USER MOD reduce.3.24.130724 H: found=0, std=0, add=1037, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1041 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 121 ASN : amide:sc= 0.588 K(o=-3.2,f=-3.8) USER MOD Set 1.2: A 142 ASN : amide:sc= -4.5! C(o=-3.2!,f=-13!) USER MOD Set 1.3: A 144 ASN : amide:sc= 1.04 K(o=-3.2,f=-5.2) USER MOD Set 1.4: A 147 THR OG1 : rot -65:sc= -0.351 USER MOD Set 2.1: A 110 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 112 THR OG1 : rot 60:sc= 0.0614 USER MOD Set 3.1: A 80 CYS SG : rot 156:sc= -0.705 USER MOD Set 3.2: A 103 ASN : amide:sc= -0.368 K(o=-1.1,f=-3.8!) USER MOD Set 4.1: A 38 TYR OH : rot 180:sc= 0.00641 USER MOD Set 4.2: A 47 ASN : amide:sc= -0.0268 X(o=-0.02,f=0.31) USER MOD Set 5.1: A 35 THR OG1 : rot 170:sc= 1.82 USER MOD Set 5.2: A 66 TYR OH : rot 80:sc= -0.375 USER MOD Set 6.1: A 32 TYR OH : rot -140:sc= -0.866 USER MOD Set 6.2: A 84 CYS SG : rot 157:sc= -0.406 USER MOD Set 6.3: A 96 HIS : no HE2:sc= -2.86 K(o=-4.1,f=-6.2!) USER MOD Set 7.1: A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 7.2: A 61 ASN : amide:sc= -4.46! C(o=-4.5!,f=-4.7!) USER MOD Set 8.1: A 9 SER OG : rot 180:sc= 0 USER MOD Set 8.2: A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 CYS SG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot -98:sc= 1.97 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -139:sc= -0.936 (180deg=-1.8!) USER MOD Single : A 39 HIS :FLIP no HD1:sc= -7.72! C(o=-8.3!,f=-7.7!) USER MOD Single : A 45 CYS SG : rot 56:sc= 0.0777 USER MOD Single : A 49 ASN : amide:sc= 0.185 K(o=0.18,f=-6.4!) USER MOD Single : A 50 THR OG1 : rot -127:sc= 0.463 USER MOD Single : A 51 GLN : amide:sc= -0.0121 K(o=-0.012,f=-1.4) USER MOD Single : A 55 CYS SG : rot 180:sc= -0.102 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -0.0295 X(o=-0.03,f=0) USER MOD Single : A 65 ASN : amide:sc= 0.0829 K(o=0.083,f=-5!) USER MOD Single : A 82 SER OG : rot 130:sc= -2.72! USER MOD Single : A 85 SER OG : rot 180:sc= -3.27! USER MOD Single : A 87 LYS NZ :NH3+ -153:sc= 0 (180deg=-0.0829) USER MOD Single : A 97 CYS SG : rot 180:sc= -0.0908 USER MOD Single : A 105 ASN : amide:sc= -0.756 X(o=-0.76,f=-0.31) USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 86:sc= 0.0693 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 MET CE :methyl 163:sc= 0 (180deg=-0.051) USER MOD Single : A 134 ASN :FLIP amide:sc= -0.329 F(o=-2.5,f=-0.33) USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 45:sc= 0.358 USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 CYS SG : rot 37:sc= -3.64! USER MOD Single : A 158 SER OG : rot -58:sc= 0.681 USER MOD ----------------------------------------------------------------- ATOM 80 N SER A 9 -0.409 11.689 -7.732 1.00 0.00 N ATOM 81 CA SER A 9 -1.780 11.687 -7.235 1.00 0.00 C ATOM 82 C SER A 9 -2.232 10.270 -6.894 1.00 0.00 C ATOM 83 O SER A 9 -2.853 10.038 -5.858 1.00 0.00 O ATOM 84 CB SER A 9 -2.722 12.300 -8.273 1.00 0.00 C ATOM 85 OG SER A 9 -2.568 13.707 -8.334 1.00 0.00 O ATOM 0 HA SER A 9 -1.812 12.288 -6.326 1.00 0.00 H new ATOM 0 HB2 SER A 9 -2.520 11.866 -9.252 1.00 0.00 H new ATOM 0 HB3 SER A 9 -3.754 12.055 -8.022 1.00 0.00 H new ATOM 0 HG SER A 9 -3.180 14.074 -9.006 1.00 0.00 H new ATOM 91 N ALA A 10 -1.916 9.327 -7.776 1.00 0.00 N ATOM 92 CA ALA A 10 -2.288 7.933 -7.569 1.00 0.00 C ATOM 93 C ALA A 10 -1.054 7.059 -7.374 1.00 0.00 C ATOM 94 O ALA A 10 -0.042 7.235 -8.055 1.00 0.00 O ATOM 95 CB ALA A 10 -3.116 7.428 -8.741 1.00 0.00 C ATOM 0 H ALA A 10 -1.404 9.503 -8.640 1.00 0.00 H new ATOM 0 HA ALA A 10 -2.890 7.874 -6.662 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -3.387 6.386 -8.573 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -4.021 8.028 -8.832 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -2.534 7.508 -9.659 1.00 0.00 H new ATOM 101 N LEU A 11 -1.142 6.117 -6.442 1.00 0.00 N ATOM 102 CA LEU A 11 -0.032 5.215 -6.158 1.00 0.00 C ATOM 103 C LEU A 11 -0.190 3.901 -6.916 1.00 0.00 C ATOM 104 O LEU A 11 -1.283 3.338 -6.982 1.00 0.00 O ATOM 105 CB LEU A 11 0.057 4.942 -4.655 1.00 0.00 C ATOM 106 CG LEU A 11 0.703 3.616 -4.251 1.00 0.00 C ATOM 107 CD1 LEU A 11 2.146 3.558 -4.726 1.00 0.00 C ATOM 108 CD2 LEU A 11 0.628 3.425 -2.743 1.00 0.00 C ATOM 0 H LEU A 11 -1.971 5.958 -5.870 1.00 0.00 H new ATOM 0 HA LEU A 11 0.888 5.696 -6.489 1.00 0.00 H new ATOM 0 HB2 LEU A 11 0.619 5.753 -4.191 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -0.950 4.974 -4.240 1.00 0.00 H new ATOM 0 HG LEU A 11 0.153 2.805 -4.728 1.00 0.00 H new ATOM 0 HD11 LEU A 11 2.589 2.607 -4.429 1.00 0.00 H new ATOM 0 HD12 LEU A 11 2.176 3.649 -5.812 1.00 0.00 H new ATOM 0 HD13 LEU A 11 2.710 4.376 -4.278 1.00 0.00 H new ATOM 0 HD21 LEU A 11 1.092 2.477 -2.473 1.00 0.00 H new ATOM 0 HD22 LEU A 11 1.153 4.241 -2.246 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -0.416 3.421 -2.428 1.00 0.00 H new ATOM 120 N ARG A 12 0.909 3.416 -7.484 1.00 0.00 N ATOM 121 CA ARG A 12 0.893 2.167 -8.237 1.00 0.00 C ATOM 122 C ARG A 12 2.106 1.308 -7.891 1.00 0.00 C ATOM 123 O ARG A 12 3.237 1.795 -7.865 1.00 0.00 O ATOM 124 CB ARG A 12 0.869 2.453 -9.740 1.00 0.00 C ATOM 125 CG ARG A 12 1.237 1.251 -10.594 1.00 0.00 C ATOM 126 CD ARG A 12 0.589 1.325 -11.968 1.00 0.00 C ATOM 127 NE ARG A 12 1.436 2.017 -12.936 1.00 0.00 N ATOM 128 CZ ARG A 12 1.161 2.090 -14.233 1.00 0.00 C ATOM 129 NH1 ARG A 12 0.066 1.518 -14.715 1.00 0.00 N ATOM 130 NH2 ARG A 12 1.981 2.738 -15.051 1.00 0.00 N ATOM 0 H ARG A 12 1.822 3.869 -7.437 1.00 0.00 H new ATOM 0 HA ARG A 12 -0.009 1.619 -7.964 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -0.127 2.796 -10.020 1.00 0.00 H new ATOM 0 HB3 ARG A 12 1.560 3.268 -9.957 1.00 0.00 H new ATOM 0 HG2 ARG A 12 2.320 1.199 -10.704 1.00 0.00 H new ATOM 0 HG3 ARG A 12 0.923 0.336 -10.091 1.00 0.00 H new ATOM 0 HD2 ARG A 12 0.380 0.317 -12.325 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -0.368 1.840 -11.890 1.00 0.00 H new ATOM 0 HE ARG A 12 2.285 2.469 -12.597 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -0.567 1.021 -14.089 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -0.143 1.576 -15.712 1.00 0.00 H new ATOM 0 HH21 ARG A 12 2.823 3.180 -14.684 1.00 0.00 H new ATOM 0 HH22 ARG A 12 1.769 2.793 -16.047 1.00 0.00 H new ATOM 144 N ILE A 13 1.862 0.029 -7.625 1.00 0.00 N ATOM 145 CA ILE A 13 2.933 -0.897 -7.282 1.00 0.00 C ATOM 146 C ILE A 13 2.740 -2.243 -7.972 1.00 0.00 C ATOM 147 O ILE A 13 1.628 -2.770 -8.029 1.00 0.00 O ATOM 148 CB ILE A 13 3.018 -1.121 -5.760 1.00 0.00 C ATOM 149 CG1 ILE A 13 3.202 0.214 -5.036 1.00 0.00 C ATOM 150 CG2 ILE A 13 4.158 -2.072 -5.427 1.00 0.00 C ATOM 151 CD1 ILE A 13 2.887 0.148 -3.558 1.00 0.00 C ATOM 0 H ILE A 13 0.932 -0.389 -7.641 1.00 0.00 H new ATOM 0 HA ILE A 13 3.863 -0.445 -7.628 1.00 0.00 H new ATOM 0 HB ILE A 13 2.085 -1.571 -5.421 1.00 0.00 H new ATOM 0 HG12 ILE A 13 4.231 0.549 -5.165 1.00 0.00 H new ATOM 0 HG13 ILE A 13 2.562 0.963 -5.503 1.00 0.00 H new ATOM 0 HG21 ILE A 13 4.205 -2.220 -4.348 1.00 0.00 H new ATOM 0 HG22 ILE A 13 3.988 -3.030 -5.918 1.00 0.00 H new ATOM 0 HG23 ILE A 13 5.099 -1.648 -5.776 1.00 0.00 H new ATOM 0 HD11 ILE A 13 3.039 1.130 -3.109 1.00 0.00 H new ATOM 0 HD12 ILE A 13 1.850 -0.157 -3.420 1.00 0.00 H new ATOM 0 HD13 ILE A 13 3.545 -0.576 -3.078 1.00 0.00 H new ATOM 163 N LYS A 14 3.829 -2.796 -8.495 1.00 0.00 N ATOM 164 CA LYS A 14 3.781 -4.082 -9.179 1.00 0.00 C ATOM 165 C LYS A 14 4.623 -5.121 -8.445 1.00 0.00 C ATOM 166 O LYS A 14 5.791 -4.881 -8.137 1.00 0.00 O ATOM 167 CB LYS A 14 4.276 -3.935 -10.620 1.00 0.00 C ATOM 168 CG LYS A 14 4.202 -5.223 -11.423 1.00 0.00 C ATOM 169 CD LYS A 14 5.154 -5.197 -12.607 1.00 0.00 C ATOM 170 CE LYS A 14 5.119 -6.507 -13.379 1.00 0.00 C ATOM 171 NZ LYS A 14 5.979 -6.458 -14.594 1.00 0.00 N ATOM 0 H LYS A 14 4.756 -2.373 -8.458 1.00 0.00 H new ATOM 0 HA LYS A 14 2.745 -4.421 -9.189 1.00 0.00 H new ATOM 0 HB2 LYS A 14 3.685 -3.169 -11.122 1.00 0.00 H new ATOM 0 HB3 LYS A 14 5.308 -3.584 -10.607 1.00 0.00 H new ATOM 0 HG2 LYS A 14 4.444 -6.069 -10.779 1.00 0.00 H new ATOM 0 HG3 LYS A 14 3.182 -5.374 -11.778 1.00 0.00 H new ATOM 0 HD2 LYS A 14 4.888 -4.375 -13.271 1.00 0.00 H new ATOM 0 HD3 LYS A 14 6.168 -5.007 -12.256 1.00 0.00 H new ATOM 0 HE2 LYS A 14 5.451 -7.319 -12.732 1.00 0.00 H new ATOM 0 HE3 LYS A 14 4.092 -6.730 -13.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 5.928 -7.369 -15.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 5.647 -5.700 -15.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 6.963 -6.271 -14.315 1.00 0.00 H new ATOM 185 N ILE A 15 4.024 -6.274 -8.169 1.00 0.00 N ATOM 186 CA ILE A 15 4.720 -7.349 -7.473 1.00 0.00 C ATOM 187 C ILE A 15 5.391 -8.298 -8.460 1.00 0.00 C ATOM 188 O ILE A 15 4.828 -8.624 -9.506 1.00 0.00 O ATOM 189 CB ILE A 15 3.761 -8.153 -6.576 1.00 0.00 C ATOM 190 CG1 ILE A 15 2.885 -7.207 -5.752 1.00 0.00 C ATOM 191 CG2 ILE A 15 4.544 -9.087 -5.666 1.00 0.00 C ATOM 192 CD1 ILE A 15 3.575 -6.665 -4.519 1.00 0.00 C ATOM 0 H ILE A 15 3.058 -6.488 -8.417 1.00 0.00 H new ATOM 0 HA ILE A 15 5.480 -6.880 -6.848 1.00 0.00 H new ATOM 0 HB ILE A 15 3.113 -8.757 -7.212 1.00 0.00 H new ATOM 0 HG12 ILE A 15 2.574 -6.373 -6.381 1.00 0.00 H new ATOM 0 HG13 ILE A 15 1.980 -7.734 -5.450 1.00 0.00 H new ATOM 0 HG21 ILE A 15 3.852 -9.648 -5.038 1.00 0.00 H new ATOM 0 HG22 ILE A 15 5.128 -9.780 -6.272 1.00 0.00 H new ATOM 0 HG23 ILE A 15 5.214 -8.503 -5.035 1.00 0.00 H new ATOM 0 HD11 ILE A 15 2.895 -6.002 -3.984 1.00 0.00 H new ATOM 0 HD12 ILE A 15 3.862 -7.492 -3.870 1.00 0.00 H new ATOM 0 HD13 ILE A 15 4.465 -6.110 -4.815 1.00 0.00 H new ATOM 204 N LEU A 16 6.596 -8.741 -8.120 1.00 0.00 N ATOM 205 CA LEU A 16 7.345 -9.656 -8.975 1.00 0.00 C ATOM 206 C LEU A 16 7.184 -11.098 -8.503 1.00 0.00 C ATOM 207 O LEU A 16 6.515 -11.903 -9.152 1.00 0.00 O ATOM 208 CB LEU A 16 8.826 -9.275 -8.990 1.00 0.00 C ATOM 209 CG LEU A 16 9.261 -8.318 -10.101 1.00 0.00 C ATOM 210 CD1 LEU A 16 8.996 -8.931 -11.468 1.00 0.00 C ATOM 211 CD2 LEU A 16 8.546 -6.982 -9.966 1.00 0.00 C ATOM 0 H LEU A 16 7.076 -8.482 -7.258 1.00 0.00 H new ATOM 0 HA LEU A 16 6.946 -9.577 -9.986 1.00 0.00 H new ATOM 0 HB2 LEU A 16 9.074 -8.822 -8.030 1.00 0.00 H new ATOM 0 HB3 LEU A 16 9.415 -10.188 -9.073 1.00 0.00 H new ATOM 0 HG LEU A 16 10.333 -8.144 -10.005 1.00 0.00 H new ATOM 0 HD11 LEU A 16 9.312 -8.236 -12.246 1.00 0.00 H new ATOM 0 HD12 LEU A 16 9.555 -9.862 -11.564 1.00 0.00 H new ATOM 0 HD13 LEU A 16 7.931 -9.135 -11.575 1.00 0.00 H new ATOM 0 HD21 LEU A 16 8.868 -6.314 -10.765 1.00 0.00 H new ATOM 0 HD22 LEU A 16 7.469 -7.137 -10.035 1.00 0.00 H new ATOM 0 HD23 LEU A 16 8.787 -6.536 -9.001 1.00 0.00 H new ATOM 223 N CYS A 17 7.799 -11.415 -7.369 1.00 0.00 N ATOM 224 CA CYS A 17 7.723 -12.760 -6.809 1.00 0.00 C ATOM 225 C CYS A 17 8.324 -12.800 -5.408 1.00 0.00 C ATOM 226 O CYS A 17 8.780 -11.782 -4.889 1.00 0.00 O ATOM 227 CB CYS A 17 8.448 -13.755 -7.717 1.00 0.00 C ATOM 228 SG CYS A 17 10.230 -13.479 -7.838 1.00 0.00 S ATOM 0 H CYS A 17 8.355 -10.760 -6.820 1.00 0.00 H new ATOM 0 HA CYS A 17 6.672 -13.040 -6.742 1.00 0.00 H new ATOM 0 HB2 CYS A 17 8.272 -14.765 -7.346 1.00 0.00 H new ATOM 0 HB3 CYS A 17 8.014 -13.702 -8.716 1.00 0.00 H new ATOM 0 HG CYS A 17 10.755 -14.371 -8.625 1.00 0.00 H new ATOM 234 N ALA A 18 8.318 -13.982 -4.801 1.00 0.00 N ATOM 235 CA ALA A 18 8.863 -14.154 -3.460 1.00 0.00 C ATOM 236 C ALA A 18 9.951 -15.223 -3.443 1.00 0.00 C ATOM 237 O ALA A 18 10.080 -16.008 -4.382 1.00 0.00 O ATOM 238 CB ALA A 18 7.754 -14.512 -2.481 1.00 0.00 C ATOM 0 H ALA A 18 7.942 -14.834 -5.216 1.00 0.00 H new ATOM 0 HA ALA A 18 9.312 -13.209 -3.153 1.00 0.00 H new ATOM 0 HB1 ALA A 18 8.176 -14.637 -1.484 1.00 0.00 H new ATOM 0 HB2 ALA A 18 7.012 -13.714 -2.464 1.00 0.00 H new ATOM 0 HB3 ALA A 18 7.279 -15.442 -2.794 1.00 0.00 H new ATOM 244 N THR A 19 10.733 -15.247 -2.368 1.00 0.00 N ATOM 245 CA THR A 19 11.812 -16.217 -2.230 1.00 0.00 C ATOM 246 C THR A 19 11.829 -16.824 -0.831 1.00 0.00 C ATOM 247 O THR A 19 11.424 -16.183 0.139 1.00 0.00 O ATOM 248 CB THR A 19 13.183 -15.578 -2.517 1.00 0.00 C ATOM 249 OG1 THR A 19 14.219 -16.557 -2.377 1.00 0.00 O ATOM 250 CG2 THR A 19 13.447 -14.415 -1.572 1.00 0.00 C ATOM 0 H THR A 19 10.639 -14.606 -1.580 1.00 0.00 H new ATOM 0 HA THR A 19 11.626 -17.003 -2.962 1.00 0.00 H new ATOM 0 HB THR A 19 13.176 -15.200 -3.539 1.00 0.00 H new ATOM 0 HG1 THR A 19 14.632 -16.472 -1.492 1.00 0.00 H new ATOM 0 HG21 THR A 19 14.421 -13.980 -1.794 1.00 0.00 H new ATOM 0 HG22 THR A 19 12.673 -13.658 -1.702 1.00 0.00 H new ATOM 0 HG23 THR A 19 13.436 -14.773 -0.543 1.00 0.00 H new ATOM 258 N TYR A 20 12.301 -18.062 -0.734 1.00 0.00 N ATOM 259 CA TYR A 20 12.370 -18.756 0.546 1.00 0.00 C ATOM 260 C TYR A 20 11.029 -18.694 1.271 1.00 0.00 C ATOM 261 O TYR A 20 10.956 -18.297 2.434 1.00 0.00 O ATOM 262 CB TYR A 20 13.465 -18.146 1.423 1.00 0.00 C ATOM 263 CG TYR A 20 14.690 -17.716 0.649 1.00 0.00 C ATOM 264 CD1 TYR A 20 15.434 -18.635 -0.080 1.00 0.00 C ATOM 265 CD2 TYR A 20 15.104 -16.389 0.646 1.00 0.00 C ATOM 266 CE1 TYR A 20 16.555 -18.247 -0.788 1.00 0.00 C ATOM 267 CE2 TYR A 20 16.223 -15.992 -0.060 1.00 0.00 C ATOM 268 CZ TYR A 20 16.945 -16.924 -0.775 1.00 0.00 C ATOM 269 OH TYR A 20 18.061 -16.533 -1.480 1.00 0.00 O ATOM 0 H TYR A 20 12.642 -18.606 -1.527 1.00 0.00 H new ATOM 0 HA TYR A 20 12.610 -19.801 0.351 1.00 0.00 H new ATOM 0 HB2 TYR A 20 13.058 -17.284 1.951 1.00 0.00 H new ATOM 0 HB3 TYR A 20 13.760 -18.873 2.180 1.00 0.00 H new ATOM 0 HD1 TYR A 20 15.131 -19.671 -0.094 1.00 0.00 H new ATOM 0 HD2 TYR A 20 14.541 -15.656 1.205 1.00 0.00 H new ATOM 0 HE1 TYR A 20 17.123 -18.975 -1.348 1.00 0.00 H new ATOM 0 HE2 TYR A 20 16.531 -14.957 -0.052 1.00 0.00 H new ATOM 0 HH TYR A 20 18.198 -15.569 -1.368 1.00 0.00 H new ATOM 279 N VAL A 21 9.968 -19.092 0.575 1.00 0.00 N ATOM 280 CA VAL A 21 8.629 -19.085 1.152 1.00 0.00 C ATOM 281 C VAL A 21 8.453 -20.225 2.148 1.00 0.00 C ATOM 282 O VAL A 21 9.260 -21.153 2.194 1.00 0.00 O ATOM 283 CB VAL A 21 7.548 -19.200 0.061 1.00 0.00 C ATOM 284 CG1 VAL A 21 6.164 -18.991 0.656 1.00 0.00 C ATOM 285 CG2 VAL A 21 7.812 -18.203 -1.057 1.00 0.00 C ATOM 0 H VAL A 21 10.010 -19.423 -0.389 1.00 0.00 H new ATOM 0 HA VAL A 21 8.513 -18.133 1.670 1.00 0.00 H new ATOM 0 HB VAL A 21 7.588 -20.204 -0.361 1.00 0.00 H new ATOM 0 HG11 VAL A 21 5.413 -19.076 -0.130 1.00 0.00 H new ATOM 0 HG12 VAL A 21 5.978 -19.747 1.419 1.00 0.00 H new ATOM 0 HG13 VAL A 21 6.107 -18.000 1.106 1.00 0.00 H new ATOM 0 HG21 VAL A 21 7.039 -18.298 -1.819 1.00 0.00 H new ATOM 0 HG22 VAL A 21 7.800 -17.191 -0.652 1.00 0.00 H new ATOM 0 HG23 VAL A 21 8.787 -18.405 -1.502 1.00 0.00 H new ATOM 394 N ILE A 28 -1.037 -27.354 -0.703 1.00 0.00 N ATOM 395 CA ILE A 28 -1.548 -26.020 -0.992 1.00 0.00 C ATOM 396 C ILE A 28 -1.907 -25.877 -2.467 1.00 0.00 C ATOM 397 O ILE A 28 -1.093 -26.164 -3.345 1.00 0.00 O ATOM 398 CB ILE A 28 -0.526 -24.932 -0.616 1.00 0.00 C ATOM 399 CG1 ILE A 28 -0.143 -25.049 0.861 1.00 0.00 C ATOM 400 CG2 ILE A 28 -1.089 -23.550 -0.914 1.00 0.00 C ATOM 401 CD1 ILE A 28 1.230 -24.498 1.175 1.00 0.00 C ATOM 0 HA ILE A 28 -2.445 -25.888 -0.388 1.00 0.00 H new ATOM 0 HB ILE A 28 0.372 -25.075 -1.217 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -0.883 -24.522 1.463 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -0.181 -26.098 1.156 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -0.355 -22.792 -0.643 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -1.316 -23.471 -1.977 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.000 -23.396 -0.336 1.00 0.00 H new ATOM 0 HD11 ILE A 28 1.434 -24.614 2.239 1.00 0.00 H new ATOM 0 HD12 ILE A 28 1.980 -25.041 0.600 1.00 0.00 H new ATOM 0 HD13 ILE A 28 1.267 -23.441 0.912 1.00 0.00 H new ATOM 413 N ASP A 29 -3.129 -25.429 -2.732 1.00 0.00 N ATOM 414 CA ASP A 29 -3.596 -25.244 -4.101 1.00 0.00 C ATOM 415 C ASP A 29 -2.927 -24.034 -4.744 1.00 0.00 C ATOM 416 O ASP A 29 -2.170 -24.167 -5.706 1.00 0.00 O ATOM 417 CB ASP A 29 -5.116 -25.075 -4.126 1.00 0.00 C ATOM 418 CG ASP A 29 -5.625 -24.613 -5.477 1.00 0.00 C ATOM 419 OD1 ASP A 29 -5.350 -25.301 -6.483 1.00 0.00 O ATOM 420 OD2 ASP A 29 -6.299 -23.563 -5.529 1.00 0.00 O ATOM 0 H ASP A 29 -3.815 -25.187 -2.017 1.00 0.00 H new ATOM 0 HA ASP A 29 -3.328 -26.132 -4.673 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -5.588 -26.023 -3.868 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -5.411 -24.354 -3.364 1.00 0.00 H new ATOM 425 N LYS A 30 -3.211 -22.852 -4.207 1.00 0.00 N ATOM 426 CA LYS A 30 -2.637 -21.616 -4.728 1.00 0.00 C ATOM 427 C LYS A 30 -2.299 -20.654 -3.594 1.00 0.00 C ATOM 428 O LYS A 30 -2.520 -20.959 -2.422 1.00 0.00 O ATOM 429 CB LYS A 30 -3.609 -20.950 -5.704 1.00 0.00 C ATOM 430 CG LYS A 30 -3.787 -21.717 -7.003 1.00 0.00 C ATOM 431 CD LYS A 30 -2.681 -21.398 -7.995 1.00 0.00 C ATOM 432 CE LYS A 30 -2.512 -22.511 -9.018 1.00 0.00 C ATOM 433 NZ LYS A 30 -1.991 -23.761 -8.398 1.00 0.00 N ATOM 0 H LYS A 30 -3.836 -22.724 -3.411 1.00 0.00 H new ATOM 0 HA LYS A 30 -1.717 -21.866 -5.256 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -4.580 -20.841 -5.220 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -3.252 -19.945 -5.931 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -3.794 -22.787 -6.797 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -4.754 -21.471 -7.443 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -2.909 -20.463 -8.507 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -1.743 -21.248 -7.460 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -3.471 -22.715 -9.495 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -1.830 -22.183 -9.