USER MOD reduce.3.24.130724 H: found=0, std=0, add=1112, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1110 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 96 LYS NZ :NH3+ -154:sc= 1.23 (180deg=1.2) USER MOD Set 1.2: A 98 TYR OH : rot 20:sc= 1.29 USER MOD Set 2.1: A 31 TYR OH : rot -177:sc= 1.64 USER MOD Set 2.2: A 50 CYS SG : rot 144:sc= 1.21 USER MOD Set 2.3: A 55 SER OG : rot 179:sc= 1.29 USER MOD Set 3.1: A 39 HIS : no HE2:sc= -0.639 K(o=-0.61,f=-8.4) USER MOD Set 3.2: A 43 GLN : amide:sc= 0.0236 K(o=-0.61,f=-7.6!) USER MOD Single : A 10 GLN : amide:sc= 0.562 K(o=0.56,f=-1.3!) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN : amide:sc= -0.473 X(o=-0.47,f=0) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 SER OG : rot 180:sc= 0.0521 USER MOD Single : A 27 CYS SG : rot 65:sc= 0.768 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 THR OG1 : rot 42:sc= 0.191 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 GLN : amide:sc= -0.0616 K(o=-0.062,f=-2.7) USER MOD Single : A 48 ASN : amide:sc= 1.19 K(o=1.2,f=-2.5!) USER MOD Single : A 62 THR OG1 : rot 162:sc= 0.137 USER MOD Single : A 64 THR OG1 : rot 7:sc= 0.735 USER MOD Single : A 65 ASN : amide:sc= -0.299 K(o=-0.3,f=-4.3!) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 74 SER OG : rot 180:sc= 0.0437 USER MOD Single : A 76 GLN : amide:sc= 1.09 K(o=1.1,f=-5.8!) USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0.0526 USER MOD Single : A 84 SER OG : rot 180:sc= 0.0447 USER MOD Single : A 87 TYR OH : rot 180:sc= 0.419 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 MET CE :methyl 144:sc= -2.71! (180deg=-3.68!) USER MOD Single : A 106 ASN : amide:sc= 0.831 K(o=0.83,f=-1.1) USER MOD Single : A 109 CYS SG : rot -110:sc= -2.47 USER MOD Single : A 113 LYS NZ :NH3+ -133:sc= 1.32 (180deg=0.774) USER MOD Single : A 119 HIS : no HD1:sc= -0.19 X(o=-0.19,f=-0.0031) USER MOD Single : A 124 MET CE :methyl 172:sc= -1.28 (180deg=-1.59) USER MOD Single : A 126 CYS SG : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= -0.0123 K(o=-0.012,f=-0.8) USER MOD Single : A 136 GLN : amide:sc= 0.0126 K(o=0.013,f=-0.51) USER MOD Single : A 142 GLN : amide:sc= -0.02 X(o=-0.02,f=-0.031) USER MOD Single : A 143 GLN : amide:sc= -0.141 X(o=-0.14,f=0) USER MOD ----------------------------------------------------------------- ATOM 36 N PRO A 4 19.630 -3.581 -7.918 1.00 1.00 N ATOM 37 CA PRO A 4 18.312 -2.970 -7.942 1.00 1.00 C ATOM 38 C PRO A 4 17.378 -3.757 -7.018 1.00 1.00 C ATOM 39 O PRO A 4 17.734 -4.840 -6.544 1.00 1.00 O ATOM 40 CB PRO A 4 17.883 -2.986 -9.403 1.00 1.00 C ATOM 41 CG PRO A 4 18.557 -4.242 -9.941 1.00 1.00 C ATOM 42 CD PRO A 4 19.824 -4.406 -9.097 1.00 1.00 C ATOM 0 HA PRO A 4 18.295 -1.944 -7.573 1.00 1.00 H new ATOM 0 HB2 PRO A 4 16.799 -3.034 -9.505 1.00 1.00 H new ATOM 0 HB3 PRO A 4 18.214 -2.092 -9.931 1.00 1.00 H new ATOM 0 HG2 PRO A 4 17.905 -5.111 -9.847 1.00 1.00 H new ATOM 0 HG3 PRO A 4 18.798 -4.138 -10.999 1.00 1.00 H new ATOM 0 HD2 PRO A 4 19.977 -5.450 -8.822 1.00 1.00 H new ATOM 0 HD3 PRO A 4 20.707 -4.090 -9.653 1.00 1.00 H new ATOM 50 N ARG A 5 16.187 -3.196 -6.786 1.00 1.00 N ATOM 51 CA ARG A 5 15.267 -3.437 -5.667 1.00 1.00 C ATOM 52 C ARG A 5 15.734 -2.642 -4.456 1.00 1.00 C ATOM 53 O ARG A 5 14.948 -2.453 -3.538 1.00 1.00 O ATOM 54 CB ARG A 5 15.073 -4.910 -5.274 1.00 1.00 C ATOM 55 CG ARG A 5 14.676 -5.867 -6.397 1.00 1.00 C ATOM 56 CD ARG A 5 13.273 -5.580 -6.957 1.00 1.00 C ATOM 57 NE ARG A 5 13.197 -5.823 -8.409 1.00 1.00 N ATOM 58 CZ ARG A 5 12.372 -5.233 -9.282 1.00 1.00 C ATOM 59 NH1 ARG A 5 11.451 -4.363 -8.882 1.00 1.00 N ATOM 60 NH2 ARG A 5 12.495 -5.506 -10.576 1.00 1.00 N ATOM 0 H ARG A 5 15.809 -2.502 -7.431 1.00 1.00 H new ATOM 0 HA ARG A 5 14.289 -3.107 -6.018 1.00 1.00 H new ATOM 0 HB2 ARG A 5 16.001 -5.270 -4.831 1.00 1.00 H new ATOM 0 HB3 ARG A 5 14.309 -4.959 -4.498 1.00 1.00 H new ATOM 0 HG2 ARG A 5 15.406 -5.796 -7.204 1.00 1.00 H new ATOM 0 HG3 ARG A 5 14.711 -6.891 -6.025 1.00 1.00 H new ATOM 0 HD2 ARG A 5 12.543 -6.208 -6.446 1.00 1.00 H new ATOM 0 HD3 ARG A 5 13.004 -4.544 -6.748 1.00 1.00 H new ATOM 0 HE ARG A 5 13.843 -6.515 -8.789 1.00 1.00 H new ATOM 0 HH11 ARG A 5 11.362 -4.133 -7.892 1.00 1.00 H new ATOM 0 HH12 ARG A 5 10.833 -3.925 -9.565 1.00 1.00 H new ATOM 0 HH21 ARG A 5 13.212 -6.158 -10.894 1.00 1.00 H new ATOM 0 HH22 ARG A 5 11.873 -5.063 -11.252 1.00 1.00 H new ATOM 74 N VAL A 6 16.952 -2.104 -4.453 1.00 1.00 N ATOM 75 CA VAL A 6 17.484 -1.364 -3.326 1.00 1.00 C ATOM 76 C VAL A 6 18.302 -0.180 -3.843 1.00 1.00 C ATOM 77 O VAL A 6 18.972 -0.288 -4.872 1.00 1.00 O ATOM 78 CB VAL A 6 18.252 -2.322 -2.391 1.00 1.00 C ATOM 79 CG1 VAL A 6 17.293 -3.350 -1.778 1.00 1.00 C ATOM 80 CG2 VAL A 6 19.378 -3.113 -3.068 1.00 1.00 C ATOM 0 H VAL A 6 17.596 -2.173 -5.241 1.00 1.00 H new ATOM 0 HA VAL A 6 16.688 -0.937 -2.716 1.00 1.00 H new ATOM 0 HB VAL A 6 18.701 -1.669 -1.643 1.00 1.00 H new ATOM 0 HG11 VAL A 6 17.848 -4.019 -1.121 1.00 1.00 H new ATOM 0 HG12 VAL A 6 16.524 -2.833 -1.204 1.00 1.00 H new ATOM 0 HG13 VAL A 6 16.824 -3.929 -2.573 1.00 1.00 H new ATOM 0 HG21 VAL A 6 19.861 -3.759 -2.335 1.00 1.00 H new ATOM 0 HG22 VAL A 6 18.963 -3.722 -3.871 1.00 1.00 H new ATOM 0 HG23 VAL A 6 20.112 -2.421 -3.481 1.00 1.00 H new ATOM 90 N VAL A 7 18.261 0.952 -3.142 1.00 1.00 N ATOM 91 CA VAL A 7 19.242 2.034 -3.246 1.00 1.00 C ATOM 92 C VAL A 7 20.244 1.861 -2.079 1.00 1.00 C ATOM 93 O VAL A 7 19.983 1.019 -1.216 1.00 1.00 O ATOM 94 CB VAL A 7 18.530 3.408 -3.281 1.00 1.00 C ATOM 95 CG1 VAL A 7 17.385 3.503 -4.299 1.00 1.00 C ATOM 96 CG2 VAL A 7 17.980 3.829 -1.920 1.00 1.00 C ATOM 0 H VAL A 7 17.523 1.149 -2.466 1.00 1.00 H new ATOM 0 HA VAL A 7 19.803 1.991 -4.179 1.00 1.00 H new ATOM 0 HB VAL A 7 19.326 4.086 -3.590 1.00 1.00 H new ATOM 0 HG11 VAL A 7 16.942 4.498 -4.257 1.00 1.00 H new ATOM 0 HG12 VAL A 7 17.773 3.321 -5.301 1.00 1.00 H new ATOM 0 HG13 VAL A 7 16.626 2.758 -4.063 1.00 1.00 H new ATOM 0 HG21 VAL A 7 17.493 4.800 -2.009 1.00 1.00 H new ATOM 0 HG22 VAL A 7 17.257 3.090 -1.575 1.00 1.00 H new ATOM 0 HG23 VAL A 7 18.798 3.898 -1.203 1.00 1.00 H new ATOM 106 N PRO A 8 21.365 2.607 -1.997 1.00 1.00 N ATOM 107 CA PRO A 8 22.254 2.511 -0.845 1.00 1.00 C ATOM 108 C PRO A 8 21.599 3.200 0.351 1.00 1.00 C ATOM 109 O PRO A 8 21.137 2.557 1.289 1.00 1.00 O ATOM 110 CB PRO A 8 23.564 3.175 -1.273 1.00 1.00 C ATOM 111 CG PRO A 8 23.190 4.122 -2.412 1.00 1.00 C ATOM 112 CD PRO A 8 21.871 3.577 -2.960 1.00 1.00 C ATOM 0 HA PRO A 8 22.450 1.485 -0.535 1.00 1.00 H new ATOM 0 HB2 PRO A 8 24.017 3.718 -0.444 1.00 1.00 H new ATOM 0 HB3 PRO A 8 24.291 2.432 -1.603 1.00 1.00 H new ATOM 0 HG2 PRO A 8 23.076 5.145 -2.054 1.00 1.00 H new ATOM 0 HG3 PRO A 8 23.961 4.138 -3.182 1.00 1.00 H new ATOM 0 HD2 PRO A 8 21.153 4.384 -3.105 1.00 1.00 H new ATOM 0 HD3 PRO A 8 22.024 3.108 -3.932 1.00 1.00 H new ATOM 120 N ASP A 9 21.525 4.529 0.297 1.00 1.00 N ATOM 121 CA ASP A 9 20.971 5.399 1.333 1.00 1.00 C ATOM 122 C ASP A 9 19.438 5.372 1.264 1.00 1.00 C ATOM 123 O ASP A 9 18.786 6.374 0.971 1.00 1.00 O ATOM 124 CB ASP A 9 21.536 6.828 1.196 1.00 1.00 C ATOM 125 CG ASP A 9 22.927 6.991 1.804 1.00 1.00 C ATOM 126 OD1 ASP A 9 23.772 6.086 1.630 1.00 1.00 O ATOM 127 OD2 ASP A 9 23.172 8.026 2.468 1.00 1.00 O ATOM 0 H ASP A 9 21.866 5.053 -0.509 1.00 1.00 H new ATOM 0 HA ASP A 9 21.267 5.033 2.316 1.00 1.00 H new ATOM 0 HB2 ASP A 9 21.576 7.095 0.140 1.00 1.00 H new ATOM 0 HB3 ASP A 9 20.853 7.528 1.677 1.00 1.00 H new ATOM 132 N GLN A 10 18.836 4.213 1.532 1.00 1.00 N ATOM 133 CA GLN A 10 17.396 3.968 1.495 1.00 1.00 C ATOM 134 C GLN A 10 16.676 4.963 2.395 1.00 1.00 C ATOM 135 O GLN A 10 15.677 5.551 1.991 1.00 1.00 O ATOM 136 CB GLN A 10 17.087 2.524 1.934 1.00 1.00 C ATOM 137 CG GLN A 10 17.755 1.464 1.033 1.00 1.00 C ATOM 138 CD GLN A 10 18.211 0.193 1.755 1.00 1.00 C ATOM 139 OE1 GLN A 10 18.552 0.227 2.937 1.00 1.00 O ATOM 140 NE2 GLN A 10 18.249 -0.933 1.066 1.00 1.00 N ATOM 0 H GLN A 10 19.365 3.381 1.793 1.00 1.00 H new ATOM 0 HA GLN A 10 17.042 4.100 0.473 1.00 1.00 H new ATOM 0 HB2 GLN A 10 17.422 2.383 2.962 1.00 1.00 H new ATOM 0 HB3 GLN A 10 16.008 2.371 1.927 1.00 1.00 H new ATOM 0 HG2 GLN A 10 17.054 1.185 0.246 1.00 1.00 H new ATOM 0 HG3 GLN A 10 18.619 1.916 0.545 1.00 1.00 H new ATOM 0 HE21 GLN A 10 17.962 -0.942 0.087 1.00 1.00 H new ATOM 0 HE22 GLN A 10 18.565 -1.794 1.513 1.00 1.00 H new ATOM 149 N ARG A 11 17.196 5.182 3.603 1.00 1.00 N ATOM 150 CA ARG A 11 16.566 6.067 4.572 1.00 1.00 C ATOM 151 C ARG A 11 16.575 7.518 4.103 1.00 1.00 C ATOM 152 O ARG A 11 15.602 8.233 4.325 1.00 1.00 O ATOM 153 CB ARG A 11 17.264 5.907 5.934 1.00 1.00 C ATOM 154 CG ARG A 11 16.305 6.051 7.120 1.00 1.00 C ATOM 155 CD ARG A 11 15.270 4.918 7.124 1.00 1.00 C ATOM 156 NE ARG A 11 14.659 4.695 8.441 1.00 1.00 N ATOM 157 CZ ARG A 11 15.230 4.105 9.503 1.00 1.00 C ATOM 158 NH1 ARG A 11 16.473 3.641 9.454 1.00 1.00 N ATOM 159 NH2 ARG A 11 14.544 3.983 10.630 1.00 1.00 N ATOM 0 H ARG A 11 18.060 4.752 3.932 1.00 1.00 H new ATOM 0 HA ARG A 11 15.518 5.786 4.675 1.00 1.00 H new ATOM 0 HB2 ARG A 11 17.743 4.929 5.978 1.00 1.00 H new ATOM 0 HB3 ARG A 11 18.054 6.653 6.021 1.00 1.00 H new ATOM 0 HG2 ARG A 11 16.869 6.038 8.053 1.00 1.00 H new ATOM 0 HG3 ARG A 11 15.797 7.014 7.068 1.00 1.00 H new ATOM 0 HD2 ARG A 11 14.487 5.148 6.402 1.00 1.00 H new ATOM 0 HD3 ARG A 11 15.749 3.997 6.792 1.00 1.00 H new ATOM 0 HE ARG A 11 13.701 5.023 8.561 1.00 1.00 H new ATOM 0 HH11 ARG A 11 17.017 3.729 8.595 1.00 1.00 H new ATOM 0 HH12 ARG A 11 16.884 3.197 10.275 1.00 1.00 H new ATOM 0 HH21 ARG A 11 13.589 4.336 10.686 1.00 1.00 H new ATOM 0 HH22 ARG A 11 14.971 3.536 11.441 1.00 1.00 H new ATOM 173 N SER A 12 17.634 7.958 3.426 1.00 1.00 N ATOM 174 CA SER A 12 17.662 9.298 2.858 1.00 1.00 C ATOM 175 C SER A 12 16.810 9.354 1.588 1.00 1.00 C ATOM 176 O SER A 12 16.156 10.363 1.347 1.00 1.00 O ATOM 177 CB SER A 12 19.109 9.726 2.595 1.00 1.00 C ATOM 178 OG SER A 12 19.929 9.424 3.716 1.00 1.00 O ATOM 0 H SER A 12 18.477 7.408 3.260 1.00 1.00 H new ATOM 0 HA SER A 12 17.232 10.002 3.570 1.00 1.00 H new ATOM 0 HB2 SER A 12 19.490 9.216 1.710 1.00 1.00 H new ATOM 0 HB3 SER A 12 19.146 10.795 2.387 1.00 1.00 H new ATOM 0 HG SER A 12 20.851 9.702 3.532 1.00 1.00 H new ATOM 184 N LYS A 13 16.748 8.299 0.768 1.00 1.00 N ATOM 185 CA LYS A 13 15.898 8.307 -0.422 1.00 1.00 C ATOM 186 C LYS A 13 14.417 8.259 -0.053 1.00 1.00 C ATOM 187 O LYS A 13 13.639 8.870 -0.775 1.00 1.00 O ATOM 188 CB LYS A 13 16.314 7.198 -1.389 1.00 1.00 C ATOM 189 CG LYS A 13 15.659 7.191 -2.789 1.00 1.00 C ATOM 190 CD LYS A 13 16.334 8.087 -3.841 1.00 1.00 C ATOM 191 CE LYS A 13 16.202 9.573 -3.499 1.00 1.00 C ATOM 192 NZ LYS A 13 16.780 10.445 -4.535 1.00 1.00 N ATOM 0 H LYS A 13 17.273 7.436 0.907 1.00 1.00 H new ATOM 0 HA LYS A 13 16.042 9.252 -0.946 1.00 1.00 H new ATOM 0 HB2 LYS A 13 17.394 7.256 -1.523 1.00 1.00 H new ATOM 0 HB3 LYS A 13 16.103 6.240 -0.914 1.00 1.00 H new ATOM 0 HG2 LYS A 13 15.650 6.167 -3.162 1.00 1.00 H new ATOM 0 HG3 LYS A 13 14.619 7.502 -2.686 1.00 1.00 H new ATOM 0 HD2 LYS A 13 17.389 7.825 -3.917 1.00 1.00 H new ATOM 0 HD3 LYS A 13 15.888 7.899 -4.817 1.00 1.00 H new ATOM 0 HE2 LYS A 13 15.148 9.820 -3.368 1.00 1.00 H new ATOM 0 HE3 LYS A 13 16.696 9.769 -2.547 1.00 1.00 H new ATOM 0 HZ1 LYS A 13 16.665 11.440 -4.255 1.00 1.00 H new ATOM 0 HZ2 LYS A 13 17.792 10.231 -4.644 1.00 1.00 H new ATOM 0 HZ3 LYS A 13 16.292 10.281 -5.439 1.00 1.00 H new ATOM 206 N PHE A 14 14.039 7.628 1.063 1.00 1.00 N ATOM 207 CA PHE A 14 12.695 7.683 1.633 1.00 1.00 C ATOM 208 C PHE A 14 12.249 9.132 1.793 1.00 1.00 C ATOM 209 O PHE A 14 11.119 9.477 1.449 1.00 1.00 O ATOM 210 CB PHE A 14 12.685 6.958 2.991 1.00 1.00 C ATOM 211 CG PHE A 14 11.472 7.211 3.867 1.00 1.00 C ATOM 212 CD1 PHE A 14 10.184 6.994 3.352 1.00 1.00 C ATOM 213 CD2 PHE A 14 11.625 7.675 5.189 1.00 1.00 C ATOM 214 CE1 PHE A 14 9.053 7.195 4.160 1.00 1.00 C ATOM 215 CE2 PHE A 14 10.492 7.891 5.995 1.00 1.00 C ATOM 216 CZ PHE A 14 9.207 7.633 5.487 1.00 1.00 C ATOM 0 H PHE A 14 14.679 7.050 1.607 1.00 1.00 H new ATOM 0 HA PHE A 14 11.996 7.185 0.961 1.00 1.00 H new ATOM 0 HB2 PHE A 14 12.761 5.886 2.810 1.00 1.00 H new ATOM 0 HB3 PHE A 14 13.577 7.252 3.545 1.00 1.00 H new ATOM 0 HD1 PHE A 14 10.062 6.671 2.329 1.00 1.00 H new ATOM 0 HD2 PHE A 14 12.612 7.865 5.584 1.00 1.00 H new ATOM 0 HE1 PHE A 14 8.066 7.013 3.762 1.00 1.00 H new ATOM 0 HE2 PHE A 14 10.610 8.255 7.005 1.00 1.00 H new ATOM 0 HZ PHE A 14 8.339 7.771 6.115 1.00 1.00 H new ATOM 226 N GLU A 15 13.134 9.976 2.320 1.00 1.00 N ATOM 227 CA GLU A 15 12.844 11.390 2.460 1.00 1.00 C ATOM 228 C GLU A 15 12.892 12.098 1.099 1.00 1.00 C ATOM 229 O GLU A 15 12.023 12.931 0.835 1.00 1.00 O ATOM 230 CB GLU A 15 13.706 12.018 3.579 1.00 1.00 C ATOM 231 CG GLU A 15 14.952 12.831 3.196 1.00 1.00 C ATOM 232 CD GLU A 15 14.656 14.300 2.892 1.00 1.00 C ATOM 233 OE1 GLU A 15 14.496 15.085 3.854 1.00 1.00 O ATOM 234 OE2 GLU A 15 14.616 14.714 1.714 1.00 1.00 O ATOM 0 H GLU A 15 14.057 9.699 2.655 1.00 1.00 H new ATOM 0 HA GLU A 15 11.817 11.530 2.798 1.00 1.00 H new ATOM 0 HB2 GLU A 15 13.058 12.668 4.167 1.00 1.00 H new ATOM 0 HB3 GLU A 15 14.030 11.211 4.236 1.00 1.00 H new ATOM 0 HG2 GLU A 15 15.675 12.776 4.009 1.00 1.00 H new ATOM 0 HG3 GLU A 15 15.419 12.375 2.323 1.00 1.00 H new ATOM 241 N ASN A 16 13.878 11.772 0.251 1.00 1.00 N ATOM 242 CA ASN A 16 14.300 12.600 -0.870 1.00 1.00 C ATOM 243 C ASN A 16 13.408 12.430 -2.082 1.00 1.00 C ATOM 244 O ASN A 16 13.141 13.432 -2.740 1.00 1.00 O ATOM 245 CB ASN A 16 15.738 12.276 -1.304 1.00 1.00 C ATOM 246 CG ASN A 16 16.770 13.222 -0.727 1.00 1.00 C ATOM 247 OD1 ASN A 16 17.263 14.101 -1.425 1.00 1.00 O ATOM 248 ND2 ASN A 16 17.160 13.017 0.514 1.00 1.00 N ATOM 0 H ASN A 16 14.411 10.906 0.334 1.00 1.00 H new ATOM 0 HA ASN A 16 14.234 13.627 -0.510 1.00 1.00 H new ATOM 0 HB2 ASN A 16 15.980 11.258 -1.000 1.00 1.00 H new ATOM 0 HB3 ASN A 16 15.796 12.307 -2.392 1.00 1.00 H new ATOM 0 HD21 ASN A 16 17.893 13.598 0.921 1.00 1.00 H new ATOM 0 HD22 ASN A 16 16.729 12.277 1.068 1.00 1.00 H new ATOM 255 N GLU A 17 13.037 11.195 -2.443 1.00 1.00 N ATOM 256 CA GLU A 17 12.225 10.950 -3.625 1.00 1.00 C ATOM 257 C GLU A 17 11.011 11.870 -3.707 1.00 1.00 C ATOM 258 O GLU A 17 10.118 11.836 -2.858 1.00 1.00 O ATOM 259 CB GLU A 17 11.801 9.487 -3.618 1.00 1.00 C ATOM 260 CG GLU A 17 12.615 8.690 -4.615 1.00 1.00 C ATOM 261 CD GLU A 17 12.147 8.866 -6.064 1.00 1.00 C ATOM 262 OE1 GLU A 17 11.034 9.368 -6.330 1.00 1.00 O ATOM 263 OE2 GLU A 17 12.950 8.542 -6.967 1.00 1.00 O ATOM 0 H GLU A 17 13.291 10.353 -1.927 1.00 1.00 H new ATOM 0 HA GLU A 17 12.823 11.169 -4.510 1.00 1.00 H new ATOM 0 HB2 GLU A 17 11.931 9.070 -2.619 1.00 1.00 H new ATOM 0 HB3 GLU A 17 10.741 9.409 -3.861 1.00 1.00 H new ATOM 0 HG2 GLU A 17 13.661 8.989 -4.540 1.00 1.00 H new ATOM 0 HG3 GLU A 17 12.566 7.634 -4.351 1.00 1.00 H new ATOM 270 N GLU A 18 10.968 12.679 -4.762 1.00 1.00 N ATOM 271 CA GLU A 18 9.870 13.574 -5.049 1.00 1.00 C ATOM 272 C GLU A 18 8.580 12.797 -5.310 1.00 1.00 C ATOM 273 O GLU A 18 7.494 13.346 -5.112 1.00 1.00 O ATOM 274 CB GLU A 18 10.245 14.426 -6.259 1.00 1.00 C ATOM 275 CG GLU A 18 11.272 15.511 -5.903 1.00 1.00 C ATOM 276 CD GLU A 18 11.713 16.302 -7.133 1.00 1.00 C ATOM 277 OE1 GLU A 18 10.882 16.546 -8.038 1.00 1.00 O ATOM 278 OE2 GLU A 18 12.903 16.688 -7.207 1.00 1.00 O ATOM 0 H GLU A 18 11.717 12.725 -5.452 1.00 1.00 H new ATOM 0 HA GLU A 18 9.688 14.216 -4.187 1.00 1.00 H new ATOM 0 HB2 GLU A 18 10.651 13.785 -7.042 1.00 1.00 H new ATOM 0 HB3 GLU A 18 9.348 14.895 -6.664 1.00 1.00 H new ATOM 0 HG2 GLU A 18 10.841 16.192 -5.169 1.00 1.00 H new ATOM 0 HG3 GLU A 18 12.142 15.049 -5.437 1.00 1.00 H new ATOM 285 N PHE A 19 8.669 11.517 -5.696 1.00 1.00 N ATOM 286 CA PHE A 19 7.510 10.657 -5.739 1.00 1.00 C ATOM 287 C PHE A 19 6.949 10.508 -4.325 1.00 1.00 C ATOM 288 O PHE A 19 5.754 10.727 -4.131 1.00 1.00 O