USER MOD reduce.3.24.130724 H: found=0, std=0, add=870, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 875 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 88 HIS : no HD1:sc= -15.6! C(o=-17!,f=-22!) USER MOD Set 1.2: A 105 SER OG : rot -56:sc= -0.575! USER MOD Set 1.3: A 109 THR OG1 : rot -20:sc= -0.799 USER MOD Set 2.1: A 71 ASN : amide:sc= -2.35 K(o=-3.8,f=-4.5!) USER MOD Set 2.2: A 86 ASN : amide:sc= -1.41 K(o=-3.8,f=-7.1!) USER MOD Set 3.1: A 85 SER OG : rot -40:sc= 0.483 USER MOD Set 3.2: A 106 THR OG1 : rot 90:sc= 1.17 USER MOD Set 4.1: A 67 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 90 GLN :FLIP amide:sc= -0.278 F(o=-1.1,f=-0.28) USER MOD Set 5.1: A 38 CYS SG : rot 29:sc= -2.65! USER MOD Set 5.2: A 40 THR OG1 : rot -10:sc= 0.426 USER MOD Set 5.3: A 42 GLN : amide:sc= -1.98 K(o=-4.2,f=-5.1!) USER MOD Single : A 16 GLN : amide:sc= -0.175 K(o=-0.18,f=-2!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 CYS SG : rot -80:sc= -4.96! USER MOD Single : A 39 THR OG1 : rot -166:sc= 1.2 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 161:sc= -0.449 (180deg=-0.761) USER MOD Single : A 74 CYS SG : rot 32:sc= -5.83 USER MOD Single : A 76 TYR OH : rot -20:sc= -0.2 USER MOD Single : A 77 HIS : no HE2:sc= -2.12! X(o=-2.1!,f=-1.6) USER MOD Single : A 82 SER OG : rot 180:sc= 0.06 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 ASN : amide:sc= -0.536 K(o=-0.54,f=-5!) USER MOD Single : A 107 ASN : amide:sc= 0.057 K(o=0.057,f=-0.98) USER MOD Single : A 112 ASN : amide:sc= 0.0252 X(o=0.025,f=0) USER MOD Single : A 114 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= -0.143! (180deg=-0.143!) USER MOD Single : A 118 LYS NZ :NH3+ -176:sc= 0.78 (180deg=0.773) USER MOD Single : A 119 ASN : amide:sc= -2.87! C(o=-2.9!,f=-4.4!) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 ASN :FLIP amide:sc= -0.538 F(o=-2.6,f=-0.54) USER MOD Single : A 122 GLN : amide:sc= -0.42 X(o=-0.42,f=-0.066) USER MOD Single : A 125 SER OG : rot 180:sc= -0.0482 USER MOD Single : A 126 GLN :FLIP amide:sc= -0.708 F(o=-2,f=-0.71) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot 120:sc= -2.56 USER MOD Single : A 148 ASN : amide:sc= -1.19 X(o=-1.2,f=-1.4!) USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 25 N GLN A 16 -20.414 8.729 -52.478 1.00 0.00 N ATOM 26 CA GLN A 16 -20.084 9.691 -53.523 1.00 0.00 C ATOM 27 C GLN A 16 -19.792 11.063 -52.924 1.00 0.00 C ATOM 28 O GLN A 16 -18.856 11.746 -53.338 1.00 0.00 O ATOM 29 CB GLN A 16 -21.229 9.792 -54.532 1.00 0.00 C ATOM 30 CG GLN A 16 -21.037 8.917 -55.760 1.00 0.00 C ATOM 31 CD GLN A 16 -20.023 9.490 -56.731 1.00 0.00 C ATOM 32 OE1 GLN A 16 -18.827 9.537 -56.442 1.00 0.00 O ATOM 33 NE2 GLN A 16 -20.496 9.931 -57.891 1.00 0.00 N ATOM 0 HA GLN A 16 -19.189 9.341 -54.037 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -22.161 9.514 -54.040 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -21.333 10.830 -54.848 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -20.714 7.924 -55.447 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -21.993 8.796 -56.269 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -21.495 9.873 -58.090 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -19.860 10.328 -58.583 1.00 0.00 H new ATOM 42 N ARG A 17 -20.600 11.460 -51.946 1.00 0.00 N ATOM 43 CA ARG A 17 -20.427 12.751 -51.290 1.00 0.00 C ATOM 44 C ARG A 17 -19.115 12.794 -50.513 1.00 0.00 C ATOM 45 O ARG A 17 -18.452 13.830 -50.450 1.00 0.00 O ATOM 46 CB ARG A 17 -21.599 13.028 -50.347 1.00 0.00 C ATOM 47 CG ARG A 17 -22.787 13.685 -51.032 1.00 0.00 C ATOM 48 CD ARG A 17 -23.650 12.662 -51.753 1.00 0.00 C ATOM 49 NE ARG A 17 -23.372 12.626 -53.187 1.00 0.00 N ATOM 50 CZ ARG A 17 -23.843 13.516 -54.057 1.00 0.00 C ATOM 51 NH1 ARG A 17 -24.615 14.514 -53.643 1.00 0.00 N ATOM 52 NH2 ARG A 17 -23.542 13.410 -55.343 1.00 0.00 N ATOM 0 H ARG A 17 -21.380 10.907 -51.591 1.00 0.00 H new ATOM 0 HA ARG A 17 -20.399 13.521 -52.061 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -21.923 12.089 -49.897 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -21.258 13.670 -49.535 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -23.388 14.213 -50.292 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -22.432 14.430 -51.744 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -23.476 11.675 -51.325 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -24.702 12.898 -51.593 1.00 0.00 H new ATOM 0 HE ARG A 17 -22.782 11.874 -53.542 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -24.849 14.601 -52.654 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -24.973 15.194 -54.314 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -22.949 12.646 -55.667 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -23.903 14.093 -56.009 1.00 0.00 H new ATOM 66 N PHE A 18 -18.745 11.662 -49.924 1.00 0.00 N ATOM 67 CA PHE A 18 -17.511 11.567 -49.153 1.00 0.00 C ATOM 68 C PHE A 18 -16.299 11.869 -50.027 1.00 0.00 C ATOM 69 O PHE A 18 -15.359 12.536 -49.594 1.00 0.00 O ATOM 70 CB PHE A 18 -17.376 10.175 -48.536 1.00 0.00 C ATOM 71 CG PHE A 18 -16.524 10.146 -47.300 1.00 0.00 C ATOM 72 CD1 PHE A 18 -15.177 10.466 -47.363 1.00 0.00 C ATOM 73 CD2 PHE A 18 -17.069 9.799 -46.074 1.00 0.00 C ATOM 74 CE1 PHE A 18 -14.390 10.441 -46.227 1.00 0.00 C ATOM 75 CE2 PHE A 18 -16.287 9.772 -44.934 1.00 0.00 C ATOM 76 CZ PHE A 18 -14.946 10.094 -45.011 1.00 0.00 C ATOM 0 H PHE A 18 -19.283 10.796 -49.966 1.00 0.00 H new ATOM 0 HA PHE A 18 -17.553 12.307 -48.354 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -18.369 9.797 -48.292 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -16.950 9.498 -49.277 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -14.737 10.738 -48.311 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -18.117 9.547 -46.008 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -13.342 10.692 -46.290 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -16.724 9.500 -43.985 1.00 0.00 H new ATOM 0 HZ PHE A 18 -14.333 10.075 -44.122 1.00 0.00 H new ATOM 86 N LEU A 19 -16.325 11.372 -51.259 1.00 0.00 N ATOM 87 CA LEU A 19 -15.227 11.589 -52.194 1.00 0.00 C ATOM 88 C LEU A 19 -15.022 13.076 -52.458 1.00 0.00 C ATOM 89 O LEU A 19 -13.889 13.554 -52.525 1.00 0.00 O ATOM 90 CB LEU A 19 -15.498 10.858 -53.511 1.00 0.00 C ATOM 91 CG LEU A 19 -14.257 10.299 -54.208 1.00 0.00 C ATOM 92 CD1 LEU A 19 -14.641 9.185 -55.169 1.00 0.00 C ATOM 93 CD2 LEU A 19 -13.513 11.405 -54.941 1.00 0.00 C ATOM 0 H LEU A 19 -17.094 10.816 -51.633 1.00 0.00 H new ATOM 0 HA LEU A 19 -14.318 11.190 -51.745 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -16.188 10.037 -53.318 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -16.001 11.544 -54.193 1.00 0.00 H new ATOM 0 HG LEU A 19 -13.594 9.884 -53.449 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -13.745 8.799 -55.656 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -15.129 8.381 -54.618 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -15.325 9.575 -55.923 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -12.633 10.989 -55.431 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -14.168 11.850 -55.690 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -13.204 12.170 -54.228 1.00 0.00 H new ATOM 105 N ILE A 20 -16.123 13.805 -52.602 1.00 0.00 N ATOM 106 CA ILE A 20 -16.062 15.240 -52.856 1.00 0.00 C ATOM 107 C ILE A 20 -15.555 15.993 -51.631 1.00 0.00 C ATOM 108 O ILE A 20 -14.849 16.991 -51.755 1.00 0.00 O ATOM 109 CB ILE A 20 -17.428 15.811 -53.274 1.00 0.00 C ATOM 110 CG1 ILE A 20 -18.112 14.883 -54.281 1.00 0.00 C ATOM 111 CG2 ILE A 20 -17.251 17.201 -53.867 1.00 0.00 C ATOM 112 CD1 ILE A 20 -17.225 14.480 -55.440 1.00 0.00 C ATOM 0 H ILE A 20 -17.068 13.426 -52.547 1.00 0.00 H new ATOM 0 HA ILE A 20 -15.364 15.379 -53.681 1.00 0.00 H new ATOM 0 HB ILE A 20 -18.063 15.884 -52.391 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -18.448 13.985 -53.763 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -19.002 15.378 -54.671 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -18.223 17.598 -54.160 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -16.800 17.859 -53.124 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -16.604 17.144 -54.742 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -17.779 13.823 -56.111 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -16.909 15.371 -55.983 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -16.347 13.956 -55.061 1.00 0.00 H new ATOM 124 N GLU A 21 -15.921 15.513 -50.448 1.00 0.00 N ATOM 125 CA GLU A 21 -15.496 16.151 -49.211 1.00 0.00 C ATOM 126 C GLU A 21 -13.974 16.221 -49.144 1.00 0.00 C ATOM 127 O GLU A 21 -13.406 17.190 -48.637 1.00 0.00 O ATOM 128 CB GLU A 21 -16.039 15.385 -48.002 1.00 0.00 C ATOM 129 CG GLU A 21 -17.551 15.460 -47.863 1.00 0.00 C ATOM 130 CD GLU A 21 -18.019 16.788 -47.301 1.00 0.00 C ATOM 131 OE1 GLU A 21 -17.507 17.836 -47.746 1.00 0.00 O ATOM 132 OE2 GLU A 21 -18.900 16.779 -46.414 1.00 0.00 O ATOM 0 H GLU A 21 -16.508 14.689 -50.321 1.00 0.00 H new ATOM 0 HA GLU A 21 -15.895 17.165 -49.193 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -15.741 14.339 -48.081 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -15.579 15.780 -47.096 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -18.010 15.300 -48.839 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -17.893 14.654 -47.214 1.00 0.00 H new ATOM 139 N LYS A 22 -13.321 15.193 -49.673 1.00 0.00 N ATOM 140 CA LYS A 22 -11.863 15.134 -49.692 1.00 0.00 C ATOM 141 C LYS A 22 -11.287 16.207 -50.614 1.00 0.00 C ATOM 142 O LYS A 22 -10.138 16.621 -50.460 1.00 0.00 O ATOM 143 CB LYS A 22 -11.394 13.750 -50.145 1.00 0.00 C ATOM 144 CG LYS A 22 -10.213 13.217 -49.350 1.00 0.00 C ATOM 145 CD LYS A 22 -9.705 11.904 -49.921 1.00 0.00 C ATOM 146 CE LYS A 22 -8.450 11.433 -49.201 1.00 0.00 C ATOM 147 NZ LYS A 22 -7.214 11.817 -49.935 1.00 0.00 N ATOM 0 H LYS A 22 -13.779 14.386 -50.096 1.00 0.00 H new ATOM 0 HA LYS A 22 -11.503 15.319 -48.680 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -12.224 13.049 -50.061 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -11.121 13.795 -51.199 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -9.408 13.952 -49.354 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -10.508 13.073 -48.311 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -10.482 11.144 -49.836 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -9.493 12.025 -50.983 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -8.425 11.860 -48.198 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -8.482 10.350 -49.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -6.381 11.478 -49.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -7.226 11.389 -50.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -7.170 12.852 -50.023 1.00 0.00 H new ATOM 161 N PHE A 23 -12.094 16.652 -51.575 1.00 0.00 N ATOM 162 CA PHE A 23 -11.669 17.674 -52.527 1.00 0.00 C ATOM 163 C PHE A 23 -11.211 18.938 -51.810 1.00 0.00 C ATOM 164 O PHE A 23 -10.151 19.489 -52.111 1.00 0.00 O ATOM 165 CB PHE A 23 -12.811 18.007 -53.468 1.00 0.00 C ATOM 166 CG PHE A 23 -12.421 18.036 -54.912 1.00 0.00 C ATOM 167 CD1 PHE A 23 -11.318 18.756 -55.332 1.00 0.00 C ATOM 168 CD2 PHE A 23 -13.166 17.343 -55.853 1.00 0.00 C ATOM 169 CE1 PHE A 23 -10.962 18.787 -56.664 1.00 0.00 C ATOM 170 CE2 PHE A 23 -12.816 17.369 -57.186 1.00 0.00 C ATOM 171 CZ PHE A 23 -11.713 18.093 -57.591 1.00 0.00 C ATOM 0 H PHE A 23 -13.048 16.319 -51.714 1.00 0.00 H new ATOM 0 HA PHE A 23 -10.827 17.279 -53.096 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -13.606 17.274 -53.332 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -13.223 18.978 -53.194 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -10.729 19.300 -54.609 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -14.030 16.777 -55.539 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -10.098 19.353 -56.981 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -13.403 16.825 -57.911 1.00 0.00 H new ATOM 0 HZ PHE A 23 -11.437 18.117 -58.635 1.00 0.00 H new ATOM 296 N ILE A 32 -9.226 18.491 -30.338 1.00 0.00 N ATOM 297 CA ILE A 32 -8.489 17.273 -30.454 1.00 0.00 C ATOM 298 C ILE A 32 -7.014 17.454 -30.146 1.00 0.00 C ATOM 299 O ILE A 32 -6.373 18.403 -30.600 1.00 0.00 O ATOM 300 CB ILE A 32 -8.670 16.680 -31.856 1.00 0.00 C ATOM 301 CG1 ILE A 32 -10.083 16.935 -32.391 1.00 0.00 C ATOM 302 CG2 ILE A 32 -8.415 15.202 -31.811 1.00 0.00 C ATOM 303 CD1 ILE A 32 -11.176 16.534 -31.420 1.00 0.00 C ATOM 0 HA ILE A 32 -8.887 16.583 -29.710 1.00 0.00 H new ATOM 0 HB ILE A 32 -7.958 17.165 -32.524 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -10.188 17.994 -32.628 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -10.215 16.385 -33.323 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -8.544 14.780 -32.808 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -7.397 15.019 -31.468 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -9.119 14.732 -31.124 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -12.150 16.742 -31.863 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -11.096 15.469 -31.202 