USER MOD reduce.3.24.130724 H: found=0, std=0, add=1226, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1220 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: B 81 ASN : amide:sc= 0.889 K(o=2.6,f=-0.9) USER MOD Set 1.2: B 83 SER OG : rot 180:sc= 0.496 USER MOD Set 1.3: B 84 THR OG1 : rot 65:sc= 1.19 USER MOD Set 2.1: B 66 GLN : amide:sc= 0.471 K(o=-5.9,f=-5.1) USER MOD Set 2.2: B 76 ASN : amide:sc= -6.34! C(o=-5.9!,f=-5.1!) USER MOD Set 3.1: B 62 LYS NZ :NH3+ 157:sc= 1.94 (180deg=2.01) USER MOD Set 3.2: B 78 HIS : no HE2:sc= -1.15 X(o=0.79,f=1.3) USER MOD Set 4.1: B 56 SER OG : rot 142:sc= 0.807! USER MOD Set 4.2: B 64 GLN : amide:sc= -0.626 K(o=0.18,f=-3.5!) USER MOD Set 5.1: B 45 HIS : no HE2:sc= -1.19! C(o=0.0049!,f=-3.1!) USER MOD Set 5.2: B 75 THR OG1 : rot -141:sc= 1.19 USER MOD Set 6.1: B 1 MET CE :methyl 161:sc= -0.0963 (180deg=-0.538) USER MOD Set 6.2: B 3 THR OG1 : rot 180:sc= -0.19 USER MOD Set 7.1: A 414 LYS NZ :NH3+ 146:sc= 2.16 (180deg=-0.345) USER MOD Set 7.2: B 97 GLN : amide:sc= -7.58! C(o=-5.4!,f=-16!) USER MOD Single : A 393 THR OG1 : rot 180:sc= 0.127 USER MOD Single : A 417 TYR OH : rot -53:sc= 1.22 USER MOD Single : A 420 HIS : no HD1:sc= -0.399 X(o=-0.4,f=-0.058) USER MOD Single : A 424 HIS : no HE2:sc= 0.462 K(o=0.46,f=-7.7!) USER MOD Single : A 429 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 MET N :NH3+ 168:sc= 0.746 (180deg=-0.111!) USER MOD Single : B 4 SER OG : rot 180:sc= -0.148 USER MOD Single : B 5 SER OG : rot -68:sc= 0.00963 USER MOD Single : B 13 LYS NZ :NH3+ -115:sc= 2.29 (180deg=-1.26) USER MOD Single : B 14 LYS NZ :NH3+ -124:sc= 2.17 (180deg=-2.25!) USER MOD Single : B 17 GLN : amide:sc=-0.00591 K(o=-0.0059,f=-0.96) USER MOD Single : B 18 LYS NZ :NH3+ -152:sc= 3.58 (180deg=1.18) USER MOD Single : B 19 LYS NZ :NH3+ -174:sc= -0.252 (180deg=-0.392) USER MOD Single : B 20 GLN : amide:sc= 0.46 X(o=0.46,f=0) USER MOD Single : B 25 TYR OH : rot 180:sc= 0 USER MOD Single : B 27 MET CE :methyl -162:sc= -0.998 (180deg=-1.17) USER MOD Single : B 38 LYS NZ :NH3+ 143:sc= 1.7 (180deg=-1.99!) USER MOD Single : B 42 THR OG1 : rot 123:sc= -0.876 USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 46 MET CE :methyl -160:sc= -0.126 (180deg=-0.706) USER MOD Single : B 47 TYR OH : rot 148:sc= 0.945 USER MOD Single : B 51 LYS NZ :NH3+ -171:sc= 1.72 (180deg=1.54) USER MOD Single : B 52 CYS SG : rot 100:sc= 1.24 USER MOD Single : B 53 GLN : amide:sc= -3.26! C(o=-3.3!,f=-9.5!) USER MOD Single : B 54 LYS NZ :NH3+ 161:sc= 0.179 (180deg=-2.38!) USER MOD Single : B 60 LYS NZ :NH3+ -178:sc= -0.475! (180deg=-0.57!) USER MOD Single : B 70 HIS : no HD1:sc= -0.848 K(o=-0.85,f=-2.6) USER MOD Single : B 74 THR OG1 : rot 180:sc= 0 USER MOD Single : B 80 SER OG : rot 50:sc= 0.933 USER MOD Single : B 87 LYS NZ :NH3+ 152:sc= 2.69 (180deg=0.49) USER MOD Single : B 93 LYS NZ :NH3+ -153:sc= 2.31 (180deg=1.83) USER MOD Single : B 98 GLN : amide:sc= -8.96! C(o=-9!,f=-9.9!) USER MOD Single : B 102 LYS NZ :NH3+ -134:sc= 2.92 (180deg=-2.02) USER MOD Single : B 104 LYS NZ :NH3+ 159:sc= -0.297! (180deg=-1.72!) USER MOD Single : B 106 LYS NZ :NH3+ -167:sc= 2.28 (180deg=1.95) USER MOD Single : B 108 ASN : amide:sc= -0.119 X(o=-0.12,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 390 13.982 17.172 -2.343 1.00 0.00 N ATOM 2 CA ARG A 390 13.061 18.141 -2.971 1.00 0.00 C ATOM 3 C ARG A 390 12.551 17.601 -4.298 1.00 0.00 C ATOM 4 O ARG A 390 12.720 16.424 -4.598 1.00 0.00 O ATOM 5 CB ARG A 390 13.779 19.474 -3.190 1.00 0.00 C ATOM 6 CG ARG A 390 13.580 20.469 -2.059 1.00 0.00 C ATOM 7 CD ARG A 390 12.112 20.816 -1.877 1.00 0.00 C ATOM 8 NE ARG A 390 11.526 21.351 -3.106 1.00 0.00 N ATOM 9 CZ ARG A 390 10.219 21.401 -3.353 1.00 0.00 C ATOM 10 NH1 ARG A 390 9.351 20.923 -2.471 1.00 0.00 N ATOM 11 NH2 ARG A 390 9.782 21.927 -4.489 1.00 0.00 N ATOM 0 HA ARG A 390 12.210 18.298 -2.308 1.00 0.00 H new ATOM 0 HB2 ARG A 390 14.846 19.286 -3.313 1.00 0.00 H new ATOM 0 HB3 ARG A 390 13.425 19.919 -4.120 1.00 0.00 H new ATOM 0 HG2 ARG A 390 13.974 20.052 -1.132 1.00 0.00 H new ATOM 0 HG3 ARG A 390 14.147 21.377 -2.267 1.00 0.00 H new ATOM 0 HD2 ARG A 390 11.563 19.926 -1.570 1.00 0.00 H new ATOM 0 HD3 ARG A 390 12.008 21.547 -1.076 1.00 0.00 H new ATOM 0 HE ARG A 390 12.160 21.709 -3.820 1.00 0.00 H new ATOM 0 HH11 ARG A 390 9.684 20.514 -1.598 1.00 0.00 H new ATOM 0 HH12 ARG A 390 8.351 20.964 -2.666 1.00 0.00 H new ATOM 0 HH21 ARG A 390 10.447 22.292 -5.171 1.00 0.00 H new ATOM 0 HH22 ARG A 390 8.781 21.967 -4.681 1.00 0.00 H new ATOM 25 N ARG A 391 11.921 18.464 -5.091 1.00 0.00 N ATOM 26 CA ARG A 391 11.400 18.061 -6.390 1.00 0.00 C ATOM 27 C ARG A 391 12.503 18.125 -7.431 1.00 0.00 C ATOM 28 O ARG A 391 12.519 17.360 -8.391 1.00 0.00 O ATOM 29 CB ARG A 391 10.243 18.964 -6.821 1.00 0.00 C ATOM 30 CG ARG A 391 8.940 18.689 -6.094 1.00 0.00 C ATOM 31 CD ARG A 391 7.770 19.367 -6.790 1.00 0.00 C ATOM 32 NE ARG A 391 6.519 19.174 -6.066 1.00 0.00 N ATOM 33 CZ ARG A 391 5.331 18.997 -6.639 1.00 0.00 C ATOM 34 NH1 ARG A 391 5.207 19.009 -7.963 1.00 0.00 N ATOM 35 NH2 ARG A 391 4.268 18.812 -5.874 1.00 0.00 N ATOM 0 H ARG A 391 11.760 19.443 -4.856 1.00 0.00 H new ATOM 0 HA ARG A 391 11.031 17.039 -6.305 1.00 0.00 H new ATOM 0 HB2 ARG A 391 10.526 20.004 -6.656 1.00 0.00 H new ATOM 0 HB3 ARG A 391 10.082 18.844 -7.892 1.00 0.00 H new ATOM 0 HG2 ARG A 391 8.766 17.614 -6.048 1.00 0.00 H new ATOM 0 HG3 ARG A 391 9.011 19.045 -5.066 1.00 0.00 H new ATOM 0 HD2 ARG A 391 7.973 20.434 -6.885 1.00 0.00 H new ATOM 0 HD3 ARG A 391 7.669 18.970 -7.800 1.00 0.00 H new ATOM 0 HE ARG A 391 6.557 19.175 -5.047 1.00 0.00 H new ATOM 0 HH11 ARG A 391 6.028 19.155 -8.551 1.00 0.00 H new ATOM 0 HH12 ARG A 391 4.291 18.872 -8.391 1.00 0.00 H new ATOM 0 HH21 ARG A 391 4.365 18.806 -4.859 1.00 0.00 H new ATOM 0 HH22 ARG A 391 3.351 18.675 -6.299 1.00 0.00 H new ATOM 49 N ARG A 392 13.409 19.070 -7.238 1.00 0.00 N ATOM 50 CA ARG A 392 14.533 19.262 -8.138 1.00 0.00 C ATOM 51 C ARG A 392 15.800 19.478 -7.323 1.00 0.00 C ATOM 52 O ARG A 392 15.838 19.173 -6.130 1.00 0.00 O ATOM 53 CB ARG A 392 14.282 20.468 -9.054 1.00 0.00 C ATOM 54 CG ARG A 392 13.059 20.318 -9.949 1.00 0.00 C ATOM 55 CD ARG A 392 12.536 21.669 -10.414 1.00 0.00 C ATOM 56 NE ARG A 392 12.109 22.511 -9.294 1.00 0.00 N ATOM 57 CZ ARG A 392 11.638 23.752 -9.424 1.00 0.00 C ATOM 58 NH1 ARG A 392 11.515 24.301 -10.629 1.00 0.00 N ATOM 59 NH2 ARG A 392 11.293 24.440 -8.344 1.00 0.00 N ATOM 0 H ARG A 392 13.386 19.723 -6.455 1.00 0.00 H new ATOM 0 HA ARG A 392 14.650 18.375 -8.761 1.00 0.00 H new ATOM 0 HB2 ARG A 392 14.163 21.360 -8.439 1.00 0.00 H new ATOM 0 HB3 ARG A 392 15.161 20.626 -9.679 1.00 0.00 H new ATOM 0 HG2 ARG A 392 13.314 19.708 -10.816 1.00 0.00 H new ATOM 0 HG3 ARG A 392 12.274 19.790 -9.408 1.00 0.00 H new ATOM 0 HD2 ARG A 392 13.314 22.184 -10.978 1.00 0.00 H new ATOM 0 HD3 ARG A 392 11.697 21.518 -11.094 1.00 0.00 H new ATOM 0 HE ARG A 392 12.176 22.123 -8.353 1.00 0.00 H new ATOM 0 HH11 ARG A 392 11.781 23.773 -11.460 1.00 0.00 H new ATOM 0 HH12 ARG A 392 11.154 25.250 -10.722 1.00 0.00 H new ATOM 0 HH21 ARG A 392 11.388 24.020 -7.420 1.00 0.00 H new ATOM 0 HH22 ARG A 392 10.932 25.389 -8.438 1.00 0.00 H new ATOM 73 N THR A 393 16.824 20.035 -7.950 1.00 0.00 N ATOM 74 CA THR A 393 18.087 20.303 -7.280 1.00 0.00 C ATOM 75 C THR A 393 17.997 21.555 -6.404 1.00 0.00 C ATOM 76 O THR A 393 19.016 22.134 -6.030 1.00 0.00 O ATOM 77 CB THR A 393 19.207 20.480 -8.317 1.00 0.00 C ATOM 78 OG1 THR A 393 18.634 20.534 -9.633 1.00 0.00 O ATOM 79 CG2 THR A 393 20.204 19.334 -8.237 1.00 0.00 C ATOM 0 H THR A 393 16.804 20.313 -8.931 1.00 0.00 H new ATOM 0 HA THR A 393 18.313 19.451 -6.639 1.00 0.00 H new ATOM 0 HB THR A 393 19.735 21.410 -8.106 1.00 0.00 H new ATOM 0 HG1 THR A 393 19.347 20.649 -10.296 1.00 0.00 H new ATOM 0 HG21 THR A 393 20.988 19.481 -8.980 1.00 0.00 H new ATOM 0 HG22 THR A 393 20.648 19.307 -7.242 1.00 0.00 H new ATOM 0 HG23 THR A 393 19.692 18.392 -8.431 1.00 0.00 H new ATOM 87 N GLU A 394 16.766 21.940 -6.066 1.00 0.00 N ATOM 88 CA GLU A 394 16.497 23.116 -5.242 1.00 0.00 C ATOM 89 C GLU A 394 17.258 23.042 -3.922 1.00 0.00 C ATOM 90 O GLU A 394 17.846 24.023 -3.475 1.00 0.00 O ATOM 91 CB GLU A 394 14.992 23.222 -4.973 1.00 0.00 C ATOM 92 CG GLU A 394 14.138 23.097 -6.227 1.00 0.00 C ATOM 93 CD GLU A 394 12.829 22.375 -5.975 1.00 0.00 C ATOM 94 OE1 GLU A 394 11.756 22.971 -6.202 1.00 0.00 O ATOM 95 OE2 GLU A 394 12.864 21.203 -5.559 1.00 0.00 O ATOM 0 H GLU A 394 15.925 21.442 -6.358 1.00 0.00 H new ATOM 0 HA GLU A 394 16.835 24.002 -5.780 1.00 0.00 H new ATOM 0 HB2 GLU A 394 14.702 22.444 -4.267 1.00 0.00 H new ATOM 0 HB3 GLU A 394 14.783 24.179 -4.495 1.00 0.00 H new ATOM 0 HG2 GLU A 394 13.929 24.092 -6.620 1.00 0.00 H new ATOM 0 HG3 GLU A 394 14.701 22.563 -6.993 1.00 0.00 H new ATOM 102 N ALA A 395 17.242 21.870 -3.307 1.00 0.00 N ATOM 103 CA ALA A 395 17.935 21.658 -2.047 1.00 0.00 C ATOM 104 C ALA A 395 18.971 20.554 -2.200 1.00 0.00 C ATOM 105 O ALA A 395 18.999 19.603 -1.417 1.00 0.00 O ATOM 106 CB ALA A 395 16.943 21.317 -0.945 1.00 0.00 C ATOM 0 H ALA A 395 16.754 21.048 -3.662 1.00 0.00 H new ATOM 0 HA ALA A 395 18.448 22.579 -1.769 1.00 0.00 H new ATOM 0 HB1 ALA A 395 17.479 21.161 -0.009 1.00 0.00 H new ATOM 0 HB2 ALA A 395 16.235 22.137 -0.826 1.00 0.00 H new ATOM 0 HB3 ALA A 395 16.403 20.408 -1.210 1.00 0.00 H new ATOM 112 N LEU A 396 19.810 20.688 -3.232 1.00 0.00 N ATOM 113 CA LEU A 396 20.859 19.711 -3.524 1.00 0.00 C ATOM 114 C LEU A 396 20.249 18.320 -3.685 1.00 0.00 C ATOM 115 O LEU A 396 20.755 17.330 -3.160 1.00 0.00 O ATOM 116 CB LEU A 396 21.924 19.711 -2.418 1.00 0.00 C ATOM 117 CG LEU A 396 23.244 19.022 -2.777 1.00 0.00 C ATOM 118 CD1 LEU A 396 23.969 19.786 -3.874 1.00 0.00 C