ATOM 289 CB PHE A 19 7.872 9.327 -6.400 1.00 1.00 C ATOM 290 CG PHE A 19 6.671 8.443 -6.631 1.00 1.00 C ATOM 291 CD1 PHE A 19 6.178 7.685 -5.560 1.00 1.00 C ATOM 292 CD2 PHE A 19 6.027 8.402 -7.882 1.00 1.00 C ATOM 293 CE1 PHE A 19 5.032 6.891 -5.728 1.00 1.00 C ATOM 294 CE2 PHE A 19 4.887 7.597 -8.053 1.00 1.00 C ATOM 295 CZ PHE A 19 4.389 6.842 -6.977 1.00 1.00 C ATOM 0 H PHE A 19 9.539 11.067 -5.981 1.00 1.00 H new ATOM 0 HA PHE A 19 6.721 11.093 -6.352 1.00 1.00 H new ATOM 0 HB2 PHE A 19 8.363 9.522 -7.354 1.00 1.00 H new ATOM 0 HB3 PHE A 19 8.591 8.799 -5.774 1.00 1.00 H new ATOM 0 HD1 PHE A 19 6.680 7.712 -4.604 1.00 1.00 H new ATOM 0 HD2 PHE A 19 6.407 8.986 -8.707 1.00 1.00 H new ATOM 0 HE1 PHE A 19 4.645 6.318 -4.898 1.00 1.00 H new ATOM 0 HE2 PHE A 19 4.393 7.559 -9.013 1.00 1.00 H new ATOM 0 HZ PHE A 19 3.513 6.225 -7.110 1.00 1.00 H new ATOM 305 N PHE A 20 7.770 10.185 -3.313 1.00 1.00 N ATOM 306 CA PHE A 20 7.256 10.097 -1.961 1.00 1.00 C ATOM 307 C PHE A 20 6.813 11.451 -1.430 1.00 1.00 C ATOM 308 O PHE A 20 5.807 11.487 -0.734 1.00 1.00 O ATOM 309 CB PHE A 20 8.302 9.473 -1.048 1.00 1.00 C ATOM 310 CG PHE A 20 8.832 8.132 -1.517 1.00 1.00 C ATOM 311 CD1 PHE A 20 8.024 7.165 -2.143 1.00 1.00 C ATOM 312 CD2 PHE A 20 10.189 7.871 -1.341 1.00 1.00 C ATOM 313 CE1 PHE A 20 8.563 5.925 -2.513 1.00 1.00 C ATOM 314 CE2 PHE A 20 10.747 6.640 -1.721 1.00 1.00 C ATOM 315 CZ PHE A 20 9.925 5.655 -2.292 1.00 1.00 C ATOM 0 H PHE A 20 8.766 9.987 -3.412 1.00 1.00 H new ATOM 0 HA PHE A 20 6.372 9.459 -1.980 1.00 1.00 H new ATOM 0 HB2 PHE A 20 9.138 10.165 -0.950 1.00 1.00 H new ATOM 0 HB3 PHE A 20 7.871 9.351 -0.054 1.00 1.00 H new ATOM 0 HD1 PHE A 20 6.984 7.379 -2.339 1.00 1.00 H new ATOM 0 HD2 PHE A 20 10.823 8.629 -0.905 1.00 1.00 H new ATOM 0 HE1 PHE A 20 7.932 5.176 -2.968 1.00 1.00 H new ATOM 0 HE2 PHE A 20 11.800 6.452 -1.575 1.00 1.00 H new ATOM 0 HZ PHE A 20 10.337 4.694 -2.560 1.00 1.00 H new ATOM 325 N ARG A 21 7.466 12.565 -1.783 1.00 1.00 N ATOM 326 CA ARG A 21 7.019 13.894 -1.340 1.00 1.00 C ATOM 327 C ARG A 21 5.602 14.201 -1.802 1.00 1.00 C ATOM 328 O ARG A 21 4.867 14.901 -1.104 1.00 1.00 O ATOM 329 CB ARG A 21 7.948 15.001 -1.880 1.00 1.00 C ATOM 330 CG ARG A 21 9.385 14.981 -1.342 1.00 1.00 C ATOM 331 CD ARG A 21 9.429 15.439 0.119 1.00 1.00 C ATOM 332 NE ARG A 21 10.205 16.677 0.302 1.00 1.00 N ATOM 333 CZ ARG A 21 11.468 16.761 0.731 1.00 1.00 C ATOM 334 NH1 ARG A 21 12.180 15.664 0.943 1.00 1.00 N ATOM 335 NH2 ARG A 21 12.030 17.939 0.955 1.00 1.00 N ATOM 0 H ARG A 21 8.300 12.575 -2.370 1.00 1.00 H new ATOM 0 HA ARG A 21 7.048 13.876 -0.251 1.00 1.00 H new ATOM 0 HB2 ARG A 21 7.985 14.922 -2.966 1.00 1.00 H new ATOM 0 HB3 ARG A 21 7.505 15.969 -1.646 1.00 1.00 H new ATOM 0 HG2 ARG A 21 9.794 13.974 -1.424 1.00 1.00 H new ATOM 0 HG3 ARG A 21 10.014 15.631 -1.950 1.00 1.00 H new ATOM 0 HD2 ARG A 21 8.412 15.596 0.477 1.00 1.00 H new ATOM 0 HD3 ARG A 21 9.864 14.648 0.731 1.00 1.00 H new ATOM 0 HE ARG A 21 9.734 17.554 0.080 1.00 1.00 H new ATOM 0 HH11 ARG A 21 11.765 14.747 0.779 1.00 1.00 H new ATOM 0 HH12 ARG A 21 13.143 15.737 1.270 1.00 1.00 H new ATOM 0 HH21 ARG A 21 11.498 18.795 0.800 1.00 1.00 H new ATOM 0 HH22 ARG A 21 12.995 17.990 1.282 1.00 1.00 H new ATOM 349 N LYS A 22 5.190 13.675 -2.955 1.00 1.00 N ATOM 350 CA LYS A 22 3.824 13.870 -3.418 1.00 1.00 C ATOM 351 C LYS A 22 2.863 13.187 -2.458 1.00 1.00 C ATOM 352 O LYS A 22 1.842 13.763 -2.104 1.00 1.00 O ATOM 353 CB LYS A 22 3.651 13.373 -4.862 1.00 1.00 C ATOM 354 CG LYS A 22 4.357 14.350 -5.812 1.00 1.00 C ATOM 355 CD LYS A 22 4.845 13.707 -7.111 1.00 1.00 C ATOM 356 CE LYS A 22 5.857 14.689 -7.705 1.00 1.00 C ATOM 357 NZ LYS A 22 6.622 14.162 -8.845 1.00 1.00 N ATOM 0 H LYS A 22 5.777 13.118 -3.576 1.00 1.00 H new ATOM 0 HA LYS A 22 3.596 14.936 -3.430 1.00 1.00 H new ATOM 0 HB2 LYS A 22 4.071 12.373 -4.969 1.00 1.00 H new ATOM 0 HB3 LYS A 22 2.592 13.303 -5.112 1.00 1.00 H new ATOM 0 HG2 LYS A 22 3.673 15.163 -6.055 1.00 1.00 H new ATOM 0 HG3 LYS A 22 5.208 14.793 -5.295 1.00 1.00 H new ATOM 0 HD2 LYS A 22 5.306 12.738 -6.919 1.00 1.00 H new ATOM 0 HD3 LYS A 22 4.016 13.535 -7.798 1.00 1.00 H new ATOM 0 HE2 LYS A 22 5.328 15.588 -8.023 1.00 1.00 H new ATOM 0 HE3 LYS A 22 6.555 14.989 -6.923 1.00 1.00 H new ATOM 0 HZ1 LYS A 22 7.283 14.889 -9.186 1.00 1.00 H new ATOM 0 HZ2 LYS A 22 7.157 13.322 -8.546 1.00 1.00 H new ATOM 0 HZ3 LYS A 22 5.969 13.902 -9.611 1.00 1.00 H new ATOM 371 N LEU A 23 3.164 11.954 -2.065 1.00 1.00 N ATOM 372 CA LEU A 23 2.292 11.153 -1.220 1.00 1.00 C ATOM 373 C LEU A 23 2.371 11.610 0.234 1.00 1.00 C ATOM 374 O LEU A 23 1.372 11.534 0.944 1.00 1.00 O ATOM 375 CB LEU A 23 2.641 9.667 -1.411 1.00 1.00 C ATOM 376 CG LEU A 23 2.657 9.230 -2.895 1.00 1.00 C ATOM 377 CD1 LEU A 23 2.677 7.705 -3.054 1.00 1.00 C ATOM 378 CD2 LEU A 23 1.508 9.845 -3.709 1.00 1.00 C ATOM 0 H LEU A 23 4.028 11.480 -2.327 1.00 1.00 H new ATOM 0 HA LEU A 23 1.251 11.290 -1.514 1.00 1.00 H new ATOM 0 HB2 LEU A 23 3.619 9.471 -0.971 1.00 1.00 H new ATOM 0 HB3 LEU A 23 1.919 9.058 -0.868 1.00 1.00 H new ATOM 0 HG LEU A 23 3.590 9.620 -3.303 1.00 1.00 H new ATOM 0 HD11 LEU A 23 2.688 7.450 -4.114 1.00 1.00 H new ATOM 0 HD12 LEU A 23 3.568 7.301 -2.574 1.00 1.00 H new ATOM 0 HD13 LEU A 23 1.789 7.279 -2.587 1.00 1.00 H new ATOM 0 HD21 LEU A 23 1.570 9.503 -4.742 1.00 1.00 H new ATOM 0 HD22 LEU A 23 0.554 9.537 -3.282 1.00 1.00 H new ATOM 0 HD23 LEU A 23 1.584 10.932 -3.681 1.00 1.00 H new ATOM 390 N SER A 24 3.527 12.151 0.631 1.00 1.00 N ATOM 391 CA SER A 24 3.814 12.759 1.901 1.00 1.00 C ATOM 392 C SER A 24 3.526 11.829 3.088 1.00 1.00 C ATOM 393 O SER A 24 3.384 10.602 2.984 1.00 1.00 O ATOM 394 CB SER A 24 3.075 14.110 1.942 1.00 1.00 C ATOM 395 OG SER A 24 3.537 15.003 2.944 1.00 1.00 O ATOM 0 H SER A 24 4.338 12.168 0.013 1.00 1.00 H new ATOM 0 HA SER A 24 4.883 12.946 2.005 1.00 1.00 H new ATOM 0 HB2 SER A 24 3.173 14.593 0.970 1.00 1.00 H new ATOM 0 HB3 SER A 24 2.013 13.924 2.100 1.00 1.00 H new ATOM 0 HG SER A 24 3.021 15.835 2.904 1.00 1.00 H new ATOM 401 N ARG A 25 3.513 12.460 4.258 1.00 1.00 N ATOM 402 CA ARG A 25 2.877 11.992 5.475 1.00 1.00 C ATOM 403 C ARG A 25 1.358 12.094 5.298 1.00 1.00 C ATOM 404 O ARG A 25 0.874 12.353 4.202 1.00 1.00 O ATOM 405 CB ARG A 25 3.341 12.871 6.636 1.00 1.00 C ATOM 406 CG ARG A 25 4.863 12.931 6.808 1.00 1.00 C ATOM 407 CD ARG A 25 5.228 13.649 8.115 1.00 1.00 C ATOM 408 NE ARG A 25 5.131 15.115 8.002 1.00 1.00 N ATOM 409 CZ ARG A 25 4.063 15.908 8.161 1.00 1.00 C ATOM 410 NH1 ARG A 25 2.872 15.426 8.502 1.00 1.00 N ATOM 411 NH2 ARG A 25 4.186 17.216 7.971 1.00 1.00 N ATOM 0 H ARG A 25 3.973 13.362 4.384 1.00 1.00 H new ATOM 0 HA ARG A 25 3.145 10.956 5.684 1.00 1.00 H new ATOM 0 HB2 ARG A 25 2.963 13.882 6.485 1.00 1.00 H new ATOM 0 HB3 ARG A 25 2.896 12.499 7.559 1.00 1.00 H new ATOM 0 HG2 ARG A 25 5.274 11.922 6.813 1.00 1.00 H new ATOM 0 HG3 ARG A 25 5.310 13.453 5.962 1.00 1.00 H new ATOM 0 HD2 ARG A 25 4.567 13.305 8.911 1.00 1.00 H new ATOM 0 HD3 ARG A 25 6.243 13.377 8.404 1.00 1.00 H new ATOM 0 HE ARG A 25 6.001 15.594 7.770 1.00 1.00 H new ATOM 0 HH11 ARG A 25 2.751 14.424 8.651 1.00 1.00 H new ATOM 0 HH12 ARG A 25 2.079 16.058 8.615 1.00 1.00 H new ATOM 0 HH21 ARG A 25 5.089 17.610 7.706 1.00 1.00 H new ATOM 0 HH22 ARG A 25 3.378 17.827 8.090 1.00 1.00 H new ATOM 425 N GLU A 26 0.610 11.865 6.376 1.00 1.00 N ATOM 426 CA GLU A 26 -0.848 11.774 6.424 1.00 1.00 C ATOM 427 C GLU A 26 -1.577 12.747 5.484 1.00 1.00 C ATOM 428 O GLU A 26 -1.614 13.953 5.736 1.00 1.00 O ATOM 429 CB GLU A 26 -1.305 11.925 7.879 1.00 1.00 C ATOM 430 CG GLU A 26 -0.791 13.168 8.628 1.00 1.00 C ATOM 431 CD GLU A 26 0.296 12.826 9.642 1.00 1.00 C ATOM 432 OE1 GLU A 26 -0.039 12.178 10.663 1.00 1.00 O ATOM 433 OE2 GLU A 26 1.454 13.264 9.461 1.00 1.00 O ATOM 0 H GLU A 26 1.032 11.730 7.295 1.00 1.00 H new ATOM 0 HA GLU A 26 -1.127 10.790 6.046 1.00 1.00 H new ATOM 0 HB2 GLU A 26 -2.395 11.941 7.896 1.00 1.00 H new ATOM 0 HB3 GLU A 26 -0.991 11.039 8.430 1.00 1.00 H new ATOM 0 HG2 GLU A 26 -0.400 13.887 7.908 1.00 1.00 H new ATOM 0 HG3 GLU A 26 -1.623 13.651 9.140 1.00 1.00 H new ATOM 440 N CYS A 27 -2.205 12.219 4.430 1.00 1.00 N ATOM 441 CA CYS A 27 -3.027 12.943 3.475 1.00 1.00 C ATOM 442 C CYS A 27 -4.322 12.189 3.179 1.00 1.00 C ATOM 443 O CYS A 27 -4.505 11.033 3.541 1.00 1.00 O ATOM 444 CB CYS A 27 -2.284 13.077 2.149 1.00 1.00 C ATOM 445 SG CYS A 27 -0.815 14.129 2.264 1.00 1.00 S ATOM 0 H CYS A 27 -2.147 11.224 4.215 1.00 1.00 H new ATOM 0 HA CYS A 27 -3.248 13.917 3.912 1.00 1.00 H new ATOM 0 HB2 CYS A 27 -1.989 12.087 1.803 1.00 1.00 H new ATOM 0 HB3 CYS A 27 -2.961 13.488 1.400 1.00 1.00 H new ATOM 0 HG CYS A 27 0.057 13.572 3.050 1.00 1.00 H new ATOM 451 N GLU A 28 -5.218 12.850 2.462 1.00 1.00 N ATOM 452 CA GLU A 28 -6.450 12.253 1.976 1.00 1.00 C ATOM 453 C GLU A 28 -6.166 11.405 0.722 1.00 1.00 C ATOM 454 O GLU A 28 -5.312 11.765 -0.102 1.00 1.00 O ATOM 455 CB GLU A 28 -7.424 13.402 1.668 1.00 1.00 C ATOM 456 CG GLU A 28 -8.894 13.036 1.886 1.00 1.00 C ATOM 457 CD GLU A 28 -9.302 13.365 3.327 1.00 1.00 C ATOM 458 OE1 GLU A 28 -9.023 12.591 4.269 1.00 1.00 O ATOM 459 OE2 GLU A 28 -9.836 14.483 3.529 1.00 1.00 O ATOM 0 H GLU A 28 -5.107 13.829 2.199 1.00 1.00 H new ATOM 0 HA GLU A 28 -6.887 11.588 2.721 1.00 1.00 H new ATOM 0 HB2 GLU A 28 -7.174 14.257 2.297 1.00 1.00 H new ATOM 0 HB3 GLU A 28 -7.286 13.716 0.633 1.00 1.00 H new ATOM 0 HG2 GLU A 28 -9.523 13.585 1.186 1.00 1.00 H new ATOM 0 HG3 GLU A 28 -9.048 11.975 1.688 1.00 1.00 H new ATOM 466 N ILE A 29 -6.908 10.312 0.540 1.00 1.00 N ATOM 467 CA ILE A 29 -6.744 9.312 -0.515 1.00 1.00 C ATOM 468 C ILE A 29 -8.100 8.867 -1.059 1.00 1.00 C ATOM 469 O ILE A 29 -9.134 9.003 -0.407 1.00 1.00 O ATOM 470 CB ILE A 29 -5.966 8.074 -0.008 1.00 1.00 C ATOM 471 CG1 ILE A 29 -6.680 7.467 1.212 1.00 1.00 C ATOM 472 CG2 ILE A 29 -4.502 8.414 0.302 1.00 1.00 C ATOM 473 CD1 ILE A 29 -6.178 6.094 1.632 1.00 1.00 C ATOM 0 H ILE A 29 -7.685 10.088 1.162 1.00 1.00 H new ATOM 0 HA ILE A 29 -6.171 9.782 -1.314 1.00 1.00 H new ATOM 0 HB ILE A 29 -5.951 7.328 -0.802 1.00 1.00 H new ATOM 0 HG12 ILE A 29 -6.572 8.150 2.054 1.00 1.00 H new ATOM 0 HG13 ILE A 29 -7.745 7.397 0.993 1.00 1.00 H new ATOM 0 HG21 ILE A 29 -3.988 7.520 0.655 1.00 1.00 H new ATOM 0 HG22 ILE A 29 -4.014 8.780 -0.602 1.00 1.00 H new ATOM 0 HG23 ILE A 29 -4.463 9.184 1.073 1.00 1.00 H new ATOM 0 HD11 ILE A 29 -6.742 5.750 2.499 1.00 1.00 H new ATOM 0 HD12 ILE A 29 -6.312 5.391 0.810 1.00 1.00 H new ATOM 0 HD13 ILE A 29 -5.120 6.156 1.888 1.00 1.00 H new ATOM 485 N LYS A 30 -8.066 8.274 -2.250 1.00 1.00 N ATOM 486 CA LYS A 30 -9.249 7.749 -2.947 1.00 1.00 C ATOM 487 C LYS A 30 -8.890 6.498 -3.730 1.00 1.00 C ATOM 488 O LYS A 30 -7.894 6.501 -4.441 1.00 1.00 O ATOM 489 CB LYS A 30 -9.801 8.864 -3.839 1.00 1.00 C ATOM 490 CG LYS A 30 -11.071 8.515 -4.623 1.00 1.00 C ATOM 491 CD LYS A 30 -11.850 9.797 -4.960 1.00 1.00 C ATOM 492 CE LYS A 30 -11.046 10.796 -5.800 1.00 1.00 C ATOM 493 NZ LYS A 30 -11.628 12.155 -5.786 1.00 1.00 N ATOM 0 H LYS A 30 -7.200 8.140 -2.772 1.00 1.00 H new ATOM 0 HA LYS A 30 -10.022 7.452 -2.238 1.00 1.00 H new ATOM 0 HB2 LYS A 30 -10.007 9.735 -3.217 1.00 1.00 H new ATOM 0 HB3 LYS A 30 -9.026 9.155 -4.548 1.00 1.00 H new ATOM 0 HG2 LYS A 30 -10.809 7.987 -5.540 1.00 1.00 H new ATOM 0 HG3 LYS A 30 -11.697 7.843 -4.036 1.00 1.00 H new ATOM 0 HD2 LYS A 30 -12.759 9.530 -5.499 1.00 1.00 H new ATOM 0 HD3 LYS A 30 -12.159 10.280 -4.033 1.00 1.00 H new ATOM 0 HE2 LYS A 30 -10.024 10.840 -5.424 1.00 1.00 H new ATOM 0 HE3 LYS A 30 -10.993 10.439 -6.829 1.00 1.00 H new ATOM 0 HZ1 LYS A 30 -11.045 12.788 -6.369 1.00 1.00 H new ATOM 0 HZ2 LYS A 30 -12.594 12.123 -6.170 1.00 1.00 H new ATOM 0 HZ3 LYS A 30 -11.655 12.511 -4.809 1.00 1.00 H new ATOM 507 N TYR A 31 -9.647 5.409 -3.603 1.00 1.00 N ATOM 508 CA TYR A 31 -9.429 4.200 -4.375 1.00 1.00 C ATOM 509 C TYR A 31 -9.799 4.489 -5.828 1.00 1.00 C ATOM 510 O TYR A 31 -10.829 5.113 -6.074 1.00 1.00 O ATOM 511 CB TYR A 31 -10.307 3.114 -3.755 1.00 1.00 C ATOM 512 CG TYR A 31 -9.798 1.699 -3.890 1.00 1.00 C ATOM 513 CD1 TYR A 31 -9.614 1.078 -5.144 1.00 1.00 C ATOM 514 CD2 TYR A 31 -9.502 0.997 -2.712 1.00 1.00 C ATOM 515 CE1 TYR A 31 -9.168 -0.255 -5.219 1.00 1.00 C ATOM 516 CE2 TYR A 31 -9.018 -0.311 -2.789 1.00 1.00 C ATOM 517 CZ TYR A 31 -8.903 -0.961 -4.025 1.00 1.00 C ATOM 518 OH TYR A 31 -8.662 -2.291 -4.005 1.00 1.00 O ATOM 0 H TYR A 31 -10.433 5.347 -2.955 1.00 1.00 H new ATOM 0 HA TYR A 31 -8.392 3.866 -4.360 1.00 1.00 H new ATOM 0 HB2 TYR A 31 -10.431 3.335 -2.695 1.00 1.00 H new ATOM 0 HB3 TYR A 31 -11.296 3.169 -4.210 1.00 1.00 H new ATOM 0 HD1 TYR A 31 -9.816 1.628 -6.051 1.00 1.00 H new ATOM 0 HD2 TYR A 31 -9.648 1.466 -1.750 1.00 1.00 H new ATOM 0 HE1 TYR A 31 -9.030 -0.732 -6.178 1.00 1.00 H new ATOM 0 HE2 TYR A 31 -8.729 -0.827 -1.885 1.00 1.00 H new ATOM 0 HH TYR A 31 -8.556 -2.590 -3.078 1.00 1.00 H new ATOM 528 N THR A 32 -9.015 4.023 -6.799 1.00 1.00 N ATOM 529 CA THR A 32 -9.262 4.298 -8.210 1.00 1.00 C ATOM 530 C THR A 32 -9.129 2.979 -8.967 1.00 1.00 C ATOM 531 O THR A 32 -8.121 2.717 -9.620 1.00 1.00 O ATOM 532 CB THR A 32 -8.349 5.436 -8.703 1.00 1.00 C ATOM 533 OG1 THR A 32 -6.976 5.142 -8.520 1.00 1.00 O ATOM 534 CG2 THR A 32 -8.648 6.754 -7.976 1.00 1.00 C ATOM 0 H THR A 32 -8.192 3.445 -6.628 1.00 1.00 H new ATOM 0 HA THR A 32 -10.271 4.670 -8.390 1.00 1.00 H new ATOM 0 HB THR A 32 -8.559 5.537 -9.768 1.00 1.00 H new ATOM 0 HG1 THR A 32 -6.806 4.208 -8.762 1.00 1.00 H new ATOM 0 HG21 THR A 32 -7.985 7.534 -8.350 1.00 1.00 H new ATOM 0 HG22 THR A 32 -9.684 7.042 -8.156 1.00 1.00 H new ATOM 0 HG23 THR A 32 -8.488 6.624 -6.906 1.00 1.00 H new ATOM 542 N GLY A 33 -10.140 2.125 -8.801 1.00 1.00 N ATOM 543 CA GLY A 33 -10.127 0.726 -9.198 1.00 1.00 C ATOM 544 C GLY A 33 -11.520 0.294 -9.641 1.00 1.00 C ATOM 545 O GLY A 33 -12.323 1.131 -10.065 1.00 1.00 O ATOM 0 H GLY A 33 -11.021 2.404 -8.370 1.00 1.00 H new ATOM 0 HA2 GLY A 33 -9.416 0.577 -10.011 1.00 1.00 H new ATOM 0 HA3 GLY A 33 -9.793 0.107 -8.365 1.00 1.00 H new ATOM 549 N PHE A 34 -11.850 -0.994 -9.506 1.00 1.00 N ATOM 550 CA PHE A 34 -13.164 -1.565 -9.793 1.00 1.00 C ATOM 551 C PHE A 34 -14.238 -0.908 -8.914 1.00 1.00 C ATOM 552 O PHE A 34 -15.430 -1.025 -9.203 1.00 1.00 O ATOM 553 CB PHE A 34 -13.083 -3.078 -9.522 1.00 1.00 C ATOM 554 CG PHE A 34 -12.573 -3.332 -8.118 1.00 1.00 C ATOM 555 CD1 PHE A 34 -13.439 -3.128 -7.035 1.00 1.00 C ATOM 556 CD2 PHE A 34 -11.198 -3.484 -7.887 1.00 1.00 C ATOM 557 CE1 PHE A 34 -12.950 -3.008 -5.727 1.00 1.00 C ATOM 558 CE2 PHE A 34 -10.699 -3.334 -6.587 1.00 1.00 C ATOM 559 CZ PHE A 34 -11.567 -3.087 -5.512 1.00 1.00 C ATOM 0 H PHE A 34 -11.181 -1.692 -9.181 1.00 1.00 H new ATOM 0 HA PHE A 34 -13.441 -1.384 -10.832 1.00 1.00 H new ATOM 0 HB2 PHE A 34 -14.067 -3.530 -9.647 1.00 1.00 H new ATOM 0 HB3 PHE A 34 -12.421 -3.550 -10.248 1.00 1.00 H new ATOM 0 HD1 PHE A 34 -14.502 -3.062 -7.212 1.00 1.00 H new ATOM 0 HD2 PHE A 34 -10.530 -3.715 -8.704 1.00 1.00 H new ATOM 0 HE1 PHE A 34 -13.627 -2.857 -4.899 1.00 1.00 H new ATOM 0 HE2 PHE A 34 -9.636 -3.409 -6.410 1.00 1.00 H new ATOM 0 HZ PHE A 34 -11.168 -2.957 -4.517 1.00 1.00 H new ATOM 569 N ARG A 35 -13.830 -0.222 -7.834 1.00 1.00 N ATOM 570 CA ARG A 35 -14.701 0.554 -6.950 1.00 1.00 C ATOM 571 C ARG A 35 -15.559 1.576 -7.685 1.00 1.00 C ATOM 572 O ARG A 35 -16.527 2.031 -7.098 1.00 1.00 O ATOM 573 CB ARG A 35 -13.870 1.314 -5.896 1.00 1.00 C ATOM 574 CG ARG A 35 -13.182 2.601 -6.403 1.00 1.00 C ATOM 575 CD ARG A 35 -13.945 3.850 -5.928 1.00 1.00 C ATOM 576 NE ARG A 35 -13.703 5.026 -6.773 1.00 1.00 N ATOM 577 CZ ARG A 35 -13.792 6.300 -6.378 1.00 1.00 C ATOM 578 NH1 ARG A 35 -14.151 6.625 -5.139 1.00 1.00 N ATOM 579 NH2 ARG A 35 -13.541 7.244 -7.274 1.00 1.00 N ATOM 0 H ARG A 35 -12.852 -0.194 -7.547 1.00 1.00 H new ATOM 0 HA ARG A 35 -15.361 -0.178 -6.484 1.00 1.00 H new ATOM 0 