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -11.069 17.103 -30.496 1.00 0.00 H new ATOM 315 N VAL A 33 -6.492 16.525 -29.362 1.00 0.00 N ATOM 316 CA VAL A 33 -5.122 16.521 -28.953 1.00 0.00 C ATOM 317 C VAL A 33 -4.294 15.706 -29.936 1.00 0.00 C ATOM 318 O VAL A 33 -3.370 16.214 -30.575 1.00 0.00 O ATOM 319 CB VAL A 33 -5.014 15.892 -27.558 1.00 0.00 C ATOM 320 CG1 VAL A 33 -3.719 16.272 -26.936 1.00 0.00 C ATOM 321 CG2 VAL A 33 -6.157 16.305 -26.652 1.00 0.00 C ATOM 0 H VAL A 33 -7.031 15.742 -28.992 1.00 0.00 H new ATOM 0 HA VAL A 33 -4.749 17.545 -28.928 1.00 0.00 H new ATOM 0 HB VAL A 33 -5.068 14.810 -27.681 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -3.646 15.823 -25.945 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -2.898 15.915 -27.558 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -3.662 17.357 -26.848 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -6.036 15.834 -25.676 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -6.155 17.389 -26.535 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -7.103 15.989 -27.092 1.00 0.00 H new ATOM 331 N CYS A 34 -4.652 14.434 -30.050 1.00 0.00 N ATOM 332 CA CYS A 34 -3.978 13.509 -30.957 1.00 0.00 C ATOM 333 C CYS A 34 -4.955 12.437 -31.442 1.00 0.00 C ATOM 334 O CYS A 34 -6.034 12.274 -30.874 1.00 0.00 O ATOM 335 CB CYS A 34 -2.778 12.857 -30.263 1.00 0.00 C ATOM 336 SG CYS A 34 -1.174 13.418 -30.879 1.00 0.00 S ATOM 0 H CYS A 34 -5.415 14.014 -29.519 1.00 0.00 H new ATOM 0 HA CYS A 34 -3.617 14.070 -31.819 1.00 0.00 H new ATOM 0 HB2 CYS A 34 -2.836 13.061 -29.194 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -2.844 11.776 -30.386 1.00 0.00 H new ATOM 0 HG CYS A 34 -0.892 12.795 -31.985 1.00 0.00 H new ATOM 342 N ARG A 35 -4.582 11.712 -32.492 1.00 0.00 N ATOM 343 CA ARG A 35 -5.446 10.667 -33.035 1.00 0.00 C ATOM 344 C ARG A 35 -4.693 9.349 -33.195 1.00 0.00 C ATOM 345 O ARG A 35 -3.548 9.327 -33.639 1.00 0.00 O ATOM 346 CB ARG A 35 -6.026 11.100 -34.383 1.00 0.00 C ATOM 347 CG ARG A 35 -7.064 10.136 -34.936 1.00 0.00 C ATOM 348 CD ARG A 35 -7.016 10.068 -36.453 1.00 0.00 C ATOM 349 NE ARG A 35 -8.103 10.826 -37.069 1.00 0.00 N ATOM 350 CZ ARG A 35 -8.134 11.166 -38.356 1.00 0.00 C ATOM 351 NH1 ARG A 35 -7.139 10.821 -39.165 1.00 0.00 N ATOM 352 NH2 ARG A 35 -9.161 11.854 -38.834 1.00 0.00 N ATOM 0 H ARG A 35 -3.694 11.827 -32.981 1.00 0.00 H new ATOM 0 HA ARG A 35 -6.260 10.511 -32.327 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -6.479 12.086 -34.275 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -5.214 11.199 -35.104 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -6.895 9.142 -34.522 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -8.058 10.449 -34.617 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -6.059 10.456 -36.803 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -7.074 9.027 -36.771 1.00 0.00 H new ATOM 0 HE ARG A 35 -8.884 11.111 -36.478 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -6.346 10.293 -38.801 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -7.168 11.084 -40.150 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -9.927 12.123 -38.216 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -9.186 12.115 -39.820 1.00 0.00 H new ATOM 366 N VAL A 36 -5.348 8.248 -32.836 1.00 0.00 N ATOM 367 CA VAL A 36 -4.740 6.929 -32.950 1.00 0.00 C ATOM 368 C VAL A 36 -5.322 6.162 -34.133 1.00 0.00 C ATOM 369 O VAL A 36 -6.533 5.961 -34.221 1.00 0.00 O ATOM 370 CB VAL A 36 -4.938 6.105 -31.663 1.00 0.00 C ATOM 371 CG1 VAL A 36 -4.198 4.778 -31.754 1.00 0.00 C ATOM 372 CG2 VAL A 36 -4.477 6.897 -30.449 1.00 0.00 C ATOM 0 H VAL A 36 -6.298 8.245 -32.465 1.00 0.00 H new ATOM 0 HA VAL A 36 -3.672 7.081 -33.109 1.00 0.00 H new ATOM 0 HB VAL A 36 -6.001 5.892 -31.551 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -4.351 4.212 -30.835 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -4.579 4.206 -32.600 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -3.133 4.964 -31.892 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -4.624 6.301 -29.548 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -3.420 7.142 -30.554 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -5.057 7.817 -30.373 1.00 0.00 H new ATOM 382 N ILE A 37 -4.451 5.744 -35.045 1.00 0.00 N ATOM 383 CA ILE A 37 -4.871 5.012 -36.231 1.00 0.00 C ATOM 384 C ILE A 37 -4.191 3.648 -36.311 1.00 0.00 C ATOM 385 O ILE A 37 -2.963 3.556 -36.290 1.00 0.00 O ATOM 386 CB ILE A 37 -4.538 5.808 -37.504 1.00 0.00 C ATOM 387 CG1 ILE A 37 -4.958 7.271 -37.340 1.00 0.00 C ATOM 388 CG2 ILE A 37 -5.213 5.185 -38.716 1.00 0.00 C ATOM 389 CD1 ILE A 37 -4.508 8.163 -38.476 1.00 0.00 C ATOM 0 H ILE A 37 -3.445 5.901 -34.983 1.00 0.00 H new ATOM 0 HA ILE A 37 -5.949 4.868 -36.157 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.460 5.775 -37.663 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -6.044 7.321 -37.258 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -4.550 7.654 -36.405 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -4.966 5.762 -39.607 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -4.865 4.160 -38.839 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -6.293 5.186 -38.571 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -4.842 9.184 -38.291 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -3.420 8.143 -38.545 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -4.937 7.805 -39.412 1.00 0.00 H new ATOM 401 N CYS A 38 -4.993 2.592 -36.412 1.00 0.00 N ATOM 402 CA CYS A 38 -4.460 1.238 -36.505 1.00 0.00 C ATOM 403 C CYS A 38 -4.163 0.877 -37.958 1.00 0.00 C ATOM 404 O CYS A 38 -5.074 0.579 -38.732 1.00 0.00 O ATOM 405 CB CYS A 38 -5.443 0.230 -35.905 1.00 0.00 C ATOM 406 SG CYS A 38 -4.692 -1.354 -35.466 1.00 0.00 S ATOM 0 H CYS A 38 -6.011 2.648 -36.431 1.00 0.00 H new ATOM 0 HA CYS A 38 -3.530 1.200 -35.938 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -5.896 0.665 -35.014 1.00 0.00 H new ATOM 0 HB3 CYS A 38 -6.248 0.054 -36.618 1.00 0.00 H new ATOM 0 HG CYS A 38 -3.440 -1.173 -35.168 1.00 0.00 H new ATOM 412 N THR A 39 -2.885 0.918 -38.324 1.00 0.00 N ATOM 413 CA THR A 39 -2.468 0.606 -39.687 1.00 0.00 C ATOM 414 C THR A 39 -2.490 -0.897 -39.953 1.00 0.00 C ATOM 415 O THR A 39 -2.549 -1.330 -41.104 1.00 0.00 O ATOM 416 CB THR A 39 -1.064 1.159 -39.948 1.00 0.00 C ATOM 417 OG1 THR A 39 -0.265 1.066 -38.782 1.00 0.00 O ATOM 418 CG2 THR A 39 -1.065 2.607 -40.391 1.00 0.00 C ATOM 0 H THR A 39 -2.120 1.164 -37.695 1.00 0.00 H new ATOM 0 HA THR A 39 -3.178 1.078 -40.366 1.00 0.00 H new ATOM 0 HB THR A 39 -0.657 0.550 -40.755 1.00 0.00 H new ATOM 0 HG1 THR A 39 0.541 1.611 -38.894 1.00 0.00 H new ATOM 0 HG21 THR A 39 -0.040 2.937 -40.559 1.00 0.00 H new ATOM 0 HG22 THR A 39 -1.634 2.704 -41.316 1.00 0.00 H new ATOM 0 HG23 THR A 39 -1.522 3.224 -39.617 1.00 0.00 H new ATOM 426 N THR A 40 -2.438 -1.691 -38.887 1.00 0.00 N ATOM 427 CA THR A 40 -2.449 -3.145 -39.023 1.00 0.00 C ATOM 428 C THR A 40 -3.863 -3.678 -39.251 1.00 0.00 C ATOM 429 O THR A 40 -4.062 -4.878 -39.438 1.00 0.00 O ATOM 430 CB THR A 40 -1.842 -3.789 -37.777 1.00 0.00 C ATOM 431 OG1 THR A 40 -2.587 -3.454 -36.617 1.00 0.00 O ATOM 432 CG2 THR A 40 -0.410 -3.368 -37.536 1.00 0.00 C ATOM 0 H THR A 40 -2.388 -1.355 -37.925 1.00 0.00 H new ATOM 0 HA THR A 40 -1.850 -3.404 -39.896 1.00 0.00 H new ATOM 0 HB THR A 40 -1.871 -4.863 -37.963 1.00 0.00 H new ATOM 0 HG1 THR A 40 -3.231 -2.748 -36.835 1.00 0.00 H new ATOM 0 HG21 THR A 40 -0.033 -3.857 -36.638 1.00 0.00 H new ATOM 0 HG22 THR A 40 0.203 -3.656 -38.390 1.00 0.00 H new ATOM 0 HG23 THR A 40 -0.366 -2.287 -37.406 1.00 0.00 H new ATOM 440 N GLY A 41 -4.841 -2.778 -39.242 1.00 0.00 N ATOM 441 CA GLY A 41 -6.221 -3.178 -39.457 1.00 0.00 C ATOM 442 C GLY A 41 -6.737 -4.113 -38.380 1.00 0.00 C ATOM 443 O GLY A 41 -6.879 -5.314 -38.610 1.00 0.00 O ATOM 0 H GLY A 41 -4.703 -1.779 -39.090 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -6.851 -2.289 -39.492 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -6.306 -3.667 -40.427 1.00 0.00 H new ATOM 447 N GLN A 42 -7.017 -3.561 -37.205 1.00 0.00 N ATOM 448 CA GLN A 42 -7.518 -4.352 -36.087 1.00 0.00 C ATOM 449 C GLN A 42 -8.469 -3.532 -35.216 1.00 0.00 C ATOM 450 O GLN A 42 -9.502 -4.029 -34.770 1.00 0.00 O ATOM 451 CB GLN A 42 -6.353 -4.867 -35.240 1.00 0.00 C ATOM 452 CG GLN A 42 -5.331 -5.662 -36.037 1.00 0.00 C ATOM 453 CD GLN A 42 -4.602 -6.696 -35.200 1.00 0.00 C ATOM 454 OE1 GLN A 42 -3.374 -6.766 -35.212 1.00 0.00 O ATOM 455 NE2 GLN A 42 -5.356 -7.509 -34.469 1.00 0.00 N ATOM 0 H GLN A 42 -6.905 -2.568 -37.002 1.00 0.00 H new ATOM 0 HA GLN A 42 -8.069 -5.199 -36.495 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -5.855 -4.020 -34.767 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -6.745 -5.494 -34.439 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -5.833 -6.162 -36.866 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -4.604 -4.976 -36.472 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -6.372 -7.417 -34.488 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -4.919 -8.225 -33.889 1.00 0.00 H new ATOM 464 N ILE A 43 -8.104 -2.276 -34.973 1.00 0.00 N ATOM 465 CA ILE A 43 -8.916 -1.385 -34.151 1.00 0.00 C ATOM 466 C ILE A 43 -9.349 -0.152 -34.943 1.00 0.00 C ATOM 467 O ILE A 43 -8.577 0.381 -35.740 1.00 0.00 O ATOM 468 CB ILE A 43 -8.140 -0.928 -32.899 1.00 0.00 C ATOM 469 CG1 ILE A 43 -7.394 -2.106 -32.262 1.00 0.00 C ATOM 470 CG2 ILE A 43 -9.081 -0.291 -31.892 1.00 0.00 C ATOM 471 CD1 ILE A 43 -5.971 -1.777 -31.865 1.00 0.00 C ATOM 0 H ILE A 43 -7.250 -1.852 -35.335 1.00 0.00 H new ATOM 0 HA ILE A 43 -9.799 -1.945 -33.844 1.00 0.00 H new ATOM 0 HB ILE A 43 -7.406 -0.184 -33.207 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -7.941 -2.438 -31.380 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -7.383 -2.941 -32.963 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -8.516 0.025 -31.015 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -9.565 0.575 -32.344 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -9.839 -1.015 -31.593 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -5.504 -2.657 -31.421 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -5.408 -1.474 -32.748 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -5.974 -0.963 -31.140 1.00 0.00 H new ATOM 483 N PRO A 44 -10.594 0.325 -34.739 1.00 0.00 N ATOM 484 CA PRO A 44 -11.103 1.500 -35.447 1.00 0.00 C ATOM 485 C PRO A 44 -10.460 2.792 -34.955 1.00 0.00 C ATOM 486 O PRO A 44 -10.230 2.966 -33.758 1.00 0.00 O ATOM 487 CB PRO A 44 -12.601 1.487 -35.138 1.00 0.00 C ATOM 488 CG PRO A 44 -12.721 0.758 -33.845 1.00 0.00 C ATOM 489 CD PRO A 44 -11.593 -0.239 -33.811 1.00 0.00 C ATOM 0 HA PRO A 44 -10.881 1.462 -36.514 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -12.996 2.500 -35.058 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -13.162 0.987 -35.927 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -12.655 1.447 -33.003 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -13.685 0.256 -33.771 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -11.187 -0.349 -32.805 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -11.923 -1.227 -34.131 1.00 0.00 H new ATOM 497 N ILE A 45 -10.160 3.689 -35.887 1.00 0.00 N ATOM 498 CA ILE A 45 -9.530 4.960 -35.555 1.00 0.00 C ATOM 499 C ILE A 45 -10.348 5.749 -34.535 1.00 0.00 C ATOM 500 O ILE A 45 -11.578 5.723 -34.550 1.00 0.00 O ATOM 501 CB ILE A 45 -9.322 5.829 -36.815 1.00 0.00 C ATOM 502 CG1 ILE A 45 -8.404 5.107 -37.800 1.00 0.00 C ATOM 503 CG2 ILE A 45 -8.742 7.188 -36.446 1.00 0.00 C ATOM 504 CD1 ILE A 45 -8.566 5.575 -39.229 1.00 0.00 C ATOM 0 H ILE A 45 -10.344 3.558 -36.882 1.00 0.00 H new ATOM 0 HA ILE A 45 -8.561 4.719 -35.118 1.00 0.00 H new ATOM 0 HB ILE A 45 -10.291 5.992 -37.288 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -7.368 5.253 -37.493 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -8.603 4.036 -37.752 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -8.604 7.782 -37.349 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -9.426 7.705 -35.772 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -7.780 7.051 -35.952 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -7.884 5.020 -39.873 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -9.592 5.404 -39.554 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -8.339 6.639 -39.291 1.00 0.00 H new ATOM 516 N ARG A 46 -9.645 6.460 -33.659 1.00 0.00 N ATOM 517 CA ARG A 46 -10.280 7.277 -32.634 1.00 0.00 C ATOM 518 C ARG A 46 -9.550 8.610 -32.506 1.00 0.00 C ATOM 519 O ARG A 46 -8.432 8.757 -32.996 1.00 0.00 O ATOM 520 CB ARG A 46 -10.290 6.546 -31.290 1.00 0.00 C ATOM 521 CG ARG A 46 -11.628 6.620 -30.571 1.00 0.00 C ATOM 522 CD ARG A 46 -12.046 5.262 -30.025 1.00 0.00 C ATOM 523 NE ARG A 46 -13.147 5.371 -29.070 1.00 0.00 N ATOM 524 CZ ARG A 46 -14.422 5.515 -29.421 1.00 0.00 C ATOM 525 NH1 ARG A 46 -14.763 5.570 -30.702 1.00 0.00 N ATOM 526 NH2 ARG A 46 -15.359 5.605 -28.487 1.00 0.00 N ATOM 0 H ARG A 46 -8.625 6.485 -33.640 1.00 0.00 H new ATOM 0 HA ARG A 46 -11.313 7.464 -32.928 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -10.031 5.500 -31.452 