00 0.00 C ATOM 498 CD GLU A 35 8.794 -7.632 5.111 1.00 0.00 C ATOM 499 OE1 GLU A 35 9.027 -7.996 3.939 1.00 0.00 O ATOM 500 OE2 GLU A 35 9.367 -8.120 6.107 1.00 0.00 O ATOM 0 H GLU A 35 10.419 -5.970 4.033 1.00 0.00 H new ATOM 0 HA GLU A 35 8.075 -6.340 2.757 1.00 0.00 H new ATOM 0 HB2 GLU A 35 8.887 -4.733 5.166 1.00 0.00 H new ATOM 0 HB3 GLU A 35 7.231 -4.603 4.608 1.00 0.00 H new ATOM 0 HG2 GLU A 35 7.673 -6.345 6.402 1.00 0.00 H new ATOM 0 HG3 GLU A 35 6.788 -6.897 4.994 1.00 0.00 H new ATOM 507 N VAL A 36 8.729 -3.090 2.700 1.00 0.00 N ATOM 508 CA VAL A 36 8.456 -1.855 1.975 1.00 0.00 C ATOM 509 C VAL A 36 9.600 -1.509 1.029 1.00 0.00 C ATOM 510 O VAL A 36 10.630 -0.980 1.450 1.00 0.00 O ATOM 511 CB VAL A 36 8.226 -0.676 2.939 1.00 0.00 C ATOM 512 CG1 VAL A 36 7.908 0.594 2.164 1.00 0.00 C ATOM 513 CG2 VAL A 36 7.112 -1.002 3.923 1.00 0.00 C ATOM 0 H VAL A 36 9.345 -2.978 3.506 1.00 0.00 H new ATOM 0 HA VAL A 36 7.548 -2.022 1.396 1.00 0.00 H new ATOM 0 HB VAL A 36 9.143 -0.508 3.505 1.00 0.00 H new ATOM 0 HG11 VAL A 36 7.749 1.416 2.862 1.00 0.00 H new ATOM 0 HG12 VAL A 36 8.741 0.835 1.503 1.00 0.00 H new ATOM 0 HG13 VAL A 36 7.006 0.442 1.571 1.00 0.00 H new ATOM 0 HG21 VAL A 36 6.963 -0.158 4.597 1.00 0.00 H new ATOM 0 HG22 VAL A 36 6.189 -1.197 3.376 1.00 0.00 H new ATOM 0 HG23 VAL A 36 7.385 -1.884 4.502 1.00 0.00 H new ATOM 523 N LYS A 37 9.414 -1.809 -0.251 1.00 0.00 N ATOM 524 CA LYS A 37 10.430 -1.528 -1.259 1.00 0.00 C ATOM 525 C LYS A 37 10.147 -0.205 -1.964 1.00 0.00 C ATOM 526 O LYS A 37 9.197 -0.095 -2.740 1.00 0.00 O ATOM 527 CB LYS A 37 10.487 -2.662 -2.285 1.00 0.00 C ATOM 528 CG LYS A 37 11.299 -3.860 -1.823 1.00 0.00 C ATOM 529 CD LYS A 37 10.993 -5.095 -2.654 1.00 0.00 C ATOM 530 CE LYS A 37 9.727 -5.789 -2.176 1.00 0.00 C ATOM 531 NZ LYS A 37 9.112 -6.620 -3.248 1.00 0.00 N ATOM 0 H LYS A 37 8.568 -2.247 -0.616 1.00 0.00 H new ATOM 0 HA LYS A 37 11.394 -1.452 -0.755 1.00 0.00 H new ATOM 0 HB2 LYS A 37 9.472 -2.987 -2.511 1.00 0.00 H new ATOM 0 HB3 LYS A 37 10.914 -2.280 -3.213 1.00 0.00 H new ATOM 0 HG2 LYS A 37 12.362 -3.628 -1.891 1.00 0.00 H new ATOM 0 HG3 LYS A 37 11.084 -4.064 -0.774 1.00 0.00 H new ATOM 0 HD2 LYS A 37 10.881 -4.812 -3.701 1.00 0.00 H new ATOM 0 HD3 LYS A 37 11.832 -5.789 -2.599 1.00 0.00 H new ATOM 0 HE2 LYS A 37 9.960 -6.418 -1.317 1.00 0.00 H new ATOM 0 HE3 LYS A 37 9.009 -5.042 -1.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 8.252 -7.076 -2.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 8.866 -6.016 -4.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 9.788 -7.349 -3.553 1.00 0.00 H new ATOM 545 N LEU A 38 10.976 0.796 -1.689 1.00 0.00 N ATOM 546 CA LEU A 38 10.815 2.111 -2.298 1.00 0.00 C ATOM 547 C LEU A 38 11.731 2.267 -3.508 1.00 0.00 C ATOM 548 O LEU A 38 12.952 2.322 -3.371 1.00 0.00 O ATOM 549 CB LEU A 38 11.113 3.208 -1.275 1.00 0.00 C ATOM 550 CG LEU A 38 9.925 3.691 -0.442 1.00 0.00 C ATOM 551 CD1 LEU A 38 10.405 4.395 0.817 1.00 0.00 C ATOM 552 CD2 LEU A 38 9.037 4.613 -1.265 1.00 0.00 C ATOM 0 H LEU A 38 11.766 0.722 -1.048 1.00 0.00 H new ATOM 0 HA LEU A 38 9.782 2.205 -2.633 1.00 0.00 H new ATOM 0 HB2 LEU A 38 11.883 2.843 -0.595 1.00 0.00 H new ATOM 0 HB3 LEU A 38 11.533 4.064 -1.803 1.00 0.00 H new ATOM 0 HG LEU A 38 9.338 2.822 -0.145 1.00 0.00 H new ATOM 0 HD11 LEU A 38 9.545 4.731 1.396 1.00 0.00 H new ATOM 0 HD12 LEU A 38 10.998 3.704 1.416 1.00 0.00 H new ATOM 0 HD13 LEU A 38 11.016 5.255 0.543 1.00 0.00 H new ATOM 0 HD21 LEU A 38 8.197 4.947 -0.657 1.00 0.00 H new ATOM 0 HD22 LEU A 38 9.614 5.478 -1.592 1.00 0.00 H new ATOM 0 HD23 LEU A 38 8.663 4.075 -2.136 1.00 0.00 H new ATOM 564 N GLU A 39 11.131 2.339 -4.692 1.00 0.00 N ATOM 565 CA GLU A 39 11.893 2.490 -5.926 1.00 0.00 C ATOM 566 C GLU A 39 12.871 3.656 -5.822 1.00 0.00 C ATOM 567 O GLU A 39 13.926 3.654 -6.458 1.00 0.00 O ATOM 568 CB GLU A 39 10.950 2.705 -7.111 1.00 0.00 C ATOM 569 CG GLU A 39 10.183 1.456 -7.514 1.00 0.00 C ATOM 570 CD GLU A 39 10.921 0.626 -8.545 1.00 0.00 C ATOM 571 OE1 GLU A 39 11.458 1.215 -9.507 1.00 0.00 O ATOM 572 OE2 GLU A 39 10.962 -0.613 -8.392 1.00 0.00 O ATOM 0 H GLU A 39 10.120 2.295 -4.823 1.00 0.00 H new ATOM 0 HA GLU A 39 12.462 1.574 -6.086 1.00 0.00 H new ATOM 0 HB2 GLU A 39 10.239 3.492 -6.860 1.00 0.00 H new ATOM 0 HB3 GLU A 39 11.528 3.057 -7.965 1.00 0.00 H new ATOM 0 HG2 GLU A 39 9.996 0.847 -6.629 1.00 0.00 H new ATOM 0 HG3 GLU A 39 9.211 1.744 -7.913 1.00 0.00 H new ATOM 579 N ASP A 40 12.514 4.650 -5.017 1.00 0.00 N ATOM 580 CA ASP A 40 13.359 5.824 -4.829 1.00 0.00 C ATOM 581 C ASP A 40 13.433 6.209 -3.355 1.00 0.00 C ATOM 582 O ASP A 40 12.414 6.489 -2.723 1.00 0.00 O ATOM 583 CB ASP A 40 12.827 6.999 -5.650 1.00 0.00 C ATOM 584 CG ASP A 40 11.315 6.995 -5.755 1.00 0.00 C ATOM 585 OD1 ASP A 40 10.656 6.524 -4.805 1.00 0.00 O ATOM 586 OD2 ASP A 40 10.790 7.461 -6.789 1.00 0.00 O ATOM 0 H ASP A 40 11.645 4.667 -4.484 1.00 0.00 H new ATOM 0 HA ASP A 40 14.364 5.577 -5.173 1.00 0.00 H new ATOM 0 HB2 ASP A 40 13.154 7.934 -5.195 1.00 0.00 H new ATOM 0 HB3 ASP A 40 13.258 6.964 -6.651 1.00 0.00 H new ATOM 591 N VAL A 41 14.647 6.220 -2.811 1.00 0.00 N ATOM 592 CA VAL A 41 14.854 6.571 -1.412 1.00 0.00 C ATOM 593 C VAL A 41 14.871 8.083 -1.220 1.00 0.00 C ATOM 594 O VAL A 41 14.729 8.580 -0.104 1.00 0.00 O ATOM 595 CB VAL A 41 16.173 5.983 -0.875 1.00 0.00 C ATOM 596 CG1 VAL A 41 16.155 4.464 -0.963 1.00 0.00 C ATOM 597 CG2 VAL A 41 17.359 6.555 -1.636 1.00 0.00 C ATOM 0 H VAL A 41 15.501 5.990 -3.319 1.00 0.00 H new ATOM 0 HA VAL A 41 14.020 6.146 -0.853 1.00 0.00 H new ATOM 0 HB VAL A 41 16.275 6.261 0.174 1.00 0.00 H new ATOM 0 HG11 VAL A 41 17.095 4.066 -0.579 1.00 0.00 H new ATOM 0 HG12 VAL A 41 15.327 4.075 -0.370 1.00 0.00 H new ATOM 0 HG13 VAL A 41 16.030 4.161 -2.003 1.00 0.00 H new ATOM 0 HG21 VAL A 41 18.283 6.129 -1.244 1.00 0.00 H new ATOM 0 HG22 VAL A 41 17.266 6.308 -2.694 1.00 0.00 H new ATOM 0 HG23 VAL A 41 17.380 7.638 -1.517 1.00 0.00 H new ATOM 607 N ASN A 42 15.044 8.811 -2.319 1.00 0.00 N ATOM 608 CA ASN A 42 15.079 10.268 -2.273 1.00 0.00 C ATOM 609 C ASN A 42 13.729 10.858 -2.670 1.00 0.00 C ATOM 610 O ASN A 42 13.594 12.070 -2.836 1.00 0.00 O ATOM 611 CB ASN A 42 16.174 10.803 -3.199 1.00 0.00 C ATOM 612 CG ASN A 42 17.468 10.022 -3.075 1.00 0.00 C ATOM 613 OD1 ASN A 42 18.255 10.245 -2.156 1.00 0.00 O ATOM 614 ND2 ASN A 42 17.693 9.100 -4.004 1.00 0.00 N ATOM 0 H ASN A 42 15.162 8.416 -3.252 1.00 0.00 H new ATOM 0 HA ASN A 42 15.300 10.568 -1.249 1.00 0.00 H new ATOM 0 HB2 ASN A 42 15.825 10.762 -4.231 1.00 0.00 H new ATOM 0 HB3 ASN A 42 16.362 11.851 -2.967 1.00 0.00 H new ATOM 0 HD21 ASN A 42 18.547 8.543 -3.973 1.00 0.00 H new ATOM 0 HD22 ASN A 42 17.012 8.949 -4.748 1.00 0.00 H new ATOM 621 N ALA A 43 12.733 9.992 -2.819 1.00 0.00 N ATOM 622 CA ALA A 43 11.393 10.426 -3.194 1.00 0.00 C ATOM 623 C ALA A 43 10.782 11.315 -2.115 1.00 0.00 C ATOM 624 O ALA A 43 10.246 12.384 -2.407 1.00 0.00 O ATOM 625 CB ALA A 43 10.501 9.221 -3.455 1.00 0.00 C ATOM 0 H ALA A 43 12.828 8.985 -2.686 1.00 0.00 H new ATOM 0 HA ALA A 43 11.471 11.012 -4.110 1.00 0.00 H new ATOM 0 HB1 ALA A 43 9.503 9.560 -3.734 1.00 0.00 H new ATOM 0 HB2 ALA A 43 10.922 8.626 -4.265 1.00 0.00 H new ATOM 0 HB3 ALA A 43 10.438 8.613 -2.553 1.00 0.00 H new ATOM 631 N LEU A 44 10.866 10.865 -0.868 1.00 0.00 N ATOM 632 CA LEU A 44 10.321 11.620 0.255 1.00 0.00 C ATOM 633 C LEU A 44 11.109 12.906 0.481 1.00 0.00 C ATOM 634 O LEU A 44 10.531 13.982 0.641 1.00 0.00 O ATOM 635 CB LEU A 44 10.340 10.767 1.525 1.00 0.00 C ATOM 636 CG LEU A 44 10.175 9.260 1.324 1.00 0.00 C ATOM 637 CD1 LEU A 44 10.015 8.557 2.664 1.00 0.00 C ATOM 638 CD2 LEU A 44 8.985 8.970 0.422 1.00 0.00 C ATOM 0 H LEU A 44 11.306 9.982 -0.609 1.00 0.00 H new ATOM 0 HA LEU A 44 9.291 11.885 0.017 1.00 0.00 H new ATOM 0 HB2 LEU A 44 11.283 10.943 2.043 1.00 0.00 H new ATOM 0 HB3 LEU A 44 9.544 11.115 2.184 1.00 0.00 H new ATOM 0 HG LEU A 44 11.074 8.876 0.841 1.00 0.00 H new ATOM 0 HD11 LEU A 44 9.899 7.486 2.501 1.00 0.00 H new ATOM 0 HD12 LEU A 44 10.898 8.737 3.277 1.00 0.00 H new ATOM 0 HD13 LEU A 44 9.133 8.944 3.175 1.00 0.00 H new ATOM 0 HD21 LEU A 44 8.883 7.893 0.290 1.00 0.00 H new ATOM 0 HD22 LEU A 44 8.078 9.368 0.877 1.00 0.00 H new ATOM 0 HD23 LEU A 44 9.141 9.441 -0.548 1.00 0.00 H new ATOM 650 N THR A 45 12.433 12.789 0.491 1.00 0.00 N ATOM 651 CA THR A 45 13.301 13.942 0.696 1.00 0.00 C ATOM 652 C THR A 45 12.928 15.084 -0.241 1.00 0.00 C ATOM 653 O THR A 45 12.729 16.217 0.195 1.00 0.00 O ATOM 654 CB THR A 45 14.782 13.576 0.478 1.00 0.00 C ATOM 655 OG1 THR A 45 15.188 12.586 1.429 1.00 0.00 O ATOM 656 CG2 THR A 45 15.667 14.806 0.608 1.00 0.00 C ATOM 0 H THR A 45 12.928 11.907 0.359 1.00 0.00 H new ATOM 0 HA THR A 45 13.162 14.263 1.728 1.00 0.00 H new ATOM 0 HB THR A 45 14.890 13.175 -0.530 1.00 0.00 H new ATOM 0 HG1 THR A 45 16.130 12.358 1.282 1.00 0.00 H new ATOM 0 HG21 THR A 45 16.708 14.524 0.450 1.00 0.00 H new ATOM 0 HG22 THR A 45 15.375 15.545 -0.138 1.00 0.00 H new ATOM 0 HG23 THR A 45 15.554 15.232 1.605 1.00 0.00 H new ATOM 664 N ASN A 46 12.833 14.779 -1.531 1.00 0.00 N ATOM 665 CA ASN A 46 12.483 15.781 -2.530 1.00 0.00 C ATOM 666 C ASN A 46 11.181 16.486 -2.161 1.00 0.00 C ATOM 667 O ASN A 46 11.130 17.714 -2.077 1.00 0.00 O ATOM 668 CB ASN A 46 12.351 15.132 -3.910 1.00 0.00 C ATOM 669 CG ASN A 46 13.696 14.773 -4.511 1.00 0.00 C ATOM 670 OD1 ASN A 46 14.694 15.456 -4.280 1.00 0.00 O ATOM 671 ND2 ASN A 46 13.728 13.696 -5.287 1.00 0.00 N ATOM 0 H ASN A 46 12.994 13.845 -1.909 1.00 0.00 H new ATOM 0 HA ASN A 46 13.281 16.522 -2.559 1.00 0.00 H new ATOM 0 HB2 ASN A 46 11.741 14.233 -3.829 1.00 0.00 H new ATOM 0 HB3 ASN A 46 11.827 15.813 -4.580 1.00 0.00 H new ATOM 0 HD21 ASN A 46 14.605 13.405 -5.719 1.00 0.00 H new ATOM 0 HD22 ASN A 46 12.876 13.160 -5.451 1.00 0.00 H new ATOM 678 N ILE A 47 10.132 15.701 -1.940 1.00 0.00 N ATOM 679 CA ILE A 47 8.831 16.250 -1.578 1.00 0.00 C ATOM 680 C ILE A 47 8.977 17.408 -0.596 1.00 0.00 C ATOM 681 O ILE A 47 8.411 18.483 -0.797 1.00 0.00 O ATOM 682 CB ILE A 47 7.920 15.176 -0.955 1.00 0.00 C ATOM 683 CG1 ILE A 47 7.556 14.117 -1.998 1.00 0.00 C ATOM 684 CG2 ILE A 47 6.665 15.814 -0.379 1.00 0.00 C ATOM 685 CD1 ILE A 47 6.696 13.000 -1.451 1.00 0.00 C ATOM 0 H ILE A 47 10.157 14.683 -2.005 1.00 0.00 H new ATOM 0 HA ILE A 47 8.374 16.612 -2.499 1.00 0.00 H new ATOM 0 HB ILE A 47 8.461 14.689 -0.144 1.00 0.00 H new ATOM 0 HG12 ILE A 47 7.031 14.597 -2.824 1.00 0.00 H new ATOM 0 HG13 ILE A 47 8.472 13.692 -2.407 1.00 0.00 H new ATOM 0 HG21 ILE A 47 6.032 15.042 0.057 1.00 0.00 H new ATOM 0 HG22 ILE A 47 6.943 16.533 0.391 1.00 0.00 H new ATOM 0 HG23 ILE A 47 6.120 16.325 -1.172 1.00 0.00 H new ATOM 0 HD11 ILE A 47 6.477 12.287 -2.246 1.00 0.00 H new ATOM 0 HD12 ILE A 47 7.227 12.494 -0.645 1.00 0.00 H new ATOM 0 HD13 ILE A 47 5.763 13.413 -1.068 1.00 0.00 H new ATOM 697 N LYS A 48 9.742 17.182 0.467 1.00 0.00 N ATOM 698 CA LYS A 48 9.966 18.207 1.480 1.00 0.00 C ATOM 699 C LYS A 48 10.518 19.482 0.851 1.00 0.00 C ATOM 700 O LYS A 48 10.181 20.589 1.272 1.00 0.00 O ATOM 701 CB LYS A 48 10.932 17.693 2.550 1.00 0.00 C ATOM 702 CG LYS A 48 10.307 16.689 3.503 1.00 0.00 C ATOM 703 CD LYS A 48 11.362 15.826 4.175 1.00 0.00 C ATOM 704 CE LYS A 48 10.739 14.856 5.167 1.00 0.00 C ATOM 705 NZ LYS A 48 11.753 13.940 5.759 1.00 0.00 N ATOM 0 H LYS A 48 10.217 16.298 0.649 1.00 0.00 H new ATOM 0 HA LYS A 48 9.008 18.438 1.945 1.00 0.00 H new ATOM 0 HB2 LYS A 48 11.790 17.232 2.061 1.00 0.00 H new ATOM 0 HB3 LYS A 48 11.309 18.540 3.124 1.00 0.00 H new ATOM 0 HG2 LYS A 48 9.730 17.217 4.262 1.00 0.00 H new ATOM 0 HG3 LYS A 48 9.609 16.054 2.957 1.00 0.00 H new ATOM 0 HD2 LYS A 48 11.914 15.269 3.418 1.00 0.00 H new ATOM 0 HD3 LYS A 48 12.081 16.463 4.690 1.00 0.00 H new ATOM 0 HE2 LYS A 48 10.247 15.416 5.962 1.00 0.00 H new ATOM 0 HE3 LYS A 48 9.968 14.270 4.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 11.289 13.295 6.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 12.205 13.387 5.