HB2 ARG A 35 -14.521 1.574 -5.062 1.00 1.00 H new ATOM 0 HB3 ARG A 35 -13.105 0.642 -5.506 1.00 1.00 H new ATOM 0 HG2 ARG A 35 -12.155 2.637 -6.041 1.00 1.00 H new ATOM 0 HG3 ARG A 35 -13.136 2.590 -7.492 1.00 1.00 H new ATOM 0 HD2 ARG A 35 -15.013 3.633 -5.914 1.00 1.00 H new ATOM 0 HD3 ARG A 35 -13.653 4.080 -4.903 1.00 1.00 H new ATOM 0 HE ARG A 35 -13.445 4.856 -7.745 1.00 1.00 H new ATOM 0 HH11 ARG A 35 -14.367 5.893 -4.462 1.00 1.00 H new ATOM 0 HH12 ARG A 35 -14.210 7.606 -4.866 1.00 1.00 H new ATOM 0 HH21 ARG A 35 -13.290 6.987 -8.229 1.00 1.00 H new ATOM 0 HH22 ARG A 35 -13.599 8.227 -7.009 1.00 1.00 H new ATOM 593 N ASP A 36 -15.166 1.982 -8.893 1.00 1.00 N ATOM 594 CA ASP A 36 -15.793 3.105 -9.595 1.00 1.00 C ATOM 595 C ASP A 36 -17.056 2.707 -10.371 1.00 1.00 C ATOM 596 O ASP A 36 -17.730 3.563 -10.944 1.00 1.00 O ATOM 597 CB ASP A 36 -14.763 3.836 -10.476 1.00 1.00 C ATOM 598 CG ASP A 36 -14.737 5.331 -10.160 1.00 1.00 C ATOM 599 OD1 ASP A 36 -15.750 6.022 -10.407 1.00 1.00 O ATOM 600 OD2 ASP A 36 -13.711 5.834 -9.649 1.00 1.00 O ATOM 0 H ASP A 36 -14.406 1.543 -9.412 1.00 1.00 H new ATOM 0 HA ASP A 36 -16.141 3.805 -8.835 1.00 1.00 H new ATOM 0 HB2 ASP A 36 -13.773 3.409 -10.315 1.00 1.00 H new ATOM 0 HB3 ASP A 36 -15.007 3.687 -11.528 1.00 1.00 H new ATOM 605 N ARG A 37 -17.397 1.414 -10.392 1.00 1.00 N ATOM 606 CA ARG A 37 -18.755 0.943 -10.687 1.00 1.00 C ATOM 607 C ARG A 37 -19.666 1.352 -9.508 1.00 1.00 C ATOM 608 O ARG A 37 -19.128 1.680 -8.454 1.00 1.00 O ATOM 609 CB ARG A 37 -18.696 -0.582 -10.935 1.00 1.00 C ATOM 610 CG ARG A 37 -18.300 -0.929 -12.381 1.00 1.00 C ATOM 611 CD ARG A 37 -16.783 -0.967 -12.624 1.00 1.00 C ATOM 612 NE ARG A 37 -16.458 -0.536 -13.991 1.00 1.00 N ATOM 613 CZ ARG A 37 -15.833 -1.208 -14.964 1.00 1.00 C ATOM 614 NH1 ARG A 37 -15.460 -2.473 -14.818 1.00 1.00 N ATOM 615 NH2 ARG A 37 -15.580 -0.592 -16.109 1.00 1.00 N ATOM 0 H ARG A 37 -16.735 0.661 -10.204 1.00 1.00 H new ATOM 0 HA ARG A 37 -19.174 1.392 -11.588 1.00 1.00 H new ATOM 0 HB2 ARG A 37 -17.979 -1.031 -10.248 1.00 1.00 H new ATOM 0 HB3 ARG A 37 -19.669 -1.021 -10.713 1.00 1.00 H new ATOM 0 HG2 ARG A 37 -18.723 -1.900 -12.639 1.00 1.00 H new ATOM 0 HG3 ARG A 37 -18.747 -0.197 -13.054 1.00 1.00 H new ATOM 0 HD2 ARG A 37 -16.280 -0.320 -11.905 1.00 1.00 H new ATOM 0 HD3 ARG A 37 -16.410 -1.978 -12.459 1.00 1.00 H new ATOM 0 HE ARG A 37 -16.751 0.411 -14.232 1.00 1.00 H new ATOM 0 HH11 ARG A 37 -15.648 -2.962 -13.943 1.00 1.00 H new ATOM 0 HH12 ARG A 37 -14.985 -2.956 -15.581 1.00 1.00 H new ATOM 0 HH21 ARG A 37 -15.861 0.380 -16.238 1.00 1.00 H new ATOM 0 HH22 ARG A 37 -15.104 -1.090 -16.862 1.00 1.00 H new ATOM 629 N PRO A 38 -21.010 1.335 -9.616 1.00 1.00 N ATOM 630 CA PRO A 38 -21.885 1.914 -8.592 1.00 1.00 C ATOM 631 C PRO A 38 -21.630 1.292 -7.217 1.00 1.00 C ATOM 632 O PRO A 38 -21.564 0.065 -7.099 1.00 1.00 O ATOM 633 CB PRO A 38 -23.322 1.670 -9.066 1.00 1.00 C ATOM 634 CG PRO A 38 -23.175 0.518 -10.053 1.00 1.00 C ATOM 635 CD PRO A 38 -21.827 0.823 -10.705 1.00 1.00 C ATOM 0 HA PRO A 38 -21.692 2.980 -8.471 1.00 1.00 H new ATOM 0 HB2 PRO A 38 -23.980 1.408 -8.237 1.00 1.00 H new ATOM 0 HB3 PRO A 38 -23.745 2.555 -9.541 1.00 1.00 H new ATOM 0 HG2 PRO A 38 -23.175 -0.450 -9.552 1.00 1.00 H new ATOM 0 HG3 PRO A 38 -23.985 0.500 -10.782 1.00 1.00 H new ATOM 0 HD2 PRO A 38 -21.387 -0.071 -11.146 1.00 1.00 H new ATOM 0 HD3 PRO A 38 -21.929 1.556 -11.505 1.00 1.00 H new ATOM 643 N HIS A 39 -21.465 2.133 -6.192 1.00 1.00 N ATOM 644 CA HIS A 39 -21.164 1.716 -4.829 1.00 1.00 C ATOM 645 C HIS A 39 -22.294 0.876 -4.221 1.00 1.00 C ATOM 646 O HIS A 39 -23.413 0.827 -4.724 1.00 1.00 O ATOM 647 CB HIS A 39 -20.885 2.942 -3.945 1.00 1.00 C ATOM 648 CG HIS A 39 -20.305 2.642 -2.583 1.00 1.00 C ATOM 649 ND1 HIS A 39 -19.105 2.023 -2.313 1.00 1.00 N ATOM 650 CD2 HIS A 39 -20.930 2.879 -1.387 1.00 1.00 C ATOM 651 CE1 HIS A 39 -19.036 1.852 -0.980 1.00 1.00 C ATOM 652 NE2 HIS A 39 -20.151 2.302 -0.380 1.00 1.00 N ATOM 0 H HIS A 39 -21.540 3.145 -6.294 1.00 1.00 H new ATOM 0 HA HIS A 39 -20.273 1.089 -4.871 1.00 1.00 H new ATOM 0 HB2 HIS A 39 -20.199 3.602 -4.476 1.00 1.00 H new ATOM 0 HB3 HIS A 39 -21.817 3.491 -3.811 1.00 1.00 H new ATOM 0 HD1 HIS A 39 -18.400 1.746 -2.996 1.00 1.00 H new ATOM 0 HD2 HIS A 39 -21.857 3.415 -1.247 1.00 1.00 H new ATOM 0 HE1 HIS A 39 -18.197 1.412 -0.462 1.00 1.00 H new ATOM 660 N GLU A 40 -21.937 0.252 -3.104 1.00 1.00 N ATOM 661 CA GLU A 40 -22.643 -0.491 -2.061 1.00 1.00 C ATOM 662 C GLU A 40 -22.071 -1.906 -2.085 1.00 1.00 C ATOM 663 O GLU A 40 -21.503 -2.380 -1.104 1.00 1.00 O ATOM 664 CB GLU A 40 -24.176 -0.423 -2.178 1.00 1.00 C ATOM 665 CG GLU A 40 -24.876 -0.991 -0.932 1.00 1.00 C ATOM 666 CD GLU A 40 -26.372 -0.649 -0.864 1.00 1.00 C ATOM 667 OE1 GLU A 40 -26.948 -0.153 -1.859 1.00 1.00 O ATOM 668 OE2 GLU A 40 -26.983 -0.854 0.213 1.00 1.00 O ATOM 0 H GLU A 40 -20.945 0.261 -2.867 1.00 1.00 H new ATOM 0 HA GLU A 40 -22.475 -0.037 -1.085 1.00 1.00 H new ATOM 0 HB2 GLU A 40 -24.483 0.613 -2.325 1.00 1.00 H new ATOM 0 HB3 GLU A 40 -24.497 -0.979 -3.059 1.00 1.00 H new ATOM 0 HG2 GLU A 40 -24.758 -2.074 -0.920 1.00 1.00 H new ATOM 0 HG3 GLU A 40 -24.382 -0.606 -0.040 1.00 1.00 H new ATOM 675 N GLU A 41 -22.039 -2.501 -3.273 1.00 1.00 N ATOM 676 CA GLU A 41 -21.465 -3.824 -3.528 1.00 1.00 C ATOM 677 C GLU A 41 -19.946 -3.669 -3.554 1.00 1.00 C ATOM 678 O GLU A 41 -19.178 -4.515 -3.086 1.00 1.00 O ATOM 679 CB GLU A 41 -21.970 -4.338 -4.887 1.00 1.00 C ATOM 680 CG GLU A 41 -21.739 -5.838 -5.114 1.00 1.00 C ATOM 681 CD GLU A 41 -22.930 -6.666 -4.630 1.00 1.00 C ATOM 682 OE1 GLU A 41 -23.145 -6.789 -3.404 1.00 1.00 O ATOM 683 OE2 GLU A 41 -23.692 -7.168 -5.491 1.00 1.00 O ATOM 0 H GLU A 41 -22.422 -2.066 -4.112 1.00 1.00 H new ATOM 0 HA GLU A 41 -21.757 -4.536 -2.756 1.00 1.00 H new ATOM 0 HB2 GLU A 41 -23.037 -4.129 -4.969 1.00 1.00 H new ATOM 0 HB3 GLU A 41 -21.474 -3.780 -5.681 1.00 1.00 H new ATOM 0 HG2 GLU A 41 -21.571 -6.025 -6.175 1.00 1.00 H new ATOM 0 HG3 GLU A 41 -20.838 -6.152 -4.588 1.00 1.00 H new ATOM 690 N ARG A 42 -19.507 -2.506 -4.054 1.00 1.00 N ATOM 691 CA ARG A 42 -18.109 -2.129 -4.117 1.00 1.00 C ATOM 692 C ARG A 42 -17.457 -2.191 -2.744 1.00 1.00 C ATOM 693 O ARG A 42 -16.252 -2.370 -2.688 1.00 1.00 O ATOM 694 CB ARG A 42 -17.922 -0.712 -4.677 1.00 1.00 C ATOM 695 CG ARG A 42 -18.536 -0.465 -6.056 1.00 1.00 C ATOM 696 CD ARG A 42 -17.839 -1.188 -7.211 1.00 1.00 C ATOM 697 NE ARG A 42 -18.702 -2.220 -7.798 1.00 1.00 N ATOM 698 CZ ARG A 42 -18.338 -3.225 -8.596 1.00 1.00 C ATOM 699 NH1 ARG A 42 -17.072 -3.345 -8.987 1.00 1.00 N ATOM 700 NH2 ARG A 42 -19.265 -4.084 -8.992 1.00 1.00 N ATOM 0 H ARG A 42 -20.134 -1.795 -4.430 1.00 1.00 H new ATOM 0 HA ARG A 42 -17.632 -2.845 -4.786 1.00 1.00 H new ATOM 0 HB2 ARG A 42 -18.355 -0.001 -3.973 1.00 1.00 H new ATOM 0 HB3 ARG A 42 -16.854 -0.498 -4.730 1.00 1.00 H new ATOM 0 HG2 ARG A 42 -19.581 -0.772 -6.032 1.00 1.00 H new ATOM 0 HG3 ARG A 42 -18.523 0.606 -6.257 1.00 1.00 H new ATOM 0 HD2 ARG A 42 -17.560 -0.466 -7.978 1.00 1.00 H new ATOM 0 HD3 ARG A 42 -16.916 -1.644 -6.852 1.00 1.00 H new ATOM 0 HE ARG A 42 -19.694 -2.162 -7.569 1.00 1.00 H new ATOM 0 HH11 ARG A 42 -16.376 -2.667 -8.677 1.00 1.00 H new ATOM 0 HH12 ARG A 42 -16.797 -4.115 -9.597 1.00 1.00 H new ATOM 0 HH21 ARG A 42 -20.231 -3.968 -8.687 1.00 1.00 H new ATOM 0 HH22 ARG A 42 -19.013 -4.861 -9.602 1.00 1.00 H new ATOM 714 N GLN A 43 -18.210 -2.014 -1.659 1.00 1.00 N ATOM 715 CA GLN A 43 -17.684 -1.967 -0.304 1.00 1.00 C ATOM 716 C GLN A 43 -17.111 -3.315 0.123 1.00 1.00 C ATOM 717 O GLN A 43 -16.029 -3.391 0.702 1.00 1.00 O ATOM 718 CB GLN A 43 -18.828 -1.571 0.630 1.00 1.00 C ATOM 719 CG GLN A 43 -18.306 -0.718 1.777 1.00 1.00 C ATOM 720 CD GLN A 43 -19.446 -0.318 2.697 1.00 1.00 C ATOM 721 OE1 GLN A 43 -19.600 -0.907 3.766 1.00 1.00 O ATOM 722 NE2 GLN A 43 -20.211 0.692 2.332 1.00 1.00 N ATOM 0 H GLN A 43 -19.222 -1.897 -1.703 1.00 1.00 H new ATOM 0 HA GLN A 43 -16.872 -1.241 -0.259 1.00 1.00 H new ATOM 0 HB2 GLN A 43 -19.586 -1.019 0.074 1.00 1.00 H new ATOM 0 HB3 GLN A 43 -19.310 -2.466 1.024 1.00 1.00 H new ATOM 0 HG2 GLN A 43 -17.554 -1.272 2.338 1.00 1.00 H new ATOM 0 HG3 GLN A 43 -17.817 0.173 1.383 1.00 1.00 H new ATOM 0 HE21 GLN A 43 -20.052 1.155 1.437 1.00 1.00 H new ATOM 0 HE22 GLN A 43 -20.962 1.010 2.944 1.00 1.00 H new ATOM 731 N THR A 44 -17.850 -4.378 -0.160 1.00 1.00 N ATOM 732 CA THR A 44 -17.418 -5.740 0.117 1.00 1.00 C ATOM 733 C THR A 44 -16.365 -6.155 -0.906 1.00 1.00 C ATOM 734 O THR A 44 -15.299 -6.652 -0.526 1.00 1.00 O ATOM 735 CB THR A 44 -18.659 -6.647 0.117 1.00 1.00 C ATOM 736 OG1 THR A 44 -19.602 -6.113 1.027 1.00 1.00 O ATOM 737 CG2 THR A 44 -18.340 -8.076 0.557 1.00 1.00 C ATOM 0 H THR A 44 -18.772 -4.319 -0.591 1.00 1.00 H new ATOM 0 HA THR A 44 -16.947 -5.824 1.096 1.00 1.00 H new ATOM 0 HB THR A 44 -19.042 -6.683 -0.903 1.00 1.00 H new ATOM 0 HG1 THR A 44 -20.402 -6.679 1.039 1.00 1.00 H new ATOM 0 HG21 THR A 44 -19.251 -8.674 0.539 1.00 1.00 H new ATOM 0 HG22 THR A 44 -17.607 -8.511 -0.122 1.00 1.00 H new ATOM 0 HG23 THR A 44 -17.934 -8.063 1.569 1.00 1.00 H new ATOM 745 N ARG A 45 -16.589 -5.895 -2.203 1.00 1.00 N ATOM 746 CA ARG A 45 -15.593 -6.194 -3.219 1.00 1.00 C ATOM 747 C ARG A 45 -14.286 -5.475 -2.944 1.00 1.00 C ATOM 748 O ARG A 45 -13.249 -6.029 -3.259 1.00 1.00 O ATOM 749 CB ARG A 45 -16.138 -5.789 -4.595 1.00 1.00 C ATOM 750 CG ARG A 45 -15.310 -6.365 -5.757 1.00 1.00 C ATOM 751 CD ARG A 45 -15.896 -7.641 -6.382 1.00 1.00 C ATOM 752 NE ARG A 45 -17.152 -7.363 -7.103 1.00 1.00 N ATOM 753 CZ ARG A 45 -18.400 -7.557 -6.660 1.00 1.00 C ATOM 754 NH1 ARG A 45 -18.640 -8.207 -5.531 1.00 1.00 N ATOM 755 NH2 ARG A 45 -19.410 -7.074 -7.366 1.00 1.00 N ATOM 0 H ARG A 45 -17.449 -5.481 -2.562 1.00 1.00 H new ATOM 0 HA ARG A 45 -15.390 -7.265 -3.200 1.00 1.00 H new ATOM 0 HB2 ARG A 45 -17.170 -6.129 -4.687 1.00 1.00 H new ATOM 0 HB3 ARG A 45 -16.153 -4.702 -4.669 1.00 1.00 H new ATOM 0 HG2 ARG A 45 -15.217 -5.605 -6.533 1.00 1.00 H new ATOM 0 HG3 ARG A 45 -14.303 -6.580 -5.398 1.00 1.00 H new ATOM 0 HD2 ARG A 45 -15.170 -8.077 -7.068 1.00 1.00 H new ATOM 0 HD3 ARG A 45 -16.079 -8.379 -5.601 1.00 1.00 H new ATOM 0 HE ARG A 45 -17.059 -6.980 -8.044 1.00 1.00 H new ATOM 0 HH11 ARG A 45 -17.865 -8.572 -4.978 1.00 1.00 H new ATOM 0 HH12 ARG A 45 -19.600 -8.342 -5.214 1.00 1.00 H new ATOM 0 HH21 ARG A 45 -19.230 -6.564 -8.231 1.00 1.00 H new ATOM 0 HH22 ARG A 45 -20.368 -7.211 -7.045 1.00 1.00 H new ATOM 769 N PHE A 46 -14.310 -4.303 -2.326 1.00 1.00 N ATOM 770 CA PHE A 46 -13.128 -3.562 -1.954 1.00 1.00 C ATOM 771 C PHE A 46 -12.258 -4.417 -1.053 1.00 1.00 C ATOM 772 O PHE A 46 -11.116 -4.693 -1.407 1.00 1.00 O ATOM 773 CB PHE A 46 -13.571 -2.253 -1.295 1.00 1.00 C ATOM 774 CG PHE A 46 -12.641 -1.689 -0.256 1.00 1.00 C ATOM 775 CD1 PHE A 46 -11.301 -1.442 -0.599 1.00 1.00 C ATOM 776 CD2 PHE A 46 -13.125 -1.378 1.033 1.00 1.00 C ATOM 777 CE1 PHE A 46 -10.442 -0.842 0.328 1.00 1.00 C ATOM 778 CE2 PHE A 46 -12.276 -0.720 1.929 1.00 1.00 C ATOM 779 CZ PHE A 46 -10.939 -0.469 1.576 1.00 1.00 C ATOM 0 H PHE A 46 -15.178 -3.835 -2.066 1.00 1.00 H new ATOM 0 HA PHE A 46 -12.522 -3.310 -2.824 1.00 1.00 H new ATOM 0 HB2 PHE A 46 -13.708 -1.505 -2.076 1.00 1.00 H new ATOM 0 HB3 PHE A 46 -14.545 -2.414 -0.833 1.00 1.00 H new ATOM 0 HD1 PHE A 46 -10.934 -1.715 -1.577 1.00 1.00 H new ATOM 0 HD2 PHE A 46 -14.131 -1.643 1.322 1.00 1.00 H new ATOM 0 HE1 PHE A 46 -9.405 -0.670 0.080 1.00 1.00 H new ATOM 0 HE2 PHE A 46 -12.648 -0.405 2.893 1.00 1.00 H new ATOM 0 HZ PHE A 46 -10.286 0.021 2.283 1.00 1.00 H new ATOM 789 N GLN A 47 -12.803 -4.907 0.062 1.00 1.00 N ATOM 790 CA GLN A 47 -12.014 -5.754 0.952 1.00 1.00 C ATOM 791 C GLN A 47 -11.594 -7.040 0.247 1.00 1.00 C ATOM 792 O GLN A 47 -10.519 -7.557 0.552 1.00 1.00 O ATOM 793 CB GLN A 47 -12.819 -6.078 2.217 1.00 1.00 C ATOM 794 CG GLN A 47 -12.634 -5.027 3.328 1.00 1.00 C ATOM 795 CD GLN A 47 -13.995 -4.516 3.751 1.00 1.00 C ATOM 796 OE1 GLN A 47 -14.816 -5.264 4.269 1.00 1.00 O ATOM 797 NE2 GLN A 47 -14.283 -3.252 3.504 1.00 1.00 N ATOM 0 H GLN A 47 -13.763 -4.737 0.363 1.00 1.00 H new ATOM 0 HA GLN A 47 -11.111 -5.212 1.234 1.00 1.00 H new ATOM 0 HB2 GLN A 47 -13.876 -6.148 1.961 1.00 1.00 H new ATOM 0 HB3 GLN A 47 -12.517 -7.055 2.594 1.00 1.00 H new ATOM 0 HG2 GLN A 47 -12.115 -5.466 4.180 1.00 1.00 H new ATOM 0 HG3 GLN A 47 -12.017 -4.203 2.969 1.00 1.00 H new ATOM 0 HE21 GLN A 47 -13.586 -2.645 3.072 1.00 1.00 H new ATOM 0 HE22 GLN A 47 -15.202 -2.882 3.745 1.00 1.00 H new ATOM 806 N ASN A 48 -12.396 -7.559 -0.690 1.00 1.00 N ATOM 807 CA ASN A 48 -12.050 -8.818 -1.327 1.00 1.00 C ATOM 808 C ASN A 48 -10.962 -8.606 -2.377 1.00 1.00 C ATOM 809 O ASN A 48 -10.063 -9.432 -2.455 1.00 1.00 O ATOM 810 CB ASN A 48 -13.304 -9.506 -1.889 1.00 1.00 C ATOM 811 CG ASN A 48 -14.180 -10.119 -0.795 1.00 1.00 C ATOM 812 OD1 ASN A 48 -14.369 -11.327 -0.744 1.00 1.00 O ATOM 813 ND2 ASN A 48 -14.764 -9.347 0.105 1.00 1.00 N ATOM 0 H ASN A 48 -13.265 -7.134 -1.012 1.00 1.00 H new ATOM 0 HA ASN A 48 -11.635 -9.495 -0.580 1.00 1.00 H new ATOM 0 HB2 ASN A 48 -13.889 -8.781 -2.454 1.00 1.00 H new ATOM 0 HB3 ASN A 48 -13.003 -10.286 -2.588 1.00 1.00 H new ATOM 0 HD21 ASN A 48 -15.358 -9.761 0.823 1.00 1.00 H new ATOM 0 HD22 ASN A 48 -14.620 -8.337 0.081 1.00 1.00 H new ATOM 820 N ALA A 49 -10.970 -7.502 -3.128 1.00 1.00 N ATOM 821 CA ALA A 49 -9.950 -7.166 -4.117 1.00 1.00 C ATOM 822 C ALA A 49 -8.638 -6.786 -3.438 1.00 1.00 C ATOM 823 O ALA A 49 -7.572 -7.202 -3.879 1.00 1.00 O ATOM 824 CB ALA A 49 -10.451 -5.986 -4.962 1.00 1.00 C ATOM 0 H ALA A 49 -11.707 -6.800 -3.061 1.00 1.00 H new ATOM 0 HA ALA A 49 -9.768 -8.035 -4.749 1.00 1.00 H new ATOM 0 HB1 ALA A 49 -9.698 -5.725 -5.705 1.00 1.00 H new ATOM 0 HB2 ALA A 49 -11.376 -6.266 -5.466 1.00 1.00 H new ATOM 0 HB3 ALA A 49 -10.636 -5.128 -4.316 1.00 1.00 H new ATOM 830 N CYS A 50 -8.729 -6.105 -2.297 1.00 1.00 N ATOM 831 CA CYS A 50 -7.591 -5.842 -1.423 1.00 1.00 C ATOM 832 C CYS A 50 -6.963 -7.157 -0.949 1.00 1.00 C ATOM 833 O CYS A 50 -5.747 -7.252 -0.783 1.00 1.00 O ATOM 834 CB CYS A 50 -8.076 -4.984 -0.240 1.00 1.00 C ATOM 835 SG CYS A 50 -8.332 -3.295 -0.818 1.00 1.00 S ATOM 0 H CYS A 50 -9.606 -5.716 -1.951 1.00 1.00 H new ATOM 0 HA CYS A 50 -6.816 -5.298 -1.964 1.00 1.00 H new ATOM 0 HB2 CYS A 50 -9.003 -5.389 0.166 1.00 1.00 H new ATOM 0 HB3 CYS A 50 -7.341 -5.001 0.565 1.00 1.00 H new ATOM 0 HG CYS A 50 -9.363 -2.782 -0.216 1.00 1.00 H new ATOM 841 N ARG A 51 -7.781 -8.183 -0.698 1.00 1.00 N ATOM 842 CA ARG A 51 -7.296 -9.464 -0.215 1.00 1.00 C ATOM 843 C ARG A 51 -6.723 -10.252 -1.385 1.00 1.00 C ATOM 844 O ARG A 51 -5.697 -10.900 -1.208 1.00 1.00 O ATOM 845 CB ARG A 51 -8.428 -10.199 0.515 1.00 1.00 C ATOM 846 CG ARG A 51 -7.903 -11.427 1.266 1.00 1.00 C ATOM 847 CD ARG A 51 -8.962 -12.022 2.206 1.00 1.00 C ATOM 848 NE ARG A 51 -10.144 -12.499 1.467 1.00 1.00 N ATOM 849 CZ ARG A 51 -11.391 -12.013 1.482 1.00 1.00 C ATOM 850 NH1 ARG A 51 -11.752 -11.015 2.281 1.00 1.00 N ATOM 851 NH2 ARG A 51 -12.274 -12.542 0.649 1.00 1.00 N ATOM 0 H ARG A 51 -8.792 -8.142 -0.825 1.00 1.00 H new ATOM 0 HA ARG A 51 -6.492 -9.331 0.508 1.00 1.00 H new ATOM 0 HB2 ARG A 51 -8.911 -9.520 1.217 1.00 1.00 H new ATOM 0 HB3 ARG A 51 -9.187 -10.507 -0.204 1.00 1.00 H new ATOM 0 HG2 ARG A 51 -7.589 -12.184 0.548 1.00 1.00 H new ATOM 0 HG3 ARG A 51 -7.021 -11.150 1.843 1.00 1.00 H new ATOM 0 HD2 ARG A 51 -8.526 -12.849 2.767 1.00 1.00 H new ATOM 0 HD3 ARG A 51 -9.267 -11.269 2.933 1.00 1.00 H new ATOM 0 HE ARG A 51 -9.992 -13.307 0.864 1.00 1.00 H new ATOM 0 HH11 ARG A 51 -11.069 -10.593 2.910 1.00 1.00 H new ATOM 0 HH12 ARG A 51 -12.712 -10.671 2.265 1.00 1.00 H new ATOM 0 HH21 ARG A 51 -11.995 -13.296 0.022 1.00 1.00 H new ATOM 0 HH22 ARG A 51 -13.233 -12.195 0.635 1.00 1.00 H new ATOM 865 N ASP A 52 -7.318 -10.123 -2.574 1.00 1.00 N ATOM 866 CA ASP A 52 -6.950 -10.771 -3.813 1.00 1.00 C