ATOM 119 CD2 LEU A 396 24.126 18.888 -1.546 1.00 0.00 C ATOM 0 H LEU A 396 19.780 21.472 -3.884 1.00 0.00 H new ATOM 0 HA LEU A 396 21.344 19.990 -4.459 1.00 0.00 H new ATOM 0 HB2 LEU A 396 22.136 20.744 -2.142 1.00 0.00 H new ATOM 0 HB3 LEU A 396 21.508 19.224 -1.536 1.00 0.00 H new ATOM 0 HG LEU A 396 23.018 18.023 -3.150 1.00 0.00 H new ATOM 0 HD11 LEU A 396 24.904 19.279 -4.113 1.00 0.00 H new ATOM 0 HD12 LEU A 396 23.341 19.828 -4.764 1.00 0.00 H new ATOM 0 HD13 LEU A 396 24.183 20.799 -3.532 1.00 0.00 H new ATOM 0 HD21 LEU A 396 25.060 18.396 -1.819 1.00 0.00 H new ATOM 0 HD22 LEU A 396 24.341 19.878 -1.143 1.00 0.00 H new ATOM 0 HD23 LEU A 396 23.610 18.294 -0.792 1.00 0.00 H new ATOM 131 N GLY A 397 19.149 18.261 -4.421 1.00 0.00 N ATOM 132 CA GLY A 397 18.464 17.006 -4.627 1.00 0.00 C ATOM 133 C GLY A 397 17.456 16.757 -3.531 1.00 0.00 C ATOM 134 O GLY A 397 16.262 16.989 -3.715 1.00 0.00 O ATOM 0 H GLY A 397 18.719 19.064 -4.880 1.00 0.00 H new ATOM 0 HA2 GLY A 397 17.961 17.016 -5.594 1.00 0.00 H new ATOM 0 HA3 GLY A 397 19.188 16.192 -4.653 1.00 0.00 H new ATOM 138 N ASP A 398 17.943 16.319 -2.379 1.00 0.00 N ATOM 139 CA ASP A 398 17.087 16.050 -1.230 1.00 0.00 C ATOM 140 C ASP A 398 17.910 16.065 0.052 1.00 0.00 C ATOM 141 O ASP A 398 18.134 15.033 0.680 1.00 0.00 O ATOM 142 CB ASP A 398 16.366 14.704 -1.380 1.00 0.00 C ATOM 143 CG ASP A 398 15.149 14.603 -0.481 1.00 0.00 C ATOM 144 OD1 ASP A 398 14.044 14.995 -0.919 1.00 0.00 O ATOM 145 OD2 ASP A 398 15.287 14.138 0.668 1.00 0.00 O ATOM 0 H ASP A 398 18.934 16.141 -2.214 1.00 0.00 H new ATOM 0 HA ASP A 398 16.332 16.834 -1.179 1.00 0.00 H new ATOM 0 HB2 ASP A 398 16.061 14.571 -2.418 1.00 0.00 H new ATOM 0 HB3 ASP A 398 17.058 13.895 -1.145 1.00 0.00 H new ATOM 150 N ALA A 399 18.383 17.244 0.423 1.00 0.00 N ATOM 151 CA ALA A 399 19.184 17.403 1.628 1.00 0.00 C ATOM 152 C ALA A 399 18.414 18.197 2.673 1.00 0.00 C ATOM 153 O ALA A 399 18.995 18.898 3.501 1.00 0.00 O ATOM 154 CB ALA A 399 20.504 18.085 1.300 1.00 0.00 C ATOM 0 H ALA A 399 18.226 18.109 -0.095 1.00 0.00 H new ATOM 0 HA ALA A 399 19.400 16.416 2.037 1.00 0.00 H new ATOM 0 HB1 ALA A 399 21.092 18.197 2.211 1.00 0.00 H new ATOM 0 HB2 ALA A 399 21.058 17.480 0.583 1.00 0.00 H new ATOM 0 HB3 ALA A 399 20.309 19.068 0.871 1.00 0.00 H new ATOM 160 N GLU A 400 17.097 18.075 2.621 1.00 0.00 N ATOM 161 CA GLU A 400 16.214 18.776 3.544 1.00 0.00 C ATOM 162 C GLU A 400 16.043 18.008 4.858 1.00 0.00 C ATOM 163 O GLU A 400 16.982 17.382 5.351 1.00 0.00 O ATOM 164 CB GLU A 400 14.858 19.006 2.874 1.00 0.00 C ATOM 165 CG GLU A 400 14.377 17.808 2.075 1.00 0.00 C ATOM 166 CD GLU A 400 14.129 18.136 0.619 1.00 0.00 C ATOM 167 OE1 GLU A 400 12.953 18.271 0.225 1.00 0.00 O ATOM 168 OE2 GLU A 400 15.109 18.243 -0.148 1.00 0.00 O ATOM 0 H GLU A 400 16.610 17.490 1.942 1.00 0.00 H new ATOM 0 HA GLU A 400 16.666 19.737 3.790 1.00 0.00 H new ATOM 0 HB2 GLU A 400 14.118 19.246 3.638 1.00 0.00 H new ATOM 0 HB3 GLU A 400 14.928 19.871 2.214 1.00 0.00 H new ATOM 0 HG2 GLU A 400 15.118 17.011 2.142 1.00 0.00 H new ATOM 0 HG3 GLU A 400 13.457 17.427 2.519 1.00 0.00 H new ATOM 175 N GLU A 401 14.840 18.055 5.418 1.00 0.00 N ATOM 176 CA GLU A 401 14.552 17.380 6.677 1.00 0.00 C ATOM 177 C GLU A 401 14.409 15.875 6.473 1.00 0.00 C ATOM 178 O GLU A 401 13.967 15.420 5.419 1.00 0.00 O ATOM 179 CB GLU A 401 13.281 17.955 7.322 1.00 0.00 C ATOM 180 CG GLU A 401 12.281 18.548 6.333 1.00 0.00 C ATOM 181 CD GLU A 401 11.643 17.508 5.435 1.00 0.00 C ATOM 182 OE1 GLU A 401 10.783 16.745 5.917 1.00 0.00 O ATOM 183 OE2 GLU A 401 12.008 17.445 4.244 1.00 0.00 O ATOM 0 H GLU A 401 14.046 18.555 5.018 1.00 0.00 H new ATOM 0 HA GLU A 401 15.393 17.554 7.349 1.00 0.00 H new ATOM 0 HB2 GLU A 401 12.787 17.165 7.889 1.00 0.00 H new ATOM 0 HB3 GLU A 401 13.569 18.727 8.035 1.00 0.00 H new ATOM 0 HG2 GLU A 401 11.500 19.071 6.885 1.00 0.00 H new ATOM 0 HG3 GLU A 401 12.787 19.291 5.716 1.00 0.00 H new ATOM 190 N ASP A 402 14.806 15.107 7.476 1.00 0.00 N ATOM 191 CA ASP A 402 14.712 13.656 7.402 1.00 0.00 C ATOM 192 C ASP A 402 13.301 13.203 7.757 1.00 0.00 C ATOM 193 O ASP A 402 12.536 13.946 8.372 1.00 0.00 O ATOM 194 CB ASP A 402 15.738 12.994 8.335 1.00 0.00 C ATOM 195 CG ASP A 402 15.714 11.475 8.256 1.00 0.00 C ATOM 196 OD1 ASP A 402 15.456 10.935 7.157 1.00 0.00 O ATOM 197 OD2 ASP A 402 15.937 10.817 9.293 1.00 0.00 O ATOM 0 H ASP A 402 15.196 15.463 8.349 1.00 0.00 H new ATOM 0 HA ASP A 402 14.934 13.348 6.380 1.00 0.00 H new ATOM 0 HB2 ASP A 402 16.736 13.351 8.081 1.00 0.00 H new ATOM 0 HB3 ASP A 402 15.541 13.303 9.362 1.00 0.00 H new ATOM 202 N GLU A 403 12.965 11.992 7.355 1.00 0.00 N ATOM 203 CA GLU A 403 11.655 11.426 7.617 1.00 0.00 C ATOM 204 C GLU A 403 11.557 10.989 9.073 1.00 0.00 C ATOM 205 O GLU A 403 12.290 10.100 9.501 1.00 0.00 O ATOM 206 CB GLU A 403 11.415 10.227 6.696 1.00 0.00 C ATOM 207 CG GLU A 403 10.789 10.581 5.356 1.00 0.00 C ATOM 208 CD GLU A 403 11.520 11.686 4.620 1.00 0.00 C ATOM 209 OE1 GLU A 403 12.434 11.384 3.827 1.00 0.00 O ATOM 210 OE2 GLU A 403 11.165 12.869 4.815 1.00 0.00 O ATOM 0 H GLU A 403 13.591 11.374 6.839 1.00 0.00 H new ATOM 0 HA GLU A 403 10.895 12.184 7.424 1.00 0.00 H new ATOM 0 HB2 GLU A 403 12.366 9.725 6.518 1.00 0.00 H new ATOM 0 HB3 GLU A 403 10.769 9.514 7.208 1.00 0.00 H new ATOM 0 HG2 GLU A 403 10.766 9.690 4.728 1.00 0.00 H new ATOM 0 HG3 GLU A 403 9.754 10.885 5.516 1.00 0.00 H new ATOM 217 N ASP A 404 10.670 11.613 9.834 1.00 0.00 N ATOM 218 CA ASP A 404 10.503 11.259 11.232 1.00 0.00 C ATOM 219 C ASP A 404 9.729 9.960 11.344 1.00 0.00 C ATOM 220 O ASP A 404 8.537 9.897 11.055 1.00 0.00 O ATOM 221 CB ASP A 404 9.838 12.386 12.050 1.00 0.00 C ATOM 222 CG ASP A 404 8.613 13.023 11.403 1.00 0.00 C ATOM 223 OD1 ASP A 404 8.001 13.906 12.047 1.00 0.00 O ATOM 224 OD2 ASP A 404 8.263 12.666 10.261 1.00 0.00 O ATOM 0 H ASP A 404 10.059 12.362 9.508 1.00 0.00 H new ATOM 0 HA ASP A 404 11.494 11.118 11.663 1.00 0.00 H new ATOM 0 HB2 ASP A 404 9.549 11.986 13.022 1.00 0.00 H new ATOM 0 HB3 ASP A 404 10.578 13.165 12.234 1.00 0.00 H new ATOM 229 N ASP A 405 10.436 8.918 11.757 1.00 0.00 N ATOM 230 CA ASP A 405 9.860 7.585 11.906 1.00 0.00 C ATOM 231 C ASP A 405 9.009 7.485 13.169 1.00 0.00 C ATOM 232 O ASP A 405 8.831 6.404 13.725 1.00 0.00 O ATOM 233 CB ASP A 405 10.974 6.529 11.943 1.00 0.00 C ATOM 234 CG ASP A 405 11.986 6.700 10.825 1.00 0.00 C ATOM 235 OD1 ASP A 405 11.726 6.223 9.700 1.00 0.00 O ATOM 236 OD2 ASP A 405 13.049 7.320 11.068 1.00 0.00 O ATOM 0 H ASP A 405 11.426 8.971 11.999 1.00 0.00 H new ATOM 0 HA ASP A 405 9.215 7.402 11.047 1.00 0.00 H new ATOM 0 HB2 ASP A 405 11.488 6.583 12.903 1.00 0.00 H new ATOM 0 HB3 ASP A 405 10.529 5.536 11.875 1.00 0.00 H new ATOM 241 N GLU A 406 8.463 8.614 13.595 1.00 0.00 N ATOM 242 CA GLU A 406 7.644 8.662 14.795 1.00 0.00 C ATOM 243 C GLU A 406 6.355 9.434 14.542 1.00 0.00 C ATOM 244 O GLU A 406 6.288 10.226 13.607 1.00 0.00 O ATOM 245 CB GLU A 406 8.440 9.322 15.929 1.00 0.00 C ATOM 246 CG GLU A 406 7.664 9.493 17.227 1.00 0.00 C ATOM 247 CD GLU A 406 7.243 8.172 17.839 1.00 0.00 C ATOM 248 OE1 GLU A 406 6.244 7.590 17.360 1.00 0.00 O ATOM 249 OE2 GLU A 406 7.903 7.723 18.795 1.00 0.00 O ATOM 0 H GLU A 406 8.573 9.512 13.125 1.00 0.00 H new ATOM 0 HA GLU A 406 7.378 7.644 15.080 1.00 0.00 H new ATOM 0 HB2 GLU A 406 9.329 8.724 16.128 1.00 0.00 H new ATOM 0 HB3 GLU A 406 8.783 10.301 15.594 1.00 0.00 H new ATOM 0 HG2 GLU A 406 8.278 10.040 17.942 1.00 0.00 H new ATOM 0 HG3 GLU A 406 6.778 10.099 17.038 1.00 0.00 H new ATOM 256 N ASP A 407 5.345 9.181 15.379 1.00 0.00 N ATOM 257 CA ASP A 407 4.054 9.834 15.308 1.00 0.00 C ATOM 258 C ASP A 407 3.283 9.404 14.071 1.00 0.00 C ATOM 259 O ASP A 407 3.128 10.156 13.112 1.00 0.00 O ATOM 260 CB ASP A 407 4.204 11.350 15.418 1.00 0.00 C ATOM 261 CG ASP A 407 2.879 12.085 15.470 1.00 0.00 C ATOM 262 OD1 ASP A 407 1.860 11.465 15.835 1.00 0.00 O ATOM 263 OD2 ASP A 407 2.870 13.296 15.151 1.00 0.00 O ATOM 0 H ASP A 407 5.413 8.501 16.137 1.00 0.00 H new ATOM 0 HA ASP A 407 3.459 9.515 16.163 1.00 0.00 H new ATOM 0 HB2 ASP A 407 4.777 11.587 16.314 1.00 0.00 H new ATOM 0 HB3 ASP A 407 4.779 11.713 14.566 1.00 0.00 H new ATOM 268 N PHE A 408 2.884 8.134 14.084 1.00 0.00 N ATOM 269 CA PHE A 408 2.073 7.546 13.037 1.00 0.00 C ATOM 270 C PHE A 408 0.913 6.860 13.712 1.00 0.00 C ATOM 271 O PHE A 408 1.093 6.030 14.603 1.00 0.00 O ATOM 272 CB PHE A 408 2.853 6.535 12.183 1.00 0.00 C ATOM 273 CG PHE A 408 3.908 7.143 11.309 1.00 0.00 C ATOM 274 CD1 PHE A 408 3.801 7.073 9.932 1.00 0.00 C ATOM 275 CD2 PHE A 408 4.994 7.792 11.859 1.00 0.00 C ATOM 276 CE1 PHE A 408 4.757 7.644 9.123 1.00 0.00 C ATOM 277 CE2 PHE A 408 5.955 8.362 11.056 1.00 0.00 C ATOM 278 CZ PHE A 408 5.834 8.291 9.687 1.00 0.00 C ATOM 0 H PHE A 408 3.121 7.483 14.833 1.00 0.00 H new ATOM 0 HA PHE A 408 1.743 8.330 12.356 1.00 0.00 H new ATOM 0 HB2 PHE A 408 3.322 5.806 12.844 1.00 0.00 H new ATOM 0 HB3 PHE A 408 2.149 5.989 11.555 1.00 0.00 H new ATOM 0 HD1 PHE A 408 2.958 6.565 9.487 1.00 0.00 H new ATOM 0 HD2 PHE A 408 5.091 7.853 12.933 1.00 0.00 H new ATOM 0 HE1 PHE A 408 4.663 7.585 8.049 1.00 0.00 H new ATOM 0 HE2 PHE A 408 6.802 8.864 11.499 1.00 0.00 H new ATOM 0 HZ PHE A 408 6.584 8.743 9.055 1.00 0.00 H new ATOM 288 N VAL A 409 -0.268 7.210 13.282 1.00 0.00 N ATOM 289 CA VAL A 409 -1.465 6.670 13.839 1.00 0.00 C ATOM 290 C VAL A 409 -1.786 5.372 13.166 1.00 0.00 C ATOM 291 O VAL A 409 -1.937 5.311 11.953 1.00 0.00 O ATOM 292 CB VAL A 409 -2.579 7.712 13.741 1.00 0.00 C ATOM 293 CG1 VAL A 409 -2.241 8.762 14.728 1.00 0.00 C ATOM 294 CG2 VAL A 409 -2.659 8.356 12.391 1.00 0.00 C ATOM 0 H VAL A 409 -0.422 7.882 12.531 1.00 0.00 H new ATOM 0 HA VAL A 409 -1.343 6.444 14.898 1.00 