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 12.475 14.498 6.259 1.00 0.00 H new ATOM 719 N ARG A 49 11.367 19.319 -0.159 1.00 0.00 N ATOM 720 CA ARG A 49 11.965 20.457 -0.845 1.00 0.00 C ATOM 721 C ARG A 49 10.922 21.202 -1.674 1.00 0.00 C ATOM 722 O ARG A 49 11.168 22.311 -2.148 1.00 0.00 O ATOM 723 CB ARG A 49 13.111 19.992 -1.746 1.00 0.00 C ATOM 724 CG ARG A 49 13.945 18.874 -1.142 1.00 0.00 C ATOM 725 CD ARG A 49 15.245 18.674 -1.906 1.00 0.00 C ATOM 726 NE ARG A 49 16.020 19.909 -1.999 1.00 0.00 N ATOM 727 CZ ARG A 49 17.120 20.032 -2.734 1.00 0.00 C ATOM 728 NH1 ARG A 49 17.571 19.002 -3.435 1.00 0.00 N ATOM 729 NH2 ARG A 49 17.770 21.188 -2.768 1.00 0.00 N ATOM 0 H ARG A 49 11.656 18.410 -0.520 1.00 0.00 H new ATOM 0 HA ARG A 49 12.358 21.138 -0.090 1.00 0.00 H new ATOM 0 HB2 ARG A 49 12.700 19.654 -2.697 1.00 0.00 H new ATOM 0 HB3 ARG A 49 13.759 20.841 -1.963 1.00 0.00 H new ATOM 0 HG2 ARG A 49 14.166 19.105 -0.100 1.00 0.00 H new ATOM 0 HG3 ARG A 49 13.372 17.947 -1.148 1.00 0.00 H new ATOM 0 HD2 ARG A 49 15.842 17.908 -1.412 1.00 0.00 H new ATOM 0 HD3 ARG A 49 15.024 18.308 -2.909 1.00 0.00 H new ATOM 0 HE ARG A 49 15.699 20.721 -1.471 1.00 0.00 H new ATOM 0 HH11 ARG A 49 17.073 18.112 -3.411 1.00 0.00 H new ATOM 0 HH12 ARG A 49 18.416 19.099 -3.998 1.00 0.00 H new ATOM 0 HH21 ARG A 49 17.425 21.983 -2.230 1.00 0.00 H new ATOM 0 HH22 ARG A 49 18.614 21.282 -3.332 1.00 0.00 H new ATOM 743 N TYR A 50 9.759 20.584 -1.844 1.00 0.00 N ATOM 744 CA TYR A 50 8.680 21.187 -2.617 1.00 0.00 C ATOM 745 C TYR A 50 7.747 21.991 -1.717 1.00 0.00 C ATOM 746 O TYR A 50 7.250 23.049 -2.105 1.00 0.00 O ATOM 747 CB TYR A 50 7.888 20.106 -3.355 1.00 0.00 C ATOM 748 CG TYR A 50 6.700 20.643 -4.121 1.00 0.00 C ATOM 749 CD1 TYR A 50 6.863 21.242 -5.364 1.00 0.00 C ATOM 750 CD2 TYR A 50 5.414 20.549 -3.603 1.00 0.00 C ATOM 751 CE1 TYR A 50 5.780 21.734 -6.067 1.00 0.00 C ATOM 752 CE2 TYR A 50 4.325 21.037 -4.299 1.00 0.00 C ATOM 753 CZ TYR A 50 4.514 21.629 -5.531 1.00 0.00 C ATOM 754 OH TYR A 50 3.433 22.117 -6.229 1.00 0.00 O ATOM 0 H TYR A 50 9.539 19.666 -1.457 1.00 0.00 H new ATOM 0 HA TYR A 50 9.125 21.865 -3.346 1.00 0.00 H new ATOM 0 HB2 TYR A 50 8.553 19.589 -4.047 1.00 0.00 H new ATOM 0 HB3 TYR A 50 7.541 19.366 -2.634 1.00 0.00 H new ATOM 0 HD1 TYR A 50 7.853 21.324 -5.788 1.00 0.00 H new ATOM 0 HD2 TYR A 50 5.263 20.086 -2.639 1.00 0.00 H new ATOM 0 HE1 TYR A 50 5.924 22.198 -7.031 1.00 0.00 H new ATOM 0 HE2 TYR A 50 3.332 20.956 -3.882 1.00 0.00 H new ATOM 0 HH TYR A 50 2.614 21.963 -5.713 1.00 0.00 H new ATOM 764 N LEU A 51 7.515 21.482 -0.512 1.00 0.00 N ATOM 765 CA LEU A 51 6.643 22.152 0.446 1.00 0.00 C ATOM 766 C LEU A 51 7.232 23.492 0.875 1.00 0.00 C ATOM 767 O LEU A 51 6.510 24.476 1.031 1.00 0.00 O ATOM 768 CB LEU A 51 6.422 21.264 1.672 1.00 0.00 C ATOM 769 CG LEU A 51 5.760 19.911 1.410 1.00 0.00 C ATOM 770 CD1 LEU A 51 5.926 18.994 2.612 1.00 0.00 C ATOM 771 CD2 LEU A 51 4.286 20.094 1.077 1.00 0.00 C ATOM 0 H LEU A 51 7.919 20.608 -0.175 1.00 0.00 H new ATOM 0 HA LEU A 51 5.685 22.336 -0.040 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.387 21.088 2.147 1.00 0.00 H new ATOM 0 HB3 LEU A 51 5.810 21.813 2.388 1.00 0.00 H new ATOM 0 HG LEU A 51 6.251 19.448 0.554 1.00 0.00 H new ATOM 0 HD11 LEU A 51 5.449 18.036 2.407 1.00 0.00 H new ATOM 0 HD12 LEU A 51 6.987 18.837 2.806 1.00 0.00 H new ATOM 0 HD13 LEU A 51 5.462 19.451 3.486 1.00 0.00 H new ATOM 0 HD21 LEU A 51 3.831 19.121 0.893 1.00 0.00 H new ATOM 0 HD22 LEU A 51 3.782 20.579 1.913 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.189 20.714 0.186 1.00 0.00 H new ATOM 783 N GLU A 52 8.548 23.522 1.060 1.00 0.00 N ATOM 784 CA GLU A 52 9.233 24.743 1.469 1.00 0.00 C ATOM 785 C GLU A 52 9.298 25.742 0.317 1.00 0.00 C ATOM 786 O GLU A 52 9.333 26.953 0.533 1.00 0.00 O ATOM 787 CB GLU A 52 10.646 24.421 1.959 1.00 0.00 C ATOM 788 CG GLU A 52 11.490 23.677 0.937 1.00 0.00 C ATOM 789 CD GLU A 52 12.907 23.432 1.418 1.00 0.00 C ATOM 790 OE1 GLU A 52 13.736 24.361 1.321 1.00 0.00 O ATOM 791 OE2 GLU A 52 13.187 22.311 1.892 1.00 0.00 O ATOM 0 H GLU A 52 9.160 22.716 0.933 1.00 0.00 H new ATOM 0 HA GLU A 52 8.666 25.192 2.285 1.00 0.00 H new ATOM 0 HB2 GLU A 52 11.149 25.350 2.226 1.00 0.00 H new ATOM 0 HB3 GLU A 52 10.579 23.822 2.867 1.00 0.00 H new ATOM 0 HG2 GLU A 52 11.018 22.722 0.708 1.00 0.00 H new ATOM 0 HG3 GLU A 52 11.519 24.249 0.010 1.00 0.00 H new ATOM 798 N GLY A 53 9.314 25.225 -0.908 1.00 0.00 N ATOM 799 CA GLY A 53 9.375 26.084 -2.075 1.00 0.00 C ATOM 800 C GLY A 53 10.710 25.998 -2.789 1.00 0.00 C ATOM 801 O GLY A 53 10.770 26.052 -4.018 1.00 0.00 O ATOM 0 H GLY A 53 9.286 24.226 -1.112 1.00 0.00 H new ATOM 0 HA2 GLY A 53 8.578 25.810 -2.766 1.00 0.00 H new ATOM 0 HA3 GLY A 53 9.194 27.116 -1.773 1.00 0.00 H new ATOM 868 N LEU A 58 7.802 19.522 -9.958 1.00 0.00 N ATOM 869 CA LEU A 58 6.961 18.540 -9.282 1.00 0.00 C ATOM 870 C LEU A 58 7.773 17.313 -8.879 1.00 0.00 C ATOM 871 O LEU A 58 8.356 16.623 -9.715 1.00 0.00 O ATOM 872 CB LEU A 58 5.800 18.124 -10.187 1.00 0.00 C ATOM 873 CG LEU A 58 4.497 17.752 -9.478 1.00 0.00 C ATOM 874 CD1 LEU A 58 4.720 16.584 -8.529 1.00 0.00 C ATOM 875 CD2 LEU A 58 3.936 18.951 -8.729 1.00 0.00 C ATOM 0 HA LEU A 58 6.561 19.001 -8.379 1.00 0.00 H new ATOM 0 HB2 LEU A 58 5.594 18.941 -10.878 1.00 0.00 H new ATOM 0 HB3 LEU A 58 6.120 17.272 -10.787 1.00 0.00 H new ATOM 0 HG LEU A 58 3.770 17.448 -10.231 1.00 0.00 H new ATOM 0 HD11 LEU A 58 3.782 16.334 -8.034 1.00 0.00 H new ATOM 0 HD12 LEU A 58 5.075 15.721 -9.092 1.00 0.00 H new ATOM 0 HD13 LEU A 58 5.463 16.860 -7.781 1.00 0.00 H new ATOM 0 HD21 LEU A 58 3.009 18.668 -8.231 1.00 0.00 H new ATOM 0 HD22 LEU A 58 4.659 19.287 -7.986 1.00 0.00 H new ATOM 0 HD23 LEU A 58 3.737 19.759 -9.433 1.00 0.00 H new ATOM 887 N PRO A 59 7.810 17.032 -7.568 1.00 0.00 N ATOM 888 CA PRO A 59 8.545 15.886 -7.025 1.00 0.00 C ATOM 889 C PRO A 59 7.896 14.555 -7.391 1.00 0.00 C ATOM 890 O PRO A 59 6.699 14.477 -7.671 1.00 0.00 O ATOM 891 CB PRO A 59 8.485 16.111 -5.512 1.00 0.00 C ATOM 892 CG PRO A 59 7.263 16.936 -5.299 1.00 0.00 C ATOM 893 CD PRO A 59 7.138 17.812 -6.515 1.00 0.00 C ATOM 0 HA PRO A 59 9.559 15.827 -7.422 1.00 0.00 H new ATOM 0 HB2 PRO A 59 8.423 15.165 -4.973 1.00 0.00 H new ATOM 0 HB3 PRO A 59 9.377 16.625 -5.153 1.00 0.00 H new ATOM 0 HG2 PRO A 59 6.382 16.305 -5.180 1.00 0.00 H new ATOM 0 HG3 PRO A 59 7.350 17.536 -4.393 1.00 0.00 H new ATOM 0 HD2 PRO A 59 6.095 18.008 -6.764 1.00 0.00 H new ATOM 0 HD3 PRO A 59 7.617 18.780 -6.364 1.00 0.00 H new ATOM 901 N PRO A 60 8.701 13.483 -7.389 1.00 0.00 N ATOM 902 CA PRO A 60 8.227 12.136 -7.719 1.00 0.00 C ATOM 903 C PRO A 60 7.305 11.567 -6.645 1.00 0.00 C ATOM 904 O PRO A 60 7.641 11.568 -5.460 1.00 0.00 O ATOM 905 CB PRO A 60 9.516 11.316 -7.805 1.00 0.00 C ATOM 906 CG PRO A 60 10.487 12.046 -6.942 1.00 0.00 C ATOM 907 CD PRO A 60 10.138 13.503 -7.066 1.00 0.00 C ATOM 0 HA PRO A 60 7.637 12.125 -8.636 1.00 0.00 H new ATOM 0 HB2 PRO A 60 9.361 10.296 -7.452 1.00 0.00 H new ATOM 0 HB3 PRO A 60 9.873 11.247 -8.832 1.00 0.00 H new ATOM 0 HG2 PRO A 60 10.415 11.714 -5.906 1.00 0.00 H new ATOM 0 HG3 PRO A 60 11.512 11.861 -7.265 1.00 0.00 H new ATOM 0 HD2 PRO A 60 10.334 14.044 -6.140 1.00 0.00 H new ATOM 0 HD3 PRO A 60 10.719 13.990 -7.849 1.00 0.00 H new ATOM 915 N LYS A 61 6.142 11.081 -7.066 1.00 0.00 N ATOM 916 CA LYS A 61 5.172 10.508 -6.141 1.00 0.00 C ATOM 917 C LYS A 61 5.784 9.348 -5.361 1.00 0.00 C ATOM 918 O LYS A 61 6.809 8.793 -5.758 1.00 0.00 O ATOM 919 CB LYS A 61 3.934 10.029 -6.901 1.00 0.00 C ATOM 920 CG LYS A 61 4.222 8.918 -7.896 1.00 0.00 C ATOM 921 CD LYS A 61 2.944 8.253 -8.376 1.00 0.00 C ATOM 922 CE LYS A 61 3.110 7.663 -9.768 1.00 0.00 C ATOM 923 NZ LYS A 61 3.869 6.382 -9.741 1.00 0.00 N ATOM 0 H LYS A 61 5.848 11.073 -8.043 1.00 0.00 H new ATOM 0 HA LYS A 61 4.879 11.284 -5.434 1.00 0.00 H new ATOM 0 HB2 LYS A 61 3.191 9.680 -6.184 1.00 0.00 H new ATOM 0 HB3 LYS A 61 3.494 10.874 -7.430 1.00 0.00 H new ATOM 0 HG2 LYS A 61 4.764 9.325 -8.750 1.00 0.00 H new ATOM 0 HG3 LYS A 61 4.869 8.173 -7.433 1.00 0.00 H new ATOM 0 HD2 LYS A 61 2.658 7.466 -7.678 1.00 0.00 H new ATOM 0 HD3 LYS A 61 2.134 8.982 -8.383 1.00 0.00 H new ATOM 0 HE2 LYS A 61 2.128 7.494 -10.210 1.00 0.00 H new ATOM 0 HE3 LYS A 61 3.628 8.379 -10.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 4.532 6.354 -10.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 4.400 6.312 -8.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 3.206 5.584 -9.813 1.00 0.00 H new ATOM 937 N ILE A 62 5.148 8.986 -4.252 1.00 0.00 N ATOM 938 CA ILE A 62 5.628 7.890 -3.420 1.00 0.00 C ATOM 939 C ILE A 62 5.023 6.561 -3.857 1.00 0.00 C ATOM 940 O ILE A 62 3.850 6.288 -3.603 1.00 0.00 O ATOM 941 CB ILE A 62 5.300 8.127 -1.934 1.00 0.00 C ATOM 942 CG1 ILE A 62 6.066 9.342 -1.407 1.00 0.00 C ATOM 943 CG2 ILE A 62 5.633 6.889 -1.114 1.00 0.00 C ATOM 944 CD1 ILE A 62 5.546 9.856 -0.083 1.00 0.00 C ATOM 0 H ILE A 62 4.299 9.436 -3.909 1.00 0.00 H new ATOM 0 HA ILE A 62 6.710 7.851 -3.544 1.00 0.00 H new ATOM 0 HB ILE A 62 4.232 8.325 -1.841 1.00 0.00 H new ATOM 0 HG12 ILE A 62 7.118 9.079 -1.297 1.00 0.00 H new ATOM 0 HG13 ILE A 62 6.013 10.143 -2.145 1.00 0.00 H new ATOM 0 HG21 ILE A 62 5.396 7.072 -0.066 1.00 0.00 H new ATOM 0 HG22 ILE A 62 5.047 6.044 -1.476 1.00 0.00 H new ATOM 0 HG23 ILE A 62 6.695 6.663 -1.211 1.00 0.00 H new ATOM 0 HD11 ILE A 62 6.136 10.718 0.230 1.00 0.00 H new ATOM 0 HD12 ILE A 62 4.502 10.151 -0.192 1.00 0.00 H new ATOM 0 HD13 ILE A 62 5.625 9.070 0.668 1.00 0.00 H new ATOM 956 N GLU A 63 5.832 5.736 -4.515 1.00 0.00 N ATOM 957 CA GLU A 63 5.375 4.434 -4.987 1.00 0.00 C ATOM 958 C GLU A 63 6.283 3.320 -4.474 1.00 0.00 C ATOM 959 O GLU A 63 7.502 3.371 -4.641 1.00 0.00 O ATOM 960 CB GLU A 63 5.331 4.408 -6.516 1.00 0.00 C ATOM 961 CG GLU A 63 4.832 3.091 -7.088 1.00 0.00 C ATOM 962 CD GLU A 63 5.065 2.979 -8.582 1.00 0.00 C ATOM 963 OE1 GLU A 63 6.228 3.126 -9.014 1.00 0.00 O ATOM 964 OE2 GLU A 63 4.085 2.745 -9.320 1.00 0.00 O ATOM 0 H GLU A 63 6.806 5.946 -4.733 1.00 0.00 H new ATOM 0 HA GLU A 63 4.370 4.267 -4.599 1.00 0.00 H new ATOM 0 HB2 GLU A 63 4.686 5.214 -6.866 1.00 0.00 H new ATOM 0 HB3 GLU A 63 6.330 4.607 -6.903 1.00 0.00 H new ATOM 0 HG2 GLU A 63 5.334 2.266 -6.583 1.00 0.00 H new ATOM 0 HG3 GLU A 63 3.767 2.990 -6.882 1.00 0.00 H new ATOM 971 N PHE A 64 5.680 2.315 -3.847 1.00 0.00 N ATOM 972 CA PHE A 64 6.434 1.189 -3.308 1.00 0.00 C ATOM 973 C PHE A 64 5.566 -0.064 -3.242 1.00 0.00 C ATOM 974 O PHE A 64 4.384 -0.033 -3.584 1.00 0.00 O ATOM 975 CB PHE A 64 6.968 1.527 -1.914 1.00 0.00 C ATOM 976 CG PHE A 64 5.911 2.026 -0.971 1.00 0.00 C ATOM 977 CD1 PHE A 64 5.274 3.235 -1.201 1.00 0.00 C ATOM 978 CD2 PHE A 64 5.554 1.286 0.144 1.00 0.00 C ATOM 979 CE1 PHE A 64 4.302 3.697 -0.334 1.00 0.00 C ATOM 980 CE2 PHE A 64 4.581 1.742 1.014 1.00 0.00 C ATOM 981 CZ PHE A 64 3.954 2.949 0.774 1.00 0.00 C ATOM 0 H PHE A 64 4.672 2.257 -3.700 1.00 0.00 H new ATOM 0 HA PHE A 64 7.274 0.993 -3.974 1.00 0.00 H new ATOM 0 HB2 PHE A 64 7.434 0.639 -1.487 1.00 0.00 H new ATOM 0 HB3 PHE A 64 7.748 2.283 -2.006 1.00 0.00 H new ATOM 0 HD1 PHE A 64 5.540 3.823 -2.067 1.00 0.00 H new ATOM 0 HD2 PHE A 64 6.041 0.342 0.336 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.815 4.642 -0.523 1.00 0.00 H new ATOM 0 HE2 PHE A 64 4.312 1.155 1.880 1.00 0.00 H new ATOM 0 HZ PHE A 64 3.193 3.307 1.451 1.00 0.00 H new ATOM 991 N VAL A 65 6.162 -1.167 -2.800 1.00 0.00 N ATOM 992 CA VAL A 65 5.445 -2.431 -2.688 1.00 0.00 C ATOM 993 C VAL A 65 5.466 -2.950 -1.255 1.00 0.00 C ATOM 994 O VAL A 65 6.529 -3.089 -0.650 1.00 0.00 O ATOM 995 CB VAL A 65 6.046 -3.502 -3.619 1.00 0.00 C ATOM 996 CG1 VAL A 65 5.178 -4.751 -3.626 1.00 0.00 C ATOM 997 CG2 VAL A 65 6.213 -2.950 -5.027 1.00 0.00 C ATOM 0 H VAL A 65 7.140 -1.210 -2.514 1.00 0.00 H new ATOM 0 HA VAL A 65 4.415 -2.237 -2.986 1.00 0.00 H new ATOM 0 HB VAL A 65 7.031 -3.776 -3.242 1.00 0.00 H new ATOM 0 HG11 VAL A 65 5.618 -5.496 -4.289 1.00 0.00 H new ATOM 0 HG12 VAL A 65 5.115 -5.156 -2.616 1.00 0.00 H new ATOM 0 HG13 VAL A 65 4.178 -4.497 -3.978 1.00 0.00 H new ATOM 0 HG21 VAL A 65 6.639 -3.719 -5.671 1.00 0.00 H new ATOM 0 HG22 VAL A 65 5.241 -2.647 -5.417 1.00 0.00 H new ATOM 0 HG23 VAL A 65 6.879 -2.088 -5.003 1.00 0.00 H new ATOM 1007 N ILE A 66 4.284 -3.236 -0.718 1.00 0.00 N ATOM 1008 CA ILE A 66 4.167 -3.741 0.644 1.00 0.00 C ATOM 1009 C ILE A 66 3.757 -5.209 0.653 1.00 0.00 C