ATOM 867 C ASP A 52 -5.507 -10.478 -4.149 1.00 1.00 C ATOM 868 O ASP A 52 -4.824 -11.339 -4.689 1.00 1.00 O ATOM 869 CB ASP A 52 -7.847 -10.256 -4.950 1.00 1.00 C ATOM 870 CG ASP A 52 -8.224 -11.303 -5.990 1.00 1.00 C ATOM 871 OD1 ASP A 52 -7.445 -11.583 -6.926 1.00 1.00 O ATOM 872 OD2 ASP A 52 -9.399 -11.743 -5.944 1.00 1.00 O ATOM 0 H ASP A 52 -8.129 -9.515 -2.693 1.00 1.00 H new ATOM 0 HA ASP A 52 -7.079 -11.847 -3.697 1.00 1.00 H new ATOM 0 HB2 ASP A 52 -8.761 -9.849 -4.517 1.00 1.00 H new ATOM 0 HB3 ASP A 52 -7.338 -9.433 -5.451 1.00 1.00 H new ATOM 877 N GLY A 53 -5.018 -9.293 -3.797 1.00 1.00 N ATOM 878 CA GLY A 53 -3.663 -8.930 -4.169 1.00 1.00 C ATOM 879 C GLY A 53 -3.519 -7.428 -4.298 1.00 1.00 C ATOM 880 O GLY A 53 -4.113 -6.665 -3.542 1.00 1.00 O ATOM 0 H GLY A 53 -5.528 -8.586 -3.268 1.00 1.00 H new ATOM 0 HA2 GLY A 53 -2.964 -9.303 -3.420 1.00 1.00 H new ATOM 0 HA3 GLY A 53 -3.402 -9.406 -5.114 1.00 1.00 H new ATOM 884 N ARG A 54 -2.654 -7.004 -5.227 1.00 1.00 N ATOM 885 CA ARG A 54 -2.425 -5.589 -5.515 1.00 1.00 C ATOM 886 C ARG A 54 -3.737 -4.923 -5.920 1.00 1.00 C ATOM 887 O ARG A 54 -4.655 -5.591 -6.397 1.00 1.00 O ATOM 888 CB ARG A 54 -1.362 -5.378 -6.619 1.00 1.00 C ATOM 889 CG ARG A 54 -1.551 -6.271 -7.863 1.00 1.00 C ATOM 890 CD ARG A 54 -0.698 -7.554 -7.905 1.00 1.00 C ATOM 891 NE ARG A 54 -0.202 -8.023 -6.591 1.00 1.00 N ATOM 892 CZ ARG A 54 0.643 -9.058 -6.449 1.00 1.00 C ATOM 893 NH1 ARG A 54 0.977 -9.795 -7.502 1.00 1.00 N ATOM 894 NH2 ARG A 54 1.166 -9.350 -5.259 1.00 1.00 N ATOM 0 H ARG A 54 -2.094 -7.636 -5.799 1.00 1.00 H new ATOM 0 HA ARG A 54 -2.042 -5.129 -4.604 1.00 1.00 H new ATOM 0 HB2 ARG A 54 -1.381 -4.333 -6.930 1.00 1.00 H new ATOM 0 HB3 ARG A 54 -0.375 -5.567 -6.197 1.00 1.00 H new ATOM 0 HG2 ARG A 54 -2.602 -6.554 -7.927 1.00 1.00 H new ATOM 0 HG3 ARG A 54 -1.326 -5.678 -8.750 1.00 1.00 H new ATOM 0 HD2 ARG A 54 -1.289 -8.350 -8.358 1.00 1.00 H new ATOM 0 HD3 ARG A 54 0.157 -7.382 -8.558 1.00 1.00 H new ATOM 0 HE ARG A 54 -0.517 -7.536 -5.752 1.00 1.00 H new ATOM 0 HH11 ARG A 54 0.592 -9.576 -8.421 1.00 1.00 H new ATOM 0 HH12 ARG A 54 1.619 -10.580 -7.392 1.00 1.00 H new ATOM 0 HH21 ARG A 54 0.926 -8.786 -4.444 1.00 1.00 H new ATOM 0 HH22 ARG A 54 1.806 -10.138 -5.163 1.00 1.00 H new ATOM 908 N SER A 55 -3.787 -3.602 -5.830 1.00 1.00 N ATOM 909 CA SER A 55 -4.878 -2.819 -6.369 1.00 1.00 C ATOM 910 C SER A 55 -4.345 -1.442 -6.745 1.00 1.00 C ATOM 911 O SER A 55 -3.137 -1.234 -6.825 1.00 1.00 O ATOM 912 CB SER A 55 -5.998 -2.725 -5.330 1.00 1.00 C ATOM 913 OG SER A 55 -7.173 -3.236 -5.926 1.00 1.00 O ATOM 0 H SER A 55 -3.064 -3.044 -5.377 1.00 1.00 H new ATOM 0 HA SER A 55 -5.291 -3.289 -7.261 1.00 1.00 H new ATOM 0 HB2 SER A 55 -5.742 -3.295 -4.437 1.00 1.00 H new ATOM 0 HB3 SER A 55 -6.145 -1.691 -5.017 1.00 1.00 H new ATOM 0 HG SER A 55 -7.907 -3.210 -5.277 1.00 1.00 H new ATOM 919 N GLU A 56 -5.248 -0.503 -6.999 1.00 1.00 N ATOM 920 CA GLU A 56 -4.971 0.806 -7.539 1.00 1.00 C ATOM 921 C GLU A 56 -5.718 1.821 -6.686 1.00 1.00 C ATOM 922 O GLU A 56 -6.952 1.856 -6.659 1.00 1.00 O ATOM 923 CB GLU A 56 -5.402 0.808 -9.002 1.00 1.00 C ATOM 924 CG GLU A 56 -4.281 0.254 -9.898 1.00 1.00 C ATOM 925 CD GLU A 56 -4.762 -0.128 -11.295 1.00 1.00 C ATOM 926 OE1 GLU A 56 -5.813 0.365 -11.763 1.00 1.00 O ATOM 927 OE2 GLU A 56 -4.109 -0.972 -11.953 1.00 1.00 O ATOM 0 H GLU A 56 -6.242 -0.650 -6.822 1.00 1.00 H new ATOM 0 HA GLU A 56 -3.913 1.068 -7.512 1.00 1.00 H new ATOM 0 HB2 GLU A 56 -6.302 0.205 -9.122 1.00 1.00 H new ATOM 0 HB3 GLU A 56 -5.654 1.822 -9.311 1.00 1.00 H new ATOM 0 HG2 GLU A 56 -3.491 1.000 -9.984 1.00 1.00 H new ATOM 0 HG3 GLU A 56 -3.842 -0.622 -9.420 1.00 1.00 H new ATOM 934 N ILE A 57 -4.956 2.608 -5.933 1.00 1.00 N ATOM 935 CA ILE A 57 -5.480 3.690 -5.101 1.00 1.00 C ATOM 936 C ILE A 57 -4.790 4.964 -5.607 1.00 1.00 C ATOM 937 O ILE A 57 -3.790 4.895 -6.317 1.00 1.00 O ATOM 938 CB ILE A 57 -5.308 3.340 -3.586 1.00 1.00 C ATOM 939 CG1 ILE A 57 -5.925 1.941 -3.275 1.00 1.00 C ATOM 940 CG2 ILE A 57 -5.896 4.407 -2.639 1.00 1.00 C ATOM 941 CD1 ILE A 57 -6.166 1.523 -1.805 1.00 1.00 C ATOM 0 H ILE A 57 -3.942 2.512 -5.882 1.00 1.00 H new ATOM 0 HA ILE A 57 -6.556 3.847 -5.183 1.00 1.00 H new ATOM 0 HB ILE A 57 -4.235 3.317 -3.398 1.00 1.00 H new ATOM 0 HG12 ILE A 57 -6.883 1.885 -3.792 1.00 1.00 H new ATOM 0 HG13 ILE A 57 -5.276 1.190 -3.725 1.00 1.00 H new ATOM 0 HG21 ILE A 57 -5.742 4.100 -1.605 1.00 1.00 H new ATOM 0 HG22 ILE A 57 -5.398 5.361 -2.812 1.00 1.00 H new ATOM 0 HG23 ILE A 57 -6.964 4.515 -2.830 1.00 1.00 H new ATOM 0 HD11 ILE A 57 -6.599 0.523 -1.777 1.00 1.00 H new ATOM 0 HD12 ILE A 57 -5.218 1.523 -1.267 1.00 1.00 H new ATOM 0 HD13 ILE A 57 -6.851 2.228 -1.334 1.00 1.00 H new ATOM 953 N ALA A 58 -5.305 6.140 -5.282 1.00 1.00 N ATOM 954 CA ALA A 58 -4.680 7.411 -5.585 1.00 1.00 C ATOM 955 C ALA A 58 -4.715 8.288 -4.344 1.00 1.00 C ATOM 956 O ALA A 58 -5.535 8.083 -3.448 1.00 1.00 O ATOM 957 CB ALA A 58 -5.393 8.085 -6.764 1.00 1.00 C ATOM 0 H ALA A 58 -6.192 6.235 -4.788 1.00 1.00 H new ATOM 0 HA ALA A 58 -3.641 7.254 -5.875 1.00 1.00 H new ATOM 0 HB1 ALA A 58 -4.914 9.039 -6.982 1.00 1.00 H new ATOM 0 HB2 ALA A 58 -5.334 7.441 -7.641 1.00 1.00 H new ATOM 0 HB3 ALA A 58 -6.439 8.254 -6.508 1.00 1.00 H new ATOM 963 N PHE A 59 -3.851 9.295 -4.292 1.00 1.00 N ATOM 964 CA PHE A 59 -3.952 10.334 -3.279 1.00 1.00 C ATOM 965 C PHE A 59 -4.829 11.444 -3.808 1.00 1.00 C ATOM 966 O PHE A 59 -4.677 11.831 -4.963 1.00 1.00 O ATOM 967 CB PHE A 59 -2.561 10.878 -2.901 1.00 1.00 C ATOM 968 CG PHE A 59 -1.848 9.949 -1.970 1.00 1.00 C ATOM 969 CD1 PHE A 59 -1.281 8.767 -2.474 1.00 1.00 C ATOM 970 CD2 PHE A 59 -1.781 10.262 -0.605 1.00 1.00 C ATOM 971 CE1 PHE A 59 -0.652 7.880 -1.572 1.00 1.00 C ATOM 972 CE2 PHE A 59 -1.160 9.376 0.278 1.00 1.00 C ATOM 973 CZ PHE A 59 -0.605 8.177 -0.197 1.00 1.00 C ATOM 0 H PHE A 59 -3.073 9.412 -4.941 1.00 1.00 H new ATOM 0 HA PHE A 59 -4.393 9.913 -2.376 1.00 1.00 H new ATOM 0 HB2 PHE A 59 -1.966 11.019 -3.803 1.00 1.00 H new ATOM 0 HB3 PHE A 59 -2.666 11.856 -2.432 1.00 1.00 H new ATOM 0 HD1 PHE A 59 -1.325 8.541 -3.529 1.00 1.00 H new ATOM 0 HD2 PHE A 59 -2.208 11.184 -0.238 1.00 1.00 H new ATOM 0 HE1 PHE A 59 -0.204 6.968 -1.940 1.00 1.00 H new ATOM 0 HE2 PHE A 59 -1.106 9.614 1.330 1.00 1.00 H new ATOM 0 HZ PHE A 59 -0.143 7.484 0.491 1.00 1.00 H new ATOM 983 N VAL A 60 -5.725 11.959 -2.974 1.00 1.00 N ATOM 984 CA VAL A 60 -6.624 13.053 -3.316 1.00 1.00 C ATOM 985 C VAL A 60 -5.833 14.351 -3.293 1.00 1.00 C ATOM 986 O VAL A 60 -5.785 15.041 -4.313 1.00 1.00 O ATOM 987 CB VAL A 60 -7.803 13.050 -2.321 1.00 1.00 C ATOM 988 CG1 VAL A 60 -8.634 14.334 -2.308 1.00 1.00 C ATOM 989 CG2 VAL A 60 -8.724 11.873 -2.628 1.00 1.00 C ATOM 0 H VAL A 60 -5.849 11.619 -2.020 1.00 1.00 H new ATOM 0 HA VAL A 60 -7.041 12.940 -4.317 1.00 1.00 H new ATOM 0 HB VAL A 60 -7.351 12.967 -1.332 1.00 1.00 H new ATOM 0 HG11 VAL A 60 -9.439 14.239 -1.579 1.00 1.00 H new ATOM 0 HG12 VAL A 60 -7.997 15.177 -2.038 1.00 1.00 H new ATOM 0 HG13 VAL A 60 -9.059 14.503 -3.298 1.00 1.00 H new ATOM 0 HG21 VAL A 60 -9.557 11.870 -1.925 1.00 1.00 H new ATOM 0 HG22 VAL A 60 -9.107 11.966 -3.644 1.00 1.00 H new ATOM 0 HG23 VAL A 60 -8.167 10.941 -2.534 1.00 1.00 H new ATOM 999 N ALA A 61 -5.190 14.631 -2.152 1.00 1.00 N ATOM 1000 CA ALA A 61 -4.523 15.889 -1.855 1.00 1.00 C ATOM 1001 C ALA A 61 -3.634 16.308 -3.020 1.00 1.00 C ATOM 1002 O ALA A 61 -3.788 17.395 -3.569 1.00 1.00 O ATOM 1003 CB ALA A 61 -3.722 15.730 -0.560 1.00 1.00 C ATOM 0 H ALA A 61 -5.122 13.959 -1.388 1.00 1.00 H new ATOM 0 HA ALA A 61 -5.261 16.679 -1.715 1.00 1.00 H new ATOM 0 HB1 ALA A 61 -3.217 16.668 -0.327 1.00 1.00 H new ATOM 0 HB2 ALA A 61 -4.397 15.469 0.255 1.00 1.00 H new ATOM 0 HB3 ALA A 61 -2.981 14.940 -0.685 1.00 1.00 H new ATOM 1009 N THR A 62 -2.747 15.403 -3.428 1.00 1.00 N ATOM 1010 CA THR A 62 -1.698 15.705 -4.379 1.00 1.00 C ATOM 1011 C THR A 62 -1.938 15.041 -5.741 1.00 1.00 C ATOM 1012 O THR A 62 -1.326 15.474 -6.720 1.00 1.00 O ATOM 1013 CB THR A 62 -0.373 15.305 -3.714 1.00 1.00 C ATOM 1014 OG1 THR A 62 -0.320 15.849 -2.406 1.00 1.00 O ATOM 1015 CG2 THR A 62 0.845 15.777 -4.501 1.00 1.00 C ATOM 0 H THR A 62 -2.742 14.437 -3.102 1.00 1.00 H new ATOM 0 HA THR A 62 -1.677 16.768 -4.617 1.00 1.00 H new ATOM 0 HB THR A 62 -0.342 14.216 -3.684 1.00 1.00 H new ATOM 0 HG1 THR A 62 0.365 15.381 -1.884 1.00 1.00 H new ATOM 0 HG21 THR A 62 1.754 15.467 -3.985 1.00 1.00 H new ATOM 0 HG22 THR A 62 0.826 15.338 -5.499 1.00 1.00 H new ATOM 0 HG23 THR A 62 0.827 16.864 -4.582 1.00 1.00 H new ATOM 1023 N GLY A 63 -2.836 14.052 -5.858 1.00 1.00 N ATOM 1024 CA GLY A 63 -3.101 13.388 -7.124 1.00 1.00 C ATOM 1025 C GLY A 63 -1.916 12.538 -7.536 1.00 1.00 C ATOM 1026 O GLY A 63 -1.111 12.947 -8.371 1.00 1.00 O ATOM 0 H GLY A 63 -3.391 13.698 -5.079 1.00 1.00 H new ATOM 0 HA2 GLY A 63 -3.990 12.764 -7.035 1.00 1.00 H new ATOM 0 HA3 GLY A 63 -3.309 14.131 -7.894 1.00 1.00 H new ATOM 1030 N THR A 64 -1.770 11.356 -6.944 1.00 1.00 N ATOM 1031 CA THR A 64 -0.888 10.349 -7.513 1.00 1.00 C ATOM 1032 C THR A 64 -1.568 8.992 -7.383 1.00 1.00 C ATOM 1033 O THR A 64 -1.776 8.534 -6.259 1.00 1.00 O ATOM 1034 CB THR A 64 0.476 10.455 -6.835 1.00 1.00 C ATOM 1035 OG1 THR A 64 1.139 11.627 -7.277 1.00 1.00 O ATOM 1036 CG2 THR A 64 1.385 9.246 -7.084 1.00 1.00 C ATOM 0 H THR A 64 -2.244 11.077 -6.085 1.00 1.00 H new ATOM 0 HA THR A 64 -0.704 10.498 -8.577 1.00 1.00 H new ATOM 0 HB THR A 64 0.281 10.491 -5.763 1.00 1.00 H new ATOM 0 HG1 THR A 64 0.528 12.161 -7.826 1.00 1.00 H new ATOM 0 HG21 THR A 64 2.335 9.394 -6.571 1.00 1.00 H new ATOM 0 HG22 THR A 64 0.904 8.345 -6.704 1.00 1.00 H new ATOM 0 HG23 THR A 64 1.563 9.139 -8.154 1.00 1.00 H new ATOM 1044 N ASN A 65 -1.948 8.393 -8.517 1.00 1.00 N ATOM 1045 CA ASN A 65 -2.325 6.995 -8.652 1.00 1.00 C ATOM 1046 C ASN A 65 -1.097 6.144 -8.335 1.00 1.00 C ATOM 1047 O ASN A 65 -0.034 6.332 -8.936 1.00 1.00 O ATOM 1048 CB ASN A 65 -2.859 6.712 -10.069 1.00 1.00 C ATOM 1049 CG ASN A 65 -3.418 5.296 -10.244 1.00 1.00 C ATOM 1050 OD1 ASN A 65 -2.955 4.333 -9.643 1.00 1.00 O ATOM 1051 ND2 ASN A 65 -4.377 5.109 -11.135 1.00 1.00 N ATOM 0 H ASN A 65 -2.001 8.899 -9.401 1.00 1.00 H new ATOM 0 HA ASN A 65 -3.128 6.748 -7.958 1.00 1.00 H new ATOM 0 HB2 ASN A 65 -3.641 7.434 -10.304 1.00 1.00 H new ATOM 0 HB3 ASN A 65 -2.055 6.868 -10.789 1.00 1.00 H new ATOM 0 HD21 ASN A 65 -4.727 4.168 -11.318 1.00 1.00 H new ATOM 0 HD22 ASN A 65 -4.767 5.905 -11.639 1.00 1.00 H new ATOM 1058 N LEU A 66 -1.222 5.232 -7.379 1.00 1.00 N ATOM 1059 CA LEU A 66 -0.186 4.317 -6.950 1.00 1.00 C ATOM 1060 C LEU A 66 -0.809 2.920 -6.918 1.00 1.00 C ATOM 1061 O LEU A 66 -1.908 2.710 -6.398 1.00 1.00 O ATOM 1062 CB LEU A 66 0.503 4.859 -5.675 1.00 1.00 C ATOM 1063 CG LEU A 66 0.101 4.368 -4.273 1.00 1.00 C ATOM 1064 CD1 LEU A 66 -1.335 4.703 -3.861 1.00 1.00 C ATOM 1065 CD2 LEU A 66 0.383 2.879 -4.098 1.00 1.00 C ATOM 0 H LEU A 66 -2.092 5.109 -6.861 1.00 1.00 H new ATOM 0 HA LEU A 66 0.659 4.230 -7.634 1.00 1.00 H new ATOM 0 HB2 LEU A 66 1.570 4.665 -5.785 1.00 1.00 H new ATOM 0 HB3 LEU A 66 0.374 5.941 -5.681 1.00 1.00 H new ATOM 0 HG LEU A 66 0.736 4.934 -3.592 1.00 1.00 H new ATOM 0 HD11 LEU A 66 -1.526 4.317 -2.860 1.00 1.00 H new ATOM 0 HD12 LEU A 66 -1.472 5.784 -3.865 1.00 1.00 H new ATOM 0 HD13 LEU A 66 -2.031 4.246 -4.564 1.00 1.00 H new ATOM 0 HD21 LEU A 66 0.087 2.568 -3.096 1.00 1.00 H new ATOM 0 HD22 LEU A 66 -0.184 2.312 -4.837 1.00 1.00 H new ATOM 0 HD23 LEU A 66 1.448 2.692 -4.236 1.00 1.00 H new ATOM 1077 N SER A 67 -0.130 1.951 -7.527 1.00 1.00 N ATOM 1078 CA SER A 67 -0.602 0.579 -7.512 1.00 1.00 C ATOM 1079 C SER A 67 -0.183 -0.002 -6.169 1.00 1.00 C ATOM 1080 O SER A 67 0.998 -0.258 -5.931 1.00 1.00 O ATOM 1081 CB SER A 67 -0.030 -0.210 -8.691 1.00 1.00 C ATOM 1082 OG SER A 67 -0.396 0.402 -9.916 1.00 1.00 O ATOM 0 H SER A 67 0.744 2.094 -8.033 1.00 1.00 H new ATOM 0 HA SER A 67 -1.685 0.526 -7.624 1.00 1.00 H new ATOM 0 HB2 SER A 67 1.056 -0.260 -8.612 1.00 1.00 H new ATOM 0 HB3 SER A 67 -0.399 -1.235 -8.664 1.00 1.00 H new ATOM 0 HG SER A 67 -0.022 -0.111 -10.663 1.00 1.00 H new ATOM 1088 N LEU A 68 -1.129 -0.084 -5.243 1.00 1.00 N ATOM 1089 CA LEU A 68 -0.927 -0.525 -3.881 1.00 1.00 C ATOM 1090 C LEU A 68 -0.747 -2.025 -3.917 1.00 1.00 C ATOM 1091 O LEU A 68 -1.653 -2.757 -4.299 1.00 1.00 O ATOM 1092 CB LEU A 68 -2.139 -0.140 -3.039 1.00 1.00 C ATOM 1093 CG LEU A 68 -1.748 0.708 -1.831 1.00 1.00 C ATOM 1094 CD1 LEU A 68 -3.025 1.166 -1.167 1.00 1.00 C ATOM 1095 CD2 LEU A 68 -0.914 -0.059 -0.826 1.00 1.00 C ATOM 0 H LEU A 68 -2.099 0.168 -5.435 1.00 1.00 H new ATOM 0 HA LEU A 68 -0.049 -0.057 -3.436 1.00 1.00 H new ATOM 0 HB2 LEU A 68 -2.849 0.412 -3.655 1.00 1.00 H new ATOM 0 HB3 LEU A 68 -2.647 -1.043 -2.700 1.00 1.00 H new ATOM 0 HG LEU A 68 -1.140 1.545 -2.175 1.00 1.00 H new ATOM 0 HD11 LEU A 68 -2.784 1.777 -0.297 1.00 1.00 H new ATOM 0 HD12 LEU A 68 -3.611 1.755 -1.873 1.00 1.00 H new ATOM 0 HD13 LEU A 68 -3.603 0.297 -0.852 1.00 1.00 H new ATOM 0 HD21 LEU A 68 -0.664 0.592 0.012 1.00 1.00 H new ATOM 0 HD22 LEU A 68 -1.480 -0.917 -0.463 1.00 1.00 H new ATOM 0 HD23 LEU A 68 0.003 -0.405 -1.303 1.00 1.00 H new ATOM 1107 N GLN A 69 0.446 -2.474 -3.579 1.00 1.00 N ATOM 1108 CA GLN A 69 0.927 -3.787 -3.968 1.00 1.00 C ATOM 1109 C GLN A 69 1.419 -4.558 -2.743 1.00 1.00 C ATOM 1110 O GLN A 69 2.527 -4.346 -2.279 1.00 1.00 O ATOM 1111 CB GLN A 69 1.939 -3.643 -5.126 1.00 1.00 C ATOM 1112 CG GLN A 69 3.086 -2.619 -4.944 1.00 1.00 C ATOM 1113 CD GLN A 69 3.870 -2.394 -6.244 1.00 1.00 C ATOM 1114 OE1 GLN A 69 3.928 -3.266 -7.106 1.00 1.00 O ATOM 1115 NE2 GLN A 69 4.490 -1.240 -6.444 1.00 1.00 N ATOM 0 H GLN A 69 1.112 -1.937 -3.024 1.00 1.00 H new ATOM 0 HA GLN A 69 0.121 -4.403 -4.367 1.00 1.00 H new ATOM 0 HB2 GLN A 69 2.385 -4.621 -5.307 1.00 1.00 H new ATOM 0 HB3 GLN A 69 1.386 -3.373 -6.026 1.00 1.00 H new ATOM 0 HG2 GLN A 69 2.673 -1.670 -4.601 1.00 1.00 H new ATOM 0 HG3 GLN A 69 3.765 -2.970 -4.167 1.00 1.00 H new ATOM 0 HE21 GLN A 69 4.448 -0.509 -5.734 1.00 1.00 H new ATOM 0 HE22 GLN A 69 5.009 -1.083 -7.308 1.00 1.00 H new ATOM 1124 N PHE A 70 0.568 -5.427 -2.189 1.00 1.00 N ATOM 1125 CA PHE A 70 0.788 -6.187 -0.953 1.00 1.00 C ATOM 1126 C PHE A 70 1.758 -7.339 -1.210 1.00 1.00 C ATOM 1127 O PHE A 70 1.372 -8.511 -1.265 1.00 1.00 O ATOM 1128 CB PHE A 70 -0.553 -6.643 -0.334 1.00 1.00 C ATOM 1129 CG PHE A 70 -1.612 -5.557 -0.337 1.00 1.00 C ATOM 1130 CD1 PHE A 70 -2.272 -5.283 -1.538 1.00 1.00 C ATOM 1131 CD2 PHE A 70 -1.891 -4.763 0.784 1.00 1.00 C ATOM 1132 CE1 PHE A 70 -3.120 -4.186 -1.681 1.00 1.00 C ATOM 1133 CE2 PHE A 70 -2.804 -3.695 0.670 1.00 1.00 C ATOM 1134 CZ PHE A 70 -3.404 -3.387 -0.565 1.00 1.00 C ATOM 0 H PHE A 70 -0.338 -5.630 -2.611 1.00 1.00 H new ATOM 0 HA PHE A 70 1.254 -5.540 -0.210 1.00 1.00 H new ATOM 0 HB2 PHE A 70 -0.925 -7.506 -0.885 1.00 1.00 H new ATOM 0 HB3 PHE A 70 -0.380 -6.970 0.691 1.00 1.00 H new ATOM 0 HD1 PHE A 70 -2.120 -5.941 -2.381 1.00 1.00 H new ATOM 0 HD2 PHE A 70 -1.410 -4.968 1.729 1.00 1.00 H new ATOM 0 HE1 PHE A 70 -3.554 -3.954 -2.642 1.00 1.00 H new ATOM 0 HE2 PHE A 70 -3.046 -3.105 1.542 1.00 1.00 H new ATOM 0 HZ PHE A 70 -4.075 -2.545 -0.652 1.00 1.00 H new ATOM 1144 N PHE A 71 3.025 -6.989 -1.391 1.00 1.00 N ATOM 1145 CA PHE A 71 4.149 -7.882 -1.581 1.00 1.00 C ATOM 1146 C PHE A 71 5.183 -7.604 -0.478 1.00 1.00 C ATOM 1147 O PHE A 71 6.038 -6.737 -0.634 1.00 1.00 O ATOM 1148 CB PHE A 71 4.585 -7.870 -3.061 1.00 1.00 C ATOM 1149 CG PHE A 71 5.682 -6.904 -3.455 1.00 1.00 C ATOM 1150 CD1 PHE A 71 5.334 -5.584 -3.792 1.00 1.00 C ATOM 1151 CD2 PHE A 71 7.031 -7.297 -3.471 1.00 1.00 C ATOM 1152 CE1 PHE A 71 6.326 -4.663 -4.162 1.00 1.00 C ATOM 1153 CE2 PHE A 71 8.025 -6.375 -3.840 1.00 1.00 C ATOM 1154 CZ PHE A 71 7.668 -5.068 -4.203 1.00 1.00 C ATOM 0 H PHE A 71 3.308 -6.009 -1.409 1.00 1.00 H new ATOM 0 HA PHE A 71 3.915 -8.937 -1.436 