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -9.518 6.970 -30.649 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -11.563 7.337 -29.753 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -12.391 6.987 -31.257 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -12.345 4.616 -30.850 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -11.192 4.787 -29.541 1.00 0.00 H new ATOM 0 HE ARG A 46 -12.925 5.334 -28.075 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -14.046 5.502 -31.424 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -15.742 5.680 -30.965 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -15.102 5.564 -27.501 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -16.337 5.715 -28.755 1.00 0.00 H new ATOM 540 N ASP A 47 -10.184 9.584 -31.862 1.00 0.00 N ATOM 541 CA ASP A 47 -9.572 10.899 -31.701 1.00 0.00 C ATOM 542 C ASP A 47 -9.456 11.300 -30.235 1.00 0.00 C ATOM 543 O ASP A 47 -10.458 11.429 -29.531 1.00 0.00 O ATOM 544 CB ASP A 47 -10.377 11.958 -32.462 1.00 0.00 C ATOM 545 CG ASP A 47 -10.717 11.524 -33.873 1.00 0.00 C ATOM 546 OD1 ASP A 47 -11.722 10.803 -34.048 1.00 0.00 O ATOM 547 OD2 ASP A 47 -9.977 11.903 -34.805 1.00 0.00 O ATOM 0 H ASP A 47 -11.111 9.491 -31.447 1.00 0.00 H new ATOM 0 HA ASP A 47 -8.565 10.838 -32.113 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -11.298 12.170 -31.919 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -9.807 12.887 -32.498 1.00 0.00 H new ATOM 552 N LEU A 48 -8.223 11.525 -29.792 1.00 0.00 N ATOM 553 CA LEU A 48 -7.962 11.949 -28.422 1.00 0.00 C ATOM 554 C LEU A 48 -8.097 13.460 -28.330 1.00 0.00 C ATOM 555 O LEU A 48 -7.503 14.182 -29.133 1.00 0.00 O ATOM 556 CB LEU A 48 -6.548 11.551 -27.988 1.00 0.00 C ATOM 557 CG LEU A 48 -6.312 10.059 -27.750 1.00 0.00 C ATOM 558 CD1 LEU A 48 -6.832 9.231 -28.911 1.00 0.00 C ATOM 559 CD2 LEU A 48 -4.831 9.793 -27.522 1.00 0.00 C ATOM 0 H LEU A 48 -7.386 11.420 -30.365 1.00 0.00 H new ATOM 0 HA LEU A 48 -8.683 11.461 -27.766 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -5.847 11.892 -28.750 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -6.307 12.087 -27.070 1.00 0.00 H new ATOM 0 HG LEU A 48 -6.863 9.763 -26.858 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -6.651 8.174 -28.714 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -7.902 9.400 -29.028 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -6.317 9.523 -29.826 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -4.674 8.728 -27.354 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -4.265 10.109 -28.399 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -4.491 10.352 -26.650 1.00 0.00 H new ATOM 571 N SER A 49 -8.867 13.953 -27.367 1.00 0.00 N ATOM 572 CA SER A 49 -9.034 15.387 -27.230 1.00 0.00 C ATOM 573 C SER A 49 -8.970 15.862 -25.799 1.00 0.00 C ATOM 574 O SER A 49 -9.255 15.132 -24.853 1.00 0.00 O ATOM 575 CB SER A 49 -10.338 15.864 -27.821 1.00 0.00 C ATOM 576 OG SER A 49 -11.096 14.795 -28.360 1.00 0.00 O ATOM 0 H SER A 49 -9.375 13.391 -26.684 1.00 0.00 H new ATOM 0 HA SER A 49 -8.194 15.813 -27.779 1.00 0.00 H new ATOM 0 HB2 SER A 49 -10.921 16.371 -27.052 1.00 0.00 H new ATOM 0 HB3 SER A 49 -10.136 16.596 -28.603 1.00 0.00 H new ATOM 0 HG SER A 49 -11.934 15.143 -28.732 1.00 0.00 H new ATOM 582 N ALA A 50 -8.618 17.124 -25.681 1.00 0.00 N ATOM 583 CA ALA A 50 -8.516 17.786 -24.386 1.00 0.00 C ATOM 584 C ALA A 50 -8.921 19.252 -24.498 1.00 0.00 C ATOM 585 O ALA A 50 -8.632 19.910 -25.497 1.00 0.00 O ATOM 586 CB ALA A 50 -7.103 17.660 -23.836 1.00 0.00 C ATOM 0 H ALA A 50 -8.394 17.724 -26.475 1.00 0.00 H new ATOM 0 HA ALA A 50 -9.200 17.296 -23.693 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -7.043 18.159 -22.869 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -6.852 16.606 -23.716 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -6.400 18.124 -24.528 1.00 0.00 H new ATOM 821 N LYS A 64 -4.679 15.627 -19.287 1.00 0.00 N ATOM 822 CA LYS A 64 -5.546 14.506 -19.638 1.00 0.00 C ATOM 823 C LYS A 64 -4.749 13.346 -20.220 1.00 0.00 C ATOM 824 O LYS A 64 -3.799 13.550 -20.974 1.00 0.00 O ATOM 825 CB LYS A 64 -6.611 14.951 -20.631 1.00 0.00 C ATOM 826 CG LYS A 64 -7.963 14.330 -20.352 1.00 0.00 C ATOM 827 CD LYS A 64 -9.092 15.259 -20.736 1.00 0.00 C ATOM 828 CE LYS A 64 -9.482 15.034 -22.175 1.00 0.00 C ATOM 829 NZ LYS A 64 -10.726 15.767 -22.545 1.00 0.00 N ATOM 0 HA LYS A 64 -6.028 14.162 -18.723 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -6.701 16.037 -20.600 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -6.295 14.686 -21.640 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -8.056 13.395 -20.905 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -8.039 14.082 -19.293 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -9.951 15.087 -20.087 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -8.786 16.295 -20.592 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -8.667 15.355 -22.824 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -9.626 13.967 -22.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -10.783 15.854 -23.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -11.554 15.244 -22.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -10.710 16.715 -22.118 1.00 0.00 H new ATOM 843 N VAL A 65 -5.138 12.127 -19.859 1.00 0.00 N ATOM 844 CA VAL A 65 -4.458 10.939 -20.339 1.00 0.00 C ATOM 845 C VAL A 65 -5.440 9.878 -20.823 1.00 0.00 C ATOM 846 O VAL A 65 -6.479 9.642 -20.207 1.00 0.00 O ATOM 847 CB VAL A 65 -3.600 10.317 -19.239 1.00 0.00 C ATOM 848 CG1 VAL A 65 -2.714 9.220 -19.800 1.00 0.00 C ATOM 849 CG2 VAL A 65 -2.775 11.377 -18.526 1.00 0.00 C ATOM 0 H VAL A 65 -5.923 11.941 -19.234 1.00 0.00 H new ATOM 0 HA VAL A 65 -3.833 11.261 -21.171 1.00 0.00 H new ATOM 0 HB VAL A 65 -4.268 9.866 -18.505 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -2.112 8.792 -18.998 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -3.335 8.441 -20.243 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -2.057 9.637 -20.563 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -2.173 10.907 -17.748 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -2.119 11.871 -19.243 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -3.440 12.114 -18.075 1.00 0.00 H new ATOM 859 N TRP A 66 -5.087 9.242 -21.928 1.00 0.00 N ATOM 860 CA TRP A 66 -5.916 8.189 -22.518 1.00 0.00 C ATOM 861 C TRP A 66 -5.374 6.796 -22.239 1.00 0.00 C ATOM 862 O TRP A 66 -4.176 6.562 -22.338 1.00 0.00 O ATOM 863 CB TRP A 66 -5.998 8.360 -24.023 1.00 0.00 C ATOM 864 CG TRP A 66 -6.834 9.516 -24.426 1.00 0.00 C ATOM 865 CD1 TRP A 66 -8.120 9.551 -24.885 1.00 0.00 C ATOM 866 CD2 TRP A 66 -6.386 10.832 -24.380 1.00 0.00 C ATOM 867 NE1 TRP A 66 -8.477 10.861 -25.137 1.00 0.00 N ATOM 868 CE2 TRP A 66 -7.410 11.665 -24.827 1.00 0.00 C ATOM 869 CE3 TRP A 66 -5.185 11.361 -23.995 1.00 0.00 C ATOM 870 CZ2 TRP A 66 -7.250 13.045 -24.895 1.00 0.00 C ATOM 871 CZ3 TRP A 66 -5.009 12.715 -24.051 1.00 0.00 C ATOM 872 CH2 TRP A 66 -6.039 13.556 -24.503 1.00 0.00 C ATOM 0 H TRP A 66 -4.227 9.434 -22.442 1.00 0.00 H new ATOM 0 HA TRP A 66 -6.900 8.284 -22.058 1.00 0.00 H new ATOM 0 HB2 TRP A 66 -4.993 8.487 -24.425 1.00 0.00 H new ATOM 0 HB3 TRP A 66 -6.406 7.451 -24.466 1.00 0.00 H new ATOM 0 HD1 TRP A 66 -8.757 8.690 -25.028 1.00 0.00 H new ATOM 0 HE1 TRP A 66 -9.379 11.177 -25.493 1.00 0.00 H new ATOM 0 HE3 TRP A 66 -4.388 10.718 -23.652 1.00 0.00 H new ATOM 0 HZ2 TRP A 66 -8.046 13.687 -25.242 1.00 0.00 H new ATOM 0 HZ3 TRP A 66 -4.066 13.144 -23.744 1.00 0.00 H new ATOM 0 HH2 TRP A 66 -5.875 14.623 -24.543 1.00 0.00 H new ATOM 883 N THR A 67 -6.269 5.862 -21.940 1.00 0.00 N ATOM 884 CA THR A 67 -5.873 4.481 -21.703 1.00 0.00 C ATOM 885 C THR A 67 -6.360 3.604 -22.855 1.00 0.00 C ATOM 886 O THR A 67 -7.517 3.687 -23.264 1.00 0.00 O ATOM 887 CB THR A 67 -6.419 3.970 -20.368 1.00 0.00 C ATOM 888 OG1 THR A 67 -6.875 5.045 -19.567 1.00 0.00 O ATOM 889 CG2 THR A 67 -5.392 3.200 -19.563 1.00 0.00 C ATOM 0 H THR A 67 -7.271 6.036 -21.856 1.00 0.00 H new ATOM 0 HA THR A 67 -4.785 4.435 -21.652 1.00 0.00 H new ATOM 0 HB THR A 67 -7.238 3.298 -20.626 1.00 0.00 H new ATOM 0 HG1 THR A 67 -7.222 4.697 -18.719 1.00 0.00 H new ATOM 0 HG21 THR A 67 -5.840 2.864 -18.628 1.00 0.00 H new ATOM 0 HG22 THR A 67 -5.055 2.335 -20.135 1.00 0.00 H new ATOM 0 HG23 THR A 67 -4.541 3.846 -19.346 1.00 0.00 H new ATOM 897 N PHE A 68 -5.462 2.791 -23.392 1.00 0.00 N ATOM 898 CA PHE A 68 -5.787 1.923 -24.521 1.00 0.00 C ATOM 899 C PHE A 68 -5.586 0.453 -24.175 1.00 0.00 C ATOM 900 O PHE A 68 -4.678 0.101 -23.424 1.00 0.00 O ATOM 901 CB PHE A 68 -4.915 2.278 -25.731 1.00 0.00 C ATOM 902 CG PHE A 68 -4.826 3.753 -26.021 1.00 0.00 C ATOM 903 CD1 PHE A 68 -4.271 4.629 -25.099 1.00 0.00 C ATOM 904 CD2 PHE A 68 -5.292 4.261 -27.222 1.00 0.00 C ATOM 905 CE1 PHE A 68 -4.189 5.980 -25.372 1.00 0.00 C ATOM 906 CE2 PHE A 68 -5.212 5.611 -27.497 1.00 0.00 C ATOM 907 CZ PHE A 68 -4.660 6.471 -26.571 1.00 0.00 C ATOM 0 H PHE A 68 -4.499 2.712 -23.065 1.00 0.00 H new ATOM 0 HA PHE A 68 -6.838 2.081 -24.761 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -3.910 1.891 -25.565 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -5.311 1.770 -26.611 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -3.899 4.250 -24.158 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -5.723 3.593 -27.952 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -3.756 6.652 -24.646 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -5.581 5.994 -28.437 1.00 0.00 H new ATOM 0 HZ PHE A 68 -4.597 7.528 -26.785 1.00 0.00 H new ATOM 917 N GLY A 69 -6.438 -0.403 -24.735 1.00 0.00 N ATOM 918 CA GLY A 69 -6.330 -1.826 -24.483 1.00 0.00 C ATOM 919 C GLY A 69 -7.591 -2.588 -24.852 1.00 0.00 C ATOM 920 O GLY A 69 -8.480 -2.048 -25.512 1.00 0.00 O ATOM 0 H GLY A 69 -7.200 -0.134 -25.358 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -5.490 -2.228 -25.049 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -6.109 -1.987 -23.428 1.00 0.00 H new ATOM 924 N ARG A 70 -7.661 -3.848 -24.434 1.00 0.00 N ATOM 925 CA ARG A 70 -8.815 -4.698 -24.727 1.00 0.00 C ATOM 926 C ARG A 70 -9.969 -4.448 -23.755 1.00 0.00 C ATOM 927 O ARG A 70 -11.000 -5.116 -23.828 1.00 0.00 O ATOM 928 CB ARG A 70 -8.411 -6.169 -24.664 1.00 0.00 C ATOM 929 CG ARG A 70 -7.618 -6.635 -25.870 1.00 0.00 C ATOM 930 CD ARG A 70 -6.541 -7.631 -25.475 1.00 0.00 C ATOM 931 NE ARG A 70 -7.105 -8.934 -25.118 1.00 0.00 N ATOM 932 CZ ARG A 70 -7.316 -9.342 -23.868 1.00 0.00 C ATOM 933 NH1 ARG A 70 -7.008 -8.561 -22.839 1.00 0.00 N ATOM 934 NH2 ARG A 70 -7.836 -10.542 -23.644 1.00 0.00 N ATOM 0 H ARG A 70 -6.931 -4.306 -23.889 1.00 0.00 H new ATOM 0 HA ARG A 70 -9.157 -4.447 -25.731 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -7.819 -6.336 -23.764 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -9.309 -6.780 -24.572 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -8.291 -7.093 -26.595 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -7.159 -5.776 -26.360 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -5.840 -7.753 -26.300 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -5.975 -7.237 -24.631 1.00 0.00 H new ATOM 0 HE ARG A 70 -7.352 -9.570 -25.876 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -6.605 -7.638 -23.002 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -7.174 -8.884 -21.886 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -8.073 -11.150 -24.428 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -7.999 -10.857 -22.688 1.00 0.00 H new ATOM 948 N ASN A 71 -9.791 -3.503 -22.836 1.00 0.00 N ATOM 949 CA ASN A 71 -10.823 -3.197 -21.851 1.00 0.00 C ATOM 950 C ASN A 71 -11.851 -2.209 -22.403 1.00 0.00 C ATOM 951 O ASN A 71 -11.490 -1.198 -23.005 1.00 0.00 O ATOM 952 CB ASN A 71 -10.188 -2.626 -20.582 1.00 0.00 C ATOM 953 CG ASN A 71 -11.046 -2.855 -19.353 1.00 0.00 C ATOM 954 OD1 ASN A 71 -11.359 -1.919 -18.617 1.00 0.00 O ATOM 955 ND2 ASN A 71 -11.431 -4.105 -19.123 1.00 0.00 N ATOM 0 H ASN A 71 -8.946 -2.938 -22.753 1.00 0.00 H new ATOM 0 HA ASN A 71 -11.340 -4.127 -21.614 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -9.211 -3.084 -20.430 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -10.022 -1.557 -20.712 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -12.009 -4.319 -18.310 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -11.149 -4.851 -19.759 1.00 0.00 H new ATOM 962 N PRO A 72 -13.154 -2.483 -22.191 1.00 0.00 N ATOM 963 CA PRO A 72 -14.235 -1.607 -22.656 1.00 0.00 C ATOM 964 C PRO A 72 -14.227 -0.266 -21.931 1.00 0.00 C ATOM 965 O PRO A 72 -14.878 0.687 -22.359 1.00 0.00 O ATOM 966 CB PRO A 72 -15.518 -2.384 -22.324 1.00 0.00 C ATOM 967 CG PRO A 72 -15.075 -3.772 -22.006 1.00 0.00 C ATOM 968 CD PRO A 72 -13.677 -3.653 -21.474 1.00 0.00 C ATOM 0 HA PRO A 72 -14.137 -1.372 -23.716 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -16.040 -1.936 -21.479 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -16.210 -2.377 -23.166 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -15.734 -4.232 -21.270 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -15.101 -4.402 -22.895 