ATOM 1010 O ILE A 66 2.742 -5.586 0.065 1.00 0.00 O ATOM 1011 CB ILE A 66 3.143 -2.929 1.460 1.00 0.00 C ATOM 1012 CG1 ILE A 66 3.587 -1.468 1.567 1.00 0.00 C ATOM 1013 CG2 ILE A 66 2.966 -3.537 2.843 1.00 0.00 C ATOM 1014 CD1 ILE A 66 2.634 -0.604 2.361 1.00 0.00 C ATOM 0 H ILE A 66 3.395 -3.126 -1.205 1.00 0.00 H new ATOM 0 HA ILE A 66 5.150 -3.638 1.104 1.00 0.00 H new ATOM 0 HB ILE A 66 2.183 -2.961 0.945 1.00 0.00 H new ATOM 0 HG12 ILE A 66 4.572 -1.429 2.031 1.00 0.00 H new ATOM 0 HG13 ILE A 66 3.691 -1.054 0.564 1.00 0.00 H new ATOM 0 HG21 ILE A 66 2.240 -2.952 3.407 1.00 0.00 H new ATOM 0 HG22 ILE A 66 2.610 -4.563 2.747 1.00 0.00 H new ATOM 0 HG23 ILE A 66 3.922 -3.532 3.367 1.00 0.00 H new ATOM 0 HD11 ILE A 66 3.012 0.418 2.395 1.00 0.00 H new ATOM 0 HD12 ILE A 66 1.653 -0.612 1.886 1.00 0.00 H new ATOM 0 HD13 ILE A 66 2.549 -0.994 3.375 1.00 0.00 H new ATOM 1026 N THR A 67 4.552 -6.037 1.324 1.00 0.00 N ATOM 1027 CA THR A 67 4.271 -7.464 1.410 1.00 0.00 C ATOM 1028 C THR A 67 3.297 -7.766 2.543 1.00 0.00 C ATOM 1029 O THR A 67 3.538 -7.405 3.696 1.00 0.00 O ATOM 1030 CB THR A 67 5.561 -8.278 1.627 1.00 0.00 C ATOM 1031 OG1 THR A 67 6.475 -8.043 0.550 1.00 0.00 O ATOM 1032 CG2 THR A 67 5.253 -9.765 1.723 1.00 0.00 C ATOM 0 H THR A 67 5.396 -5.743 1.816 1.00 0.00 H new ATOM 0 HA THR A 67 3.821 -7.755 0.461 1.00 0.00 H new ATOM 0 HB THR A 67 6.014 -7.956 2.565 1.00 0.00 H new ATOM 0 HG1 THR A 67 7.293 -8.562 0.696 1.00 0.00 H new ATOM 0 HG21 THR A 67 6.179 -10.319 1.876 1.00 0.00 H new ATOM 0 HG22 THR A 67 4.580 -9.944 2.562 1.00 0.00 H new ATOM 0 HG23 THR A 67 4.779 -10.099 0.800 1.00 0.00 H new ATOM 1040 N LEU A 68 2.197 -8.431 2.209 1.00 0.00 N ATOM 1041 CA LEU A 68 1.185 -8.783 3.200 1.00 0.00 C ATOM 1042 C LEU A 68 1.400 -10.202 3.717 1.00 0.00 C ATOM 1043 O LEU A 68 0.947 -11.170 3.107 1.00 0.00 O ATOM 1044 CB LEU A 68 -0.215 -8.655 2.596 1.00 0.00 C ATOM 1045 CG LEU A 68 -0.830 -7.255 2.619 1.00 0.00 C ATOM 1046 CD1 LEU A 68 -1.066 -6.799 4.050 1.00 0.00 C ATOM 1047 CD2 LEU A 68 0.064 -6.268 1.883 1.00 0.00 C ATOM 0 H LEU A 68 1.983 -8.738 1.260 1.00 0.00 H new ATOM 0 HA LEU A 68 1.277 -8.092 4.038 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -0.175 -8.996 1.561 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -0.882 -9.332 3.129 1.00 0.00 H new ATOM 0 HG LEU A 68 -1.792 -7.293 2.109 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.504 -5.801 4.046 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -1.746 -7.492 4.545 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.117 -6.777 4.586 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -0.389 -5.277 1.909 1.00 0.00 H new ATOM 0 HD22 LEU A 68 1.041 -6.233 2.365 1.00 0.00 H new ATOM 0 HD23 LEU A 68 0.181 -6.586 0.847 1.00 0.00 H new ATOM 1059 N GLN A 69 2.092 -10.315 4.847 1.00 0.00 N ATOM 1060 CA GLN A 69 2.365 -11.616 5.447 1.00 0.00 C ATOM 1061 C GLN A 69 1.105 -12.199 6.078 1.00 0.00 C ATOM 1062 O GLN A 69 0.936 -12.162 7.297 1.00 0.00 O ATOM 1063 CB GLN A 69 3.467 -11.494 6.500 1.00 0.00 C ATOM 1064 CG GLN A 69 3.795 -12.807 7.193 1.00 0.00 C ATOM 1065 CD GLN A 69 3.939 -13.960 6.219 1.00 0.00 C ATOM 1066 OE1 GLN A 69 5.002 -14.162 5.632 1.00 0.00 O ATOM 1067 NE2 GLN A 69 2.867 -14.724 6.044 1.00 0.00 N ATOM 0 H GLN A 69 2.473 -9.523 5.364 1.00 0.00 H new ATOM 0 HA GLN A 69 2.699 -12.289 4.658 1.00 0.00 H new ATOM 0 HB2 GLN A 69 4.369 -11.108 6.026 1.00 0.00 H new ATOM 0 HB3 GLN A 69 3.163 -10.763 7.249 1.00 0.00 H new ATOM 0 HG2 GLN A 69 4.721 -12.695 7.757 1.00 0.00 H new ATOM 0 HG3 GLN A 69 3.010 -13.040 7.913 1.00 0.00 H new ATOM 0 HE21 GLN A 69 2.006 -14.519 6.552 1.00 0.00 H new ATOM 0 HE22 GLN A 69 2.904 -15.516 5.402 1.00 0.00 H new ATOM 1076 N ILE A 70 0.224 -12.737 5.241 1.00 0.00 N ATOM 1077 CA ILE A 70 -1.019 -13.329 5.718 1.00 0.00 C ATOM 1078 C ILE A 70 -0.751 -14.397 6.773 1.00 0.00 C ATOM 1079 O ILE A 70 -0.008 -15.348 6.532 1.00 0.00 O ATOM 1080 CB ILE A 70 -1.824 -13.955 4.563 1.00 0.00 C ATOM 1081 CG1 ILE A 70 -2.041 -12.928 3.449 1.00 0.00 C ATOM 1082 CG2 ILE A 70 -3.157 -14.482 5.072 1.00 0.00 C ATOM 1083 CD1 ILE A 70 -2.768 -11.684 3.907 1.00 0.00 C ATOM 0 H ILE A 70 0.348 -12.775 4.229 1.00 0.00 H new ATOM 0 HA ILE A 70 -1.602 -12.522 6.162 1.00 0.00 H new ATOM 0 HB ILE A 70 -1.257 -14.792 4.155 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -1.074 -12.642 3.036 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -2.607 -13.393 2.642 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -3.714 -14.921 4.245 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -2.981 -15.241 5.834 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -3.732 -13.662 5.502 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -2.886 -11.001 3.066 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.750 -11.958 4.293 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.193 -11.195 4.693 1.00 0.00 H new ATOM 1095 N GLU A 71 -1.363 -14.234 7.941 1.00 0.00 N ATOM 1096 CA GLU A 71 -1.190 -15.185 9.033 1.00 0.00 C ATOM 1097 C GLU A 71 -1.639 -16.582 8.613 1.00 0.00 C ATOM 1098 O GLU A 71 -0.890 -17.550 8.743 1.00 0.00 O ATOM 1099 CB GLU A 71 -1.980 -14.732 10.263 1.00 0.00 C ATOM 1100 CG GLU A 71 -1.562 -13.368 10.786 1.00 0.00 C ATOM 1101 CD GLU A 71 -2.596 -12.756 11.711 1.00 0.00 C ATOM 1102 OE1 GLU A 71 -3.712 -12.456 11.236 1.00 0.00 O ATOM 1103 OE2 GLU A 71 -2.291 -12.577 12.908 1.00 0.00 O ATOM 0 H GLU A 71 -1.983 -13.453 8.156 1.00 0.00 H new ATOM 0 HA GLU A 71 -0.130 -15.222 9.284 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -3.041 -14.707 10.014 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -1.856 -15.470 11.056 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -0.615 -13.461 11.317 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -1.391 -12.697 9.944 1.00 0.00 H new ATOM 1110 N GLU A 72 -2.866 -16.677 8.110 1.00 0.00 N ATOM 1111 CA GLU A 72 -3.414 -17.955 7.672 1.00 0.00 C ATOM 1112 C GLU A 72 -4.429 -17.756 6.550 1.00 0.00 C ATOM 1113 O GLU A 72 -5.417 -17.037 6.692 1.00 0.00 O ATOM 1114 CB GLU A 72 -4.073 -18.682 8.847 1.00 0.00 C ATOM 1115 CG GLU A 72 -5.000 -19.808 8.423 1.00 0.00 C ATOM 1116 CD GLU A 72 -5.120 -20.892 9.477 1.00 0.00 C ATOM 1117 OE1 GLU A 72 -5.806 -20.656 10.494 1.00 0.00 O ATOM 1118 OE2 GLU A 72 -4.530 -21.975 9.284 1.00 0.00 O ATOM 0 H GLU A 72 -3.499 -15.885 7.996 1.00 0.00 H new ATOM 0 HA GLU A 72 -2.592 -18.562 7.292 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -3.296 -19.087 9.495 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -4.637 -17.961 9.439 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -5.989 -19.400 8.212 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -4.632 -20.247 7.496 1.00 0.00 H new ATOM 1125 N PRO A 73 -4.179 -18.409 5.405 1.00 0.00 N ATOM 1126 CA PRO A 73 -3.005 -19.268 5.223 1.00 0.00 C ATOM 1127 C PRO A 73 -1.707 -18.471 5.166 1.00 0.00 C ATOM 1128 O PRO A 73 -1.704 -17.294 4.806 1.00 0.00 O ATOM 1129 CB PRO A 73 -3.271 -19.953 3.880 1.00 0.00 C ATOM 1130 CG PRO A 73 -4.172 -19.018 3.150 1.00 0.00 C ATOM 1131 CD PRO A 73 -5.023 -18.358 4.199 1.00 0.00 C ATOM 0 HA PRO A 73 -2.876 -19.962 6.053 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -2.345 -20.120 3.330 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -3.740 -20.927 4.018 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -3.597 -18.279 2.592 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -4.788 -19.554 2.428 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -5.273 -17.333 3.927 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -5.964 -18.888 4.345 1.00 0.00 H new ATOM 1139 N LYS A 74 -0.603 -19.120 5.524 1.00 0.00 N ATOM 1140 CA LYS A 74 0.703 -18.472 5.512 1.00 0.00 C ATOM 1141 C LYS A 74 1.232 -18.340 4.087 1.00 0.00 C ATOM 1142 O LYS A 74 1.906 -19.235 3.579 1.00 0.00 O ATOM 1143 CB LYS A 74 1.696 -19.266 6.364 1.00 0.00 C ATOM 1144 CG LYS A 74 2.772 -18.406 7.004 1.00 0.00 C ATOM 1145 CD LYS A 74 2.325 -17.869 8.354 1.00 0.00 C ATOM 1146 CE LYS A 74 3.487 -17.256 9.121 1.00 0.00 C ATOM 1147 NZ LYS A 74 4.283 -18.289 9.841 1.00 0.00 N ATOM 0 H LYS A 74 -0.587 -20.094 5.826 1.00 0.00 H new ATOM 0 HA LYS A 74 0.589 -17.473 5.933 1.00 0.00 H new ATOM 0 HB2 LYS A 74 1.150 -19.793 7.147 1.00 0.00 H new ATOM 0 HB3 LYS A 74 2.171 -20.024 5.741 1.00 0.00 H new ATOM 0 HG2 LYS A 74 3.682 -18.992 7.128 1.00 0.00 H new ATOM 0 HG3 LYS A 74 3.016 -17.574 6.343 1.00 0.00 H new ATOM 0 HD2 LYS A 74 1.547 -17.119 8.209 1.00 0.00 H new ATOM 0 HD3 LYS A 74 1.885 -18.676 8.941 1.00 0.00 H new ATOM 0 HE2 LYS A 74 4.134 -16.716 8.430 1.00 0.00 H new ATOM 0 HE3 LYS A 74 3.106 -16.527 9.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 5.065 -17.831 10.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 3.672 -18.788 10.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 4.668 -18.970 9.156 1.00 0.00 H new ATOM 1161 N VAL A 75 0.922 -17.216 3.448 1.00 0.00 N ATOM 1162 CA VAL A 75 1.368 -16.965 2.083 1.00 0.00 C ATOM 1163 C VAL A 75 1.900 -15.544 1.931 1.00 0.00 C ATOM 1164 O VAL A 75 1.854 -14.748 2.870 1.00 0.00 O ATOM 1165 CB VAL A 75 0.228 -17.186 1.071 1.00 0.00 C ATOM 1166 CG1 VAL A 75 -0.213 -18.641 1.072 1.00 0.00 C ATOM 1167 CG2 VAL A 75 -0.943 -16.265 1.378 1.00 0.00 C ATOM 0 H VAL A 75 0.364 -16.465 3.854 1.00 0.00 H new ATOM 0 HA VAL A 75 2.170 -17.674 1.876 1.00 0.00 H new ATOM 0 HB VAL A 75 0.599 -16.945 0.075 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -1.019 -18.777 0.351 1.00 0.00 H new ATOM 0 HG12 VAL A 75 0.629 -19.277 0.799 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -0.566 -18.913 2.067 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -1.739 -16.435 0.653 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -1.315 -16.472 2.381 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -0.615 -15.227 1.320 1.00 0.00 H new ATOM 1177 N LYS A 76 2.404 -15.231 0.742 1.00 0.00 N ATOM 1178 CA LYS A 76 2.944 -13.905 0.465 1.00 0.00 C ATOM 1179 C LYS A 76 2.172 -13.229 -0.665 1.00 0.00 C ATOM 1180 O LYS A 76 1.852 -13.859 -1.673 1.00 0.00 O ATOM 1181 CB LYS A 76 4.426 -14.002 0.097 1.00 0.00 C ATOM 1182 CG LYS A 76 5.157 -12.672 0.162 1.00 0.00 C ATOM 1183 CD LYS A 76 6.664 -12.862 0.135 1.00 0.00 C ATOM 1184 CE LYS A 76 7.170 -13.102 -1.279 1.00 0.00 C ATOM 1185 NZ LYS A 76 6.925 -11.928 -2.162 1.00 0.00 N ATOM 0 H LYS A 76 2.450 -15.878 -0.045 1.00 0.00 H new ATOM 0 HA LYS A 76 2.839 -13.301 1.366 1.00 0.00 H new ATOM 0 HB2 LYS A 76 4.913 -14.708 0.769 1.00 0.00 H new ATOM 0 HB3 LYS A 76 4.516 -14.408 -0.911 1.00 0.00 H new ATOM 0 HG2 LYS A 76 4.853 -12.047 -0.678 1.00 0.00 H new ATOM 0 HG3 LYS A 76 4.872 -12.143 1.072 1.00 0.00 H new ATOM 0 HD2 LYS A 76 7.151 -11.980 0.552 1.00 0.00 H new ATOM 0 HD3 LYS A 76 6.937 -13.706 0.768 1.00 0.00 H new ATOM 0 HE2 LYS A 76 8.238 -13.319 -1.251 1.00 0.00 H new ATOM 0 HE3 LYS A 76 6.677 -13.980 -1.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 7.624 -11.920 -2.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 5.968 -11.990 -2.