1.00 1.00 H new ATOM 0 HB2 PHE A 71 4.911 -8.876 -3.324 1.00 1.00 H new ATOM 0 HB3 PHE A 71 3.708 -7.650 -3.669 1.00 1.00 H new ATOM 0 HD1 PHE A 71 4.299 -5.278 -3.766 1.00 1.00 H new ATOM 0 HD2 PHE A 71 7.303 -8.306 -3.200 1.00 1.00 H new ATOM 0 HE1 PHE A 71 6.057 -3.648 -4.414 1.00 1.00 H new ATOM 0 HE2 PHE A 71 9.063 -6.672 -3.844 1.00 1.00 H new ATOM 0 HZ PHE A 71 8.431 -4.370 -4.516 1.00 1.00 H new ATOM 1164 N PRO A 72 5.058 -8.249 0.704 1.00 1.00 N ATOM 1165 CA PRO A 72 6.105 -8.279 1.729 1.00 1.00 C ATOM 1166 C PRO A 72 7.285 -9.116 1.209 1.00 1.00 C ATOM 1167 O PRO A 72 7.518 -9.160 0.004 1.00 1.00 O ATOM 1168 CB PRO A 72 5.414 -8.835 2.982 1.00 1.00 C ATOM 1169 CG PRO A 72 4.355 -9.764 2.409 1.00 1.00 C ATOM 1170 CD PRO A 72 3.907 -9.020 1.153 1.00 1.00 C ATOM 0 HA PRO A 72 6.539 -7.309 1.971 1.00 1.00 H new ATOM 0 HB2 PRO A 72 6.114 -9.369 3.625 1.00 1.00 H new ATOM 0 HB3 PRO A 72 4.971 -8.041 3.584 1.00 1.00 H new ATOM 0 HG2 PRO A 72 4.762 -10.748 2.174 1.00 1.00 H new ATOM 0 HG3 PRO A 72 3.531 -9.918 3.105 1.00 1.00 H new ATOM 0 HD2 PRO A 72 3.582 -9.719 0.382 1.00 1.00 H new ATOM 0 HD3 PRO A 72 3.061 -8.367 1.368 1.00 1.00 H new ATOM 1178 N ALA A 73 8.053 -9.789 2.068 1.00 1.00 N ATOM 1179 CA ALA A 73 9.033 -10.738 1.547 1.00 1.00 C ATOM 1180 C ALA A 73 8.333 -12.043 1.164 1.00 1.00 C ATOM 1181 O ALA A 73 8.469 -12.506 0.035 1.00 1.00 O ATOM 1182 CB ALA A 73 10.175 -10.958 2.528 1.00 1.00 C ATOM 0 H ALA A 73 8.019 -9.701 3.084 1.00 1.00 H new ATOM 0 HA ALA A 73 9.486 -10.321 0.647 1.00 1.00 H new ATOM 0 HB1 ALA A 73 10.885 -11.670 2.107 1.00 1.00 H new ATOM 0 HB2 ALA A 73 10.680 -10.011 2.717 1.00 1.00 H new ATOM 0 HB3 ALA A 73 9.780 -11.351 3.465 1.00 1.00 H new ATOM 1188 N SER A 74 7.557 -12.625 2.078 1.00 1.00 N ATOM 1189 CA SER A 74 6.871 -13.901 1.891 1.00 1.00 C ATOM 1190 C SER A 74 5.438 -13.675 1.401 1.00 1.00 C ATOM 1191 O SER A 74 4.559 -13.312 2.190 1.00 1.00 O ATOM 1192 CB SER A 74 6.926 -14.700 3.203 1.00 1.00 C ATOM 1193 OG SER A 74 6.805 -13.856 4.342 1.00 1.00 O ATOM 0 H SER A 74 7.384 -12.210 2.993 1.00 1.00 H new ATOM 0 HA SER A 74 7.373 -14.485 1.120 1.00 1.00 H new ATOM 0 HB2 SER A 74 6.125 -15.439 3.212 1.00 1.00 H new ATOM 0 HB3 SER A 74 7.867 -15.248 3.255 1.00 1.00 H new ATOM 0 HG SER A 74 6.843 -14.399 5.157 1.00 1.00 H new ATOM 1199 N TRP A 75 5.176 -13.847 0.105 1.00 1.00 N ATOM 1200 CA TRP A 75 3.851 -13.792 -0.469 1.00 1.00 C ATOM 1201 C TRP A 75 3.724 -14.810 -1.586 1.00 1.00 C ATOM 1202 O TRP A 75 4.660 -15.079 -2.335 1.00 1.00 O ATOM 1203 CB TRP A 75 3.560 -12.412 -1.052 1.00 1.00 C ATOM 1204 CG TRP A 75 4.700 -11.783 -1.777 1.00 1.00 C ATOM 1205 CD1 TRP A 75 5.720 -11.192 -1.144 1.00 1.00 C ATOM 1206 CD2 TRP A 75 5.049 -11.767 -3.193 1.00 1.00 C ATOM 1207 NE1 TRP A 75 6.675 -10.794 -2.050 1.00 1.00 N ATOM 1208 CE2 TRP A 75 6.327 -11.145 -3.331 1.00 1.00 C ATOM 1209 CE3 TRP A 75 4.445 -12.248 -4.370 1.00 1.00 C ATOM 1210 CZ2 TRP A 75 6.970 -11.002 -4.564 1.00 1.00 C ATOM 1211 CZ3 TRP A 75 5.080 -12.100 -5.615 1.00 1.00 C ATOM 1212 CH2 TRP A 75 6.335 -11.478 -5.719 1.00 1.00 C ATOM 0 H TRP A 75 5.905 -14.033 -0.584 1.00 1.00 H new ATOM 0 HA TRP A 75 3.140 -14.008 0.329 1.00 1.00 H new ATOM 0 HB2 TRP A 75 2.715 -12.493 -1.735 1.00 1.00 H new ATOM 0 HB3 TRP A 75 3.253 -11.749 -0.243 1.00 1.00 H new ATOM 0 HD1 TRP A 75 5.784 -11.048 -0.076 1.00 1.00 H new ATOM 0 HE1 TRP A 75 7.533 -10.301 -1.802 1.00 1.00 H new ATOM 0 HE3 TRP A 75 3.483 -12.736 -4.316 1.00 1.00 H new ATOM 0 HZ2 TRP A 75 7.941 -10.532 -4.625 1.00 1.00 H new ATOM 0 HZ3 TRP A 75 4.595 -12.471 -6.506 1.00 1.00 H new ATOM 0 HH2 TRP A 75 6.808 -11.367 -6.684 1.00 1.00 H new ATOM 1223 N GLN A 76 2.496 -15.274 -1.728 1.00 1.00 N ATOM 1224 CA GLN A 76 1.968 -16.101 -2.788 1.00 1.00 C ATOM 1225 C GLN A 76 1.786 -15.238 -4.052 1.00 1.00 C ATOM 1226 O GLN A 76 2.722 -15.163 -4.845 1.00 1.00 O ATOM 1227 CB GLN A 76 0.756 -16.799 -2.161 1.00 1.00 C ATOM 1228 CG GLN A 76 -0.099 -17.656 -3.082 1.00 1.00 C ATOM 1229 CD GLN A 76 -1.447 -16.982 -3.270 1.00 1.00 C ATOM 1230 OE1 GLN A 76 -2.235 -16.874 -2.338 1.00 1.00 O ATOM 1231 NE2 GLN A 76 -1.682 -16.388 -4.421 1.00 1.00 N ATOM 0 H GLN A 76 1.778 -15.058 -1.036 1.00 1.00 H new ATOM 0 HA GLN A 76 2.607 -16.898 -3.168 1.00 1.00 H new ATOM 0 HB2 GLN A 76 1.112 -17.429 -1.346 1.00 1.00 H new ATOM 0 HB3 GLN A 76 0.117 -16.035 -1.718 1.00 1.00 H new ATOM 0 HG2 GLN A 76 0.396 -17.784 -4.045 1.00 1.00 H new ATOM 0 HG3 GLN A 76 -0.231 -18.651 -2.656 1.00 1.00 H new ATOM 0 HE21 GLN A 76 -1.019 -16.485 -5.190 1.00 1.00 H new ATOM 0 HE22 GLN A 76 -2.527 -15.831 -4.544 1.00 1.00 H new ATOM 1240 N GLY A 77 0.672 -14.520 -4.251 1.00 1.00 N ATOM 1241 CA GLY A 77 0.543 -13.623 -5.402 1.00 1.00 C ATOM 1242 C GLY A 77 -0.846 -13.014 -5.555 1.00 1.00 C ATOM 1243 O GLY A 77 -1.066 -11.900 -5.081 1.00 1.00 O ATOM 0 H GLY A 77 -0.142 -14.543 -3.637 1.00 1.00 H new ATOM 0 HA2 GLY A 77 1.273 -12.819 -5.308 1.00 1.00 H new ATOM 0 HA3 GLY A 77 0.790 -14.174 -6.310 1.00 1.00 H new ATOM 1247 N GLU A 78 -1.756 -13.739 -6.205 1.00 1.00 N ATOM 1248 CA GLU A 78 -3.082 -13.293 -6.640 1.00 1.00 C ATOM 1249 C GLU A 78 -4.161 -14.221 -6.058 1.00 1.00 C ATOM 1250 O GLU A 78 -3.864 -15.380 -5.753 1.00 1.00 O ATOM 1251 CB GLU A 78 -3.099 -13.281 -8.175 1.00 1.00 C ATOM 1252 CG GLU A 78 -4.452 -12.846 -8.752 1.00 1.00 C ATOM 1253 CD GLU A 78 -4.444 -12.816 -10.273 1.00 1.00 C ATOM 1254 OE1 GLU A 78 -4.169 -13.862 -10.904 1.00 1.00 O ATOM 1255 OE2 GLU A 78 -4.806 -11.766 -10.856 1.00 1.00 O ATOM 0 H GLU A 78 -1.578 -14.711 -6.458 1.00 1.00 H new ATOM 0 HA GLU A 78 -3.297 -12.288 -6.278 1.00 1.00 H new ATOM 0 HB2 GLU A 78 -2.322 -12.608 -8.537 1.00 1.00 H new ATOM 0 HB3 GLU A 78 -2.855 -14.277 -8.544 1.00 1.00 H new ATOM 0 HG2 GLU A 78 -5.229 -13.529 -8.408 1.00 1.00 H new ATOM 0 HG3 GLU A 78 -4.706 -11.857 -8.372 1.00 1.00 H new ATOM 1262 N GLN A 79 -5.402 -13.735 -5.902 1.00 1.00 N ATOM 1263 CA GLN A 79 -6.422 -14.270 -5.003 1.00 1.00 C ATOM 1264 C GLN A 79 -5.737 -14.723 -3.708 1.00 1.00 C ATOM 1265 O GLN A 79 -5.751 -15.896 -3.325 1.00 1.00 O ATOM 1266 CB GLN A 79 -7.247 -15.325 -5.745 1.00 1.00 C ATOM 1267 CG GLN A 79 -8.664 -15.476 -5.182 1.00 1.00 C ATOM 1268 CD GLN A 79 -8.778 -16.500 -4.059 1.00 1.00 C ATOM 1269 OE1 GLN A 79 -8.938 -17.695 -4.298 1.00 1.00 O ATOM 1270 NE2 GLN A 79 -8.715 -16.082 -2.807 1.00 1.00 N ATOM 0 H GLN A 79 -5.731 -12.923 -6.424 1.00 1.00 H new ATOM 0 HA GLN A 79 -7.154 -13.523 -4.695 1.00 1.00 H new ATOM 0 HB2 GLN A 79 -7.307 -15.057 -6.800 1.00 1.00 H new ATOM 0 HB3 GLN A 79 -6.735 -16.285 -5.689 1.00 1.00 H new ATOM 0 HG2 GLN A 79 -9.003 -14.508 -4.813 1.00 1.00 H new ATOM 0 HG3 GLN A 79 -9.337 -15.762 -5.991 1.00 1.00 H new ATOM 0 HE21 GLN A 79 -8.582 -15.091 -2.606 1.00 1.00 H new ATOM 0 HE22 GLN A 79 -8.799 -16.751 -2.041 1.00 1.00 H new ATOM 1279 N ARG A 80 -5.014 -13.776 -3.106 1.00 1.00 N ATOM 1280 CA ARG A 80 -3.994 -14.049 -2.115 1.00 1.00 C ATOM 1281 C ARG A 80 -4.647 -14.667 -0.888 1.00 1.00 C ATOM 1282 O ARG A 80 -5.668 -14.167 -0.406 1.00 1.00 O ATOM 1283 CB ARG A 80 -3.243 -12.743 -1.785 1.00 1.00 C ATOM 1284 CG ARG A 80 -1.736 -12.872 -2.015 1.00 1.00 C ATOM 1285 CD ARG A 80 -0.942 -13.585 -0.913 1.00 1.00 C ATOM 1286 NE ARG A 80 -0.887 -12.865 0.369 1.00 1.00 N ATOM 1287 CZ ARG A 80 -0.226 -11.732 0.642 1.00 1.00 C ATOM 1288 NH1 ARG A 80 0.230 -10.955 -0.337 1.00 1.00 N ATOM 1289 NH2 ARG A 80 -0.007 -11.383 1.900 1.00 1.00 N ATOM 0 H ARG A 80 -5.130 -12.782 -3.304 1.00 1.00 H new ATOM 0 HA ARG A 80 -3.262 -14.761 -2.496 1.00 1.00 H new ATOM 0 HB2 ARG A 80 -3.635 -11.934 -2.401 1.00 1.00 H new ATOM 0 HB3 ARG A 80 -3.429 -12.471 -0.746 1.00 1.00 H new ATOM 0 HG2 ARG A 80 -1.577 -13.406 -2.952 1.00 1.00 H new ATOM 0 HG3 ARG A 80 -1.322 -11.872 -2.143 1.00 1.00 H new ATOM 0 HD2 ARG A 80 -1.383 -14.567 -0.744 1.00 1.00 H new ATOM 0 HD3 ARG A 80 0.076 -13.749 -1.266 1.00 1.00 H new ATOM 0 HE ARG A 80 -1.413 -13.276 1.140 1.00 1.00 H new ATOM 0 HH11 ARG A 80 0.078 -11.219 -1.310 1.00 1.00 H new ATOM 0 HH12 ARG A 80 0.732 -10.095 -0.114 1.00 1.00 H new ATOM 0 HH21 ARG A 80 -0.341 -11.976 2.659 1.00 1.00 H new ATOM 0 HH22 ARG A 80 0.496 -10.521 2.110 1.00 1.00 H new ATOM 1303 N GLN A 81 -4.035 -15.727 -0.371 1.00 1.00 N ATOM 1304 CA GLN A 81 -4.295 -16.228 0.949 1.00 1.00 C ATOM 1305 C GLN A 81 -3.859 -15.130 1.914 1.00 1.00 C ATOM 1306 O GLN A 81 -2.859 -14.433 1.707 1.00 1.00 O ATOM 1307 CB GLN A 81 -3.475 -17.506 1.198 1.00 1.00 C ATOM 1308 CG GLN A 81 -3.818 -18.684 0.264 1.00 1.00 C ATOM 1309 CD GLN A 81 -2.883 -19.878 0.480 1.00 1.00 C ATOM 1310 OE1 GLN A 81 -1.700 -19.728 0.771 1.00 1.00 O ATOM 1311 NE2 GLN A 81 -3.374 -21.100 0.378 1.00 1.00 N ATOM 0 H GLN A 81 -3.332 -16.264 -0.879 1.00 1.00 H new ATOM 0 HA GLN A 81 -5.348 -16.479 1.081 1.00 1.00 H new ATOM 0 HB2 GLN A 81 -2.417 -17.269 1.088 1.00 1.00 H new ATOM 0 HB3 GLN A 81 -3.626 -17.823 2.230 1.00 1.00 H new ATOM 0 HG2 GLN A 81 -4.849 -18.995 0.436 1.00 1.00 H new ATOM 0 HG3 GLN A 81 -3.753 -18.355 -0.773 1.00 1.00 H new ATOM 0 HE21 GLN A 81 -4.356 -21.237 0.137 1.00 1.00 H new ATOM 0 HE22 GLN A 81 -2.772 -21.907 0.541 1.00 1.00 H new ATOM 1320 N THR A 82 -4.640 -15.048 2.972 1.00 1.00 N ATOM 1321 CA THR A 82 -4.609 -14.193 4.142 1.00 1.00 C ATOM 1322 C THR A 82 -3.357 -13.305 4.219 1.00 1.00 C ATOM 1323 O THR A 82 -2.338 -13.738 4.762 1.00 1.00 O ATOM 1324 CB THR A 82 -4.750 -15.124 5.358 1.00 1.00 C ATOM 1325 OG1 THR A 82 -5.855 -16.004 5.211 1.00 1.00 O ATOM 1326 CG2 THR A 82 -4.897 -14.367 6.680 1.00 1.00 C ATOM 0 H THR A 82 -5.437 -15.682 3.038 1.00 1.00 H new ATOM 0 HA THR A 82 -5.427 -13.473 4.103 1.00 1.00 H new ATOM 0 HB THR A 82 -3.822 -15.694 5.394 1.00 1.00 H new ATOM 0 HG1 THR A 82 -5.918 -16.584 5.998 1.00 1.00 H new ATOM 0 HG21 THR A 82 -4.992 -15.080 7.499 1.00 1.00 H new ATOM 0 HG22 THR A 82 -4.018 -13.744 6.842 1.00 1.00 H new ATOM 0 HG23 THR A 82 -5.786 -13.737 6.642 1.00 1.00 H new ATOM 1334 N PRO A 83 -3.384 -12.064 3.695 1.00 1.00 N ATOM 1335 CA PRO A 83 -2.542 -10.988 4.213 1.00 1.00 C ATOM 1336 C PRO A 83 -2.774 -10.829 5.719 1.00 1.00 C ATOM 1337 O PRO A 83 -3.798 -11.286 6.237 1.00 1.00 O ATOM 1338 CB PRO A 83 -2.950 -9.725 3.450 1.00 1.00 C ATOM 1339 CG PRO A 83 -3.713 -10.256 2.234 1.00 1.00 C ATOM 1340 CD PRO A 83 -4.358 -11.531 2.765 1.00 1.00 C ATOM 0 HA PRO A 83 -1.481 -11.193 4.074 1.00 1.00 H new ATOM 0 HB2 PRO A 83 -3.576 -9.075 4.061 1.00 1.00 H new ATOM 0 HB3 PRO A 83 -2.080 -9.141 3.151 1.00 1.00 H new ATOM 0 HG2 PRO A 83 -4.458 -9.543 1.882 1.00 1.00 H new ATOM 0 HG3 PRO A 83 -3.046 -10.460 1.396 1.00 1.00 H new ATOM 0 HD2 PRO A 83 -5.307 -11.321 3.259 1.00 1.00 H new ATOM 0 HD3 PRO A 83 -4.567 -12.236 1.960 1.00 1.00 H new ATOM 1348 N SER A 84 -1.856 -10.178 6.433 1.00 1.00 N ATOM 1349 CA SER A 84 -2.038 -10.006 7.866 1.00 1.00 C ATOM 1350 C SER A 84 -2.994 -8.838 8.073 1.00 1.00 C ATOM 1351 O SER A 84 -3.049 -7.955 7.216 1.00 1.00 O ATOM 1352 CB SER A 84 -0.697 -9.703 8.547 1.00 1.00 C ATOM 1353 OG SER A 84 0.446 -9.881 7.717 1.00 1.00 O ATOM 0 H SER A 84 -1.002 -9.772 6.052 1.00 1.00 H new ATOM 0 HA SER A 84 -2.440 -10.920 8.304 1.00 1.00 H new ATOM 0 HB2 SER A 84 -0.712 -8.674 8.906 1.00 1.00 H new ATOM 0 HB3 SER A 84 -0.597 -10.344 9.423 1.00 1.00 H new ATOM 0 HG SER A 84 1.256 -9.666 8.225 1.00 1.00 H new ATOM 1359 N ARG A 85 -3.575 -8.714 9.270 1.00 1.00 N ATOM 1360 CA ARG A 85 -4.617 -7.720 9.538 1.00 1.00 C ATOM 1361 C ARG A 85 -4.110 -6.312 9.265 1.00 1.00 C ATOM 1362 O ARG A 85 -4.784 -5.538 8.588 1.00 1.00 O ATOM 1363 CB ARG A 85 -5.125 -7.838 10.983 1.00 1.00 C ATOM 1364 CG ARG A 85 -6.354 -8.740 11.141 1.00 1.00 C ATOM 1365 CD ARG A 85 -6.648 -9.061 12.613 1.00 1.00 C ATOM 1366 NE ARG A 85 -6.930 -7.831 13.382 1.00 1.00 N ATOM 1367 CZ ARG A 85 -8.028 -7.563 14.099 1.00 1.00 C ATOM 1368 NH1 ARG A 85 -8.895 -8.520 14.405 1.00 1.00 N ATOM 1369 NH2 ARG A 85 -8.243 -6.320 14.510 1.00 1.00 N ATOM 0 H ARG A 85 -3.338 -9.295 10.074 1.00 1.00 H new ATOM 0 HA ARG A 85 -5.450 -7.919 8.863 1.00 1.00 H new ATOM 0 HB2 ARG A 85 -4.321 -8.224 11.609 1.00 1.00 H new ATOM 0 HB3 ARG A 85 -5.368 -6.842 11.354 1.00 1.00 H new ATOM 0 HG2 ARG A 85 -7.221 -8.252 10.696 1.00 1.00 H new ATOM 0 HG3 ARG A 85 -6.195 -9.668 10.593 1.00 1.00 H new ATOM 0 HD2 ARG A 85 -7.501 -9.737 12.677 1.00 1.00 H new ATOM 0 HD3 ARG A 85 -5.796 -9.580 13.052 1.00 1.00 H new ATOM 0 HE ARG A 85 -6.210 -7.108 13.365 1.00 1.00 H new ATOM 0 HH11 ARG A 85 -8.730 -9.477 14.093 1.00 1.00 H new ATOM 0 HH12 ARG A 85 -9.727 -8.299 14.952 1.00 1.00 H new ATOM 0 HH21 ARG A 85 -7.576 -5.584 14.279 1.00 1.00 H new ATOM 0 HH22 ARG A 85 -9.075 -6.101 15.057 1.00 1.00 H new ATOM 1383 N GLU A 86 -2.913 -5.984 9.757 1.00 1.00 N ATOM 1384 CA GLU A 86 -2.359 -4.648 9.632 1.00 1.00 C ATOM 1385 C GLU A 86 -1.910 -4.328 8.199 1.00 1.00 C ATOM 1386 O GLU A 86 -1.549 -3.184 7.942 1.00 1.00 O ATOM 1387 CB GLU A 86 -1.188 -4.499 10.611 1.00 1.00 C ATOM 1388 CG GLU A 86 -1.072 -3.089 11.204 1.00 1.00 C ATOM 1389 CD GLU A 86 -2.148 -2.850 12.264 1.00 1.00 C ATOM 1390 OE1 GLU A 86 -1.921 -3.191 13.450 1.00 1.00 O ATOM 1391 OE2 GLU A 86 -3.236 -2.332 11.925 1.00 1.00 O ATOM 0 H GLU A 86 -2.308 -6.640 10.251 1.00 1.00 H new ATOM 0 HA GLU A 86 -3.144 -3.932 9.875 1.00 1.00 H new ATOM 0 HB2 GLU A 86 -1.306 -5.218 11.421 1.00 1.00 H new ATOM 0 HB3 GLU A 86 -0.259 -4.748 10.097 1.00 1.00 H new ATOM 0 HG2 GLU A 86 -0.085 -2.957 11.647 1.00 1.00 H new ATOM 0 HG3 GLU A 86 -1.167 -2.348 10.410 1.00 1.00 H new ATOM 1398 N TYR A 87 -1.932 -5.286 7.267 1.00 1.00 N ATOM 1399 CA TYR A 87 -1.886 -5.016 5.836 1.00 1.00 C ATOM 1400 C TYR A 87 -3.322 -5.022 5.310 1.00 1.00 C ATOM 1401 O TYR A 87 -3.849 -3.953 4.988 1.00 1.00 O ATOM 1402 CB TYR A 87 -0.957 -6.005 5.095 1.00 1.00 C ATOM 1403 CG TYR A 87 0.555 -5.869 5.308 1.00 1.00 C ATOM 1404 CD1 TYR A 87 1.178 -4.606 5.363 1.00 1.00 C ATOM 1405 CD2 TYR A 87 1.368 -7.021 5.353 1.00 1.00 C ATOM 1406 CE1 TYR A 87 2.572 -4.488 5.512 1.00 1.00 C ATOM 1407 CE2 TYR A 87 2.774 -6.918 5.402 1.00 1.00 C ATOM 1408 CZ TYR A 87 3.373 -5.649 5.519 1.00 1.00 C ATOM 1409 OH TYR A 87 4.726 -5.547 5.578 1.00 1.00 O ATOM 0 H TYR A 87 -1.983 -6.279 7.493 1.00 1.00 H new ATOM 0 HA TYR A 87 -1.449 -4.035 5.648 1.00 1.00 H new ATOM 0 HB2 TYR A 87 -1.246 -7.015 5.385 1.00 1.00 H new ATOM 0 HB3 TYR A 87 -1.154 -5.911 4.027 1.00 1.00 H new ATOM 0 HD1 TYR A 87 0.575 -3.713 5.289 1.00 1.00 H new ATOM 0 HD2 TYR A 87 0.907 -7.997 5.350 1.00 1.00 H new ATOM 0 HE1 TYR A 87 3.026 -3.514 5.620 1.00 1.00 H new ATOM 0 HE2 TYR A 87 3.387 -7.806 5.350 1.00 1.00 H new ATOM 0 HH TYR A 87 5.122 -6.443 5.575 1.00 1.00 H new ATOM 1419 N VAL A 88 -3.986 -6.181 5.260 1.00 1.00 N ATOM 1420 CA VAL A 88 -5.354 -6.286 4.755 1.00 1.00 C ATOM 1421 C VAL A 88 -6.167 -7.260 5.615 1.00 1.00 C ATOM 1422 O VAL A 88 -5.648 -8.268 6.085 1.00 1.00 O ATOM 1423 CB VAL A 88 -5.350 -6.751 3.277 1.00 1.00 C ATOM 1424 CG1 VAL A 88 -6.732 -6.588 2.641 1.00 1.00 C ATOM 1425 CG2 VAL A 88 -4.339 -6.021 2.382 1.00 1.00 C ATOM 0 H VAL A 88 -3.590 -7.069 5.568 1.00 1.00 H new ATOM 0 HA VAL A 88 -5.819 -5.302 4.809 1.00 1.00 H new ATOM 0 HB VAL A 88 -5.056 -7.799 3.330 1.00 1.00 H new ATOM 0 HG11 VAL A 88 -6.697 -6.923 1.604 1.00 1.00 H new ATOM 0 HG12 VAL A 88 -7.459 -7.186 3.191 1.00 1.00 H new ATOM 0 HG13 VAL A 88 -7.026 -5.539 2.674 1.00 1.00 H new ATOM 0 HG21 VAL A 88 -4.405 -6.410 1.366 1.00 1.00 H new ATOM 0 HG22 VAL A 88 -4.561 -4.954 2.377 1.00 1.00 H new ATOM 0 HG23 VAL A 88 -3.331 -6.180 2.766 1.00 1.00 H new ATOM 1435 N ASP A 89 -7.477 -7.009 5.665 1.00 1.00 N ATOM 1436 CA ASP A 89 -8.543 -7.913 6.090 1.00 1.00 C ATOM 1437 C ASP A 89 -8.596 -8.065 7.605 1.00 1.00 C ATOM 1438 O ASP A 89 -7.775 -8.741 8.215 1.00 1.00 O ATOM 1439 CB ASP A 89 -8.494 -9.264 5.363 1.00 1.00 C ATOM 1440 CG ASP A 89 -9.900 -9.838 5.288 1.00 1.00 C ATOM 1441 OD1 ASP A 89 -10.333 -10.553 6.212 1.00 1.00 O ATOM 1442 OD2 ASP A 89 -10.599 -9.539 4.291 1.00 1.00 O ATOM 0 H ASP A 89 -7.846 -6.099 5.388 