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -13.667 -3.504 -20.394 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -13.089 -4.548 -21.678 1.00 0.00 H new ATOM 976 N ALA A 73 -13.470 -0.196 -20.841 1.00 0.00 N ATOM 977 CA ALA A 73 -13.353 1.019 -20.068 1.00 0.00 C ATOM 978 C ALA A 73 -12.329 1.909 -20.707 1.00 0.00 C ATOM 979 O ALA A 73 -12.514 3.117 -20.849 1.00 0.00 O ATOM 980 CB ALA A 73 -12.938 0.724 -18.642 1.00 0.00 C ATOM 0 H ALA A 73 -12.927 -0.979 -20.477 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.326 1.510 -20.047 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -12.858 1.658 -18.086 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.684 0.083 -18.171 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -11.973 0.218 -18.641 1.00 0.00 H new ATOM 986 N CYS A 74 -11.236 1.272 -21.089 1.00 0.00 N ATOM 987 CA CYS A 74 -10.139 1.942 -21.723 1.00 0.00 C ATOM 988 C CYS A 74 -10.627 2.934 -22.753 1.00 0.00 C ATOM 989 O CYS A 74 -11.564 2.669 -23.505 1.00 0.00 O ATOM 990 CB CYS A 74 -9.238 0.925 -22.386 1.00 0.00 C ATOM 991 SG CYS A 74 -7.544 0.909 -21.759 1.00 0.00 S ATOM 0 H CYS A 74 -11.094 0.270 -20.963 1.00 0.00 H new ATOM 0 HA CYS A 74 -9.584 2.487 -20.959 1.00 0.00 H new ATOM 0 HB2 CYS A 74 -9.671 -0.067 -22.254 1.00 0.00 H new ATOM 0 HB3 CYS A 74 -9.214 1.122 -23.458 1.00 0.00 H new ATOM 0 HG CYS A 74 -7.545 1.229 -20.499 1.00 0.00 H new ATOM 997 N ASP A 75 -9.966 4.065 -22.789 1.00 0.00 N ATOM 998 CA ASP A 75 -10.303 5.105 -23.744 1.00 0.00 C ATOM 999 C ASP A 75 -10.240 4.551 -25.167 1.00 0.00 C ATOM 1000 O ASP A 75 -10.807 5.134 -26.093 1.00 0.00 O ATOM 1001 CB ASP A 75 -9.348 6.292 -23.600 1.00 0.00 C ATOM 1002 CG ASP A 75 -9.538 7.029 -22.289 1.00 0.00 C ATOM 1003 OD1 ASP A 75 -9.005 6.561 -21.261 1.00 0.00 O ATOM 1004 OD2 ASP A 75 -10.216 8.078 -22.290 1.00 0.00 O ATOM 0 H ASP A 75 -9.189 4.294 -22.169 1.00 0.00 H new ATOM 0 HA ASP A 75 -11.318 5.448 -23.542 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -8.319 5.938 -23.669 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -9.504 6.983 -24.428 1.00 0.00 H new ATOM 1009 N TYR A 76 -9.552 3.417 -25.340 1.00 0.00 N ATOM 1010 CA TYR A 76 -9.431 2.792 -26.651 1.00 0.00 C ATOM 1011 C TYR A 76 -9.801 1.316 -26.580 1.00 0.00 C ATOM 1012 O TYR A 76 -9.128 0.530 -25.915 1.00 0.00 O ATOM 1013 CB TYR A 76 -8.008 2.951 -27.185 1.00 0.00 C ATOM 1014 CG TYR A 76 -7.885 2.719 -28.674 1.00 0.00 C ATOM 1015 CD1 TYR A 76 -8.717 3.375 -29.571 1.00 0.00 C ATOM 1016 CD2 TYR A 76 -6.930 1.846 -29.184 1.00 0.00 C ATOM 1017 CE1 TYR A 76 -8.604 3.169 -30.932 1.00 0.00 C ATOM 1018 CE2 TYR A 76 -6.809 1.637 -30.543 1.00 0.00 C ATOM 1019 CZ TYR A 76 -7.649 2.299 -31.413 1.00 0.00 C ATOM 1020 OH TYR A 76 -7.533 2.093 -32.768 1.00 0.00 O ATOM 0 H TYR A 76 -9.074 2.919 -24.589 1.00 0.00 H new ATOM 0 HA TYR A 76 -10.122 3.290 -27.332 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -7.653 3.955 -26.953 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -7.354 2.253 -26.663 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -9.466 4.058 -29.198 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -6.272 1.323 -28.506 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -9.260 3.687 -31.616 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -6.060 0.958 -30.923 1.00 0.00 H new ATOM 0 HH TYR A 76 -8.364 2.362 -33.212 1.00 0.00 H new ATOM 1030 N HIS A 77 -10.878 0.946 -27.263 1.00 0.00 N ATOM 1031 CA HIS A 77 -11.332 -0.438 -27.266 1.00 0.00 C ATOM 1032 C HIS A 77 -10.618 -1.250 -28.341 1.00 0.00 C ATOM 1033 O HIS A 77 -10.779 -0.997 -29.535 1.00 0.00 O ATOM 1034 CB HIS A 77 -12.844 -0.505 -27.480 1.00 0.00 C ATOM 1035 CG HIS A 77 -13.489 -1.646 -26.760 1.00 0.00 C ATOM 1036 ND1 HIS A 77 -14.701 -2.186 -27.131 1.00 0.00 N ATOM 1037 CD2 HIS A 77 -13.076 -2.354 -25.684 1.00 0.00 C ATOM 1038 CE1 HIS A 77 -15.008 -3.177 -26.313 1.00 0.00 C ATOM 1039 NE2 HIS A 77 -14.038 -3.301 -25.426 1.00 0.00 N ATOM 0 H HIS A 77 -11.450 1.582 -27.819 1.00 0.00 H new ATOM 0 HA HIS A 77 -11.091 -0.869 -26.294 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -13.294 0.429 -27.144 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -13.050 -0.593 -28.547 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -15.272 -1.870 -27.915 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -12.161 -2.203 -25.131 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -15.901 -3.783 -26.362 1.00 0.00 H new ATOM 1088 N ILE A 81 -6.831 -9.393 -28.126 1.00 0.00 N ATOM 1089 CA ILE A 81 -5.551 -10.090 -28.199 1.00 0.00 C ATOM 1090 C ILE A 81 -5.046 -10.474 -26.811 1.00 0.00 C ATOM 1091 O ILE A 81 -4.762 -9.610 -25.981 1.00 0.00 O ATOM 1092 CB ILE A 81 -4.483 -9.232 -28.902 1.00 0.00 C ATOM 1093 CG1 ILE A 81 -5.032 -8.676 -30.217 1.00 0.00 C ATOM 1094 CG2 ILE A 81 -3.225 -10.050 -29.150 1.00 0.00 C ATOM 1095 CD1 ILE A 81 -4.037 -7.823 -30.974 1.00 0.00 C ATOM 0 HA ILE A 81 -5.721 -10.996 -28.781 1.00 0.00 H new ATOM 0 HB ILE A 81 -4.225 -8.395 -28.254 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -5.344 -9.506 -30.851 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -5.922 -8.083 -30.008 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -2.480 -9.429 -29.648 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -2.827 -10.403 -28.199 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -3.466 -10.905 -29.782 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -4.494 -7.463 -31.896 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -3.744 -6.973 -30.358 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -3.156 -8.418 -31.214 1.00 0.00 H new ATOM 1107 N SER A 82 -4.928 -11.776 -26.566 1.00 0.00 N ATOM 1108 CA SER A 82 -4.456 -12.272 -25.277 1.00 0.00 C ATOM 1109 C SER A 82 -3.102 -11.663 -24.922 1.00 0.00 C ATOM 1110 O SER A 82 -2.840 -11.344 -23.764 1.00 0.00 O ATOM 1111 CB SER A 82 -4.349 -13.799 -25.301 1.00 0.00 C ATOM 1112 OG SER A 82 -5.351 -14.368 -26.127 1.00 0.00 O ATOM 0 H SER A 82 -5.152 -12.506 -27.242 1.00 0.00 H new ATOM 0 HA SER A 82 -5.179 -11.977 -24.517 1.00 0.00 H new ATOM 0 HB2 SER A 82 -3.364 -14.092 -25.665 1.00 0.00 H new ATOM 0 HB3 SER A 82 -4.444 -14.189 -24.288 1.00 0.00 H new ATOM 0 HG SER A 82 -5.260 -15.344 -26.127 1.00 0.00 H new ATOM 1118 N ARG A 83 -2.248 -11.504 -25.928 1.00 0.00 N ATOM 1119 CA ARG A 83 -0.921 -10.934 -25.723 1.00 0.00 C ATOM 1120 C ARG A 83 -1.013 -9.512 -25.177 1.00 0.00 C ATOM 1121 O ARG A 83 -0.076 -9.019 -24.549 1.00 0.00 O ATOM 1122 CB ARG A 83 -0.134 -10.939 -27.036 1.00 0.00 C ATOM 1123 CG ARG A 83 0.188 -12.334 -27.546 1.00 0.00 C ATOM 1124 CD ARG A 83 1.686 -12.585 -27.585 1.00 0.00 C ATOM 1125 NE ARG A 83 2.144 -13.352 -26.429 1.00 0.00 N ATOM 1126 CZ ARG A 83 3.304 -14.003 -26.382 1.00 0.00 C ATOM 1127 NH1 ARG A 83 4.126 -13.983 -27.424 1.00 0.00 N ATOM 1128 NH2 ARG A 83 3.642 -14.678 -25.292 1.00 0.00 N ATOM 0 H ARG A 83 -2.451 -11.762 -26.894 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.399 -11.549 -24.990 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -0.707 -10.407 -27.795 1.00 0.00 H new ATOM 0 HB3 ARG A 83 0.796 -10.389 -26.895 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -0.289 -13.075 -26.905 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -0.229 -12.462 -28.545 1.00 0.00 H new ATOM 0 HD2 ARG A 83 1.940 -13.121 -28.499 1.00 0.00 H new ATOM 0 HD3 ARG A 83 2.212 -11.631 -27.619 1.00 0.00 H new ATOM 0 HE ARG A 83 1.539 -13.391 -25.609 1.00 0.00 H new ATOM 0 HH11 ARG A 83 3.870 -13.467 -28.266 1.00 0.00 H new ATOM 0 HH12 ARG A 83 5.014 -14.484 -27.383 1.00 0.00 H new ATOM 0 HH21 ARG A 83 3.013 -14.698 -24.489 1.00 0.00 H new ATOM 0 HH22 ARG A 83 4.531 -15.177 -25.256 1.00 0.00 H new ATOM 1142 N LEU A 84 -2.143 -8.854 -25.420 1.00 0.00 N ATOM 1143 CA LEU A 84 -2.345 -7.489 -24.949 1.00 0.00 C ATOM 1144 C LEU A 84 -3.148 -7.468 -23.653 1.00 0.00 C ATOM 1145 O LEU A 84 -3.948 -8.368 -23.394 1.00 0.00 O ATOM 1146 CB LEU A 84 -3.056 -6.656 -26.018 1.00 0.00 C ATOM 1147 CG LEU A 84 -2.446 -6.745 -27.419 1.00 0.00 C ATOM 1148 CD1 LEU A 84 -3.330 -6.032 -28.432 1.00 0.00 C ATOM 1149 CD2 LEU A 84 -1.044 -6.157 -27.424 1.00 0.00 C ATOM 0 H LEU A 84 -2.930 -9.243 -25.939 1.00 0.00 H new ATOM 0 HA LEU A 84 -1.365 -7.054 -24.752 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -4.098 -6.973 -26.071 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.056 -5.612 -25.704 1.00 0.00 H new ATOM 0 HG LEU A 84 -2.380 -7.795 -27.702 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -2.881 -6.105 -29.422 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -4.316 -6.497 -28.445 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -3.427 -4.982 -28.155 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.623 -6.228 -28.427 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.087 -5.111 -27.121 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.415 -6.711 -26.727 1.00 0.00 H new ATOM 1161 N SER A 85 -2.927 -6.441 -22.836 1.00 0.00 N ATOM 1162 CA SER A 85 -3.631 -6.316 -21.560 1.00 0.00 C ATOM 1163 C SER A 85 -4.862 -5.417 -21.682 1.00 0.00 C ATOM 1164 O SER A 85 -5.003 -4.675 -22.654 1.00 0.00 O ATOM 1165 CB SER A 85 -2.688 -5.762 -20.491 1.00 0.00 C ATOM 1166 OG SER A 85 -1.535 -6.573 -20.356 1.00 0.00 O ATOM 0 H SER A 85 -2.270 -5.686 -23.032 1.00 0.00 H new ATOM 0 HA SER A 85 -3.968 -7.311 -21.269 1.00 0.00 H new ATOM 0 HB2 SER A 85 -2.393 -4.746 -20.754 1.00 0.00 H new ATOM 0 HB3 SER A 85 -3.210 -5.705 -19.536 1.00 0.00 H new ATOM 0 HG SER A 85 -1.790 -7.517 -20.415 1.00 0.00 H new ATOM 1172 N ASN A 86 -5.746 -5.478 -20.675 1.00 0.00 N ATOM 1173 CA ASN A 86 -6.962 -4.655 -20.652 1.00 0.00 C ATOM 1174 C ASN A 86 -6.633 -3.238 -21.096 1.00 0.00 C ATOM 1175 O ASN A 86 -7.235 -2.697 -22.021 1.00 0.00 O ATOM 1176 CB ASN A 86 -7.555 -4.632 -19.244 1.00 0.00 C ATOM 1177 CG ASN A 86 -8.820 -5.457 -19.130 1.00 0.00 C ATOM 1178 OD1 ASN A 86 -9.395 -5.877 -20.135 1.00 0.00 O ATOM 1179 ND2 ASN A 86 -9.264 -5.693 -17.901 1.00 0.00 N ATOM 0 H ASN A 86 -5.640 -6.090 -19.866 1.00 0.00 H new ATOM 0 HA ASN A 86 -7.693 -5.085 -21.336 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -6.816 -5.008 -18.537 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -7.771 -3.602 -18.962 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -10.113 -6.241 -17.762 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -8.756 -5.326 -17.096 1.00 0.00 H new ATOM 1186 N LYS A 87 -5.634 -2.674 -20.434 1.00 0.00 N ATOM 1187 CA LYS A 87 -5.130 -1.344 -20.742 1.00 0.00 C ATOM 1188 C LYS A 87 -3.674 -1.496 -21.132 1.00 0.00 C ATOM 1189 O LYS A 87 -2.771 -1.338 -20.310 1.00 0.00 O ATOM 1190 CB LYS A 87 -5.282 -0.410 -19.538 1.00 0.00 C ATOM 1191 CG LYS A 87 -4.720 -0.982 -18.247 1.00 0.00 C ATOM 1192 CD LYS A 87 -5.208 -0.204 -17.035 1.00 0.00 C ATOM 1193 CE LYS A 87 -4.406 1.070 -16.830 1.00 0.00 C ATOM 1194 NZ LYS A 87 -4.964 1.907 -15.733 1.00 0.00 N ATOM 0 H LYS A 87 -5.147 -3.130 -19.662 1.00 0.00 H new ATOM 0 HA LYS A 87 -5.698 -0.898 -21.558 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -4.781 0.533 -19.756 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -6.339 -0.184 -19.395 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -5.014 -2.027 -18.152 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -3.631 -0.959 -18.281 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -6.262 0.045 -17.161 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -5.133 -0.830 -16.146 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -3.371 0.815 -16.601 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -4.395 1.645 -17.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -4.389 2.767 -15.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -5.943 2.172 -15.