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -1.283 -24.191 -9.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -1.551 -23.537 -7.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -2.775 -24.429 -8.252 1.00 0.00 H new ATOM 447 N ILE A 31 -1.765 -19.491 -3.951 1.00 0.00 N ATOM 448 CA ILE A 31 -1.400 -18.483 -2.963 1.00 0.00 C ATOM 449 C ILE A 31 -1.823 -17.090 -3.417 1.00 0.00 C ATOM 450 O ILE A 31 -2.366 -16.919 -4.509 1.00 0.00 O ATOM 451 CB ILE A 31 0.116 -18.484 -2.692 1.00 0.00 C ATOM 452 CG1 ILE A 31 0.892 -18.541 -4.010 1.00 0.00 C ATOM 453 CG2 ILE A 31 0.494 -19.655 -1.798 1.00 0.00 C ATOM 454 CD1 ILE A 31 2.312 -18.031 -3.898 1.00 0.00 C ATOM 0 H ILE A 31 -1.575 -19.223 -4.917 1.00 0.00 H new ATOM 0 HA ILE A 31 -1.926 -18.738 -2.043 1.00 0.00 H new ATOM 0 HB ILE A 31 0.378 -17.560 -2.177 1.00 0.00 H new ATOM 0 HG12 ILE A 31 0.912 -19.571 -4.366 1.00 0.00 H new ATOM 0 HG13 ILE A 31 0.362 -17.954 -4.760 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.569 -19.642 -1.616 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -0.036 -19.574 -0.849 1.00 0.00 H new ATOM 0 HG23 ILE A 31 0.221 -20.590 -2.288 1.00 0.00 H new ATOM 0 HD11 ILE A 31 2.801 -18.101 -4.869 1.00 0.00 H new ATOM 0 HD12 ILE A 31 2.300 -16.991 -3.572 1.00 0.00 H new ATOM 0 HD13 ILE A 31 2.859 -18.633 -3.172 1.00 0.00 H new ATOM 466 N TYR A 32 -1.570 -16.097 -2.572 1.00 0.00 N ATOM 467 CA TYR A 32 -1.925 -14.718 -2.885 1.00 0.00 C ATOM 468 C TYR A 32 -1.373 -13.761 -1.833 1.00 0.00 C ATOM 469 O TYR A 32 -1.062 -14.164 -0.712 1.00 0.00 O ATOM 470 CB TYR A 32 -3.444 -14.569 -2.980 1.00 0.00 C ATOM 471 CG TYR A 32 -4.113 -14.328 -1.645 1.00 0.00 C ATOM 472 CD1 TYR A 32 -4.104 -13.068 -1.059 1.00 0.00 C ATOM 473 CD2 TYR A 32 -4.755 -15.359 -0.972 1.00 0.00 C ATOM 474 CE1 TYR A 32 -4.713 -12.844 0.161 1.00 0.00 C ATOM 475 CE2 TYR A 32 -5.368 -15.143 0.248 1.00 0.00 C ATOM 476 CZ TYR A 32 -5.344 -13.884 0.810 1.00 0.00 C ATOM 477 OH TYR A 32 -5.953 -13.664 2.024 1.00 0.00 O ATOM 0 H TYR A 32 -1.120 -16.221 -1.665 1.00 0.00 H new ATOM 0 HA TYR A 32 -1.481 -14.465 -3.848 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -3.678 -13.741 -3.649 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -3.862 -15.470 -3.429 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -3.613 -12.250 -1.565 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -4.776 -16.346 -1.409 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -4.695 -11.859 0.604 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -5.863 -15.956 0.758 1.00 0.00 H new ATOM 0 HH TYR A 32 -5.785 -14.426 2.617 1.00 0.00 H new ATOM 487 N VAL A 33 -1.256 -12.489 -2.202 1.00 0.00 N ATOM 488 CA VAL A 33 -0.744 -11.472 -1.291 1.00 0.00 C ATOM 489 C VAL A 33 -1.789 -10.394 -1.028 1.00 0.00 C ATOM 490 O VAL A 33 -2.614 -10.092 -1.890 1.00 0.00 O ATOM 491 CB VAL A 33 0.531 -10.811 -1.847 1.00 0.00 C ATOM 492 CG1 VAL A 33 1.052 -9.758 -0.881 1.00 0.00 C ATOM 493 CG2 VAL A 33 1.596 -11.861 -2.130 1.00 0.00 C ATOM 0 H VAL A 33 -1.509 -12.138 -3.126 1.00 0.00 H new ATOM 0 HA VAL A 33 -0.504 -11.977 -0.355 1.00 0.00 H new ATOM 0 HB VAL A 33 0.283 -10.316 -2.786 1.00 0.00 H new ATOM 0 HG11 VAL A 33 1.953 -9.302 -1.291 1.00 0.00 H new ATOM 0 HG12 VAL A 33 0.292 -8.991 -0.734 1.00 0.00 H new ATOM 0 HG13 VAL A 33 1.285 -10.225 0.076 1.00 0.00 H new ATOM 0 HG21 VAL A 33 2.490 -11.376 -2.522 1.00 0.00 H new ATOM 0 HG22 VAL A 33 1.843 -12.386 -1.207 1.00 0.00 H new ATOM 0 HG23 VAL A 33 1.218 -12.574 -2.863 1.00 0.00 H new ATOM 503 N ARG A 34 -1.747 -9.817 0.168 1.00 0.00 N ATOM 504 CA ARG A 34 -2.691 -8.772 0.546 1.00 0.00 C ATOM 505 C ARG A 34 -1.956 -7.514 1.000 1.00 0.00 C ATOM 506 O ARG A 34 -1.178 -7.545 1.954 1.00 0.00 O ATOM 507 CB ARG A 34 -3.614 -9.267 1.661 1.00 0.00 C ATOM 508 CG ARG A 34 -4.425 -8.161 2.316 1.00 0.00 C ATOM 509 CD ARG A 34 -5.498 -8.726 3.234 1.00 0.00 C ATOM 510 NE ARG A 34 -6.528 -9.448 2.491 1.00 0.00 N ATOM 511 CZ ARG A 34 -7.742 -9.694 2.969 1.00 0.00 C ATOM 512 NH1 ARG A 34 -8.078 -9.277 4.183 1.00 0.00 N ATOM 513 NH2 ARG A 34 -8.625 -10.357 2.233 1.00 0.00 N ATOM 0 H ARG A 34 -1.069 -10.055 0.892 1.00 0.00 H new ATOM 0 HA ARG A 34 -3.291 -8.525 -0.330 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -4.296 -10.013 1.252 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -3.015 -9.766 2.422 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -3.762 -7.511 2.887 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -4.890 -7.545 1.547 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -5.038 -9.396 3.960 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -5.959 -7.914 3.796 1.00 0.00 H new ATOM 0 HE ARG A 34 -6.302 -9.781 1.554 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -7.403 -8.766 4.752 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -9.011 -9.467 4.547 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -8.371 -10.678 1.299 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -9.557 -10.545 2.602 1.00 0.00 H new ATOM 527 N THR A 35 -2.208 -6.406 0.309 1.00 0.00 N ATOM 528 CA THR A 35 -1.570 -5.138 0.640 1.00 0.00 C ATOM 529 C THR A 35 -2.591 -4.124 1.146 1.00 0.00 C ATOM 530 O THR A 35 -3.797 -4.320 1.004 1.00 0.00 O ATOM 531 CB THR A 35 -0.835 -4.545 -0.577 1.00 0.00 C ATOM 532 OG1 THR A 35 -1.783 -4.043 -1.526 1.00 0.00 O ATOM 533 CG2 THR A 35 0.047 -5.592 -1.240 1.00 0.00 C ATOM 0 H THR A 35 -2.849 -6.362 -0.483 1.00 0.00 H new ATOM 0 HA THR A 35 -0.846 -5.345 1.428 1.00 0.00 H new ATOM 0 HB THR A 35 -0.203 -3.728 -0.228 1.00 0.00 H new ATOM 0 HG1 THR A 35 -1.314 -3.528 -2.215 1.00 0.00 H new ATOM 0 HG21 THR A 35 0.556 -5.150 -2.097 1.00 0.00 H new ATOM 0 HG22 THR A 35 0.787 -5.951 -0.524 1.00 0.00 H new ATOM 0 HG23 THR A 35 -0.568 -6.427 -1.575 1.00 0.00 H new ATOM 541 N GLY A 36 -2.098 -3.040 1.736 1.00 0.00 N ATOM 542 CA GLY A 36 -2.981 -2.011 2.254 1.00 0.00 C ATOM 543 C GLY A 36 -2.257 -1.017 3.140 1.00 0.00 C ATOM 544 O GLY A 36 -1.221 -1.336 3.724 1.00 0.00 O ATOM 0 H GLY A 36 -1.103 -2.856 1.865 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -3.444 -1.481 1.421 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -3.786 -2.479 2.821 1.00 0.00 H new ATOM 548 N ILE A 37 -2.801 0.191 3.238 1.00 0.00 N ATOM 549 CA ILE A 37 -2.199 1.235 4.059 1.00 0.00 C ATOM 550 C ILE A 37 -2.946 1.396 5.378 1.00 0.00 C ATOM 551 O ILE A 37 -4.167 1.251 5.434 1.00 0.00 O ATOM 552 CB ILE A 37 -2.181 2.588 3.324 1.00 0.00 C ATOM 553 CG1 ILE A 37 -1.190 2.547 2.159 1.00 0.00 C ATOM 554 CG2 ILE A 37 -1.827 3.710 4.289 1.00 0.00 C ATOM 555 CD1 ILE A 37 -1.757 1.921 0.904 1.00 0.00 C ATOM 0 H ILE A 37 -3.657 0.471 2.760 1.00 0.00 H new ATOM 0 HA ILE A 37 -1.173 0.926 4.260 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.176 2.781 2.923 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -0.865 3.563 1.934 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -0.305 1.990 2.465 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.818 4.660 3.755 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -2.567 3.750 5.088 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -0.841 3.525 4.716 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.999 1.926 0.121 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -2.056 0.894 1.113 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -2.625 2.491 0.573 1.00 0.00 H new ATOM 567 N TYR A 38 -2.204 1.698 6.438 1.00 0.00 N ATOM 568 CA TYR A 38 -2.796 1.879 7.759 1.00 0.00 C ATOM 569 C TYR A 38 -2.158 3.059 8.484 1.00 0.00 C ATOM 570 O TYR A 38 -1.005 3.410 8.231 1.00 0.00 O ATOM 571 CB TYR A 38 -2.634 0.606 8.591 1.00 0.00 C ATOM 572 CG TYR A 38 -3.561 -0.513 8.174 1.00 0.00 C ATOM 573 CD1 TYR A 38 -3.283 -1.292 7.057 1.00 0.00 C ATOM 574 CD2 TYR A 38 -4.716 -0.791 8.895 1.00 0.00 C ATOM 575 CE1 TYR A 38 -4.127 -2.315 6.671 1.00 0.00 C ATOM 576 CE2 TYR A 38 -5.565 -1.813 8.517 1.00 0.00 C ATOM 577 CZ TYR A 38 -5.267 -2.572 7.405 1.00 0.00 C ATOM 578 OH TYR A 38 -6.111 -3.590 7.024 1.00 0.00 O ATOM 0 H TYR A 38 -1.192 1.823 6.409 1.00 0.00 H new ATOM 0 HA TYR A 38 -3.858 2.087 7.629 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -1.603 0.260 8.513 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -2.813 0.843 9.640 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -2.391 -1.094 6.481 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -4.954 -0.198 9.766 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -3.896 -2.910 5.800 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -6.458 -2.017 9.090 1.00 0.00 H new ATOM 0 HH TYR A 38 -6.866 -3.639 7.647 1.00 0.00 H new ATOM 588 N HIS A 39 -2.917 3.669 9.390 1.00 0.00 N ATOM 589 CA HIS A 39 -2.427 4.810 10.155 1.00 0.00 C ATOM 590 C HIS A 39 -2.677 4.612 11.647 1.00 0.00 C ATOM 591 O HIS A 39 -3.794 4.795 12.129 1.00 0.00 O ATOM 592 CB HIS A 39 -3.101 6.097 9.679 1.00 0.00 C ATOM 593 CG HIS A 39 -2.605 7.326 10.376 1.00 0.00 C ATOM 594 ND1 HIS A 39 -2.081 7.492 11.613 1.00 0.00 N flip ATOM 595 CD2 HIS A 39 -2.617 8.577 9.796 1.00 0.00 C flip ATOM 596 CE1 HIS A 39 -1.788 8.826 11.756 1.00 0.00 C flip ATOM 597 NE2 HIS A 39 -2.120 9.459 10.646 1.00 0.00 N flip ATOM 0 H HIS A 39 -3.873 3.392 9.612 1.00 0.00 H new ATOM 0 HA HIS A 39 -1.352 4.890 9.993 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -2.939 6.207 8.607 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -4.177 6.012 9.832 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -2.976 8.801 8.802 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -1.356 9.283 12.634 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -2.011 10.458 10.474 1.00 0.00 H new ATOM 606 N GLY A 40 -1.629 4.235 12.373 1.00 0.00 N ATOM 607 CA GLY A 40 -1.756 4.017 13.802 1.00 0.00 C ATOM 608 C GLY A 40 -2.535 2.758 14.130 1.00 0.00 C ATOM 609 O GLY A 40 -3.114 2.641 15.209 1.00 0.00 O ATOM 0 H GLY A 40 -0.694 4.077 11.997 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -0.763 3.952 14.246 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.252 4.876 14.255 1.00 0.00 H new ATOM 613 N GLY A 41 -2.550 1.813 13.194 1.00 0.00 N ATOM 614 CA GLY A 41 -3.269 0.570 13.407 1.00 0.00 C ATOM 615 C GLY A 41 -4.599 0.537 12.681 1.00 0.00 C ATOM 616 O GLY A 41 -5.022 -0.512 12.197 1.00 0.00 O ATOM 0 H GLY A 41 -2.078 1.886 12.293 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -2.654 -0.264 13.070 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -3.438 0.430 14.475 1.00 0.00 H new ATOM 620 N GLU A 42 -5.259 1.688 12.606 1.00 0.00 N ATOM 621 CA GLU A 42 -6.550 1.785 11.936 1.00 0.00 C ATOM 622 C GLU A 42 -6.373 1.857 10.421 1.00 0.00 C ATOM 623 O GLU A 42 -5.481 2.532 9.907 1.00 0.00 O ATOM 624 CB GLU A 42 -7.315 3.015 12.429 1.00 0.00 C ATOM 625 CG GLU A 42 -7.011 4.278 11.642 1.00 0.00 C ATOM 626 CD GLU A 42 -7.483 5.534 12.348 1.00 0.00 C ATOM 627 OE1 GLU A 42 -6.773 6.003 13.262 1.00 0.00 O ATOM 628 OE2 GLU A 42 -8.562 6.049 11.986 1.00 0.00 O ATOM 0 H GLU A 42 -4.921 2.566 13.001 1.00 0.00 H new ATOM 0 HA GLU A 42 -7.123 0.889 12.176 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -8.385 2.812 12.375 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -7.075 3.185 13.479 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -5.937 4.345 11.470 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -7.487 4.215 10.664 1.00 0.00 H new ATOM 635 N PRO A 43 -7.243 1.144 9.690 1.00 0.00 N ATOM 636 CA PRO A 43 -7.203 1.110 8.225 1.00 0.00 C ATOM 637 C PRO A 43 -7.619 2.439 7.603 1.00 0.00 C ATOM 638 O PRO A 43 -8.191 3.298 8.274 1.00 0.00 O ATOM 639 CB PRO A 43 -8.211 0.014 7.869 1.00 0.00 C ATOM 640 CG PRO A 43 -9.151 -0.026 9.024 1.00 0.00 C ATOM 641 CD PRO A 43 -8.331 0.317 10.237 1.00 0.00 C ATOM 0 HA PRO A 43 -6.197 0.923 7.848 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -8.734 0.244 6.941 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -7.717 -0.947 7.727 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -9.965 0.686 8.889 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -9.604 -1.012 9.125 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -8.917 0.862 10.977 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -7.948 -0.577 10.729 1.00 0.00 H new ATOM 649 N LEU A 44 -7.328 2.601 6.317 1.00 0.00 N ATOM 650 CA LEU A 44 -7.672 3.825 5.603 1.00 0.00 C ATOM 651 C LEU A 44 -8.548 3.522 4.392 1.00 0.00 C ATOM 652 O LEU A 44 -9.493 4.255 4.097 1.00 0.00 O ATOM 653 CB LEU A 44 -6.403 4.554 5.159 1.00 0.00 C ATOM 654 CG LEU A 44 -5.742 5.451 6.206 1.00 0.00 C ATOM 655 CD1 LEU A 44 -5.212 4.620 7.363 1.00 0.00 C ATOM 656 CD2 LEU A 44 -4.624 6.270 5.578 1.00 0.00 C ATOM 0 H LEU A 44 -6.854 1.900 5.747 1.00 0.00 H new ATOM 0 HA LEU A 44 -8.233 4.466 6.282 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -5.675 3.810 4.836 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -6.644 5.163 4.288 1.00 0.00 H new ATOM 0 HG LEU A 44 -6.494 6.138 6.594 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -4.745 5.276 8.098 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -6.035 4.080 7.830 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -4.475 3.908 6.992 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -4.165 6.902 6.338 