1.00 1.00 H new ATOM 0 HA ASP A 89 -9.482 -7.446 5.793 1.00 1.00 H new ATOM 0 HB2 ASP A 89 -8.085 -9.137 4.361 1.00 1.00 H new ATOM 0 HB3 ASP A 89 -7.834 -9.952 5.892 1.00 1.00 H new ATOM 1447 N LEU A 90 -9.541 -7.363 8.229 1.00 1.00 N ATOM 1448 CA LEU A 90 -9.629 -7.157 9.667 1.00 1.00 C ATOM 1449 C LEU A 90 -11.091 -7.069 10.117 1.00 1.00 C ATOM 1450 O LEU A 90 -11.417 -6.390 11.084 1.00 1.00 O ATOM 1451 CB LEU A 90 -8.764 -5.944 10.088 1.00 1.00 C ATOM 1452 CG LEU A 90 -8.908 -4.595 9.353 1.00 1.00 C ATOM 1453 CD1 LEU A 90 -8.258 -4.588 7.960 1.00 1.00 C ATOM 1454 CD2 LEU A 90 -10.361 -4.142 9.215 1.00 1.00 C ATOM 0 H LEU A 90 -10.297 -6.904 7.721 1.00 1.00 H new ATOM 0 HA LEU A 90 -9.216 -8.020 10.188 1.00 1.00 H new ATOM 0 HB2 LEU A 90 -8.959 -5.759 11.144 1.00 1.00 H new ATOM 0 HB3 LEU A 90 -7.720 -6.247 10.005 1.00 1.00 H new ATOM 0 HG LEU A 90 -8.374 -3.891 9.992 1.00 1.00 H new ATOM 0 HD11 LEU A 90 -8.396 -3.610 7.499 1.00 1.00 H new ATOM 0 HD12 LEU A 90 -7.192 -4.797 8.055 1.00 1.00 H new ATOM 0 HD13 LEU A 90 -8.724 -5.352 7.337 1.00 1.00 H new ATOM 0 HD21 LEU A 90 -10.396 -3.188 8.690 1.00 1.00 H new ATOM 0 HD22 LEU A 90 -10.922 -4.887 8.651 1.00 1.00 H new ATOM 0 HD23 LEU A 90 -10.802 -4.028 10.205 1.00 1.00 H new ATOM 1466 N GLU A 91 -11.991 -7.729 9.388 1.00 1.00 N ATOM 1467 CA GLU A 91 -13.401 -7.958 9.702 1.00 1.00 C ATOM 1468 C GLU A 91 -14.280 -6.700 9.725 1.00 1.00 C ATOM 1469 O GLU A 91 -15.502 -6.826 9.813 1.00 1.00 O ATOM 1470 CB GLU A 91 -13.477 -8.815 10.976 1.00 1.00 C ATOM 1471 CG GLU A 91 -14.841 -9.476 11.201 1.00 1.00 C ATOM 1472 CD GLU A 91 -14.732 -10.722 12.083 1.00 1.00 C ATOM 1473 OE1 GLU A 91 -13.887 -10.768 13.009 1.00 1.00 O ATOM 1474 OE2 GLU A 91 -15.512 -11.675 11.845 1.00 1.00 O ATOM 0 H GLU A 91 -11.733 -8.149 8.495 1.00 1.00 H new ATOM 0 HA GLU A 91 -13.850 -8.508 8.875 1.00 1.00 H new ATOM 0 HB2 GLU A 91 -12.713 -9.590 10.926 1.00 1.00 H new ATOM 0 HB3 GLU A 91 -13.241 -8.190 11.837 1.00 1.00 H new ATOM 0 HG2 GLU A 91 -15.519 -8.760 11.666 1.00 1.00 H new ATOM 0 HG3 GLU A 91 -15.276 -9.749 10.239 1.00 1.00 H new ATOM 1481 N ARG A 92 -13.676 -5.523 9.512 1.00 1.00 N ATOM 1482 CA ARG A 92 -14.208 -4.173 9.300 1.00 1.00 C ATOM 1483 C ARG A 92 -13.981 -3.380 10.576 1.00 1.00 C ATOM 1484 O ARG A 92 -14.398 -3.830 11.645 1.00 1.00 O ATOM 1485 CB ARG A 92 -15.701 -4.114 8.922 1.00 1.00 C ATOM 1486 CG ARG A 92 -16.004 -2.941 8.000 1.00 1.00 C ATOM 1487 CD ARG A 92 -15.567 -3.281 6.567 1.00 1.00 C ATOM 1488 NE ARG A 92 -16.646 -3.013 5.602 1.00 1.00 N ATOM 1489 CZ ARG A 92 -17.655 -3.857 5.311 1.00 1.00 C ATOM 1490 NH1 ARG A 92 -17.621 -5.134 5.672 1.00 1.00 N ATOM 1491 NH2 ARG A 92 -18.735 -3.439 4.658 1.00 1.00 N ATOM 0 H ARG A 92 -12.657 -5.496 9.481 1.00 1.00 H new ATOM 0 HA ARG A 92 -13.679 -3.755 8.443 1.00 1.00 H new ATOM 0 HB2 ARG A 92 -15.989 -5.045 8.433 1.00 1.00 H new ATOM 0 HB3 ARG A 92 -16.302 -4.030 9.827 1.00 1.00 H new ATOM 0 HG2 ARG A 92 -17.070 -2.716 8.021 1.00 1.00 H new ATOM 0 HG3 ARG A 92 -15.483 -2.049 8.347 1.00 1.00 H new ATOM 0 HD2 ARG A 92 -14.687 -2.694 6.304 1.00 1.00 H new ATOM 0 HD3 ARG A 92 -15.279 -4.331 6.512 1.00 1.00 H new ATOM 0 HE ARG A 92 -16.628 -2.117 5.115 1.00 1.00 H new ATOM 0 HH11 ARG A 92 -16.817 -5.498 6.183 1.00 1.00 H new ATOM 0 HH12 ARG A 92 -18.399 -5.751 5.439 1.00 1.00 H new ATOM 0 HH21 ARG A 92 -18.810 -2.464 4.368 1.00 1.00 H new ATOM 0 HH22 ARG A 92 -19.488 -4.093 4.447 1.00 1.00 H new ATOM 1505 N GLU A 93 -13.335 -2.224 10.480 1.00 1.00 N ATOM 1506 CA GLU A 93 -13.325 -1.244 11.546 1.00 1.00 C ATOM 1507 C GLU A 93 -14.616 -0.425 11.505 1.00 1.00 C ATOM 1508 O GLU A 93 -15.484 -0.651 10.659 1.00 1.00 O ATOM 1509 CB GLU A 93 -12.074 -0.356 11.434 1.00 1.00 C ATOM 1510 CG GLU A 93 -11.327 -0.218 12.763 1.00 1.00 C ATOM 1511 CD GLU A 93 -11.675 1.062 13.510 1.00 1.00 C ATOM 1512 OE1 GLU A 93 -11.026 2.109 13.299 1.00 1.00 O ATOM 1513 OE2 GLU A 93 -12.598 1.005 14.349 1.00 1.00 O ATOM 0 H GLU A 93 -12.803 -1.944 9.656 1.00 1.00 H new ATOM 0 HA GLU A 93 -13.281 -1.748 12.512 1.00 1.00 H new ATOM 0 HB2 GLU A 93 -11.402 -0.775 10.686 1.00 1.00 H new ATOM 0 HB3 GLU A 93 -12.366 0.633 11.081 1.00 1.00 H new ATOM 0 HG2 GLU A 93 -11.559 -1.075 13.395 1.00 1.00 H new ATOM 0 HG3 GLU A 93 -10.254 -0.242 12.575 1.00 1.00 H new ATOM 1520 N ALA A 94 -14.719 0.535 12.419 1.00 1.00 N ATOM 1521 CA ALA A 94 -15.867 1.415 12.598 1.00 1.00 C ATOM 1522 C ALA A 94 -16.055 2.296 11.365 1.00 1.00 C ATOM 1523 O ALA A 94 -15.434 3.351 11.236 1.00 1.00 O ATOM 1524 CB ALA A 94 -15.703 2.249 13.868 1.00 1.00 C ATOM 0 H ALA A 94 -13.971 0.729 13.084 1.00 1.00 H new ATOM 0 HA ALA A 94 -16.766 0.810 12.714 1.00 1.00 H new ATOM 0 HB1 ALA A 94 -16.568 2.902 13.989 1.00 1.00 H new ATOM 0 HB2 ALA A 94 -15.625 1.587 14.730 1.00 1.00 H new ATOM 0 HB3 ALA A 94 -14.800 2.854 13.792 1.00 1.00 H new ATOM 1530 N GLY A 95 -16.869 1.824 10.426 1.00 1.00 N ATOM 1531 CA GLY A 95 -17.152 2.480 9.163 1.00 1.00 C ATOM 1532 C GLY A 95 -15.947 2.625 8.228 1.00 1.00 C ATOM 1533 O GLY A 95 -16.081 3.250 7.169 1.00 1.00 O ATOM 0 H GLY A 95 -17.367 0.940 10.532 1.00 1.00 H new ATOM 0 HA2 GLY A 95 -17.930 1.919 8.645 1.00 1.00 H new ATOM 0 HA3 GLY A 95 -17.556 3.471 9.368 1.00 1.00 H new ATOM 1537 N LYS A 96 -14.791 2.041 8.551 1.00 1.00 N ATOM 1538 CA LYS A 96 -13.610 2.057 7.704 1.00 1.00 C ATOM 1539 C LYS A 96 -12.997 0.669 7.667 1.00 1.00 C ATOM 1540 O LYS A 96 -13.403 -0.232 8.401 1.00 1.00 O ATOM 1541 CB LYS A 96 -12.629 3.153 8.157 1.00 1.00 C ATOM 1542 CG LYS A 96 -12.276 3.295 9.648 1.00 1.00 C ATOM 1543 CD LYS A 96 -11.853 4.739 9.993 1.00 1.00 C ATOM 1544 CE LYS A 96 -10.517 4.836 10.738 1.00 1.00 C ATOM 1545 NZ LYS A 96 -10.612 4.549 12.181 1.00 1.00 N ATOM 0 H LYS A 96 -14.653 1.536 9.426 1.00 1.00 H new ATOM 0 HA LYS A 96 -13.884 2.313 6.681 1.00 1.00 H new ATOM 0 HB2 LYS A 96 -11.696 2.998 7.615 1.00 1.00 H new ATOM 0 HB3 LYS A 96 -13.035 4.109 7.826 1.00 1.00 H new ATOM 0 HG2 LYS A 96 -13.136 3.011 10.255 1.00 1.00 H new ATOM 0 HG3 LYS A 96 -11.468 2.608 9.899 1.00 1.00 H new ATOM 0 HD2 LYS A 96 -11.786 5.317 9.071 1.00 1.00 H new ATOM 0 HD3 LYS A 96 -12.631 5.199 10.602 1.00 1.00 H new ATOM 0 HE2 LYS A 96 -9.809 4.141 10.286 1.00 1.00 H new ATOM 0 HE3 LYS A 96 -10.110 5.838 10.603 1.00 1.00 H new ATOM 0 HZ1 LYS A 96 -9.842 5.035 12.683 1.00 1.00 H new ATOM 0 HZ2 LYS A 96 -11.527 4.885 12.542 1.00 1.00 H new ATOM 0 HZ3 LYS A 96 -10.534 3.524 12.337 1.00 1.00 H new ATOM 1559 N VAL A 97 -12.001 0.475 6.818 1.00 1.00 N ATOM 1560 CA VAL A 97 -11.102 -0.665 6.936 1.00 1.00 C ATOM 1561 C VAL A 97 -9.691 -0.094 6.968 1.00 1.00 C ATOM 1562 O VAL A 97 -9.430 0.995 6.444 1.00 1.00 O ATOM 1563 CB VAL A 97 -11.381 -1.689 5.815 1.00 1.00 C ATOM 1564 CG1 VAL A 97 -10.646 -1.354 4.529 1.00 1.00 C ATOM 1565 CG2 VAL A 97 -11.013 -3.123 6.163 1.00 1.00 C ATOM 0 H VAL A 97 -11.793 1.095 6.035 1.00 1.00 H new ATOM 0 HA VAL A 97 -11.252 -1.240 7.850 1.00 1.00 H new ATOM 0 HB VAL A 97 -12.461 -1.619 5.686 1.00 1.00 H new ATOM 0 HG11 VAL A 97 -10.876 -2.104 3.773 1.00 1.00 H new ATOM 0 HG12 VAL A 97 -10.962 -0.373 4.174 1.00 1.00 H new ATOM 0 HG13 VAL A 97 -9.572 -1.344 4.716 1.00 1.00 H new ATOM 0 HG21 VAL A 97 -11.243 -3.773 5.319 1.00 1.00 H new ATOM 0 HG22 VAL A 97 -9.948 -3.181 6.386 1.00 1.00 H new ATOM 0 HG23 VAL A 97 -11.584 -3.444 7.034 1.00 1.00 H new ATOM 1575 N TYR A 98 -8.781 -0.808 7.617 1.00 1.00 N ATOM 1576 CA TYR A 98 -7.395 -0.417 7.655 1.00 1.00 C ATOM 1577 C TYR A 98 -6.749 -0.961 6.395 1.00 1.00 C ATOM 1578 O TYR A 98 -7.238 -1.925 5.795 1.00 1.00 O ATOM 1579 CB TYR A 98 -6.786 -0.928 8.956 1.00 1.00 C ATOM 1580 CG TYR A 98 -7.223 -0.189 10.210 1.00 1.00 C ATOM 1581 CD1 TYR A 98 -8.285 0.743 10.194 1.00 1.00 C ATOM 1582 CD2 TYR A 98 -6.555 -0.449 11.420 1.00 1.00 C ATOM 1583 CE1 TYR A 98 -8.704 1.367 11.368 1.00 1.00 C ATOM 1584 CE2 TYR A 98 -6.934 0.220 12.597 1.00 1.00 C ATOM 1585 CZ TYR A 98 -8.023 1.118 12.578 1.00 1.00 C ATOM 1586 OH TYR A 98 -8.394 1.764 13.714 1.00 1.00 O ATOM 0 H TYR A 98 -8.989 -1.667 8.126 1.00 1.00 H new ATOM 0 HA TYR A 98 -7.242 0.662 7.659 1.00 1.00 H new ATOM 0 HB2 TYR A 98 -7.040 -1.982 9.068 1.00 1.00 H new ATOM 0 HB3 TYR A 98 -5.700 -0.868 8.878 1.00 1.00 H new ATOM 0 HD1 TYR A 98 -8.778 0.975 9.261 1.00 1.00 H new ATOM 0 HD2 TYR A 98 -5.747 -1.166 11.445 1.00 1.00 H new ATOM 0 HE1 TYR A 98 -9.549 2.040 11.351 1.00 1.00 H new ATOM 0 HE2 TYR A 98 -6.392 0.047 13.515 1.00 1.00 H new ATOM 0 HH TYR A 98 -9.307 2.106 13.612 1.00 1.00 H new ATOM 1596 N LEU A 99 -5.711 -0.273 5.937 1.00 1.00 N ATOM 1597 CA LEU A 99 -5.159 -0.504 4.623 1.00 1.00 C ATOM 1598 C LEU A 99 -3.686 -0.134 4.712 1.00 1.00 C ATOM 1599 O LEU A 99 -3.325 0.867 5.331 1.00 1.00 O ATOM 1600 CB LEU A 99 -5.987 0.324 3.608 1.00 1.00 C ATOM 1601 CG LEU A 99 -6.276 -0.365 2.265 1.00 1.00 C ATOM 1602 CD1 LEU A 99 -5.009 -0.660 1.467 1.00 1.00 C ATOM 1603 CD2 LEU A 99 -7.101 -1.647 2.449 1.00 1.00 C ATOM 0 H LEU A 99 -5.235 0.456 6.469 1.00 1.00 H new ATOM 0 HA LEU A 99 -5.216 -1.536 4.278 1.00 1.00 H new ATOM 0 HB2 LEU A 99 -6.937 0.588 4.072 1.00 1.00 H new ATOM 0 HB3 LEU A 99 -5.458 1.257 3.411 1.00 1.00 H new ATOM 0 HG LEU A 99 -6.866 0.346 1.687 1.00 1.00 H new ATOM 0 HD11 LEU A 99 -5.275 -1.147 0.529 1.00 1.00 H new ATOM 0 HD12 LEU A 99 -4.486 0.273 1.257 1.00 1.00 H new ATOM 0 HD13 LEU A 99 -4.360 -1.317 2.045 1.00 1.00 H new ATOM 0 HD21 LEU A 99 -7.284 -2.104 1.477 1.00 1.00 H new ATOM 0 HD22 LEU A 99 -6.552 -2.345 3.081 1.00 1.00 H new ATOM 0 HD23 LEU A 99 -8.053 -1.403 2.920 1.00 1.00 H new ATOM 1615 N LYS A 100 -2.815 -0.959 4.148 1.00 1.00 N ATOM 1616 CA LYS A 100 -1.368 -0.827 4.297 1.00 1.00 C ATOM 1617 C LYS A 100 -0.735 -1.810 3.337 1.00 1.00 C ATOM 1618 O LYS A 100 -1.220 -2.936 3.244 1.00 1.00 O ATOM 1619 CB LYS A 100 -0.908 -1.171 5.733 1.00 1.00 C ATOM 1620 CG LYS A 100 0.404 -0.492 6.138 1.00 1.00 C ATOM 1621 CD LYS A 100 1.130 -1.127 7.334 1.00 1.00 C ATOM 1622 CE LYS A 100 0.446 -0.982 8.693 1.00 1.00 C ATOM 1623 NZ LYS A 100 0.391 0.398 9.220 1.00 1.00 N ATOM 0 H LYS A 100 -3.094 -1.749 3.567 1.00 1.00 H new ATOM 0 HA LYS A 100 -1.074 0.202 4.092 1.00 1.00 H new ATOM 0 HB2 LYS A 100 -1.689 -0.880 6.435 1.00 1.00 H new ATOM 0 HB3 LYS A 100 -0.789 -2.251 5.818 1.00 1.00 H new ATOM 0 HG2 LYS A 100 1.077 -0.498 5.281 1.00 1.00 H new ATOM 0 HG3 LYS A 100 0.196 0.552 6.373 1.00 1.00 H new ATOM 0 HD2 LYS A 100 1.263 -2.189 7.129 1.00 1.00 H new ATOM 0 HD3 LYS A 100 2.125 -0.688 7.403 1.00 1.00 H new ATOM 0 HE2 LYS A 100 -0.571 -1.366 8.614 1.00 1.00 H new ATOM 0 HE3 LYS A 100 0.968 -1.610 9.415 1.00 1.00 H new ATOM 0 HZ1 LYS A 100 -0.089 0.398 10.143 1.00 1.00 H new ATOM 0 HZ2 LYS A 100 1.357 0.766 9.332 1.00 1.00 H new ATOM 0 HZ3 LYS A 100 -0.134 1.002 8.556 1.00 1.00 H new ATOM 1637 N ALA A 101 0.362 -1.444 2.686 1.00 1.00 N ATOM 1638 CA ALA A 101 1.164 -2.428 1.958 1.00 1.00 C ATOM 1639 C ALA A 101 2.636 -2.024 2.006 1.00 1.00 C ATOM 1640 O ALA A 101 2.929 -0.831 1.907 1.00 1.00 O ATOM 1641 CB ALA A 101 0.684 -2.588 0.504 1.00 1.00 C ATOM 0 H ALA A 101 0.716 -0.488 2.645 1.00 1.00 H new ATOM 0 HA ALA A 101 1.043 -3.397 2.442 1.00 1.00 H new ATOM 0 HB1 ALA A 101 1.304 -3.327 -0.004 1.00 1.00 H new ATOM 0 HB2 ALA A 101 -0.354 -2.919 0.498 1.00 1.00 H new ATOM 0 HB3 ALA A 101 0.763 -1.631 -0.012 1.00 1.00 H new ATOM 1647 N PRO A 102 3.568 -2.982 2.130 1.00 1.00 N ATOM 1648 CA PRO A 102 4.978 -2.717 1.913 1.00 1.00 C ATOM 1649 C PRO A 102 5.210 -2.593 0.406 1.00 1.00 C ATOM 1650 O PRO A 102 4.461 -3.149 -0.398 1.00 1.00 O ATOM 1651 CB PRO A 102 5.697 -3.928 2.500 1.00 1.00 C ATOM 1652 CG PRO A 102 4.726 -5.064 2.183 1.00 1.00 C ATOM 1653 CD PRO A 102 3.342 -4.419 2.166 1.00 1.00 C ATOM 0 HA PRO A 102 5.336 -1.798 2.376 1.00 1.00 H new ATOM 0 HB2 PRO A 102 6.672 -4.085 2.039 1.00 1.00 H new ATOM 0 HB3 PRO A 102 5.864 -3.822 3.572 1.00 1.00 H new ATOM 0 HG2 PRO A 102 4.958 -5.523 1.222 1.00 1.00 H new ATOM 0 HG3 PRO A 102 4.784 -5.852 2.934 1.00 1.00 H new ATOM 0 HD2 PRO A 102 2.770 -4.746 1.297 1.00 1.00 H new ATOM 0 HD3 PRO A 102 2.769 -4.702 3.049 1.00 1.00 H new ATOM 1661 N MET A 103 6.233 -1.853 0.009 1.00 1.00 N ATOM 1662 CA MET A 103 6.547 -1.613 -1.382 1.00 1.00 C ATOM 1663 C MET A 103 7.984 -1.183 -1.524 1.00 1.00 C ATOM 1664 O MET A 103 8.595 -0.688 -0.582 1.00 1.00 O ATOM 1665 CB MET A 103 5.642 -0.516 -1.947 1.00 1.00 C ATOM 1666 CG MET A 103 5.079 0.466 -0.916 1.00 1.00 C ATOM 1667 SD MET A 103 4.285 1.915 -1.642 1.00 1.00 S ATOM 1668 CE MET A 103 3.314 1.051 -2.886 1.00 1.00 C ATOM 0 H MET A 103 6.875 -1.397 0.657 1.00 1.00 H new ATOM 0 HA MET A 103 6.386 -2.539 -1.934 1.00 1.00 H new ATOM 0 HB2 MET A 103 6.204 0.048 -2.692 1.00 1.00 H new ATOM 0 HB3 MET A 103 4.809 -0.988 -2.467 1.00 1.00 H new ATOM 0 HG2 MET A 103 4.356 -0.056 -0.289 1.00 1.00 H new ATOM 0 HG3 MET A 103 5.888 0.796 -0.264 1.00 1.00 H new ATOM 0 HE1 MET A 103 2.352 1.549 -3.007 1.00 1.00 H new ATOM 0 HE2 MET A 103 3.849 1.060 -3.836 1.00 1.00 H new ATOM 0 HE3 MET A 103 3.152 0.020 -2.570 1.00 1.00 H new ATOM 1678 N ILE A 104 8.498 -1.329 -2.739 1.00 1.00 N ATOM 1679 CA ILE A 104 9.900 -1.130 -3.050 1.00 1.00 C ATOM 1680 C ILE A 104 9.925 -0.213 -4.265 1.00 1.00 C ATOM 1681 O ILE A 104 9.908 -0.667 -5.416 1.00 1.00 O ATOM 1682 CB ILE A 104 10.604 -2.494 -3.182 1.00 1.00 C ATOM 1683 CG1 ILE A 104 10.709 -3.191 -1.803 1.00 1.00 C ATOM 1684 CG2 ILE A 104 12.020 -2.344 -3.748 1.00 1.00 C ATOM 1685 CD1 ILE A 104 10.391 -4.680 -1.829 1.00 1.00 C ATOM 0 H ILE A 104 7.937 -1.594 -3.549 1.00 1.00 H new ATOM 0 HA ILE A 104 10.477 -0.638 -2.267 1.00 1.00 H new ATOM 0 HB ILE A 104 10.002 -3.094 -3.865 1.00 1.00 H new ATOM 0 HG12 ILE A 104 11.718 -3.053 -1.415 1.00 1.00 H new ATOM 0 HG13 ILE A 104 10.030 -2.698 -1.107 1.00 1.00 H new ATOM 0 HG21 ILE A 104 12.486 -3.326 -3.827 1.00 1.00 H new ATOM 0 HG22 ILE A 104 11.970 -1.885 -4.735 1.00 1.00 H new ATOM 0 HG23 ILE A 104 12.612 -1.714 -3.084 1.00 1.00 H new ATOM 0 HD11 ILE A 104 10.488 -5.090 -0.824 1.00 1.00 H new ATOM 0 HD12 ILE A 104 9.371 -4.828 -2.184 1.00 1.00 H new ATOM 0 HD13 ILE A 104 11.086 -5.189 -2.497 1.00 1.00 H new ATOM 1697 N LEU A 105 9.888 1.090 -3.989 1.00 1.00 N ATOM 1698 CA LEU A 105 9.809 2.150 -4.984 1.00 1.00 C ATOM 1699 C LEU A 105 11.176 2.803 -5.079 1.00 1.00 C ATOM 1700 O LEU A 105 11.738 3.183 -4.054 1.00 1.00 O ATOM 1701 CB LEU A 105 8.727 3.177 -4.611 1.00 1.00 C ATOM 1702 CG LEU A 105 7.473 3.138 -5.498 1.00 1.00 C ATOM 1703 CD1 LEU A 105 7.792 3.508 -6.950 1.00 1.00 C ATOM 1704 CD2 LEU A 105 6.761 1.782 -5.418 1.00 1.00 C ATOM 0 H LEU A 105 9.913 1.445 -3.033 1.00 1.00 H new ATOM 0 HA LEU A 105 9.527 1.735 -5.952 1.00 1.00 H new ATOM 0 HB2 LEU A 105 8.429 3.011 -3.576 1.00 1.00 H new ATOM 0 HB3 LEU A 105 9.160 4.176 -4.661 1.00 1.00 H new ATOM 0 HG LEU A 105 6.789 3.892 -5.109 1.00 1.00 H new ATOM 0 HD11 LEU A 105 6.879 3.469 -7.544 1.00 1.00 H new ATOM 0 HD12 LEU A 105 8.205 4.516 -6.986 1.00 1.00 H new ATOM 0 HD13 LEU A 105 8.519 2.803 -7.354 1.00 1.00 H new ATOM 0 HD21 LEU A 105 5.880 1.795 -6.059 1.00 1.00 H new ATOM 0 HD22 LEU A 105 7.439 0.995 -5.749 1.00 1.00 H new ATOM 0 HD23 LEU A 105 6.458 1.590 -4.389 1.00 1.00 H new ATOM 1716 N ASN A 106 11.751 2.847 -6.282 1.00 1.00 N ATOM 1717 CA ASN A 106 13.124 3.244 -6.629 1.00 1.00 C ATOM 1718 C ASN A 106 14.147 2.211 -6.150 1.00 1.00 C ATOM 1719 O ASN A 106 15.142 1.937 -6.819 1.00 1.00 O ATOM 1720 CB ASN A 106 13.467 4.659 -6.126 1.00 1.00 C ATOM 1721 CG ASN A 106 14.697 5.234 -6.824 1.00 1.00 C ATOM 1722 OD1 ASN A 106 15.777 4.657 -6.832 1.00 1.00 O ATOM 1723 ND2 ASN A 106 14.571 6.398 -7.421 1.00 1.00 N ATOM 0 H ASN A 106 11.224 2.583 -7.115 1.00 1.00 H new ATOM 0 HA ASN A 106 13.177 3.277 -7.717 1.00 1.00 H new ATOM 0 HB2 ASN A 106 12.615 5.319 -6.292 1.00 1.00 H new ATOM 0 HB3 ASN A 106 13.642 4.628 -5.051 1.00 1.00 H new ATOM 0 HD21 ASN A 106 15.372 6.820 -7.890 1.00 1.00 H new ATOM 0 HD22 ASN A 106 13.672 6.880 -7.415 1.00 1.00 H new ATOM 1730 N GLY A 107 13.854 1.590 -5.017 1.00 1.00 N ATOM 1731 CA GLY A 107 14.728 0.756 -4.219 1.00 1.00 C ATOM 1732 C GLY A 107 14.679 1.153 -2.744 1.00 1.00 C ATOM 1733 O GLY A 107 15.653 0.988 -2.015 1.00 1.00 O ATOM 0 H GLY A 107 12.925 1.665 -4.603 1.00 1.00 H new ATOM 0 HA2 GLY A 107 14.436 -0.289 -4.327 1.00 1.00 H new ATOM 0 HA3 GLY A 107 15.751 0.840 -4.587 1.00 1.00 H new ATOM 1737 N VAL A 108 13.571 1.736 -2.302 1.00 1.00 N ATOM 1738 CA VAL A 108 13.301 2.090 -0.936 1.00 1.00 C ATOM 1739 C VAL A 108 12.120 1.247 -0.500 1.00 1.00 C ATOM 1740 O VAL A 108 11.061 1.307 -1.130 1.00 1.00 O ATOM 1741 CB VAL A 108 13.018 3.591 -0.795 1.00 1.00 C ATOM 1742 CG1 VAL A 108 12.958 3.970 0.688 1.00 1.00 C ATOM 1743 CG2 VAL A 108 14.091 4.447 -1.474 1.00 1.00 C ATOM 0 H VAL A 108 12.805 1.982 -2.928 1.00 1.00 H new ATOM 0 HA VAL A 108 14.165 1.894 -0.300 1.00 1.00 H new ATOM 0 HB VAL A 108 12.063 3.785 -1.283 1.00 1.00 H new ATOM 0 HG11 VAL A 108 12.757 5.037 0.783 1.00 1.00 H new ATOM 0 HG12 VAL A 108 12.163 3.406 1.176 1.00 1.00 H new ATOM 0 HG13 VAL A 108 13.912 3.737 1.162 1.00 1.00 H new ATOM 0 HG21 VAL A 108 13.848 5.502 -1.348 1.00 1.00 H new ATOM 0 HG22 VAL A 108 15.061 4.241 -1.021 1.00 1.00 H new ATOM 0 HG23 VAL A 108 14.129 4.208 -2.537 1.00 1.00 H new ATOM 1753 N CYS A 109 12.318 0.474 0.564 1.00 1.00 N ATOM 1754 CA CYS A 109 11.275 -0.248 1.249 1.00 1.00 C ATOM 1755 C CYS A 109 10.473 0.768 2.036 1.00 1.00 C ATOM 1756 O CYS A 109 10.823 1.156 3.150 1.00 1.00 O ATOM 1757 CB CYS A 109 11.868 -1.316 2.151 1.00 1.00 C ATOM 1758 SG CYS A 109 12.634 -2.548 1.065 1.00 1.00 S ATOM 0 H CYS A 109 13.240 0.335 0.978 1.00 1.00 H new ATOM 0 HA CYS A 109 10.628 -0.767 0.542 1.00 1.00 H new ATOM 0 HB2 CYS A 109 12.606 -0.885 2.828 1.00 1.00 H new ATOM 0 HB3 CYS A 109 11.096 -1.773 2.770 1.00 1.00 H new ATOM 0 HG CYS A 109 11.944 -3.649 1.104 1.00 1.00 H new ATOM 1764 N VAL A 110 9.427 1.245 1.392 1.00 1.00 N ATOM 1765 CA VAL A 110 8.420 2.077 2.008 1.00 1.00 C ATOM 1766 C VAL A 110 7.247 1.194 2.399 1.00 1.00 C ATOM 1767 O VAL A 110 7.088 0.062 1.936 1.00 1.00 O ATOM 1768 CB VAL A 110 8.054 3.264 1.093 1.00 1.00 C ATOM 1769 CG1 VAL A 110 9.333 4.075 0.849 1.00 1.00 C ATOM 1770 CG2 VAL A 110 7.349 2.836 -0.205 1.00 1.00 C ATOM 0 H VAL A 110 9.252 1.059 0.404 1.00 1.00 H new ATOM 0 HA VAL A 110 8.794 2.541 2.921 1.00 1.00 H new ATOM 0 HB VAL A 110 7.313 3.892 1.589 1.00 1.00 H new ATOM 0 HG11 VAL A 110 9.108 4.924 0.204 1.00 1.00 H new ATOM 0 HG12 VAL A 110 9.722 4.436 1.801 1.00 1.00 H new ATOM 0 HG13 VAL A 110 10.079 3.442 0.369 1.00 1.00 H new ATOM 0 HG21 VAL A 110 7.119 3.718 -0.802 1.00 1.00 H new ATOM 0 HG22 VAL A 110 8.002 2.173 -0.773 1.00 1.00 H new ATOM 0 HG23 VAL A 110 6.425 2.312 0.039 1.00 1.00 H new ATOM 1780 N ILE A 111 6.398 1.740 3.245 1.00 1.00 N ATOM 1781 CA ILE A 111 5.120 1.182 3.604 1.00 1.00 C ATOM 1782 C ILE A 111 4.135 2.269 3.214 1.00 1.00 C ATOM 1783 O ILE A 111 4.177 3.372 3.747 1.00 1.00 O ATOM 1784 CB ILE A 111 5.160 0.756 5.090 1.00 1.00 C ATOM 1785 CG1 ILE A 111 5.755 -0.662 5.152 1.00 1.00 C ATOM 1786 CG2 ILE A 111 3.782 0.785 5.750 1.00 1.00 C ATOM 1787 CD1 ILE A 111 6.025 -1.197 6.557 1.00 1.00 C ATOM 0 H ILE A 111 6.592 2.622 3.719 1.00 1.00 H new ATOM 0 HA ILE A 111 4.826 0.262 3.099 1.00 1.00 H new ATOM 0 HB ILE A 111 5.773 1.467 5.644 1.00 1.00 H new ATOM 0 HG12 ILE A 111 5.074 -1.346 4.645 1.00 1.00 H new ATOM 0 HG13 ILE A 111 6.690 -0.670 4.592 1.00 1.00 H new ATOM 0 HG21 ILE A 111 3.871 0.477 6.792 1.00 1.00 H new ATOM 0 HG22 ILE A 111 3.378 1.796 5.704 1.00 1.00 H new ATOM 0 HG23 ILE A 111 3.113 0.103 5.226 1.00 1.00 H new ATOM 0 HD11 ILE A 111 6.443 -2.202 6.490 1.00 1.00 H new ATOM 0 HD12 ILE A 111 6.733 -0.543 7.066 1.00 1.00 H new ATOM 0 HD13 ILE A 111 5.092 -1.229 7.120 1.00 1.00 H new ATOM 1799 N TRP A 112 3.279 2.000 2.237 1.00 1.00 N ATOM 1800 CA TRP A 112 2.074 2.800 2.101 1.00 1.00 C ATOM 1801 C TRP A 112 1.196 2.402 3.276 1.00 1.00 C ATOM 1802 O TRP A 112 1.042 1.204 3.528 1.00 1.00 O ATOM 1803 CB TRP A 112 1.390 2.513 0.764 1.00 1.00 C ATOM 1804 CG TRP A 112 0.176 3.342 0.464 1.00 1.00 C ATOM 1805 CD1 TRP A 112 0.121 4.356 -0.428 1.00 1.00 C ATOM 1806 CD2 TRP A 112 -1.168 3.249 1.032 1.00 1.00 C ATOM 1807 NE1 TRP A 112 -1.165 4.858 -0.480 1.00 1.00 N ATOM 1808 CE2 TRP A 112 -2.016 4.168 0.350 1.00 1.00 C ATOM 1809 CE3 TRP A 112 -1.779 2.442 2.013 1.00 1.00 C ATOM 1810 CZ2 TRP A 112 -3.402 4.213 0.563 1.00 1.00 C ATOM 1811 CZ3 TRP A 112 -3.138 2.581 2.329 1.00 1.00 C ATOM 1812 CH2 TRP A 112 -3.964 3.438 1.589 1.00 1.00 C ATOM 0 H TRP A 112 3.392 1.257 1.547 1.00 1.00 H new ATOM 0 HA TRP A 112 2.283 3.870 2.109 1.00 1.00 H new ATOM 0 HB2 TRP A 112 2.116 2.663 -0.035 1.00 1.00 H new ATOM 0 HB3 TRP A 112 1.104 1.461 0.741 1.00 1.00 H new ATOM 0 HD1 TRP A 112 0.955 4.718 -1.011 1.00 1.00 H new ATOM 0 HE1 TRP A 112 -1.449 5.645 -1.063 1.00 1.00 H new ATOM 0 HE3 TRP A 112 -1.188 1.702 2.532 1.00 1.00 H new ATOM 0 HZ2 TRP A 112 -4.029 4.837 -0.056 1.00 1.00 H new ATOM 0 HZ3 TRP A 112 -3.554 2.020 3.153 1.00 1.00 H new ATOM 0 HH2 TRP A 112 -5.020 3.501 1.806 1.00 1.00 H new ATOM 1823 N LYS A 113 0.601 3.359 3.983 1.00 1.00 N ATOM 1824 CA LYS A 113 -0.306 3.072 5.094 1.00 1.00 C ATOM 1825 C LYS A 113 -1.543 3.967 5.062 1.00 1.00 C ATOM 1826 O LYS A 113 -1.495 5.030 4.446 1.00 1.00 O ATOM 1827 CB LYS A 113 0.490 3.220 6.396 1.00 1.00 C ATOM 1828 CG LYS A 113 0.806 4.687 6.745 1.00 1.00 C ATOM 1829 CD LYS A 113 1.772 4.859 7.922 1.00 1.00 C ATOM 1830 CE LYS A 113 1.073 4.864 9.279 1.00 1.00 C ATOM 1831 NZ LYS A 113 1.979 5.385 10.321 1.00 1.00 N ATOM 0 H LYS A 113 0.733 4.354 3.803 1.00 1.00 H new ATOM 0 HA LYS A 113 -0.687 2.054 5.014 1.00 1.00 H new ATOM 0 HB2 LYS A 113 -0.074 2.771 7.213 1.00 1.00 H new ATOM 0 HB3 LYS A 113 1.423 2.664 6.310 1.00 1.00 H new ATOM 0 HG2 LYS A 113 1.230 5.174 5.867 1.00 1.00 H new ATOM 0 HG3 LYS A 113 -0.126 5.203 6.976 1.00 1.00 H new ATOM 0 HD2 LYS A 113 2.506 4.053 7.902 1.00 1.00 H new ATOM 0 HD3 LYS A 113 2.320 5.793 7.800 1.00 1.00 H new ATOM 0 HE2 LYS A 113 0.174 5.478 9.230 1.00 1.00 H new ATOM 0 HE3 LYS A 113 0.756 3.853 9.536 1.00 1.00 H new ATOM 0 HZ1 LYS A 113 1.952 4.758 11.150 1.00 1.00 H new ATOM 0 HZ2 LYS A 113 2.949 5.425 9.949 1.00 1.00 H new ATOM 0 HZ3 LYS A 113 1.675 6.340 10.599 1.00 1.00 H new ATOM 1845 N GLY A 114 -2.616 3.593 5.766 1.00 1.00 N ATOM 1846 CA GLY A 114 -3.825 4.398 5.834 1.00 1.00 C ATOM 1847 C GLY A 114 -5.017 3.678 6.460 1.00 1.00 C ATOM 1848 O GLY A 114 -4.904 2.582 7.024 1.00 1.00 O ATOM 0 H GLY A 114 -2.664 2.726 6.301 1.00 1.00 H new ATOM 0 HA2 GLY A 114 -3.616 5.300 6.409 1.00 1.00 H new ATOM 0 HA3 GLY A 114 -4.094 4.716 4.827 1.00 1.00 H new ATOM 1852 N TRP A 115 -6.180 4.316 6.353 1.00 1.00 N ATOM 1853 CA TRP A 115 -7.499 3.760 6.569 1.00 1.00 C ATOM 1854 C TRP A 115 -8.378 4.283 5.432 1.00 1.00 C ATOM 1855 O TRP A 115 -8.502 5.492 5.236 1.00 1.00 O ATOM 1856 CB TRP A 115 -8.034 4.115 7.965 1.00 1.00 C ATOM 1857 CG TRP A 115 -8.167 5.569 8.331 1.00 1.00 C ATOM 1858 CD1 TRP A 115 -9.254 6.342 8.093 1.00 1.00 C ATOM 1859 CD2 TRP A 115 -7.200 6.452 8.987 1.00 1.00 C ATOM 1860 NE1 TRP A 115 -9.059 7.598 8.628 1.00 1.00 N ATOM 1861 CE2 TRP A 115 -7.827 7.713 9.224 1.00 1.00 C ATOM 1862 CE3 TRP A 115 -5.844 6.341 9.366 1.00 1.00 C ATOM 1863 CZ2 TRP A 115 -7.182 8.770 9.885 1.00 1.00 C ATOM 1864 CZ3 TRP A 115 -5.168 7.423 9.968 1.00 1.00 C ATOM 1865 CH2 TRP A 115 -5.846 8.611 10.279 1.00 1.00 C ATOM 0 H TRP A 115 -6.220 5.302 6.095 1.00 1.00 H new ATOM 0 HA TRP A 115 -7.486 2.670 6.551 1.00 1.00 H new ATOM 0 HB2 TRP A 115 -9.016 3.654 8.071 1.00 1.00 H new ATOM 0 HB3 TRP A 115 -7.381 3.646 8.700 1.00 1.00 H new ATOM 0 HD1 TRP A 115 -10.140 6.023 7.564 1.00 1.00 H new ATOM 0 HE1 TRP A 115 -9.746 8.350 8.586 1.00 1.00 H new ATOM 0 HE3 TRP A 115 -5.317 5.414 9.192 1.00 1.00 H new ATOM 0 HZ2 TRP A 115 -7.707 9.692 10.087 1.00 1.00 H new ATOM 0 HZ3 TRP A 115 -4.115 7.336 10.192 1.00 1.00 H new ATOM 0 HH2 TRP A 115 -5.342 9.399 10.819 1.00 1.00 H new ATOM 1876 N ILE A 116 -8.949 3.375 4.643 1.00 1.00 N ATOM 1877 CA ILE A 116 -9.949 3.726 3.649 1.00 1.00 C ATOM 1878 C ILE A 116 -11.281 3.525 4.357 1.00 1.00 C ATOM 1879 O ILE A 116 -11.662 2.395 4.688 1.00 1.00 O ATOM 1880 CB ILE A 116 -9.789 2.875 2.367 1.00 1.00 C ATOM 1881 CG1 ILE A 116 -8.679 3.398 1.426 1.00 1.00 C ATOM 1882 CG2 ILE A 116 -11.099 2.756 1.571 1.00 1.00 C ATOM 1883 CD1 ILE A 116 -9.040 4.667 0.629 1.00 1.00 C ATOM 0 H ILE A 116 -8.729 2.380 4.678 1.00 1.00 H new ATOM 0 HA ILE A 116 -9.856 4.752 3.293 1.00 1.00 H new ATOM 0 HB ILE A 116 -9.500 1.888 2.729 1.00 1.00 H new ATOM 0 HG12 ILE A 116 -7.788 3.602 2.019 1.00 1.00 H new ATOM 0 HG13 ILE A 116 -8.419 2.608 0.722 1.00 1.00 H new ATOM 0 HG21 ILE A 116 -10.930 2.149 0.682 1.00 1.00 H new ATOM 0 HG22 ILE A 116 -11.861 2.285 2.192 1.00 1.00 H new ATOM 0 HG23 ILE A 116 -11.436 3.749 1.274 1.00 1.00 H new ATOM 0 HD11 ILE A 116 -8.197 4.953 -0.000 1.00 1.00 H new ATOM 0 HD12 ILE A 116 -9.910 4.468 0.003 1.00 1.00 H new ATOM 0 HD13 ILE A 116 -9.269 5.478 1.320 1.00 1.00 H new ATOM 1895 N ASP A 117 -11.975 4.618 4.634 1.00 1.00 N ATOM 1896 CA ASP A 117 -13.380 4.589 4.874 1.00 1.00 C ATOM 1897 C ASP A 117 -14.200 3.978 3.760 1.00 1.00 C ATOM 1898 O ASP A 117 -13.936 4.070 2.559 1.00 1.00 O ATOM 1899 CB ASP A 117 -13.935 5.942 5.292 1.00 1.00 C ATOM 1900 CG ASP A 117 -13.032 6.772 6.203 1.00 1.00 C ATOM 1901 OD1 ASP A 117 -12.115 7.458 5.706 1.00 1.00 O ATOM 1902 OD2 ASP A 117 -13.271 6.723 7.430 1.00 1.00 O ATOM 0 H ASP A 117 -11.562 5.548 4.695 1.00 1.00 H new ATOM 0 HA ASP A 117 -13.485 3.910 5.720 1.00 1.00 H new ATOM 0 HB2 ASP A 117 -14.146 6.522 4.393 1.00 1.00 H new ATOM 0 HB3 ASP A 117 -14.886 5.783 5.800 1.00 1.00 H new ATOM 1907 N LEU A 118 -15.281 3.359 4.209 1.00 1.00 N ATOM 1908 CA LEU A 118 -16.156 2.547 3.393 1.00 1.00 C ATOM 1909 C LEU A 118 -17.066 3.396 2.512 1.00 1.00 C ATOM 1910 O LEU A 118 -17.820 2.824 1.731 1.00 1.00 O ATOM 1911 CB LEU A 118 -16.980 1.661 4.329 1.00 1.00 C ATOM 1912 CG LEU A 118 -16.132 0.730 5.210 1.00 1.00 C ATOM 1913 CD1 LEU A 118 -17.023 0.101 6.276 1.00 1.00 C ATOM 1914 CD2 LEU A 118 -15.311 -0.296 4.420 1.00 1.00 C ATOM 0 H LEU A 118 -15.579 3.413 5.183 1.00 1.00 H new ATOM 0 HA LEU A 118 -15.557 1.938 2.717 1.00 1.00 H new ATOM 0 HB2 LEU A 118 -17.591 2.296 4.971 1.00 1.00 H new ATOM 0 HB3 LEU A 118 -17.665 1.058 3.733 1.00 1.00 H new ATOM 0 HG LEU A 118 -15.370 1.333 5.704 1.00 1.00 H new ATOM 0 HD11 LEU A 118 -16.427 -0.561 6.904 1.00 1.00 H new ATOM 0 HD12 LEU A 118 -17.464 0.886 6.891 1.00 1.00 H new ATOM 0 HD13 LEU A 118 -17.816 -0.472 5.796 1.00 1.00 H new ATOM 0 HD21 LEU A 118 -14.740 -0.915 5.112 1.00 1.00 H new ATOM 0 HD22 LEU A 118 -15.981 -0.927 3.837 1.00 1.00 H new ATOM 0 HD23 LEU A 118 -14.627 0.224 3.749 1.00 1.00 H new ATOM 1926 N HIS A 119 -16.976 4.728 2.603 1.00 1.00 N ATOM 1927 CA HIS A 119 -17.949 5.661 2.066 1.00 1.00 C ATOM 1928 C HIS A 119 -17.978 5.515 0.550 1.00 1.00 C ATOM 1929 O HIS A 119 -18.947 5.040 -0.035 1.00 1.00 O ATOM 1930 CB HIS A 119 -17.560 7.103 2.472 1.00 1.00 C ATOM 1931 CG HIS A 119 -17.462 7.345 3.954 1.00 1.00 C ATOM 1932 ND1 HIS A 119 -18.394 6.960 4.886 1.00 1.00 N ATOM 1933 CD2 HIS A 119 -16.456 8.010 4.611 1.00 1.00 C ATOM 1934 CE1 HIS A 119 -17.960 7.373 6.084 1.00 1.00 C ATOM 1935 NE2 HIS A 119 -16.800 8.042 5.969 1.00 1.00 N ATOM 0 H HIS A 119 -16.196 5.192 3.069 1.00 1.00 H new ATOM 0 HA HIS A 119 -18.941 5.449 2.465 1.00 1.00 H new ATOM 0 HB2 HIS A 119 -16.600 7.346 2.016 1.00 1.00 H new ATOM 0 HB3 HIS A 119 -18.295 7.792 2.055 1.00 1.00 H new ATOM 0 HD2 HIS A 119 -15.567 8.430 4.165 1.00 1.00 H new ATOM 0 HE1 HIS A 119 -18.473 7.193 7.017 1.00 1.00 H new ATOM 0 HE2 HIS A 119 -16.274 8.486 6.722 1.00 1.00 H new ATOM 1943 N ARG A 120 -16.895 5.927 -0.092 1.00 1.00 N ATOM 1944 CA ARG A 120 -16.683 5.874 -1.533 1.00 1.00 C ATOM 1945 C ARG A 120 -15.443 5.055 -1.827 1.00 1.00 C ATOM 1946 O ARG A 120 -15.022 5.007 -2.983 1.00 1.00 O ATOM 1947 CB ARG A 120 -16.572 7.299 -2.099 1.00 1.00 C ATOM 1948 CG ARG A 120 -17.611 8.327 -1.609 1.00 1.00 C ATOM 1949 CD ARG A 120 -19.057 8.076 -2.085 1.00 1.00 C ATOM 1950 NE ARG A 120 -19.902 7.359 -1.106 1.00 1.00 N ATOM 1951 CZ ARG A 120 -20.477 7.884 -0.016 1.00 1.00 C ATOM 1952 NH1 ARG A 120 -20.494 9.196 0.179 1.00 1.00 N ATOM 1953 NH2 ARG A 120 -21.003 7.088 0.907 1.00 1.00 N ATOM 0 H ARG A 120 -16.098 6.328 0.403 1.00 1.00 H new ATOM 0 HA ARG A 120 -17.532 5.393 -2.019 1.00 1.00 H new ATOM 0 HB2 ARG A 120 -15.579 7.681 -1.863 1.00 1.00 H new ATOM 0 HB3 ARG A 120 -16.640 7.239 -3.185 1.00 1.00 H new ATOM 0 HG2 ARG A 120 -17.601 8.339 -0.519 1.00 1.00 H new ATOM 0 HG3 ARG A 120 -17.303 9.318 -1.941 1.00 1.00 H new ATOM 0 HD2 ARG A 120 -19.523 9.034 -2.317 1.00 1.00 H new ATOM 0 HD3 ARG A 120 -19.028 7.503 -3.012 1.00 1.00 H new ATOM 0 HE ARG A 120 -20.063 6.367 -1.278 1.00 1.00 H new ATOM 0 HH11 ARG A 120 -20.066 9.819 -0.506 1.00 1.00 H new ATOM 0 HH12 ARG A 120 -20.935 9.582 1.014 1.00 1.00 H new ATOM 0 HH21 ARG A 120 -20.970 6.076 0.787 1.00 1.00 H new ATOM 0 HH22 ARG A 120 -21.441 7.489 1.737 1.00 1.00 H new ATOM 1967 N LEU A 121 -14.852 4.438 -0.793 1.00 1.00 N ATOM 1968 CA LEU A 121 -13.500 3.927 -0.817 1.00 1.00 C ATOM 1969 C LEU A 121 -12.600 5.125 -1.020 1.00 1.00 C ATOM 1970 O LEU A 121 -11.949 5.296 -2.045 1.00 1.00 O ATOM 1971 CB LEU A 121 -13.267 2.802 -1.830 1.00 1.00 C ATOM 1972 CG LEU A 121 -14.196 1.593 -1.739 1.00 1.00 C ATOM 1973 CD1 LEU A 121 -14.427 1.139 -0.295 1.00 1.00 C ATOM 1974 CD2 LEU A 121 -15.576 1.759 -2.389 1.00 1.00 C ATOM 0 H LEU A 121 -15.324 4.284 0.098 1.00 1.00 H new ATOM 0 HA LEU A 121 -13.273 3.429 0.126 1.00 1.00 H new ATOM 0 HB2 LEU A 121 -13.354 3.223 -2.832 1.00 1.00 H new ATOM 0 HB3 LEU A 121 -12.241 2.452 -1.719 1.00 1.00 H new ATOM 0 HG LEU A 121 -13.647 0.844 -2.310 1.00 1.00 H new ATOM 0 HD11 LEU A 121 -15.094 0.277 -0.287 1.00 1.00 H new ATOM 0 HD12 LEU A 121 -13.474 0.864 0.157 1.00 1.00 H new ATOM 0 HD13 LEU A 121 -14.878 1.952 0.274 1.00 1.00 H new ATOM 0 HD21 LEU A 121 -16.150 0.841 -2.264 1.00 1.00 H new ATOM 0 HD22 LEU A 121 -16.105 2.585 -1.914 1.00 1.00 H new ATOM 0 HD23 LEU A 121 -15.455 1.969 -3.452 1.00 1.00 H new ATOM 1986 N ASP A 122 -12.638 5.993 -0.031 1.00 1.00 N ATOM 1987 CA ASP A 122 -11.828 7.182 0.108 1.00 1.00 C ATOM 1988 C ASP A 122 -11.522 7.235 1.602 1.00 1.00 C ATOM 1989 O ASP A 122 -11.958 6.366 2.360 1.00 1.00 O ATOM 1990 CB ASP A 122 -12.686 8.342 -0.386 1.00 1.00 C ATOM 1991 CG ASP A 122 -12.137 9.757 -0.300 1.00 1.00 C ATOM 1992 OD1 ASP A 122 -12.245 10.359 0.788 1.00 1.00 O ATOM 1993 OD2 ASP A 122 -11.877 10.358 -1.365 1.00 1.00 O ATOM 0 H ASP A 122 -13.282 5.877 0.752 1.00 1.00 H new ATOM 0 HA ASP A 122 -10.896 7.210 -0.457 1.00 1.00 H new ATOM 0 HB2 ASP A 122 -12.931 8.148 -1.430 1.00 1.00 H new ATOM 0 HB3 ASP A 122 -13.623 8.319 0.171 1.00 1.00 H new ATOM 1998 N GLY A 123 -10.746 8.205 2.029 1.00 1.00 N ATOM 1999 CA GLY A 123 -10.288 8.289 3.405 1.00 1.00 C ATOM 2000 C GLY A 123 -8.877 8.829 3.468 1.00 1.00 C ATOM 2001 O GLY A 123 -8.559 9.792 2.775 1.00 1.00 O ATOM 0 H GLY A 123 -10.411 8.962 1.433 1.00 1.00 H new ATOM 0 HA2 GLY A 123 -10.955 8.934 3.977 1.00 1.00 H new ATOM 0 HA3 GLY A 123 -10.326 7.302 3.867 1.00 1.00 H new ATOM 2005 N MET A 124 -8.027 8.245 4.309 1.00 1.00 N ATOM 2006 CA MET A 124 -6.731 8.811 4.675 1.00 1.00 C ATOM 2007 C MET A 124 -5.621 7.783 4.509 1.00 1.00 C ATOM 2008 O MET A 124 -5.794 6.604 4.805 1.00 1.00 O ATOM 2009 CB MET A 124 -6.850 9.356 6.100 1.00 1.00 C ATOM 2010 CG MET A 124 -5.647 9.236 7.037 1.00 1.00 C ATOM 2011 SD MET A 124 -4.105 10.085 6.627 1.00 1.00 S ATOM 2012 CE MET A 124 -4.788 11.757 6.562 1.00 1.00 C ATOM 0 H MET A 124 -8.222 7.352 4.762 1.00 1.00 H new ATOM 0 HA MET A 124 -6.457 9.631 4.012 1.00 1.00 H new ATOM 0 HB2 MET A 124 -7.109 10.412 6.029 1.00 1.00 H new ATOM 0 HB3 MET A 124 -7.691 8.853 6.577 1.00 1.00 H new ATOM 0 HG2 MET A 124 -5.962 9.589 8.019 1.00 1.00 H new