0.00 H new ATOM 0 HB VAL A 409 -3.538 7.226 13.922 1.00 0.00 H new ATOM 0 HG11 VAL A 409 -3.004 9.541 14.707 1.00 0.00 H new ATOM 0 HG12 VAL A 409 -2.198 8.324 15.725 1.00 0.00 H new ATOM 0 HG13 VAL A 409 -1.272 9.196 14.480 1.00 0.00 H new ATOM 0 HG21 VAL A 409 -3.468 9.086 12.384 1.00 0.00 H new ATOM 0 HG22 VAL A 409 -1.716 8.857 12.170 1.00 0.00 H new ATOM 0 HG23 VAL A 409 -2.851 7.594 11.635 1.00 0.00 H new ATOM 304 N GLU A 410 -1.842 4.330 13.967 1.00 0.00 N ATOM 305 CA GLU A 410 -2.063 3.002 13.455 1.00 0.00 C ATOM 306 C GLU A 410 -3.313 2.924 12.595 1.00 0.00 C ATOM 307 O GLU A 410 -4.408 3.312 13.006 1.00 0.00 O ATOM 308 CB GLU A 410 -2.138 1.979 14.578 1.00 0.00 C ATOM 309 CG GLU A 410 -1.881 0.564 14.091 1.00 0.00 C ATOM 310 CD GLU A 410 -0.575 0.001 14.611 1.00 0.00 C ATOM 311 OE1 GLU A 410 -0.262 0.207 15.803 1.00 0.00 O ATOM 312 OE2 GLU A 410 0.172 -0.615 13.824 1.00 0.00 O ATOM 0 H GLU A 410 -1.736 4.381 14.980 1.00 0.00 H new ATOM 0 HA GLU A 410 -1.205 2.766 12.825 1.00 0.00 H new ATOM 0 HB2 GLU A 410 -1.409 2.234 15.347 1.00 0.00 H new ATOM 0 HB3 GLU A 410 -3.122 2.027 15.044 1.00 0.00 H new ATOM 0 HG2 GLU A 410 -2.702 -0.080 14.406 1.00 0.00 H new ATOM 0 HG3 GLU A 410 -1.869 0.555 13.001 1.00 0.00 H new ATOM 319 N VAL A 411 -3.116 2.427 11.399 1.00 0.00 N ATOM 320 CA VAL A 411 -4.170 2.256 10.440 1.00 0.00 C ATOM 321 C VAL A 411 -4.624 0.800 10.454 1.00 0.00 C ATOM 322 O VAL A 411 -3.865 -0.108 10.085 1.00 0.00 O ATOM 323 CB VAL A 411 -3.718 2.660 9.025 1.00 0.00 C ATOM 324 CG1 VAL A 411 -4.918 2.837 8.128 1.00 0.00 C ATOM 325 CG2 VAL A 411 -2.927 3.921 9.071 1.00 0.00 C ATOM 0 H VAL A 411 -2.201 2.126 11.062 1.00 0.00 H new ATOM 0 HA VAL A 411 -5.000 2.907 10.715 1.00 0.00 H new ATOM 0 HB VAL A 411 -3.087 1.867 8.623 1.00 0.00 H new ATOM 0 HG11 VAL A 411 -4.587 3.123 7.130 1.00 0.00 H new ATOM 0 HG12 VAL A 411 -5.472 1.900 8.072 1.00 0.00 H new ATOM 0 HG13 VAL A 411 -5.563 3.616 8.533 1.00 0.00 H new ATOM 0 HG21 VAL A 411 -2.615 4.192 8.062 1.00 0.00 H new ATOM 0 HG22 VAL A 411 -3.540 4.720 9.489 1.00 0.00 H new ATOM 0 HG23 VAL A 411 -2.046 3.775 9.696 1.00 0.00 H new ATOM 335 N PRO A 412 -5.858 0.569 10.919 1.00 0.00 N ATOM 336 CA PRO A 412 -6.452 -0.770 11.017 1.00 0.00 C ATOM 337 C PRO A 412 -6.892 -1.317 9.665 1.00 0.00 C ATOM 338 O PRO A 412 -6.845 -0.613 8.660 1.00 0.00 O ATOM 339 CB PRO A 412 -7.674 -0.527 11.902 1.00 0.00 C ATOM 340 CG PRO A 412 -8.074 0.867 11.571 1.00 0.00 C ATOM 341 CD PRO A 412 -6.785 1.613 11.395 1.00 0.00 C ATOM 0 HA PRO A 412 -5.746 -1.505 11.404 1.00 0.00 H new ATOM 0 HB2 PRO A 412 -8.473 -1.236 11.685 1.00 0.00 H new ATOM 0 HB3 PRO A 412 -7.431 -0.634 12.959 1.00 0.00 H new ATOM 0 HG2 PRO A 412 -8.675 0.899 10.662 1.00 0.00 H new ATOM 0 HG3 PRO A 412 -8.676 1.304 12.367 1.00 0.00 H new ATOM 0 HD2 PRO A 412 -6.884 2.424 10.674 1.00 0.00 H new ATOM 0 HD3 PRO A 412 -6.445 2.058 12.330 1.00 0.00 H new ATOM 349 N GLU A 413 -7.314 -2.573 9.655 1.00 0.00 N ATOM 350 CA GLU A 413 -7.789 -3.218 8.437 1.00 0.00 C ATOM 351 C GLU A 413 -9.293 -3.005 8.309 1.00 0.00 C ATOM 352 O GLU A 413 -9.978 -2.815 9.314 1.00 0.00 O ATOM 353 CB GLU A 413 -7.484 -4.718 8.479 1.00 0.00 C ATOM 354 CG GLU A 413 -6.265 -5.070 9.314 1.00 0.00 C ATOM 355 CD GLU A 413 -5.155 -5.685 8.492 1.00 0.00 C ATOM 356 OE1 GLU A 413 -5.065 -6.929 8.443 1.00 0.00 O ATOM 357 OE2 GLU A 413 -4.360 -4.929 7.897 1.00 0.00 O ATOM 0 H GLU A 413 -7.337 -3.170 10.482 1.00 0.00 H new ATOM 0 HA GLU A 413 -7.280 -2.780 7.578 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -8.351 -5.245 8.878 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -7.332 -5.078 7.461 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -5.893 -4.170 9.805 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -6.557 -5.765 10.101 1.00 0.00 H new ATOM 364 N LYS A 414 -9.811 -3.013 7.086 1.00 0.00 N ATOM 365 CA LYS A 414 -11.241 -2.824 6.891 1.00 0.00 C ATOM 366 C LYS A 414 -11.879 -4.014 6.191 1.00 0.00 C ATOM 367 O LYS A 414 -12.910 -4.509 6.642 1.00 0.00 O ATOM 368 CB LYS A 414 -11.518 -1.538 6.122 1.00 0.00 C ATOM 369 CG LYS A 414 -11.597 -0.321 7.023 1.00 0.00 C ATOM 370 CD LYS A 414 -10.790 0.832 6.468 1.00 0.00 C ATOM 371 CE LYS A 414 -11.531 1.566 5.367 1.00 0.00 C ATOM 372 NZ LYS A 414 -11.087 2.983 5.255 1.00 0.00 N ATOM 0 H LYS A 414 -9.273 -3.146 6.230 1.00 0.00 H new ATOM 0 HA LYS A 414 -11.694 -2.743 7.879 1.00 0.00 H new ATOM 0 HB2 LYS A 414 -10.732 -1.386 5.382 1.00 0.00 H new ATOM 0 HB3 LYS A 414 -12.455 -1.641 5.575 1.00 0.00 H new ATOM 0 HG2 LYS A 414 -12.638 -0.017 7.136 1.00 0.00 H new ATOM 0 HG3 LYS A 414 -11.230 -0.578 8.017 1.00 0.00 H new ATOM 0 HD2 LYS A 414 -10.553 1.529 7.272 1.00 0.00 H new ATOM 0 HD3 LYS A 414 -9.842 0.458 6.080 1.00 0.00 H new ATOM 0 HE2 LYS A 414 -11.368 1.057 4.417 1.00 0.00 H new ATOM 0 HE3 LYS A 414 -12.602 1.535 5.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 414 -11.121 3.280 4.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 414 -11.716 3.590 5.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 414 -10.113 3.071 5.609 1.00 0.00 H new ATOM 386 N GLU A 415 -11.238 -4.484 5.119 1.00 0.00 N ATOM 387 CA GLU A 415 -11.718 -5.628 4.333 1.00 0.00 C ATOM 388 C GLU A 415 -13.100 -5.376 3.710 1.00 0.00 C ATOM 389 O GLU A 415 -13.215 -5.183 2.503 1.00 0.00 O ATOM 390 CB GLU A 415 -11.735 -6.905 5.182 1.00 0.00 C ATOM 391 CG GLU A 415 -11.816 -8.182 4.359 1.00 0.00 C ATOM 392 CD GLU A 415 -10.995 -8.102 3.086 1.00 0.00 C ATOM 393 OE1 GLU A 415 -9.783 -7.824 3.169 1.00 0.00 O ATOM 394 OE2 GLU A 415 -11.564 -8.299 1.993 1.00 0.00 O ATOM 0 H GLU A 415 -10.368 -4.082 4.769 1.00 0.00 H new ATOM 0 HA GLU A 415 -11.015 -5.761 3.510 1.00 0.00 H new ATOM 0 HB2 GLU A 415 -10.835 -6.935 5.796 1.00 0.00 H new ATOM 0 HB3 GLU A 415 -12.585 -6.867 5.863 1.00 0.00 H new ATOM 0 HG2 GLU A 415 -11.468 -9.022 4.961 1.00 0.00 H new ATOM 0 HG3 GLU A 415 -12.857 -8.382 4.105 1.00 0.00 H new ATOM 401 N GLY A 416 -14.132 -5.346 4.536 1.00 0.00 N ATOM 402 CA GLY A 416 -15.482 -5.135 4.048 1.00 0.00 C ATOM 403 C GLY A 416 -15.791 -3.672 3.801 1.00 0.00 C ATOM 404 O GLY A 416 -16.679 -3.102 4.431 1.00 0.00 O ATOM 0 H GLY A 416 -14.060 -5.465 5.546 1.00 0.00 H new ATOM 0 HA2 GLY A 416 -15.621 -5.693 3.122 1.00 0.00 H new ATOM 0 HA3 GLY A 416 -16.192 -5.535 4.771 1.00 0.00 H new ATOM 408 N TYR A 417 -15.046 -3.066 2.891 1.00 0.00 N ATOM 409 CA TYR A 417 -15.233 -1.663 2.549 1.00 0.00 C ATOM 410 C TYR A 417 -14.891 -1.428 1.078 1.00 0.00 C ATOM 411 O TYR A 417 -15.723 -0.945 0.311 1.00 0.00 O ATOM 412 CB TYR A 417 -14.368 -0.797 3.483 1.00 0.00 C ATOM 413 CG TYR A 417 -13.906 0.531 2.916 1.00 0.00 C ATOM 414 CD1 TYR A 417 -12.625 0.668 2.401 1.00 0.00 C ATOM 415 CD2 TYR A 417 -14.728 1.647 2.922 1.00 0.00 C ATOM 416 CE1 TYR A 417 -12.173 1.871 1.905 1.00 0.00 C ATOM 417 CE2 TYR A 417 -14.285 2.857 2.422 1.00 0.00 C ATOM 418 CZ TYR A 417 -13.006 2.964 1.915 1.00 0.00 C ATOM 419 OH TYR A 417 -12.559 4.166 1.425 1.00 0.00 O ATOM 0 H TYR A 417 -14.300 -3.527 2.371 1.00 0.00 H new ATOM 0 HA TYR A 417 -16.277 -1.381 2.687 1.00 0.00 H new ATOM 0 HB2 TYR A 417 -14.934 -0.604 4.395 1.00 0.00 H new ATOM 0 HB3 TYR A 417 -13.488 -1.373 3.770 1.00 0.00 H new ATOM 0 HD1 TYR A 417 -11.967 -0.188 2.389 1.00 0.00 H new ATOM 0 HD2 TYR A 417 -15.728 1.570 3.323 1.00 0.00 H new ATOM 0 HE1 TYR A 417 -11.171 1.955 1.511 1.00 0.00 H new ATOM 0 HE2 TYR A 417 -14.938 3.717 2.428 1.00 0.00 H new ATOM 0 HH TYR A 417 -11.715 4.404 1.862 1.00 0.00 H new ATOM 429 N GLU A 418 -13.670 -1.812 0.704 1.00 0.00 N ATOM 430 CA GLU A 418 -13.151 -1.666 -0.658 1.00 0.00 C ATOM 431 C GLU A 418 -12.991 -0.193 -1.054 1.00 0.00 C ATOM 432 O GLU A 418 -13.669 0.687 -0.528 1.00 0.00 O ATOM 433 CB GLU A 418 -14.005 -2.443 -1.662 1.00 0.00 C ATOM 434 CG GLU A 418 -13.760 -3.946 -1.601 1.00 0.00 C ATOM 435 CD GLU A 418 -12.280 -4.296 -1.495 1.00 0.00 C ATOM 436 OE1 GLU A 418 -11.614 -4.395 -2.542 1.00 0.00 O ATOM 437 OE2 GLU A 418 -11.777 -4.469 -0.359 1.00 0.00 O ATOM 0 H GLU A 418 -13.004 -2.239 1.347 1.00 0.00 H new ATOM 0 HA GLU A 418 -12.152 -2.102 -0.677 1.00 0.00 H new ATOM 0 HB2 GLU A 418 -15.059 -2.242 -1.469 1.00 0.00 H new ATOM 0 HB3 GLU A 418 -13.792 -2.084 -2.669 1.00 0.00 H new ATOM 0 HG2 GLU A 418 -14.290 -4.362 -0.744 1.00 0.00 H new ATOM 0 HG3 GLU A 418 -14.177 -4.415 -2.492 1.00 0.00 H new ATOM 444 N PRO A 419 -12.051 0.093 -1.972 1.00 0.00 N ATOM 445 CA PRO A 419 -11.752 1.461 -2.422 1.00 0.00 C ATOM 446 C PRO A 419 -12.890 2.155 -3.174 1.00 0.00 C ATOM 447 O PRO A 419 -12.818 2.341 -4.390 1.00 0.00 O ATOM 448 CB PRO A 419 -10.547 1.278 -3.350 1.00 0.00 C ATOM 449 CG PRO A 419 -10.617 -0.139 -3.795 1.00 0.00 C ATOM 450 CD PRO A 419 -11.191 -0.903 -2.639 1.00 0.00 C ATOM 0 HA PRO A 419 -11.578 2.108 -1.563 1.00 0.00 H new ATOM 0 HB2 PRO A 419 -10.594 1.961 -4.198 1.00 0.00 H new ATOM 0 HB3 PRO A 419 -9.612 1.482 -2.828 1.00 0.00 H new ATOM 0 HG2 PRO A 419 -11.244 -0.240 -4.681 1.00 0.00 H new ATOM 0 HG3 PRO A 419 -9.629 -0.515 -4.060 1.00 0.00 H new ATOM 0 HD2 PRO A 419 -11.762 -1.769 -2.973 1.00 0.00 H new ATOM 0 HD3 PRO A 419 -10.411 -1.272 -1.973 1.00 0.00 H new ATOM 458 N HIS A 420 -13.932 2.534 -2.451 1.00 0.00 N ATOM 459 CA HIS A 420 -15.052 3.251 -3.042 1.00 0.00 C ATOM 460 C HIS A 420 -15.902 3.900 -1.975 1.00 0.00 C ATOM 461 O HIS A 420 -16.765 3.270 -1.366 1.00 0.00 O ATOM 462 CB HIS A 420 -15.925 2.356 -3.922 1.00 0.00 C ATOM 463 CG HIS A 420 -16.843 3.135 -4.828 1.00 0.00 C ATOM 464 ND1 HIS A 420 -17.547 2.572 -5.869 1.00 0.00 N ATOM 465 CD2 HIS A 420 -17.167 4.463 -4.834 1.00 0.00 C ATOM 466 CE1 HIS A 420 -18.256 3.542 -6.461 1.00 0.00 C ATOM 467 NE2 HIS A 420 -18.061 4.707 -5.872 1.00 0.00 N ATOM 0 H HIS A 420 -14.026 2.357 -1.451 1.00 0.00 H new ATOM 0 HA HIS A 420 -14.619 4.022 -3.680 