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -3.872 5.600 5.161 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -5.033 6.895 4.784 1.00 0.00 H new ATOM 668 N CYS A 45 -8.230 2.437 3.695 1.00 0.00 N ATOM 669 CA CYS A 45 -8.989 2.035 2.516 1.00 0.00 C ATOM 670 C CYS A 45 -9.026 0.516 2.385 1.00 0.00 C ATOM 671 O CYS A 45 -8.208 -0.188 2.977 1.00 0.00 O ATOM 672 CB CYS A 45 -8.381 2.654 1.257 1.00 0.00 C ATOM 673 SG CYS A 45 -6.794 1.935 0.774 1.00 0.00 S ATOM 0 H CYS A 45 -7.452 1.820 3.926 1.00 0.00 H new ATOM 0 HA CYS A 45 -10.011 2.396 2.632 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -9.085 2.540 0.433 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -8.249 3.724 1.418 1.00 0.00 H new ATOM 0 HG CYS A 45 -6.927 0.650 0.625 1.00 0.00 H new ATOM 679 N ASP A 46 -9.980 0.018 1.606 1.00 0.00 N ATOM 680 CA ASP A 46 -10.124 -1.418 1.397 1.00 0.00 C ATOM 681 C ASP A 46 -8.779 -2.056 1.062 1.00 0.00 C ATOM 682 O ASP A 46 -7.874 -1.392 0.558 1.00 0.00 O ATOM 683 CB ASP A 46 -11.127 -1.694 0.275 1.00 0.00 C ATOM 684 CG ASP A 46 -12.563 -1.519 0.727 1.00 0.00 C ATOM 685 OD1 ASP A 46 -13.004 -2.282 1.611 1.00 0.00 O ATOM 686 OD2 ASP A 46 -13.247 -0.618 0.196 1.00 0.00 O ATOM 0 H ASP A 46 -10.665 0.587 1.109 1.00 0.00 H new ATOM 0 HA ASP A 46 -10.495 -1.859 2.322 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -10.928 -1.022 -0.560 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -10.986 -2.710 -0.093 1.00 0.00 H new ATOM 691 N ASN A 47 -8.656 -3.349 1.346 1.00 0.00 N ATOM 692 CA ASN A 47 -7.421 -4.076 1.076 1.00 0.00 C ATOM 693 C ASN A 47 -7.383 -4.568 -0.367 1.00 0.00 C ATOM 694 O ASN A 47 -8.405 -4.970 -0.924 1.00 0.00 O ATOM 695 CB ASN A 47 -7.283 -5.261 2.034 1.00 0.00 C ATOM 696 CG ASN A 47 -7.796 -4.943 3.425 1.00 0.00 C ATOM 697 OD1 ASN A 47 -8.803 -5.496 3.869 1.00 0.00 O ATOM 698 ND2 ASN A 47 -7.105 -4.047 4.121 1.00 0.00 N ATOM 0 H ASN A 47 -9.396 -3.914 1.763 1.00 0.00 H new ATOM 0 HA ASN A 47 -6.586 -3.393 1.230 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -7.831 -6.114 1.634 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -6.235 -5.555 2.095 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -7.403 -3.792 5.063 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -6.276 -3.614 3.714 1.00 0.00 H new ATOM 705 N VAL A 48 -6.198 -4.533 -0.968 1.00 0.00 N ATOM 706 CA VAL A 48 -6.026 -4.977 -2.346 1.00 0.00 C ATOM 707 C VAL A 48 -5.458 -6.391 -2.402 1.00 0.00 C ATOM 708 O VAL A 48 -4.512 -6.719 -1.687 1.00 0.00 O ATOM 709 CB VAL A 48 -5.095 -4.031 -3.128 1.00 0.00 C ATOM 710 CG1 VAL A 48 -4.909 -4.524 -4.555 1.00 0.00 C ATOM 711 CG2 VAL A 48 -5.645 -2.612 -3.114 1.00 0.00 C ATOM 0 H VAL A 48 -5.343 -4.202 -0.522 1.00 0.00 H new ATOM 0 HA VAL A 48 -7.014 -4.967 -2.807 1.00 0.00 H new ATOM 0 HB VAL A 48 -4.120 -4.024 -2.641 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -4.248 -3.843 -5.092 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -4.469 -5.521 -4.541 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -5.876 -4.561 -5.056 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.975 -1.957 -3.671 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -6.632 -2.600 -3.576 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -5.722 -2.262 -2.085 1.00 0.00 H new ATOM 721 N ASN A 49 -6.043 -7.224 -3.256 1.00 0.00 N ATOM 722 CA ASN A 49 -5.595 -8.604 -3.405 1.00 0.00 C ATOM 723 C ASN A 49 -5.139 -8.876 -4.835 1.00 0.00 C ATOM 724 O ASN A 49 -5.749 -8.403 -5.795 1.00 0.00 O ATOM 725 CB ASN A 49 -6.719 -9.571 -3.024 1.00 0.00 C ATOM 726 CG ASN A 49 -7.997 -9.304 -3.795 1.00 0.00 C ATOM 727 OD1 ASN A 49 -8.301 -8.162 -4.139 1.00 0.00 O ATOM 728 ND2 ASN A 49 -8.753 -10.361 -4.070 1.00 0.00 N ATOM 0 H ASN A 49 -6.828 -6.968 -3.855 1.00 0.00 H new ATOM 0 HA ASN A 49 -4.748 -8.759 -2.736 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -6.393 -10.594 -3.210 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -6.919 -9.489 -1.956 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -9.625 -10.244 -4.586 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -8.462 -11.290 -3.765 1.00 0.00 H new ATOM 735 N THR A 50 -4.061 -9.643 -4.971 1.00 0.00 N ATOM 736 CA THR A 50 -3.522 -9.978 -6.283 1.00 0.00 C ATOM 737 C THR A 50 -3.999 -11.353 -6.738 1.00 0.00 C ATOM 738 O THR A 50 -4.480 -12.150 -5.934 1.00 0.00 O ATOM 739 CB THR A 50 -1.982 -9.956 -6.280 1.00 0.00 C ATOM 740 OG1 THR A 50 -1.486 -10.172 -7.606 1.00 0.00 O ATOM 741 CG2 THR A 50 -1.428 -11.021 -5.346 1.00 0.00 C ATOM 0 H THR A 50 -3.544 -10.044 -4.188 1.00 0.00 H new ATOM 0 HA THR A 50 -3.887 -9.221 -6.978 1.00 0.00 H new ATOM 0 HB THR A 50 -1.655 -8.978 -5.926 1.00 0.00 H new ATOM 0 HG1 THR A 50 -0.844 -10.912 -7.599 1.00 0.00 H new ATOM 0 HG21 THR A 50 -0.339 -10.987 -5.360 1.00 0.00 H new ATOM 0 HG22 THR A 50 -1.784 -10.837 -4.332 1.00 0.00 H new ATOM 0 HG23 THR A 50 -1.764 -12.004 -5.675 1.00 0.00 H new ATOM 749 N GLN A 51 -3.860 -11.624 -8.032 1.00 0.00 N ATOM 750 CA GLN A 51 -4.277 -12.903 -8.593 1.00 0.00 C ATOM 751 C GLN A 51 -3.690 -14.064 -7.797 1.00 0.00 C ATOM 752 O GLN A 51 -2.733 -13.890 -7.042 1.00 0.00 O ATOM 753 CB GLN A 51 -3.848 -13.006 -10.058 1.00 0.00 C ATOM 754 CG GLN A 51 -2.341 -13.083 -10.247 1.00 0.00 C ATOM 755 CD GLN A 51 -1.933 -13.039 -11.706 1.00 0.00 C ATOM 756 OE1 GLN A 51 -1.257 -12.109 -12.146 1.00 0.00 O ATOM 757 NE2 GLN A 51 -2.342 -14.048 -12.466 1.00 0.00 N ATOM 0 H GLN A 51 -3.462 -10.975 -8.711 1.00 0.00 H new ATOM 0 HA GLN A 51 -5.364 -12.959 -8.535 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -4.307 -13.890 -10.501 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -4.230 -12.142 -10.601 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -1.869 -12.256 -9.717 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -1.969 -14.003 -9.797 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -2.901 -14.798 -12.060 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -2.097 -14.073 -13.456 1.00 0.00 H new ATOM 766 N ARG A 52 -4.269 -15.247 -7.971 1.00 0.00 N ATOM 767 CA ARG A 52 -3.805 -16.436 -7.267 1.00 0.00 C ATOM 768 C ARG A 52 -2.778 -17.196 -8.102 1.00 0.00 C ATOM 769 O ARG A 52 -3.054 -17.590 -9.235 1.00 0.00 O ATOM 770 CB ARG A 52 -4.984 -17.351 -6.933 1.00 0.00 C ATOM 771 CG ARG A 52 -5.609 -17.070 -5.576 1.00 0.00 C ATOM 772 CD ARG A 52 -6.551 -15.878 -5.633 1.00 0.00 C ATOM 773 NE ARG A 52 -7.605 -16.060 -6.628 1.00 0.00 N ATOM 774 CZ ARG A 52 -8.671 -16.830 -6.437 1.00 0.00 C ATOM 775 NH1 ARG A 52 -8.824 -17.485 -5.294 1.00 0.00 N ATOM 776 NH2 ARG A 52 -9.587 -16.946 -7.390 1.00 0.00 N ATOM 0 H ARG A 52 -5.061 -15.408 -8.594 1.00 0.00 H new ATOM 0 HA ARG A 52 -3.329 -16.116 -6.340 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -5.747 -17.243 -7.704 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -4.648 -18.387 -6.961 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -6.155 -17.950 -5.236 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -4.823 -16.880 -4.845 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -7.001 -15.724 -4.652 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -5.983 -14.978 -5.867 1.00 0.00 H new ATOM 0 HE ARG A 52 -7.518 -15.569 -7.518 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -8.122 -17.398 -4.559 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -9.643 -18.075 -5.150 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -9.473 -16.444 -8.270 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -10.405 -17.537 -7.242 1.00 0.00 H new ATOM 790 N VAL A 53 -1.593 -17.398 -7.534 1.00 0.00 N ATOM 791 CA VAL A 53 -0.526 -18.111 -8.225 1.00 0.00 C ATOM 792 C VAL A 53 -0.113 -19.361 -7.457 1.00 0.00 C ATOM 793 O VAL A 53 -0.237 -19.438 -6.234 1.00 0.00 O ATOM 794 CB VAL A 53 0.710 -17.213 -8.426 1.00 0.00 C ATOM 795 CG1 VAL A 53 0.289 -15.809 -8.832 1.00 0.00 C ATOM 796 CG2 VAL A 53 1.556 -17.181 -7.163 1.00 0.00 C ATOM 0 H VAL A 53 -1.348 -17.078 -6.597 1.00 0.00 H new ATOM 0 HA VAL A 53 -0.918 -18.401 -9.200 1.00 0.00 H new ATOM 0 HB VAL A 53 1.315 -17.632 -9.230 1.00 0.00 H new ATOM 0 HG11 VAL A 53 1.175 -15.189 -8.969 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -0.272 -15.853 -9.766 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.338 -15.377 -8.052 1.00 0.00 H new ATOM 0 HG21 VAL A 53 2.425 -16.542 -7.323 1.00 0.00 H new ATOM 0 HG22 VAL A 53 0.963 -16.787 -6.338 1.00 0.00 H new ATOM 0 HG23 VAL A 53 1.888 -18.191 -6.922 1.00 0.00 H new ATOM 806 N PRO A 54 0.391 -20.366 -8.189 1.00 0.00 N ATOM 807 CA PRO A 54 0.835 -21.632 -7.597 1.00 0.00 C ATOM 808 C PRO A 54 2.103 -21.470 -6.766 1.00 0.00 C ATOM 809 O PRO A 54 3.069 -20.846 -7.206 1.00 0.00 O ATOM 810 CB PRO A 54 1.103 -22.518 -8.816 1.00 0.00 C ATOM 811 CG PRO A 54 1.403 -21.564 -9.920 1.00 0.00 C ATOM 812 CD PRO A 54 0.568 -20.343 -9.651 1.00 0.00 C ATOM 0 HA PRO A 54 0.096 -22.042 -6.909 1.00 0.00 H new ATOM 0 HB2 PRO A 54 1.940 -23.193 -8.638 1.00 0.00 H new ATOM 0 HB3 PRO A 54 0.238 -23.138 -9.053 1.00 0.00 H new ATOM 0 HG2 PRO A 54 2.464 -21.314 -9.942 1.00 0.00 H new ATOM 0 HG3 PRO A 54 1.158 -21.999 -10.889 1.00 0.00 H new ATOM 0 HD2 PRO A 54 1.069 -19.433 -9.981 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -0.388 -20.387 -10.172 1.00 0.00 H new ATOM 820 N CYS A 55 2.094 -22.037 -5.565 1.00 0.00 N ATOM 821 CA CYS A 55 3.244 -21.955 -4.672 1.00 0.00 C ATOM 822 C CYS A 55 4.541 -22.223 -5.430 1.00 0.00 C ATOM 823 O CYS A 55 5.519 -21.490 -5.286 1.00 0.00 O ATOM 824 CB CYS A 55 3.096 -22.953 -3.522 1.00 0.00 C ATOM 825 SG CYS A 55 2.578 -24.606 -4.042 1.00 0.00 S ATOM 0 H CYS A 55 1.303 -22.559 -5.187 1.00 0.00 H new ATOM 0 HA CYS A 55 3.284 -20.945 -4.264 1.00 0.00 H new ATOM 0 HB2 CYS A 55 4.048 -23.030 -2.997 1.00 0.00 H new ATOM 0 HB3 CYS A 55 2.370 -22.564 -2.808 1.00 0.00 H new ATOM 0 HG CYS A 55 2.483 -25.379 -3.001 1.00 0.00 H new ATOM 831 N SER A 56 4.541 -23.280 -6.236 1.00 0.00 N ATOM 832 CA SER A 56 5.719 -23.648 -7.013 1.00 0.00 C ATOM 833 C SER A 56 6.270 -22.443 -7.769 1.00 0.00 C ATOM 834 O SER A 56 7.480 -22.305 -7.941 1.00 0.00 O ATOM 835 CB SER A 56 5.377 -24.769 -7.996 1.00 0.00 C ATOM 836 OG SER A 56 5.481 -26.040 -7.377 1.00 0.00 O ATOM 0 H SER A 56 3.739 -23.896 -6.368 1.00 0.00 H new ATOM 0 HA SER A 56 6.484 -24.001 -6.322 1.00 0.00 H new ATOM 0 HB2 SER A 56 4.365 -24.628 -8.376 1.00 0.00 H new ATOM 0 HB3 SER A 56 6.049 -24.723 -8.853 1.00 0.00 H new ATOM 0 HG SER A 56 5.256 -26.739 -8.026 1.00 0.00 H new ATOM 842 N ASN A 57 5.371 -21.573 -8.219 1.00 0.00 N ATOM 843 CA ASN A 57 5.766 -20.379 -8.958 1.00 0.00 C ATOM 844 C ASN A 57 5.014 -19.152 -8.450 1.00 0.00 C ATOM 845 O ASN A 57 3.957 -18.785 -8.964 1.00 0.00 O ATOM 846 CB ASN A 57 5.504 -20.570 -10.453 1.00 0.00 C ATOM 847 CG ASN A 57 6.691 -21.177 -11.175 1.00 0.00 C ATOM 848 OD1 ASN A 57 6.624 -22.305 -11.664 1.00 0.00 O ATOM 849 ND2 ASN A 57 7.786 -20.430 -11.245 1.00 0.00 N ATOM 0 H ASN A 57 4.365 -21.672 -8.085 1.00 0.00 H new ATOM 0 HA ASN A 57 6.833 -20.220 -8.801 1.00 0.00 H new ATOM 0 HB2 ASN A 57 4.633 -21.212 -10.587 1.00 0.00 H new ATOM 0 HB3 ASN A 57 5.262 -19.607 -10.903 1.00 0.00 H new ATOM 0 HD21 ASN A 57 8.617 -20.786 -11.718 1.00 0.00 H new ATOM 0 HD22 ASN A 57 7.797 -19.500 -10.825 1.00 0.00 H new ATOM 856 N PRO A 58 5.571 -18.502 -7.418 1.00 0.00 N ATOM 857 CA PRO A 58 4.971 -17.306 -6.819 1.00 0.00 C ATOM 858 C PRO A 58 5.041 -16.097 -7.745 1.00 0.00 C ATOM 859 O PRO A 58 4.640 -14.994 -7.373 1.00 0.00 O ATOM 860 CB PRO A 58 5.820 -17.071 -5.568 1.00 0.00 C ATOM 861 CG PRO A 58 7.134 -17.701 -5.879 1.00 0.00 C ATOM 862 CD PRO A 58 6.829 -18.884 -6.756 1.00 0.00 C ATOM 0 HA PRO A 58 3.910 -17.443 -6.611 1.00 0.00 H new ATOM 0 HB2 PRO A 58 5.931 -16.007 -5.359 1.00 0.00 H new ATOM 0 HB3 PRO A 58 5.362 -17.523 -4.688 1.00 0.00 H new ATOM 0 HG2 PRO A 58 7.793 -16.998 -6.388 1.00 0.00 H new ATOM 0 HG3 PRO A 58 7.643 -18.012 -4.967 1.00 0.00 H new ATOM 0 HD2 PRO A 58 7.625 -19.064 -7.479 1.00 0.00 H new ATOM 0 HD3 PRO A 58 6.715 -19.798 -6.173 1.00 0.00 H new ATOM 870 N ARG A 59 5.551 -16.311 -8.953 1.00 0.00 N ATOM 871 CA ARG A 59 5.674 -15.238 -9.932 1.00 0.00 C ATOM 872 C ARG A 59 4.332 -14.546 -10.152 1.00 0.00 C ATOM 873 O ARG A 59 3.406 -15.130 -10.715 1.00 0.00 O ATOM 874 CB ARG A 59 6.200 -15.788 -11.260 1.00 0.00 C ATOM 875 CG ARG A 59 6.510 -14.709 -12.285 1.00 0.00 C ATOM 876 CD ARG A 59 7.332 -15.259 -13.440 1.00 0.00 C ATOM 877 NE ARG A 59 6.490 -15.816 -14.496 1.00 0.00 N ATOM 878 CZ ARG A 59 6.912 -16.721 -15.372 1.00 0.00 C ATOM 879 NH1 ARG A 59 8.158 -17.170 -15.318 1.00 0.00 N ATOM 880 NH2 ARG A 59 6.085 -17.180 -16.303 1.00 0.00 N ATOM 0 H ARG A 59 5.886 -17.218 -9.277 1.00 0.00 H new ATOM 0 HA ARG A 59 6.382 -14.506 -9.544 1.00 0.00 H new ATOM 0 HB2 ARG A 59 7.103 -16.368 -11.071 1.00 0.00 H new ATOM 0 HB3 ARG A 59 5.462 -16.473 -11.678 1.00 0.00 H new ATOM 0 HG2 ARG A 59 5.579 -14.290 -12.667 1.00 0.00 H new ATOM 0 HG3 ARG A 59 7.053 -13.895 -11.805 1.00 0.00 H new ATOM 0 HD2 ARG A 59 7.953 -14.464 -13.853 1.00 0.00 H new ATOM 0 HD3 ARG A 59 8.007 -16.031 -13.069 1.00 0.00 H new ATOM 0 HE ARG A 59 5.525 -15.492 -14.564 1.00 0.00 H new ATOM 0 HH11 ARG A 59 8.795 -16.821 -14.602 1.00 0.00 H new ATOM 0 HH12 ARG A 59 8.479 -17.865 -15.992 1.00 0.00 H new ATOM 0 HH21 ARG A 59 5.125 -16.838 -16.346 1.00 0.00 H new ATOM 0 HH22 ARG A 59 6.409 -17.875 -16.976 1.00 0.00 H new ATOM 894 N TRP A 60 4.235 -13.300 -9.703 1.00 0.00 N ATOM 895 CA TRP A 60 3.006 -12.528 -9.850 1.00 0.00 C ATOM 896 C TRP A 60 3.085 -11.604 -11.060 1.00 0.00 C ATOM 897 O TRP A 60 2.284 -11.712 -11.988 1.00 0.00 O ATOM 898 CB TRP A 60 2.738 -11.711 -8.585 1.00 0.00 C ATOM 899 CG TRP A 60 1.964 -12.463 -7.545 1.00 0.00 C ATOM 900 CD1 TRP A 60 0.620 -12.705 -7.539 1.00 0.00 C ATOM 901 CD2 TRP A 60 2.488 -13.069 -6.358 1.00 0.00 C ATOM 902 NE1 TRP A 60 0.277 -13.425 -6.420 1.00 0.00 N ATOM 903 CE2 TRP A 60 1.405 -13.662 -5.680 1.00 0.00 C ATOM 904 CE3 TRP A 60 3.767 -13.170 -5.804 1.00 0.00 C ATOM 905 CZ2 TRP A 60 1.564 -14.343 -4.476 1.00 0.00 C ATOM 906 CZ3 TRP A 60 3.923 -13.847 -4.609 1.00 0.00 C ATOM 907 CH2 TRP A 60 2.827 -14.427 -3.956 1.00 0.00 C ATOM 0 H TRP A 60 4.992 -12.803 -9.234 1.00 0.00 H new ATOM 0 HA TRP A 60 2.184 -13.227 -10.003 1.00 0.00 H new ATOM 0 HB2 TRP A 60 3.689 -11.391 -8.159 1.00 0.00 H new ATOM 0 HB3 TRP A 60 2.190 -10.808 -8.854 1.00 0.00 H new ATOM 0 HD1 TRP A 60 -0.072 -12.379 -8.302 1.00 0.00 H new ATOM 0 HE1 TRP A 60 -0.665 -13.733 -6.179 1.00 0.00 H new ATOM 0 HE3 TRP A 60 4.618 -12.727 -6.300 1.00 0.00 H new ATOM 0 HZ2 TRP A 60 0.720 -14.789 -3.970 1.00 0.00 H new ATOM 0 HZ3 TRP A 60 4.907 -13.930 -4.171 1.00 0.00 H new ATOM 0 HH2 TRP A 60 2.982 -14.950 -3.024 1.00 0.00 H new ATOM 918 N ASN A 61 4.054 -10.695 -11.043 1.00 0.00 N ATOM 919 CA ASN A 61 4.237 -9.752 -12.140 1.00 0.00 C ATOM 920 C ASN A 61 2.911 -9.101 -12.524 1.00 0.00 C ATOM 921 O ASN A 61 2.540 -9.073 -13.697 1.00 0.00 O ATOM 922 CB ASN A 61 4.841 -10.460 -13.354 1.00 0.00 C ATOM 923 CG ASN A 61 6.352 -10.556 -13.275 1.00 0.00 C ATOM 924 OD1 ASN A 61 7.060 -9.570 -13.482 1.00 0.00 O ATOM 925 ND2 ASN A 61 6.854 -11.748 -12.974 1.00 0.00 N ATOM 0 H ASN A 61 4.725 -10.591 -10.282 1.00 0.00 H new ATOM 0 HA ASN A 61 4.921 -8.972 -11.806 1.00 0.00 H new ATOM 0 HB2 ASN A 61 4.420 -11.462 -13.433 1.00 0.00 H new ATOM 0 HB3 ASN A 61 4.561 -9.924 -14.261 1.00 0.00 H new ATOM 0 HD21 ASN A 61 7.864 -11.874 -12.906 1.00 0.00 H new