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 7.011 -11.052 -1.607 1.00 0.00 H new ATOM 1199 N ILE A 77 1.878 -11.946 -0.488 1.00 0.00 N ATOM 1200 CA ILE A 77 1.147 -11.185 -1.494 1.00 0.00 C ATOM 1201 C ILE A 77 1.777 -9.813 -1.711 1.00 0.00 C ATOM 1202 O ILE A 77 1.689 -8.936 -0.852 1.00 0.00 O ATOM 1203 CB ILE A 77 -0.330 -11.003 -1.098 1.00 0.00 C ATOM 1204 CG1 ILE A 77 -1.012 -12.364 -0.946 1.00 0.00 C ATOM 1205 CG2 ILE A 77 -1.055 -10.154 -2.133 1.00 0.00 C ATOM 1206 CD1 ILE A 77 -2.448 -12.272 -0.480 1.00 0.00 C ATOM 0 H ILE A 77 2.134 -11.411 0.342 1.00 0.00 H new ATOM 0 HA ILE A 77 1.198 -11.756 -2.421 1.00 0.00 H new ATOM 0 HB ILE A 77 -0.372 -10.487 -0.139 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -0.982 -12.885 -1.903 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.446 -12.968 -0.236 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -2.098 -10.034 -1.839 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -0.581 -9.174 -2.197 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -1.006 -10.645 -3.105 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -2.868 -13.274 -0.395 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -2.484 -11.779 0.492 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -3.028 -11.696 -1.201 1.00 0.00 H new ATOM 1218 N ASP A 78 2.410 -9.635 -2.865 1.00 0.00 N ATOM 1219 CA ASP A 78 3.052 -8.369 -3.198 1.00 0.00 C ATOM 1220 C ASP A 78 2.013 -7.306 -3.541 1.00 0.00 C ATOM 1221 O ASP A 78 1.375 -7.364 -4.593 1.00 0.00 O ATOM 1222 CB ASP A 78 4.017 -8.554 -4.369 1.00 0.00 C ATOM 1223 CG ASP A 78 4.971 -9.713 -4.156 1.00 0.00 C ATOM 1224 OD1 ASP A 78 4.490 -10.851 -3.975 1.00 0.00 O ATOM 1225 OD2 ASP A 78 6.198 -9.482 -4.172 1.00 0.00 O ATOM 0 H ASP A 78 2.492 -10.352 -3.586 1.00 0.00 H new ATOM 0 HA ASP A 78 3.613 -8.034 -2.325 1.00 0.00 H new ATOM 0 HB2 ASP A 78 3.447 -8.720 -5.283 1.00 0.00 H new ATOM 0 HB3 ASP A 78 4.590 -7.638 -4.512 1.00 0.00 H new ATOM 1230 N LEU A 79 1.847 -6.337 -2.647 1.00 0.00 N ATOM 1231 CA LEU A 79 0.884 -5.261 -2.855 1.00 0.00 C ATOM 1232 C LEU A 79 1.567 -4.021 -3.422 1.00 0.00 C ATOM 1233 O LEU A 79 2.407 -3.408 -2.762 1.00 0.00 O ATOM 1234 CB LEU A 79 0.184 -4.916 -1.540 1.00 0.00 C ATOM 1235 CG LEU A 79 -0.813 -3.758 -1.594 1.00 0.00 C ATOM 1236 CD1 LEU A 79 -2.094 -4.187 -2.292 1.00 0.00 C ATOM 1237 CD2 LEU A 79 -1.113 -3.246 -0.193 1.00 0.00 C ATOM 0 H LEU A 79 2.367 -6.274 -1.772 1.00 0.00 H new ATOM 0 HA LEU A 79 0.142 -5.605 -3.575 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -0.340 -5.804 -1.187 1.00 0.00 H new ATOM 0 HB3 LEU A 79 0.946 -4.679 -0.797 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.366 -2.946 -2.168 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -2.791 -3.349 -2.320 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.865 -4.504 -3.310 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.545 -5.016 -1.747 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.824 -2.422 -0.251 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.539 -4.051 0.405 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -0.191 -2.897 0.272 1.00 0.00 H new ATOM 1249 N GLN A 80 1.200 -3.656 -4.646 1.00 0.00 N ATOM 1250 CA GLN A 80 1.777 -2.488 -5.300 1.00 0.00 C ATOM 1251 C GLN A 80 0.959 -1.236 -5.000 1.00 0.00 C ATOM 1252 O GLN A 80 -0.089 -1.008 -5.604 1.00 0.00 O ATOM 1253 CB GLN A 80 1.856 -2.710 -6.811 1.00 0.00 C ATOM 1254 CG GLN A 80 2.660 -3.938 -7.204 1.00 0.00 C ATOM 1255 CD GLN A 80 3.280 -3.814 -8.582 1.00 0.00 C ATOM 1256 OE1 GLN A 80 2.586 -3.555 -9.566 1.00 0.00 O ATOM 1257 NE2 GLN A 80 4.593 -3.998 -8.660 1.00 0.00 N ATOM 0 H GLN A 80 0.506 -4.152 -5.205 1.00 0.00 H new ATOM 0 HA GLN A 80 2.784 -2.344 -4.908 1.00 0.00 H new ATOM 0 HB2 GLN A 80 0.846 -2.805 -7.209 1.00 0.00 H new ATOM 0 HB3 GLN A 80 2.301 -1.830 -7.276 1.00 0.00 H new ATOM 0 HG2 GLN A 80 3.448 -4.102 -6.469 1.00 0.00 H new ATOM 0 HG3 GLN A 80 2.013 -4.815 -7.179 1.00 0.00 H new ATOM 0 HE21 GLN A 80 5.129 -4.211 -7.819 1.00 0.00 H new ATOM 0 HE22 GLN A 80 5.065 -3.926 -9.561 1.00 0.00 H new ATOM 1266 N VAL A 81 1.444 -0.428 -4.062 1.00 0.00 N ATOM 1267 CA VAL A 81 0.758 0.801 -3.682 1.00 0.00 C ATOM 1268 C VAL A 81 1.288 1.993 -4.470 1.00 0.00 C ATOM 1269 O VAL A 81 2.488 2.098 -4.727 1.00 0.00 O ATOM 1270 CB VAL A 81 0.910 1.086 -2.176 1.00 0.00 C ATOM 1271 CG1 VAL A 81 2.234 1.780 -1.896 1.00 0.00 C ATOM 1272 CG2 VAL A 81 -0.256 1.922 -1.672 1.00 0.00 C ATOM 0 H VAL A 81 2.310 -0.603 -3.551 1.00 0.00 H new ATOM 0 HA VAL A 81 -0.298 0.658 -3.912 1.00 0.00 H new ATOM 0 HB VAL A 81 0.904 0.136 -1.641 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.324 1.974 -0.827 1.00 0.00 H new ATOM 0 HG12 VAL A 81 3.055 1.141 -2.220 1.00 0.00 H new ATOM 0 HG13 VAL A 81 2.272 2.724 -2.440 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -0.132 2.114 -0.606 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -0.284 2.869 -2.210 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -1.189 1.383 -1.838 1.00 0.00 H new ATOM 1282 N THR A 82 0.386 2.892 -4.853 1.00 0.00 N ATOM 1283 CA THR A 82 0.763 4.077 -5.613 1.00 0.00 C ATOM 1284 C THR A 82 -0.025 5.298 -5.152 1.00 0.00 C ATOM 1285 O THR A 82 -1.246 5.350 -5.293 1.00 0.00 O ATOM 1286 CB THR A 82 0.535 3.872 -7.122 1.00 0.00 C ATOM 1287 OG1 THR A 82 0.767 2.503 -7.471 1.00 0.00 O ATOM 1288 CG2 THR A 82 1.454 4.771 -7.935 1.00 0.00 C ATOM 0 H THR A 82 -0.611 2.821 -4.649 1.00 0.00 H new ATOM 0 HA THR A 82 1.825 4.244 -5.433 1.00 0.00 H new ATOM 0 HB THR A 82 -0.498 4.134 -7.350 1.00 0.00 H new ATOM 0 HG1 THR A 82 0.618 2.381 -8.432 1.00 0.00 H new ATOM 0 HG21 THR A 82 1.275 4.609 -8.998 1.00 0.00 H new ATOM 0 HG22 THR A 82 1.254 5.814 -7.689 1.00 0.00 H new ATOM 0 HG23 THR A 82 2.492 4.536 -7.702 1.00 0.00 H new ATOM 1296 N MET A 83 0.683 6.280 -4.602 1.00 0.00 N ATOM 1297 CA MET A 83 0.049 7.502 -4.123 1.00 0.00 C ATOM 1298 C MET A 83 0.454 8.697 -4.979 1.00 0.00 C ATOM 1299 O MET A 83 1.525 9.280 -4.807 1.00 0.00 O ATOM 1300 CB MET A 83 0.423 7.757 -2.661 1.00 0.00 C ATOM 1301 CG MET A 83 -0.036 6.658 -1.716 1.00 0.00 C ATOM 1302 SD MET A 83 1.199 5.362 -1.506 1.00 0.00 S ATOM 1303 CE MET A 83 1.194 5.174 0.275 1.00 0.00 C ATOM 0 H MET A 83 1.695 6.253 -4.477 1.00 0.00 H new ATOM 0 HA MET A 83 -1.031 7.374 -4.198 1.00 0.00 H new ATOM 0 HB2 MET A 83 1.505 7.862 -2.584 1.00 0.00 H new ATOM 0 HB3 MET A 83 -0.013 8.704 -2.343 1.00 0.00 H new ATOM 0 HG2 MET A 83 -0.269 7.094 -0.744 1.00 0.00 H new ATOM 0 HG3 MET A 83 -0.958 6.218 -2.097 1.00 0.00 H new ATOM 0 HE1 MET A 83 1.359 4.127 0.531 1.00 0.00 H new ATOM 0 HE2 MET A 83 1.988 5.783 0.707 1.00 0.00 H new ATOM 0 HE3 MET A 83 0.232 5.497 0.672 1.00 0.00 H new ATOM 1313 N PRO A 84 -0.419 9.072 -5.926 1.00 0.00 N ATOM 1314 CA PRO A 84 -0.173 10.201 -6.828 1.00 0.00 C ATOM 1315 C PRO A 84 -0.229 11.543 -6.106 1.00 0.00 C ATOM 1316 O PRO A 84 -0.510 11.603 -4.909 1.00 0.00 O ATOM 1317 CB PRO A 84 -1.309 10.094 -7.848 1.00 0.00 C ATOM 1318 CG PRO A 84 -2.398 9.376 -7.129 1.00 0.00 C ATOM 1319 CD PRO A 84 -1.714 8.422 -6.188 1.00 0.00 C ATOM 0 HA PRO A 84 0.822 10.159 -7.272 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -1.637 11.079 -8.180 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -0.993 9.547 -8.736 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -3.032 10.075 -6.584 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -3.041 8.841 -7.828 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -2.286 8.282 -5.271 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -1.586 7.437 -6.637 1.00 0.00 H new ATOM 1327 N HIS A 85 0.038 12.617 -6.842 1.00 0.00 N ATOM 1328 CA HIS A 85 0.017 13.959 -6.271 1.00 0.00 C ATOM 1329 C HIS A 85 -1.386 14.323 -5.792 1.00 0.00 C ATOM 1330 O HIS A 85 -1.585 15.357 -5.154 1.00 0.00 O ATOM 1331 CB HIS A 85 0.497 14.982 -7.301 1.00 0.00 C ATOM 1332 CG HIS A 85 1.514 14.437 -8.256 1.00 0.00 C ATOM 1333 ND1 HIS A 85 2.308 13.343 -8.176 1.00 0.00 N flip ATOM 1334 CD2 HIS A 85 1.810 15.036 -9.463 1.00 0.00 C flip ATOM 1335 CE1 HIS A 85 3.060 13.301 -9.325 1.00 0.00 C flip ATOM 1336 NE2 HIS A 85 2.740 14.333 -10.084 1.00 0.00 N flip ATOM 0 H HIS A 85 0.271 12.584 -7.834 1.00 0.00 H new ATOM 0 HA HIS A 85 0.691 13.973 -5.414 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -0.361 15.347 -7.866 1.00 0.00 H new ATOM 0 HB3 HIS A 85 0.923 15.839 -6.779 1.00 0.00 H new ATOM 0 HD2 HIS A 85 1.353 15.939 -9.841 1.00 0.00 H new ATOM 0 HE1 HIS A 85 3.794 12.547 -9.568 1.00 0.00 H new ATOM 0 HE2 HIS A 85 3.143 14.551 -10.996 1.00 0.00 H new ATOM 1345 N SER A 86 -2.353 13.466 -6.104 1.00 0.00 N ATOM 1346 CA SER A 86 -3.737 13.700 -5.709 1.00 0.00 C ATOM 1347 C SER A 86 -4.036 13.045 -4.364 1.00 0.00 C ATOM 1348 O SER A 86 -4.327 13.726 -3.380 1.00 0.00 O ATOM 1349 CB SER A 86 -4.692 13.160 -6.775 1.00 0.00 C ATOM 1350 OG SER A 86 -4.625 13.935 -7.960 1.00 0.00 O ATOM 0 H SER A 86 -2.204 12.604 -6.629 1.00 0.00 H new ATOM 0 HA SER A 86 -3.884 14.776 -5.611 1.00 0.00 H new ATOM 0 HB2 SER A 86 -4.442 12.123 -7.000 1.00 0.00 H new ATOM 0 HB3 SER A 86 -5.712 13.165 -6.390 1.00 0.00 H new ATOM 0 HG SER A 86 -5.243 13.568 -8.626 1.00 0.00 H new ATOM 1356 N TYR A 87 -3.962 11.719 -4.329 1.00 0.00 N ATOM 1357 CA TYR A 87 -4.227 10.971 -3.106 1.00 0.00 C ATOM 1358 C TYR A 87 -3.749 11.743 -1.880 1.00 0.00 C ATOM 1359 O TYR A 87 -2.789 12.513 -1.935 1.00 0.00 O ATOM 1360 CB TYR A 87 -3.542 9.604 -3.161 1.00 0.00 C ATOM 1361 CG TYR A 87 -3.128 9.079 -1.805 1.00 0.00 C ATOM 1362 CD1 TYR A 87 -2.153 9.726 -1.056 1.00 0.00 C ATOM 1363 CD2 TYR A 87 -3.712 7.936 -1.273 1.00 0.00 C ATOM 1364 CE1 TYR A 87 -1.771 9.250 0.183 1.00 0.00 C ATOM 1365 CE2 TYR A 87 -3.337 7.454 -0.034 1.00 0.00 C ATOM 1366 CZ TYR A 87 -2.366 8.114 0.690 1.00 0.00 C ATOM 1367 OH TYR A 87 -1.989 7.635 1.924 1.00 0.00 O ATOM 0 H TYR A 87 -3.721 11.140 -5.134 1.00 0.00 H new ATOM 0 HA TYR A 87 -5.304 10.827 -3.025 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -4.217 8.887 -3.628 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -2.661 9.674 -3.799 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -1.686 10.617 -1.449 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -4.472 7.416 -1.838 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -1.011 9.765 0.752 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -3.802 6.565 0.366 1.00 0.00 H new ATOM 0 HH TYR A 87 -2.505 6.829 2.133 1.00 0.00 H new ATOM 1377 N PRO A 88 -4.432 11.532 -0.746 1.00 0.00 N ATOM 1378 CA PRO A 88 -5.576 10.618 -0.668 1.00 0.00 C ATOM 1379 C PRO A 88 -6.793 11.148 -1.419 1.00 0.00 C ATOM 1380 O PRO A 88 -7.646 10.378 -1.861 1.00 0.00 O ATOM 1381 CB PRO A 88 -5.866 10.539 0.832 1.00 0.00 C ATOM 1382 CG PRO A 88 -5.338 11.816 1.388 1.00 0.00 C ATOM 1383 CD PRO A 88 -4.142 12.171 0.549 1.00 0.00 C ATOM 0 HA PRO A 88 -5.358 9.653 -1.125 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -6.934 10.435 1.024 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -5.376 9.677 1.285 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -6.092 12.602 1.344 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -5.059 11.700 2.435 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -4.028 13.250 0.448 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -3.218 11.792 0.986 1.00 0.00 H new ATOM 1391 N TYR A 89 -6.867 12.467 -1.560 1.00 0.00 N ATOM 1392 CA TYR A 89 -7.981 13.100 -2.255 1.00 0.00 C ATOM 1393 C TYR A 89 -8.479 12.222 -3.400 1.00 0.00 C ATOM 1394 O TYR A 89 -9.683 12.044 -3.583 1.00 0.00 O ATOM 1395 CB TYR A 89 -7.563 14.469 -2.793 1.00 0.00 C ATOM 1396 CG TYR A 89 -7.530 15.550 -1.737 1.00 0.00 C ATOM 1397 CD1 TYR A 89 -6.444 15.679 -0.880 1.00 0.00 C ATOM 1398 CD2 TYR A 89 -8.585 16.443 -1.595 1.00 0.00 C ATOM 1399 CE1 TYR A 89 -6.410 16.665 0.088 1.00 0.00 C ATOM 1400 CE2 TYR A 89 -8.559 17.433 -0.631 1.00 0.00 C ATOM 1401 CZ TYR A 89 -7.469 17.539 0.207 1.00 0.00 C ATOM 1402 OH TYR A 89 -7.440 18.523 1.169 1.00 0.00 O ATOM 0 H TYR A 89 -6.168 13.118 -1.202 1.00 0.00 H new ATOM 0 HA TYR A 89 -8.794 13.231 -1.541 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -6.575 14.386 -3.247 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -8.253 14.766 -3.583 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -5.612 14.997 -0.972 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -9.440 16.362 -2.249 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -5.559 16.750 0.747 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -9.387 18.119 -0.535 1.00 0.00 H new ATOM 0 HH TYR A 89 -8.262 19.054 1.119 1.00 0.00 H new ATOM 1412 N LEU A 90 -7.542 11.675 -4.166 1.00 0.00 N ATOM 1413 CA LEU A 90 -7.883 10.814 -5.294 1.00 0.00 C ATOM 1414 C LEU A 90 -7.690 9.344 -4.934 1.00 0.00 C ATOM 1415 O LEU A 90 -6.822 9.000 -4.132 1.00 0.00 O ATOM 1416 CB LEU A 90 -7.026 11.170 -6.510 1.00 0.00 C ATOM 1417 CG LEU A 90 -7.100 10.200 -7.690 1.00 0.00 C ATOM 1418 CD1 LEU A 90 -6.895 10.940 -9.003 1.00 0.00 C ATOM 1419 CD2 LEU A 90 -6.069 9.091 -7.534 1.00 0.00 C ATOM 0 H LEU A 90 -6.541 11.812 -4.027 1.00 0.00 H new ATOM 0 HA LEU A 90 -8.933 10.975 -5.538 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -7.320 12.159 -6.860 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -5.987 11.242 -6.189 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.092 9.748 -7.703 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -6.951 10.234 -9.831 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -7.670 11.697 -9.119 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -5.916 11.420 -9.001 