1.00 0.00 H new ATOM 0 HB2 HIS A 420 -15.284 1.715 -4.528 1.00 0.00 H new ATOM 0 HB3 HIS A 420 -16.521 1.701 -3.286 1.00 0.00 H new ATOM 0 HD2 HIS A 420 -16.790 5.204 -4.144 1.00 0.00 H new ATOM 0 HE1 HIS A 420 -18.904 3.390 -7.311 1.00 0.00 H new ATOM 0 HE2 HIS A 420 -18.480 5.602 -6.126 1.00 0.00 H new ATOM 475 N ILE A 421 -15.636 5.168 -1.760 1.00 0.00 N ATOM 476 CA ILE A 421 -16.374 5.950 -0.808 1.00 0.00 C ATOM 477 C ILE A 421 -16.063 7.420 -1.019 1.00 0.00 C ATOM 478 O ILE A 421 -14.952 7.775 -1.418 1.00 0.00 O ATOM 479 CB ILE A 421 -16.090 5.527 0.655 1.00 0.00 C ATOM 480 CG1 ILE A 421 -17.405 5.496 1.422 1.00 0.00 C ATOM 481 CG2 ILE A 421 -15.097 6.465 1.335 1.00 0.00 C ATOM 482 CD1 ILE A 421 -17.375 4.637 2.666 1.00 0.00 C ATOM 0 H ILE A 421 -14.900 5.683 -2.243 1.00 0.00 H new ATOM 0 HA ILE A 421 -17.436 5.772 -0.976 1.00 0.00 H new ATOM 0 HB ILE A 421 -15.637 4.536 0.649 1.00 0.00 H new ATOM 0 HG12 ILE A 421 -17.673 6.514 1.703 1.00 0.00 H new ATOM 0 HG13 ILE A 421 -18.190 5.131 0.760 1.00 0.00 H new ATOM 0 HG21 ILE A 421 -14.926 6.133 2.359 1.00 0.00 H new ATOM 0 HG22 ILE A 421 -14.154 6.456 0.788 1.00 0.00 H new ATOM 0 HG23 ILE A 421 -15.501 7.477 1.345 1.00 0.00 H new ATOM 0 HD11 ILE A 421 -18.349 4.669 3.154 1.00 0.00 H new ATOM 0 HD12 ILE A 421 -17.140 3.608 2.392 1.00 0.00 H new ATOM 0 HD13 ILE A 421 -16.614 5.014 3.350 1.00 0.00 H new ATOM 494 N PRO A 422 -17.063 8.280 -0.833 1.00 0.00 N ATOM 495 CA PRO A 422 -16.894 9.721 -0.986 1.00 0.00 C ATOM 496 C PRO A 422 -15.852 10.275 -0.008 1.00 0.00 C ATOM 497 O PRO A 422 -15.814 9.882 1.159 1.00 0.00 O ATOM 498 CB PRO A 422 -18.286 10.276 -0.665 1.00 0.00 C ATOM 499 CG PRO A 422 -18.960 9.194 0.103 1.00 0.00 C ATOM 500 CD PRO A 422 -18.444 7.924 -0.482 1.00 0.00 C ATOM 0 HA PRO A 422 -16.535 9.996 -1.978 1.00 0.00 H new ATOM 0 HB2 PRO A 422 -18.221 11.194 -0.081 1.00 0.00 H new ATOM 0 HB3 PRO A 422 -18.836 10.516 -1.575 1.00 0.00 H new ATOM 0 HG2 PRO A 422 -18.728 9.261 1.166 1.00 0.00 H new ATOM 0 HG3 PRO A 422 -20.044 9.260 0.009 1.00 0.00 H new ATOM 0 HD2 PRO A 422 -18.483 7.102 0.232 1.00 0.00 H new ATOM 0 HD3 PRO A 422 -19.019 7.615 -1.355 1.00 0.00 H new ATOM 508 N ASP A 423 -15.011 11.183 -0.483 1.00 0.00 N ATOM 509 CA ASP A 423 -13.969 11.766 0.357 1.00 0.00 C ATOM 510 C ASP A 423 -14.483 12.983 1.114 1.00 0.00 C ATOM 511 O ASP A 423 -14.721 14.040 0.527 1.00 0.00 O ATOM 512 CB ASP A 423 -12.749 12.155 -0.486 1.00 0.00 C ATOM 513 CG ASP A 423 -11.540 12.544 0.355 1.00 0.00 C ATOM 514 OD1 ASP A 423 -11.693 12.799 1.569 1.00 0.00 O ATOM 515 OD2 ASP A 423 -10.422 12.598 -0.198 1.00 0.00 O ATOM 0 H ASP A 423 -15.028 11.532 -1.441 1.00 0.00 H new ATOM 0 HA ASP A 423 -13.673 11.010 1.084 1.00 0.00 H new ATOM 0 HB2 ASP A 423 -12.480 11.320 -1.133 1.00 0.00 H new ATOM 0 HB3 ASP A 423 -13.015 12.988 -1.136 1.00 0.00 H new ATOM 520 N HIS A 424 -14.658 12.819 2.418 1.00 0.00 N ATOM 521 CA HIS A 424 -15.115 13.901 3.283 1.00 0.00 C ATOM 522 C HIS A 424 -14.000 14.271 4.246 1.00 0.00 C ATOM 523 O HIS A 424 -14.239 14.813 5.321 1.00 0.00 O ATOM 524 CB HIS A 424 -16.356 13.499 4.085 1.00 0.00 C ATOM 525 CG HIS A 424 -17.496 13.003 3.256 1.00 0.00 C ATOM 526 ND1 HIS A 424 -18.444 13.816 2.675 1.00 0.00 N ATOM 527 CD2 HIS A 424 -17.841 11.736 2.934 1.00 0.00 C ATOM 528 CE1 HIS A 424 -19.319 13.035 2.036 1.00 0.00 C ATOM 529 NE2 HIS A 424 -18.999 11.760 2.161 1.00 0.00 N ATOM 0 H HIS A 424 -14.489 11.939 2.905 1.00 0.00 H new ATOM 0 HA HIS A 424 -15.379 14.750 2.653 1.00 0.00 H new ATOM 0 HB2 HIS A 424 -16.077 12.723 4.798 1.00 0.00 H new ATOM 0 HB3 HIS A 424 -16.692 14.358 4.665 1.00 0.00 H new ATOM 0 HD1 HIS A 424 -18.473 14.834 2.724 1.00 0.00 H new ATOM 0 HD2 HIS A 424 -17.304 10.847 3.229 1.00 0.00 H new ATOM 0 HE1 HIS A 424 -20.176 13.399 1.489 1.00 0.00 H new ATOM 537 N LEU A 425 -12.777 13.953 3.855 1.00 0.00 N ATOM 538 CA LEU A 425 -11.620 14.233 4.681 1.00 0.00 C ATOM 539 C LEU A 425 -10.779 15.335 4.050 1.00 0.00 C ATOM 540 O LEU A 425 -9.788 15.069 3.365 1.00 0.00 O ATOM 541 CB LEU A 425 -10.793 12.958 4.861 1.00 0.00 C ATOM 542 CG LEU A 425 -11.594 11.724 5.295 1.00 0.00 C ATOM 543 CD1 LEU A 425 -10.794 10.456 5.045 1.00 0.00 C ATOM 544 CD2 LEU A 425 -11.981 11.829 6.762 1.00 0.00 C ATOM 0 H LEU A 425 -12.562 13.499 2.967 1.00 0.00 H new ATOM 0 HA LEU A 425 -11.952 14.575 5.661 1.00 0.00 H new ATOM 0 HB2 LEU A 425 -10.289 12.734 3.921 1.00 0.00 H new ATOM 0 HB3 LEU A 425 -10.016 13.148 5.602 1.00 0.00 H new ATOM 0 HG LEU A 425 -12.507 11.679 4.701 1.00 0.00 H new ATOM 0 HD11 LEU A 425 -11.377 9.590 5.359 1.00 0.00 H new ATOM 0 HD12 LEU A 425 -10.565 10.374 3.982 1.00 0.00 H new ATOM 0 HD13 LEU A 425 -9.865 10.494 5.614 1.00 0.00 H new ATOM 0 HD21 LEU A 425 -12.549 10.945 7.053 1.00 0.00 H new ATOM 0 HD22 LEU A 425 -11.080 11.899 7.372 1.00 0.00 H new ATOM 0 HD23 LEU A 425 -12.592 12.719 6.914 1.00 0.00 H new ATOM 556 N ARG A 426 -11.196 16.575 4.259 1.00 0.00 N ATOM 557 CA ARG A 426 -10.491 17.721 3.711 1.00 0.00 C ATOM 558 C ARG A 426 -9.794 18.492 4.826 1.00 0.00 C ATOM 559 O ARG A 426 -10.443 18.985 5.745 1.00 0.00 O ATOM 560 CB ARG A 426 -11.460 18.654 2.969 1.00 0.00 C ATOM 561 CG ARG A 426 -11.883 18.165 1.589 1.00 0.00 C ATOM 562 CD ARG A 426 -12.875 17.010 1.661 1.00 0.00 C ATOM 563 NE ARG A 426 -13.945 17.249 2.631 1.00 0.00 N ATOM 564 CZ ARG A 426 -15.245 17.126 2.363 1.00 0.00 C ATOM 565 NH1 ARG A 426 -15.658 16.838 1.136 1.00 0.00 N ATOM 566 NH2 ARG A 426 -16.135 17.290 3.325 1.00 0.00 N ATOM 0 H ARG A 426 -12.023 16.812 4.807 1.00 0.00 H new ATOM 0 HA ARG A 426 -9.747 17.355 3.004 1.00 0.00 H new ATOM 0 HB2 ARG A 426 -12.352 18.790 3.581 1.00 0.00 H new ATOM 0 HB3 ARG A 426 -10.992 19.633 2.865 1.00 0.00 H new ATOM 0 HG2 ARG A 426 -12.330 18.991 1.035 1.00 0.00 H new ATOM 0 HG3 ARG A 426 -11.001 17.849 1.032 1.00 0.00 H new ATOM 0 HD2 ARG A 426 -13.312 16.849 0.676 1.00 0.00 H new ATOM 0 HD3 ARG A 426 -12.345 16.096 1.928 1.00 0.00 H new ATOM 0 HE ARG A 426 -13.678 17.528 3.575 1.00 0.00 H new ATOM 0 HH11 ARG A 426 -14.978 16.708 0.386 1.00 0.00 H new ATOM 0 HH12 ARG A 426 -16.655 16.746 0.942 1.00 0.00 H new ATOM 0 HH21 ARG A 426 -15.827 17.511 4.272 1.00 0.00 H new ATOM 0 HH22 ARG A 426 -17.130 17.196 3.121 1.00 0.00 H new ATOM 580 N PRO A 427 -8.459 18.600 4.765 1.00 0.00 N ATOM 581 CA PRO A 427 -7.676 19.327 5.766 1.00 0.00 C ATOM 582 C PRO A 427 -7.811 20.837 5.592 1.00 0.00 C ATOM 583 O PRO A 427 -6.837 21.534 5.312 1.00 0.00 O ATOM 584 CB PRO A 427 -6.227 18.882 5.503 1.00 0.00 C ATOM 585 CG PRO A 427 -6.307 17.811 4.463 1.00 0.00 C ATOM 586 CD PRO A 427 -7.600 18.021 3.731 1.00 0.00 C ATOM 0 HA PRO A 427 -8.010 19.113 6.781 1.00 0.00 H new ATOM 0 HB2 PRO A 427 -5.619 19.718 5.156 1.00 0.00 H new ATOM 0 HB3 PRO A 427 -5.763 18.507 6.415 1.00 0.00 H new ATOM 0 HG2 PRO A 427 -5.460 17.871 3.779 1.00 0.00 H new ATOM 0 HG3 PRO A 427 -6.277 16.823 4.921 1.00 0.00 H new ATOM 0 HD2 PRO A 427 -7.480 18.692 2.880 1.00 0.00 H new ATOM 0 HD3 PRO A 427 -8.004 17.085 3.345 1.00 0.00 H new ATOM 594 N GLU A 428 -9.029 21.325 5.752 1.00 0.00 N ATOM 595 CA GLU A 428 -9.318 22.739 5.601 1.00 0.00 C ATOM 596 C GLU A 428 -10.206 23.221 6.746 1.00 0.00 C ATOM 597 O GLU A 428 -10.480 22.473 7.683 1.00 0.00 O ATOM 598 CB GLU A 428 -9.999 22.979 4.251 1.00 0.00 C ATOM 599 CG GLU A 428 -9.274 23.982 3.369 1.00 0.00 C ATOM 600 CD GLU A 428 -9.551 25.410 3.779 1.00 0.00 C ATOM 601 OE1 GLU A 428 -10.686 25.682 4.225 1.00 0.00 O ATOM 602 OE2 GLU A 428 -8.646 26.255 3.668 1.00 0.00 O ATOM 0 H GLU A 428 -9.841 20.755 5.989 1.00 0.00 H new ATOM 0 HA GLU A 428 -8.387 23.304 5.632 1.00 0.00 H new ATOM 0 HB2 GLU A 428 -10.076 22.030 3.719 1.00 0.00 H new ATOM 0 HB3 GLU A 428 -11.016 23.330 4.425 1.00 0.00 H new ATOM 0 HG2 GLU A 428 -8.201 23.794 3.415 1.00 0.00 H new ATOM 0 HG3 GLU A 428 -9.579 23.838 2.332 1.00 0.00 H new ATOM 609 N TYR A 429 -10.650 24.466 6.665 1.00 0.00 N ATOM 610 CA TYR A 429 -11.500 25.048 7.696 1.00 0.00 C ATOM 611 C TYR A 429 -12.781 25.613 7.089 1.00 0.00 C ATOM 612 O TYR A 429 -13.812 25.693 7.753 1.00 0.00 O ATOM 613 CB TYR A 429 -10.744 26.143 8.464 1.00 0.00 C ATOM 614 CG TYR A 429 -9.875 27.024 7.590 1.00 0.00 C ATOM 615 CD1 TYR A 429 -8.541 26.709 7.363 1.00 0.00 C ATOM 616 CD2 TYR A 429 -10.387 28.170 6.994 1.00 0.00 C ATOM 617 CE1 TYR A 429 -7.744 27.506 6.566 1.00 0.00 C ATOM 618 CE2 TYR A 429 -9.596 28.974 6.195 1.00 0.00 C ATOM 619 CZ TYR A 429 -8.277 28.637 5.984 1.00 0.00 C ATOM 620 OH TYR A 429 -7.486 29.430 5.187 1.00 0.00 O ATOM 0 H TYR A 429 -10.435 25.097 5.893 1.00 0.00 H new ATOM 0 HA TYR A 429 -11.773 24.258 8.396 1.00 0.00 H new ATOM 0 HB2 TYR A 429 -11.466 26.769 8.988 1.00 0.00 H new ATOM 0 HB3 TYR A 429 -10.119 25.673 9.224 1.00 0.00 H new ATOM 0 HD1 TYR A 429 -8.120 25.825 7.818 1.00 0.00 H new ATOM 0 HD2 TYR A 429 -11.421 28.437 7.158 1.00 0.00 H new ATOM 0 HE1 TYR A 429 -6.709 27.245 6.399 1.00 0.00 H new ATOM 0 HE2 TYR A 429 -10.010 29.861 5.739 1.00 0.00 H new ATOM 0 HH TYR A 429 -8.012 30.186 4.853 1.00 0.00 H new ATOM 630 N GLY A 430 -12.704 26.009 5.826 1.00 0.00 N ATOM 631 CA GLY A 430 -13.856 26.553 5.142 1.00 0.00 C ATOM 632 C GLY A 430 -14.310 25.649 4.016 1.00 0.00 C ATOM 633 O GLY A 430 -15.484 25.635 3.652 1.00 0.00 O ATOM 0 H GLY A 430 -11.856 25.962 5.261 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -14.672 26.689 5.852 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -13.613 27.538 4.744 1.00 0.00 H new ATOM 637 N LEU A 431 -13.372 24.888 3.464 1.00 0.00 N ATOM 638 CA LEU A 431 -13.676 23.966 2.374 1.00 0.00 C ATOM 639 C LEU A 431 -14.131 22.614 2.919 1.00 0.00 C ATOM 640 O LEU A 431 -14.390 21.681 2.159 1.00 0.00 O ATOM 641 CB LEU A 431 -12.456 23.786 1.468 1.00 0.00 C ATOM 642 CG LEU A 431 -11.985 25.054 0.749 1.00 0.00 C ATOM 643 CD1 