ATOM 0 HD22 ASN A 61 6.230 -12.538 -12.810 1.00 0.00 H new ATOM 932 N GLU A 62 2.203 -8.580 -11.527 1.00 0.00 N ATOM 933 CA GLU A 62 0.919 -7.930 -11.761 1.00 0.00 C ATOM 934 C GLU A 62 0.943 -6.485 -11.271 1.00 0.00 C ATOM 935 O GLU A 62 1.524 -6.182 -10.229 1.00 0.00 O ATOM 936 CB GLU A 62 -0.202 -8.699 -11.060 1.00 0.00 C ATOM 937 CG GLU A 62 -1.570 -8.055 -11.213 1.00 0.00 C ATOM 938 CD GLU A 62 -2.704 -9.053 -11.072 1.00 0.00 C ATOM 939 OE1 GLU A 62 -2.886 -9.877 -11.992 1.00 0.00 O ATOM 940 OE2 GLU A 62 -3.407 -9.009 -10.041 1.00 0.00 O ATOM 0 H GLU A 62 2.497 -8.595 -10.550 1.00 0.00 H new ATOM 0 HA GLU A 62 0.732 -7.928 -12.835 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -0.240 -9.713 -11.459 1.00 0.00 H new ATOM 0 HB3 GLU A 62 0.034 -8.783 -9.999 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -1.685 -7.272 -10.463 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -1.634 -7.574 -12.189 1.00 0.00 H new ATOM 947 N TRP A 63 0.309 -5.599 -12.030 1.00 0.00 N ATOM 948 CA TRP A 63 0.257 -4.185 -11.674 1.00 0.00 C ATOM 949 C TRP A 63 -0.858 -3.917 -10.669 1.00 0.00 C ATOM 950 O TRP A 63 -2.031 -3.833 -11.036 1.00 0.00 O ATOM 951 CB TRP A 63 0.050 -3.330 -12.925 1.00 0.00 C ATOM 952 CG TRP A 63 1.298 -3.151 -13.736 1.00 0.00 C ATOM 953 CD1 TRP A 63 1.663 -3.859 -14.845 1.00 0.00 C ATOM 954 CD2 TRP A 63 2.346 -2.205 -13.498 1.00 0.00 C ATOM 955 NE1 TRP A 63 2.874 -3.409 -15.312 1.00 0.00 N ATOM 956 CE2 TRP A 63 3.314 -2.394 -14.504 1.00 0.00 C ATOM 957 CE3 TRP A 63 2.559 -1.215 -12.536 1.00 0.00 C ATOM 958 CZ2 TRP A 63 4.476 -1.631 -14.571 1.00 0.00 C ATOM 959 CZ3 TRP A 63 3.714 -0.458 -12.604 1.00 0.00 C ATOM 960 CH2 TRP A 63 4.659 -0.668 -13.616 1.00 0.00 C ATOM 0 H TRP A 63 -0.176 -5.834 -12.896 1.00 0.00 H new ATOM 0 HA TRP A 63 1.208 -3.917 -11.213 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -0.717 -3.790 -13.548 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -0.326 -2.351 -12.629 1.00 0.00 H new ATOM 0 HD1 TRP A 63 1.085 -4.656 -15.290 1.00 0.00 H new ATOM 0 HE1 TRP A 63 3.366 -3.772 -16.128 1.00 0.00 H new ATOM 0 HE3 TRP A 63 1.835 -1.044 -11.753 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 5.207 -1.793 -15.349 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 3.890 0.308 -11.864 1.00 0.00 H new ATOM 0 HH2 TRP A 63 5.550 -0.058 -13.643 1.00 0.00 H new ATOM 971 N LEU A 64 -0.486 -3.783 -9.401 1.00 0.00 N ATOM 972 CA LEU A 64 -1.456 -3.524 -8.343 1.00 0.00 C ATOM 973 C LEU A 64 -1.615 -2.026 -8.105 1.00 0.00 C ATOM 974 O LEU A 64 -0.680 -1.354 -7.671 1.00 0.00 O ATOM 975 CB LEU A 64 -1.024 -4.215 -7.048 1.00 0.00 C ATOM 976 CG LEU A 64 -2.152 -4.645 -6.109 1.00 0.00 C ATOM 977 CD1 LEU A 64 -3.021 -5.704 -6.768 1.00 0.00 C ATOM 978 CD2 LEU A 64 -1.583 -5.161 -4.794 1.00 0.00 C ATOM 0 H LEU A 64 0.480 -3.849 -9.080 1.00 0.00 H new ATOM 0 HA LEU A 64 -2.418 -3.927 -8.659 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -0.438 -5.097 -7.308 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -0.362 -3.542 -6.504 1.00 0.00 H new ATOM 0 HG LEU A 64 -2.774 -3.775 -5.897 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -3.818 -5.997 -6.085 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -3.457 -5.300 -7.682 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -2.412 -6.575 -7.011 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -2.399 -5.463 -4.138 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -0.938 -6.018 -4.988 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -1.004 -4.372 -4.314 1.00 0.00 H new ATOM 990 N ASN A 65 -2.806 -1.509 -8.389 1.00 0.00 N ATOM 991 CA ASN A 65 -3.088 -0.091 -8.204 1.00 0.00 C ATOM 992 C ASN A 65 -3.803 0.154 -6.879 1.00 0.00 C ATOM 993 O ASN A 65 -4.680 -0.614 -6.484 1.00 0.00 O ATOM 994 CB ASN A 65 -3.940 0.436 -9.361 1.00 0.00 C ATOM 995 CG ASN A 65 -5.201 -0.381 -9.569 1.00 0.00 C ATOM 996 OD1 ASN A 65 -5.433 -1.371 -8.876 1.00 0.00 O ATOM 997 ND2 ASN A 65 -6.021 0.032 -10.528 1.00 0.00 N ATOM 0 H ASN A 65 -3.591 -2.052 -8.748 1.00 0.00 H new ATOM 0 HA ASN A 65 -2.138 0.443 -8.188 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -4.211 1.474 -9.166 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -3.349 0.427 -10.277 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -6.885 -0.478 -10.715 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -5.787 0.859 -11.078 1.00 0.00 H new ATOM 1004 N TYR A 66 -3.422 1.228 -6.197 1.00 0.00 N ATOM 1005 CA TYR A 66 -4.025 1.574 -4.915 1.00 0.00 C ATOM 1006 C TYR A 66 -4.966 2.765 -5.059 1.00 0.00 C ATOM 1007 O TYR A 66 -4.662 3.730 -5.762 1.00 0.00 O ATOM 1008 CB TYR A 66 -2.939 1.889 -3.885 1.00 0.00 C ATOM 1009 CG TYR A 66 -2.124 0.683 -3.476 1.00 0.00 C ATOM 1010 CD1 TYR A 66 -1.274 0.055 -4.378 1.00 0.00 C ATOM 1011 CD2 TYR A 66 -2.203 0.172 -2.186 1.00 0.00 C ATOM 1012 CE1 TYR A 66 -0.528 -1.048 -4.009 1.00 0.00 C ATOM 1013 CE2 TYR A 66 -1.460 -0.930 -1.808 1.00 0.00 C ATOM 1014 CZ TYR A 66 -0.624 -1.536 -2.723 1.00 0.00 C ATOM 1015 OH TYR A 66 0.118 -2.633 -2.350 1.00 0.00 O ATOM 0 H TYR A 66 -2.698 1.875 -6.510 1.00 0.00 H new ATOM 0 HA TYR A 66 -4.604 0.717 -4.572 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -2.271 2.647 -4.294 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -3.405 2.320 -2.999 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -1.195 0.436 -5.386 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -2.856 0.644 -1.467 1.00 0.00 H new ATOM 0 HE1 TYR A 66 0.126 -1.525 -4.724 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -1.533 -1.315 -0.802 1.00 0.00 H new ATOM 0 HH TYR A 66 1.036 -2.355 -2.151 1.00 0.00 H new ATOM 1025 N ASP A 67 -6.110 2.691 -4.388 1.00 0.00 N ATOM 1026 CA ASP A 67 -7.097 3.764 -4.439 1.00 0.00 C ATOM 1027 C ASP A 67 -6.758 4.862 -3.436 1.00 0.00 C ATOM 1028 O ASP A 67 -7.648 5.508 -2.882 1.00 0.00 O ATOM 1029 CB ASP A 67 -8.496 3.213 -4.156 1.00 0.00 C ATOM 1030 CG ASP A 67 -9.585 4.028 -4.825 1.00 0.00 C ATOM 1031 OD1 ASP A 67 -9.736 3.918 -6.060 1.00 0.00 O ATOM 1032 OD2 ASP A 67 -10.287 4.776 -4.113 1.00 0.00 O ATOM 0 H ASP A 67 -6.377 1.900 -3.802 1.00 0.00 H new ATOM 0 HA ASP A 67 -7.079 4.193 -5.441 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -8.554 2.181 -4.502 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -8.667 3.198 -3.080 1.00 0.00 H new ATOM 1037 N ILE A 68 -5.465 5.068 -3.207 1.00 0.00 N ATOM 1038 CA ILE A 68 -5.009 6.088 -2.270 1.00 0.00 C ATOM 1039 C ILE A 68 -4.573 7.352 -3.004 1.00 0.00 C ATOM 1040 O ILE A 68 -4.352 7.334 -4.215 1.00 0.00 O ATOM 1041 CB ILE A 68 -3.838 5.578 -1.409 1.00 0.00 C ATOM 1042 CG1 ILE A 68 -2.569 5.458 -2.255 1.00 0.00 C ATOM 1043 CG2 ILE A 68 -4.189 4.240 -0.777 1.00 0.00 C ATOM 1044 CD1 ILE A 68 -1.730 6.716 -2.269 1.00 0.00 C ATOM 0 H ILE A 68 -4.715 4.543 -3.657 1.00 0.00 H new ATOM 0 HA ILE A 68 -5.853 6.320 -1.620 1.00 0.00 H new ATOM 0 HB ILE A 68 -3.653 6.297 -0.611 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -1.966 4.633 -1.875 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -2.847 5.205 -3.278 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -3.352 3.893 -0.172 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -5.070 4.356 -0.145 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -4.397 3.511 -1.560 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -0.847 6.558 -2.888 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -2.316 7.540 -2.677 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -1.421 6.959 -1.252 1.00 0.00 H new ATOM 1056 N TYR A 69 -4.449 8.447 -2.262 1.00 0.00 N ATOM 1057 CA TYR A 69 -4.040 9.720 -2.842 1.00 0.00 C ATOM 1058 C TYR A 69 -2.715 10.188 -2.248 1.00 0.00 C ATOM 1059 O TYR A 69 -2.583 10.333 -1.033 1.00 0.00 O ATOM 1060 CB TYR A 69 -5.118 10.780 -2.610 1.00 0.00 C ATOM 1061 CG TYR A 69 -5.400 11.634 -3.826 1.00 0.00 C ATOM 1062 CD1 TYR A 69 -5.475 11.069 -5.093 1.00 0.00 C ATOM 1063 CD2 TYR A 69 -5.590 13.005 -3.708 1.00 0.00 C ATOM 1064 CE1 TYR A 69 -5.731 11.844 -6.207 1.00 0.00 C ATOM 1065 CE2 TYR A 69 -5.849 13.788 -4.816 1.00 0.00 C ATOM 1066 CZ TYR A 69 -5.918 13.203 -6.063 1.00 0.00 C ATOM 1067 OH TYR A 69 -6.174 13.980 -7.170 1.00 0.00 O ATOM 0 H TYR A 69 -4.626 8.478 -1.258 1.00 0.00 H new ATOM 0 HA TYR A 69 -3.907 9.576 -3.914 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -6.040 10.287 -2.301 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -4.810 11.425 -1.787 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -5.331 10.005 -5.209 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -5.534 13.467 -2.733 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -5.784 11.389 -7.185 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -5.997 14.852 -4.706 1.00 0.00 H new ATOM 0 HH TYR A 69 -6.282 14.915 -6.896 1.00 0.00 H new ATOM 1077 N ILE A 70 -1.736 10.424 -3.116 1.00 0.00 N ATOM 1078 CA ILE A 70 -0.421 10.877 -2.678 1.00 0.00 C ATOM 1079 C ILE A 70 -0.525 12.167 -1.871 1.00 0.00 C ATOM 1080 O ILE A 70 -0.036 12.265 -0.746 1.00 0.00 O ATOM 1081 CB ILE A 70 0.522 11.107 -3.874 1.00 0.00 C ATOM 1082 CG1 ILE A 70 1.208 9.798 -4.270 1.00 0.00 C ATOM 1083 CG2 ILE A 70 1.554 12.173 -3.538 1.00 0.00 C ATOM 1084 CD1 ILE A 70 0.366 8.923 -5.172 1.00 0.00 C ATOM 0 H ILE A 70 -1.829 10.309 -4.125 1.00 0.00 H new ATOM 0 HA ILE A 70 -0.009 10.089 -2.047 1.00 0.00 H new ATOM 0 HB ILE A 70 -0.068 11.456 -4.721 1.00 0.00 H new ATOM 0 HG12 ILE A 70 2.147 10.027 -4.773 1.00 0.00 H new ATOM 0 HG13 ILE A 70 1.458 9.241 -3.367 1.00 0.00 H new ATOM 0 HG21 ILE A 70 2.213 12.324 -4.393 1.00 0.00 H new ATOM 0 HG22 ILE A 70 1.047 13.108 -3.301 1.00 0.00 H new ATOM 0 HG23 ILE A 70 2.143 11.852 -2.679 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.915 8.013 -5.412 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -0.562 8.663 -4.663 1.00 0.00 H new ATOM 0 HD13 ILE A 70 0.137 9.462 -6.092 1.00 0.00 H new ATOM 1096 N PRO A 71 -1.178 13.181 -2.458 1.00 0.00 N ATOM 1097 CA PRO A 71 -1.363 14.483 -1.810 1.00 0.00 C ATOM 1098 C PRO A 71 -2.330 14.412 -0.633 1.00 0.00 C ATOM 1099 O PRO A 71 -2.628 15.425 -0.001 1.00 0.00 O ATOM 1100 CB PRO A 71 -1.944 15.355 -2.927 1.00 0.00 C ATOM 1101 CG PRO A 71 -2.606 14.393 -3.852 1.00 0.00 C ATOM 1102 CD PRO A 71 -1.786 13.134 -3.798 1.00 0.00 C ATOM 0 HA PRO A 71 -0.433 14.866 -1.391 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -2.656 16.080 -2.533 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -1.163 15.920 -3.436 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -3.634 14.202 -3.546 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -2.644 14.790 -4.866 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -2.404 12.246 -3.928 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -1.029 13.113 -4.582 1.00 0.00 H new ATOM 1110 N ASP A 72 -2.816 13.210 -0.344 1.00 0.00 N ATOM 1111 CA ASP A 72 -3.747 13.007 0.760 1.00 0.00 C ATOM 1112 C ASP A 72 -3.227 11.944 1.722 1.00 0.00 C ATOM 1113 O ASP A 72 -3.778 11.750 2.807 1.00 0.00 O ATOM 1114 CB ASP A 72 -5.122 12.601 0.226 1.00 0.00 C ATOM 1115 CG ASP A 72 -6.251 13.047 1.134 1.00 0.00 C ATOM 1116 OD1 ASP A 72 -6.129 14.130 1.745 1.00 0.00 O ATOM 1117 OD2 ASP A 72 -7.256 12.313 1.234 1.00 0.00 O ATOM 0 H ASP A 72 -2.581 12.361 -0.859 1.00 0.00 H new ATOM 0 HA ASP A 72 -3.839 13.948 1.303 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -5.265 13.032 -0.765 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -5.158 11.518 0.111 1.00 0.00 H new ATOM 1122 N LEU A 73 -2.164 11.257 1.318 1.00 0.00 N ATOM 1123 CA LEU A 73 -1.570 10.212 2.144 1.00 0.00 C ATOM 1124 C LEU A 73 -0.770 10.815 3.294 1.00 0.00 C ATOM 1125 O LEU A 73 0.248 11.478 3.093 1.00 0.00 O ATOM 1126 CB LEU A 73 -0.666 9.315 1.295 1.00 0.00 C ATOM 1127 CG LEU A 73 -0.518 7.870 1.770 1.00 0.00 C ATOM 1128 CD1 LEU A 73 -0.055 7.829 3.218 1.00 0.00 C ATOM 1129 CD2 LEU A 73 -1.830 7.116 1.606 1.00 0.00 C ATOM 0 H LEU A 73 -1.696 11.405 0.424 1.00 0.00 H new ATOM 0 HA LEU A 73 -2.378 9.612 2.563 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -1.053 9.304 0.276 1.00 0.00 H new ATOM 0 HB3 LEU A 73 0.325 9.766 1.255 1.00 0.00 H new ATOM 0 HG LEU A 73 0.237 7.382 1.154 1.00 0.00 H new ATOM 0 HD11 LEU A 73 0.045 6.792 3.539 1.00 0.00 H new ATOM 0 HD12 LEU A 73 0.909 8.330 3.306 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -0.786 8.335 3.848 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -1.705 6.089 1.949 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -2.606 7.604 2.196 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -2.120 7.114 0.555 1.00 0.00 H new ATOM 1141 N PRO A 74 -1.238 10.580 4.528 1.00 0.00 N ATOM 1142 CA PRO A 74 -0.580 11.090 5.735 1.00 0.00 C ATOM 1143 C PRO A 74 0.753 10.400 6.003 1.00 0.00 C ATOM 1144 O PRO A 74 0.912 9.210 5.733 1.00 0.00 O ATOM 1145 CB PRO A 74 -1.582 10.769 6.847 1.00 0.00 C ATOM 1146 CG PRO A 74 -2.364 9.611 6.331 1.00 0.00 C ATOM 1147 CD PRO A 74 -2.446 9.798 4.841 1.00 0.00 C ATOM 0 HA PRO A 74 -0.340 12.150 5.652 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -1.073 10.519 7.778 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -2.228 11.622 7.055 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -1.876 8.669 6.580 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -3.359 9.582 6.776 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -2.453 8.843 4.316 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.354 10.328 4.552 1.00 0.00 H new ATOM 1155 N ARG A 75 1.707 11.155 6.538 1.00 0.00 N ATOM 1156 CA ARG A 75 3.027 10.616 6.842 1.00 0.00 C ATOM 1157 C ARG A 75 2.922 9.419 7.783 1.00 0.00 C ATOM 1158 O ARG A 75 3.561 8.390 7.568 1.00 0.00 O ATOM 1159 CB ARG A 75 3.910 11.696 7.470 1.00 0.00 C ATOM 1160 CG ARG A 75 3.990 12.972 6.648 1.00 0.00 C ATOM 1161 CD ARG A 75 4.836 12.777 5.399 1.00 0.00 C ATOM 1162 NE ARG A 75 5.286 14.049 4.840 1.00 0.00 N ATOM 1163 CZ ARG A 75 6.167 14.844 5.438 1.00 0.00 C ATOM 1164 NH1 ARG A 75 6.689 14.499 6.607 1.00 0.00 N ATOM 1165 NH2 ARG A 75 6.527 15.986 4.866 1.00 0.00 N ATOM 0 H ARG A 75 1.590 12.141 6.770 1.00 0.00 H new ATOM 0 HA ARG A 75 3.480 10.284 5.908 1.00 0.00 H new ATOM 0 HB2 ARG A 75 3.526 11.936 8.461 1.00 0.00 H new ATOM 0 HB3 ARG A 75 4.916 11.298 7.606 1.00 0.00 H new ATOM 0 HG2 ARG A 75 2.986 13.287 6.363 1.00 0.00 H new ATOM 0 HG3 ARG A 75 4.414 13.772 7.255 1.00 0.00 H new ATOM 0 HD2 ARG A 75 5.702 12.160 5.640 1.00 0.00 H new ATOM 0 HD3 ARG A 75 4.258 12.236 4.650 1.00 0.00 H new ATOM 0 HE ARG A 75 4.903 14.343 3.942 1.00 0.00 H new ATOM 0 HH11 ARG A 75 6.415 13.622 7.049 1.00 0.00 H new ATOM 0 HH12 ARG A 75 7.365 15.111 7.064 1.00 0.00 H new ATOM 0 HH21 ARG A 75 6.127 16.254 3.967 1.00 0.00 H new ATOM 0 HH22 ARG A 75 7.203 16.596 5.326 1.00 0.00 H new ATOM 1179 N ALA A 76 2.112 9.563 8.827 1.00 0.00 N ATOM 1180 CA ALA A 76 1.922 8.494 9.799 1.00 0.00 C ATOM 1181 C ALA A 76 1.547 7.186 9.111 1.00 0.00 C ATOM 1182 O ALA A 76 1.948 6.108 9.547 1.00 0.00 O ATOM 1183 CB ALA A 76 0.855 8.885 10.812 1.00 0.00 C ATOM 0 H ALA A 76 1.577 10.410 9.021 1.00 0.00 H new ATOM 0 HA ALA A 76 2.866 8.341 10.322 1.00 0.00 H new ATOM 0 HB1 ALA A 76 0.723 8.077 11.532 1.00 0.00 H new ATOM 0 HB2 ALA A 76 1.164 9.790 11.335 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -0.087 9.068 10.296 1.00 0.00 H new ATOM 1189 N ALA A 77 0.775 7.290 8.034 1.00 0.00 N ATOM 1190 CA ALA A 77 0.347 6.115 7.285 1.00 0.00 C ATOM 1191 C ALA A 77 1.535 5.421 6.626 1.00 0.00 C ATOM 