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -6.136 8.410 -8.382 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -5.070 9.526 -7.495 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -6.262 8.542 -6.612 1.00 0.00 H new ATOM 1431 N ALA A 91 -8.503 8.481 -5.535 1.00 0.00 N ATOM 1432 CA ALA A 91 -8.418 7.048 -5.281 1.00 0.00 C ATOM 1433 C ALA A 91 -7.093 6.480 -5.777 1.00 0.00 C ATOM 1434 O ALA A 91 -6.862 6.375 -6.982 1.00 0.00 O ATOM 1435 CB ALA A 91 -9.584 6.326 -5.941 1.00 0.00 C ATOM 0 H ALA A 91 -9.228 8.749 -6.201 1.00 0.00 H new ATOM 0 HA ALA A 91 -8.470 6.891 -4.204 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -9.509 5.257 -5.744 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -10.523 6.704 -5.536 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -9.557 6.499 -7.017 1.00 0.00 H new ATOM 1441 N LEU A 92 -6.224 6.115 -4.840 1.00 0.00 N ATOM 1442 CA LEU A 92 -4.920 5.558 -5.182 1.00 0.00 C ATOM 1443 C LEU A 92 -5.072 4.254 -5.960 1.00 0.00 C ATOM 1444 O LEU A 92 -6.185 3.775 -6.173 1.00 0.00 O ATOM 1445 CB LEU A 92 -4.099 5.316 -3.914 1.00 0.00 C ATOM 1446 CG LEU A 92 -4.718 4.371 -2.884 1.00 0.00 C ATOM 1447 CD1 LEU A 92 -4.324 2.932 -3.175 1.00 0.00 C ATOM 1448 CD2 LEU A 92 -4.296 4.767 -1.476 1.00 0.00 C ATOM 0 H LEU A 92 -6.399 6.195 -3.838 1.00 0.00 H new ATOM 0 HA LEU A 92 -4.399 6.278 -5.813 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -3.127 4.918 -4.205 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -3.918 6.277 -3.433 1.00 0.00 H new ATOM 0 HG LEU A 92 -5.803 4.450 -2.953 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -4.774 2.274 -2.431 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -4.676 2.652 -4.168 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -3.239 2.837 -3.135 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -4.746 4.084 -0.756 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -3.210 4.717 -1.394 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -4.629 5.784 -1.269 1.00 0.00 H new ATOM 1460 N GLN A 93 -3.945 3.687 -6.378 1.00 0.00 N ATOM 1461 CA GLN A 93 -3.954 2.438 -7.131 1.00 0.00 C ATOM 1462 C GLN A 93 -3.238 1.333 -6.361 1.00 0.00 C ATOM 1463 O GLN A 93 -2.119 1.522 -5.881 1.00 0.00 O ATOM 1464 CB GLN A 93 -3.292 2.636 -8.496 1.00 0.00 C ATOM 1465 CG GLN A 93 -3.721 1.612 -9.534 1.00 0.00 C ATOM 1466 CD GLN A 93 -4.948 2.047 -10.310 1.00 0.00 C ATOM 1467 OE1 GLN A 93 -6.016 2.263 -9.736 1.00 0.00 O ATOM 1468 NE2 GLN A 93 -4.803 2.178 -11.624 1.00 0.00 N ATOM 0 H GLN A 93 -3.016 4.072 -6.209 1.00 0.00 H new ATOM 0 HA GLN A 93 -4.992 2.139 -7.278 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -3.528 3.635 -8.864 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -2.210 2.588 -8.376 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -2.899 1.438 -10.229 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -3.926 0.663 -9.039 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -3.900 1.989 -12.059 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -5.595 2.468 -12.198 1.00 0.00 H new ATOM 1477 N LEU A 94 -3.889 0.181 -6.246 1.00 0.00 N ATOM 1478 CA LEU A 94 -3.315 -0.955 -5.533 1.00 0.00 C ATOM 1479 C LEU A 94 -3.465 -2.238 -6.343 1.00 0.00 C ATOM 1480 O LEU A 94 -4.538 -2.530 -6.871 1.00 0.00 O ATOM 1481 CB LEU A 94 -3.986 -1.118 -4.168 1.00 0.00 C ATOM 1482 CG LEU A 94 -3.341 -0.358 -3.008 1.00 0.00 C ATOM 1483 CD1 LEU A 94 -4.303 -0.261 -1.834 1.00 0.00 C ATOM 1484 CD2 LEU A 94 -2.045 -1.033 -2.584 1.00 0.00 C ATOM 0 H LEU A 94 -4.815 0.009 -6.637 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.252 -0.762 -5.387 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -5.024 -0.796 -4.255 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -4.001 -2.179 -3.917 1.00 0.00 H new ATOM 0 HG LEU A 94 -3.108 0.652 -3.345 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -3.827 0.283 -1.018 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.205 0.267 -2.145 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.568 -1.263 -1.497 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -1.600 -0.479 -1.758 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -2.254 -2.054 -2.265 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -1.352 -1.050 -3.425 1.00 0.00 H new ATOM 1496 N PHE A 95 -2.382 -3.003 -6.436 1.00 0.00 N ATOM 1497 CA PHE A 95 -2.394 -4.257 -7.181 1.00 0.00 C ATOM 1498 C PHE A 95 -1.677 -5.358 -6.404 1.00 0.00 C ATOM 1499 O PHE A 95 -0.473 -5.278 -6.162 1.00 0.00 O ATOM 1500 CB PHE A 95 -1.733 -4.069 -8.548 1.00 0.00 C ATOM 1501 CG PHE A 95 -2.100 -5.133 -9.543 1.00 0.00 C ATOM 1502 CD1 PHE A 95 -3.257 -5.026 -10.297 1.00 0.00 C ATOM 1503 CD2 PHE A 95 -1.286 -6.240 -9.724 1.00 0.00 C ATOM 1504 CE1 PHE A 95 -3.597 -6.004 -11.212 1.00 0.00 C ATOM 1505 CE2 PHE A 95 -1.621 -7.222 -10.638 1.00 0.00 C ATOM 1506 CZ PHE A 95 -2.777 -7.103 -11.384 1.00 0.00 C ATOM 0 H PHE A 95 -1.486 -2.777 -6.005 1.00 0.00 H new ATOM 0 HA PHE A 95 -3.432 -4.555 -7.325 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -2.016 -3.095 -8.948 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -0.650 -4.059 -8.421 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -3.901 -4.168 -10.168 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -0.380 -6.337 -9.145 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -4.503 -5.910 -11.792 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -0.979 -8.081 -10.768 1.00 0.00 H new ATOM 0 HZ PHE A 95 -3.040 -7.867 -12.100 1.00 0.00 H new ATOM 1516 N GLY A 96 -2.427 -6.385 -6.016 1.00 0.00 N ATOM 1517 CA GLY A 96 -1.847 -7.486 -5.270 1.00 0.00 C ATOM 1518 C GLY A 96 -1.879 -8.790 -6.043 1.00 0.00 C ATOM 1519 O GLY A 96 -2.950 -9.340 -6.301 1.00 0.00 O ATOM 0 H GLY A 96 -3.425 -6.474 -6.205 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -0.815 -7.244 -5.014 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -2.388 -7.610 -4.332 1.00 0.00 H new ATOM 1523 N ARG A 97 -0.703 -9.284 -6.416 1.00 0.00 N ATOM 1524 CA ARG A 97 -0.601 -10.530 -7.166 1.00 0.00 C ATOM 1525 C ARG A 97 0.266 -11.543 -6.424 1.00 0.00 C ATOM 1526 O ARG A 97 1.313 -11.196 -5.878 1.00 0.00 O ATOM 1527 CB ARG A 97 -0.020 -10.266 -8.556 1.00 0.00 C ATOM 1528 CG ARG A 97 1.358 -9.625 -8.528 1.00 0.00 C ATOM 1529 CD ARG A 97 1.636 -8.845 -9.804 1.00 0.00 C ATOM 1530 NE ARG A 97 2.951 -8.210 -9.782 1.00 0.00 N ATOM 1531 CZ ARG A 97 4.073 -8.833 -10.125 1.00 0.00 C ATOM 1532 NH1 ARG A 97 4.040 -10.100 -10.514 1.00 0.00 N ATOM 1533 NH2 ARG A 97 5.232 -8.188 -10.079 1.00 0.00 N ATOM 0 H ARG A 97 0.192 -8.840 -6.211 1.00 0.00 H new ATOM 0 HA ARG A 97 -1.603 -10.945 -7.271 1.00 0.00 H new ATOM 0 HB2 ARG A 97 0.038 -11.208 -9.101 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -0.701 -9.619 -9.109 1.00 0.00 H new ATOM 0 HG2 ARG A 97 1.433 -8.958 -7.669 1.00 0.00 H new ATOM 0 HG3 ARG A 97 2.117 -10.397 -8.399 1.00 0.00 H new ATOM 0 HD2 ARG A 97 1.572 -9.516 -10.660 1.00 0.00 H new ATOM 0 HD3 ARG A 97 0.868 -8.083 -9.938 1.00 0.00 H new ATOM 0 HE ARG A 97 3.011 -7.235 -9.487 1.00 0.00 H new ATOM 0 HH11 ARG A 97 3.151 -10.599 -10.551 1.00 0.00 H new ATOM 0 HH12 ARG A 97 4.903 -10.575 -10.777 1.00 0.00 H new ATOM 0 HH21 ARG A 97 5.262 -7.213 -9.780 1.00 0.00 H new ATOM 0 HH22 ARG A 97 6.093 -8.667 -10.343 1.00 0.00 H new ATOM 1547 N SER A 98 -0.179 -12.796 -6.408 1.00 0.00 N ATOM 1548 CA SER A 98 0.554 -13.858 -5.729 1.00 0.00 C ATOM 1549 C SER A 98 0.562 -15.133 -6.567 1.00 0.00 C ATOM 1550 O SER A 98 -0.486 -15.613 -6.997 1.00 0.00 O ATOM 1551 CB SER A 98 -0.066 -14.139 -4.359 1.00 0.00 C ATOM 1552 OG SER A 98 0.764 -14.992 -3.589 1.00 0.00 O ATOM 0 H SER A 98 -1.043 -13.100 -6.857 1.00 0.00 H new ATOM 0 HA SER A 98 1.583 -13.526 -5.593 1.00 0.00 H new ATOM 0 HB2 SER A 98 -0.221 -13.200 -3.827 1.00 0.00 H new ATOM 0 HB3 SER A 98 -1.046 -14.599 -4.487 1.00 0.00 H new ATOM 0 HG SER A 98 0.800 -14.666 -2.665 1.00 0.00 H new ATOM 1558 N SER A 99 1.754 -15.676 -6.795 1.00 0.00 N ATOM 1559 CA SER A 99 1.901 -16.893 -7.585 1.00 0.00 C ATOM 1560 C SER A 99 0.879 -17.943 -7.160 1.00 0.00 C ATOM 1561 O SER A 99 0.179 -18.516 -7.994 1.00 0.00 O ATOM 1562 CB SER A 99 3.317 -17.454 -7.437 1.00 0.00 C ATOM 1563 OG SER A 99 3.441 -18.705 -8.091 1.00 0.00 O ATOM 0 H SER A 99 2.632 -15.292 -6.444 1.00 0.00 H new ATOM 0 HA SER A 99 1.725 -16.642 -8.631 1.00 0.00 H new ATOM 0 HB2 SER A 99 4.036 -16.749 -7.854 1.00 0.00 H new ATOM 0 HB3 SER A 99 3.558 -17.567 -6.380 1.00 0.00 H new ATOM 0 HG SER A 99 4.355 -19.041 -7.983 1.00 0.00 H new ATOM 1569 N GLU A 100 0.800 -18.189 -5.856 1.00 0.00 N ATOM 1570 CA GLU A 100 -0.136 -19.171 -5.320 1.00 0.00 C ATOM 1571 C GLU A 100 -1.556 -18.886 -5.799 1.00 0.00 C ATOM 1572 O GLU A 100 -2.261 -19.787 -6.257 1.00 0.00 O ATOM 1573 CB GLU A 100 -0.091 -19.168 -3.790 1.00 0.00 C ATOM 1574 CG GLU A 100 1.191 -19.750 -3.218 1.00 0.00 C ATOM 1575 CD GLU A 100 1.164 -21.264 -3.147 1.00 0.00 C ATOM 1576 OE1 GLU A 100 0.266 -21.810 -2.473 1.00 0.00 O ATOM 1577 OE2 GLU A 100 2.041 -21.903 -3.765 1.00 0.00 O ATOM 0 H GLU A 100 1.372 -17.723 -5.152 1.00 0.00 H new ATOM 0 HA GLU A 100 0.161 -20.155 -5.683 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -0.206 -18.144 -3.433 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -0.940 -19.736 -3.409 1.00 0.00 H new ATOM 0 HG2 GLU A 100 2.034 -19.434 -3.832 1.00 0.00 H new ATOM 0 HG3 GLU A 100 1.355 -19.346 -2.219 1.00 0.00 H new ATOM 1584 N LEU A 101 -1.970 -17.629 -5.689 1.00 0.00 N ATOM 1585 CA LEU A 101 -3.307 -17.224 -6.110 1.00 0.00 C ATOM 1586 C LEU A 101 -3.552 -17.589 -7.570 1.00 0.00 C ATOM 1587 O LEU A 101 -2.652 -18.069 -8.260 1.00 0.00 O ATOM 1588 CB LEU A 101 -3.492 -15.719 -5.911 1.00 0.00 C ATOM 1589 CG LEU A 101 -3.947 -15.277 -4.519 1.00 0.00 C ATOM 1590 CD1 LEU A 101 -4.182 -13.774 -4.487 1.00 0.00 C ATOM 1591 CD2 LEU A 101 -5.207 -16.024 -4.108 1.00 0.00 C ATOM 0 H LEU A 101 -1.399 -16.872 -5.312 1.00 0.00 H new ATOM 0 HA LEU A 101 -4.032 -17.757 -5.495 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -2.547 -15.224 -6.137 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -4.221 -15.363 -6.640 1.00 0.00 H new ATOM 0 HG LEU A 101 -3.158 -15.516 -3.806 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -4.505 -13.477 -3.489 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -3.257 -13.256 -4.738 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -4.953 -13.511 -5.211 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -5.516 -15.697 -3.115 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -6.003 -15.816 -4.823 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -5.006 -17.095 -4.091 1.00 0.00 H new ATOM 1603 N ASP A 102 -4.775 -17.358 -8.035 1.00 0.00 N ATOM 1604 CA ASP A 102 -5.138 -17.659 -9.415 1.00 0.00 C ATOM 1605 C ASP A 102 -5.618 -16.404 -10.137 1.00 0.00 C ATOM 1606 O ASP A 102 -5.633 -15.314 -9.565 1.00 0.00 O ATOM 1607 CB ASP A 102 -6.226 -18.734 -9.456 1.00 0.00 C ATOM 1608 CG ASP A 102 -6.226 -19.508 -10.759 1.00 0.00 C ATOM 1609 OD1 ASP A 102 -5.176 -20.092 -11.103 1.00 0.00 O ATOM 1610 OD2 ASP A 102 -7.275 -19.532 -11.435 1.00 0.00 O ATOM 0 H ASP A 102 -5.532 -16.963 -7.476 1.00 0.00 H new ATOM 0 HA ASP A 102 -4.250 -18.032 -9.925 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -6.081 -19.426 -8.626 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -7.200 -18.266 -9.315 1.00 0.00 H new ATOM 1615 N ARG A 103 -6.008 -16.566 -11.398 1.00 0.00 N ATOM 1616 CA ARG A 103 -6.486 -15.445 -12.199 1.00 0.00 C ATOM 1617 C ARG A 103 -7.879 -15.012 -11.751 1.00 0.00 C ATOM 1618 O ARG A 103 -8.136 -13.825 -11.548 1.00 0.00 O ATOM 1619 CB ARG A 103 -6.510 -15.824 -13.681 1.00 0.00 C ATOM 1620 CG ARG A 103 -6.985 -14.701 -14.589 1.00 0.00 C ATOM 1621 CD ARG A 103 -7.656 -15.244 -15.841 1.00 0.00 C ATOM 1622 NE ARG A 103 -7.554 -14.314 -16.963 1.00 0.00 N ATOM 1623 CZ ARG A 103 -8.043 -14.566 -18.172 1.00 0.00 C ATOM 1624 NH1 ARG A 103 -8.666 -15.711 -18.414 1.00 0.00 N ATOM 1625 NH2 ARG A 103 -7.911 -13.670 -19.142 1.00 0.00 N ATOM 0 H ARG A 103 -6.002 -17.462 -11.886 1.00 0.00 H new ATOM 0 HA ARG A 103 -5.801 -14.609 -12.055 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -5.509 -16.128 -13.986 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -7.160 -16.689 -13.816 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -7.684 -14.064 -14.047 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -6.138 -14.076 -14.871 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -7.198 -16.194 -16.115 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -8.706 -15.445 -15.631 1.00 0.00 H new ATOM 0 HE ARG A 103 -7.082 -13.423 -16.810 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -8.771 -16.402 -17.671 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -9.040 -15.901 -19.344 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -7.434 -12.787 -18.959 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -8.287 -13.864 -20.070 1.00 0.00 H new ATOM 1639 N HIS A 104 -8.775 -15.983 -11.599 1.00 0.00 N ATOM 1640 CA HIS A 104 -10.142 -15.702 -11.175 1.00 0.00 C ATOM 1641 C HIS A 104 -10.190 -15.357 -9.689 1.00 0.00 C ATOM 1642 O HIS A 104 -11.101 -14.668 -9.233 1.00 0.00 O ATOM 1643 CB HIS A 104 -11.044 -16.902 -11.462 1.00 0.00 C ATOM 1644 CG HIS A 104 -12.503 -16.608 -11.294 1.00 0.00 C ATOM 1645 ND1 HIS A 104 -13.299 -16.142 -12.318 1.00 0.00 N ATOM 1646 CD2 HIS A 104 -13.310 -16.719 -10.213 1.00 0.00 C ATOM 1647 CE1 HIS A 104 -14.533 -15.977 -11.874 1.00 0.00 C ATOM 1648 NE2 HIS A 104 -14.566 -16.320 -10.599 1.00 0.00 N ATOM 0 H HIS A 104 -8.579 -16.970 -11.763 1.00 0.00 H new ATOM 0 HA HIS A 104 -10.503 -14.843 -11.741 1.00 0.00 H new ATOM 0 HB2 HIS A 104 -10.866 -17.245 -12.481 1.00 0.00 H new ATOM 0 HB3 HIS A 104 -10.768 -17.721 -10.798 1.00 0.00 H new ATOM 0 HD2 HIS A 104 -13.020 -17.058 -9.230 1.00 0.00 H new ATOM 0 HE1 HIS A 104 -15.371 -15.622 -12.455 1.00 0.00 H new ATOM 0 HE2 HIS A 104 -15.390 -16.293 -9.999 1.00 0.00 H new ATOM 1657 N GLN A 105 -9.204 -15.842 -8.942 1.00 0.00 N ATOM 1658 CA GLN A 105 -9.135 -15.586 -7.508 1.00 0.00 C ATOM 1659 C GLN A 105 -8.621 -14.178 -7.230 1.00 0.00 C ATOM 1660 O GLN A 105 -9.085 -13.509 -6.308 1.00 0.00 O ATOM 1661 CB GLN A 105 -8.232 -16.616 -6.828 1.00 0.00 C ATOM 1662 CG GLN A 105 -8.881 -17.981 -6.663 1.00 0.00 C ATOM 1663 CD GLN A 105 -8.313 -18.760 -5.493 1.00 0.00 C ATOM 1664 OE1 GLN A 105 -8.342 -18.158 -4.310 1.00 0.00 O flip ATOM 1665 NE2 GLN A 105 -7.852 -19.891 -5.651 1.00 0.00 N flip ATOM 0 H GLN A 105 -8.442 -16.414 -9.306 1.00 0.00 H new ATOM 0 HA GLN A 105 -10.142 -15.671 -7.100 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -7.318 -16.726 -7.411 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -7.941 -16.240 -5.847 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -9.955 -17.854 -6.523 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -8.745 -18.557 -7.578 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -7.850 -20.316 -6.578 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -7.472 -20.403 -4.855 1.00 0.00 H new ATOM 1674 N GLN A 106 -7.659 -13.736 -8.034 1.00 0.00 N ATOM 1675 CA GLN A 106 -7.080 -12.407 -7.873 1.00 0.00 C ATOM 1676 C GLN A 106 -8.091 -11.325 -8.240 1.00 0.00 C ATOM 1677 O GLN A 106 -8.363 -10.421 -7.449 1.00 0.00 O ATOM 1678 CB GLN A 106 -5.827 -12.265 -8.739 1.00 0.00 C ATOM 1679 CG GLN A 106 -4.555 -12.726 -8.047 1.00 0.00 C ATOM 1680 CD GLN A 106 -3.354 -12.726 -8.972 1.00 0.00 C ATOM 1681 OE1 GLN A 106 -2.846 -13.782 -9.349 1.00 0.00 O ATOM 1682 NE2 GLN A 106 -2.894 -11.537 -9.345 1.00 0.00 N ATOM 0 H GLN A 106 -7.264 -14.278 -8.803 1.00 0.00 H new ATOM 0 HA GLN A 106 -6.805 -12.282 -6.826 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -5.961 -12.840 -9.655 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -5.714 -11.221 -9.032 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -4.353 -12.076 -7.196 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -4.705 -13.731 -7.652 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -3.346 -10.687 -9.008 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -2.089 -11.474 -9.968 1.00 0.00 H new ATOM 1691 N LEU A 107 -8.645 -11.424 -9.443 1.00 0.00 N ATOM 1692 CA LEU A 107 -9.626 -10.453 -9.915 1.00 0.00 C ATOM 1693 C LEU A 107 -10.659 -10.152 -8.834 1.00 0.00 C ATOM 1694 O LEU A 107 -11.091 -9.010 -8.673 1.00 0.00 O ATOM 1695 CB LEU A 107 -10.325 -10.975 -11.172 1.00 0.00 C ATOM 1696 CG LEU A 107 -11.467 -11.965 -10.943 1.00 0.00 C ATOM 1697 CD1 LEU A 107 -12.732 -11.234 -10.524 1.00 0.00 C ATOM 1698 CD2 LEU A 107 -11.716 -12.791 -12.197 1.00 0.00 C ATOM 0 H LEU A 107 -8.432 -12.166 -10.109 1.00 0.00 H new ATOM 0 HA LEU A 107 -9.099 -9.529 -10.155 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -10.716 -10.122 -11.727 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -9.579 -11.453 -11.807 1.00 0.00 H new ATOM 0 HG LEU A 107 -11.180 -12.641 -10.138 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -13.534 -11.955 -10.366 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -12.547 -10.688 -9.599 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -13.024 -10.534 -11.307 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -12.532 -13.490 -12.016 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -11.981 -12.129 -13.022 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -10.813 -13.345 -12.453 1.00 0.00 H new ATOM 1710 N LEU A 108 -11.050 -11.184 -8.093 1.00 0.00 N ATOM 1711 CA LEU A 108 -12.030 -11.030 -7.024 1.00 0.00 C ATOM 1712 C LEU A 108 -11.452 -10.224 -5.866 1.00 0.00 C ATOM 1713 O LEU A 108 -12.120 -9.354 -5.306 1.00 0.00 O ATOM 1714 CB LEU A 108 -12.490 -12.401 -6.526 1.00 0.00 C ATOM 1715 CG LEU A 108 -13.260 -13.257 -7.533 1.00 0.00 C ATOM 1716 CD1 LEU A 108 -13.238 -14.720 -7.116 1.00 0.00 C ATOM 1717 CD2 LEU A 108 -14.692 -12.761 -7.670 1.00 0.00 C ATOM 0 H LEU A 108 -10.703 -12.136 -8.213 1.00 0.00 H new ATOM 0 HA LEU A 108 -12.887 -10.489 -7.426 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -11.613 -12.960 -6.200 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -13.119 -12.254 -5.648 1.00 0.00 H new ATOM 0 HG LEU A 108 -12.772 -13.169 -8.504 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -13.791 -15.314 -7.844 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -12.207 -15.070 -7.070 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -13.701 -14.826 -6.135 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -15.225 -13.382 -8.390 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -15.191 -12.818 -6.703 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -14.687 -11.727 -8.015 1.00 0.00 H new ATOM 1729 N LEU A 109 -10.205 -10.516 -5.514 1.00 0.00 N ATOM 1730 CA LEU A 109 -9.534 -9.816 -4.423 1.00 0.00 C ATOM 1731 C LEU A 109 -9.301 -8.351 -4.778 1.00 0.00 C ATOM 1732 O LEU A 109 -9.838 -7.453 -4.132 1.00 0.00 O ATOM 1733 CB LEU A 109 -8.201 -10.493 -4.101 1.00 0.00 C ATOM 1734 CG LEU A 109 -7.483 -9.998 -2.845 1.00 0.00 C ATOM 1735 CD1 LEU A 109 -7.922 -10.799 -1.629 1.00 0.00 C ATOM 1736 CD2 LEU A 109 -5.974 -10.081 -3.025 1.00 0.00 C ATOM 0 H LEU A 109 -9.638 -11.232 -5.968 1.00 0.00 H new ATOM 0 HA LEU A 109 -10.178 -9.860 -3.545 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -8.376 -11.564 -3.997 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -7.534 -10.360 -4.953 1.00 0.00 H new ATOM 0 HG LEU A 109 -7.752 -8.954 -2.683 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -7.401 -10.433 -0.745 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -8.997 -10.688 -1.489 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -7.683 -11.852 -1.781 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -5.480 -9.725 -2.121 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -5.686 -11.116 -3.212 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -5.674 -9.462 -3.871 1.00 0.00 H new ATOM 1748 N ASN A 110 -8.497 -8.119 -5.811 1.00 0.00 N ATOM 1749 CA ASN A 110 -8.194 -6.762 -6.254 1.00 0.00 C ATOM 1750 C ASN A 110 -9.453 -5.900 -6.266 1.00 0.00 C ATOM 1751 O ASN A 110 -9.543 -4.902 -5.551 1.00 0.00 O ATOM 1752 CB ASN A 110 -7.565 -6.787 -7.648 1.00 0.00 C ATOM 1753 CG ASN A 110 -6.062 -6.982 -7.601 1.00 0.00 C ATOM 1754 OD1 ASN A 110 -5.297 -6.026 -7.728 1.00 0.00 O ATOM 1755 ND2 ASN A 110 -5.632 -8.225 -7.418 1.00 0.00 N ATOM 0 H ASN A 110 -8.044 -8.852 -6.357 1.00 0.00 H new ATOM 0 HA ASN A 110 -7.484 -6.326 -5.551 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -8.015 -7.590 -8.232 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -7.792 -5.853 -8.163 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -4.631 -8.418 -7.378 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -6.303 -8.987 -7.318 1.00 0.00 H new ATOM 1762 N LYS A 111 -10.424 -6.293 -7.084 1.00 0.00 N ATOM 1763 CA LYS A 111 -11.679 -5.559 -7.190 1.00 0.00 C ATOM 1764 C LYS A 111 -12.298 -5.338 -5.813 1.00 0.00 C ATOM 1765 O LYS A 111 -12.743 -4.237 -5.491 1.00 0.00 O ATOM 1766 CB LYS A 111 -12.662 -6.314 -8.088 1.00 0.00 C ATOM 1767 CG LYS A 111 -12.494 -6.008 -9.566 1.00 0.00 C ATOM 1768 CD LYS A 111 -13.037 -7.131 -10.433 1.00 0.00 C ATOM 1769 CE LYS A 111 -13.071 -6.735 -11.901 1.00 0.00 C ATOM 1770 NZ LYS A 111 -11.789 -6.117 -12.339 1.00 0.00 N ATOM 0 H LYS A 111 -10.365 -7.116 -7.683 1.00 0.00 H new ATOM 0 HA LYS A 111 -11.466 -4.586 -7.633 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -12.536 -7.385 -7.931 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -13.680 -6.066 -7.788 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -13.010 -5.079 -9.807 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -11.438 -5.853 -9.789 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -12.418 -8.020 -10.309 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -14.042 -7.394 -10.103 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -13.276 -7.615 -12.510 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -13.888 -6.034 -12.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -11.625 -6.333 -13.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -11.839 -5.086 -12.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -11.007 -6.500 -11.770 1.00 0.00 H new ATOM 1784 N GLY A 112 -12.323 -6.393 -5.004 1.00 0.00 N ATOM 1785 CA GLY A 112 -12.888 -6.293 -3.671 1.00 0.00 C ATOM 1786 C GLY A 112 -12.121 -5.330 -2.787 1.00 0.00 C ATOM 1787 O GLY A 112 -12.688 -4.726 -1.875 1.00 0.00 O ATOM 0 H GLY A 112 -11.962 -7.315 -5.248 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -13.926 -5.967 -3.743 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -12.895 -7.280 -3.208 1.00 0.00 H new ATOM 1791 N LEU A 113 -10.828 -5.186 -3.054 1.00 0.00 N ATOM 1792 CA LEU A 113 -9.980 -4.291 -2.274 1.00 0.00 C ATOM 1793 C LEU A 113 -10.171 -2.842 -2.712 1.00 0.00 C ATOM 1794 O LEU A 113 -10.371 -1.953 -1.884 1.00 0.00 O ATOM 1795 CB LEU A 113 -8.511 -4.691 -2.421 1.00 0.00 C ATOM 1796 CG LEU A 113 -7.484 -3.610 -2.081 1.00 0.00 C ATOM 1797 CD1 LEU A 113 -7.311 -3.493 -0.575 1.00 0.00 C ATOM 1798 CD2 LEU A 113 -6.151 -3.911 -2.752 1.00 0.00 C ATOM 0 H LEU A 113 -10.343 -5.678 -3.805 1.00 0.00 H new ATOM 0 HA LEU A 113 -10.270 -4.376 -1.227 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -8.325 -5.555 -1.783 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -8.344 -5.012 -3.449 1.00 0.00 H new ATOM 0 HG LEU A 113 -7.851 -2.655 -2.459 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -6.577 -2.719 -0.352 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -8.265 -3.230 -0.118 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -6.967 -4.446 -0.173 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -5.432 -3.132 -2.499 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -5.778 -4.875 -2.405 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -6.287 -3.942 -3.833 1.00 0.00 H new ATOM 1810 N THR A 114 -10.110 -2.611 -4.020 1.00 0.00 N ATOM 1811 CA THR A 114 -10.277 -1.271 -4.568 1.00 0.00 C ATOM 1812 C THR A 114 -11.635 -0.690 -4.194 1.00 0.00 C ATOM 1813 O THR A 114 -11.773 0.519 -4.003 1.00 0.00 O ATOM 1814 CB THR A 114 -10.136 -1.270 -6.102 1.00 0.00 C ATOM 1815 OG1 THR A 114 -11.062 -2.196 -6.680 1.00 0.00 O ATOM 1816 CG2 THR A 114 -8.718 -1.637 -6.515 1.00 0.00 C ATOM 0 H THR A 114 -9.946 -3.335 -4.719 1.00 0.00 H new ATOM 0 HA THR A 114 -9.489 -0.653 -4.138 1.00 0.00 H new ATOM 0 HB THR A 114 -10.355 -0.266 -6.464 1.00 0.00 H new ATOM 0 HG1 THR A 114 -11.516 -2.692 -5.967 1.00 0.00 H new ATOM 0 HG21 THR A 114 -8.642 -1.630 -7.602 1.00 0.00 H new ATOM 0 HG22 THR A 114 -8.019 -0.913 -6.098 1.00 0.00 H new ATOM 0 HG23 THR A 114 -8.476 -2.632 -6.141 1.00 0.00 H new ATOM 1824 N SER A 115 -12.637 -1.557 -4.089 1.00 0.00 N ATOM 1825 CA SER A 115 -13.986 -1.128 -3.740 1.00 0.00 C ATOM 1826 C SER A 115 -14.045 -0.638 -2.297 1.00 0.00 C ATOM 1827 O SER A 115 -14.748 0.323 -1.983 1.00 0.00 O ATOM 1828 CB SER A 115 -14.977 -2.277 -3.941 1.00 0.00 C ATOM 1829 OG SER A 115 -15.037 -2.667 -5.302 1.00 0.00 O ATOM 0 H SER A 115 -12.540 -2.561 -4.241 1.00 0.00 H new ATOM 0 HA SER A 115 -14.259 -0.302 -4.397 1.00 0.00 H new ATOM 0 HB2 SER A 115 -14.681 -3.128 -3.328 1.00 0.00 H new ATOM 0 HB3 SER A 115 -15.967 -1.971 -3.603 1.00 0.00 H new ATOM 0 HG SER A 115 -14.277 -3.250 -5.509 1.00 0.00 H new ATOM 1835 N TYR A 116 -13.301 -1.306 -1.422 1.00 0.00 N ATOM 1836 CA TYR A 116 -13.269 -0.941 -0.010 1.00 0.00 C ATOM 1837 C TYR A 116 -12.513 0.368 0.197 1.00 0.00 C ATOM 1838 O TYR A 116 -12.896 1.194 1.025 1.00 0.00 O ATOM 1839 CB TYR A 116 -12.617 -2.055 0.811 1.00 0.00 C ATOM 1840 CG TYR A 116 -12.338 -1.666 2.245 1.00 0.00 C ATOM 1841 CD1 TYR A 116 -13.317 -1.794 3.223 1.00 0.00 C ATOM 1842 CD2 TYR A 116 -11.097 -1.168 2.622 1.00 0.00 C ATOM 1843 CE1 TYR A 116 -13.067 -1.439 4.535 1.00 0.00 C ATOM 1844 CE2 TYR A 116 -10.838 -0.812 3.931 1.00 0.00 C ATOM 1845 CZ TYR A 116 -11.826 -0.949 4.884 1.00 0.00 C ATOM 1846 OH TYR A 116 -11.572 -0.594 6.189 1.00 0.00 O ATOM 0 H TYR A 116 -12.712 -2.103 -1.665 1.00 0.00 H new ATOM 0 HA TYR A 116 -14.296 -0.803 0.327 1.00 0.00 H new ATOM 0 HB2 TYR A 116 -13.266 -2.930 0.801 1.00 0.00 H new ATOM 0 HB3 TYR A 116 -11.681 -2.347 0.334 1.00 0.00 H new ATOM 0 HD1 TYR A 116 -14.290 -2.177 2.953 1.00 0.00 H new ATOM 0 HD2 TYR A 116 -10.321 -1.057 1.879 1.00 0.00 H new ATOM 0 HE1 TYR A 116 -13.839 -1.545 5.283 1.00 0.00 H new ATOM 0 HE2 TYR A 116 -9.867 -0.428 4.207 1.00 0.00 H new ATOM 0 HH TYR A 116 -10.605 -0.499 6.320 1.00 0.00 H new ATOM 1856 N ILE A 117 -11.437 0.549 -0.562 1.00 0.00 N ATOM 1857 CA ILE A 117 -10.628 1.757 -0.464 1.00 0.00 C ATOM 1858 C ILE A 117 -11.325 2.941 -1.126 1.00 0.00 C ATOM 1859 O ILE A 117 -11.116 4.091 -0.744 1.00 0.00 O ATOM 1860 CB ILE A 117 -9.244 1.562 -1.111 1.00 0.00 C ATOM 1861 CG1 ILE A 117 -8.536 0.353 -0.497 1.00 0.00 C ATOM 1862 CG2 ILE A 117 -8.400 2.817 -0.945 1.00 0.00 C ATOM 1863 CD1 ILE A 117 -8.054 0.588 0.917 1.00 0.00 C ATOM 0 H ILE A 117 -11.106 -0.126 -1.251 1.00 0.00 H new ATOM 0 HA ILE A 117 -10.497 1.964 0.598 1.00 0.00 H new ATOM 0 HB ILE A 117 -9.380 1.378 -2.177 1.00 0.00 H new ATOM 0 HG12 ILE A 117 -9.217 -0.498 -0.503 1.00 0.00 H new ATOM 0 HG13 ILE A 117 -7.685 0.085 -1.122 1.00 0.00 H new ATOM 0 HG21 ILE A 117 -7.425 2.664 -1.407 1.00 0.00 H new ATOM 0 HG22 ILE A 117 -8.901 3.658 -1.424 1.00 0.00 H new ATOM 0 HG23 ILE A 117 -8.269 3.030 0.116 1.00 0.00 H new ATOM 0 HD11 ILE A 117 -7.562 -0.311 1.288 1.00 0.00 H new ATOM 0 HD12 ILE A 117 -7.348 1.418 0.927 1.00 0.00 H new ATOM 0 HD13 ILE A 117 -8.904 0.826 1.556 1.00 0.00 H new ATOM 1875 N GLY A 118 -12.155 2.649 -2.123 1.00 0.00 N ATOM 1876 CA GLY A 118 -12.872 3.700 -2.822 1.00 0.00 C ATOM 1877 C GLY A 118 -13.933 4.352 -1.959 1.00 0.00 C ATOM 1878 O GLY A 118 -14.428 5.433 -2.279 1.00 0.00 O ATOM 0 H GLY A 118 -12.344 1.705 -2.459 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -12.164 4.458 -3.156 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -13.339 3.285 -3.715 1.00 0.00 H new ATOM 1882 N THR A 119 -14.286 3.693 -0.859 1.00 0.00 N ATOM 1883 CA THR A 119 -15.298 4.214 0.052 1.00 0.00 C ATOM 1884 C THR A 119 -14.757 5.387 0.861 1.00 0.00 C ATOM 1885 O THR A 119 -15.414 6.421 0.988 1.00 0.00 O ATOM 1886 CB THR A 119 -15.796 3.124 1.020 1.00 0.00 C ATOM 1887 OG1 THR A 119 -14.723 2.688 1.861 1.00 0.00 O ATOM 1888 CG2 THR A 119 -16.362 1.937 0.254 1.00 0.00 C ATOM 0 H THR A 119 -13.886 2.798 -0.578 1.00 0.00 H new ATOM 0 HA THR A 119 -16.132 4.553 -0.562 1.00 0.00 H new ATOM 0 HB THR A 119 -16.588 3.550 1.635 1.00 0.00 H new ATOM 0 HG1 THR A 119 -13.953 2.440 1.307 1.00 0.00 H new ATOM 0 HG21 THR A 119 -16.707 1.180 0.959 1.00 0.00 H new ATOM 0 HG22 THR A 119 -17.198 2.267 -0.363 1.00 0.00 H new ATOM 0 HG23 THR A 119 -15.587 1.512 -0.383 1.00 0.00 H new ATOM 1896 N PHE A 120 -13.557 5.221 1.406 1.00 0.00 N ATOM 1897 CA PHE A 120 -12.928 6.268 2.203 1.00 0.00 C ATOM 1898 C PHE A 120 -13.125 7.636 1.558 1.00 0.00 C ATOM 1899 O PHE A 120 -13.263 7.745 0.339 1.00 0.00 O ATOM 1900 CB PHE A 120 -11.435 5.981 2.373 1.00 0.00 C ATOM 1901 CG PHE A 120 -11.126 5.075 3.530 1.00 0.00 C ATOM 1902 CD1 PHE A 120 -11.374 3.715 3.448 1.00 0.00 C ATOM 1903 CD2 PHE A 120 -10.587 5.584 4.701 1.00 0.00 C ATOM 1904 CE1 PHE A 120 -11.091 2.878 4.511 1.00 0.00 C ATOM 1905 CE2 PHE A 120 -10.301 4.753 5.767 1.00 0.00 C ATOM 1906 CZ PHE A 120 -10.554 3.398 5.673 1.00 0.00 C ATOM 0 H PHE A 120 -13.000 4.372 1.311 1.00 0.00 H new ATOM 0 HA PHE A 120 -13.403 6.278 3.184 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -11.053 5.530 1.457 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -10.905 6.924 2.509 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -11.794 3.303 2.542 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -10.388 6.643 4.781 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -11.289 1.819 4.433 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -9.880 5.162 6.673 1.00 0.00 H new ATOM 0 HZ PHE A 120 -10.333 2.747 6.506 1.00 0.00 H new ATOM 1916 N ASP A 121 -13.136 8.677 2.383 1.00 0.00 N ATOM 1917 CA ASP A 121 -13.315 10.039 1.894 1.00 0.00 C ATOM 1918 C ASP A 121 -11.968 10.724 1.689 1.00 0.00 C ATOM 1919 O ASP A 121 -10.960 10.360 2.296 1.00 0.00 O ATOM 1920 CB ASP A 121 -14.169 10.847 2.872 1.00 0.00 C ATOM 1921 CG ASP A 121 -15.654 10.615 2.672 1.00 0.00 C ATOM 1922 OD1 ASP A 121 -16.252 11.304 1.820 1.00 0.00 O ATOM 1923 OD2 ASP A 121 -16.218 9.745 3.368 1.00 0.00 O ATOM 0 H ASP A 121 -13.023 8.604 3.394 1.00 0.00 H new ATOM 0 HA ASP A 121 -13.827 9.989 0.933 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -13.897 10.581 3.893 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -13.950 11.908 2.750 1.00 0.00 H new ATOM 1928 N PRO A 122 -11.947 11.741 0.814 1.00 0.00 N ATOM 1929 CA PRO A 122 -10.730 12.498 0.509 1.00 0.00 C ATOM 1930 C PRO A 122 -10.280 13.367 1.678 1.00 0.00 C ATOM 1931 O PRO A 122 -11.031 14.214 2.160 1.00 0.00 O ATOM 1932 CB PRO A 122 -11.144 13.371 -0.679 1.00 0.00 C ATOM 1933 CG PRO A 122 -12.620 13.517 -0.545 1.00 0.00 C ATOM 1934 CD PRO A 122 -13.111 12.229 0.055 1.00 0.00 C ATOM 0 HA PRO A 122 -9.884 11.843 0.300 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -10.646 14.340 -0.651 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -10.877 12.903 -1.626 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -12.872 14.365 0.092 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -13.084 13.698 -1.515 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -13.974 12.390 0.702 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -13.417 11.519 -0.713 1.00 0.00 H new ATOM 1942 N GLY A 123 -9.047 13.153 2.129 1.00 0.00 N ATOM 1943 CA GLY A 123 -8.519 13.925 3.238 1.00 0.00 C ATOM 1944 C GLY A 123 -7.794 13.062 4.252 1.00 0.00 C ATOM 1945 O GLY A 123 -6.994 13.562 5.042 1.00 0.00 O ATOM 0 H GLY A 123 -8.405 12.459 1.746 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -7.835 14.683 2.856 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -9.336 14.452 3.732 1.00 0.00 H new ATOM 1949 N GLU A 124 -8.075 11.763 4.230 1.00 0.00 N ATOM 1950 CA GLU A 124 -7.445 10.830 5.157 1.00 0.00 C ATOM 1951 C GLU A 124 -6.638 9.777 4.404 1.00 0.00 C ATOM 1952 O GLU A 124 -6.676 9.711 3.174 1.00 0.00 O ATOM 1953 CB GLU A 124 -8.503 10.151 6.029 1.00 0.00 C ATOM 1954 CG GLU A 124 -9.870 10.066 5.372 1.00 0.00 C ATOM 1955 CD GLU A 124 -9.974 8.917 4.388 1.00 0.00 C ATOM 1956 OE1 GLU A 124 -8.921 8.367 4.004 1.00 0.00 O ATOM 1957 OE2 GLU A 124 -11.110 8.569 4.002 1.00 0.00 O ATOM 0 H GLU A 124 -8.734 11.333 3.581 1.00 0.00 H new ATOM 0 HA GLU A 124 -6.766 11.395 5.796 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -8.166 9.145 6.278 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -8.594 10.698 6.968 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -10.633 9.950 6.142 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -10.079 11.002 4.855 1.00 0.00 H new ATOM 1964 N LEU A 125 -5.907 8.955 5.149 1.00 0.00 N ATOM 1965 CA LEU A 125 -5.090 7.904 4.553 1.00 0.00 C ATOM 1966 C LEU A 125 -5.941 6.693 4.189 1.00 0.00 C ATOM 1967 O LEU A 125 -6.997 6.463 4.780 1.00 0.00 O ATOM 1968 CB LEU A 125 -3.977 7.489 5.517 1.00 0.00 C ATOM 1969 CG LEU A 125 -3.129 8.623 6.093 1.00 0.00 C ATOM 1970 CD1 LEU A 125 -2.006 8.066 6.954 1.00 0.00 C ATOM 1971 CD2 LEU A 125 -2.567 9.489 4.975 1.00 0.00 C ATOM 0 H LEU A 125 -5.863 8.996 6.167 1.00 0.00 H new ATOM 0 HA LEU A 125 -4.644 8.298 3.640 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -4.427 6.942 6.346 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -3.315 6.795 4.999 1.00 0.00 H new ATOM 0 HG LEU A 125 -3.767 9.244 6.722 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -1.413 8.888 7.355 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -2.430 7.489 7.776 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -1.369 7.421 6.349 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -1.966 10.291 5.403 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -1.945 8.879 4.320 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -3.387 9.918 4.400 1.00 0.00 H new ATOM 1983 N CYS A 126 -5.475 5.920 3.214 1.00 0.00 N ATOM 1984 CA CYS A 126 -6.193 4.730 2.772 1.00 0.00 C ATOM 1985 C CYS A 126 -5.303 3.495 2.856 1.00 0.00 C ATOM 1986 O CYS A 126 -5.717 2.451 3.361 1.00 0.00 O ATOM 1987 CB CYS A 126 -6.695 4.915 1.339 1.00 0.00 C ATOM 1988 SG CYS A 126 -7.747 6.367 1.107 1.00 0.00 S ATOM 0 H CYS A 126 -4.603 6.096 2.715 1.00 0.00 H new ATOM 0 HA CYS A 126 -7.047 4.585 3.433 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -5.837 4.991 0.672 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -7.251 4.026 1.043 1.00 0.00 H new ATOM 0 HG CYS A 126 -8.119 6.439 -0.136 1.00 0.00 H new ATOM 1994 N VAL A 127 -4.077 3.620 2.357 1.00 0.00 N ATOM 1995 CA VAL A 127 -3.128 2.513 2.375 1.00 0.00 C ATOM 1996 C VAL A 127 -3.089 1.845 3.745 1.00 0.00 C ATOM 1997 O VAL A 127 -2.880 0.636 3.852 1.00 0.00 O ATOM 1998 CB VAL A 127 -1.709 2.985 2.005 1.00 0.00 C ATOM 1999 CG1 VAL A 127 -1.202 3.999 3.019 1.00 0.00 C ATOM 2000 CG2 VAL A 127 -0.763 1.798 1.906 1.00 0.00 C ATOM 0 H VAL A 127 -3.718 4.477 1.935 1.00 0.00 H new ATOM 0 HA VAL A 127 -3.468 1.792 1.632 1.00 0.00 H new ATOM 0 HB VAL A 127 -1.749 3.471 1.030 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -0.198 4.321 2.741 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -1.868 4.862 3.035 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -1.176 3.542 4.008 1.00 0.00 H new ATOM 0 HG21 VAL A 127 0.235 2.149 1.644 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -0.726 1.281 2.865 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -1.120 1.112 1.138 1.00 0.00 H new ATOM 2010 N CYS A 128 -3.291 2.640 4.790 1.00 0.00 N ATOM 2011 CA CYS A 128 -3.278 2.126 6.155 1.00 0.00 C ATOM 2012 C CYS A 128 -4.378 1.088 6.355 1.00 0.00 C ATOM 2013 O CYS A 128 -4.201 0.115 7.087 1.00 0.00 O ATOM 2014 CB CYS A 128 -3.453 3.270 7.155 1.00 0.00 C ATOM 2015 SG CYS A 128 -2.788 2.921 8.800 1.00 0.00 S ATOM 0 H CYS A 128 -3.466 3.642 4.718 1.00 0.00 H new ATOM 0 HA CYS A 128 -2.314 1.647 6.327 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -2.966 4.161 6.760 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -4.515 3.500 7.245 1.00 0.00 H new ATOM 0 HG CYS A 128 -2.982 3.948 9.573 1.00 0.00 H new ATOM 2021 N ALA A 129 -5.514 1.303 5.700 1.00 0.00 N ATOM 2022 CA ALA A 129 -6.642 0.386 5.806 1.00 0.00 C ATOM 2023 C ALA A 129 -6.479 -0.796 4.858 1.00 0.00 C ATOM 2024 O ALA A 129 -6.583 -1.952 5.268 1.00 0.00 O ATOM 2025 CB ALA A 129 -7.945 1.118 5.521 1.00 0.00 C ATOM 0 H ALA A 129 -5.678 2.104 5.090 1.00 0.00 H new ATOM 0 HA ALA A 129 -6.670 -0.000 6.825 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -8.779 0.421 5.604 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -8.074 1.926 6.242 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -7.917 1.532 4.513 1.00 0.00 H new ATOM 2031 N ALA