LEU A 431 -10.750 24.763 -0.088 1.00 0.00 C ATOM 644 CD2 LEU A 431 -13.097 25.621 -0.124 1.00 0.00 C ATOM 0 H LEU A 431 -12.394 24.891 3.753 1.00 0.00 H new ATOM 0 HA LEU A 431 -14.489 24.393 1.786 1.00 0.00 H new ATOM 0 HB2 LEU A 431 -11.632 23.400 2.068 1.00 0.00 H new ATOM 0 HB3 LEU A 431 -12.688 23.028 0.720 1.00 0.00 H new ATOM 0 HG LEU A 431 -11.726 25.798 1.502 1.00 0.00 H new ATOM 0 HD11 LEU A 431 -10.429 25.675 -0.592 1.00 0.00 H new ATOM 0 HD12 LEU A 431 -9.949 24.404 0.558 1.00 0.00 H new ATOM 0 HD13 LEU A 431 -10.985 24.001 -0.831 1.00 0.00 H new ATOM 0 HD21 LEU A 431 -12.742 26.521 -0.626 1.00 0.00 H new ATOM 0 HD22 LEU A 431 -13.388 24.881 -0.869 1.00 0.00 H new ATOM 0 HD23 LEU A 431 -13.958 25.867 0.498 1.00 0.00 H new ATOM 656 N GLU A 432 -14.221 22.519 4.237 1.00 0.00 N ATOM 657 CA GLU A 432 -14.652 21.296 4.897 1.00 0.00 C ATOM 658 C GLU A 432 -16.064 21.484 5.443 1.00 0.00 C ATOM 659 O GLU A 432 -16.277 22.261 6.375 1.00 0.00 O ATOM 660 CB GLU A 432 -13.673 20.932 6.023 1.00 0.00 C ATOM 661 CG GLU A 432 -14.002 19.633 6.746 1.00 0.00 C ATOM 662 CD GLU A 432 -14.360 18.507 5.798 1.00 0.00 C ATOM 663 OE1 GLU A 432 -13.446 17.919 5.182 1.00 0.00 O ATOM 664 OE2 GLU A 432 -15.562 18.216 5.654 1.00 0.00 O ATOM 0 H GLU A 432 -13.999 23.282 4.876 1.00 0.00 H new ATOM 0 HA GLU A 432 -14.661 20.477 4.178 1.00 0.00 H new ATOM 0 HB2 GLU A 432 -12.669 20.857 5.605 1.00 0.00 H new ATOM 0 HB3 GLU A 432 -13.656 21.744 6.750 1.00 0.00 H new ATOM 0 HG2 GLU A 432 -13.147 19.333 7.352 1.00 0.00 H new ATOM 0 HG3 GLU A 432 -14.833 19.804 7.430 1.00 0.00 H new ATOM 671 N ALA A 433 -17.025 20.785 4.844 1.00 0.00 N ATOM 672 CA ALA A 433 -18.421 20.883 5.257 1.00 0.00 C ATOM 673 C ALA A 433 -19.273 19.800 4.604 1.00 0.00 C ATOM 674 O ALA A 433 -20.142 19.211 5.244 1.00 0.00 O ATOM 675 CB ALA A 433 -18.980 22.260 4.921 1.00 0.00 C ATOM 0 H ALA A 433 -16.861 20.143 4.069 1.00 0.00 H new ATOM 0 HA ALA A 433 -18.457 20.737 6.337 1.00 0.00 H new ATOM 0 HB1 ALA A 433 -20.022 22.316 5.236 1.00 0.00 H new ATOM 0 HB2 ALA A 433 -18.402 23.024 5.441 1.00 0.00 H new ATOM 0 HB3 ALA A 433 -18.916 22.426 3.846 1.00 0.00 H new ATOM 681 N ALA A 434 -19.027 19.551 3.326 1.00 0.00 N ATOM 682 CA ALA A 434 -19.775 18.546 2.585 1.00 0.00 C ATOM 683 C ALA A 434 -18.829 17.554 1.925 1.00 0.00 C ATOM 684 O ALA A 434 -18.296 17.865 0.843 1.00 0.00 O ATOM 685 CB ALA A 434 -20.668 19.208 1.545 1.00 0.00 C ATOM 686 OXT ALA A 434 -18.588 16.484 2.514 1.00 0.00 O ATOM 0 H ALA A 434 -18.313 20.033 2.779 1.00 0.00 H new ATOM 0 HA ALA A 434 -20.408 18.001 3.285 1.00 0.00 H new ATOM 0 HB1 ALA A 434 -21.220 18.443 1.000 1.00 0.00 H new ATOM 0 HB2 ALA A 434 -21.370 19.878 2.042 1.00 0.00 H new ATOM 0 HB3 ALA A 434 -20.054 19.778 0.848 1.00 0.00 H new TER 692 ALA A 434 ATOM 693 N MET B 1 1.610 -9.146 -13.883 1.00 0.00 N ATOM 694 CA MET B 1 1.647 -10.449 -14.578 1.00 0.00 C ATOM 695 C MET B 1 2.327 -11.501 -13.704 1.00 0.00 C ATOM 696 O MET B 1 1.653 -12.274 -13.028 1.00 0.00 O ATOM 697 CB MET B 1 2.384 -10.318 -15.915 1.00 0.00 C ATOM 698 CG MET B 1 2.394 -11.600 -16.735 1.00 0.00 C ATOM 699 SD MET B 1 3.328 -11.436 -18.269 1.00 0.00 S ATOM 700 CE MET B 1 4.985 -11.181 -17.638 1.00 0.00 C ATOM 0 H1 MET B 1 1.335 -8.402 -14.555 1.00 0.00 H new ATOM 0 H2 MET B 1 0.918 -9.186 -13.108 1.00 0.00 H new ATOM 0 H3 MET B 1 2.551 -8.932 -13.496 1.00 0.00 H new ATOM 0 HA MET B 1 0.622 -10.766 -14.771 1.00 0.00 H new ATOM 0 HB2 MET B 1 1.918 -9.526 -16.501 1.00 0.00 H new ATOM 0 HB3 MET B 1 3.412 -10.011 -15.725 1.00 0.00 H new ATOM 0 HG2 MET B 1 2.822 -12.405 -16.138 1.00 0.00 H new ATOM 0 HG3 MET B 1 1.368 -11.886 -16.968 1.00 0.00 H new ATOM 0 HE1 MET B 1 5.710 -11.397 -18.423 1.00 0.00 H new ATOM 0 HE2 MET B 1 5.096 -10.146 -17.316 1.00 0.00 H new ATOM 0 HE3 MET B 1 5.158 -11.845 -16.791 1.00 0.00 H new ATOM 710 N ALA B 2 3.662 -11.500 -13.712 1.00 0.00 N ATOM 711 CA ALA B 2 4.459 -12.445 -12.933 1.00 0.00 C ATOM 712 C ALA B 2 5.945 -12.202 -13.178 1.00 0.00 C ATOM 713 O ALA B 2 6.599 -12.972 -13.881 1.00 0.00 O ATOM 714 CB ALA B 2 4.103 -13.886 -13.285 1.00 0.00 C ATOM 0 H ALA B 2 4.219 -10.844 -14.259 1.00 0.00 H new ATOM 0 HA ALA B 2 4.236 -12.287 -11.878 1.00 0.00 H new ATOM 0 HB1 ALA B 2 4.712 -14.567 -12.690 1.00 0.00 H new ATOM 0 HB2 ALA B 2 3.048 -14.062 -13.073 1.00 0.00 H new ATOM 0 HB3 ALA B 2 4.294 -14.060 -14.344 1.00 0.00 H new ATOM 720 N THR B 3 6.471 -11.112 -12.636 1.00 0.00 N ATOM 721 CA THR B 3 7.882 -10.785 -12.808 1.00 0.00 C ATOM 722 C THR B 3 8.395 -9.935 -11.645 1.00 0.00 C ATOM 723 O THR B 3 9.058 -10.437 -10.737 1.00 0.00 O ATOM 724 CB THR B 3 8.127 -10.034 -14.137 1.00 0.00 C ATOM 725 OG1 THR B 3 7.515 -10.743 -15.224 1.00 0.00 O ATOM 726 CG2 THR B 3 9.617 -9.873 -14.409 1.00 0.00 C ATOM 0 H THR B 3 5.945 -10.441 -12.076 1.00 0.00 H new ATOM 0 HA THR B 3 8.428 -11.728 -12.830 1.00 0.00 H new ATOM 0 HB THR B 3 7.681 -9.043 -14.050 1.00 0.00 H new ATOM 0 HG1 THR B 3 7.674 -10.259 -16.061 1.00 0.00 H new ATOM 0 HG21 THR B 3 9.760 -9.342 -15.350 1.00 0.00 H new ATOM 0 HG22 THR B 3 10.076 -9.306 -13.599 1.00 0.00 H new ATOM 0 HG23 THR B 3 10.083 -10.856 -14.473 1.00 0.00 H new ATOM 734 N SER B 4 8.083 -8.647 -11.678 1.00 0.00 N ATOM 735 CA SER B 4 8.509 -7.717 -10.642 1.00 0.00 C ATOM 736 C SER B 4 7.539 -6.546 -10.591 1.00 0.00 C ATOM 737 O SER B 4 6.918 -6.280 -9.560 1.00 0.00 O ATOM 738 CB SER B 4 9.932 -7.215 -10.917 1.00 0.00 C ATOM 739 OG SER B 4 10.826 -8.295 -11.130 1.00 0.00 O ATOM 0 H SER B 4 7.530 -8.219 -12.420 1.00 0.00 H new ATOM 0 HA SER B 4 8.512 -8.231 -9.681 1.00 0.00 H new ATOM 0 HB2 SER B 4 9.928 -6.565 -11.792 1.00 0.00 H new ATOM 0 HB3 SER B 4 10.277 -6.615 -10.075 1.00 0.00 H new ATOM 0 HG SER B 4 11.725 -7.946 -11.304 1.00 0.00 H new ATOM 745 N SER B 5 7.412 -5.857 -11.713 1.00 0.00 N ATOM 746 CA SER B 5 6.499 -4.738 -11.823 1.00 0.00 C ATOM 747 C SER B 5 5.129 -5.255 -12.247 1.00 0.00 C ATOM 748 O SER B 5 4.792 -5.263 -13.431 1.00 0.00 O ATOM 749 CB SER B 5 7.039 -3.725 -12.834 1.00 0.00 C ATOM 750 OG SER B 5 8.449 -3.604 -12.719 1.00 0.00 O ATOM 0 H SER B 5 7.935 -6.057 -12.565 1.00 0.00 H new ATOM 0 HA SER B 5 6.404 -4.236 -10.860 1.00 0.00 H new ATOM 0 HB2 SER B 5 6.777 -4.038 -13.845 1.00 0.00 H new ATOM 0 HB3 SER B 5 6.571 -2.754 -12.669 1.00 0.00 H new ATOM 0 HG SER B 5 8.672 -3.175 -11.867 1.00 0.00 H new ATOM 756 N GLU B 6 4.361 -5.718 -11.271 1.00 0.00 N ATOM 757 CA GLU B 6 3.041 -6.267 -11.530 1.00 0.00 C ATOM 758 C GLU B 6 1.997 -5.171 -11.634 1.00 0.00 C ATOM 759 O GLU B 6 2.311 -3.987 -11.492 1.00 0.00 O ATOM 760 CB GLU B 6 2.656 -7.265 -10.439 1.00 0.00 C ATOM 761 CG GLU B 6 2.758 -8.716 -10.883 1.00 0.00 C ATOM 762 CD GLU B 6 4.043 -9.015 -11.633 1.00 0.00 C ATOM 763 OE1 GLU B 6 5.037 -9.411 -10.988 1.00 0.00 O ATOM 764 OE2 GLU B 6 4.057 -8.868 -12.874 1.00 0.00 O ATOM 0 H GLU B 6 4.633 -5.723 -10.288 1.00 0.00 H new ATOM 0 HA GLU B 6 3.078 -6.787 -12.487 1.00 0.00 H new ATOM 0 HB2 GLU B 6 3.300 -7.112 -9.573 1.00 0.00 H new ATOM 0 HB3 GLU B 6 1.635 -7.063 -10.116 1.00 0.00 H new ATOM 0 HG2 GLU B 6 2.695 -9.364 -10.009 1.00 0.00 H new ATOM 0 HG3 GLU B 6 1.907 -8.956 -11.520 1.00 0.00 H new ATOM 771 N GLU B 7 0.763 -5.585 -11.898 1.00 0.00 N ATOM 772 CA GLU B 7 -0.365 -4.676 -12.045 1.00 0.00 C ATOM 773 C GLU B 7 -0.425 -3.685 -10.889 1.00 0.00 C ATOM 774 O GLU B 7 -0.699 -4.052 -9.742 1.00 0.00 O ATOM 775 CB GLU B 7 -1.677 -5.468 -12.125 1.00 0.00 C ATOM 776 CG GLU B 7 -1.851 -6.257 -13.420 1.00 0.00 C ATOM 777 CD GLU B 7 -0.789 -7.324 -13.614 1.00 0.00 C ATOM 778 OE1 GLU B 7 -0.411 -7.982 -12.621 1.00 0.00 O ATOM 779 OE2 GLU B 7 -0.308 -7.501 -14.753 1.00 0.00 O ATOM 0 H GLU B 7 0.517 -6.568 -12.017 1.00 0.00 H new ATOM 0 HA GLU B 7 -0.228 -4.115 -12.969 1.00 0.00 H new ATOM 0 HB2 GLU B 7 -1.724 -6.158 -11.283 1.00 0.00 H new ATOM 0 HB3 GLU B 7 -2.513 -4.777 -12.018 1.00 0.00 H new ATOM 0 HG2 GLU B 7 -2.835 -6.727 -13.423 1.00 0.00 H new ATOM 0 HG3 GLU B 7 -1.824 -5.568 -14.264 1.00 0.00 H new ATOM 786 N VAL B 8 -0.143 -2.431 -11.200 1.00 0.00 N ATOM 787 CA VAL B 8 -0.162 -1.376 -10.210 1.00 0.00 C ATOM 788 C VAL B 8 -1.590 -0.894 -10.000 1.00 0.00 C ATOM 789 O VAL B 8 -2.203 -0.332 -10.905 1.00 0.00 O ATOM 790 CB VAL B 8 0.722 -0.183 -10.627 1.00 0.00 C ATOM 791 CG1 VAL B 8 0.886 0.784 -9.468 1.00 0.00 C ATOM 792 CG2 VAL B 8 2.080 -0.658 -11.123 1.00 0.00 C ATOM 0 H VAL B 8 0.103 -2.121 -12.140 1.00 0.00 H new ATOM 0 HA VAL B 8 0.238 -1.786 -9.283 1.00 0.00 H new ATOM 0 HB VAL B 8 0.227 0.337 -11.447 1.00 0.00 H new ATOM 0 HG11 VAL B 8 1.512 1.621 -9.778 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -0.092 1.156 -9.164 1.00 0.00 H new ATOM 0 HG13 VAL B 8 1.356 0.270 -8.629 1.00 0.00 H new ATOM 0 HG21 VAL B 8 2.684 0.203 -11.411 1.00 0.00 H new ATOM 0 HG22 VAL B 8 2.586 -1.207 -10.329 1.00 0.00 H new ATOM 0 HG23 VAL B 8 1.944 -1.311 -11.985 1.00 0.00 H new ATOM 802 N LEU B 9 -2.112 -1.131 -8.810 1.00 0.00 N ATOM 803 CA LEU B 9 -3.471 -0.736 -8.480 1.00 0.00 C ATOM 804 C LEU B 9 -3.522 0.726 -8.054 1.00 0.00 C ATOM 805 O LEU B 9 -4.509 1.416 -8.297 1.00 0.00 O ATOM 806 CB LEU B 9 -4.030 -1.624 -7.364 1.00 0.00 C ATOM 807 CG LEU B 9 -3.965 -3.131 -7.628 1.00 0.00 C ATOM 808 CD1 LEU B 9 -4.589 -3.896 -6.472 1.00 0.00 C ATOM 809 CD2 LEU B 9 -4.658 -3.483 -8.938 1.00 0.00 C ATOM 0 H LEU B 9 -1.613 -1.597 -8.052 1.00 0.00 H new ATOM 0 HA LEU B 9 -4.084 -0.859 -9.373 1.00 0.00 H new ATOM 0 HB2 LEU B 9 -3.485 -1.410 -6.445 1.00 0.00 H new ATOM 0 HB3 LEU B 9 -5.070 -1.348 -7.190 1.00 0.00 H new ATOM 0 HG LEU B 9 -2.917 -3.419 -7.712 1.00 0.00 H new ATOM 0 HD11 LEU B 9 -4.536 -4.966 -6.673 1.00 0.00 H new ATOM 0 HD12 LEU B 9 -4.047 -3.672 -5.553 1.00 0.00 H new ATOM 0 HD13 LEU B 9 -5.632 -3.599 -6.360 1.00 0.00 H new ATOM 0 HD21 LEU B 9 -4.599 -4.559 -9.103 1.00 