1192 O ALA A 77 2.569 6.042 6.380 1.00 0.00 O ATOM 1193 CB ALA A 77 -0.687 6.503 6.239 1.00 0.00 C ATOM 0 H ALA A 77 0.433 8.176 7.661 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.107 5.414 7.985 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -0.997 5.616 5.687 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -1.553 6.946 6.730 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.252 7.226 5.548 1.00 0.00 H new ATOM 1199 N ARG A 78 1.379 4.132 6.344 1.00 0.00 N ATOM 1200 CA ARG A 78 2.440 3.354 5.715 1.00 0.00 C ATOM 1201 C ARG A 78 1.860 2.193 4.912 1.00 0.00 C ATOM 1202 O ARG A 78 0.659 1.927 4.965 1.00 0.00 O ATOM 1203 CB ARG A 78 3.408 2.823 6.774 1.00 0.00 C ATOM 1204 CG ARG A 78 3.980 3.905 7.675 1.00 0.00 C ATOM 1205 CD ARG A 78 4.734 3.309 8.853 1.00 0.00 C ATOM 1206 NE ARG A 78 5.467 4.324 9.604 1.00 0.00 N ATOM 1207 CZ ARG A 78 5.905 4.147 10.846 1.00 0.00 C ATOM 1208 NH1 ARG A 78 5.686 2.999 11.472 1.00 0.00 N ATOM 1209 NH2 ARG A 78 6.565 5.118 11.463 1.00 0.00 N ATOM 0 H ARG A 78 0.529 3.604 6.541 1.00 0.00 H new ATOM 0 HA ARG A 78 2.982 4.009 5.033 1.00 0.00 H new ATOM 0 HB2 ARG A 78 2.892 2.086 7.389 1.00 0.00 H new ATOM 0 HB3 ARG A 78 4.228 2.305 6.277 1.00 0.00 H new ATOM 0 HG2 ARG A 78 4.650 4.543 7.099 1.00 0.00 H new ATOM 0 HG3 ARG A 78 3.173 4.539 8.042 1.00 0.00 H new ATOM 0 HD2 ARG A 78 4.031 2.805 9.516 1.00 0.00 H new ATOM 0 HD3 ARG A 78 5.430 2.552 8.492 1.00 0.00 H new ATOM 0 HE ARG A 78 5.653 5.218 9.150 1.00 0.00 H new ATOM 0 HH11 ARG A 78 5.180 2.249 11.000 1.00 0.00 H new ATOM 0 HH12 ARG A 78 6.023 2.866 12.425 1.00 0.00 H new ATOM 0 HH21 ARG A 78 6.737 6.002 10.984 1.00 0.00 H new ATOM 0 HH22 ARG A 78 6.901 4.981 12.416 1.00 0.00 H new ATOM 1223 N LEU A 79 2.721 1.507 4.169 1.00 0.00 N ATOM 1224 CA LEU A 79 2.295 0.374 3.354 1.00 0.00 C ATOM 1225 C LEU A 79 2.467 -0.938 4.113 1.00 0.00 C ATOM 1226 O LEU A 79 3.513 -1.186 4.714 1.00 0.00 O ATOM 1227 CB LEU A 79 3.092 0.331 2.050 1.00 0.00 C ATOM 1228 CG LEU A 79 2.740 -0.802 1.085 1.00 0.00 C ATOM 1229 CD1 LEU A 79 1.278 -0.719 0.676 1.00 0.00 C ATOM 1230 CD2 LEU A 79 3.642 -0.759 -0.140 1.00 0.00 C ATOM 0 H LEU A 79 3.718 1.715 4.114 1.00 0.00 H new ATOM 0 HA LEU A 79 1.238 0.502 3.122 1.00 0.00 H new ATOM 0 HB2 LEU A 79 2.953 1.279 1.531 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.151 0.255 2.297 1.00 0.00 H new ATOM 0 HG LEU A 79 2.900 -1.752 1.596 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.046 -1.533 -0.011 1.00 0.00 H new ATOM 0 HD12 LEU A 79 0.647 -0.800 1.561 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.092 0.235 0.184 1.00 0.00 H new ATOM 0 HD21 LEU A 79 3.377 -1.572 -0.816 1.00 0.00 H new ATOM 0 HD22 LEU A 79 3.514 0.194 -0.653 1.00 0.00 H new ATOM 0 HD23 LEU A 79 4.681 -0.868 0.169 1.00 0.00 H new ATOM 1242 N CYS A 80 1.435 -1.774 4.079 1.00 0.00 N ATOM 1243 CA CYS A 80 1.473 -3.062 4.762 1.00 0.00 C ATOM 1244 C CYS A 80 1.100 -4.194 3.810 1.00 0.00 C ATOM 1245 O CYS A 80 0.132 -4.092 3.056 1.00 0.00 O ATOM 1246 CB CYS A 80 0.523 -3.055 5.961 1.00 0.00 C ATOM 1247 SG CYS A 80 0.949 -1.842 7.233 1.00 0.00 S ATOM 0 H CYS A 80 0.563 -1.583 3.586 1.00 0.00 H new ATOM 0 HA CYS A 80 2.491 -3.228 5.114 1.00 0.00 H new ATOM 0 HB2 CYS A 80 -0.489 -2.855 5.608 1.00 0.00 H new ATOM 0 HB3 CYS A 80 0.514 -4.048 6.410 1.00 0.00 H new ATOM 0 HG CYS A 80 -0.114 -1.540 7.918 1.00 0.00 H new ATOM 1253 N LEU A 81 1.876 -5.272 3.848 1.00 0.00 N ATOM 1254 CA LEU A 81 1.629 -6.423 2.987 1.00 0.00 C ATOM 1255 C LEU A 81 1.866 -7.728 3.741 1.00 0.00 C ATOM 1256 O LEU A 81 2.629 -7.768 4.707 1.00 0.00 O ATOM 1257 CB LEU A 81 2.529 -6.364 1.752 1.00 0.00 C ATOM 1258 CG LEU A 81 3.941 -5.821 1.976 1.00 0.00 C ATOM 1259 CD1 LEU A 81 4.885 -6.942 2.383 1.00 0.00 C ATOM 1260 CD2 LEU A 81 4.449 -5.122 0.723 1.00 0.00 C ATOM 0 H LEU A 81 2.681 -5.373 4.466 1.00 0.00 H new ATOM 0 HA LEU A 81 0.586 -6.391 2.671 1.00 0.00 H new ATOM 0 HB2 LEU A 81 2.609 -7.369 1.337 1.00 0.00 H new ATOM 0 HB3 LEU A 81 2.039 -5.747 0.999 1.00 0.00 H new ATOM 0 HG LEU A 81 3.905 -5.092 2.785 1.00 0.00 H new ATOM 0 HD11 LEU A 81 5.885 -6.537 2.538 1.00 0.00 H new ATOM 0 HD12 LEU A 81 4.531 -7.398 3.307 1.00 0.00 H new ATOM 0 HD13 LEU A 81 4.917 -7.695 1.596 1.00 0.00 H new ATOM 0 HD21 LEU A 81 5.455 -4.742 0.901 1.00 0.00 H new ATOM 0 HD22 LEU A 81 4.470 -5.830 -0.106 1.00 0.00 H new ATOM 0 HD23 LEU A 81 3.787 -4.293 0.475 1.00 0.00 H new ATOM 1272 N SER A 82 1.210 -8.793 3.292 1.00 0.00 N ATOM 1273 CA SER A 82 1.348 -10.099 3.925 1.00 0.00 C ATOM 1274 C SER A 82 0.944 -11.214 2.965 1.00 0.00 C ATOM 1275 O SER A 82 -0.113 -11.153 2.336 1.00 0.00 O ATOM 1276 CB SER A 82 0.495 -10.168 5.193 1.00 0.00 C ATOM 1277 OG SER A 82 -0.884 -10.065 4.886 1.00 0.00 O ATOM 0 H SER A 82 0.577 -8.777 2.492 1.00 0.00 H new ATOM 0 HA SER A 82 2.396 -10.236 4.193 1.00 0.00 H new ATOM 0 HB2 SER A 82 0.686 -11.107 5.713 1.00 0.00 H new ATOM 0 HB3 SER A 82 0.781 -9.364 5.871 1.00 0.00 H new ATOM 0 HG SER A 82 -1.372 -10.791 5.327 1.00 0.00 H new ATOM 1283 N ILE A 83 1.792 -12.230 2.858 1.00 0.00 N ATOM 1284 CA ILE A 83 1.524 -13.359 1.976 1.00 0.00 C ATOM 1285 C ILE A 83 0.562 -14.348 2.626 1.00 0.00 C ATOM 1286 O ILE A 83 0.631 -14.596 3.831 1.00 0.00 O ATOM 1287 CB ILE A 83 2.820 -14.097 1.594 1.00 0.00 C ATOM 1288 CG1 ILE A 83 3.870 -13.103 1.092 1.00 0.00 C ATOM 1289 CG2 ILE A 83 2.537 -15.155 0.539 1.00 0.00 C ATOM 1290 CD1 ILE A 83 5.281 -13.647 1.123 1.00 0.00 C ATOM 0 H ILE A 83 2.671 -12.295 3.371 1.00 0.00 H new ATOM 0 HA ILE A 83 1.069 -12.952 1.073 1.00 0.00 H new ATOM 0 HB ILE A 83 3.212 -14.594 2.481 1.00 0.00 H new ATOM 0 HG12 ILE A 83 3.624 -12.812 0.071 1.00 0.00 H new ATOM 0 HG13 ILE A 83 3.824 -12.200 1.701 1.00 0.00 H new ATOM 0 HG21 ILE A 83 3.463 -15.667 0.280 1.00 0.00 H new ATOM 0 HG22 ILE A 83 1.820 -15.877 0.931 1.00 0.00 H new ATOM 0 HG23 ILE A 83 2.124 -14.680 -0.351 1.00 0.00 H new ATOM 0 HD11 ILE A 83 5.971 -12.889 0.754 1.00 0.00 H new ATOM 0 HD12 ILE A 83 5.546 -13.912 2.146 1.00 0.00 H new ATOM 0 HD13 ILE A 83 5.343 -14.533 0.491 1.00 0.00 H new ATOM 1302 N CYS A 84 -0.333 -14.911 1.822 1.00 0.00 N ATOM 1303 CA CYS A 84 -1.309 -15.875 2.319 1.00 0.00 C ATOM 1304 C CYS A 84 -1.424 -17.067 1.375 1.00 0.00 C ATOM 1305 O CYS A 84 -1.238 -16.935 0.165 1.00 0.00 O ATOM 1306 CB CYS A 84 -2.675 -15.208 2.487 1.00 0.00 C ATOM 1307 SG CYS A 84 -2.729 -13.955 3.789 1.00 0.00 S ATOM 0 H CYS A 84 -0.403 -14.717 0.823 1.00 0.00 H new ATOM 0 HA CYS A 84 -0.967 -16.235 3.289 1.00 0.00 H new ATOM 0 HB2 CYS A 84 -2.961 -14.747 1.542 1.00 0.00 H new ATOM 0 HB3 CYS A 84 -3.418 -15.975 2.705 1.00 0.00 H new ATOM 0 HG CYS A 84 -3.701 -13.125 3.553 1.00 0.00 H new ATOM 1313 N SER A 85 -1.730 -18.232 1.937 1.00 0.00 N ATOM 1314 CA SER A 85 -1.865 -19.450 1.146 1.00 0.00 C ATOM 1315 C SER A 85 -3.300 -19.966 1.183 1.00 0.00 C ATOM 1316 O SER A 85 -3.834 -20.272 2.249 1.00 0.00 O ATOM 1317 CB SER A 85 -0.910 -20.528 1.664 1.00 0.00 C ATOM 1318 OG SER A 85 0.441 -20.158 1.449 1.00 0.00 O ATOM 0 H SER A 85 -1.889 -18.358 2.937 1.00 0.00 H new ATOM 0 HA SER A 85 -1.609 -19.213 0.113 1.00 0.00 H new ATOM 0 HB2 SER A 85 -1.081 -20.689 2.728 1.00 0.00 H new ATOM 0 HB3 SER A 85 -1.116 -21.473 1.161 1.00 0.00 H new ATOM 0 HG SER A 85 1.031 -20.862 1.790 1.00 0.00 H new ATOM 1324 N VAL A 86 -3.919 -20.060 0.011 1.00 0.00 N ATOM 1325 CA VAL A 86 -5.292 -20.539 -0.093 1.00 0.00 C ATOM 1326 C VAL A 86 -5.338 -21.961 -0.642 1.00 0.00 C ATOM 1327 O VAL A 86 -4.615 -22.300 -1.580 1.00 0.00 O ATOM 1328 CB VAL A 86 -6.140 -19.624 -0.996 1.00 0.00 C ATOM 1329 CG1 VAL A 86 -5.790 -19.846 -2.460 1.00 0.00 C ATOM 1330 CG2 VAL A 86 -7.622 -19.861 -0.752 1.00 0.00 C ATOM 0 H VAL A 86 -3.491 -19.811 -0.881 1.00 0.00 H new ATOM 0 HA VAL A 86 -5.708 -20.528 0.915 1.00 0.00 H new ATOM 0 HB VAL A 86 -5.915 -18.587 -0.747 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -6.399 -19.191 -3.083 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -4.735 -19.622 -2.620 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -5.984 -20.885 -2.727 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -8.206 -19.206 -1.398 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -7.865 -20.900 -0.973 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -7.858 -19.647 0.290 1.00 0.00 H new ATOM 1340 N LYS A 87 -6.192 -22.790 -0.053 1.00 0.00 N ATOM 1341 CA LYS A 87 -6.335 -24.176 -0.483 1.00 0.00 C ATOM 1342 C LYS A 87 -7.803 -24.528 -0.704 1.00 0.00 C ATOM 1343 O LYS A 87 -8.595 -24.549 0.237 1.00 0.00 O ATOM 1344 CB LYS A 87 -5.724 -25.119 0.555 1.00 0.00 C ATOM 1345 CG LYS A 87 -6.097 -26.577 0.346 1.00 0.00 C ATOM 1346 CD LYS A 87 -5.276 -27.209 -0.765 1.00 0.00 C ATOM 1347 CE LYS A 87 -6.000 -28.391 -1.390 1.00 0.00 C ATOM 1348 NZ LYS A 87 -5.376 -28.807 -2.676 1.00 0.00 N ATOM 0 H LYS A 87 -6.797 -22.526 0.725 1.00 0.00 H new ATOM 0 HA LYS A 87 -5.805 -24.294 -1.428 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -4.639 -25.023 0.527 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -6.046 -24.809 1.549 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -5.943 -27.129 1.273 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -7.157 -26.651 0.103 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -5.065 -26.464 -1.532 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -4.316 -27.538 -0.367 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -5.993 -29.230 -0.695 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -7.044 -28.128 -1.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -6.093 -29.258 -3.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -4.990 -27.972 -3.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -4.608 -29.483 -2.487 1.00 0.00 H new ATOM 1454 N GLU A 94 -12.564 -22.561 0.091 1.00 0.00 N ATOM 1455 CA GLU A 94 -11.148 -22.221 0.167 1.00 0.00 C ATOM 1456 C GLU A 94 -10.791 -21.683 1.550 1.00 0.00 C ATOM 1457 O GLU A 94 -11.590 -20.996 2.184 1.00 0.00 O ATOM 1458 CB GLU A 94 -10.791 -21.187 -0.902 1.00 0.00 C ATOM 1459 CG GLU A 94 -10.919 -21.711 -2.323 1.00 0.00 C ATOM 1460 CD GLU A 94 -11.139 -20.605 -3.336 1.00 0.00 C ATOM 1461 OE1 GLU A 94 -11.975 -19.715 -3.069 1.00 0.00 O ATOM 1462 OE2 GLU A 94 -10.477 -20.628 -4.394 1.00 0.00 O ATOM 0 HA GLU A 94 -10.573 -23.130 -0.010 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -11.438 -20.318 -0.785 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -9.768 -20.847 -0.740 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -10.017 -22.264 -2.585 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -11.750 -22.415 -2.373 1.00 0.00 H new ATOM 1469 N GLU A 95 -9.585 -22.002 2.009 1.00 0.00 N ATOM 1470 CA GLU A 95 -9.123 -21.552 3.317 1.00 0.00 C ATOM 1471 C GLU A 95 -7.862 -20.704 3.186 1.00 0.00 C ATOM 1472 O GLU A 95 -6.839 -21.166 2.679 1.00 0.00 O ATOM 1473 CB GLU A 95 -8.852 -22.752 4.227 1.00 0.00 C ATOM 1474 CG GLU A 95 -8.597 -22.371 5.676 1.00 0.00 C ATOM 1475 CD GLU A 95 -8.639 -23.566 6.609 1.00 0.00 C ATOM 1476 OE1 GLU A 95 -7.760 -24.445 6.487 1.00 0.00 O ATOM 1477 OE2 GLU A 95 -9.550 -23.622 7.461 1.00 0.00 O ATOM 0 H GLU A 95 -8.911 -22.570 1.495 1.00 0.00 H new ATOM 0 HA GLU A 95 -9.908 -20.939 3.760 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -9.704 -23.431 4.183 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -7.989 -23.299 3.846 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.623 -21.887 5.755 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -9.342 -21.641 5.993 1.00 0.00 H new ATOM 1484 N HIS A 96 -7.942 -19.459 3.646 1.00 0.00 N ATOM 1485 CA HIS A 96 -6.808 -18.545 3.580 1.00 0.00 C ATOM 1486 C HIS A 96 -6.004 -18.582 4.877 1.00 0.00 C ATOM 1487 O HIS A 96 -6.564 -18.752 5.960 1.00 0.00 O ATOM 1488 CB HIS A 96 -7.289 -17.120 3.306 1.00 0.00 C ATOM 1489 CG HIS A 96 -8.158 -17.005 2.091 1.00 0.00 C ATOM 1490 ND1 HIS A 96 -8.132 -15.914 1.248 1.00 0.00 N ATOM 1491 CD2 HIS A 96 -9.080 -17.853 1.578 1.00 0.00 C ATOM 1492 CE1 HIS A 96 -9.002 -16.095 0.270 1.00 0.00 C ATOM 1493 NE2 HIS A 96 -9.590 -17.264 0.447 1.00 0.00 N ATOM 0 H HIS A 96 -8.781 -19.061 4.068 1.00 0.00 H new ATOM 0 HA HIS A 96 -6.162 -18.866 2.763 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -7.841 -16.759 4.173 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -6.423 -16.469 3.186 1.00 0.00 H new ATOM 0 HD1 HIS A 96 -7.535 -15.095 1.362 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -9.362 -18.814 1.983 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -9.199 -15.404 -0.537 1.00 0.00 H new ATOM 1502 N CYS A 97 -4.691 -18.423 4.758 1.00 0.00 N ATOM 1503 CA CYS A 97 -3.811 -18.440 5.921 1.00 0.00 C ATOM 1504 C CYS A 97 -2.557 -17.609 5.666 1.00 0.00 C ATOM 1505 O CYS A 97 -1.844 -17.803 4.681 1.00 0.00 O ATOM 1506 CB CYS A 97 -3.422 -19.877 6.271 1.00 0.00 C ATOM 1507 SG CYS A 97 -2.980 -20.120 8.007 1.00 0.00 S ATOM 0 H CYS A 97 -4.212 -18.281 3.869 1.00 0.00 H new ATOM 0 HA CYS A 97 -4.351 -18.002 6.761 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -4.253 -20.538 6.023 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -2.580 -20.176 5.647 1.00 0.00 H new ATOM 0 HG CYS A 97 -2.669 -21.367 8.205 1.00 0.00 H new ATOM 1513 N PRO A 98 -2.282 -16.659 6.572 1.00 0.00 N ATOM 1514 CA PRO A 98 -1.115 -15.778 6.466 1.00 0.00 C ATOM 1515 C PRO A 98 0.195 -16.522 6.703 1.00 0.00 C ATOM 1516 O PRO A 98 0.223 -17.554 7.375 1.00 0.00 O ATOM 1517 CB PRO A 98 -1.350 -14.744 7.570 1.00 0.00 C ATOM 1518 CG PRO A 98 -2.216 -15.440 8.563 1.00 0.00 C ATOM 1519 CD PRO A 98 -3.089 -16.372 7.770 1.00 0.00 C ATOM 0 HA PRO A 98 -1.020 -15.344 5.470 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -0.410 -14.425 8.020 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -1.836 -13.850 7.178 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -1.615 -15.990 9.287 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -2.817 -14.725 9.125 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -3.318 -17.280 8.328 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -4.041 -15.908 7.512 1.00 0.00 H new ATOM 1527 N LEU A 99 1.279 -15.991 6.148 1.00 0.00 N ATOM 1528 CA LEU A 99 2.595 -16.604 6.300 1.00 0.00 C ATOM 1529 C LEU A 99 3.619 -15.583 6.785 1.00 0.00 C ATOM 1530 O LEU A 99 4.307 -15.805 7.781 1.00 0.00 O ATOM 1531 CB LEU A 99 3.052 -17.211 4.972 1.00 0.00 C ATOM 1532 CG LEU A 99 2.031 -18.090 4.249 1.00 0.00 C ATOM 1533 CD1 LEU A 99 2.453 -18.322 2.806 1.00 0.00 C ATOM 1534 CD2 LEU A 99 1.859 -19.416 4.976 1.00 0.00 C ATOM 0 H LEU A 99 1.273 -15.138 5.589 1.00 0.00 H new ATOM 0 HA LEU A 99 2.517 -17.394 7.046 1.00 0.00 H new ATOM 0 HB2 LEU A 99 3.340 -16.399 4.304 1.00 0.00 H new ATOM 0 HB3 LEU A 99 3.947 -17.805 5.156 1.00 0.00 H new ATOM 0 HG LEU A 99 1.072 -17.573 4.247 1.00 0.00 H new ATOM 0 HD11 LEU A 99 1.714 -18.950 2.307 1.00 0.00 H new ATOM 0 HD12 LEU A 99 2.524 -17.365 2.289 1.00 0.00 H new ATOM 0 HD13 LEU A 99 3.423 -18.818 2.786 1.00 0.00 H new ATOM 0 HD21 LEU A 99 1.129 -20.029 4.447 1.00 0.00 H new ATOM 0 HD22 LEU A 99 2.815 -19.939 5.010 1.00 0.00 H new ATOM 0 HD23 LEU A 99 1.510 -19.231 5.992 1.00 0.00 H new ATOM 1546 N ALA A 100 3.713 -14.464 6.075 1.00 0.00 N ATOM 1547 CA ALA A 100 4.650 -13.407 6.435 1.00 0.00 C ATOM 1548 C ALA A 100 4.000 -12.033 6.314 1.00 0.00 C ATOM 1549 O ALA A 100 3.079 -11.839 5.521 1.00 0.00 O ATOM 1550 CB ALA A 100 5.893 -13.484 5.562 1.00 0.00 C ATOM 0 H ALA A 100 3.152 -14.266 5.247 1.00 