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -4.951 1.368 -14.844 1.00 0.00 H new ATOM 1208 N HIS A 88 -3.466 -1.864 -22.387 1.00 0.00 N ATOM 1209 CA HIS A 88 -2.139 -2.115 -22.903 1.00 0.00 C ATOM 1210 C HIS A 88 -1.240 -0.900 -22.816 1.00 0.00 C ATOM 1211 O HIS A 88 -0.093 -0.998 -22.386 1.00 0.00 O ATOM 1212 CB HIS A 88 -2.207 -2.578 -24.349 1.00 0.00 C ATOM 1213 CG HIS A 88 -0.929 -3.198 -24.767 1.00 0.00 C ATOM 1214 ND1 HIS A 88 -0.738 -4.554 -24.790 1.00 0.00 N ATOM 1215 CD2 HIS A 88 0.262 -2.641 -25.066 1.00 0.00 C ATOM 1216 CE1 HIS A 88 0.519 -4.812 -25.074 1.00 0.00 C ATOM 1217 NE2 HIS A 88 1.156 -3.662 -25.249 1.00 0.00 N ATOM 0 H HIS A 88 -4.212 -1.995 -23.070 1.00 0.00 H new ATOM 0 HA HIS A 88 -1.709 -2.897 -22.277 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -3.019 -3.295 -24.467 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -2.433 -1.730 -24.996 1.00 0.00 H new ATOM 0 HD2 HIS A 88 0.472 -1.585 -25.146 1.00 0.00 H new ATOM 0 HE1 HIS A 88 0.959 -5.795 -25.152 1.00 0.00 H new ATOM 0 HE2 HIS A 88 2.144 -3.556 -25.481 1.00 0.00 H new ATOM 1226 N PHE A 89 -1.749 0.239 -23.234 1.00 0.00 N ATOM 1227 CA PHE A 89 -0.946 1.459 -23.200 1.00 0.00 C ATOM 1228 C PHE A 89 -1.787 2.683 -22.865 1.00 0.00 C ATOM 1229 O PHE A 89 -3.007 2.656 -22.982 1.00 0.00 O ATOM 1230 CB PHE A 89 -0.202 1.667 -24.521 1.00 0.00 C ATOM 1231 CG PHE A 89 -1.083 1.663 -25.738 1.00 0.00 C ATOM 1232 CD1 PHE A 89 -1.467 0.471 -26.328 1.00 0.00 C ATOM 1233 CD2 PHE A 89 -1.512 2.855 -26.299 1.00 0.00 C ATOM 1234 CE1 PHE A 89 -2.264 0.465 -27.456 1.00 0.00 C ATOM 1235 CE2 PHE A 89 -2.311 2.856 -27.426 1.00 0.00 C ATOM 1236 CZ PHE A 89 -2.686 1.661 -28.005 1.00 0.00 C ATOM 0 H PHE A 89 -2.696 0.354 -23.596 1.00 0.00 H new ATOM 0 HA PHE A 89 -0.211 1.334 -22.405 1.00 0.00 H new ATOM 0 HB2 PHE A 89 0.332 2.616 -24.477 1.00 0.00 H new ATOM 0 HB3 PHE A 89 0.548 0.884 -24.628 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -1.139 -0.465 -25.901 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -1.219 3.793 -25.851 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -2.557 -0.471 -27.908 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -2.642 3.791 -27.853 1.00 0.00 H new ATOM 0 HZ PHE A 89 -3.309 1.660 -28.887 1.00 0.00 H new ATOM 1246 N GLN A 90 -1.124 3.750 -22.424 1.00 0.00 N ATOM 1247 CA GLN A 90 -1.813 4.980 -22.049 1.00 0.00 C ATOM 1248 C GLN A 90 -1.089 6.210 -22.598 1.00 0.00 C ATOM 1249 O GLN A 90 0.139 6.250 -22.617 1.00 0.00 O ATOM 1250 CB GLN A 90 -1.898 5.064 -20.524 1.00 0.00 C ATOM 1251 CG GLN A 90 -3.058 5.902 -20.014 1.00 0.00 C ATOM 1252 CD GLN A 90 -2.997 6.128 -18.518 1.00 0.00 C ATOM 1253 OE1 GLN A 90 -1.842 6.563 -18.030 1.00 0.00 O flip ATOM 1254 NE2 GLN A 90 -3.980 5.916 -17.806 1.00 0.00 N flip ATOM 0 H GLN A 90 -0.110 3.786 -22.318 1.00 0.00 H new ATOM 0 HA GLN A 90 -2.815 4.962 -22.478 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -1.986 4.056 -20.119 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -0.966 5.481 -20.141 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -3.058 6.865 -20.524 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -3.997 5.408 -20.266 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -4.849 5.582 -18.223 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -3.925 6.075 -16.800 1.00 0.00 H new ATOM 1263 N ILE A 91 -1.842 7.223 -23.029 1.00 0.00 N ATOM 1264 CA ILE A 91 -1.226 8.444 -23.550 1.00 0.00 C ATOM 1265 C ILE A 91 -1.568 9.642 -22.672 1.00 0.00 C ATOM 1266 O ILE A 91 -2.733 9.890 -22.391 1.00 0.00 O ATOM 1267 CB ILE A 91 -1.669 8.739 -24.993 1.00 0.00 C ATOM 1268 CG1 ILE A 91 -1.386 7.534 -25.892 1.00 0.00 C ATOM 1269 CG2 ILE A 91 -0.958 9.979 -25.513 1.00 0.00 C ATOM 1270 CD1 ILE A 91 -1.995 7.653 -27.273 1.00 0.00 C ATOM 0 H ILE A 91 -2.862 7.224 -23.028 1.00 0.00 H new ATOM 0 HA ILE A 91 -0.149 8.278 -23.543 1.00 0.00 H new ATOM 0 HB ILE A 91 -2.743 8.927 -25.003 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -0.308 7.409 -25.989 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -1.769 6.634 -25.411 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -1.278 10.180 -26.535 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -1.205 10.832 -24.881 1.00 0.00 H new ATOM 0 HG23 ILE A 91 0.119 9.815 -25.496 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -1.754 6.763 -27.855 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -3.077 7.747 -27.186 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -1.593 8.534 -27.773 1.00 0.00 H new ATOM 1282 N LEU A 92 -0.552 10.385 -22.239 1.00 0.00 N ATOM 1283 CA LEU A 92 -0.775 11.545 -21.385 1.00 0.00 C ATOM 1284 C LEU A 92 -0.415 12.844 -22.096 1.00 0.00 C ATOM 1285 O LEU A 92 0.490 12.884 -22.928 1.00 0.00 O ATOM 1286 CB LEU A 92 0.044 11.416 -20.101 1.00 0.00 C ATOM 1287 CG LEU A 92 1.558 11.504 -20.291 1.00 0.00 C ATOM 1288 CD1 LEU A 92 2.176 12.443 -19.266 1.00 0.00 C ATOM 1289 CD2 LEU A 92 2.191 10.123 -20.201 1.00 0.00 C ATOM 0 H LEU A 92 0.426 10.205 -22.464 1.00 0.00 H new ATOM 0 HA LEU A 92 -1.837 11.577 -21.141 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -0.267 12.199 -19.409 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -0.193 10.462 -19.630 1.00 0.00 H new ATOM 0 HG LEU A 92 1.753 11.907 -21.285 1.00 0.00 H new ATOM 0 HD11 LEU A 92 3.254 12.491 -19.420 1.00 0.00 H new ATOM 0 HD12 LEU A 92 1.749 13.439 -19.381 1.00 0.00 H new ATOM 0 HD13 LEU A 92 1.969 12.073 -18.262 1.00 0.00 H new ATOM 0 HD21 LEU A 92 3.269 10.207 -20.339 1.00 0.00 H new ATOM 0 HD22 LEU A 92 1.983 9.691 -19.222 1.00 0.00 H new ATOM 0 HD23 LEU A 92 1.775 9.481 -20.977 1.00 0.00 H new ATOM 1301 N LEU A 93 -1.129 13.908 -21.744 1.00 0.00 N ATOM 1302 CA LEU A 93 -0.894 15.223 -22.325 1.00 0.00 C ATOM 1303 C LEU A 93 -0.642 16.250 -21.227 1.00 0.00 C ATOM 1304 O LEU A 93 -1.468 16.425 -20.330 1.00 0.00 O ATOM 1305 CB LEU A 93 -2.089 15.650 -23.182 1.00 0.00 C ATOM 1306 CG LEU A 93 -2.040 17.089 -23.700 1.00 0.00 C ATOM 1307 CD1 LEU A 93 -1.085 17.203 -24.877 1.00 0.00 C ATOM 1308 CD2 LEU A 93 -3.433 17.559 -24.092 1.00 0.00 C ATOM 0 H LEU A 93 -1.880 13.883 -21.054 1.00 0.00 H new ATOM 0 HA LEU A 93 -0.011 15.166 -22.961 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -2.162 14.976 -24.036 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -2.999 15.523 -22.596 1.00 0.00 H new ATOM 0 HG LEU A 93 -1.672 17.731 -22.900 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -1.065 18.234 -25.231 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -0.084 16.907 -24.563 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -1.421 16.550 -25.682 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -3.381 18.584 -24.458 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -3.828 16.913 -24.876 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -4.089 17.517 -23.223 1.00 0.00 H new ATOM 1375 N LEU A 99 2.975 16.208 -26.365 1.00 0.00 N ATOM 1376 CA LEU A 99 2.291 15.001 -25.912 1.00 0.00 C ATOM 1377 C LEU A 99 3.283 13.987 -25.354 1.00 0.00 C ATOM 1378 O LEU A 99 4.472 14.027 -25.672 1.00 0.00 O ATOM 1379 CB LEU A 99 1.501 14.375 -27.063 1.00 0.00 C ATOM 1380 CG LEU A 99 0.204 15.101 -27.430 1.00 0.00 C ATOM 1381 CD1 LEU A 99 0.439 16.067 -28.580 1.00 0.00 C ATOM 1382 CD2 LEU A 99 -0.884 14.098 -27.787 1.00 0.00 C ATOM 0 HA LEU A 99 1.602 15.284 -25.116 1.00 0.00 H new ATOM 0 HB2 LEU A 99 2.141 14.338 -27.945 1.00 0.00 H new ATOM 0 HB3 LEU A 99 1.261 13.345 -26.800 1.00 0.00 H new ATOM 0 HG LEU A 99 -0.127 15.675 -26.564 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -0.494 16.573 -28.826 1.00 0.00 H new ATOM 0 HD12 LEU A 99 1.186 16.805 -28.288 1.00 0.00 H new ATOM 0 HD13 LEU A 99 0.794 15.516 -29.451 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -1.799 14.631 -28.045 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -0.561 13.498 -28.638 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -1.072 13.446 -26.934 1.00 0.00 H new ATOM 1394 N LEU A 100 2.785 13.077 -24.523 1.00 0.00 N ATOM 1395 CA LEU A 100 3.622 12.049 -23.923 1.00 0.00 C ATOM 1396 C LEU A 100 2.947 10.689 -24.048 1.00 0.00 C ATOM 1397 O LEU A 100 1.720 10.591 -24.011 1.00 0.00 O ATOM 1398 CB LEU A 100 3.886 12.376 -22.450 1.00 0.00 C ATOM 1399 CG LEU A 100 5.137 13.215 -22.182 1.00 0.00 C ATOM 1400 CD1 LEU A 100 4.951 14.062 -20.931 1.00 0.00 C ATOM 1401 CD2 LEU A 100 6.364 12.323 -22.050 1.00 0.00 C ATOM 0 H LEU A 100 1.803 13.032 -24.250 1.00 0.00 H new ATOM 0 HA LEU A 100 4.576 12.018 -24.450 1.00 0.00 H new ATOM 0 HB2 LEU A 100 3.021 12.906 -22.051 1.00 0.00 H new ATOM 0 HB3 LEU A 100 3.970 11.441 -21.896 1.00 0.00 H new ATOM 0 HG LEU A 100 5.292 13.883 -23.030 1.00 0.00 H new ATOM 0 HD11 LEU A 100 5.850 14.653 -20.755 1.00 0.00 H new ATOM 0 HD12 LEU A 100 4.099 14.729 -21.066 1.00 0.00 H new ATOM 0 HD13 LEU A 100 4.770 13.412 -20.075 1.00 0.00 H new ATOM 0 HD21 LEU A 100 7.243 12.939 -21.860 1.00 0.00 H new ATOM 0 HD22 LEU A 100 6.222 11.628 -21.222 1.00 0.00 H new ATOM 0 HD23 LEU A 100 6.507 11.762 -22.974 1.00 0.00 H new ATOM 1413 N LEU A 101 3.747 9.642 -24.201 1.00 0.00 N ATOM 1414 CA LEU A 101 3.212 8.292 -24.337 1.00 0.00 C ATOM 1415 C LEU A 101 3.579 7.449 -23.124 1.00 0.00 C ATOM 1416 O LEU A 101 4.752 7.330 -22.775 1.00 0.00 O ATOM 1417 CB LEU A 101 3.749 7.633 -25.611 1.00 0.00 C ATOM 1418 CG LEU A 101 2.777 7.626 -26.794 1.00 0.00 C ATOM 1419 CD1 LEU A 101 3.538 7.630 -28.111 1.00 0.00 C ATOM 1420 CD2 LEU A 101 1.852 6.421 -26.713 1.00 0.00 C ATOM 0 H LEU A 101 4.765 9.700 -24.234 1.00 0.00 H new ATOM 0 HA LEU A 101 2.126 8.358 -24.403 1.00 0.00 H new ATOM 0 HB2 LEU A 101 4.661 8.149 -25.912 1.00 0.00 H new ATOM 0 HB3 LEU A 101 4.026 6.604 -25.381 1.00 0.00 H new ATOM 0 HG LEU A 101 2.170 8.530 -26.748 1.00 0.00 H new ATOM 0 HD11 LEU A 101 2.830 7.625 -28.940 1.00 0.00 H new ATOM 0 HD12 LEU A 101 4.159 8.524 -28.170 1.00 0.00 H new ATOM 0 HD13 LEU A 101 4.171 6.744 -28.168 1.00 0.00 H new ATOM 0 HD21 LEU A 101 1.167 6.430 -27.561 1.00 0.00 H new ATOM 0 HD22 LEU A 101 2.444 5.506 -26.735 1.00 0.00 H new ATOM 0 HD23 LEU A 101 1.281 6.462 -25.785 1.00 0.00 H new ATOM 1432 N ASN A 102 2.572 6.869 -22.479 1.00 0.00 N ATOM 1433 CA ASN A 102 2.813 6.045 -21.301 1.00 0.00 C ATOM 1434 C ASN A 102 2.432 4.596 -21.555 1.00 0.00 C ATOM 1435 O ASN A 102 1.263 4.278 -21.761 1.00 0.00 O ATOM 1436 CB ASN A 102 2.030 6.576 -20.104 1.00 0.00 C ATOM 1437 CG ASN A 102 2.639 6.156 -18.789 1.00 0.00 C ATOM 1438 OD1 ASN A 102 3.860 6.113 -18.639 1.00 0.00 O ATOM 1439 ND2 ASN A 102 1.789 5.842 -17.826 1.00 0.00 N ATOM 0 H ASN A 102 1.592 6.953 -22.748 1.00 0.00 H new ATOM 0 HA ASN A 102 3.880 6.091 -21.082 1.00 0.00 H new ATOM 0 HB2 ASN A 102 1.991 7.664 -20.152 1.00 0.00 H new ATOM 0 HB3 ASN A 102 1.002 6.217 -20.157 1.00 0.00 H new ATOM 0 HD21 ASN A 102 2.138 5.549 -16.913 1.00 0.00 H new ATOM 0 HD22 ASN A 102 0.785 5.892 -17.996 1.00 0.00 H new ATOM 1446 N ASP A 103 3.422 3.717 -21.519 1.00 0.00 N ATOM 1447 CA ASP A 103 3.181 2.299 -21.729 1.00 0.00 C ATOM 1448 C ASP A 103 2.638 1.665 -20.451 1.00 0.00 C ATOM 1449 O ASP A 103 3.109 1.961 -19.356 1.00 0.00 O ATOM 1450 CB ASP A 103 4.471 1.610 -22.179 1.00 0.00 C ATOM 1451 CG ASP A 103 5.669 1.995 -21.342 1.00 0.00 C ATOM 1452 OD1 ASP A 103 5.498 2.747 -20.361 1.00 0.00 O ATOM 1453 OD2 ASP A 103 6.783 1.542 -21.675 1.00 0.00 O ATOM 0 H ASP A 103 4.397 3.961 -21.347 1.00 0.00 H new ATOM 0 HA ASP A 103 2.435 2.174 -22.514 1.00 0.00 H new ATOM 0 HB2 ASP A 103 4.335 0.530 -22.133 1.00 0.00 H new ATOM 0 HB3 ASP A 103 4.667 1.862 -23.221 1.00 0.00 H new ATOM 1458 N ILE A 104 1.625 0.813 -20.589 1.00 0.00 N ATOM 1459 CA ILE A 104 1.008 0.170 -19.431 1.00 0.00 C ATOM 1460 C ILE A 104 0.535 -1.250 -19.750 1.00 0.00 C ATOM 1461 O ILE A 104 -0.541 -1.658 -19.314 1.00 0.00 O ATOM 1462 CB ILE A 104 -0.211 0.980 -18.934 1.00 0.00 C ATOM 1463 CG1 ILE A 104 -1.201 1.188 -20.077 1.00 0.00 C ATOM 1464 CG2 ILE A 104 0.216 2.324 -18.364 1.00 0.00 C ATOM 1465 CD1 ILE A 104 -2.589 1.564 -19.613 1.00 0.00 C ATOM 0 H ILE A 104 1.215 0.553 -21.486 1.00 0.00 H new ATOM 0 HA ILE A 104 1.776 0.129 -18.659 1.00 0.00 H new ATOM 0 HB ILE A 104 -0.693 0.412 -18.138 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -0.823 1.969 -20.736 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -1.259 0.273 -20.667 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -0.663 2.870 -18.023 1.00 0.00 H new ATOM 0 HG22 ILE A 104 0.893 2.165 -17.524 1.00 0.00 H new ATOM 0 HG23 ILE A 104 0.725 2.901 -19.136 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -3.239 1.696 -20.478 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -2.987 0.773 -18.978 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -2.544 2.495 -19.048 1.00 0.00 H new ATOM 1477 N SER A 105 1.318 -1.996 -20.524 1.00 0.00 N ATOM 1478 CA SER A 105 0.946 -3.336 -20.901 1.00 0.00 C ATOM 1479 C SER A 105 1.663 -4.380 -20.057 1.00 0.00 C ATOM 1480 O SER A 105 2.776 -4.158 -19.584 1.00 0.00 O ATOM 1481 CB SER A 105 1.320 -3.547 -22.349 1.00 0.00 C ATOM 1482 OG SER A 105 1.816 -2.369 -22.936 1.00 0.00 O ATOM 0 H SER A 105 2.214 -1.685 -20.898 1.00 0.00 H new ATOM 0 HA SER A 105 -0.127 -3.451 -20.745 1.00 0.00 H new ATOM 0 HB2 SER A 105 2.072 -4.333 -22.420 1.00 0.00 H new ATOM 0 HB3 SER A 105 0.447 -3.890 -22.904 1.00 0.00 H new ATOM 0 HG SER A 105 1.157 -1.651 -22.836 1.00 0.00 H new ATOM 1488 N THR A 106 1.030 -5.534 -19.913 1.00 0.00 N ATOM 1489 CA THR A 106 1.619 -6.634 -19.170 1.00 0.00 C ATOM 1490 C THR A 106 2.819 -7.193 -19.933 1.00 0.00 C ATOM 1491 O THR A 106 3.773 -7.690 -19.336 1.00 0.00 O ATOM 1492 CB THR A 106 0.580 -7.735 -18.939 1.00 0.00 C ATOM 1493 OG1 THR A 106 -0.458 -7.274 -18.093 1.00 0.00 O ATOM 1494 CG2 THR A 106 1.157 -8.989 -18.315 1.00 0.00 C ATOM 0 H THR A 106 0.108 -5.732 -20.302 1.00 0.00 H new ATOM 0 HA THR A 106 1.955 -6.265 -18.201 1.00 0.00 H new ATOM 0 HB THR A 106 0.203 -7.985 -19.931 1.00 0.00 H new ATOM 0 HG1 THR A 106 -1.170 -6.876 -18.636 1.00 0.00 H new ATOM 0 HG21 THR A 106 0.365 -9.726 -18.180 1.00 0.00 H new ATOM 0 HG22 THR A 106 1.927 -9.399 -18.968 1.00 0.00 H new ATOM 0 HG23 THR A 106 1.595 -8.745 -17.347 1.00 0.00 H new ATOM 1502 N ASN A 107 2.749 -7.125 -21.266 1.00 0.00 N ATOM 1503 CA ASN A 107 3.816 -7.643 -22.116 1.00 0.00 C ATOM 1504 C ASN A 107 4.776 -6.553 -22.601 1.00 0.00 C ATOM 1505 O ASN A 107 5.902 -6.854 -22.994 1.00 0.00 O ATOM 1506 CB ASN A 107 3.214 -8.372 -23.305 1.00 0.00 C ATOM 1507 CG ASN A 107 3.464 -9.864 -23.262 1.00 0.00 C ATOM 1508 OD1 ASN A 107 4.490 -10.321 -22.759 1.00 0.00 O ATOM 1509 ND2 ASN A 107 2.524 -10.629 -23.796 1.00 0.00 N ATOM 0 H ASN A 107 1.965 -6.717 -21.775 1.00 0.00 H new ATOM 0 HA ASN A 