0.00 H new ATOM 0 HD22 LEU B 9 -5.704 -3.181 -8.889 1.00 0.00 H new ATOM 0 HD23 LEU B 9 -4.168 -2.962 -9.760 1.00 0.00 H new ATOM 821 N LEU B 10 -2.457 1.198 -7.417 1.00 0.00 N ATOM 822 CA LEU B 10 -2.416 2.585 -6.967 1.00 0.00 C ATOM 823 C LEU B 10 -1.070 3.230 -7.264 1.00 0.00 C ATOM 824 O LEU B 10 -0.023 2.660 -6.969 1.00 0.00 O ATOM 825 CB LEU B 10 -2.707 2.662 -5.473 1.00 0.00 C ATOM 826 CG LEU B 10 -3.157 4.037 -4.975 1.00 0.00 C ATOM 827 CD1 LEU B 10 -4.602 4.310 -5.362 1.00 0.00 C ATOM 828 CD2 LEU B 10 -2.983 4.139 -3.473 1.00 0.00 C ATOM 0 H LEU B 10 -1.623 0.652 -7.203 1.00 0.00 H new ATOM 0 HA LEU B 10 -3.182 3.133 -7.516 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -3.480 1.933 -5.230 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -1.810 2.370 -4.927 1.00 0.00 H new ATOM 0 HG LEU B 10 -2.530 4.791 -5.451 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -4.897 5.293 -4.996 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -4.699 4.282 -6.447 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -5.247 3.550 -4.920 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -3.308 5.123 -3.135 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -3.583 3.371 -2.984 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -1.933 3.996 -3.218 1.00 0.00 H new ATOM 840 N ILE B 11 -1.105 4.425 -7.836 1.00 0.00 N ATOM 841 CA ILE B 11 0.116 5.145 -8.173 1.00 0.00 C ATOM 842 C ILE B 11 0.210 6.466 -7.412 1.00 0.00 C ATOM 843 O ILE B 11 -0.625 7.360 -7.586 1.00 0.00 O ATOM 844 CB ILE B 11 0.204 5.425 -9.691 1.00 0.00 C ATOM 845 CG1 ILE B 11 0.247 4.107 -10.469 1.00 0.00 C ATOM 846 CG2 ILE B 11 1.428 6.277 -10.008 1.00 0.00 C ATOM 847 CD1 ILE B 11 0.301 4.281 -11.970 1.00 0.00 C ATOM 0 H ILE B 11 -1.965 4.917 -8.077 1.00 0.00 H new ATOM 0 HA ILE B 11 0.949 4.506 -7.881 1.00 0.00 H new ATOM 0 HB ILE B 11 -0.684 5.979 -9.996 1.00 0.00 H new ATOM 0 HG12 ILE B 11 1.118 3.536 -10.148 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -0.633 3.517 -10.213 1.00 0.00 H new ATOM 0 HG21 ILE B 11 1.473 6.464 -11.081 1.00 0.00 H new ATOM 0 HG22 ILE B 11 1.358 7.226 -9.477 1.00 0.00 H new ATOM 0 HG23 ILE B 11 2.329 5.751 -9.693 1.00 0.00 H new ATOM 0 HD11 ILE B 11 0.329 3.302 -12.449 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -0.583 4.824 -12.305 1.00 0.00 H new ATOM 0 HD13 ILE B 11 1.196 4.843 -12.239 1.00 0.00 H new ATOM 859 N VAL B 12 1.224 6.571 -6.564 1.00 0.00 N ATOM 860 CA VAL B 12 1.475 7.772 -5.778 1.00 0.00 C ATOM 861 C VAL B 12 2.809 8.370 -6.213 1.00 0.00 C ATOM 862 O VAL B 12 3.765 7.637 -6.463 1.00 0.00 O ATOM 863 CB VAL B 12 1.512 7.460 -4.269 1.00 0.00 C ATOM 864 CG1 VAL B 12 1.642 8.737 -3.456 1.00 0.00 C ATOM 865 CG2 VAL B 12 0.267 6.690 -3.860 1.00 0.00 C ATOM 0 H VAL B 12 1.898 5.823 -6.401 1.00 0.00 H new ATOM 0 HA VAL B 12 0.664 8.480 -5.950 1.00 0.00 H new ATOM 0 HB VAL B 12 2.386 6.841 -4.067 1.00 0.00 H new ATOM 0 HG11 VAL B 12 1.666 8.492 -2.394 1.00 0.00 H new ATOM 0 HG12 VAL B 12 2.563 9.251 -3.731 1.00 0.00 H new ATOM 0 HG13 VAL B 12 0.790 9.386 -3.659 1.00 0.00 H new ATOM 0 HG21 VAL B 12 0.306 6.476 -2.792 1.00 0.00 H new ATOM 0 HG22 VAL B 12 -0.618 7.287 -4.078 1.00 0.00 H new ATOM 0 HG23 VAL B 12 0.219 5.754 -4.416 1.00 0.00 H new ATOM 875 N LYS B 13 2.883 9.688 -6.303 1.00 0.00 N ATOM 876 CA LYS B 13 4.108 10.338 -6.755 1.00 0.00 C ATOM 877 C LYS B 13 4.779 11.108 -5.629 1.00 0.00 C ATOM 878 O LYS B 13 4.170 11.360 -4.592 1.00 0.00 O ATOM 879 CB LYS B 13 3.828 11.290 -7.928 1.00 0.00 C ATOM 880 CG LYS B 13 2.754 10.800 -8.888 1.00 0.00 C ATOM 881 CD LYS B 13 1.371 11.217 -8.420 1.00 0.00 C ATOM 882 CE LYS B 13 0.298 10.263 -8.913 1.00 0.00 C ATOM 883 NZ LYS B 13 -0.761 10.054 -7.890 1.00 0.00 N ATOM 0 H LYS B 13 2.120 10.325 -6.073 1.00 0.00 H new ATOM 0 HA LYS B 13 4.782 9.549 -7.088 1.00 0.00 H new ATOM 0 HB2 LYS B 13 3.529 12.260 -7.530 1.00 0.00 H new ATOM 0 HB3 LYS B 13 4.753 11.445 -8.484 1.00 0.00 H new ATOM 0 HG2 LYS B 13 2.941 11.202 -9.884 1.00 0.00 H new ATOM 0 HG3 LYS B 13 2.802 9.714 -8.969 1.00 0.00 H new ATOM 0 HD2 LYS B 13 1.352 11.254 -7.331 1.00 0.00 H new ATOM 0 HD3 LYS B 13 1.154 12.224 -8.777 1.00 0.00 H new ATOM 0 HE2 LYS B 13 -0.149 10.658 -9.825 1.00 0.00 H new ATOM 0 HE3 LYS B 13 0.751 9.305 -9.169 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 -0.750 9.063 -7.576 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 -0.585 10.677 -7.076 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 -1.690 10.276 -8.302 1.00 0.00 H new ATOM 897 N LYS B 14 6.036 11.483 -5.871 1.00 0.00 N ATOM 898 CA LYS B 14 6.851 12.234 -4.923 1.00 0.00 C ATOM 899 C LYS B 14 6.748 11.678 -3.505 1.00 0.00 C ATOM 900 O LYS B 14 6.262 12.344 -2.592 1.00 0.00 O ATOM 901 CB LYS B 14 6.451 13.702 -4.972 1.00 0.00 C ATOM 902 CG LYS B 14 7.165 14.491 -6.060 1.00 0.00 C ATOM 903 CD LYS B 14 8.648 14.651 -5.761 1.00 0.00 C ATOM 904 CE LYS B 14 9.495 14.434 -7.007 1.00 0.00 C ATOM 905 NZ LYS B 14 10.007 13.042 -7.091 1.00 0.00 N ATOM 0 H LYS B 14 6.520 11.269 -6.743 1.00 0.00 H new ATOM 0 HA LYS B 14 7.897 12.134 -5.213 1.00 0.00 H new ATOM 0 HB2 LYS B 14 5.375 13.772 -5.131 1.00 0.00 H new ATOM 0 HB3 LYS B 14 6.661 14.160 -4.005 1.00 0.00 H new ATOM 0 HG2 LYS B 14 7.040 13.985 -7.017 1.00 0.00 H new ATOM 0 HG3 LYS B 14 6.705 15.475 -6.157 1.00 0.00 H new ATOM 0 HD2 LYS B 14 8.834 15.648 -5.362 1.00 0.00 H new ATOM 0 HD3 LYS B 14 8.944 13.939 -4.990 1.00 0.00 H new ATOM 0 HE2 LYS B 14 8.901 14.657 -7.893 1.00 0.00 H new ATOM 0 HE3 LYS B 14 10.334 15.130 -7.002 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 11.044 13.058 -7.168 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 9.731 12.518 -6.236 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 9.605 12.574 -7.928 1.00 0.00 H new ATOM 919 N VAL B 15 7.207 10.450 -3.338 1.00 0.00 N ATOM 920 CA VAL B 15 7.189 9.786 -2.046 1.00 0.00 C ATOM 921 C VAL B 15 8.615 9.546 -1.587 1.00 0.00 C ATOM 922 O VAL B 15 9.420 8.980 -2.323 1.00 0.00 O ATOM 923 CB VAL B 15 6.421 8.452 -2.105 1.00 0.00 C ATOM 924 CG1 VAL B 15 6.505 7.704 -0.779 1.00 0.00 C ATOM 925 CG2 VAL B 15 4.973 8.705 -2.480 1.00 0.00 C ATOM 0 H VAL B 15 7.601 9.887 -4.091 1.00 0.00 H new ATOM 0 HA VAL B 15 6.673 10.431 -1.335 1.00 0.00 H new ATOM 0 HB VAL B 15 6.884 7.826 -2.868 1.00 0.00 H new ATOM 0 HG11 VAL B 15 5.953 6.767 -0.854 1.00 0.00 H new ATOM 0 HG12 VAL B 15 7.549 7.492 -0.546 1.00 0.00 H new ATOM 0 HG13 VAL B 15 6.074 8.317 0.012 1.00 0.00 H new ATOM 0 HG21 VAL B 15 4.436 7.757 -2.520 1.00 0.00 H new ATOM 0 HG22 VAL B 15 4.512 9.352 -1.734 1.00 0.00 H new ATOM 0 HG23 VAL B 15 4.929 9.188 -3.456 1.00 0.00 H new ATOM 935 N ARG B 16 8.920 9.976 -0.382 1.00 0.00 N ATOM 936 CA ARG B 16 10.257 9.839 0.156 1.00 0.00 C ATOM 937 C ARG B 16 10.375 8.704 1.154 1.00 0.00 C ATOM 938 O ARG B 16 9.512 8.510 2.011 1.00 0.00 O ATOM 939 CB ARG B 16 10.685 11.130 0.834 1.00 0.00 C ATOM 940 CG ARG B 16 11.203 12.178 -0.124 1.00 0.00 C ATOM 941 CD ARG B 16 12.428 12.864 0.442 1.00 0.00 C ATOM 942 NE ARG B 16 12.212 13.342 1.808 1.00 0.00 N ATOM 943 CZ ARG B 16 12.121 14.628 2.132 1.00 0.00 C ATOM 944 NH1 ARG B 16 12.319 15.558 1.210 1.00 0.00 N ATOM 945 NH2 ARG B 16 11.877 14.977 3.384 1.00 0.00 N ATOM 0 H ARG B 16 8.256 10.426 0.248 1.00 0.00 H new ATOM 0 HA ARG B 16 10.907 9.614 -0.689 1.00 0.00 H new ATOM 0 HB2 ARG B 16 9.837 11.540 1.383 1.00 0.00 H new ATOM 0 HB3 ARG B 16 11.460 10.905 1.566 1.00 0.00 H new ATOM 0 HG2 ARG B 16 11.449 11.714 -1.079 1.00 0.00 H new ATOM 0 HG3 ARG B 16 10.425 12.916 -0.319 1.00 0.00 H new ATOM 0 HD2 ARG B 16 13.269 12.170 0.430 1.00 0.00 H new ATOM 0 HD3 ARG B 16 12.699 13.705 -0.197 1.00 0.00 H new ATOM 0 HE ARG B 16 12.127 12.650 2.553 1.00 0.00 H new ATOM 0 HH11 ARG B 16 12.541 15.287 0.252 1.00 0.00 H new ATOM 0 HH12 ARG B 16 12.249 16.545 1.458 1.00 0.00 H new ATOM 0 HH21 ARG B 16 11.759 14.260 4.100 1.00 0.00 H new ATOM 0 HH22 ARG B 16 11.807 15.963 3.634 1.00 0.00 H new ATOM 959 N GLN B 17 11.456 7.963 1.030 1.00 0.00 N ATOM 960 CA GLN B 17 11.752 6.877 1.936 1.00 0.00 C ATOM 961 C GLN B 17 13.087 7.174 2.602 1.00 0.00 C ATOM 962 O GLN B 17 14.136 6.988 1.995 1.00 0.00 O ATOM 963 CB GLN B 17 11.814 5.552 1.173 1.00 0.00 C ATOM 964 CG GLN B 17 11.251 4.371 1.944 1.00 0.00 C ATOM 965 CD GLN B 17 12.196 3.855 3.011 1.00 0.00 C ATOM 966 OE1 GLN B 17 13.415 3.900 2.861 1.00 0.00 O ATOM 967 NE2 GLN B 17 11.635 3.369 4.103 1.00 0.00 N ATOM 0 H GLN B 17 12.153 8.098 0.298 1.00 0.00 H new ATOM 0 HA GLN B 17 10.970 6.788 2.690 1.00 0.00 H new ATOM 0 HB2 GLN B 17 11.265 5.657 0.237 1.00 0.00 H new ATOM 0 HB3 GLN B 17 12.851 5.342 0.913 1.00 0.00 H new ATOM 0 HG2 GLN B 17 10.310 4.664 2.410 1.00 0.00 H new ATOM 0 HG3 GLN B 17 11.024 3.564 1.247 1.00 0.00 H new ATOM 0 HE21 GLN B 17 10.619 3.349 4.189 1.00 0.00 H new ATOM 0 HE22 GLN B 17 12.218 3.013 4.861 1.00 0.00 H new ATOM 976 N LYS B 18 13.029 7.631 3.850 1.00 0.00 N ATOM 977 CA LYS B 18 14.216 7.980 4.622 1.00 0.00 C ATOM 978 C LYS B 18 15.230 8.803 3.808 1.00 0.00 C ATOM 979 O LYS B 18 16.326 8.325 3.512 1.00 0.00 O ATOM 980 CB LYS B 18 14.850 6.708 5.166 1.00 0.00 C ATOM 981 CG LYS B 18 14.131 6.126 6.377 1.00 0.00 C ATOM 982 CD LYS B 18 13.722 7.201 7.377 1.00 0.00 C ATOM 983 CE LYS B 18 14.913 7.745 8.149 1.00 0.00 C ATOM 984 NZ LYS B 18 14.487 8.615 9.274 1.00 0.00 N ATOM 0 H LYS B 18 12.154 7.770 4.355 1.00 0.00 H new ATOM 0 HA LYS B 18 13.907 8.618 5.450 1.00 0.00 H new ATOM 0 HB2 LYS B 18 14.873 5.959 4.375 1.00 0.00 H new ATOM 0 HB3 LYS B 18 15.885 6.917 5.437 1.00 0.00 H new ATOM 0 HG2 LYS B 18 13.245 5.585 6.045 1.00 0.00 H new ATOM 0 HG3 LYS B 18 14.781 5.402 6.870 1.00 0.00 H new ATOM 0 HD2 LYS B 18 13.229 8.017 6.850 1.00 0.00 H new ATOM 0 HD3 LYS B 18 12.995 6.788 8.076 1.00 0.00 H new ATOM 0 HE2 LYS B 18 15.506 6.916 8.535 1.00 