A 130 -6.224 -0.500 3.587 1.00 0.00 N ATOM 2032 CA ALA A 130 -6.045 -1.539 2.581 1.00 0.00 C ATOM 2033 C ALA A 130 -5.240 -2.709 3.137 1.00 0.00 C ATOM 2034 O ALA A 130 -5.569 -3.871 2.896 1.00 0.00 O ATOM 2035 CB ALA A 130 -5.364 -0.967 1.346 1.00 0.00 C ATOM 0 H ALA A 130 -6.137 0.452 3.230 1.00 0.00 H new ATOM 0 HA ALA A 130 -7.030 -1.911 2.300 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -5.237 -1.754 0.603 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -5.979 -0.170 0.928 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -4.388 -0.567 1.621 1.00 0.00 H new ATOM 2041 N ILE A 131 -4.185 -2.394 3.880 1.00 0.00 N ATOM 2042 CA ILE A 131 -3.333 -3.420 4.470 1.00 0.00 C ATOM 2043 C ILE A 131 -4.148 -4.388 5.322 1.00 0.00 C ATOM 2044 O ILE A 131 -4.340 -5.545 4.950 1.00 0.00 O ATOM 2045 CB ILE A 131 -2.223 -2.799 5.339 1.00 0.00 C ATOM 2046 CG1 ILE A 131 -1.271 -1.972 4.473 1.00 0.00 C ATOM 2047 CG2 ILE A 131 -1.462 -3.887 6.082 1.00 0.00 C ATOM 2048 CD1 ILE A 131 -0.320 -1.111 5.275 1.00 0.00 C ATOM 0 H ILE A 131 -3.899 -1.437 4.088 1.00 0.00 H new ATOM 0 HA ILE A 131 -2.875 -3.963 3.644 1.00 0.00 H new ATOM 0 HB ILE A 131 -2.683 -2.138 6.074 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -0.693 -2.644 3.839 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -1.856 -1.334 3.811 1.00 0.00 H new ATOM 0 HG21 ILE A 131 -0.681 -3.433 6.692 1.00 0.00 H new ATOM 0 HG22 ILE A 131 -2.149 -4.438 6.724 1.00 0.00 H new ATOM 0 HG23 ILE A 131 -1.010 -4.570 5.363 1.00 0.00 H new ATOM 0 HD11 ILE A 131 0.325 -0.553 4.597 1.00 0.00 H new ATOM 0 HD12 ILE A 131 -0.890 -0.414 5.890 1.00 0.00 H new ATOM 0 HD13 ILE A 131 0.291 -1.745 5.917 1.00 0.00 H new ATOM 2060 N GLN A 132 -4.626 -3.904 6.464 1.00 0.00 N ATOM 2061 CA GLN A 132 -5.422 -4.727 7.367 1.00 0.00 C ATOM 2062 C GLN A 132 -6.562 -5.411 6.619 1.00 0.00 C ATOM 2063 O GLN A 132 -6.716 -6.631 6.685 1.00 0.00 O ATOM 2064 CB GLN A 132 -5.983 -3.874 8.506 1.00 0.00 C ATOM 2065 CG GLN A 132 -6.532 -4.692 9.665 1.00 0.00 C ATOM 2066 CD GLN A 132 -5.538 -5.715 10.179 1.00 0.00 C ATOM 2067 OE1 GLN A 132 -5.530 -6.865 9.740 1.00 0.00 O ATOM 2068 NE2 GLN A 132 -4.692 -5.301 11.115 1.00 0.00 N ATOM 0 H GLN A 132 -4.476 -2.948 6.785 1.00 0.00 H new ATOM 0 HA GLN A 132 -4.773 -5.497 7.784 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -5.197 -3.216 8.877 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -6.775 -3.236 8.115 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -6.811 -4.022 10.478 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -7.441 -5.202 9.346 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -4.734 -4.339 11.450 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -4.001 -5.945 11.499 1.00 0.00 H new ATOM 2077 N TRP A 133 -7.357 -4.618 5.910 1.00 0.00 N ATOM 2078 CA TRP A 133 -8.483 -5.148 5.150 1.00 0.00 C ATOM 2079 C TRP A 133 -8.107 -6.454 4.458 1.00 0.00 C ATOM 2080 O TRP A 133 -8.636 -7.517 4.786 1.00 0.00 O ATOM 2081 CB TRP A 133 -8.953 -4.125 4.114 1.00 0.00 C ATOM 2082 CG TRP A 133 -10.168 -4.563 3.355 1.00 0.00 C ATOM 2083 CD1 TRP A 133 -11.472 -4.322 3.685 1.00 0.00 C ATOM 2084 CD2 TRP A 133 -10.193 -5.320 2.140 1.00 0.00 C ATOM 2085 NE1 TRP A 133 -12.305 -4.883 2.748 1.00 0.00 N ATOM 2086 CE2 TRP A 133 -11.545 -5.500 1.789 1.00 0.00 C ATOM 2087 CE3 TRP A 133 -9.205 -5.860 1.313 1.00 0.00 C ATOM 2088 CZ2 TRP A 133 -11.931 -6.199 0.649 1.00 0.00 C ATOM 2089 CZ3 TRP A 133 -9.590 -6.554 0.182 1.00 0.00 C ATOM 2090 CH2 TRP A 133 -10.943 -6.718 -0.143 1.00 0.00 C ATOM 0 H TRP A 133 -7.243 -3.606 5.845 1.00 0.00 H new ATOM 0 HA TRP A 133 -9.296 -5.349 5.847 1.00 0.00 H new ATOM 0 HB2 TRP A 133 -9.168 -3.182 4.617 1.00 0.00 H new ATOM 0 HB3 TRP A 133 -8.143 -3.933 3.410 1.00 0.00 H new ATOM 0 HD1 TRP A 133 -11.799 -3.771 4.555 1.00 0.00 H new ATOM 0 HE1 TRP A 133 -13.324 -4.846 2.763 1.00 0.00 H new ATOM 0 HE3 TRP A 133 -8.159 -5.737 1.553 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -12.974 -6.327 0.398 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 -8.835 -6.978 -0.463 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -11.211 -7.264 -1.035 1.00 0.00 H new ATOM 2101 N LEU A 134 -7.191 -6.368 3.500 1.00 0.00 N ATOM 2102 CA LEU A 134 -6.744 -7.544 2.761 1.00 0.00 C ATOM 2103 C LEU A 134 -6.590 -8.744 3.690 1.00 0.00 C ATOM 2104 O LEU A 134 -7.260 -9.762 3.520 1.00 0.00 O ATOM 2105 CB LEU A 134 -5.416 -7.255 2.059 1.00 0.00 C ATOM 2106 CG LEU A 134 -5.516 -6.621 0.671 1.00 0.00 C ATOM 2107 CD1 LEU A 134 -4.162 -6.085 0.230 1.00 0.00 C ATOM 2108 CD2 LEU A 134 -6.047 -7.628 -0.339 1.00 0.00 C ATOM 0 H LEU A 134 -6.743 -5.497 3.217 1.00 0.00 H new ATOM 0 HA LEU A 134 -7.500 -7.781 2.012 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -4.827 -6.596 2.696 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -4.863 -8.190 1.971 1.00 0.00 H new ATOM 0 HG LEU A 134 -6.215 -5.786 0.724 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -4.253 -5.638 -0.760 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -3.821 -5.331 0.939 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -3.441 -6.902 0.194 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -6.111 -7.159 -1.321 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -5.373 -8.483 -0.389 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -7.037 -7.964 -0.032 1.00 0.00 H new ATOM 2120 N GLN A 135 -5.705 -8.615 4.673 1.00 0.00 N ATOM 2121 CA GLN A 135 -5.464 -9.689 5.630 1.00 0.00 C ATOM 2122 C GLN A 135 -6.767 -10.393 5.996 1.00 0.00 C ATOM 2123 O GLN A 135 -6.948 -11.575 5.705 1.00 0.00 O ATOM 2124 CB GLN A 135 -4.797 -9.138 6.891 1.00 0.00 C ATOM 2125 CG GLN A 135 -3.431 -8.520 6.635 1.00 0.00 C ATOM 2126 CD GLN A 135 -2.606 -8.385 7.900 1.00 0.00 C ATOM 2127 OE1 GLN A 135 -1.471 -9.072 7.943 1.00 0.00 O flip ATOM 2128 NE2 GLN A 135 -2.985 -7.670 8.829 1.00 0.00 N flip ATOM 0 H GLN A 135 -5.143 -7.778 4.828 1.00 0.00 H new ATOM 0 HA GLN A 135 -4.798 -10.415 5.163 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -5.448 -8.387 7.338 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -4.692 -9.943 7.618 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -2.888 -9.133 5.915 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -3.560 -7.537 6.183 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -3.865 -7.159 8.753 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -2.419 -7.589 9.674 1.00 0.00 H new ATOM 2137 N ASP A 136 -7.670 -9.659 6.637 1.00 0.00 N ATOM 2138 CA ASP A 136 -8.957 -10.213 7.043 1.00 0.00 C ATOM 2139 C ASP A 136 -9.733 -10.725 5.834 1.00 0.00 C ATOM 2140 O ASP A 136 -10.588 -11.601 5.959 1.00 0.00 O ATOM 2141 CB ASP A 136 -9.779 -9.158 7.783 1.00 0.00 C ATOM 2142 CG ASP A 136 -10.924 -9.764 8.571 1.00 0.00 C ATOM 2143 OD1 ASP A 136 -10.676 -10.270 9.685 1.00 0.00 O ATOM 2144 OD2 ASP A 136 -12.069 -9.732 8.073 1.00 0.00 O ATOM 0 H ASP A 136 -7.535 -8.679 6.887 1.00 0.00 H new ATOM 0 HA ASP A 136 -8.769 -11.052 7.713 1.00 0.00 H new ATOM 0 HB2 ASP A 136 -9.129 -8.604 8.460 1.00 0.00 H new ATOM 0 HB3 ASP A 136 -10.176 -8.441 7.064 1.00 0.00 H new ATOM 2149 N ASN A 137 -9.430 -10.172 4.664 1.00 0.00 N ATOM 2150 CA ASN A 137 -10.101 -10.572 3.432 1.00 0.00 C ATOM 2151 C ASN A 137 -9.128 -11.265 2.483 1.00 0.00 C ATOM 2152 O ASN A 137 -8.989 -10.872 1.325 1.00 0.00 O ATOM 2153 CB ASN A 137 -10.721 -9.353 2.746 1.00 0.00 C ATOM 2154 CG ASN A 137 -11.924 -8.816 3.496 1.00 0.00 C ATOM 2155 OD1 ASN A 137 -13.066 -9.155 3.184 1.00 0.00 O ATOM 2156 ND2 ASN A 137 -11.673 -7.974 4.491 1.00 0.00 N ATOM 0 H ASN A 137 -8.724 -9.446 4.543 1.00 0.00 H new ATOM 0 HA ASN A 137 -10.892 -11.276 3.690 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -9.970 -8.568 2.659 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -11.019 -9.622 1.733 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -12.443 -7.580 5.032 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -10.710 -7.721 4.714 1.00 0.00 H new ATOM 2163 N SER A 138 -8.458 -12.299 2.982 1.00 0.00 N ATOM 2164 CA SER A 138 -7.496 -13.045 2.180 1.00 0.00 C ATOM 2165 C SER A 138 -7.838 -14.532 2.166 1.00 0.00 C ATOM 2166 O SER A 138 -7.924 -15.150 1.105 1.00 0.00 O ATOM 2167 CB SER A 138 -6.080 -12.841 2.723 1.00 0.00 C ATOM 2168 OG SER A 138 -5.119 -12.930 1.686 1.00 0.00 O ATOM 0 H SER A 138 -8.564 -12.639 3.938 1.00 0.00 H new ATOM 0 HA SER A 138 -7.543 -12.669 1.158 1.00 0.00 H new ATOM 0 HB2 SER A 138 -6.009 -11.866 3.206 1.00 0.00 H new ATOM 0 HB3 SER A 138 -5.868 -13.591 3.485 1.00 0.00 H new ATOM 0 HG SER A 138 -4.429 -12.247 1.820 1.00 0.00 H new ATOM 2174 N ALA A 139 -8.031 -15.099 3.352 1.00 0.00 N ATOM 2175 CA ALA A 139 -8.365 -16.512 3.477 1.00 0.00 C ATOM 2176 C ALA A 139 -9.635 -16.847 2.702 1.00 0.00 C ATOM 2177 O ALA A 139 -9.709 -17.873 2.026 1.00 0.00 O ATOM 2178 CB ALA A 139 -8.525 -16.889 4.943 1.00 0.00 C ATOM 0 H ALA A 139 -7.962 -14.602 4.240 1.00 0.00 H new ATOM 0 HA ALA A 139 -7.547 -17.092 3.051 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -8.774 -17.947 5.021 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -7.592 -16.696 5.472 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -9.323 -16.294 5.387 1.00 0.00 H new ATOM 2184 N SER A 140 -10.633 -15.976 2.806 1.00 0.00 N ATOM 2185 CA SER A 140 -11.903 -16.181 2.118 1.00 0.00 C ATOM 2186 C SER A 140 -11.674 -16.653 0.685 1.00 0.00 C ATOM 2187 O SER A 140 -12.449 -17.445 0.149 1.00 0.00 O ATOM 2188 CB SER A 140 -12.722 -14.889 2.117 1.00 0.00 C ATOM 2189 OG SER A 140 -13.194 -14.584 3.418 1.00 0.00 O ATOM 0 H SER A 140 -10.587 -15.121 3.360 1.00 0.00 H new ATOM 0 HA SER A 140 -12.457 -16.953 2.652 1.00 0.00 H new ATOM 0 HB2 SER A 140 -12.110 -14.067 1.747 1.00 0.00 H new ATOM 0 HB3 SER A 140 -13.566 -14.990 1.435 1.00 0.00 H new ATOM 0 HG SER A 140 -13.713 -13.753 3.391 1.00 0.00 H new ATOM 2195 N TYR A 141 -10.604 -16.159 0.071 1.00 0.00 N ATOM 2196 CA TYR A 141 -10.273 -16.527 -1.301 1.00 0.00 C ATOM 2197 C TYR A 141 -9.446 -17.809 -1.337 1.00 0.00 C ATOM 2198 O TYR A 141 -9.784 -18.760 -2.042 1.00 0.00 O ATOM 2199 CB TYR A 141 -9.507 -15.393 -1.984 1.00 0.00 C ATOM 2200 CG TYR A 141 -10.234 -14.068 -1.957 1.00 0.00 C ATOM 2201 CD1 TYR A 141 -10.274 -13.299 -0.801 1.00 0.00 C ATOM 2202 CD2 TYR A 141 -10.883 -13.586 -3.087 1.00 0.00 C ATOM 2203 CE1 TYR A 141 -10.938 -12.088 -0.771 1.00 0.00 C ATOM 2204 CE2 TYR A 141 -11.548 -12.376 -3.067 1.00 0.00 C ATOM 2205 CZ TYR A 141 -11.573 -11.630 -1.907 1.00 0.00 C ATOM 2206 OH TYR A 141 -12.236 -10.425 -1.882 1.00 0.00 O ATOM 0 H TYR A 141 -9.952 -15.503 0.501 1.00 0.00 H new ATOM 0 HA TYR A 141 -11.205 -16.703 -1.838 1.00 0.00 H new ATOM 0 HB2 TYR A 141 -8.538 -15.276 -1.498 1.00 0.00 H new ATOM 0 HB3 TYR A 141 -9.312 -15.670 -3.020 1.00 0.00 H new ATOM 0 HD1 TYR A 141 -9.777 -13.654 0.090 1.00 0.00 H new ATOM 0 HD2 TYR A 141 -10.867 -14.168 -3.997 1.00 0.00 H new ATOM 0 HE1 TYR A 141 -10.960 -11.503 0.137 1.00 0.00 H new ATOM 0 HE2 TYR A 141 -12.046 -12.016 -3.955 1.00 0.00 H new ATOM 0 HH TYR A 141 -12.627 -10.249 -2.763 1.00 0.00 H new ATOM 2216 N PHE A 142 -8.361 -17.827 -0.571 1.00 0.00 N ATOM 2217 CA PHE A 142 -7.484 -18.990 -0.514 1.00 0.00 C ATOM 2218 C PHE A 142 -8.255 -20.231 -0.073 1.00 0.00 C ATOM 2219 O PHE A 142 -8.561 -21.107 -0.884 1.00 0.00 O ATOM 2220 CB PHE A 142 -6.320 -18.732 0.445 1.00 0.00 C ATOM 2221 CG PHE A 142 -5.277 -17.806 -0.113 1.00 0.00 C ATOM 2222 CD1 PHE A 142 -4.401 -18.240 -1.095 1.00 0.00 C ATOM 2223 CD2 PHE A 142 -5.174 -16.502 0.344 1.00 0.00 C ATOM 2224 CE1 PHE A 142 -3.441 -17.390 -1.611 1.00 0.00 C ATOM 2225 CE2 PHE A 142 -4.216 -15.648 -0.169 1.00 0.00 C ATOM 2226 CZ PHE A 142 -3.347 -16.093 -1.147 1.00 0.00 C ATOM 0 H PHE A 142 -8.068 -17.049 0.019 1.00 0.00 H new ATOM 0 HA PHE A 142 -7.089 -19.165 -1.515 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -6.710 -18.311 1.372 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -5.852 -19.683 0.699 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -4.469 -19.254 -1.461 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -5.850 -16.149 1.109 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -2.765 -17.740 -2.377 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -4.147 -14.633 0.194 1.00 0.00 H new ATOM 0 HZ PHE A 142 -2.596 -15.428 -1.547 1.00 0.00 H new