107 4.404 -8.332 -21.509 1.00 0.00 H new ATOM 0 HB2 ASN A 107 2.140 -8.188 -23.333 1.00 0.00 H new ATOM 0 HB3 ASN A 107 3.631 -7.964 -24.226 1.00 0.00 H new ATOM 0 HD21 ASN A 107 2.634 -11.643 -23.802 1.00 0.00 H new ATOM 0 HD22 ASN A 107 1.690 -10.204 -24.202 1.00 0.00 H new ATOM 1516 N GLY A 108 4.346 -5.290 -22.567 1.00 0.00 N ATOM 1517 CA GLY A 108 5.206 -4.219 -22.999 1.00 0.00 C ATOM 1518 C GLY A 108 4.656 -3.426 -24.172 1.00 0.00 C ATOM 1519 O GLY A 108 3.829 -3.915 -24.941 1.00 0.00 O ATOM 0 H GLY A 108 3.421 -5.000 -22.248 1.00 0.00 H new ATOM 0 HA2 GLY A 108 5.375 -3.542 -22.162 1.00 0.00 H new ATOM 0 HA3 GLY A 108 6.176 -4.633 -23.275 1.00 0.00 H new ATOM 1523 N THR A 109 5.141 -2.196 -24.301 1.00 0.00 N ATOM 1524 CA THR A 109 4.738 -1.290 -25.376 1.00 0.00 C ATOM 1525 C THR A 109 5.946 -0.958 -26.239 1.00 0.00 C ATOM 1526 O THR A 109 7.045 -0.756 -25.724 1.00 0.00 O ATOM 1527 CB THR A 109 4.137 -0.008 -24.799 1.00 0.00 C ATOM 1528 OG1 THR A 109 3.211 -0.307 -23.772 1.00 0.00 O ATOM 1529 CG2 THR A 109 3.419 0.841 -25.828 1.00 0.00 C ATOM 0 H THR A 109 5.827 -1.796 -23.662 1.00 0.00 H new ATOM 0 HA THR A 109 3.980 -1.780 -25.987 1.00 0.00 H new ATOM 0 HB THR A 109 4.987 0.558 -24.417 1.00 0.00 H new ATOM 0 HG1 THR A 109 2.911 -1.236 -23.862 1.00 0.00 H new ATOM 0 HG21 THR A 109 3.018 1.734 -25.348 1.00 0.00 H new ATOM 0 HG22 THR A 109 4.119 1.133 -26.611 1.00 0.00 H new ATOM 0 HG23 THR A 109 2.602 0.268 -26.267 1.00 0.00 H new ATOM 1537 N TRP A 110 5.758 -0.939 -27.552 1.00 0.00 N ATOM 1538 CA TRP A 110 6.865 -0.674 -28.460 1.00 0.00 C ATOM 1539 C TRP A 110 6.701 0.595 -29.271 1.00 0.00 C ATOM 1540 O TRP A 110 5.595 0.981 -29.645 1.00 0.00 O ATOM 1541 CB TRP A 110 7.046 -1.846 -29.412 1.00 0.00 C ATOM 1542 CG TRP A 110 7.974 -2.856 -28.884 1.00 0.00 C ATOM 1543 CD1 TRP A 110 9.244 -3.081 -29.293 1.00 0.00 C ATOM 1544 CD2 TRP A 110 7.706 -3.780 -27.834 1.00 0.00 C ATOM 1545 NE1 TRP A 110 9.794 -4.087 -28.561 1.00 0.00 N ATOM 1546 CE2 TRP A 110 8.867 -4.546 -27.656 1.00 0.00 C ATOM 1547 CE3 TRP A 110 6.594 -4.032 -27.027 1.00 0.00 C ATOM 1548 CZ2 TRP A 110 8.952 -5.553 -26.701 1.00 0.00 C ATOM 1549 CZ3 TRP A 110 6.676 -5.028 -26.078 1.00 0.00 C ATOM 1550 CH2 TRP A 110 7.848 -5.780 -25.921 1.00 0.00 C ATOM 0 H TRP A 110 4.860 -1.102 -28.008 1.00 0.00 H new ATOM 0 HA TRP A 110 7.744 -0.539 -27.829 1.00 0.00 H new ATOM 0 HB2 TRP A 110 6.078 -2.310 -29.602 1.00 0.00 H new ATOM 0 HB3 TRP A 110 7.417 -1.480 -30.369 1.00 0.00 H new ATOM 0 HD1 TRP A 110 9.746 -2.542 -30.083 1.00 0.00 H new ATOM 0 HE1 TRP A 110 10.744 -4.444 -28.667 1.00 0.00 H new ATOM 0 HE3 TRP A 110 5.687 -3.457 -27.145 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 9.854 -6.134 -26.578 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 5.824 -5.232 -25.446 1.00 0.00 H new ATOM 0 HH2 TRP A 110 7.882 -6.555 -25.169 1.00 0.00 H new ATOM 1561 N LEU A 111 7.836 1.209 -29.577 1.00 0.00 N ATOM 1562 CA LEU A 111 7.869 2.405 -30.394 1.00 0.00 C ATOM 1563 C LEU A 111 8.785 2.166 -31.584 1.00 0.00 C ATOM 1564 O LEU A 111 9.994 1.994 -31.432 1.00 0.00 O ATOM 1565 CB LEU A 111 8.354 3.603 -29.577 1.00 0.00 C ATOM 1566 CG LEU A 111 7.252 4.327 -28.801 1.00 0.00 C ATOM 1567 CD1 LEU A 111 7.750 4.746 -27.426 1.00 0.00 C ATOM 1568 CD2 LEU A 111 6.751 5.533 -29.582 1.00 0.00 C ATOM 0 H LEU A 111 8.754 0.890 -29.265 1.00 0.00 H new ATOM 0 HA LEU A 111 6.863 2.629 -30.748 1.00 0.00 H new ATOM 0 HB2 LEU A 111 9.114 3.264 -28.873 1.00 0.00 H new ATOM 0 HB3 LEU A 111 8.836 4.314 -30.248 1.00 0.00 H new ATOM 0 HG LEU A 111 6.419 3.637 -28.666 1.00 0.00 H new ATOM 0 HD11 LEU A 111 6.951 5.259 -26.891 1.00 0.00 H new ATOM 0 HD12 LEU A 111 8.054 3.863 -26.864 1.00 0.00 H new ATOM 0 HD13 LEU A 111 8.602 5.417 -27.536 1.00 0.00 H new ATOM 0 HD21 LEU A 111 5.968 6.035 -29.014 1.00 0.00 H new ATOM 0 HD22 LEU A 111 7.576 6.225 -29.752 1.00 0.00 H new ATOM 0 HD23 LEU A 111 6.350 5.205 -30.541 1.00 0.00 H new ATOM 1580 N ASN A 112 8.195 2.147 -32.770 1.00 0.00 N ATOM 1581 CA ASN A 112 8.938 1.915 -34.002 1.00 0.00 C ATOM 1582 C ASN A 112 9.889 0.728 -33.887 1.00 0.00 C ATOM 1583 O ASN A 112 10.974 0.733 -34.470 1.00 0.00 O ATOM 1584 CB ASN A 112 9.708 3.173 -34.408 1.00 0.00 C ATOM 1585 CG ASN A 112 8.794 4.360 -34.641 1.00 0.00 C ATOM 1586 OD1 ASN A 112 8.396 4.640 -35.772 1.00 0.00 O ATOM 1587 ND2 ASN A 112 8.459 5.068 -33.568 1.00 0.00 N ATOM 0 H ASN A 112 7.194 2.291 -32.907 1.00 0.00 H new ATOM 0 HA ASN A 112 8.209 1.675 -34.776 1.00 0.00 H new ATOM 0 HB2 ASN A 112 10.430 3.421 -33.630 1.00 0.00 H new ATOM 0 HB3 ASN A 112 10.276 2.971 -35.316 1.00 0.00 H new ATOM 0 HD21 ASN A 112 7.849 5.880 -33.663 1.00 0.00 H new ATOM 0 HD22 ASN A 112 8.812 4.800 -32.649 1.00 0.00 H new ATOM 1594 N GLY A 113 9.468 -0.299 -33.155 1.00 0.00 N ATOM 1595 CA GLY A 113 10.280 -1.478 -33.008 1.00 0.00 C ATOM 1596 C GLY A 113 11.162 -1.454 -31.778 1.00 0.00 C ATOM 1597 O GLY A 113 11.781 -2.464 -31.439 1.00 0.00 O ATOM 0 H GLY A 113 8.575 -0.329 -32.662 1.00 0.00 H new ATOM 0 HA2 GLY A 113 9.631 -2.353 -32.963 1.00 0.00 H new ATOM 0 HA3 GLY A 113 10.907 -1.591 -33.893 1.00 0.00 H new ATOM 1601 N GLN A 114 11.224 -0.314 -31.100 1.00 0.00 N ATOM 1602 CA GLN A 114 12.041 -0.203 -29.902 1.00 0.00 C ATOM 1603 C GLN A 114 11.168 -0.172 -28.654 1.00 0.00 C ATOM 1604 O GLN A 114 10.345 0.726 -28.479 1.00 0.00 O ATOM 1605 CB GLN A 114 12.907 1.056 -29.966 1.00 0.00 C ATOM 1606 CG GLN A 114 14.174 0.966 -29.130 1.00 0.00 C ATOM 1607 CD GLN A 114 15.110 2.137 -29.362 1.00 0.00 C ATOM 1608 OE1 GLN A 114 15.875 2.152 -30.325 1.00 0.00 O ATOM 1609 NE2 GLN A 114 15.053 3.125 -28.476 1.00 0.00 N ATOM 0 H GLN A 114 10.724 0.537 -31.357 1.00 0.00 H new ATOM 0 HA GLN A 114 12.689 -1.078 -29.849 1.00 0.00 H new ATOM 0 HB2 GLN A 114 13.179 1.247 -31.004 1.00 0.00 H new ATOM 0 HB3 GLN A 114 12.319 1.909 -29.628 1.00 0.00 H new ATOM 0 HG2 GLN A 114 13.906 0.923 -28.074 1.00 0.00 H new ATOM 0 HG3 GLN A 114 14.695 0.037 -29.365 1.00 0.00 H new ATOM 0 HE21 GLN A 114 14.403 3.070 -27.692 1.00 0.00 H new ATOM 0 HE22 GLN A 114 15.659 3.939 -28.580 1.00 0.00 H new ATOM 1618 N LYS A 115 11.355 -1.164 -27.794 1.00 0.00 N ATOM 1619 CA LYS A 115 10.603 -1.273 -26.569 1.00 0.00 C ATOM 1620 C LYS A 115 11.025 -0.202 -25.564 1.00 0.00 C ATOM 1621 O LYS A 115 12.212 0.080 -25.401 1.00 0.00 O ATOM 1622 CB LYS A 115 10.815 -2.680 -26.015 1.00 0.00 C ATOM 1623 CG LYS A 115 10.823 -2.779 -24.495 1.00 0.00 C ATOM 1624 CD LYS A 115 10.641 -4.216 -24.027 1.00 0.00 C ATOM 1625 CE LYS A 115 9.319 -4.402 -23.300 1.00 0.00 C ATOM 1626 NZ LYS A 115 8.972 -5.841 -23.141 1.00 0.00 N ATOM 0 H LYS A 115 12.034 -1.912 -27.934 1.00 0.00 H new ATOM 0 HA LYS A 115 9.543 -1.109 -26.762 1.00 0.00 H new ATOM 0 HB2 LYS A 115 10.029 -3.329 -26.402 1.00 0.00 H new ATOM 0 HB3 LYS A 115 11.762 -3.065 -26.394 1.00 0.00 H new ATOM 0 HG2 LYS A 115 11.764 -2.386 -24.109 1.00 0.00 H new ATOM 0 HG3 LYS A 115 10.026 -2.158 -24.085 1.00 0.00 H new ATOM 0 HD2 LYS A 115 10.683 -4.887 -24.885 1.00 0.00 H new ATOM 0 HD3 LYS A 115 11.463 -4.491 -23.366 1.00 0.00 H new ATOM 0 HE2 LYS A 115 9.375 -3.931 -22.319 1.00 0.00 H new ATOM 0 HE3 LYS A 115 8.527 -3.896 -23.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 8.064 -5.926 -22.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 8.894 -6.285 -24.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 9.715 -6.319 -22.593 1.00 0.00 H new ATOM 1640 N VAL A 116 10.040 0.397 -24.900 1.00 0.00 N ATOM 1641 CA VAL A 116 10.302 1.443 -23.919 1.00 0.00 C ATOM 1642 C VAL A 116 9.983 0.973 -22.500 1.00 0.00 C ATOM 1643 O VAL A 116 9.360 -0.071 -22.308 1.00 0.00 O ATOM 1644 CB VAL A 116 9.489 2.721 -24.227 1.00 0.00 C ATOM 1645 CG1 VAL A 116 9.677 3.130 -25.680 1.00 0.00 C ATOM 1646 CG2 VAL A 116 8.010 2.519 -23.911 1.00 0.00 C ATOM 0 H VAL A 116 9.052 0.175 -25.025 1.00 0.00 H new ATOM 0 HA VAL A 116 11.365 1.673 -23.984 1.00 0.00 H new ATOM 0 HB VAL A 116 9.861 3.523 -23.589 1.00 0.00 H new ATOM 0 HG11 VAL A 116 9.098 4.031 -25.882 1.00 0.00 H new ATOM 0 HG12 VAL A 116 10.732 3.326 -25.869 1.00 0.00 H new ATOM 0 HG13 VAL A 116 9.335 2.326 -26.332 1.00 0.00 H new ATOM 0 HG21 VAL A 116 7.461 3.433 -24.137 1.00 0.00 H new ATOM 0 HG22 VAL A 116 7.617 1.701 -24.516 1.00 0.00 H new ATOM 0 HG23 VAL A 116 7.893 2.278 -22.854 1.00 0.00 H new ATOM 1656 N GLU A 117 10.411 1.757 -21.516 1.00 0.00 N ATOM 1657 CA GLU A 117 10.166 1.430 -20.116 1.00 0.00 C ATOM 1658 C GLU A 117 8.689 1.591 -19.778 1.00 0.00 C ATOM 1659 O GLU A 117 8.107 2.648 -20.012 1.00 0.00 O ATOM 1660 CB GLU A 117 11.006 2.333 -19.210 1.00 0.00 C ATOM 1661 CG GLU A 117 11.066 1.860 -17.766 1.00 0.00 C ATOM 1662 CD GLU A 117 12.348 2.271 -17.072 1.00 0.00 C ATOM 1663 OE1 GLU A 117 12.771 3.434 -17.244 1.00 0.00 O ATOM 1664 OE2 GLU A 117 12.930 1.431 -16.353 1.00 0.00 O ATOM 0 H GLU A 117 10.929 2.623 -21.662 1.00 0.00 H new ATOM 0 HA GLU A 117 10.451 0.391 -19.951 1.00 0.00 H new ATOM 0 HB2 GLU A 117 12.019 2.390 -19.607 1.00 0.00 H new ATOM 0 HB3 GLU A 117 10.596 3.343 -19.236 1.00 0.00 H new ATOM 0 HG2 GLU A 117 10.215 2.265 -17.219 1.00 0.00 H new ATOM 0 HG3 GLU A 117 10.974 0.774 -17.739 1.00 0.00 H new ATOM 1671 N LYS A 118 8.084 0.539 -19.230 1.00 0.00 N ATOM 1672 CA LYS A 118 6.670 0.584 -18.867 1.00 0.00 C ATOM 1673 C LYS A 118 6.382 1.785 -17.974 1.00 0.00 C ATOM 1674 O LYS A 118 7.292 2.378 -17.397 1.00 0.00 O ATOM 1675 CB LYS A 118 6.252 -0.705 -18.163 1.00 0.00 C ATOM 1676 CG LYS A 118 4.755 -0.821 -17.937 1.00 0.00 C ATOM 1677 CD LYS A 118 4.312 -2.274 -17.879 1.00 0.00 C ATOM 1678 CE LYS A 118 2.943 -2.413 -17.234 1.00 0.00 C ATOM 1679 NZ LYS A 118 2.631 -3.829 -16.893 1.00 0.00 N ATOM 0 H LYS A 118 8.546 -0.348 -19.029 1.00 0.00 H new ATOM 0 HA LYS A 118 6.089 0.684 -19.784 1.00 0.00 H new ATOM 0 HB2 LYS A 118 6.588 -1.557 -18.755 1.00 0.00 H new ATOM 0 HB3 LYS A 118 6.761 -0.764 -17.201 1.00 0.00 H new ATOM 0 HG2 LYS A 118 4.486 -0.320 -17.007 1.00 0.00 H new ATOM 0 HG3 LYS A 118 4.224 -0.309 -18.740 1.00 0.00 H new ATOM 0 HD2 LYS A 118 4.284 -2.688 -18.887 1.00 0.00 H new ATOM 0 HD3 LYS A 118 5.042 -2.856 -17.316 1.00 0.00 H new ATOM 0 HE2 LYS A 118 2.904 -1.805 -16.330 1.00 0.00 H new ATOM 0 HE3 LYS A 118 2.182 -2.026 -17.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 1.663 -3.891 -16.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 2.709 -4.417 -17.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 3.303 -4.169 -16.175 1.00 0.00 H new ATOM 1693 N ASN A 119 5.104 2.132 -17.880 1.00 0.00 N ATOM 1694 CA ASN A 119 4.638 3.268 -17.078 1.00 0.00 C ATOM 1695 C ASN A 119 5.633 4.425 -17.087 1.00 0.00 C ATOM 1696 O ASN A 119 5.773 5.149 -16.102 1.00 0.00 O ATOM 1697 CB ASN A 119 4.348 2.840 -15.639 1.00 0.00 C ATOM 1698 CG ASN A 119 3.807 1.428 -15.537 1.00 0.00 C ATOM 1699 OD1 ASN A 119 2.720 1.130 -16.034 1.00 0.00 O ATOM 1700 ND2 ASN A 119 4.563 0.550 -14.889 1.00 0.00 N ATOM 0 H ASN A 119 4.354 1.634 -18.359 1.00 0.00 H new ATOM 0 HA ASN A 119 3.714 3.619 -17.538 1.00 0.00 H new ATOM 0 HB2 ASN A 119 5.263 2.915 -15.052 1.00 0.00 H new ATOM 0 HB3 ASN A 119 3.629 3.531 -15.198 1.00 0.00 H new ATOM 0 HD21 ASN A 119 4.250 -0.415 -14.787 1.00 0.00 H new ATOM 0 HD22 ASN A 119 5.457 0.841 -14.493 1.00 0.00 H new ATOM 1707 N SER A 120 6.307 4.592 -18.213 1.00 0.00 N ATOM 1708 CA SER A 120 7.283 5.664 -18.374 1.00 0.00 C ATOM 1709 C SER A 120 6.799 6.693 -19.391 1.00 0.00 C ATOM 1710 O SER A 120 6.143 6.347 -20.372 1.00 0.00 O ATOM 1711 CB SER A 120 8.635 5.102 -18.784 1.00 0.00 C ATOM 1712 OG SER A 120 9.689 5.756 -18.100 1.00 0.00 O ATOM 0 H SER A 120 6.197 3.997 -19.034 1.00 0.00 H new ATOM 0 HA SER A 120 7.396 6.165 -17.412 1.00 0.00 H new ATOM 0 HB2 SER A 120 8.667 4.033 -18.571 1.00 0.00 H new ATOM 0 HB3 SER A 120 8.769 5.217 -19.860 1.00 0.00 H new ATOM 0 HG SER A 120 10.547 5.375 -18.380 1.00 0.00 H new ATOM 1718 N ASN A 121 7.127 7.958 -19.152 1.00 0.00 N ATOM 1719 CA ASN A 121 6.723 9.032 -20.051 1.00 0.00 C ATOM 1720 C ASN A 121 7.733 9.209 -21.179 1.00 0.00 C ATOM 1721 O ASN A 121 8.941 9.243 -20.945 1.00 0.00 O ATOM 1722 CB ASN A 121 6.572 10.347 -19.283 1.00 0.00 C ATOM 1723 CG ASN A 121 5.748 10.189 -18.022 1.00 0.00 C ATOM 1724 OD1 ASN A 121 4.490 10.609 -18.085 1.00 0.00 O flip ATOM 1725 ND2 ASN A 121 6.235 9.696 -17.004 1.00 0.00 N flip ATOM 0 H ASN A 121 7.670 8.264 -18.345 1.00 0.00 H new ATOM 0 HA ASN A 121 5.761 8.759 -20.484 1.00 0.00 H new ATOM 0 HB2 ASN A 121 7.560 10.728 -19.023 1.00 0.00 H new ATOM 0 HB3 ASN A 121 6.104 11.090 -19.929 1.00 0.00 H new ATOM 0 HD21 ASN A 121 7.207 9.387 -17.002 1.00 0.00 H new ATOM 0 HD22 ASN A 121 5.666 9.597 -16.163 1.00 0.00 H new ATOM 1732 N GLN A 122 7.229 9.327 -22.402 1.00 0.00 N ATOM 1733 CA GLN A 122 8.085 9.511 -23.567 1.00 0.00 C ATOM 1734 C GLN A 122 7.607 10.698 -24.392 1.00 0.00 C ATOM 1735 O GLN A 122 6.412 10.984 -24.443 1.00 0.00 O ATOM 1736 CB GLN A 122 8.093 8.247 -24.428 1.00 0.00 C ATOM 1737 CG GLN A 122 8.218 6.962 -23.626 1.00 0.00 C ATOM 1738 CD GLN A 122 9.643 6.685 -23.188 1.00 0.00 C ATOM 1739 OE1 GLN A 122 10.559 6.637 -24.009 1.00 0.00 O ATOM 1740 NE2 GLN A 122 9.836 6.498 -21.888 1.00 0.00 N ATOM 0 H GLN A 122 6.231 9.298 -22.612 1.00 