ATOM 0 HG3 MET A 124 -5.418 8.175 7.139 1.00 1.00 H new ATOM 0 HE1 MET A 124 -3.977 12.478 6.460 1.00 1.00 H new ATOM 0 HE2 MET A 124 -5.459 11.843 5.707 1.00 1.00 H new ATOM 0 HE3 MET A 124 -5.341 11.960 7.479 1.00 1.00 H new ATOM 2022 N GLY A 125 -4.461 8.236 4.055 1.00 1.00 N ATOM 2023 CA GLY A 125 -3.267 7.426 3.916 1.00 1.00 C ATOM 2024 C GLY A 125 -2.044 8.283 3.640 1.00 1.00 C ATOM 2025 O GLY A 125 -2.127 9.507 3.582 1.00 1.00 O ATOM 0 H GLY A 125 -4.325 9.205 3.766 1.00 1.00 H new ATOM 0 HA2 GLY A 125 -3.110 6.848 4.827 1.00 1.00 H new ATOM 0 HA3 GLY A 125 -3.403 6.711 3.104 1.00 1.00 H new ATOM 2029 N CYS A 126 -0.890 7.641 3.524 1.00 1.00 N ATOM 2030 CA CYS A 126 0.425 8.253 3.370 1.00 1.00 C ATOM 2031 C CYS A 126 1.487 7.182 3.179 1.00 1.00 C ATOM 2032 O CYS A 126 1.168 5.999 3.033 1.00 1.00 O ATOM 2033 CB CYS A 126 0.741 9.119 4.593 1.00 1.00 C ATOM 2034 SG CYS A 126 0.614 8.223 6.171 1.00 1.00 S ATOM 0 H CYS A 126 -0.842 6.622 3.535 1.00 1.00 H new ATOM 0 HA CYS A 126 0.421 8.888 2.484 1.00 1.00 H new ATOM 0 HB2 CYS A 126 1.749 9.521 4.493 1.00 1.00 H new ATOM 0 HB3 CYS A 126 0.060 9.969 4.612 1.00 1.00 H new ATOM 0 HG CYS A 126 0.899 9.028 7.151 1.00 1.00 H new ATOM 2040 N LEU A 127 2.753 7.595 3.189 1.00 1.00 N ATOM 2041 CA LEU A 127 3.878 6.683 3.205 1.00 1.00 C ATOM 2042 C LEU A 127 4.551 6.685 4.566 1.00 1.00 C ATOM 2043 O LEU A 127 4.408 7.611 5.363 1.00 1.00 O ATOM 2044 CB LEU A 127 4.896 7.075 2.136 1.00 1.00 C ATOM 2045 CG LEU A 127 4.327 7.043 0.714 1.00 1.00 C ATOM 2046 CD1 LEU A 127 5.466 7.446 -0.206 1.00 1.00 C ATOM 2047 CD2 LEU A 127 3.773 5.676 0.294 1.00 1.00 C ATOM 0 H LEU A 127 3.021 8.579 3.186 1.00 1.00 H new ATOM 0 HA LEU A 127 3.502 5.681 2.996 1.00 1.00 H new ATOM 0 HB2 LEU A 127 5.267 8.078 2.348 1.00 1.00 H new ATOM 0 HB3 LEU A 127 5.750 6.400 2.193 1.00 1.00 H new ATOM 0 HG LEU A 127 3.475 7.721 0.660 1.00 1.00 H new ATOM 0 HD11 LEU A 127 5.118 7.441 -1.239 1.00 1.00 H new ATOM 0 HD12 LEU A 127 5.809 8.447 0.057 1.00 1.00 H new ATOM 0 HD13 LEU A 127 6.289 6.740 -0.097 1.00 1.00 H new ATOM 0 HD21 LEU A 127 3.389 5.736 -0.724 1.00 1.00 H new ATOM 0 HD22 LEU A 127 4.568 4.932 0.339 1.00 1.00 H new ATOM 0 HD23 LEU A 127 2.967 5.387 0.969 1.00 1.00 H new ATOM 2059 N GLU A 128 5.327 5.635 4.762 1.00 1.00 N ATOM 2060 CA GLU A 128 6.134 5.242 5.905 1.00 1.00 C ATOM 2061 C GLU A 128 7.366 4.506 5.338 1.00 1.00 C ATOM 2062 O GLU A 128 7.428 4.242 4.135 1.00 1.00 O ATOM 2063 CB GLU A 128 5.244 4.307 6.740 1.00 1.00 C ATOM 2064 CG GLU A 128 5.711 3.913 8.141 1.00 1.00 C ATOM 2065 CD GLU A 128 5.556 5.065 9.130 1.00 1.00 C ATOM 2066 OE1 GLU A 128 6.335 6.038 9.020 1.00 1.00 O ATOM 2067 OE2 GLU A 128 4.640 5.009 9.980 1.00 1.00 O ATOM 0 H GLU A 128 5.418 4.942 4.019 1.00 1.00 H new ATOM 0 HA GLU A 128 6.475 6.070 6.526 1.00 1.00 H new ATOM 0 HB2 GLU A 128 4.267 4.780 6.837 1.00 1.00 H new ATOM 0 HB3 GLU A 128 5.099 3.390 6.169 1.00 1.00 H new ATOM 0 HG2 GLU A 128 5.136 3.055 8.489 1.00 1.00 H new ATOM 0 HG3 GLU A 128 6.755 3.603 8.103 1.00 1.00 H new ATOM 2074 N PHE A 129 8.327 4.130 6.177 1.00 1.00 N ATOM 2075 CA PHE A 129 9.491 3.317 5.819 1.00 1.00 C ATOM 2076 C PHE A 129 9.371 1.934 6.468 1.00 1.00 C ATOM 2077 O PHE A 129 8.695 1.810 7.494 1.00 1.00 O ATOM 2078 CB PHE A 129 10.746 4.043 6.318 1.00 1.00 C ATOM 2079 CG PHE A 129 12.065 3.353 6.023 1.00 1.00 C ATOM 2080 CD1 PHE A 129 12.633 3.430 4.739 1.00 1.00 C ATOM 2081 CD2 PHE A 129 12.737 2.642 7.032 1.00 1.00 C ATOM 2082 CE1 PHE A 129 13.834 2.760 4.445 1.00 1.00 C ATOM 2083 CE2 PHE A 129 13.970 2.032 6.754 1.00 1.00 C ATOM 2084 CZ PHE A 129 14.507 2.059 5.457 1.00 1.00 C ATOM 0 H PHE A 129 8.318 4.392 7.163 1.00 1.00 H new ATOM 0 HA PHE A 129 9.551 3.180 4.739 1.00 1.00 H new ATOM 0 HB2 PHE A 129 10.770 5.038 5.873 1.00 1.00 H new ATOM 0 HB3 PHE A 129 10.661 4.178 7.396 1.00 1.00 H new ATOM 0 HD1 PHE A 129 12.142 4.009 3.971 1.00 1.00 H new ATOM 0 HD2 PHE A 129 12.306 2.565 8.019 1.00 1.00 H new ATOM 0 HE1 PHE A 129 14.237 2.785 3.443 1.00 1.00 H new ATOM 0 HE2 PHE A 129 14.512 1.537 7.546 1.00 1.00 H new ATOM 0 HZ PHE A 129 15.431 1.544 5.240 1.00 1.00 H new ATOM 2094 N ASP A 130 10.075 0.929 5.939 1.00 1.00 N ATOM 2095 CA ASP A 130 10.329 -0.332 6.659 1.00 1.00 C ATOM 2096 C ASP A 130 11.825 -0.680 6.680 1.00 1.00 C ATOM 2097 O ASP A 130 12.428 -0.860 5.619 1.00 1.00 O ATOM 2098 CB ASP A 130 9.557 -1.505 6.068 1.00 1.00 C ATOM 2099 CG ASP A 130 9.505 -2.629 7.106 1.00 1.00 C ATOM 2100 OD1 ASP A 130 10.499 -3.364 7.266 1.00 1.00 O ATOM 2101 OD2 ASP A 130 8.436 -2.849 7.716 1.00 1.00 O ATOM 0 H ASP A 130 10.485 0.961 5.005 1.00 1.00 H new ATOM 0 HA ASP A 130 9.981 -0.165 7.678 1.00 1.00 H new ATOM 0 HB2 ASP A 130 8.548 -1.195 5.795 1.00 1.00 H new ATOM 0 HB3 ASP A 130 10.040 -1.855 5.156 1.00 1.00 H new ATOM 2106 N GLU A 131 12.435 -0.784 7.867 1.00 1.00 N ATOM 2107 CA GLU A 131 13.854 -1.129 8.015 1.00 1.00 C ATOM 2108 C GLU A 131 14.141 -2.549 7.554 1.00 1.00 C ATOM 2109 O GLU A 131 15.173 -2.813 6.931 1.00 1.00 O ATOM 2110 CB GLU A 131 14.292 -1.072 9.494 1.00 1.00 C ATOM 2111 CG GLU A 131 14.339 0.292 10.186 1.00 1.00 C ATOM 2112 CD GLU A 131 14.627 0.101 11.683 1.00 1.00 C ATOM 2113 OE1 GLU A 131 15.738 -0.353 12.049 1.00 1.00 O ATOM 2114 OE2 GLU A 131 13.732 0.372 12.519 1.00 1.00 O ATOM 0 H GLU A 131 11.957 -0.631 8.755 1.00 1.00 H new ATOM 0 HA GLU A 131 14.395 -0.404 7.408 1.00 1.00 H new ATOM 0 HB2 GLU A 131 13.618 -1.711 10.065 1.00 1.00 H new ATOM 0 HB3 GLU A 131 15.286 -1.514 9.563 1.00 1.00 H new ATOM 0 HG2 GLU A 131 15.111 0.914 9.733 1.00 1.00 H new ATOM 0 HG3 GLU A 131 13.391 0.812 10.051 1.00 1.00 H new ATOM 2121 N GLU A 132 13.270 -3.469 7.945 1.00 1.00 N ATOM 2122 CA GLU A 132 13.537 -4.889 7.928 1.00 1.00 C ATOM 2123 C GLU A 132 13.320 -5.427 6.529 1.00 1.00 C ATOM 2124 O GLU A 132 14.080 -6.272 6.062 1.00 1.00 O ATOM 2125 CB GLU A 132 12.602 -5.556 8.937 1.00 1.00 C ATOM 2126 CG GLU A 132 13.061 -6.945 9.334 1.00 1.00 C ATOM 2127 CD GLU A 132 12.292 -7.538 10.518 1.00 1.00 C ATOM 2128 OE1 GLU A 132 11.369 -6.880 11.059 1.00 1.00 O ATOM 2129 OE2 GLU A 132 12.615 -8.681 10.909 1.00 1.00 O ATOM 0 H GLU A 132 12.338 -3.237 8.290 1.00 1.00 H new ATOM 0 HA GLU A 132 14.570 -5.099 8.205 1.00 1.00 H new ATOM 0 HB2 GLU A 132 12.533 -4.933 9.828 1.00 1.00 H new ATOM 0 HB3 GLU A 132 11.600 -5.617 8.512 1.00 1.00 H new ATOM 0 HG2 GLU A 132 12.958 -7.610 8.477 1.00 1.00 H new ATOM 0 HG3 GLU A 132 14.121 -6.909 9.584 1.00 1.00 H new ATOM 2136 N ARG A 133 12.312 -4.913 5.818 1.00 1.00 N ATOM 2137 CA ARG A 133 12.196 -5.210 4.406 1.00 1.00 C ATOM 2138 C ARG A 133 13.411 -4.694 3.657 1.00 1.00 C ATOM 2139 O ARG A 133 13.838 -5.397 2.756 1.00 1.00 O ATOM 2140 CB ARG A 133 10.932 -4.609 3.812 1.00 1.00 C ATOM 2141 CG ARG A 133 10.131 -5.608 2.977 1.00 1.00 C ATOM 2142 CD ARG A 133 9.434 -6.747 3.744 1.00 1.00 C ATOM 2143 NE ARG A 133 8.283 -6.253 4.520 1.00 1.00 N ATOM 2144 CZ ARG A 133 8.372 -5.645 5.715 1.00 1.00 C ATOM 2145 NH1 ARG A 133 9.467 -5.759 6.455 1.00 1.00 N ATOM 2146 NH2 ARG A 133 7.399 -4.865 6.161 1.00 1.00 N ATOM 0 H ARG A 133 11.585 -4.304 6.195 1.00 1.00 H new ATOM 0 HA ARG A 133 12.139 -6.293 4.301 1.00 1.00 H new ATOM 0 HB2 ARG A 133 10.303 -4.230 4.618 1.00 1.00 H new ATOM 0 HB3 ARG A 133 11.200 -3.756 3.189 1.00 1.00 H new ATOM 0 HG2 ARG A 133 9.372 -5.057 2.422 1.00 1.00 H new ATOM 0 HG3 ARG A 133 10.802 -6.053 2.242 1.00 1.00 H new ATOM 0 HD2 ARG A 133 9.099 -7.509 3.040 1.00 1.00 H new ATOM 0 HD3 ARG A 133 10.148 -7.225 4.415 1.00 1.00 H new ATOM 0 HE ARG A 133 7.353 -6.382 4.122 1.00 1.00 H new ATOM 0 HH11 ARG A 133 10.254 -6.313 6.119 1.00 1.00 H new ATOM 0 HH12 ARG A 133 9.522 -5.292 7.360 1.00 1.00 H new ATOM 0 HH21 ARG A 133 6.564 -4.717 5.595 1.00 1.00 H new ATOM 0 HH22 ARG A 133 7.485 -4.412 7.071 1.00 1.00 H new ATOM 2160 N ALA A 134 13.965 -3.526 4.003 1.00 1.00 N ATOM 2161 CA ALA A 134 15.129 -2.994 3.299 1.00 1.00 C ATOM 2162 C ALA A 134 16.285 -3.985 3.395 1.00 1.00 C ATOM 2163 O ALA A 134 16.854 -4.356 2.373 1.00 1.00 O ATOM 2164 CB ALA A 134 15.477 -1.594 3.829 1.00 1.00 C ATOM 0 H ALA A 134 13.625 -2.937 4.763 1.00 1.00 H new ATOM 0 HA ALA A 134 14.906 -2.871 2.239 1.00 1.00 H new ATOM 0 HB1 ALA A 134 16.346 -1.209 3.296 1.00 1.00 H new ATOM 0 HB2 ALA A 134 14.630 -0.925 3.674 1.00 1.00 H new ATOM 0 HB3 ALA A 134 15.701 -1.654 4.894 1.00 1.00 H new ATOM 2170 N GLN A 135 16.566 -4.490 4.597 1.00 1.00 N ATOM 2171 CA GLN A 135 17.541 -5.544 4.824 1.00 1.00 C ATOM 2172 C GLN A 135 17.179 -6.817 4.049 1.00 1.00 C ATOM 2173 O GLN A 135 18.079 -7.485 3.530 1.00 1.00 O ATOM 2174 CB GLN A 135 17.576 -5.828 6.334 1.00 1.00 C ATOM 2175 CG GLN A 135 17.995 -4.599 7.161 1.00 1.00 C ATOM 2176 CD GLN A 135 17.416 -4.592 8.576 1.00 1.00 C ATOM 2177 OE1 GLN A 135 16.907 -5.581 9.094 1.00 1.00 O ATOM 2178 NE2 GLN A 135 17.451 -3.451 9.233 1.00 1.00 N ATOM 0 H GLN A 135 16.111 -4.169 5.452 1.00 1.00 H new ATOM 0 HA GLN A 135 18.520 -5.223 4.468 1.00 1.00 H new ATOM 0 HB2 GLN A 135 16.591 -6.161 6.660 1.00 1.00 H new ATOM 0 HB3 GLN A 135 18.270 -6.646 6.530 1.00 1.00 H new ATOM 0 HG2 GLN A 135 19.083 -4.565 7.222 1.00 1.00 H new ATOM 0 HG3 GLN A 135 17.676 -3.695 6.642 1.00 1.00 H new ATOM 0 HE21 GLN A 135 17.874 -2.628 8.804 1.00 1.00 H new ATOM 0 HE22 GLN A 135 17.055 -3.390 10.171 1.00 1.00 H new ATOM 2187 N GLN A 136 15.891 -7.179 3.969 1.00 1.00 N ATOM 2188 CA GLN A 136 15.477 -8.395 3.275 1.00 1.00 C ATOM 2189 C GLN A 136 15.728 -8.249 1.779 1.00 1.00 C ATOM 2190 O GLN A 136 16.235 -9.177 1.155 1.00 1.00 O ATOM 2191 CB GLN A 136 13.992 -8.699 3.563 1.00 1.00 C ATOM 2192 CG GLN A 136 13.785 -9.983 4.380 1.00 1.00 C ATOM 2193 CD GLN A 136 13.552 -11.238 3.534 1.00 1.00 C ATOM 2194 OE1 GLN A 136 12.704 -12.062 3.885 1.00 1.00 O ATOM 2195 NE2 GLN A 136 14.233 -11.413 2.409 1.00 1.00 N ATOM 0 H GLN A 136 15.124 -6.645 4.377 1.00 1.00 H new ATOM 0 HA GLN A 136 16.067 -9.235 3.642 1.00 1.00 H new ATOM 0 HB2 GLN A 136 13.554 -7.859 4.101 1.00 1.00 H new ATOM 0 HB3 GLN A 136 13.456 -8.787 2.618 1.00 1.00 H new ATOM 0 HG2 GLN A 136 14.659 -10.142 5.012 1.00 1.00 H new ATOM 0 HG3 GLN A 136 12.932 -9.843 5.044 1.00 1.00 H new ATOM 0 HE21 GLN A 136 14.933 -10.728 2.125 1.00 1.00 H new ATOM 0 HE22 GLN A 136 14.057 -12.233 1.828 1.00 1.00 H new ATOM 2204 N GLU A 137 15.367 -7.106 1.211 1.00 1.00 N ATOM 2205 CA GLU A 137 15.450 -6.804 -0.201 1.00 1.00 C ATOM 2206 C GLU A 137 16.911 -6.646 -0.622 1.00 1.00 C ATOM 2207 O GLU A 137 17.287 -7.048 -1.721 1.00 1.00 O ATOM 2208 CB GLU A 137 14.653 -5.513 -0.457 1.00 1.00 C ATOM 2209 CG GLU A 137 14.178 -5.437 -1.910 1.00 1.00 C ATOM 2210 CD GLU A 137 13.193 -6.542 -2.324 1.00 1.00 C ATOM 2211 OE1 GLU A 137 12.604 -7.206 -1.444 1.00 1.00 O ATOM 2212 OE2 GLU A 137 12.979 -6.736 -3.543 1.00 1.00 O ATOM 0 H GLU A 137 14.990 -6.330 1.755 1.00 1.00 H new ATOM 0 HA GLU A 137 15.029 -7.617 -0.793 1.00 1.00 H new ATOM 0 HB2 GLU A 137 13.794 -5.474 0.212 1.00 1.00 H new ATOM 0 HB3 GLU A 137 15.274 -4.647 -0.229 1.00 1.00 H new ATOM 0 HG2 GLU A 137 13.705 -4.468 -2.073 1.00 1.00 H new ATOM 0 HG3 GLU A 137 15.048 -5.481 -2.565 1.00 1.00 H new ATOM 2219 N ASP A 138 17.757 -6.124 0.272 1.00 1.00 N ATOM 2220 CA ASP A 138 19.197 -6.006 0.061 1.00 1.00 C ATOM 2221 C ASP A 138 19.802 -7.379 -0.143 1.00 1.00 C ATOM 2222 O ASP A 138 20.718 -7.525 -0.946 1.00 1.00 O ATOM 2223 CB ASP A 138 19.882 -5.330 1.257 1.00 1.00 C ATOM 2224 CG ASP A 138 20.296 -3.887 0.954 1.00 1.00 C ATOM 2225 OD1 ASP A 138 20.989 -3.650 -0.066 1.00 1.00 O ATOM 2226 OD2 ASP A 138 19.994 -2.990 1.771 1.00 1.00 O ATOM 0 H ASP A 138 17.451 -5.766 1.177 1.00 1.00 H new ATOM 0 HA ASP A 138 19.355 -5.391 -0.825 1.00 1.00 H new ATOM 0 HB2 ASP A 138 19.206 -5.339 2.112 1.00 1.00 H new ATOM 0 HB3 ASP A 138 20.763 -5.906 1.541 1.00 1.00 H new ATOM 2231 N ALA A 139 19.307 -8.383 0.587 1.00 1.00 N ATOM 2232 CA ALA A 139 19.616 -9.784 0.320 1.00 1.00 C ATOM 2233 C ALA A 139 18.978 -10.275 -0.987 1.00 1.00 C ATOM 2234 O ALA A 139 19.642 -10.962 -1.766 1.00 1.00 O ATOM 2235 CB ALA A 139 19.222 -10.663 1.512 1.00 1.00 C ATOM 0 H ALA A 139 18.680 -8.243 1.380 1.00 1.00 H new ATOM 0 HA ALA A 139 20.695 -9.865 0.187 1.00 1.00 H new ATOM 0 HB1 ALA A 139 19.461 -11.703 1.292 1.00 1.00 H new ATOM 0 HB2 ALA A 139 19.772 -10.344 2.397 1.00 1.00 H new ATOM 0 HB3 ALA A 139 18.152 -10.568 1.696 1.00 1.00 H new ATOM 2241 N LEU A 140 17.707 -9.959 -1.256 1.00 1.00 N ATOM 2242 CA LEU A 140 17.018 -10.402 -2.470 1.00 1.00 C ATOM 2243 C LEU A 140 17.670 -9.869 -3.753 1.00 1.00 C ATOM 2244 O LEU A 140 17.495 -10.463 -4.822 1.00 1.00 O ATOM 2245 CB LEU A 140 15.516 -10.051 -2.441 1.00 1.00 C ATOM 2246 CG LEU A 140 14.655 -10.785 -1.386 1.00 1.00 C ATOM 2247 CD1 LEU A 140 13.178 -10.761 -1.795 1.00 1.00 C ATOM 2248 CD2 LEU A 140 15.077 -12.242 -1.149 1.00 1.00 C ATOM 0 H LEU A 140 17.128 -9.390 -0.638 1.00 1.00 H new ATOM 0 HA LEU A 140 17.115 -11.488 -2.485 1.00 1.00 H new ATOM 0 HB2 LEU A 140 15.420 -8.978 -2.273 1.00 1.00 H new ATOM 0 HB3 LEU A 140 15.098 -10.258 -3.426 1.00 1.00 H new ATOM 0 HG LEU A 140 14.810 -10.245 -0.452 1.00 1.00 H new ATOM 0 HD11 LEU A 140 12.584 -11.281 -1.044 1.00 1.00 H new ATOM 0 HD12 LEU A 140 12.839 -9.728 -1.874 1.00 1.00 H new ATOM 0 HD13 LEU A 140 13.059 -11.257 -2.758 1.00 1.00 H new ATOM 0 HD21 LEU A 140 14.428 -12.691 -0.397 1.00 1.00 H new ATOM 0 HD22 LEU A 140 14.994 -12.801 -2.081 1.00 1.00 H new ATOM 0 HD23 LEU A 140 16.109 -12.270 -0.800 1.00 1.00 H new ATOM 2260 N ALA A 141 18.466 -8.804 -3.677 1.00 1.00 N ATOM 2261 CA ALA A 141 19.240 -8.231 -4.771 1.00 1.00 C ATOM 2262 C ALA A 141 20.488 -9.061 -5.157 1.00 1.00 C ATOM 2263 O ALA A 141 21.456 -8.498 -5.675 1.00 1.00 O ATOM 2264 CB ALA A 141 19.602 -6.793 -4.388 1.00 1.00 C ATOM 0 H ALA A 141 18.593 -8.292 -2.804 1.00 1.00 H new ATOM 0 HA ALA A 141 18.626 -8.242 -5.672 1.00 1.00 H new ATOM 0 HB1 ALA A 141 20.183 -6.338 -5.190 1.00 1.00 H new ATOM 0 HB2 ALA A 141 18.690 -6.218 -4.230 1.00 1.00 H new ATOM 0 HB3 ALA A 141 20.191 -6.798 -3.471 1.00 1.00 H new ATOM 2270 N GLN A 142 20.466 -10.386 -4.972 1.00 1.00 N ATOM 2271 CA GLN A 142 21.600 -11.303 -4.939 1.00 1.00 C ATOM 2272 C GLN A 142 22.681 -10.780 -3.990 1.00 1.00 C ATOM 2273 O GLN A 142 23.756 -10.343 -4.411 1.00 1.00 O ATOM 2274 CB GLN A 142 22.125 -11.582 -6.353 1.00 1.00 C ATOM 2275 CG GLN A 142 21.229 -12.451 -7.244 1.00 1.00 C ATOM 2276 CD GLN A 142 20.110 -11.647 -7.900 1.00 1.00 C ATOM 2277 OE1 GLN A 142 20.351 -10.727 -8.685 1.00 1.00 O ATOM 2278 NE2 GLN A 142 18.867 -11.961 -7.592 1.00 1.00 N ATOM 0 H GLN A 142 19.584 -10.878 -4.831 1.00 1.00 H new ATOM 0 HA GLN A 142 21.270 -12.264 -4.544 1.00 1.00 H new ATOM 0 HB2 GLN A 142 22.286 -10.628 -6.854 1.00 1.00 H new ATOM 0 HB3 GLN A 142 23.098 -12.066 -6.269 1.00 1.00 H new ATOM 0 HG2 GLN A 142 21.836 -12.922 -8.017 1.00 1.00 H new ATOM 0 HG3 GLN A 142 20.795 -13.253 -6.647 1.00 1.00 H new ATOM 0 HE21 GLN A 142 18.680 -12.724 -6.941 1.00 1.00 H new ATOM 0 HE22 GLN A 142 18.092 -11.441 -8.004 1.00 1.00 H new ATOM 2287 N GLN A 143 22.389 -10.827 -2.690 1.00 1.00 N ATOM 2288 CA GLN A 143 23.346 -10.647 -1.615 1.00 1.00 C ATOM 2289 C GLN A 143 22.901 -11.562 -0.473 1.00 1.00 C ATOM 2290 O GLN A 143 22.417 -12.679 -0.767 1.00 1.00 O ATOM 2291 CB GLN A 143 23.377 -9.154 -1.267 1.00 1.00 C ATOM 2292 CG GLN A 143 24.656 -8.671 -0.573 1.00 1.00 C ATOM 2293 CD GLN A 143 24.674 -7.155 -0.334 1.00 1.00 C ATOM 2294 OE1 GLN A 143 25.737 -6.536 -0.297 1.00 1.00 O ATOM 2295 NE2 GLN A 143 23.532 -6.505 -0.158 1.00 1.00 N ATOM 0 H GLN A 143 21.442 -10.998 -2.352 1.00 1.00 H new ATOM 0 HA GLN A 143 24.369 -10.923 -1.871 1.00 1.00 H new ATOM 0 HB2 GLN A 143 23.242 -8.581 -2.184 1.00 1.00 H new ATOM 0 HB3 GLN A 143 22.527 -8.930 -0.623 1.00 1.00 H new ATOM 0 HG2 GLN A 143 24.760 -9.185 0.383 1.00 1.00 H new ATOM 0 HG3 GLN A 143 25.518 -8.948 -1.180 1.00 1.00 H new ATOM 0 HE21 GLN A 143 22.647 -7.011 -0.187 1.00 1.00 H new ATOM 0 HE22 GLN A 143 23.538 -5.498 0.007 1.00 1.00 H new