0.00 H new ATOM 0 HA ALA A 100 4.941 -13.552 7.475 1.00 0.00 H new ATOM 0 HB1 ALA A 100 6.584 -12.689 5.842 1.00 0.00 H new ATOM 0 HB2 ALA A 100 6.377 -14.451 5.702 1.00 0.00 H new ATOM 0 HB3 ALA A 100 5.611 -13.368 4.516 1.00 0.00 H new ATOM 1556 N TRP A 101 4.485 -11.083 7.106 1.00 0.00 N ATOM 1557 CA TRP A 101 3.950 -9.726 7.087 1.00 0.00 C ATOM 1558 C TRP A 101 5.075 -8.698 7.058 1.00 0.00 C ATOM 1559 O TRP A 101 5.981 -8.731 7.889 1.00 0.00 O ATOM 1560 CB TRP A 101 3.059 -9.491 8.308 1.00 0.00 C ATOM 1561 CG TRP A 101 3.739 -9.799 9.608 1.00 0.00 C ATOM 1562 CD1 TRP A 101 3.676 -10.970 10.308 1.00 0.00 C ATOM 1563 CD2 TRP A 101 4.582 -8.922 10.363 1.00 0.00 C ATOM 1564 NE1 TRP A 101 4.429 -10.874 11.453 1.00 0.00 N ATOM 1565 CE2 TRP A 101 4.996 -9.628 11.510 1.00 0.00 C ATOM 1566 CE3 TRP A 101 5.030 -7.611 10.181 1.00 0.00 C ATOM 1567 CZ2 TRP A 101 5.834 -9.065 12.468 1.00 0.00 C ATOM 1568 CZ3 TRP A 101 5.861 -7.053 11.134 1.00 0.00 C ATOM 1569 CH2 TRP A 101 6.257 -7.779 12.265 1.00 0.00 C ATOM 0 H TRP A 101 5.247 -11.227 7.769 1.00 0.00 H new ATOM 0 HA TRP A 101 3.353 -9.609 6.182 1.00 0.00 H new ATOM 0 HB2 TRP A 101 2.731 -8.451 8.315 1.00 0.00 H new ATOM 0 HB3 TRP A 101 2.164 -10.107 8.220 1.00 0.00 H new ATOM 0 HD1 TRP A 101 3.117 -11.843 10.006 1.00 0.00 H new ATOM 0 HE1 TRP A 101 4.547 -11.611 12.148 1.00 0.00 H new ATOM 0 HE3 TRP A 101 4.732 -7.044 9.311 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 6.140 -9.623 13.341 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 6.211 -6.040 11.005 1.00 0.00 H new ATOM 0 HH2 TRP A 101 6.909 -7.315 12.991 1.00 0.00 H new ATOM 1580 N GLY A 102 5.011 -7.784 6.094 1.00 0.00 N ATOM 1581 CA GLY A 102 6.031 -6.758 5.975 1.00 0.00 C ATOM 1582 C GLY A 102 5.443 -5.365 5.870 1.00 0.00 C ATOM 1583 O GLY A 102 4.556 -5.119 5.054 1.00 0.00 O ATOM 0 H GLY A 102 4.271 -7.736 5.394 1.00 0.00 H new ATOM 0 HA2 GLY A 102 6.692 -6.806 6.840 1.00 0.00 H new ATOM 0 HA3 GLY A 102 6.642 -6.958 5.095 1.00 0.00 H new ATOM 1587 N ASN A 103 5.937 -4.452 6.699 1.00 0.00 N ATOM 1588 CA ASN A 103 5.453 -3.076 6.697 1.00 0.00 C ATOM 1589 C ASN A 103 6.534 -2.120 6.202 1.00 0.00 C ATOM 1590 O ASN A 103 7.642 -2.088 6.739 1.00 0.00 O ATOM 1591 CB ASN A 103 5.002 -2.670 8.102 1.00 0.00 C ATOM 1592 CG ASN A 103 3.696 -3.328 8.502 1.00 0.00 C ATOM 1593 OD1 ASN A 103 3.228 -4.257 7.843 1.00 0.00 O ATOM 1594 ND2 ASN A 103 3.101 -2.849 9.588 1.00 0.00 N ATOM 0 H ASN A 103 6.672 -4.640 7.381 1.00 0.00 H new ATOM 0 HA ASN A 103 4.602 -3.017 6.018 1.00 0.00 H new ATOM 0 HB2 ASN A 103 5.776 -2.938 8.821 1.00 0.00 H new ATOM 0 HB3 ASN A 103 4.888 -1.587 8.145 1.00 0.00 H new ATOM 0 HD21 ASN A 103 2.220 -3.252 9.907 1.00 0.00 H new ATOM 0 HD22 ASN A 103 3.525 -2.078 10.104 1.00 0.00 H new ATOM 1601 N ILE A 104 6.204 -1.343 5.176 1.00 0.00 N ATOM 1602 CA ILE A 104 7.145 -0.385 4.610 1.00 0.00 C ATOM 1603 C ILE A 104 6.612 1.040 4.717 1.00 0.00 C ATOM 1604 O ILE A 104 5.459 1.308 4.382 1.00 0.00 O ATOM 1605 CB ILE A 104 7.447 -0.698 3.133 1.00 0.00 C ATOM 1606 CG1 ILE A 104 7.888 -2.155 2.978 1.00 0.00 C ATOM 1607 CG2 ILE A 104 8.516 0.244 2.599 1.00 0.00 C ATOM 1608 CD1 ILE A 104 7.529 -2.755 1.637 1.00 0.00 C ATOM 0 H ILE A 104 5.292 -1.358 4.720 1.00 0.00 H new ATOM 0 HA ILE A 104 8.066 -0.470 5.187 1.00 0.00 H new ATOM 0 HB ILE A 104 6.537 -0.549 2.552 1.00 0.00 H new ATOM 0 HG12 ILE A 104 8.967 -2.216 3.117 1.00 0.00 H new ATOM 0 HG13 ILE A 104 7.430 -2.751 3.768 1.00 0.00 H new ATOM 0 HG21 ILE A 104 8.718 0.010 1.554 1.00 0.00 H new ATOM 0 HG22 ILE A 104 8.167 1.273 2.679 1.00 0.00 H new ATOM 0 HG23 ILE A 104 9.430 0.124 3.181 1.00 0.00 H new ATOM 0 HD11 ILE A 104 7.872 -3.789 1.598 1.00 0.00 H new ATOM 0 HD12 ILE A 104 6.448 -2.726 1.503 1.00 0.00 H new ATOM 0 HD13 ILE A 104 8.008 -2.183 0.842 1.00 0.00 H new ATOM 1620 N ASN A 105 7.459 1.950 5.186 1.00 0.00 N ATOM 1621 CA ASN A 105 7.073 3.348 5.336 1.00 0.00 C ATOM 1622 C ASN A 105 7.022 4.047 3.981 1.00 0.00 C ATOM 1623 O ASN A 105 8.046 4.497 3.464 1.00 0.00 O ATOM 1624 CB ASN A 105 8.054 4.073 6.260 1.00 0.00 C ATOM 1625 CG ASN A 105 9.454 3.495 6.185 1.00 0.00 C ATOM 1626 OD1 ASN A 105 10.266 3.911 5.359 1.00 0.00 O ATOM 1627 ND2 ASN A 105 9.742 2.529 7.051 1.00 0.00 N ATOM 0 H ASN A 105 8.417 1.744 5.469 1.00 0.00 H new ATOM 0 HA ASN A 105 6.077 3.379 5.778 1.00 0.00 H new ATOM 0 HB2 ASN A 105 8.085 5.130 5.995 1.00 0.00 H new ATOM 0 HB3 ASN A 105 7.694 4.013 7.287 1.00 0.00 H new ATOM 0 HD21 ASN A 105 10.668 2.101 7.048 1.00 0.00 H new ATOM 0 HD22 ASN A 105 9.037 2.216 7.718 1.00 0.00 H new ATOM 1634 N LEU A 106 5.826 4.135 3.412 1.00 0.00 N ATOM 1635 CA LEU A 106 5.640 4.780 2.116 1.00 0.00 C ATOM 1636 C LEU A 106 6.563 5.985 1.971 1.00 0.00 C ATOM 1637 O LEU A 106 7.129 6.222 0.903 1.00 0.00 O ATOM 1638 CB LEU A 106 4.184 5.215 1.945 1.00 0.00 C ATOM 1639 CG LEU A 106 3.175 4.096 1.681 1.00 0.00 C ATOM 1640 CD1 LEU A 106 1.794 4.494 2.179 1.00 0.00 C ATOM 1641 CD2 LEU A 106 3.132 3.755 0.199 1.00 0.00 C ATOM 0 H LEU A 106 4.970 3.768 3.827 1.00 0.00 H new ATOM 0 HA LEU A 106 5.890 4.058 1.339 1.00 0.00 H new ATOM 0 HB2 LEU A 106 3.877 5.749 2.845 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.133 5.925 1.120 1.00 0.00 H new ATOM 0 HG LEU A 106 3.494 3.209 2.228 1.00 0.00 H new ATOM 0 HD11 LEU A 106 1.090 3.686 1.983 1.00 0.00 H new ATOM 0 HD12 LEU A 106 1.835 4.687 3.251 1.00 0.00 H new ATOM 0 HD13 LEU A 106 1.466 5.395 1.661 1.00 0.00 H new ATOM 0 HD21 LEU A 106 2.409 2.957 0.030 1.00 0.00 H new ATOM 0 HD22 LEU A 106 2.838 4.638 -0.369 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.118 3.426 -0.127 1.00 0.00 H new ATOM 1653 N PHE A 107 6.713 6.743 3.052 1.00 0.00 N ATOM 1654 CA PHE A 107 7.569 7.923 3.046 1.00 0.00 C ATOM 1655 C PHE A 107 8.923 7.617 3.679 1.00 0.00 C ATOM 1656 O PHE A 107 9.006 7.279 4.860 1.00 0.00 O ATOM 1657 CB PHE A 107 6.893 9.074 3.793 1.00 0.00 C ATOM 1658 CG PHE A 107 5.651 9.581 3.117 1.00 0.00 C ATOM 1659 CD1 PHE A 107 5.738 10.375 1.985 1.00 0.00 C ATOM 1660 CD2 PHE A 107 4.397 9.263 3.613 1.00 0.00 C ATOM 1661 CE1 PHE A 107 4.597 10.843 1.360 1.00 0.00 C ATOM 1662 CE2 PHE A 107 3.253 9.727 2.992 1.00 0.00 C ATOM 1663 CZ PHE A 107 3.353 10.519 1.865 1.00 0.00 C ATOM 0 H PHE A 107 6.253 6.561 3.944 1.00 0.00 H new ATOM 0 HA PHE A 107 7.731 8.217 2.009 1.00 0.00 H new ATOM 0 HB2 PHE A 107 6.639 8.743 4.800 1.00 0.00 H new ATOM 0 HB3 PHE A 107 7.602 9.896 3.896 1.00 0.00 H new ATOM 0 HD1 PHE A 107 6.708 10.631 1.586 1.00 0.00 H new ATOM 0 HD2 PHE A 107 4.313 8.645 4.495 1.00 0.00 H new ATOM 0 HE1 PHE A 107 4.678 11.461 0.478 1.00 0.00 H new ATOM 0 HE2 PHE A 107 2.281 9.470 3.388 1.00 0.00 H new ATOM 0 HZ PHE A 107 2.460 10.884 1.379 1.00 0.00 H new ATOM 1673 N ASP A 108 9.982 7.736 2.885 1.00 0.00 N ATOM 1674 CA ASP A 108 11.333 7.473 3.367 1.00 0.00 C ATOM 1675 C ASP A 108 11.663 8.354 4.567 1.00 0.00 C ATOM 1676 O ASP A 108 10.809 9.087 5.066 1.00 0.00 O ATOM 1677 CB ASP A 108 12.350 7.709 2.249 1.00 0.00 C ATOM 1678 CG ASP A 108 12.624 6.455 1.442 1.00 0.00 C ATOM 1679 OD1 ASP A 108 12.161 5.371 1.853 1.00 0.00 O ATOM 1680 OD2 ASP A 108 13.302 6.559 0.398 1.00 0.00 O ATOM 0 H ASP A 108 9.931 8.013 1.905 1.00 0.00 H new ATOM 0 HA ASP A 108 11.385 6.430 3.681 1.00 0.00 H new ATOM 0 HB2 ASP A 108 11.981 8.491 1.586 1.00 0.00 H new ATOM 0 HB3 ASP A 108 13.283 8.071 2.681 1.00 0.00 H new ATOM 1685 N TYR A 109 12.907 8.277 5.026 1.00 0.00 N ATOM 1686 CA TYR A 109 13.350 9.065 6.170 1.00 0.00 C ATOM 1687 C TYR A 109 13.583 10.520 5.773 1.00 0.00 C ATOM 1688 O TYR A 109 14.071 11.324 6.568 1.00 0.00 O ATOM 1689 CB TYR A 109 14.633 8.474 6.758 1.00 0.00 C ATOM 1690 CG TYR A 109 15.607 7.982 5.712 1.00 0.00 C ATOM 1691 CD1 TYR A 109 15.554 6.673 5.246 1.00 0.00 C ATOM 1692 CD2 TYR A 109 16.581 8.824 5.189 1.00 0.00 C ATOM 1693 CE1 TYR A 109 16.443 6.219 4.291 1.00 0.00 C ATOM 1694 CE2 TYR A 109 17.472 8.378 4.233 1.00 0.00 C ATOM 1695 CZ TYR A 109 17.400 7.075 3.787 1.00 0.00 C ATOM 1696 OH TYR A 109 18.287 6.627 2.836 1.00 0.00 O ATOM 0 H TYR A 109 13.627 7.677 4.623 1.00 0.00 H new ATOM 0 HA TYR A 109 12.564 9.034 6.925 1.00 0.00 H new ATOM 0 HB2 TYR A 109 15.123 9.230 7.372 1.00 0.00 H new ATOM 0 HB3 TYR A 109 14.373 7.647 7.418 1.00 0.00 H new ATOM 0 HD1 TYR A 109 14.805 6.000 5.637 1.00 0.00 H new ATOM 0 HD2 TYR A 109 16.642 9.845 5.536 1.00 0.00 H new ATOM 0 HE1 TYR A 109 16.389 5.199 3.941 1.00 0.00 H new ATOM 0 HE2 TYR A 109 18.222 9.046 3.836 1.00 0.00 H new ATOM 0 HH TYR A 109 18.894 7.355 2.587 1.00 0.00 H new ATOM 1706 N THR A 110 13.229 10.852 4.535 1.00 0.00 N ATOM 1707 CA THR A 110 13.399 12.209 4.030 1.00 0.00 C ATOM 1708 C THR A 110 12.091 12.753 3.466 1.00 0.00 C ATOM 1709 O THR A 110 12.088 13.718 2.701 1.00 0.00 O ATOM 1710 CB THR A 110 14.481 12.269 2.935 1.00 0.00 C ATOM 1711 OG1 THR A 110 14.219 11.281 1.933 1.00 0.00 O ATOM 1712 CG2 THR A 110 15.863 12.044 3.528 1.00 0.00 C ATOM 0 H THR A 110 12.823 10.200 3.864 1.00 0.00 H new ATOM 0 HA THR A 110 13.712 12.824 4.874 1.00 0.00 H new ATOM 0 HB THR A 110 14.454 13.260 2.482 1.00 0.00 H new ATOM 0 HG1 THR A 110 14.910 11.327 1.240 1.00 0.00 H new ATOM 0 HG21 THR A 110 16.611 12.091 2.736 1.00 0.00 H new ATOM 0 HG22 THR A 110 16.071 12.816 4.269 1.00 0.00 H new ATOM 0 HG23 THR A 110 15.900 11.064 4.004 1.00 0.00 H new ATOM 1720 N ASP A 111 10.982 12.130 3.849 1.00 0.00 N ATOM 1721 CA ASP A 111 9.667 12.554 3.383 1.00 0.00 C ATOM 1722 C ASP A 111 9.588 12.505 1.861 1.00 0.00 C ATOM 1723 O ASP A 111 8.862 13.283 1.240 1.00 0.00 O ATOM 1724 CB ASP A 111 9.358 13.968 3.878 1.00 0.00 C ATOM 1725 CG ASP A 111 9.742 14.170 5.330 1.00 0.00 C ATOM 1726 OD1 ASP A 111 9.498 13.253 6.141 1.00 0.00 O ATOM 1727 OD2 ASP A 111 10.287 15.246 5.656 1.00 0.00 O ATOM 0 H ASP A 111 10.967 11.330 4.481 1.00 0.00 H new ATOM 0 HA ASP A 111 8.926 11.866 3.789 1.00 0.00 H new ATOM 0 HB2 ASP A 111 9.891 14.691 3.260 1.00 0.00 H new ATOM 0 HB3 ASP A 111 8.294 14.168 3.756 1.00 0.00 H new ATOM 1732 N THR A 112 10.342 11.587 1.263 1.00 0.00 N ATOM 1733 CA THR A 112 10.359 11.438 -0.187 1.00 0.00 C ATOM 1734 C THR A 112 9.849 10.064 -0.605 1.00 0.00 C ATOM 1735 O THR A 112 10.562 9.065 -0.491 1.00 0.00 O ATOM 1736 CB THR A 112 11.776 11.642 -0.755 1.00 0.00 C ATOM 1737 OG1 THR A 112 12.248 12.955 -0.434 1.00 0.00 O ATOM 1738 CG2 THR A 112 11.787 11.449 -2.264 1.00 0.00 C ATOM 0 H THR A 112 10.949 10.936 1.761 1.00 0.00 H new ATOM 0 HA THR A 112 9.699 12.205 -0.592 1.00 0.00 H new ATOM 0 HB THR A 112 12.434 10.899 -0.305 1.00 0.00 H new ATOM 0 HG1 THR A 112 12.269 13.066 0.539 1.00 0.00 H new ATOM 0 HG21 THR A 112 12.798 11.598 -2.643 1.00 0.00 H new ATOM 0 HG22 THR A 112 11.455 10.439 -2.504 1.00 0.00 H new ATOM 0 HG23 THR A 112 11.116 12.172 -2.728 1.00 0.00 H new ATOM 1746 N LEU A 113 8.613 10.019 -1.089 1.00 0.00 N ATOM 1747 CA LEU A 113 8.008 8.765 -1.526 1.00 0.00 C ATOM 1748 C LEU A 113 9.051 7.845 -2.152 1.00 0.00 C ATOM 1749 O LEU A 113 9.874 8.280 -2.958 1.00 0.00 O ATOM 1750 CB LEU A 113 6.886 9.040 -2.529 1.00 0.00 C ATOM 1751 CG LEU A 113 5.532 9.428 -1.932 1.00 0.00 C ATOM 1752 CD1 LEU A 113 4.576 9.878 -3.026 1.00 0.00 C ATOM 1753 CD2 LEU A 113 4.941 8.264 -1.150 1.00 0.00 C ATOM 0 H LEU A 113 8.010 10.836 -1.189 1.00 0.00 H new ATOM 0 HA LEU A 113 7.591 8.267 -0.651 1.00 0.00 H new ATOM 0 HB2 LEU A 113 7.209 9.840 -3.195 1.00 0.00 H new ATOM 0 HB3 LEU A 113 6.748 8.150 -3.143 1.00 0.00 H new ATOM 0 HG LEU A 113 5.684 10.261 -1.245 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.618 10.150 -2.583 1.00 0.00 H new ATOM 0 HD12 LEU A 113 4.995 10.741 -3.543 1.00 0.00 H new ATOM 0 HD13 LEU A 113 4.429 9.065 -3.737 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.978 8.558 -0.732 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.803 7.411 -1.815 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.618 7.988 -0.342 1.00 0.00 H new ATOM 1765 N VAL A 114 9.010 6.571 -1.776 1.00 0.00 N ATOM 1766 CA VAL A 114 9.950 5.588 -2.303 1.00 0.00 C ATOM 1767 C VAL A 114 9.671 5.294 -3.773 1.00 0.00 C ATOM 1768 O VAL A 114 8.560 5.506 -4.259 1.00 0.00 O ATOM 1769 CB VAL A 114 9.890 4.271 -1.507 1.00 0.00 C ATOM 1770 CG1 VAL A 114 10.477 4.461 -0.117 1.00 0.00 C ATOM 1771 CG2 VAL A 114 8.459 3.763 -1.426 1.00 0.00 C ATOM 0 H VAL A 114 8.336 6.195 -1.109 1.00 0.00 H new ATOM 0 HA VAL A 114 10.947 6.018 -2.204 1.00 0.00 H new ATOM 0 HB VAL A 114 10.487 3.523 -2.028 1.00 0.00 H new ATOM 0 HG11 VAL A 114 10.426 3.520 0.431 1.00 0.00 H new ATOM 0 HG12 VAL A 114 11.517 4.776 -0.201 1.00 0.00 H new ATOM 0 HG13 VAL A 114 9.909 5.223 0.417 1.00 0.00 H new ATOM 0 HG21 VAL A 114 8.435 2.832 -0.860 1.00 0.00 H new ATOM 0 HG22 VAL A 114 7.837 4.506 -0.928 1.00 0.00 H new ATOM 0 HG23 VAL A 114 8.078 3.586 -2.432 1.00 0.00 H new ATOM 1781 N SER A 115 10.687 4.804 -4.476 1.00 0.00 N ATOM 1782 CA SER A 115 10.552 4.483 -5.892 1.00 0.00 C ATOM 1783 C SER A 115 11.583 3.440 -6.313 1.00 0.00 C ATOM 1784 O SER A 115 12.461 3.069 -5.535 1.00 0.00 O ATOM 1785 CB SER A 115 10.712 5.746 -6.740 1.00 0.00 C ATOM 1786 OG SER A 115 10.012 5.629 -7.967 1.00 0.00 O ATOM 0 H SER A 115 11.612 4.621 -4.088 1.00 0.00 H new ATOM 0 HA SER A 115 9.556 4.070 -6.053 1.00 0.00 H new ATOM 0 HB2 SER A 115 10.341 6.609 -6.187 1.00 0.00 H new ATOM 0 HB3 SER A 115 11.769 5.924 -6.936 1.00 0.00 H new ATOM 0 HG SER A 115 9.078 5.896 -7.837 1.00 0.00 H new ATOM 1792 N GLY A 116 11.468 2.970 -7.552 1.00 0.00 N ATOM 1793 CA GLY A 116 12.396 1.974 -8.056 1.00 0.00 C ATOM 1794 C GLY A 116 12.208 0.622 -7.399 1.00 0.00 C ATOM 1795 O GLY A 116 11.918 0.538 -6.205 1.00 0.00 O ATOM 0 H GLY A 116 10.749 3.261 -8.215 1.00 0.00 H new ATOM 0 HA2 GLY A 116 12.265 1.872 -9.133 1.00 0.00 H new ATOM 0 HA3 GLY A 116 13.417 2.316 -7.890 1.00 0.00 H new ATOM 1799 N LYS A 117 12.370 -0.441 -8.179 1.00 0.00 N ATOM 1800 CA LYS A 117 12.217 -1.798 -7.667 1.00 0.00 C ATOM 1801 C LYS A 117 12.922 -1.955 -6.323 1.00 0.00 C ATOM 1802 O LYS A 117 13.934 -1.306 -6.063 1.00 0.00 O ATOM 1803 CB LYS A 117 12.776 -2.810 -8.669 1.00 0.00 C ATOM 1804 CG LYS A 117 12.176 -4.199 -8.530 1.00 0.00 C ATOM 1805 CD LYS A 117 12.721 -5.149 -9.583 1.00 0.00 C ATOM 1806 CE LYS A 117 13.968 -5.869 -9.092 1.00 0.00 C ATOM 1807 NZ LYS A 117 14.869 -6.248 -10.215 1.00 0.00 N ATOM 0 H LYS A 117 12.608 -0.389 -9.170 1.00 0.00 H new ATOM 0 HA LYS A 117 11.153 -1.988 -7.524 1.00 0.00 H new ATOM 0 HB2 LYS A 117 12.596 -2.445 -9.680 1.00 0.00 H new ATOM 0 HB3 LYS A 117 13.857 -2.876 -8.542 1.00 0.00 H new ATOM 0 HG2 LYS A 117 12.393 -4.592 -7.537 1.00 0.00 H new ATOM 0 HG3 LYS A 117 11.091 -4.139 -8.619 1.00 0.00 H new ATOM 0 HD2 LYS A 117 11.957 -5.881 -9.845 1.00 0.00 H new ATOM 0 HD3 LYS A 117 12.954 -4.593 -10.491 1.00 0.00 H new ATOM 0 HE2 LYS A 117 14.507 -5.227 -8.395 1.00 0.00 H new ATOM 0 HE3 LYS A 117 13.677 -6.764 -8.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 15.707 -6.736 -9.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 14.363 -6.881 -10.