0.00 H new ATOM 0 HA GLN A 122 9.100 9.707 -23.221 1.00 0.00 H new ATOM 0 HB2 GLN A 122 7.174 8.211 -25.014 1.00 0.00 H new ATOM 0 HB3 GLN A 122 8.920 8.305 -25.135 1.00 0.00 H new ATOM 0 HG2 GLN A 122 7.577 7.023 -22.747 1.00 0.00 H new ATOM 0 HG3 GLN A 122 7.857 6.127 -24.226 1.00 0.00 H new ATOM 0 HE21 GLN A 122 9.047 6.547 -21.243 1.00 0.00 H new ATOM 0 HE22 GLN A 122 10.773 6.306 -21.534 1.00 0.00 H new ATOM 1749 N LEU A 123 8.539 11.383 -25.039 1.00 0.00 N ATOM 1750 CA LEU A 123 8.194 12.536 -25.860 1.00 0.00 C ATOM 1751 C LEU A 123 7.506 12.088 -27.143 1.00 0.00 C ATOM 1752 O LEU A 123 8.079 11.339 -27.935 1.00 0.00 O ATOM 1753 CB LEU A 123 9.448 13.344 -26.193 1.00 0.00 C ATOM 1754 CG LEU A 123 9.213 14.578 -27.064 1.00 0.00 C ATOM 1755 CD1 LEU A 123 8.623 15.711 -26.238 1.00 0.00 C ATOM 1756 CD2 LEU A 123 10.511 15.018 -27.723 1.00 0.00 C ATOM 0 H LEU A 123 9.535 11.163 -25.012 1.00 0.00 H new ATOM 0 HA LEU A 123 7.507 13.168 -25.297 1.00 0.00 H new ATOM 0 HB2 LEU A 123 9.915 13.660 -25.261 1.00 0.00 H new ATOM 0 HB3 LEU A 123 10.158 12.691 -26.700 1.00 0.00 H new ATOM 0 HG LEU A 123 8.500 14.317 -27.846 1.00 0.00 H new ATOM 0 HD11 LEU A 123 8.463 16.581 -26.875 1.00 0.00 H new ATOM 0 HD12 LEU A 123 7.671 15.393 -25.812 1.00 0.00 H new ATOM 0 HD13 LEU A 123 9.311 15.972 -25.434 1.00 0.00 H new ATOM 0 HD21 LEU A 123 10.326 15.898 -28.340 1.00 0.00 H new ATOM 0 HD22 LEU A 123 11.245 15.261 -26.955 1.00 0.00 H new ATOM 0 HD23 LEU A 123 10.894 14.211 -28.348 1.00 0.00 H new ATOM 1768 N LEU A 124 6.273 12.540 -27.337 1.00 0.00 N ATOM 1769 CA LEU A 124 5.506 12.172 -28.519 1.00 0.00 C ATOM 1770 C LEU A 124 6.234 12.557 -29.797 1.00 0.00 C ATOM 1771 O LEU A 124 7.045 13.482 -29.822 1.00 0.00 O ATOM 1772 CB LEU A 124 4.123 12.819 -28.487 1.00 0.00 C ATOM 1773 CG LEU A 124 3.189 12.451 -29.645 1.00 0.00 C ATOM 1774 CD1 LEU A 124 1.963 11.712 -29.128 1.00 0.00 C ATOM 1775 CD2 LEU A 124 2.776 13.695 -30.416 1.00 0.00 C ATOM 0 H LEU A 124 5.784 13.161 -26.692 1.00 0.00 H new ATOM 0 HA LEU A 124 5.390 11.088 -28.510 1.00 0.00 H new ATOM 0 HB2 LEU A 124 3.636 12.546 -27.551 1.00 0.00 H new ATOM 0 HB3 LEU A 124 4.249 13.902 -28.476 1.00 0.00 H new ATOM 0 HG LEU A 124 3.729 11.790 -30.324 1.00 0.00 H new ATOM 0 HD11 LEU A 124 1.311 11.459 -29.964 1.00 0.00 H new ATOM 0 HD12 LEU A 124 2.275 10.799 -28.622 1.00 0.00 H new ATOM 0 HD13 LEU A 124 1.423 12.349 -28.427 1.00 0.00 H new ATOM 0 HD21 LEU A 124 2.113 13.413 -31.234 1.00 0.00 H new ATOM 0 HD22 LEU A 124 2.256 14.381 -29.748 1.00 0.00 H new ATOM 0 HD23 LEU A 124 3.663 14.184 -30.820 1.00 0.00 H new ATOM 1787 N SER A 125 5.927 11.823 -30.851 1.00 0.00 N ATOM 1788 CA SER A 125 6.527 12.042 -32.161 1.00 0.00 C ATOM 1789 C SER A 125 5.447 12.267 -33.215 1.00 0.00 C ATOM 1790 O SER A 125 4.317 11.799 -33.068 1.00 0.00 O ATOM 1791 CB SER A 125 7.413 10.853 -32.547 1.00 0.00 C ATOM 1792 OG SER A 125 7.432 10.654 -33.951 1.00 0.00 O ATOM 0 H SER A 125 5.254 11.057 -30.826 1.00 0.00 H new ATOM 0 HA SER A 125 7.148 12.936 -32.111 1.00 0.00 H new ATOM 0 HB2 SER A 125 8.428 11.023 -32.189 1.00 0.00 H new ATOM 0 HB3 SER A 125 7.048 9.951 -32.055 1.00 0.00 H new ATOM 0 HG SER A 125 8.007 9.890 -34.165 1.00 0.00 H new ATOM 1798 N GLN A 126 5.796 12.988 -34.276 1.00 0.00 N ATOM 1799 CA GLN A 126 4.846 13.274 -35.344 1.00 0.00 C ATOM 1800 C GLN A 126 4.563 12.015 -36.155 1.00 0.00 C ATOM 1801 O GLN A 126 5.480 11.372 -36.667 1.00 0.00 O ATOM 1802 CB GLN A 126 5.392 14.376 -36.257 1.00 0.00 C ATOM 1803 CG GLN A 126 4.475 14.715 -37.422 1.00 0.00 C ATOM 1804 CD GLN A 126 3.330 15.621 -37.016 1.00 0.00 C ATOM 1805 OE1 GLN A 126 2.244 15.025 -36.541 1.00 0.00 O flip ATOM 1806 NE2 GLN A 126 3.420 16.844 -37.129 1.00 0.00 N flip ATOM 0 H GLN A 126 6.726 13.383 -34.418 1.00 0.00 H new ATOM 0 HA GLN A 126 3.914 13.617 -34.896 1.00 0.00 H new ATOM 0 HB2 GLN A 126 5.560 15.276 -35.665 1.00 0.00 H new ATOM 0 HB3 GLN A 126 6.361 14.065 -36.647 1.00 0.00 H new ATOM 0 HG2 GLN A 126 5.055 15.198 -38.208 1.00 0.00 H new ATOM 0 HG3 GLN A 126 4.073 13.794 -37.844 1.00 0.00 H new ATOM 0 HE21 GLN A 126 4.274 17.260 -37.499 1.00 0.00 H new ATOM 0 HE22 GLN A 126 2.640 17.440 -36.852 1.00 0.00 H new ATOM 1815 N GLY A 127 3.285 11.660 -36.249 1.00 0.00 N ATOM 1816 CA GLY A 127 2.896 10.473 -36.980 1.00 0.00 C ATOM 1817 C GLY A 127 3.555 9.222 -36.429 1.00 0.00 C ATOM 1818 O GLY A 127 3.670 8.214 -37.126 1.00 0.00 O ATOM 0 H GLY A 127 2.512 12.177 -35.830 1.00 0.00 H new ATOM 0 HA2 GLY A 127 1.813 10.360 -36.937 1.00 0.00 H new ATOM 0 HA3 GLY A 127 3.163 10.591 -38.030 1.00 0.00 H new ATOM 1822 N ASP A 128 3.990 9.292 -35.173 1.00 0.00 N ATOM 1823 CA ASP A 128 4.643 8.168 -34.522 1.00 0.00 C ATOM 1824 C ASP A 128 3.756 6.931 -34.540 1.00 0.00 C ATOM 1825 O ASP A 128 2.590 6.995 -34.933 1.00 0.00 O ATOM 1826 CB ASP A 128 4.996 8.533 -33.081 1.00 0.00 C ATOM 1827 CG ASP A 128 5.999 7.581 -32.462 1.00 0.00 C ATOM 1828 OD1 ASP A 128 7.215 7.806 -32.630 1.00 0.00 O ATOM 1829 OD2 ASP A 128 5.567 6.607 -31.809 1.00 0.00 O ATOM 0 H ASP A 128 3.899 10.122 -34.586 1.00 0.00 H new ATOM 0 HA ASP A 128 5.556 7.941 -35.073 1.00 0.00 H new ATOM 0 HB2 ASP A 128 5.400 9.545 -33.056 1.00 0.00 H new ATOM 0 HB3 ASP A 128 4.087 8.537 -32.479 1.00 0.00 H new ATOM 1834 N GLU A 129 4.317 5.808 -34.116 1.00 0.00 N ATOM 1835 CA GLU A 129 3.577 4.556 -34.085 1.00 0.00 C ATOM 1836 C GLU A 129 3.992 3.693 -32.894 1.00 0.00 C ATOM 1837 O GLU A 129 5.181 3.538 -32.613 1.00 0.00 O ATOM 1838 CB GLU A 129 3.806 3.785 -35.387 1.00 0.00 C ATOM 1839 CG GLU A 129 2.685 2.819 -35.732 1.00 0.00 C ATOM 1840 CD GLU A 129 2.909 2.117 -37.057 1.00 0.00 C ATOM 1841 OE1 GLU A 129 4.072 1.779 -37.361 1.00 0.00 O ATOM 1842 OE2 GLU A 129 1.920 1.905 -37.791 1.00 0.00 O ATOM 0 H GLU A 129 5.281 5.738 -33.789 1.00 0.00 H new ATOM 0 HA GLU A 129 2.518 4.793 -33.979 1.00 0.00 H new ATOM 0 HB2 GLU A 129 3.924 4.497 -36.204 1.00 0.00 H new ATOM 0 HB3 GLU A 129 4.741 3.230 -35.310 1.00 0.00 H new ATOM 0 HG2 GLU A 129 2.595 2.074 -34.941 1.00 0.00 H new ATOM 0 HG3 GLU A 129 1.740 3.362 -35.767 1.00 0.00 H new ATOM 1849 N ILE A 130 3.006 3.121 -32.207 1.00 0.00 N ATOM 1850 CA ILE A 130 3.269 2.260 -31.062 1.00 0.00 C ATOM 1851 C ILE A 130 2.917 0.818 -31.393 1.00 0.00 C ATOM 1852 O ILE A 130 1.816 0.529 -31.865 1.00 0.00 O ATOM 1853 CB ILE A 130 2.472 2.696 -29.814 1.00 0.00 C ATOM 1854 CG1 ILE A 130 2.512 4.218 -29.651 1.00 0.00 C ATOM 1855 CG2 ILE A 130 3.011 2.009 -28.571 1.00 0.00 C ATOM 1856 CD1 ILE A 130 1.146 4.866 -29.720 1.00 0.00 C ATOM 0 H ILE A 130 2.017 3.240 -32.426 1.00 0.00 H new ATOM 0 HA ILE A 130 4.332 2.345 -30.838 1.00 0.00 H new ATOM 0 HB ILE A 130 1.433 2.396 -29.949 1.00 0.00 H new ATOM 0 HG12 ILE A 130 2.974 4.461 -28.694 1.00 0.00 H new ATOM 0 HG13 ILE A 130 3.147 4.643 -30.428 1.00 0.00 H new ATOM 0 HG21 ILE A 130 2.437 2.328 -27.701 1.00 0.00 H new ATOM 0 HG22 ILE A 130 2.925 0.929 -28.686 1.00 0.00 H new ATOM 0 HG23 ILE A 130 4.059 2.277 -28.433 1.00 0.00 H new ATOM 0 HD11 ILE A 130 1.248 5.944 -29.597 1.00 0.00 H new ATOM 0 HD12 ILE A 130 0.690 4.653 -30.687 1.00 0.00 H new ATOM 0 HD13 ILE A 130 0.514 4.469 -28.926 1.00 0.00 H new ATOM 1868 N THR A 131 3.855 -0.083 -31.148 1.00 0.00 N ATOM 1869 CA THR A 131 3.650 -1.495 -31.423 1.00 0.00 C ATOM 1870 C THR A 131 3.395 -2.247 -30.122 1.00 0.00 C ATOM 1871 O THR A 131 4.036 -1.981 -29.109 1.00 0.00 O ATOM 1872 CB THR A 131 4.875 -2.061 -32.138 1.00 0.00 C ATOM 1873 OG1 THR A 131 5.407 -1.110 -33.044 1.00 0.00 O ATOM 1874 CG2 THR A 131 4.591 -3.322 -32.917 1.00 0.00 C ATOM 0 H THR A 131 4.770 0.141 -30.757 1.00 0.00 H new ATOM 0 HA THR A 131 2.779 -1.616 -32.068 1.00 0.00 H new ATOM 0 HB THR A 131 5.584 -2.299 -31.345 1.00 0.00 H new ATOM 0 HG1 THR A 131 6.192 -1.489 -33.492 1.00 0.00 H new ATOM 0 HG21 THR A 131 5.506 -3.666 -33.398 1.00 0.00 H new ATOM 0 HG22 THR A 131 4.225 -4.093 -32.240 1.00 0.00 H new ATOM 0 HG23 THR A 131 3.836 -3.118 -33.677 1.00 0.00 H new ATOM 1882 N VAL A 132 2.435 -3.165 -30.142 1.00 0.00 N ATOM 1883 CA VAL A 132 2.096 -3.918 -28.941 1.00 0.00 C ATOM 1884 C VAL A 132 1.807 -5.386 -29.235 1.00 0.00 C ATOM 1885 O VAL A 132 1.479 -5.756 -30.362 1.00 0.00 O ATOM 1886 CB VAL A 132 0.877 -3.301 -28.236 1.00 0.00 C ATOM 1887 CG1 VAL A 132 1.186 -1.882 -27.783 1.00 0.00 C ATOM 1888 CG2 VAL A 132 -0.342 -3.325 -29.145 1.00 0.00 C ATOM 0 H VAL A 132 1.884 -3.404 -30.966 1.00 0.00 H new ATOM 0 HA VAL A 132 2.969 -3.866 -28.291 1.00 0.00 H new ATOM 0 HB VAL A 132 0.651 -3.901 -27.354 1.00 0.00 H new ATOM 0 HG11 VAL A 132 0.312 -1.460 -27.286 1.00 0.00 H new ATOM 0 HG12 VAL A 132 2.026 -1.896 -27.089 1.00 0.00 H new ATOM 0 HG13 VAL A 132 1.441 -1.271 -28.649 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -1.192 -2.884 -28.625 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -0.133 -2.753 -30.049 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -0.576 -4.355 -29.413 1.00 0.00 H new ATOM 1898 N GLY A 133 1.933 -6.215 -28.202 1.00 0.00 N ATOM 1899 CA GLY A 133 1.686 -7.629 -28.341 1.00 0.00 C ATOM 1900 C GLY A 133 2.897 -8.364 -28.870 1.00 0.00 C ATOM 1901 O GLY A 133 2.774 -9.370 -29.565 1.00 0.00 O ATOM 0 H GLY A 133 2.205 -5.922 -27.264 1.00 0.00 H new ATOM 0 HA2 GLY A 133 1.403 -8.045 -27.374 1.00 0.00 H new ATOM 0 HA3 GLY A 133 0.843 -7.786 -29.014 1.00 0.00 H new ATOM 1905 N VAL A 134 4.069 -7.839 -28.552 1.00 0.00 N ATOM 1906 CA VAL A 134 5.312 -8.420 -29.004 1.00 0.00 C ATOM 1907 C VAL A 134 5.593 -9.767 -28.358 1.00 0.00 C ATOM 1908 O VAL A 134 5.338 -9.983 -27.174 1.00 0.00 O ATOM 1909 CB VAL A 134 6.489 -7.464 -28.763 1.00 0.00 C ATOM 1910 CG1 VAL A 134 7.819 -8.160 -29.017 1.00 0.00 C ATOM 1911 CG2 VAL A 134 6.332 -6.243 -29.653 1.00 0.00 C ATOM 0 H VAL A 134 4.180 -7.004 -27.977 1.00 0.00 H new ATOM 0 HA VAL A 134 5.203 -8.586 -30.076 1.00 0.00 H new ATOM 0 HB VAL A 134 6.485 -7.148 -27.720 1.00 0.00 H new ATOM 0 HG11 VAL A 134 8.636 -7.460 -28.839 1.00 0.00 H new ATOM 0 HG12 VAL A 134 7.918 -9.012 -28.344 1.00 0.00 H new ATOM 0 HG13 VAL A 134 7.857 -8.507 -30.050 1.00 0.00 H new ATOM 0 HG21 VAL A 134 7.166 -5.561 -29.485 1.00 0.00 H new ATOM 0 HG22 VAL A 134 6.321 -6.553 -30.698 1.00 0.00 H new ATOM 0 HG23 VAL A 134 5.396 -5.737 -29.415 1.00 0.00 H new ATOM 1921 N GLY A 135 6.113 -10.669 -29.174 1.00 0.00 N ATOM 1922 CA GLY A 135 6.431 -12.000 -28.742 1.00 0.00 C ATOM 1923 C GLY A 135 6.476 -12.942 -29.923 1.00 0.00 C ATOM 1924 O GLY A 135 7.398 -13.745 -30.063 1.00 0.00 O ATOM 0 H GLY A 135 6.323 -10.488 -30.156 1.00 0.00 H new ATOM 0 HA2 GLY A 135 7.393 -12.003 -28.230 1.00 0.00 H new ATOM 0 HA3 GLY A 135 5.687 -12.343 -28.023 1.00 0.00 H new ATOM 1928 N VAL A 136 5.482 -12.802 -30.794 1.00 0.00 N ATOM 1929 CA VAL A 136 5.386 -13.587 -31.998 1.00 0.00 C ATOM 1930 C VAL A 136 5.246 -12.656 -33.196 1.00 0.00 C ATOM 1931 O VAL A 136 4.569 -11.631 -33.115 1.00 0.00 O ATOM 1932 CB VAL A 136 4.199 -14.562 -31.952 1.00 0.00 C ATOM 1933 CG1 VAL A 136 4.206 -15.478 -33.165 1.00 0.00 C ATOM 1934 CG2 VAL A 136 4.221 -15.373 -30.664 1.00 0.00 C ATOM 0 H VAL A 136 4.721 -12.134 -30.674 1.00 0.00 H new ATOM 0 HA VAL A 136 6.295 -14.181 -32.089 1.00 0.00 H new ATOM 0 HB VAL A 136 3.278 -13.979 -31.973 1.00 0.00 H new ATOM 0 HG11 VAL A 136 3.357 -16.160 -33.111 1.00 0.00 H new ATOM 0 HG12 VAL A 136 4.134 -14.880 -34.073 1.00 0.00 H new ATOM 0 HG13 VAL A 136 5.132 -16.053 -33.182 1.00 0.00 H new ATOM 0 HG21 VAL A 136 3.373 -16.057 -30.650 1.00 0.00 H new ATOM 0 HG22 VAL A 136 5.148 -15.943 -30.609 1.00 0.00 H new ATOM 0 HG23 VAL A 136 4.158 -14.700 -29.809 1.00 0.00 H new ATOM 1944 N GLU A 137 5.900 -12.996 -34.296 1.00 0.00 N ATOM 1945 CA GLU A 137 5.858 -12.162 -35.494 1.00 0.00 C ATOM 1946 C GLU A 137 4.428 -11.806 -35.896 1.00 0.00 C ATOM 1947 O GLU A 137 4.151 -10.674 -36.292 1.00 0.00 O ATOM 1948 CB GLU A 137 6.559 -12.874 -36.654 1.00 0.00 C ATOM 1949 CG GLU A 137 6.038 -14.278 -36.911 1.00 0.00 C ATOM 1950 CD GLU A 137 7.036 -15.143 -37.656 1.00 0.00 C ATOM 1951 OE1 GLU A 137 7.312 -14.847 -38.837 1.00 0.00 O ATOM 1952 OE2 GLU A 137 7.544 -16.114 -37.057 1.00 0.00 O ATOM 0 H GLU A 137 6.465 -13.840 -34.387 1.00 0.00 H new ATOM 0 HA GLU A 137 6.378 -11.233 -35.262 1.00 0.00 H new ATOM 0 HB2 GLU A 137 6.439 -12.280 -37.560 1.00 0.00 H new ATOM 0 HB3 GLU A 137 7.628 -12.925 -36.445 1.00 0.00 H new ATOM 0 HG2 GLU A 137 5.792 -14.750 -35.960 1.00 0.00 H new ATOM 0 HG3 GLU A 137 5.114 -14.219 -37.486 1.00 0.00 H new ATOM 1959 N SER A 138 3.528 -12.780 -35.819 1.00 0.00 N ATOM 1960 CA SER A 138 2.145 -12.572 -36.202 1.00 0.00 C ATOM 1961 C SER A 138 1.247 -12.177 -35.026 1.00 0.00 C ATOM 1962 O SER A 138 0.028 -12.098 -35.185 1.00 0.00 O ATOM 1963 CB SER A 138 1.593 -13.832 -36.870 1.00 0.00 C ATOM 1964 OG SER A 138 0.887 -13.511 -38.058 1.00 0.00 O ATOM 0 H SER A 138 3.737 -13.724 -35.493 1.00 0.00 H new ATOM 0 HA SER A 138 2.137 -11.737 -36.903 1.00 0.00 H new ATOM 0 HB2 SER A 138 2.412 -14.513 -37.102 1.00 0.00 H new ATOM 0 HB3 SER A 138 0.931 -14.354 -36.179 1.00 0.00 H new ATOM 0 HG SER A 138 0.545 -14.333 -38.468 1.00 0.00 H new ATOM 1970 N ASP A 139 1.823 -11.944 -33.845 1.00 0.00 N ATOM 1971 CA ASP A 139 1.019 -11.582 -32.686 1.00 0.00 C