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 15.167 -5.392 -10.725 1.00 0.00 H new ATOM 1821 N MET A 118 12.380 -2.822 -5.474 1.00 0.00 N ATOM 1822 CA MET A 118 12.959 -3.066 -4.158 1.00 0.00 C ATOM 1823 C MET A 118 12.489 -4.404 -3.596 1.00 0.00 C ATOM 1824 O MET A 118 11.370 -4.841 -3.864 1.00 0.00 O ATOM 1825 CB MET A 118 12.587 -1.936 -3.196 1.00 0.00 C ATOM 1826 CG MET A 118 12.966 -2.219 -1.751 1.00 0.00 C ATOM 1827 SD MET A 118 13.152 -0.715 -0.775 1.00 0.00 S ATOM 1828 CE MET A 118 11.443 -0.203 -0.613 1.00 0.00 C ATOM 0 H MET A 118 11.541 -3.367 -5.674 1.00 0.00 H new ATOM 0 HA MET A 118 14.043 -3.099 -4.266 1.00 0.00 H new ATOM 0 HB2 MET A 118 13.079 -1.018 -3.519 1.00 0.00 H new ATOM 0 HB3 MET A 118 11.513 -1.760 -3.254 1.00 0.00 H new ATOM 0 HG2 MET A 118 12.203 -2.851 -1.296 1.00 0.00 H new ATOM 0 HG3 MET A 118 13.900 -2.781 -1.728 1.00 0.00 H new ATOM 0 HE1 MET A 118 11.355 0.521 0.197 1.00 0.00 H new ATOM 0 HE2 MET A 118 11.110 0.253 -1.545 1.00 0.00 H new ATOM 0 HE3 MET A 118 10.822 -1.071 -0.392 1.00 0.00 H new ATOM 1838 N ALA A 119 13.351 -5.050 -2.818 1.00 0.00 N ATOM 1839 CA ALA A 119 13.023 -6.337 -2.217 1.00 0.00 C ATOM 1840 C ALA A 119 13.535 -6.420 -0.784 1.00 0.00 C ATOM 1841 O ALA A 119 14.731 -6.269 -0.531 1.00 0.00 O ATOM 1842 CB ALA A 119 13.598 -7.471 -3.053 1.00 0.00 C ATOM 0 H ALA A 119 14.282 -4.703 -2.589 1.00 0.00 H new ATOM 0 HA ALA A 119 11.938 -6.433 -2.192 1.00 0.00 H new ATOM 0 HB1 ALA A 119 13.346 -8.426 -2.593 1.00 0.00 H new ATOM 0 HB2 ALA A 119 13.179 -7.431 -4.058 1.00 0.00 H new ATOM 0 HB3 ALA A 119 14.682 -7.370 -3.107 1.00 0.00 H new ATOM 1848 N LEU A 120 12.623 -6.662 0.152 1.00 0.00 N ATOM 1849 CA LEU A 120 12.983 -6.765 1.562 1.00 0.00 C ATOM 1850 C LEU A 120 12.355 -8.003 2.195 1.00 0.00 C ATOM 1851 O LEU A 120 11.334 -8.503 1.724 1.00 0.00 O ATOM 1852 CB LEU A 120 12.536 -5.511 2.316 1.00 0.00 C ATOM 1853 CG LEU A 120 11.047 -5.173 2.234 1.00 0.00 C ATOM 1854 CD1 LEU A 120 10.271 -5.916 3.310 1.00 0.00 C ATOM 1855 CD2 LEU A 120 10.833 -3.672 2.360 1.00 0.00 C ATOM 0 H LEU A 120 11.630 -6.790 -0.040 1.00 0.00 H new ATOM 0 HA LEU A 120 14.067 -6.855 1.629 1.00 0.00 H new ATOM 0 HB2 LEU A 120 12.804 -5.628 3.366 1.00 0.00 H new ATOM 0 HB3 LEU A 120 13.102 -4.661 1.935 1.00 0.00 H new ATOM 0 HG LEU A 120 10.675 -5.492 1.261 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.213 -5.663 3.236 1.00 0.00 H new ATOM 0 HD12 LEU A 120 10.398 -6.990 3.174 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.645 -5.628 4.293 1.00 0.00 H new ATOM 0 HD21 LEU A 120 9.768 -3.450 2.299 1.00 0.00 H new ATOM 0 HD22 LEU A 120 11.221 -3.328 3.319 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.357 -3.161 1.552 1.00 0.00 H new ATOM 1867 N ASN A 121 12.972 -8.491 3.266 1.00 0.00 N ATOM 1868 CA ASN A 121 12.473 -9.670 3.965 1.00 0.00 C ATOM 1869 C ASN A 121 11.249 -9.325 4.808 1.00 0.00 C ATOM 1870 O ASN A 121 11.091 -8.189 5.258 1.00 0.00 O ATOM 1871 CB ASN A 121 13.568 -10.263 4.854 1.00 0.00 C ATOM 1872 CG ASN A 121 14.704 -10.863 4.049 1.00 0.00 C ATOM 1873 OD1 ASN A 121 15.589 -10.149 3.576 1.00 0.00 O ATOM 1874 ND2 ASN A 121 14.686 -12.181 3.891 1.00 0.00 N ATOM 0 H ASN A 121 13.818 -8.089 3.669 1.00 0.00 H new ATOM 0 HA ASN A 121 12.181 -10.408 3.218 1.00 0.00 H new ATOM 0 HB2 ASN A 121 13.961 -9.485 5.509 1.00 0.00 H new ATOM 0 HB3 ASN A 121 13.135 -11.031 5.495 1.00 0.00 H new ATOM 0 HD21 ASN A 121 15.425 -12.641 3.360 1.00 0.00 H new ATOM 0 HD22 ASN A 121 13.933 -12.734 4.301 1.00 0.00 H new ATOM 1881 N LEU A 122 10.385 -10.312 5.018 1.00 0.00 N ATOM 1882 CA LEU A 122 9.174 -10.114 5.807 1.00 0.00 C ATOM 1883 C LEU A 122 9.204 -10.966 7.072 1.00 0.00 C ATOM 1884 O LEU A 122 9.783 -12.052 7.087 1.00 0.00 O ATOM 1885 CB LEU A 122 7.937 -10.458 4.976 1.00 0.00 C ATOM 1886 CG LEU A 122 7.961 -10.001 3.517 1.00 0.00 C ATOM 1887 CD1 LEU A 122 6.807 -10.621 2.744 1.00 0.00 C ATOM 1888 CD2 LEU A 122 7.907 -8.483 3.432 1.00 0.00 C ATOM 0 H LEU A 122 10.500 -11.257 4.653 1.00 0.00 H new ATOM 0 HA LEU A 122 9.127 -9.065 6.098 1.00 0.00 H new ATOM 0 HB2 LEU A 122 7.800 -11.539 4.995 1.00 0.00 H new ATOM 0 HB3 LEU A 122 7.065 -10.018 5.460 1.00 0.00 H new ATOM 0 HG LEU A 122 8.895 -10.337 3.067 1.00 0.00 H new ATOM 0 HD11 LEU A 122 6.841 -10.284 1.708 1.00 0.00 H new ATOM 0 HD12 LEU A 122 6.890 -11.707 2.775 1.00 0.00 H new ATOM 0 HD13 LEU A 122 5.862 -10.316 3.194 1.00 0.00 H new ATOM 0 HD21 LEU A 122 7.925 -8.176 2.386 1.00 0.00 H new ATOM 0 HD22 LEU A 122 6.990 -8.125 3.899 1.00 0.00 H new ATOM 0 HD23 LEU A 122 8.768 -8.059 3.949 1.00 0.00 H new ATOM 1900 N TRP A 123 8.575 -10.467 8.130 1.00 0.00 N ATOM 1901 CA TRP A 123 8.527 -11.184 9.399 1.00 0.00 C ATOM 1902 C TRP A 123 7.486 -12.297 9.357 1.00 0.00 C ATOM 1903 O TRP A 123 6.454 -12.189 8.695 1.00 0.00 O ATOM 1904 CB TRP A 123 8.213 -10.217 10.542 1.00 0.00 C ATOM 1905 CG TRP A 123 9.054 -8.977 10.520 1.00 0.00 C ATOM 1906 CD1 TRP A 123 8.873 -7.878 9.731 1.00 0.00 C ATOM 1907 CD2 TRP A 123 10.210 -8.711 11.323 1.00 0.00 C ATOM 1908 NE1 TRP A 123 9.846 -6.944 9.994 1.00 0.00 N ATOM 1909 CE2 TRP A 123 10.678 -7.431 10.967 1.00 0.00 C ATOM 1910 CE3 TRP A 123 10.893 -9.429 12.308 1.00 0.00 C ATOM 1911 CZ2 TRP A 123 11.798 -6.857 11.562 1.00 0.00 C ATOM 1912 CZ3 TRP A 123 12.005 -8.857 12.898 1.00 0.00 C ATOM 1913 CH2 TRP A 123 12.448 -7.582 12.524 1.00 0.00 C ATOM 0 H TRP A 123 8.091 -9.569 8.134 1.00 0.00 H new ATOM 0 HA TRP A 123 9.505 -11.634 9.571 1.00 0.00 H new ATOM 0 HB2 TRP A 123 7.161 -9.935 10.491 1.00 0.00 H new ATOM 0 HB3 TRP A 123 8.360 -10.730 11.493 1.00 0.00 H new ATOM 0 HD1 TRP A 123 8.081 -7.760 9.006 1.00 0.00 H new ATOM 0 HE1 TRP A 123 9.934 -6.036 9.539 1.00 0.00 H new ATOM 0 HE3 TRP A 123 10.559 -10.413 12.603 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 12.142 -5.874 11.275 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 12.541 -9.403 13.660 1.00 0.00 H new ATOM 0 HH2 TRP A 123 13.320 -7.163 13.004 1.00 0.00 H new ATOM 1924 N PRO A 124 7.760 -13.393 10.080 1.00 0.00 N ATOM 1925 CA PRO A 124 6.858 -14.547 10.141 1.00 0.00 C ATOM 1926 C PRO A 124 5.577 -14.241 10.910 1.00 0.00 C ATOM 1927 O PRO A 124 5.436 -13.169 11.500 1.00 0.00 O ATOM 1928 CB PRO A 124 7.684 -15.604 10.878 1.00 0.00 C ATOM 1929 CG PRO A 124 8.658 -14.824 11.692 1.00 0.00 C ATOM 1930 CD PRO A 124 8.972 -13.590 10.893 1.00 0.00 C ATOM 0 HA PRO A 124 6.527 -14.859 9.150 1.00 0.00 H new ATOM 0 HB2 PRO A 124 7.053 -16.230 11.509 1.00 0.00 H new ATOM 0 HB3 PRO A 124 8.194 -16.267 10.179 1.00 0.00 H new ATOM 0 HG2 PRO A 124 8.235 -14.563 12.662 1.00 0.00 H new ATOM 0 HG3 PRO A 124 9.560 -15.405 11.883 1.00 0.00 H new ATOM 0 HD2 PRO A 124 9.167 -12.733 11.537 1.00 0.00 H new ATOM 0 HD3 PRO A 124 9.856 -13.729 10.270 1.00 0.00 H new ATOM 1938 N VAL A 125 4.646 -15.189 10.901 1.00 0.00 N ATOM 1939 CA VAL A 125 3.377 -15.022 11.599 1.00 0.00 C ATOM 1940 C VAL A 125 3.477 -15.501 13.043 1.00 0.00 C ATOM 1941 O VAL A 125 4.007 -16.574 13.331 1.00 0.00 O ATOM 1942 CB VAL A 125 2.242 -15.787 10.892 1.00 0.00 C ATOM 1943 CG1 VAL A 125 0.942 -15.652 11.671 1.00 0.00 C ATOM 1944 CG2 VAL A 125 2.073 -15.288 9.465 1.00 0.00 C ATOM 0 H VAL A 125 4.747 -16.082 10.418 1.00 0.00 H new ATOM 0 HA VAL A 125 3.148 -13.956 11.588 1.00 0.00 H new ATOM 0 HB VAL A 125 2.507 -16.844 10.854 1.00 0.00 H new ATOM 0 HG11 VAL A 125 0.151 -16.199 11.157 1.00 0.00 H new ATOM 0 HG12 VAL A 125 1.074 -16.061 12.673 1.00 0.00 H new ATOM 0 HG13 VAL A 125 0.668 -14.599 11.742 1.00 0.00 H new ATOM 0 HG21 VAL A 125 1.267 -15.839 8.980 1.00 0.00 H new ATOM 0 HG22 VAL A 125 1.830 -14.226 9.477 1.00 0.00 H new ATOM 0 HG23 VAL A 125 3.001 -15.441 8.914 1.00 0.00 H new ATOM 2039 N LEU A 132 -5.663 -11.385 8.511 1.00 0.00 N ATOM 2040 CA LEU A 132 -4.705 -11.805 7.493 1.00 0.00 C ATOM 2041 C LEU A 132 -3.532 -10.833 7.416 1.00 0.00 C ATOM 2042 O LEU A 132 -2.371 -11.243 7.422 1.00 0.00 O ATOM 2043 CB LEU A 132 -5.391 -11.903 6.129 1.00 0.00 C ATOM 2044 CG LEU A 132 -6.687 -12.713 6.087 1.00 0.00 C ATOM 2045 CD1 LEU A 132 -7.399 -12.512 4.758 1.00 0.00 C ATOM 2046 CD2 LEU A 132 -6.403 -14.189 6.324 1.00 0.00 C ATOM 0 HA LEU A 132 -4.322 -12.787 7.772 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -5.606 -10.893 5.779 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -4.688 -12.343 5.422 1.00 0.00 H new ATOM 0 HG LEU A 132 -7.340 -12.358 6.884 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -8.319 -13.096 4.746 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -7.638 -11.456 4.629 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -6.751 -12.839 3.945 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -7.337 -14.749 6.290 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -5.730 -14.559 5.550 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -5.938 -14.318 7.301 1.00 0.00 H new ATOM 2058 N LEU A 133 -3.842 -9.543 7.346 1.00 0.00 N ATOM 2059 CA LEU A 133 -2.814 -8.512 7.271 1.00 0.00 C ATOM 2060 C LEU A 133 -2.524 -7.929 8.651 1.00 0.00 C ATOM 2061 O LEU A 133 -3.441 -7.637 9.417 1.00 0.00 O ATOM 2062 CB LEU A 133 -3.249 -7.399 6.316 1.00 0.00 C ATOM 2063 CG LEU A 133 -2.134 -6.498 5.783 1.00 0.00 C ATOM 2064 CD1 LEU A 133 -1.312 -7.230 4.734 1.00 0.00 C ATOM 2065 CD2 LEU A 133 -2.715 -5.214 5.208 1.00 0.00 C ATOM 0 H LEU A 133 -4.798 -9.186 7.340 1.00 0.00 H new ATOM 0 HA LEU A 133 -1.901 -8.972 6.892 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -3.758 -7.855 5.467 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -3.981 -6.774 6.828 1.00 0.00 H new ATOM 0 HG LEU A 133 -1.477 -6.236 6.612 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -0.524 -6.573 4.366 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -0.866 -8.120 5.177 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -1.957 -7.522 3.905 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -1.907 -4.585 4.833 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -3.395 -5.456 4.391 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -3.259 -4.680 5.987 1.00 0.00 H new ATOM 2077 N ASN A 134 -1.242 -7.762 8.959 1.00 0.00 N ATOM 2078 CA ASN A 134 -0.831 -7.213 10.247 1.00 0.00 C ATOM 2079 C ASN A 134 -0.343 -5.776 10.094 1.00 0.00 C ATOM 2080 O ASN A 134 0.834 -5.517 9.842 1.00 0.00 O ATOM 2081 CB ASN A 134 0.272 -8.075 10.864 1.00 0.00 C ATOM 2082 CG ASN A 134 0.341 -7.933 12.372 1.00 0.00 C ATOM 2083 OD1 ASN A 134 1.489 -7.492 12.872 1.00 0.00 O flip ATOM 2084 ND2 ASN A 134 -0.627 -8.215 13.079 1.00 0.00 N flip ATOM 0 H ASN A 134 -0.470 -7.999 8.335 1.00 0.00 H new ATOM 0 HA ASN A 134 -1.697 -7.216 10.908 1.00 0.00 H new ATOM 0 HB2 ASN A 134 0.099 -9.120 10.608 1.00 0.00 H new ATOM 0 HB3 ASN A 134 1.233 -7.796 10.431 1.00 0.00 H new ATOM 0 HD21 ASN A 134 -1.490 -8.551 12.652 1.00 0.00 H new ATOM 0 HD22 ASN A 134 -0.566 -8.113 14.092 1.00 0.00 H new ATOM 2091 N PRO A 135 -1.268 -4.817 10.250 1.00 0.00 N ATOM 2092 CA PRO A 135 -0.955 -3.389 10.135 1.00 0.00 C ATOM 2093 C PRO A 135 -0.099 -2.888 11.293 1.00 0.00 C ATOM 2094 O PRO A 135 0.736 -1.999 11.120 1.00 0.00 O ATOM 2095 CB PRO A 135 -2.332 -2.721 10.160 1.00 0.00 C ATOM 2096 CG PRO A 135 -3.206 -3.682 10.891 1.00 0.00 C ATOM 2097 CD PRO A 135 -2.690 -5.052 10.551 1.00 0.00 C ATOM 0 HA PRO A 135 -0.376 -3.170 9.238 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -2.295 -1.756 10.666 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -2.702 -2.538 9.151 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -3.166 -3.506 11.966 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -4.247 -3.571 10.588 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -2.815 -5.746 11.382 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -3.216 -5.479 9.697 1.00 0.00 H new ATOM 2105 N ILE A 136 -0.311 -3.464 12.471 1.00 0.00 N ATOM 2106 CA ILE A 136 0.443 -3.076 13.657 1.00 0.00 C ATOM 2107 C ILE A 136 1.867 -3.619 13.605 1.00 0.00 C ATOM 2108 O ILE A 136 2.761 -3.114 14.283 1.00 0.00 O ATOM 2109 CB ILE A 136 -0.238 -3.574 14.945 1.00 0.00 C ATOM 2110 CG1 ILE A 136 -1.738 -3.273 14.904 1.00 0.00 C ATOM 2111 CG2 ILE A 136 0.404 -2.932 16.166 1.00 0.00 C ATOM 2112 CD1 ILE A 136 -2.075 -1.837 15.236 1.00 0.00 C ATOM 0 H ILE A 136 -0.998 -4.201 12.630 1.00 0.00 H new ATOM 0 HA ILE A 136 0.473 -1.986 13.670 1.00 0.00 H new ATOM 0 HB ILE A 136 -0.105 -4.654 15.015 1.00 0.00 H new ATOM 0 HG12 ILE A 136 -2.120 -3.507 13.910 1.00 0.00 H new ATOM 0 HG13 ILE A 136 -2.252 -3.930 15.606 1.00 0.00 H new ATOM 0 HG21 ILE A 136 -0.088 -3.294 17.069 1.00 0.00 H new ATOM 0 HG22 ILE A 136 1.462 -3.193 16.200 1.00 0.00 H new ATOM 0 HG23 ILE A 136 0.299 -1.849 16.105 1.00 0.00 H new ATOM 0 HD11 ILE A 136 -3.155 -1.696 15.188 1.00 0.00 H new ATOM 0 HD12 ILE A 136 -1.723 -1.604 16.241 1.00 0.00 H new ATOM 0 HD13 ILE A 136 -1.590 -1.174 14.519 1.00 0.00 H new ATOM 2124 N GLY A 137 2.071 -4.653 12.794 1.00 0.00 N ATOM 2125 CA GLY A 137 3.389 -5.247 12.666 1.00 0.00 C ATOM 2126 C GLY A 137 4.488 -4.207 12.579 1.00 0.00 C ATOM 2127 O GLY A 137 4.252 -3.078 12.148 1.00 0.00 O ATOM 0 H GLY A 137 1.347 -5.090 12.223 1.00 0.00 H new ATOM 0 HA2 GLY A 137 3.575 -5.897 13.521 1.00 0.00 H new ATOM 0 HA3 GLY A 137 3.416 -5.875 11.776 1.00 0.00 H new ATOM 2131 N VAL A 138 5.694 -4.586 12.991 1.00 0.00 N ATOM 2132 CA VAL A 138 6.834 -3.678 12.958 1.00 0.00 C ATOM 2133 C VAL A 138 7.164 -3.262 11.529 1.00 0.00 C ATOM 2134 O VAL A 138 6.804 -3.948 10.572 1.00 0.00 O ATOM 2135 CB VAL A 138 8.081 -4.319 13.596 1.00 0.00 C ATOM 2136 CG1 VAL A 138 7.745 -4.894 14.964 1.00 0.00 C ATOM 2137 CG2 VAL A 138 8.654 -5.392 12.683 1.00 0.00 C ATOM 0 H VAL A 138 5.906 -5.516 13.352 1.00 0.00 H new ATOM 0 HA VAL A 138 6.553 -2.796 13.534 1.00 0.00 H new ATOM 0 HB VAL A 138 8.838 -3.546 13.730 1.00 0.00 H new ATOM 0 HG11 VAL A 138 8.638 -5.343 15.399 1.00 0.00 H new ATOM 0 HG12 VAL A 138 7.385 -4.097 15.615 1.00 0.00 H new ATOM 0 HG13 VAL A 138 6.971 -5.655 14.859 1.00 0.00 H new ATOM 0 HG21 VAL A 138 9.534 -5.834 13.149 1.00 0.00 H new ATOM 0 HG22 VAL A 138 7.905 -6.166 12.516 1.00 0.00 H new ATOM 0 HG23 VAL A 138 8.934 -4.946 11.729 1.00 0.00 H new ATOM 2147 N THR A 139 7.852 -2.133 11.391 1.00 0.00 N ATOM 2148 CA THR A 139 8.231 -1.624 10.079 1.00 0.00 C ATOM 2149 C THR A 139 9.709 -1.870 9.800 1.00 0.00 C ATOM 2150 O THR A 139 10.479 -2.181 10.708 1.00 0.00 O ATOM 2151 CB THR A 139 7.940 -0.116 9.956 1.00 0.00 C ATOM 2152 OG1 THR A 139 8.451 0.576 11.100 1.00 0.00 O ATOM 2153 CG2 THR A 139 6.446 0.138 9.829 1.00 0.00 C ATOM 0 H THR A 139 8.158 -1.553 12.173 1.00 0.00 H new ATOM 0 HA THR A 139 7.631 -2.163 9.345 1.00 0.00 H new ATOM 0 HB THR A 139 8.433 0.255 9.057 1.00 0.00 H new ATOM 0 HG1 THR A 139 8.264 1.534 11.013 1.00 0.00 H new ATOM 0 HG21 THR A 139 6.265 1.209 9.744 1.00 0.00 H new ATOM 0 HG22 THR A 139 6.065 -0.366 8.941 1.00 0.00 H new ATOM 0 HG23 THR A 139 5.935 -0.247 10.712 1.00 0.00 H new ATOM 2161 N GLY A 140 10.100 -1.727 8.538 1.00 0.00 N ATOM 2162 CA GLY A 140 11.486 -1.936 8.162 1.00 0.00 C ATOM 2163 C GLY A 140 11.704 -3.266 7.467 1.00 0.00 C ATOM 2164 O GLY A 140 10.814 -4.116 7.445 1.00 0.00 O ATOM 0 H GLY A 140 9.482 -1.470 7.769 1.00 0.00 H new ATOM 0 HA2 GLY A 140 11.806 -1.129 7.503 1.00 0.00 H new ATOM 0 HA3 GLY A 140 12.112 -1.888 9.053 1.00 0.00 H new ATOM 2168 N SER A 141 12.891 -3.446 6.896 1.00 0.00 N ATOM 2169 CA SER A 141 13.221 -4.679 6.192 1.00 0.00 C ATOM 2170 C SER A 141 13.799 -5.715 7.151 1.00 0.00 C ATOM 2171 O SER A 141 14.965 -5.638 7.535 1.00 0.00 O ATOM 2172 CB SER A 141 14.218 -4.397 5.066 1.00 0.00 C ATOM 2173 OG SER A 141 15.331 -3.661 5.543 1.00 0.00 O ATOM 0 H SER A 141 13.640 -2.753 6.907 1.00 0.00 H new ATOM 0 HA SER A 141 12.303 -5.080 5.763 1.00 0.00 H new ATOM 0 HB2 SER A 141 14.558 -5.338 4.633 1.00 0.00 H new ATOM 0 HB3 SER A 141 13.724 -3.840 4.270 1.00 0.00 H new ATOM 0 HG SER A 141 15.644 -4.050 6.386 1.00 0.00 