ATOM 1972 C ASP A 139 1.258 -10.160 -32.218 1.00 0.00 C ATOM 1973 O ASP A 139 0.962 -9.806 -31.078 1.00 0.00 O ATOM 1974 CB ASP A 139 1.257 -12.550 -31.540 1.00 0.00 C ATOM 1975 CG ASP A 139 0.822 -13.964 -31.877 1.00 0.00 C ATOM 1976 OD1 ASP A 139 0.758 -14.295 -33.080 1.00 0.00 O ATOM 1977 OD2 ASP A 139 0.546 -14.740 -30.938 1.00 0.00 O ATOM 0 H ASP A 139 2.827 -11.999 -33.671 1.00 0.00 H new ATOM 0 HA ASP A 139 -0.021 -11.645 -33.007 1.00 0.00 H new ATOM 0 HB2 ASP A 139 2.316 -12.550 -31.282 1.00 0.00 H new ATOM 0 HB3 ASP A 139 0.715 -12.206 -30.659 1.00 0.00 H new ATOM 1982 N ILE A 140 1.767 -9.353 -33.112 1.00 0.00 N ATOM 1983 CA ILE A 140 2.036 -7.959 -32.830 1.00 0.00 C ATOM 1984 C ILE A 140 1.037 -7.044 -33.530 1.00 0.00 C ATOM 1985 O ILE A 140 0.667 -7.261 -34.684 1.00 0.00 O ATOM 1986 CB ILE A 140 3.455 -7.530 -33.225 1.00 0.00 C ATOM 1987 CG1 ILE A 140 4.500 -8.472 -32.624 1.00 0.00 C ATOM 1988 CG2 ILE A 140 3.716 -6.104 -32.773 1.00 0.00 C ATOM 1989 CD1 ILE A 140 5.625 -8.817 -33.573 1.00 0.00 C ATOM 0 H ILE A 140 2.009 -9.641 -34.060 1.00 0.00 H new ATOM 0 HA ILE A 140 1.936 -7.860 -31.749 1.00 0.00 H new ATOM 0 HB ILE A 140 3.535 -7.580 -34.311 1.00 0.00 H new ATOM 0 HG12 ILE A 140 4.919 -8.012 -31.730 1.00 0.00 H new ATOM 0 HG13 ILE A 140 4.008 -9.392 -32.308 1.00 0.00 H new ATOM 0 HG21 ILE A 140 4.726 -5.811 -33.059 1.00 0.00 H new ATOM 0 HG22 ILE A 140 2.997 -5.435 -33.245 1.00 0.00 H new ATOM 0 HG23 ILE A 140 3.613 -6.041 -31.690 1.00 0.00 H new ATOM 0 HD11 ILE A 140 6.326 -9.488 -33.077 1.00 0.00 H new ATOM 0 HD12 ILE A 140 5.218 -9.307 -34.457 1.00 0.00 H new ATOM 0 HD13 ILE A 140 6.143 -7.905 -33.870 1.00 0.00 H new ATOM 2001 N LEU A 141 0.618 -6.017 -32.812 1.00 0.00 N ATOM 2002 CA LEU A 141 -0.332 -5.034 -33.325 1.00 0.00 C ATOM 2003 C LEU A 141 0.263 -3.631 -33.239 1.00 0.00 C ATOM 2004 O LEU A 141 0.851 -3.262 -32.223 1.00 0.00 O ATOM 2005 CB LEU A 141 -1.641 -5.096 -32.535 1.00 0.00 C ATOM 2006 CG LEU A 141 -2.849 -4.473 -33.235 1.00 0.00 C ATOM 2007 CD1 LEU A 141 -4.138 -4.879 -32.539 1.00 0.00 C ATOM 2008 CD2 LEU A 141 -2.717 -2.959 -33.275 1.00 0.00 C ATOM 0 H LEU A 141 0.924 -5.837 -31.856 1.00 0.00 H new ATOM 0 HA LEU A 141 -0.541 -5.266 -34.369 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -1.866 -6.140 -32.315 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -1.495 -4.593 -31.579 1.00 0.00 H new ATOM 0 HG LEU A 141 -2.882 -4.843 -34.260 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -4.987 -4.426 -33.052 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -4.238 -5.964 -32.562 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -4.115 -4.538 -31.504 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -3.585 -2.531 -33.777 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -2.658 -2.572 -32.258 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -1.813 -2.687 -33.819 1.00 0.00 H new ATOM 2020 N SER A 142 0.129 -2.855 -34.312 1.00 0.00 N ATOM 2021 CA SER A 142 0.678 -1.504 -34.341 1.00 0.00 C ATOM 2022 C SER A 142 -0.395 -0.430 -34.383 1.00 0.00 C ATOM 2023 O SER A 142 -1.487 -0.630 -34.913 1.00 0.00 O ATOM 2024 CB SER A 142 1.611 -1.324 -35.513 1.00 0.00 C ATOM 2025 OG SER A 142 2.185 -0.029 -35.519 1.00 0.00 O ATOM 0 H SER A 142 -0.352 -3.137 -35.166 1.00 0.00 H new ATOM 0 HA SER A 142 1.230 -1.385 -33.409 1.00 0.00 H new ATOM 0 HB2 SER A 142 2.401 -2.074 -35.471 1.00 0.00 H new ATOM 0 HB3 SER A 142 1.066 -1.487 -36.443 1.00 0.00 H new ATOM 0 HG SER A 142 3.160 -0.103 -35.459 1.00 0.00 H new ATOM 2031 N LEU A 143 -0.048 0.714 -33.819 1.00 0.00 N ATOM 2032 CA LEU A 143 -0.937 1.870 -33.772 1.00 0.00 C ATOM 2033 C LEU A 143 -0.173 3.142 -34.136 1.00 0.00 C ATOM 2034 O LEU A 143 0.965 3.325 -33.712 1.00 0.00 O ATOM 2035 CB LEU A 143 -1.550 2.015 -32.374 1.00 0.00 C ATOM 2036 CG LEU A 143 -2.896 1.312 -32.165 1.00 0.00 C ATOM 2037 CD1 LEU A 143 -3.819 1.541 -33.351 1.00 0.00 C ATOM 2038 CD2 LEU A 143 -2.690 -0.177 -31.926 1.00 0.00 C ATOM 0 H LEU A 143 0.859 0.871 -33.379 1.00 0.00 H new ATOM 0 HA LEU A 143 -1.738 1.718 -34.496 1.00 0.00 H new ATOM 0 HB2 LEU A 143 -0.840 1.627 -31.644 1.00 0.00 H new ATOM 0 HB3 LEU A 143 -1.678 3.076 -32.161 1.00 0.00 H new ATOM 0 HG LEU A 143 -3.369 1.741 -31.282 1.00 0.00 H new ATOM 0 HD11 LEU A 143 -4.767 1.032 -33.178 1.00 0.00 H new ATOM 0 HD12 LEU A 143 -3.998 2.609 -33.472 1.00 0.00 H new ATOM 0 HD13 LEU A 143 -3.355 1.146 -34.255 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -3.657 -0.659 -31.780 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -2.191 -0.618 -32.789 1.00 0.00 H new ATOM 0 HD23 LEU A 143 -2.075 -0.321 -31.038 1.00 0.00 H new ATOM 2050 N VAL A 144 -0.800 4.017 -34.917 1.00 0.00 N ATOM 2051 CA VAL A 144 -0.158 5.265 -35.325 1.00 0.00 C ATOM 2052 C VAL A 144 -0.820 6.468 -34.663 1.00 0.00 C ATOM 2053 O VAL A 144 -2.040 6.514 -34.514 1.00 0.00 O ATOM 2054 CB VAL A 144 -0.194 5.456 -36.853 1.00 0.00 C ATOM 2055 CG1 VAL A 144 0.672 6.642 -37.261 1.00 0.00 C ATOM 2056 CG2 VAL A 144 0.258 4.190 -37.567 1.00 0.00 C ATOM 0 H VAL A 144 -1.745 3.888 -35.278 1.00 0.00 H new ATOM 0 HA VAL A 144 0.881 5.196 -35.002 1.00 0.00 H new ATOM 0 HB VAL A 144 -1.223 5.662 -37.149 1.00 0.00 H new ATOM 0 HG11 VAL A 144 0.636 6.764 -38.344 1.00 0.00 H new ATOM 0 HG12 VAL A 144 0.299 7.547 -36.782 1.00 0.00 H new ATOM 0 HG13 VAL A 144 1.702 6.465 -36.950 1.00 0.00 H new ATOM 0 HG21 VAL A 144 0.224 4.348 -38.645 1.00 0.00 H new ATOM 0 HG22 VAL A 144 1.278 3.948 -37.267 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -0.404 3.366 -37.301 1.00 0.00 H new ATOM 2066 N ILE A 145 -0.004 7.435 -34.253 1.00 0.00 N ATOM 2067 CA ILE A 145 -0.484 8.618 -33.597 1.00 0.00 C ATOM 2068 C ILE A 145 -0.428 9.826 -34.532 1.00 0.00 C ATOM 2069 O ILE A 145 0.613 10.126 -35.112 1.00 0.00 O ATOM 2070 CB ILE A 145 0.383 8.885 -32.362 1.00 0.00 C ATOM 2071 CG1 ILE A 145 0.199 7.766 -31.337 1.00 0.00 C ATOM 2072 CG2 ILE A 145 0.053 10.228 -31.772 1.00 0.00 C ATOM 2073 CD1 ILE A 145 0.932 8.003 -30.034 1.00 0.00 C ATOM 0 H ILE A 145 1.009 7.407 -34.373 1.00 0.00 H new ATOM 0 HA ILE A 145 -1.523 8.462 -33.306 1.00 0.00 H new ATOM 0 HB ILE A 145 1.431 8.900 -32.660 1.00 0.00 H new ATOM 0 HG12 ILE A 145 -0.864 7.649 -31.128 1.00 0.00 H new ATOM 0 HG13 ILE A 145 0.544 6.828 -31.772 1.00 0.00 H new ATOM 0 HG21 ILE A 145 0.677 10.404 -30.896 1.00 0.00 H new ATOM 0 HG22 ILE A 145 0.240 11.006 -32.512 1.00 0.00 H new ATOM 0 HG23 ILE A 145 -0.997 10.249 -31.480 1.00 0.00 H new ATOM 0 HD11 ILE A 145 0.753 7.167 -29.358 1.00 0.00 H new ATOM 0 HD12 ILE A 145 2.001 8.090 -30.229 1.00 0.00 H new ATOM 0 HD13 ILE A 145 0.571 8.923 -29.575 1.00 0.00 H new ATOM 2085 N PHE A 146 -1.558 10.511 -34.667 1.00 0.00 N ATOM 2086 CA PHE A 146 -1.649 11.686 -35.526 1.00 0.00 C ATOM 2087 C PHE A 146 -1.887 12.944 -34.696 1.00 0.00 C ATOM 2088 O PHE A 146 -2.905 13.066 -34.015 1.00 0.00 O ATOM 2089 CB PHE A 146 -2.777 11.506 -36.545 1.00 0.00 C ATOM 2090 CG PHE A 146 -2.320 11.614 -37.971 1.00 0.00 C ATOM 2091 CD1 PHE A 146 -1.546 10.617 -38.541 1.00 0.00 C ATOM 2092 CD2 PHE A 146 -2.665 12.714 -38.739 1.00 0.00 C ATOM 2093 CE1 PHE A 146 -1.125 10.714 -39.852 1.00 0.00 C ATOM 2094 CE2 PHE A 146 -2.246 12.817 -40.052 1.00 0.00 C ATOM 2095 CZ PHE A 146 -1.476 11.816 -40.609 1.00 0.00 C ATOM 0 H PHE A 146 -2.427 10.271 -34.190 1.00 0.00 H new ATOM 0 HA PHE A 146 -0.704 11.798 -36.058 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -3.240 10.531 -36.393 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -3.546 12.257 -36.360 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -1.269 9.754 -37.953 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -3.268 13.499 -38.307 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -0.522 9.930 -40.286 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -2.521 13.679 -40.641 1.00 0.00 H new ATOM 0 HZ PHE A 146 -1.148 11.894 -41.635 1.00 0.00 H new ATOM 2105 N ILE A 147 -0.940 13.874 -34.755 1.00 0.00 N ATOM 2106 CA ILE A 147 -1.046 15.118 -34.007 1.00 0.00 C ATOM 2107 C ILE A 147 -1.856 16.162 -34.764 1.00 0.00 C ATOM 2108 O ILE A 147 -1.650 16.377 -35.959 1.00 0.00 O ATOM 2109 CB ILE A 147 0.331 15.699 -33.695 1.00 0.00 C ATOM 2110 CG1 ILE A 147 1.324 14.597 -33.328 1.00 0.00 C ATOM 2111 CG2 ILE A 147 0.235 16.723 -32.577 1.00 0.00 C ATOM 2112 CD1 ILE A 147 2.763 15.059 -33.357 1.00 0.00 C ATOM 0 H ILE A 147 -0.091 13.788 -35.314 1.00 0.00 H new ATOM 0 HA ILE A 147 -1.557 14.874 -33.076 1.00 0.00 H new ATOM 0 HB ILE A 147 0.698 16.196 -34.593 1.00 0.00 H new ATOM 0 HG12 ILE A 147 1.089 14.222 -32.332 1.00 0.00 H new ATOM 0 HG13 ILE A 147 1.203 13.763 -34.019 1.00 0.00 H new ATOM 0 HG21 ILE A 147 1.225 17.127 -32.368 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -0.430 17.532 -32.880 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -0.160 16.246 -31.680 1.00 0.00 H new ATOM 0 HD11 ILE A 147 3.417 14.230 -33.087 1.00 0.00 H new ATOM 0 HD12 ILE A 147 3.013 15.407 -34.359 1.00 0.00 H new ATOM 0 HD13 ILE A 147 2.898 15.874 -32.646 1.00 0.00 H new ATOM 2124 N ASN A 148 -2.773 16.817 -34.058 1.00 0.00 N ATOM 2125 CA ASN A 148 -3.610 17.847 -34.660 1.00 0.00 C ATOM 2126 C ASN A 148 -2.894 19.194 -34.646 1.00 0.00 C ATOM 2127 O ASN A 148 -2.729 19.811 -33.594 1.00 0.00 O ATOM 2128 CB ASN A 148 -4.944 17.951 -33.914 1.00 0.00 C ATOM 2129 CG ASN A 148 -6.134 17.708 -34.821 1.00 0.00 C ATOM 2130 OD1 ASN A 148 -6.041 16.970 -35.802 1.00 0.00 O ATOM 2131 ND2 ASN A 148 -7.262 18.328 -34.496 1.00 0.00 N ATOM 0 H ASN A 148 -2.955 16.652 -33.068 1.00 0.00 H new ATOM 0 HA ASN A 148 -3.807 17.569 -35.695 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -4.958 17.228 -33.099 1.00 0.00 H new ATOM 0 HB3 ASN A 148 -5.029 18.940 -33.464 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -8.097 18.202 -35.068 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -7.294 18.931 -33.674 1.00 0.00 H new ATOM 2138 N ASP A 149 -2.466 19.644 -35.822 1.00 0.00 N ATOM 2139 CA ASP A 149 -1.760 20.915 -35.946 1.00 0.00 C ATOM 2140 C ASP A 149 -2.605 22.068 -35.415 1.00 0.00 C ATOM 2141 O ASP A 149 -2.074 23.059 -34.912 1.00 0.00 O ATOM 2142 CB ASP A 149 -1.386 21.174 -37.407 1.00 0.00 C ATOM 2143 CG ASP A 149 -0.216 20.323 -37.863 1.00 0.00 C ATOM 2144 OD1 ASP A 149 0.858 20.402 -37.232 1.00 0.00 O ATOM 2145 OD2 ASP A 149 -0.376 19.576 -38.851 1.00 0.00 O ATOM 0 H ASP A 149 -2.596 19.147 -36.703 1.00 0.00 H new ATOM 0 HA ASP A 149 -0.851 20.853 -35.348 1.00 0.00 H new ATOM 0 HB2 ASP A 149 -2.249 20.971 -38.042 1.00 0.00 H new ATOM 0 HB3 ASP A 149 -1.137 22.228 -37.534 1.00 0.00 H new ATOM 2150 N LYS A 150 -3.921 21.934 -35.528 1.00 0.00 N ATOM 2151 CA LYS A 150 -4.835 22.962 -35.060 1.00 0.00 C ATOM 2152 C LYS A 150 -4.654 23.203 -33.567 1.00 0.00 C ATOM 2153 O LYS A 150 -4.586 24.345 -33.112 1.00 0.00 O ATOM 2154 CB LYS A 150 -6.282 22.565 -35.354 1.00 0.00 C ATOM 2155 CG LYS A 150 -6.577 22.386 -36.835 1.00 0.00 C ATOM 2156 CD LYS A 150 -8.070 22.417 -37.113 1.00 0.00 C ATOM 2157 CE LYS A 150 -8.646 23.810 -36.907 1.00 0.00 C ATOM 2158 NZ LYS A 150 -9.940 23.772 -36.168 1.00 0.00 N ATOM 0 H LYS A 150 -4.377 21.121 -35.941 1.00 0.00 H new ATOM 0 HA LYS A 150 -4.608 23.886 -35.592 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -6.508 21.635 -34.832 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -6.948 23.327 -34.949 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -6.084 23.175 -37.403 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -6.162 21.438 -37.178 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -8.258 22.092 -38.136 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -8.578 21.711 -36.456 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -7.931 24.421 -36.356 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -8.795 24.288 -37.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -10.300 24.740 -36.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -10.631 23.210 -36.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -9.794 23.339 -35.234 1.00 0.00 H new ATOM 2172 N PHE A 151 -4.578 22.115 -32.810 1.00 0.00 N ATOM 2173 CA PHE A 151 -4.406 22.191 -31.369 1.00 0.00 C ATOM 2174 C PHE A 151 -3.131 22.946 -31.009 1.00 0.00 C ATOM 2175 O PHE A 151 -3.125 23.787 -30.111 1.00 0.00 O ATOM 2176 CB PHE A 151 -4.364 20.785 -30.769 1.00 0.00 C ATOM 2177 CG PHE A 151 -4.545 20.762 -29.278 1.00 0.00 C ATOM 2178 CD1 PHE A 151 -3.455 20.883 -28.433 1.00 0.00 C ATOM 2179 CD2 PHE A 151 -5.807 20.618 -28.721 1.00 0.00 C ATOM 2180 CE1 PHE A 151 -3.617 20.861 -27.060 1.00 0.00 C ATOM 2181 CE2 PHE A 151 -5.977 20.595 -27.350 1.00 0.00 C ATOM 2182 CZ PHE A 151 -4.880 20.718 -26.519 1.00 0.00 C ATOM 0 H PHE A 151 -4.634 21.164 -33.176 1.00 0.00 H new ATOM 0 HA PHE A 151 -5.255 22.734 -30.955 1.00 0.00 H new ATOM 0 HB2 PHE A 151 -5.143 20.179 -31.231 1.00 0.00 H new ATOM 0 HB3 PHE A 151 -3.410 20.321 -31.018 1.00 0.00 H new ATOM 0 HD1 PHE A 151 -2.466 20.996 -28.851 1.00 0.00 H new ATOM 0 HD2 PHE A 151 -6.667 20.523 -29.367 1.00 0.00 H new ATOM 0 HE1 PHE A 151 -2.758 20.955 -26.412 1.00 0.00 H new ATOM 0 HE2 PHE A 151 -6.965 20.481 -26.929 1.00 0.00 H new ATOM 0 HZ PHE A 151 -5.010 20.702 -25.447 1.00 0.00 H new