H new ATOM 2179 N ASN A 142 12.974 -6.683 7.534 1.00 0.00 N ATOM 2180 CA ASN A 142 13.402 -7.735 8.450 1.00 0.00 C ATOM 2181 C ASN A 142 14.867 -8.091 8.222 1.00 0.00 C ATOM 2182 O ASN A 142 15.269 -8.506 7.134 1.00 0.00 O ATOM 2183 CB ASN A 142 12.529 -8.979 8.274 1.00 0.00 C ATOM 2184 CG ASN A 142 12.880 -10.075 9.262 1.00 0.00 C ATOM 2185 OD1 ASN A 142 13.745 -9.900 10.120 1.00 0.00 O ATOM 2186 ND2 ASN A 142 12.208 -11.215 9.144 1.00 0.00 N ATOM 0 H ASN A 142 12.005 -6.762 7.225 1.00 0.00 H new ATOM 0 HA ASN A 142 13.291 -7.363 9.469 1.00 0.00 H new ATOM 0 HB2 ASN A 142 11.481 -8.705 8.397 1.00 0.00 H new ATOM 0 HB3 ASN A 142 12.642 -9.359 7.259 1.00 0.00 H new ATOM 0 HD21 ASN A 142 12.401 -11.989 9.780 1.00 0.00 H new ATOM 0 HD22 ASN A 142 11.499 -11.316 8.418 1.00 0.00 H new ATOM 2193 N PRO A 143 15.687 -7.928 9.271 1.00 0.00 N ATOM 2194 CA PRO A 143 17.120 -8.228 9.210 1.00 0.00 C ATOM 2195 C PRO A 143 17.396 -9.724 9.104 1.00 0.00 C ATOM 2196 O PRO A 143 18.546 -10.147 9.006 1.00 0.00 O ATOM 2197 CB PRO A 143 17.654 -7.678 10.536 1.00 0.00 C ATOM 2198 CG PRO A 143 16.482 -7.704 11.455 1.00 0.00 C ATOM 2199 CD PRO A 143 15.276 -7.438 10.597 1.00 0.00 C ATOM 0 HA PRO A 143 17.591 -7.790 8.330 1.00 0.00 H new ATOM 0 HB2 PRO A 143 18.471 -8.290 10.918 1.00 0.00 H new ATOM 0 HB3 PRO A 143 18.042 -6.666 10.418 1.00 0.00 H new ATOM 0 HG2 PRO A 143 16.400 -8.669 11.955 1.00 0.00 H new ATOM 0 HG3 PRO A 143 16.581 -6.948 12.234 1.00 0.00 H new ATOM 0 HD2 PRO A 143 14.396 -7.966 10.966 1.00 0.00 H new ATOM 0 HD3 PRO A 143 15.025 -6.377 10.574 1.00 0.00 H new ATOM 2207 N ASN A 144 16.331 -10.519 9.123 1.00 0.00 N ATOM 2208 CA ASN A 144 16.459 -11.969 9.029 1.00 0.00 C ATOM 2209 C ASN A 144 16.534 -12.415 7.572 1.00 0.00 C ATOM 2210 O ASN A 144 15.765 -11.953 6.729 1.00 0.00 O ATOM 2211 CB ASN A 144 15.278 -12.652 9.723 1.00 0.00 C ATOM 2212 CG ASN A 144 15.445 -12.704 11.229 1.00 0.00 C ATOM 2213 OD1 ASN A 144 16.117 -13.588 11.761 1.00 0.00 O ATOM 2214 ND2 ASN A 144 14.830 -11.755 11.926 1.00 0.00 N ATOM 0 H ASN A 144 15.371 -10.184 9.203 1.00 0.00 H new ATOM 0 HA ASN A 144 17.383 -12.260 9.528 1.00 0.00 H new ATOM 0 HB2 ASN A 144 14.359 -12.118 9.480 1.00 0.00 H new ATOM 0 HB3 ASN A 144 15.170 -13.666 9.337 1.00 0.00 H new ATOM 0 HD21 ASN A 144 14.905 -11.740 12.943 1.00 0.00 H new ATOM 0 HD22 ASN A 144 14.283 -11.041 11.444 1.00 0.00 H new ATOM 2221 N LYS A 145 17.466 -13.317 7.283 1.00 0.00 N ATOM 2222 CA LYS A 145 17.642 -13.828 5.928 1.00 0.00 C ATOM 2223 C LYS A 145 16.699 -14.996 5.661 1.00 0.00 C ATOM 2224 O LYS A 145 15.987 -15.013 4.658 1.00 0.00 O ATOM 2225 CB LYS A 145 19.092 -14.269 5.712 1.00 0.00 C ATOM 2226 CG LYS A 145 20.112 -13.202 6.071 1.00 0.00 C ATOM 2227 CD LYS A 145 20.042 -12.021 5.118 1.00 0.00 C ATOM 2228 CE LYS A 145 20.607 -10.759 5.753 1.00 0.00 C ATOM 2229 NZ LYS A 145 20.853 -9.693 4.743 1.00 0.00 N ATOM 0 H LYS A 145 18.111 -13.709 7.969 1.00 0.00 H new ATOM 0 HA LYS A 145 17.405 -13.026 5.230 1.00 0.00 H new ATOM 0 HB2 LYS A 145 19.285 -15.160 6.310 1.00 0.00 H new ATOM 0 HB3 LYS A 145 19.226 -14.551 4.668 1.00 0.00 H new ATOM 0 HG2 LYS A 145 19.937 -12.859 7.091 1.00 0.00 H new ATOM 0 HG3 LYS A 145 21.113 -13.632 6.046 1.00 0.00 H new ATOM 0 HD2 LYS A 145 20.597 -12.252 4.209 1.00 0.00 H new ATOM 0 HD3 LYS A 145 19.006 -11.850 4.824 1.00 0.00 H new ATOM 0 HE2 LYS A 145 19.913 -10.390 6.508 1.00 0.00 H new ATOM 0 HE3 LYS A 145 21.539 -10.996 6.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 21.238 -8.850 5.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 21.535 -10.035 4.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 19.959 -9.448 4.272 1.00 0.00 H new ATOM 2243 N GLU A 146 16.699 -15.970 6.566 1.00 0.00 N ATOM 2244 CA GLU A 146 15.842 -17.142 6.427 1.00 0.00 C ATOM 2245 C GLU A 146 14.443 -16.741 5.968 1.00 0.00 C ATOM 2246 O GLU A 146 13.923 -17.271 4.986 1.00 0.00 O ATOM 2247 CB GLU A 146 15.758 -17.900 7.753 1.00 0.00 C ATOM 2248 CG GLU A 146 17.113 -18.298 8.314 1.00 0.00 C ATOM 2249 CD GLU A 146 17.054 -19.571 9.135 1.00 0.00 C ATOM 2250 OE1 GLU A 146 16.296 -19.603 10.127 1.00 0.00 O ATOM 2251 OE2 GLU A 146 17.766 -20.536 8.785 1.00 0.00 O ATOM 0 H GLU A 146 17.282 -15.971 7.403 1.00 0.00 H new ATOM 0 HA GLU A 146 16.281 -17.794 5.672 1.00 0.00 H new ATOM 0 HB2 GLU A 146 15.240 -17.280 8.484 1.00 0.00 H new ATOM 0 HB3 GLU A 146 15.155 -18.797 7.611 1.00 0.00 H new ATOM 0 HG2 GLU A 146 17.817 -18.432 7.493 1.00 0.00 H new ATOM 0 HG3 GLU A 146 17.497 -17.488 8.934 1.00 0.00 H new ATOM 2258 N THR A 147 13.837 -15.801 6.687 1.00 0.00 N ATOM 2259 CA THR A 147 12.498 -15.329 6.356 1.00 0.00 C ATOM 2260 C THR A 147 12.383 -15.000 4.872 1.00 0.00 C ATOM 2261 O THR A 147 13.351 -14.610 4.221 1.00 0.00 O ATOM 2262 CB THR A 147 12.123 -14.082 7.178 1.00 0.00 C ATOM 2263 OG1 THR A 147 12.956 -12.979 6.803 1.00 0.00 O ATOM 2264 CG2 THR A 147 12.270 -14.351 8.668 1.00 0.00 C ATOM 0 H THR A 147 14.253 -15.351 7.503 1.00 0.00 H new ATOM 0 HA THR A 147 11.808 -16.137 6.601 1.00 0.00 H new ATOM 0 HB THR A 147 11.081 -13.837 6.970 1.00 0.00 H new ATOM 0 HG1 THR A 147 13.885 -13.171 7.051 1.00 0.00 H new ATOM 0 HG21 THR A 147 12.000 -13.456 9.228 1.00 0.00 H new ATOM 0 HG22 THR A 147 11.613 -15.171 8.956 1.00 0.00 H new ATOM 0 HG23 THR A 147 13.303 -14.619 8.889 1.00 0.00 H new ATOM 2272 N PRO A 148 11.169 -15.159 4.323 1.00 0.00 N ATOM 2273 CA PRO A 148 10.898 -14.883 2.909 1.00 0.00 C ATOM 2274 C PRO A 148 10.955 -13.393 2.589 1.00 0.00 C ATOM 2275 O PRO A 148 10.819 -12.552 3.477 1.00 0.00 O ATOM 2276 CB PRO A 148 9.478 -15.419 2.710 1.00 0.00 C ATOM 2277 CG PRO A 148 8.857 -15.360 4.062 1.00 0.00 C ATOM 2278 CD PRO A 148 9.969 -15.621 5.040 1.00 0.00 C ATOM 0 HA PRO A 148 11.638 -15.343 2.254 1.00 0.00 H new ATOM 0 HB2 PRO A 148 8.923 -14.814 1.993 1.00 0.00 H new ATOM 0 HB3 PRO A 148 9.490 -16.438 2.324 1.00 0.00 H new ATOM 0 HG2 PRO A 148 8.401 -14.386 4.240 1.00 0.00 H new ATOM 0 HG3 PRO A 148 8.067 -16.104 4.161 1.00 0.00 H new ATOM 0 HD2 PRO A 148 9.822 -15.074 5.971 1.00 0.00 H new ATOM 0 HD3 PRO A 148 10.037 -16.678 5.298 1.00 0.00 H new ATOM 2286 N CYS A 149 11.157 -13.075 1.315 1.00 0.00 N ATOM 2287 CA CYS A 149 11.233 -11.686 0.877 1.00 0.00 C ATOM 2288 C CYS A 149 10.424 -11.473 -0.399 1.00 0.00 C ATOM 2289 O CYS A 149 10.452 -12.302 -1.310 1.00 0.00 O ATOM 2290 CB CYS A 149 12.689 -11.281 0.646 1.00 0.00 C ATOM 2291 SG CYS A 149 12.889 -9.727 -0.257 1.00 0.00 S ATOM 0 H CYS A 149 11.271 -13.760 0.568 1.00 0.00 H new ATOM 0 HA CYS A 149 10.810 -11.060 1.662 1.00 0.00 H new ATOM 0 HB2 CYS A 149 13.188 -11.195 1.611 1.00 0.00 H new ATOM 0 HB3 CYS A 149 13.193 -12.076 0.096 1.00 0.00 H new ATOM 0 HG CYS A 149 11.967 -8.888 0.113 1.00 0.00 H new ATOM 2297 N LEU A 150 9.704 -10.358 -0.457 1.00 0.00 N ATOM 2298 CA LEU A 150 8.885 -10.037 -1.621 1.00 0.00 C ATOM 2299 C LEU A 150 9.485 -8.873 -2.404 1.00 0.00 C ATOM 2300 O LEU A 150 10.013 -7.927 -1.821 1.00 0.00 O ATOM 2301 CB LEU A 150 7.459 -9.693 -1.187 1.00 0.00 C ATOM 2302 CG LEU A 150 6.465 -10.854 -1.170 1.00 0.00 C ATOM 2303 CD1 LEU A 150 5.277 -10.526 -0.279 1.00 0.00 C ATOM 2304 CD2 LEU A 150 6.000 -11.180 -2.582 1.00 0.00 C ATOM 0 H LEU A 150 9.671 -9.662 0.288 1.00 0.00 H new ATOM 0 HA LEU A 150 8.859 -10.913 -2.269 1.00 0.00 H new ATOM 0 HB2 LEU A 150 7.499 -9.260 -0.187 1.00 0.00 H new ATOM 0 HB3 LEU A 150 7.074 -8.921 -1.853 1.00 0.00 H new ATOM 0 HG LEU A 150 6.968 -11.731 -0.763 1.00 0.00 H new ATOM 0 HD11 LEU A 150 4.580 -11.364 -0.279 1.00 0.00 H new ATOM 0 HD12 LEU A 150 5.624 -10.343 0.738 1.00 0.00 H new ATOM 0 HD13 LEU A 150 4.774 -9.636 -0.656 1.00 0.00 H new ATOM 0 HD21 LEU A 150 5.293 -12.009 -2.550 1.00 0.00 H new ATOM 0 HD22 LEU A 150 5.515 -10.306 -3.016 1.00 0.00 H new ATOM 0 HD23 LEU A 150 6.859 -11.459 -3.193 1.00 0.00 H new ATOM 2316 N GLU A 151 9.399 -8.951 -3.729 1.00 0.00 N ATOM 2317 CA GLU A 151 9.932 -7.903 -4.591 1.00 0.00 C ATOM 2318 C GLU A 151 8.805 -7.128 -5.267 1.00 0.00 C ATOM 2319 O GLU A 151 7.962 -7.709 -5.952 1.00 0.00 O ATOM 2320 CB GLU A 151 10.859 -8.505 -5.649 1.00 0.00 C ATOM 2321 CG GLU A 151 11.837 -7.504 -6.242 1.00 0.00 C ATOM 2322 CD GLU A 151 13.098 -8.162 -6.768 1.00 0.00 C ATOM 2323 OE1 GLU A 151 12.998 -8.946 -7.734 1.00 0.00 O ATOM 2324 OE2 GLU A 151 14.184 -7.893 -6.213 1.00 0.00 O ATOM 0 H GLU A 151 8.966 -9.728 -4.228 1.00 0.00 H new ATOM 0 HA GLU A 151 10.502 -7.212 -3.970 1.00 0.00 H new ATOM 0 HB2 GLU A 151 11.419 -9.327 -5.204 1.00 0.00 H new ATOM 0 HB3 GLU A 151 10.254 -8.928 -6.451 1.00 0.00 H new ATOM 0 HG2 GLU A 151 11.350 -6.962 -7.052 1.00 0.00 H new ATOM 0 HG3 GLU A 151 12.105 -6.769 -5.482 1.00 0.00 H new ATOM 2331 N LEU A 152 8.796 -5.815 -5.070 1.00 0.00 N ATOM 2332 CA LEU A 152 7.773 -4.959 -5.661 1.00 0.00 C ATOM 2333 C LEU A 152 8.403 -3.756 -6.355 1.00 0.00 C ATOM 2334 O LEU A 152 9.572 -3.443 -6.136 1.00 0.00 O ATOM 2335 CB LEU A 152 6.793 -4.486 -4.585 1.00 0.00 C ATOM 2336 CG LEU A 152 7.335 -3.460 -3.588 1.00 0.00 C ATOM 2337 CD1 LEU A 152 8.625 -3.960 -2.957 1.00 0.00 C ATOM 2338 CD2 LEU A 152 7.557 -2.119 -4.271 1.00 0.00 C ATOM 0 H LEU A 152 9.486 -5.319 -4.505 1.00 0.00 H new ATOM 0 HA LEU A 152 7.232 -5.542 -6.406 1.00 0.00 H new ATOM 0 HB2 LEU A 152 5.921 -4.057 -5.079 1.00 0.00 H new ATOM 0 HB3 LEU A 152 6.448 -5.357 -4.028 1.00 0.00 H new ATOM 0 HG LEU A 152 6.597 -3.324 -2.797 1.00 0.00 H new ATOM 0 HD11 LEU A 152 8.996 -3.217 -2.251 1.00 0.00 H new ATOM 0 HD12 LEU A 152 8.434 -4.896 -2.433 1.00 0.00 H new ATOM 0 HD13 LEU A 152 9.370 -4.125 -3.735 1.00 0.00 H new ATOM 0 HD21 LEU A 152 7.943 -1.401 -3.547 1.00 0.00 H new ATOM 0 HD22 LEU A 152 8.276 -2.238 -5.082 1.00 0.00 H new ATOM 0 HD23 LEU A 152 6.612 -1.755 -4.674 1.00 0.00 H new ATOM 2350 N GLU A 153 7.618 -3.085 -7.193 1.00 0.00 N ATOM 2351 CA GLU A 153 8.100 -1.915 -7.918 1.00 0.00 C ATOM 2352 C GLU A 153 7.215 -0.702 -7.644 1.00 0.00 C ATOM 2353 O GLU A 153 6.026 -0.702 -7.963 1.00 0.00 O ATOM 2354 CB GLU A 153 8.140 -2.201 -9.421 1.00 0.00 C ATOM 2355 CG GLU A 153 9.273 -3.125 -9.835 1.00 0.00 C ATOM 2356 CD GLU A 153 9.231 -3.476 -11.309 1.00 0.00 C ATOM 2357 OE1 GLU A 153 8.148 -3.858 -11.798 1.00 0.00 O ATOM 2358 OE2 GLU A 153 10.283 -3.368 -11.974 1.00 0.00 O ATOM 0 H GLU A 153 6.647 -3.331 -7.386 1.00 0.00 H new ATOM 0 HA GLU A 153 9.109 -1.693 -7.570 1.00 0.00 H new ATOM 0 HB2 GLU A 153 7.192 -2.645 -9.723 1.00 0.00 H new ATOM 0 HB3 GLU A 153 8.236 -1.258 -9.959 1.00 0.00 H new ATOM 0 HG2 GLU A 153 10.227 -2.650 -9.606 1.00 0.00 H new ATOM 0 HG3 GLU A 153 9.224 -4.041 -9.246 1.00 0.00 H new ATOM 2365 N PHE A 154 7.805 0.329 -7.049 1.00 0.00 N ATOM 2366 CA PHE A 154 7.071 1.549 -6.729 1.00 0.00 C ATOM 2367 C PHE A 154 6.980 2.463 -7.947 1.00 0.00 C ATOM 2368 O PHE A 154 7.952 3.122 -8.317 1.00 0.00 O ATOM 2369 CB PHE A 154 7.747 2.287 -5.572 1.00 0.00 C ATOM 2370 CG PHE A 154 7.435 1.703 -4.224 1.00 0.00 C ATOM 2371 CD1 PHE A 154 6.133 1.676 -3.750 1.00 0.00 C ATOM 2372 CD2 PHE A 154 8.443 1.180 -3.431 1.00 0.00 C ATOM 2373 CE1 PHE A 154 5.842 1.139 -2.510 1.00 0.00 C ATOM 2374 CE2 PHE A 154 8.158 0.641 -2.190 1.00 0.00 C ATOM 2375 CZ PHE A 154 6.857 0.621 -1.729 1.00 0.00 C ATOM 0 H PHE A 154 8.788 0.345 -6.779 1.00 0.00 H new ATOM 0 HA PHE A 154 6.061 1.269 -6.431 1.00 0.00 H new ATOM 0 HB2 PHE A 154 8.826 2.273 -5.724 1.00 0.00 H new ATOM 0 HB3 PHE A 154 7.436 3.332 -5.587 1.00 0.00 H new ATOM 0 HD1 PHE A 154 5.336 2.079 -4.357 1.00 0.00 H new ATOM 0 HD2 PHE A 154 9.463 1.193 -3.786 1.00 0.00 H new ATOM 0 HE1 PHE A 154 4.823 1.124 -2.152 1.00 0.00 H new ATOM 0 HE2 PHE A 154 8.953 0.236 -1.582 1.00 0.00 H new ATOM 0 HZ PHE A 154 6.633 0.201 -0.759 1.00 0.00 H new ATOM 2385 N ASP A 155 5.805 2.498 -8.566 1.00 0.00 N ATOM 2386 CA ASP A 155 5.585 3.332 -9.742 1.00 0.00 C ATOM 2387 C ASP A 155 4.611 4.464 -9.431 1.00 0.00 C ATOM 2388 O ASP A 155 3.661 4.287 -8.668 1.00 0.00 O ATOM 2389 CB ASP A 155 5.052 2.487 -10.900 1.00 0.00 C ATOM 2390 CG ASP A 155 5.470 3.029 -12.253 1.00 0.00 C ATOM 2391 OD1 ASP A 155 4.829 3.987 -12.732 1.00 0.00 O ATOM 2392 OD2 ASP A 155 6.439 2.494 -12.833 1.00 0.00 O ATOM 0 H ASP A 155 4.990 1.959 -8.273 1.00 0.00 H new ATOM 0 HA ASP A 155 6.541 3.769 -10.031 1.00 0.00 H new ATOM 0 HB2 ASP A 155 5.412 1.464 -10.795 1.00 0.00 H new ATOM 0 HB3 ASP A 155 3.964 2.449 -10.847 1.00 0.00 H new ATOM 2397 N TRP A 156 4.854 5.627 -10.025 1.00 0.00 N ATOM 2398 CA TRP A 156 3.999 6.788 -9.811 1.00 0.00 C ATOM 2399 C TRP A 156 3.679 7.481 -11.131 1.00 0.00 C ATOM 2400 O TRP A 156 4.383 8.401 -11.547 1.00 0.00 O ATOM 2401 CB TRP A 156 4.672 7.774 -8.854 1.00 0.00 C ATOM 2402 CG TRP A 156 5.309 7.111 -7.670 1.00 0.00 C ATOM 2403 CD1 TRP A 156 6.570 6.591 -7.601 1.00 0.00 C ATOM 2404 CD2 TRP A 156 4.713 6.895 -6.386 1.00 0.00 C ATOM 2405 NE1 TRP A 156 6.794 6.066 -6.352 1.00 0.00 N ATOM 2406 CE2 TRP A 156 5.671 6.240 -5.587 1.00 0.00 C ATOM 2407 CE3 TRP A 156 3.466 7.193 -5.832 1.00 0.00 C ATOM 2408 CZ2 TRP A 156 5.418 5.879 -4.267 1.00 0.00 C ATOM 2409 CZ3 TRP A 156 3.215 6.833 -4.522 1.00 0.00 C ATOM 2410 CH2 TRP A 156 4.187 6.183 -3.751 1.00 0.00 C ATOM 0 H TRP A 156 5.636 5.791 -10.659 1.00 0.00 H new ATOM 0 HA TRP A 156 3.065 6.442 -9.368 1.00 0.00 H new ATOM 0 HB2 TRP A 156 5.430 8.337 -9.398 1.00 0.00 H new ATOM 0 HB3 TRP A 156 3.931 8.493 -8.504 1.00 0.00 H new ATOM 0 HD1 TRP A 156 7.286 6.592 -8.410 1.00 0.00 H new ATOM 0 HE1 TRP A 156 7.657 5.619 -6.044 1.00 0.00 H new ATOM 0 HE3 TRP A 156 2.711 7.696 -6.418 1.00 0.00 H new ATOM 0 HZ2 TRP A 156 6.166 5.377 -3.671 1.00 0.00 H new ATOM 0 HZ3 TRP A 156 2.253 7.057 -4.085 1.00 0.00 H new ATOM 0 HH2 TRP A 156 3.961 5.916 -2.729 1.00 0.00 H new ATOM 2421 N PHE A 157 2.613 7.033 -11.786 1.00 0.00 N ATOM 2422 CA PHE A 157 2.201 7.609 -13.061 1.00 0.00 C ATOM 2423 C PHE A 157 1.227 8.764 -12.845 1.00 0.00 C ATOM 2424 O PHE A 157 1.314 9.796 -13.511 1.00 0.00 O ATOM 2425 CB PHE A 157 1.555 6.540 -13.943 1.00 0.00 C ATOM 2426 CG PHE A 157 0.149 6.199 -13.540 1.00 0.00 C ATOM 2427 CD1 PHE A 157 -0.910 7.008 -13.918 1.00 0.00 C ATOM 2428 CD2 PHE A 157 -0.114 5.068 -12.782 1.00 0.00 C ATOM 2429 CE1 PHE A 157 -2.205 6.697 -13.547 1.00 0.00 C ATOM 2430 CE2 PHE A 157 -1.407 4.752 -12.409 1.00 0.00 C ATOM 2431 CZ PHE A 157 -2.454 5.567 -12.793 1.00 0.00 C ATOM 0 H PHE A 157 2.019 6.273 -11.455 1.00 0.00 H new ATOM 0 HA PHE A 157 3.089 7.994 -13.562 1.00 0.00 H new ATOM 0 HB2 PHE A 157 1.554 6.885 -14.977 1.00 0.00 H new ATOM 0 HB3 PHE A 157 2.163 5.636 -13.909 1.00 0.00 H new ATOM 0 HD1 PHE A 157 -0.722 7.892 -14.509 1.00 0.00 H new ATOM 0 HD2 PHE A 157 0.701 4.427 -12.480 1.00 0.00 H new ATOM 0 HE1 PHE A 157 -3.021 7.337 -13.847 1.00 0.00 H new ATOM 0 HE2 PHE A 157 -1.598 3.869 -11.818 1.00 0.00 H new ATOM 0 HZ PHE A 157 -3.465 5.321 -12.504 1.00 0.00 H new ATOM 2441 N SER A 158 0.299 8.581 -11.911 1.00 0.00 N ATOM 2442 CA SER A 158 -0.695 9.605 -11.610 1.00 0.00 C ATOM 2443 C SER A 158 -1.589 9.866 -12.819 1.00 0.00 C ATOM 2444 O SER A 158 -1.836 11.014 -13.184 1.00 0.00 O ATOM 2445 CB SER A 158 -0.007 10.902 -11.180 1.00 0.00 C ATOM 2446 OG SER A 158 -0.951 11.944 -10.998 1.00 0.00 O ATOM 0 H SER A 158 0.215 7.733 -11.350 1.00 0.00 H new ATOM 0 HA SER A 158 -1.317 9.244 -10.791 1.00 0.00 H new ATOM 0 HB2 SER A 158 0.540 10.737 -10.252 1.00 0.00 H new ATOM 0 HB3 SER A 158 0.724 11.197 -11.933 1.00 0.00 H new ATOM 0 HG SER A 158 -1.452 12.080 -11.829 1.00 0.00 H new