0.00 H new ATOM 0 HE3 LYS B 18 15.556 8.311 7.475 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 15.229 9.316 9.471 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 13.606 9.105 9.019 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 14.327 8.033 10.121 1.00 0.00 H new ATOM 998 N LYS B 19 14.830 10.025 3.432 1.00 0.00 N ATOM 999 CA LYS B 19 15.672 10.946 2.660 1.00 0.00 C ATOM 1000 C LYS B 19 15.908 10.498 1.216 1.00 0.00 C ATOM 1001 O LYS B 19 16.846 10.956 0.566 1.00 0.00 O ATOM 1002 CB LYS B 19 16.989 11.161 3.383 1.00 0.00 C ATOM 1003 CG LYS B 19 16.985 12.349 4.331 1.00 0.00 C ATOM 1004 CD LYS B 19 17.523 13.598 3.645 1.00 0.00 C ATOM 1005 CE LYS B 19 16.550 14.760 3.738 1.00 0.00 C ATOM 1006 NZ LYS B 19 15.201 14.399 3.232 1.00 0.00 N ATOM 0 H LYS B 19 13.910 10.403 3.656 1.00 0.00 H new ATOM 0 HA LYS B 19 15.129 11.889 2.589 1.00 0.00 H new ATOM 0 HB2 LYS B 19 17.234 10.260 3.946 1.00 0.00 H new ATOM 0 HB3 LYS B 19 17.779 11.300 2.645 1.00 0.00 H new ATOM 0 HG2 LYS B 19 15.971 12.533 4.685 1.00 0.00 H new ATOM 0 HG3 LYS B 19 17.592 12.121 5.207 1.00 0.00 H new ATOM 0 HD2 LYS B 19 18.472 13.882 4.100 1.00 0.00 H new ATOM 0 HD3 LYS B 19 17.726 13.378 2.597 1.00 0.00 H new ATOM 0 HE2 LYS B 19 16.473 15.086 4.775 1.00 0.00 H new ATOM 0 HE3 LYS B 19 16.937 15.604 3.167 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 14.597 15.246 3.218 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 15.283 14.016 2.268 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 14.777 13.682 3.854 1.00 0.00 H new ATOM 1020 N GLN B 20 15.051 9.628 0.711 1.00 0.00 N ATOM 1021 CA GLN B 20 15.165 9.168 -0.667 1.00 0.00 C ATOM 1022 C GLN B 20 13.888 9.511 -1.414 1.00 0.00 C ATOM 1023 O GLN B 20 12.816 9.032 -1.060 1.00 0.00 O ATOM 1024 CB GLN B 20 15.412 7.660 -0.731 1.00 0.00 C ATOM 1025 CG GLN B 20 16.685 7.208 -0.038 1.00 0.00 C ATOM 1026 CD GLN B 20 16.778 5.699 0.059 1.00 0.00 C ATOM 1027 OE1 GLN B 20 17.364 5.042 -0.801 1.00 0.00 O ATOM 1028 NE2 GLN B 20 16.180 5.138 1.097 1.00 0.00 N ATOM 0 H GLN B 20 14.270 9.226 1.230 1.00 0.00 H new ATOM 0 HA GLN B 20 16.016 9.667 -1.130 1.00 0.00 H new ATOM 0 HB2 GLN B 20 14.564 7.145 -0.280 1.00 0.00 H new ATOM 0 HB3 GLN B 20 15.452 7.354 -1.776 1.00 0.00 H new ATOM 0 HG2 GLN B 20 17.549 7.589 -0.583 1.00 0.00 H new ATOM 0 HG3 GLN B 20 16.724 7.638 0.963 1.00 0.00 H new ATOM 0 HE21 GLN B 20 15.705 5.719 1.788 1.00 0.00 H new ATOM 0 HE22 GLN B 20 16.194 4.124 1.207 1.00 0.00 H new ATOM 1037 N ASP B 21 14.000 10.346 -2.431 1.00 0.00 N ATOM 1038 CA ASP B 21 12.837 10.757 -3.212 1.00 0.00 C ATOM 1039 C ASP B 21 12.486 9.715 -4.272 1.00 0.00 C ATOM 1040 O ASP B 21 13.373 9.090 -4.862 1.00 0.00 O ATOM 1041 CB ASP B 21 13.097 12.116 -3.865 1.00 0.00 C ATOM 1042 CG ASP B 21 12.002 12.515 -4.835 1.00 0.00 C ATOM 1043 OD1 ASP B 21 12.329 12.913 -5.970 1.00 0.00 O ATOM 1044 OD2 ASP B 21 10.807 12.422 -4.471 1.00 0.00 O ATOM 0 H ASP B 21 14.882 10.755 -2.739 1.00 0.00 H new ATOM 0 HA ASP B 21 11.987 10.844 -2.536 1.00 0.00 H new ATOM 0 HB2 ASP B 21 13.185 12.877 -3.089 1.00 0.00 H new ATOM 0 HB3 ASP B 21 14.051 12.085 -4.392 1.00 0.00 H new ATOM 1049 N GLY B 22 11.192 9.526 -4.501 1.00 0.00 N ATOM 1050 CA GLY B 22 10.739 8.564 -5.481 1.00 0.00 C ATOM 1051 C GLY B 22 9.230 8.550 -5.635 1.00 0.00 C ATOM 1052 O GLY B 22 8.575 9.586 -5.526 1.00 0.00 O ATOM 0 H GLY B 22 10.445 10.027 -4.020 1.00 0.00 H new ATOM 0 HA2 GLY B 22 11.196 8.790 -6.444 1.00 0.00 H new ATOM 0 HA3 GLY B 22 11.080 7.570 -5.192 1.00 0.00 H new ATOM 1056 N ALA B 23 8.682 7.370 -5.883 1.00 0.00 N ATOM 1057 CA ALA B 23 7.247 7.197 -6.063 1.00 0.00 C ATOM 1058 C ALA B 23 6.792 5.869 -5.473 1.00 0.00 C ATOM 1059 O ALA B 23 7.528 4.880 -5.506 1.00 0.00 O ATOM 1060 CB ALA B 23 6.890 7.274 -7.540 1.00 0.00 C ATOM 0 H ALA B 23 9.218 6.506 -5.965 1.00 0.00 H new ATOM 0 HA ALA B 23 6.731 8.000 -5.537 1.00 0.00 H new ATOM 0 HB1 ALA B 23 5.815 7.143 -7.662 1.00 0.00 H new ATOM 0 HB2 ALA B 23 7.184 8.246 -7.935 1.00 0.00 H new ATOM 0 HB3 ALA B 23 7.415 6.488 -8.083 1.00 0.00 H new ATOM 1066 N LEU B 24 5.582 5.851 -4.936 1.00 0.00 N ATOM 1067 CA LEU B 24 5.032 4.649 -4.330 1.00 0.00 C ATOM 1068 C LEU B 24 3.976 4.032 -5.236 1.00 0.00 C ATOM 1069 O LEU B 24 3.084 4.720 -5.731 1.00 0.00 O ATOM 1070 CB LEU B 24 4.430 4.961 -2.961 1.00 0.00 C ATOM 1071 CG LEU B 24 4.000 3.732 -2.163 1.00 0.00 C ATOM 1072 CD1 LEU B 24 5.197 3.075 -1.499 1.00 0.00 C ATOM 1073 CD2 LEU B 24 2.948 4.106 -1.131 1.00 0.00 C ATOM 0 H LEU B 24 4.960 6.659 -4.908 1.00 0.00 H new ATOM 0 HA LEU B 24 5.844 3.934 -4.197 1.00 0.00 H new ATOM 0 HB2 LEU B 24 5.160 5.521 -2.376 1.00 0.00 H new ATOM 0 HB3 LEU B 24 3.565 5.610 -3.098 1.00 0.00 H new ATOM 0 HG LEU B 24 3.560 3.013 -2.854 1.00 0.00 H new ATOM 0 HD11 LEU B 24 4.867 2.202 -0.936 1.00 0.00 H new ATOM 0 HD12 LEU B 24 5.912 2.766 -2.262 1.00 0.00 H new ATOM 0 HD13 LEU B 24 5.672 3.785 -0.822 1.00 0.00 H new ATOM 0 HD21 LEU B 24 2.654 3.217 -0.572 1.00 0.00 H new ATOM 0 HD22 LEU B 24 3.359 4.847 -0.445 1.00 0.00 H new ATOM 0 HD23 LEU B 24 2.076 4.523 -1.635 1.00 0.00 H new ATOM 1085 N TYR B 25 4.086 2.735 -5.449 1.00 0.00 N ATOM 1086 CA TYR B 25 3.153 2.018 -6.303 1.00 0.00 C ATOM 1087 C TYR B 25 2.528 0.835 -5.571 1.00 0.00 C ATOM 1088 O TYR B 25 3.226 -0.104 -5.180 1.00 0.00 O ATOM 1089 CB TYR B 25 3.867 1.513 -7.562 1.00 0.00 C ATOM 1090 CG TYR B 25 4.436 2.607 -8.438 1.00 0.00 C ATOM 1091 CD1 TYR B 25 5.710 3.114 -8.213 1.00 0.00 C ATOM 1092 CD2 TYR B 25 3.703 3.126 -9.496 1.00 0.00 C ATOM 1093 CE1 TYR B 25 6.235 4.107 -9.017 1.00 0.00 C ATOM 1094 CE2 TYR B 25 4.221 4.119 -10.303 1.00 0.00 C ATOM 1095 CZ TYR B 25 5.486 4.607 -10.060 1.00 0.00 C ATOM 1096 OH TYR B 25 6.002 5.597 -10.864 1.00 0.00 O ATOM 0 H TYR B 25 4.816 2.151 -5.041 1.00 0.00 H new ATOM 0 HA TYR B 25 2.361 2.713 -6.582 1.00 0.00 H new ATOM 0 HB2 TYR B 25 4.676 0.846 -7.264 1.00 0.00 H new ATOM 0 HB3 TYR B 25 3.166 0.921 -8.150 1.00 0.00 H new ATOM 0 HD1 TYR B 25 6.300 2.725 -7.396 1.00 0.00 H new ATOM 0 HD2 TYR B 25 2.711 2.747 -9.691 1.00 0.00 H new ATOM 0 HE1 TYR B 25 7.227 4.490 -8.829 1.00 0.00 H new ATOM 0 HE2 TYR B 25 3.637 4.512 -11.122 1.00 0.00 H new ATOM 0 HH TYR B 25 5.346 5.835 -11.552 1.00 0.00 H new ATOM 1106 N LEU B 26 1.218 0.884 -5.372 1.00 0.00 N ATOM 1107 CA LEU B 26 0.514 -0.214 -4.726 1.00 0.00 C ATOM 1108 C LEU B 26 0.226 -1.264 -5.777 1.00 0.00 C ATOM 1109 O LEU B 26 -0.338 -0.953 -6.823 1.00 0.00 O ATOM 1110 CB LEU B 26 -0.795 0.240 -4.076 1.00 0.00 C ATOM 1111 CG LEU B 26 -0.653 1.233 -2.924 1.00 0.00 C ATOM 1112 CD1 LEU B 26 -1.857 1.153 -1.998 1.00 0.00 C ATOM 1113 CD2 LEU B 26 0.622 0.987 -2.149 1.00 0.00 C ATOM 0 H LEU B 26 0.625 1.667 -5.647 1.00 0.00 H new ATOM 0 HA LEU B 26 1.142 -0.613 -3.929 1.00 0.00 H new ATOM 0 HB2 LEU B 26 -1.424 0.690 -4.844 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -1.322 -0.641 -3.709 1.00 0.00 H new ATOM 0 HG LEU B 26 -0.605 2.235 -3.349 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -1.738 1.868 -1.184 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -2.762 1.388 -2.557 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -1.935 0.146 -1.589 1.00 0.00 H new ATOM 0 HD21 LEU B 26 0.698 1.708 -1.335 1.00 0.00 H new ATOM 0 HD22 LEU B 26 0.610 -0.023 -1.739 1.00 0.00 H new ATOM 0 HD23 LEU B 26 1.479 1.099 -2.813 1.00 0.00 H new ATOM 1125 N MET B 27 0.609 -2.493 -5.517 1.00 0.00 N ATOM 1126 CA MET B 27 0.413 -3.554 -6.482 1.00 0.00 C ATOM 1127 C MET B 27 -0.617 -4.552 -5.984 1.00 0.00 C ATOM 1128 O MET B 27 -0.980 -4.539 -4.809 1.00 0.00 O ATOM 1129 CB MET B 27 1.729 -4.263 -6.755 1.00 0.00 C ATOM 1130 CG MET B 27 2.949 -3.377 -6.570 1.00 0.00 C ATOM 1131 SD MET B 27 4.412 -4.029 -7.384 1.00 0.00 S ATOM 1132 CE MET B 27 4.315 -3.120 -8.915 1.00 0.00 C ATOM 0 H MET B 27 1.057 -2.784 -4.648 1.00 0.00 H new ATOM 0 HA MET B 27 0.046 -3.110 -7.407 1.00 0.00 H new ATOM 0 HB2 MET B 27 1.812 -5.124 -6.092 1.00 0.00 H new ATOM 0 HB3 MET B 27 1.720 -4.646 -7.775 1.00 0.00 H new ATOM 0 HG2 MET B 27 2.733 -2.383 -6.962 1.00 0.00 H new ATOM 0 HG3 MET B 27 3.152 -3.263 -5.505 1.00 0.00 H new ATOM 0 HE1 MET B 27 4.935 -3.607 -9.667 1.00 0.00 H new ATOM 0 HE2 MET B 27 3.281 -3.095 -9.258 1.00 0.00 H new ATOM 0 HE3 MET B 27 4.670 -2.102 -8.757 1.00 0.00 H new ATOM 1142 N ALA B 28 -1.046 -5.431 -6.878 1.00 0.00 N ATOM 1143 CA ALA B 28 -2.061 -6.438 -6.580 1.00 0.00 C ATOM 1144 C ALA B 28 -1.831 -7.181 -5.262 1.00 0.00 C ATOM 1145 O ALA B 28 -2.718 -7.223 -4.413 1.00 0.00 O ATOM 1146 CB ALA B 28 -2.147 -7.433 -7.728 1.00 0.00 C ATOM 0 H ALA B 28 -0.699 -5.468 -7.837 1.00 0.00 H new ATOM 0 HA ALA B 28 -3.002 -5.901 -6.464 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -2.905 -8.183 -7.503 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -2.416 -6.908 -8.645 1.00 0.00 H new ATOM 0 HB3 ALA B 28 -1.181 -7.921 -7.860 1.00 0.00 H new ATOM 1152 N GLU B 29 -0.647 -7.751 -5.073 1.00 0.00 N ATOM 1153 CA GLU B 29 -0.370 -8.512 -3.859 1.00 0.00 C ATOM 1154 C GLU B 29 0.729 -7.872 -3.020 1.00 0.00 C ATOM 1155 O GLU B 29 1.189 -8.470 -2.042 1.00 0.00 O ATOM 1156 CB GLU B 29 0.087 -9.930 -4.220 1.00 0.00 C ATOM 1157 CG GLU B 29 -0.459 -10.451 -5.538 1.00 0.00 C ATOM 1158 CD GLU B 29 0.472 -10.123 -6.692 1.00 0.00 C ATOM 1159 OE1 GLU B 29 1.051 -9.009 -6.690 1.00 0.00 O ATOM 1160 OE2 GLU B 29 0.647 -10.971 -7.583 1.00 0.00 O ATOM 0 H GLU B 29 0.128 -7.703 -5.734 1.00 0.00 H new ATOM 0 HA GLU B 29 -1.295 -8.530 -3.283 1.00 0.00 H new ATOM 0 HB2 GLU B 29 1.176 -9.948 -4.260 1.00 0.00 H new ATOM 0 HB3 GLU B 29 -0.214 -10.609 -3.423 1.00 0.00 H new ATOM 0 HG2 GLU B 29 -0.597 -11.530 -5.475 1.00 0.00 H new ATOM 0 HG3 GLU B 29 -1.440 -10.015 -5.725 1.00 0.00 H new ATOM 1167 N ARG B 30 1.143 -6.658 -3.357 1.00 0.00 N ATOM 1168 CA ARG B 30 2.236 -6.041 -2.616 1.00 0.00 C ATOM 1169 C ARG B 30 2.287 -4.537 -2.787 1.00 0.00 C ATOM 1170 O ARG B 30 1.587 -3.970 -3.608 1.00 0.00 O ATOM 1171 CB ARG B 30 3.575 -6.630 -3.078 1.00 0.00 C ATOM 1172 CG ARG B 30 3.910 -6.345 -4.540 1.00 0.00 C ATOM 1173 CD ARG B 30 3.716 -7.575 -5.413 1.00 0.00 C ATOM 1174 NE ARG B 30 4.612 -7.568 -6.568 1.00 0.00 N ATOM 1175 CZ ARG B 30 4.492 -8.386 -7.614 1.00 0.00 C ATOM 1176 NH1 ARG B 30 3.462 -9.217 -7.708 1.00 0.00 N ATOM 1177 NH2 ARG B 30 5.381 -8.336 -8.596 1.00 0.00 N ATOM 0 H ARG B 30 0.754 -6.095 -4.114 1.00 0.00 H new ATOM 0 HA ARG B 30 2.057 -6.253 -1.562 1.00 0.00 H new ATOM 0 HB2 ARG B 30 4.371 -6.231 -2.450 1.00 0.00 H new ATOM 0 HB3 ARG B 30 3.558 -7.709 -2.924 1.00 0.00 H new ATOM 0 HG2 ARG B 30 3.279 -5.536 -4.907 1.00 0.00 H new ATOM 0 HG3 ARG B 30 4.942 -6.004 -4.617 1.00 0.00 H new ATOM 0 HD2 ARG B 30 3.894 -8.473 -4.821 1.00 0.00 H new ATOM 0 HD3 ARG B 30 2.682 -7.618 -5.755 1.00 0.00 H new ATOM 0 HE ARG B 30 5.378 -6.894 -6.574 1.00 0.00 H new ATOM 0 HH11 ARG B 30 2.752 -9.234 -6.976 1.00 0.00 H new ATOM 0 HH12 ARG B 30 3.380 -9.839 -8.513 1.00 0.00 H new ATOM 0 HH21 ARG B 30 6.155 -7.673 -8.550 1.00 0.00 H new ATOM 0 HH22 ARG B 30 5.291 -8.961 -9.397 1.00 0.00 H new ATOM 1191 N ILE B 31 3.125 -3.906 -1.988 1.00 0.00 N ATOM 1192 CA ILE B 31 3.336 -2.476 -2.061 1.00 0.00 C ATOM 1193 C ILE B 31 4.813 -2.235 -2.329 1.00 0.00 C ATOM 1194 O ILE B 31 5.675 -2.754 -1.614 1.00 0.00 O ATOM 1195 CB ILE B 31 2.892 -1.744 -0.767 1.00 0.00 C ATOM 1196 CG1 ILE B 31 3.455 -0.319 -0.724 1.00 0.00 C ATOM 1197 CG2 ILE B 31 3.318 -2.523 0.466 1.00 0.00 C ATOM 1198 CD1 ILE B 31 2.994 0.483 0.476 1.00 0.00 C ATOM 0 H ILE B 31 3.679 -4.372 -1.269 1.00 0.00 H new ATOM 0 HA ILE B 31 2.723 -2.070 -2.865 1.00 0.00 H new ATOM 0 HB ILE B 31 1.804 -1.680 -0.773 1.00 0.00 H new ATOM 0 HG12 ILE B 31 4.544 -0.368 -0.720 1.00 0.00 H new ATOM 0 HG13 ILE B 31 3.163 0.205 -1.634 1.00 0.00 H new ATOM 0 HG21 ILE B 31 2.996 -1.991 1.361 1.00 0.00 H new ATOM 0 HG22 ILE B 31 2.861 -3.512 0.447 1.00 0.00 H new ATOM 0 HG23 ILE B 31 4.403 -2.625 0.475 1.00 0.00 H new ATOM 0 HD11 ILE B 31 3.433 1.480 0.438 1.00 0.00 H new ATOM 0 HD12 ILE B 31 1.907 0.564 0.463 1.00 0.00 H new ATOM 0 HD13 ILE B 31 3.310 -0.018 1.391 1.00 0.00 H new ATOM 1210 N ALA B 32 5.111 -1.480 -3.370 1.00 0.00 N ATOM 1211 CA ALA B 32 6.490 -1.226 -3.724 1.00 0.00 C ATOM 1212 C ALA B 32 6.777 0.257 -3.884 1.00 0.00 C ATOM 1213 O ALA B 32 5.893 1.050 -4.208 1.00 0.00 O ATOM 1214 CB ALA B 32 6.844 -1.979 -4.995 1.00 0.00 C ATOM 0 H ALA B 32 4.423 -1.037 -3.978 1.00 0.00 H new ATOM 0 HA ALA B 32 7.114 -1.584 -2.905 1.00 0.00 H new ATOM 0 HB1 ALA B 32 7.884 -1.783 -5.256 1.00 0.00 H new ATOM 0 HB2 ALA B 32 6.705 -3.048 -4.835 1.00 0.00 H new ATOM 0 HB3 ALA B 32 6.197 -1.646 -5.807 1.00 0.00 H new ATOM 1220 N TRP B 33 8.025 0.614 -3.647 1.00 0.00 N ATOM 1221 CA TRP B 33 8.474 1.987 -3.762 1.00 0.00 C ATOM 1222 C TRP B 33 9.747 2.038 -4.595 1.00 0.00 C ATOM 1223 O TRP B 33 10.647 1.212 -4.416 1.00 0.00 O ATOM 1224 CB TRP B 33 8.723 2.591 -2.374 1.00 0.00 C ATOM 1225 CG TRP B 33 9.285 3.980 -2.424 1.00 0.00 C ATOM 1226 CD1 TRP B 33 8.586 5.145 -2.556 1.00 0.00 C ATOM 1227 CD2 TRP B 33 10.666 4.346 -2.353 1.00 0.00 C ATOM 1228 NE1 TRP B 33 9.452 6.211 -2.582 1.00 0.00 N ATOM 1229 CE2 TRP B 33 10.732 5.746 -2.457 1.00 0.00 C ATOM 1230 CE3 TRP B 33 11.854 3.624 -2.214 1.00 0.00 C ATOM 1231 CZ2 TRP B 33 11.937 6.438 -2.428 1.00 0.00 C ATOM 1232 CZ3 TRP B 33 13.050 4.313 -2.182 1.00 0.00 C ATOM 1233 CH2 TRP B 33 13.083 5.707 -2.290 1.00 0.00 C ATOM 0 H TRP B 33 8.756 -0.041 -3.369 1.00 0.00 H new ATOM 0 HA TRP B 33 7.698 2.573 -4.254 1.00 0.00 H new ATOM 0 HB2 TRP B 33 7.785 2.606 -1.818 1.00 0.00 H new ATOM 0 HB3 TRP B 33 9.410 1.948 -1.824 1.00 0.00 H new ATOM 0 HD1 TRP B 33 7.511 5.218 -2.629 1.00 0.00 H new ATOM 0 HE1 TRP B 33 9.184 7.190 -2.679 1.00 0.00 H new ATOM 0 HE3 TRP B 33 11.837 2.547 -2.133 1.00 0.00 H new ATOM 0 HZ2 TRP B 33 11.966 7.514 -2.512 1.00 0.00 H new ATOM 0 HZ3 TRP B 33 13.975 3.767 -2.072 1.00 0.00 H new ATOM 0 HH2 TRP B 33 14.035 6.217 -2.264 1.00 0.00 H new ATOM 1244 N ALA B 34 9.814 2.995 -5.502 1.00 0.00 N ATOM 1245 CA ALA B 34 10.974 3.155 -6.359 1.00 0.00 C ATOM 1246 C ALA B 34 11.448 4.599 -6.342 1.00 0.00 C ATOM 1247 O ALA B 34 10.630 5.516 -6.319 1.00 0.00 O ATOM 1248 CB ALA B 34 10.642 2.727 -7.781 1.00 0.00 C ATOM 0 H ALA B 34 9.073 3.677 -5.665 1.00 0.00 H new ATOM 0 HA ALA B 34 11.776 2.521 -5.981 1.00 0.00 H new ATOM 0 HB1 ALA B 34 11.521 2.852 -8.413 1.00 0.00 H new ATOM 0 HB2 ALA B 34 10.339 1.680 -7.784 1.00 0.00 H new ATOM 0 HB3 ALA B 34 9.828 3.342 -8.165 1.00 0.00 H new ATOM 1254 N PRO B 35 12.770 4.820 -6.320 1.00 0.00 N ATOM 1255 CA PRO B 35 13.344 6.167 -6.323 1.00 0.00 C ATOM 1256 C PRO B 35 13.000 6.912 -7.609 1.00 0.00 C ATOM 1257 O PRO B 35 12.707 6.289 -8.631 1.00 0.00 O ATOM 1258 CB PRO B 35 14.856 5.926 -6.226 1.00 0.00 C ATOM 1259 CG PRO B 35 15.000 4.520 -5.748 1.00 0.00 C ATOM 1260 CD PRO B 35 13.807 3.780 -6.279 1.00 0.00 C ATOM 0 HA PRO B 35 12.959 6.782 -5.510 1.00 0.00 H new ATOM 0 HB2 PRO B 35 15.339 6.064 -7.193 1.00 0.00 H new ATOM 0 HB3 PRO B 35 15.322 6.627 -5.534 1.00 0.00 H new ATOM 0 HG2 PRO B 35 15.927 4.077 -6.111 1.00 0.00 H new ATOM 0 HG3 PRO B 35 15.032 4.479 -4.659 1.00 0.00 H new ATOM 0 HD2 PRO B 35 13.998 3.360 -7.267 1.00 0.00 H new ATOM 0 HD3 PRO B 35 13.523 2.951 -5.630 1.00 0.00 H new ATOM 1268 N GLU B 36 13.043 8.237 -7.560 1.00 0.00 N ATOM 1269 CA GLU B 36 12.714 9.054 -8.723 1.00 0.00 C ATOM 1270 C GLU B 36 13.586 8.692 -9.922 1.00 0.00 C ATOM 1271 O GLU B 36 14.810 8.542 -9.803 1.00 0.00 O ATOM 1272 CB GLU B 36 12.853 10.543 -8.394 1.00 0.00 C ATOM 1273 CG GLU B 36 12.246 11.456 -9.451 1.00 0.00 C ATOM 1274 CD GLU B 36 10.825 11.066 -9.813 1.00 0.00 C ATOM 1275 OE1 GLU B 36 9.881 11.721 -9.314 1.00 0.00 O ATOM 1276 OE2 GLU B 36 10.651 10.104 -10.591 1.00 0.00 O ATOM 0 H GLU B 36 13.302 8.769 -6.729 1.00 0.00 H new ATOM 0 HA GLU B 36 11.677 8.849 -8.988 1.00 0.00 H new ATOM 0 HB2 GLU B 36 12.374 10.742 -7.435 1.00 0.00 H new ATOM 0 HB3 GLU B 36 13.910 10.785 -8.279 1.00 0.00 H new ATOM 0 HG2 GLU B 36 12.255 12.483 -9.087 1.00 0.00 H new ATOM 0 HG3 GLU B 36 12.866 11.430 -10.347 1.00 0.00 H new ATOM 1283 N GLY B 37 12.942 8.537 -11.073 1.00 0.00 N ATOM 1284 CA GLY B 37 13.644 8.189 -12.291 1.00 0.00 C ATOM 1285 C GLY B 37 14.158 6.760 -12.292 1.00 0.00 C ATOM 1286 O GLY B 37 15.212 6.477 -12.864 1.00 0.00 O ATOM 0 H GLY B 37 11.934 8.648 -11.183 1.00 0.00 H new ATOM 0 HA2 GLY B 37 12.977 8.330 -13.141 1.00 0.00 H new ATOM 0 HA3 GLY B 37 14.483 8.871 -12.428 1.00 0.00 H new ATOM 1290 N LYS B 38 13.463 5.868 -11.599 1.00 0.00 N ATOM 1291 CA LYS B 38 13.863 4.465 -11.549 1.00 0.00 C ATOM 1292 C LYS B 38 12.829 3.584 -12.239 1.00 0.00 C ATOM 1293 O LYS B 38 11.636 3.881 -12.213 1.00 0.00 O ATOM 1294 CB LYS B 38 14.065 4.006 -10.103 1.00 0.00 C ATOM 1295 CG LYS B 38 15.442 3.411 -9.834 1.00 0.00 C ATOM 1296 CD LYS B 38 16.556 4.339 -10.296 1.00 0.00 C ATOM 1297 CE LYS B 38 16.525 5.668 -9.560 1.00 0.00 C ATOM 1298 NZ LYS B 38 16.744 6.814 -10.484 1.00 0.00 N ATOM 0 H LYS B 38 12.622 6.088 -11.065 1.00 0.00 H new ATOM 0 HA LYS B 38 14.811 4.369 -12.078 1.00 0.00 H new ATOM 0 HB2 LYS B 38 13.910 4.855 -9.437 1.00 0.00 H new ATOM 0 HB3 LYS B 38 13.305 3.265 -9.857 1.00 0.00 H new ATOM 0 HG2 LYS B 38 15.551 3.214 -8.768 1.00 0.00 H new ATOM 0 HG3 LYS B 38 15.531 2.453 -10.346 1.00 0.00 H new ATOM 0 HD2 LYS B 38 17.520 3.857 -10.136 1.00 0.00 H new ATOM 0 HD3 LYS B 38 16.462 4.515 -11.368 1.00 0.00 H new ATOM 0 HE2 LYS B 38 15.564 5.784 -9.058 1.00 0.00 H new ATOM 0 HE3 LYS B 38 17.292 5.673 -8.786 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 16.150 7.616 -10.190 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 17.745 7.096 -10.457 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 16.490 6.533 -11.452 1.00 0.00 H new ATOM 1312 N ASP B 39 13.295 2.508 -12.855 1.00 0.00 N ATOM 1313 CA ASP B 39 12.416 1.573 -13.548 1.00 0.00 C ATOM 1314 C ASP B 39 12.066 0.400 -12.637 1.00 0.00 C ATOM 1315 O ASP B 39 11.052 -0.275 -12.826 1.00 0.00 O ATOM 1316 CB ASP B 39 13.089 1.064 -14.830 1.00 0.00 C ATOM 1317 CG ASP B 39 14.290 0.175 -14.556 1.00 0.00 C ATOM 1318 OD1 ASP B 39 15.042 0.451 -13.590 1.00 0.00 O ATOM 1319 OD2 ASP B 39 14.494 -0.805 -15.302 1.00 0.00 O ATOM 0 H ASP B 39 14.283 2.258 -12.890 1.00 0.00 H new ATOM 0 HA ASP B 39 11.496 2.093 -13.816 1.00 0.00 H new ATOM 0 HB2 ASP B 39 12.360 0.509 -15.421 1.00 0.00 H new ATOM 0 HB3 ASP B 39 13.404 1.917 -15.432 1.00 0.00 H new ATOM 1324 N ARG B 40 12.910 0.172 -11.641 1.00 0.00 N ATOM 1325 CA ARG B 40 12.706 -0.911 -10.695 1.00 0.00 C ATOM 1326 C ARG B 40 12.505 -0.362 -9.290 1.00 0.00 C ATOM 1327 O ARG B 40 13.004 0.715 -8.953 1.00 0.00 O ATOM 1328 CB ARG B 40 13.892 -1.878 -10.726 1.00 0.00 C ATOM 1329 CG ARG B 40 15.241 -1.204 -10.525 1.00 0.00 C ATOM 1330 CD ARG B 40 16.333 -1.905 -11.317 1.00 0.00 C ATOM 1331 NE ARG B 40 16.035 -1.926 -12.749 1.00 0.00 N ATOM 1332 CZ ARG B 40 16.295 -2.952 -13.556 1.00 0.00 C ATOM 1333 NH1 ARG B 40 16.896 -4.041 -13.085 1.00 0.00 N ATOM 1334 NH2 ARG B 40 15.948 -2.886 -14.834 1.00 0.00 N ATOM 0 H ARG B 40 13.748 0.728 -11.468 1.00 0.00 H new ATOM 0 HA ARG B 40 11.807 -1.456 -10.984 1.00 0.00 H new ATOM 0 HB2 ARG B 40 13.754 -2.632 -9.951 1.00 0.00 H new ATOM 0 HB3 ARG B 40 13.897 -2.401 -11.682 1.00 0.00 H new ATOM 0 HG2 ARG B 40 15.178 -0.161 -10.834 1.00 0.00 H new ATOM 0 HG3 ARG B 40 15.498 -1.208 -9.466 1.00 0.00 H new ATOM 0 HD2 ARG B 40 17.284 -1.400 -11.151 1.00 0.00 H new ATOM 0 HD3 ARG B 40 16.447 -2.926 -10.954 1.00 0.00 H new ATOM 0 HE ARG B 40 15.599 -1.099 -13.156 1.00 0.00 H new ATOM 0 HH11 ARG B 40 17.160 -4.093 -12.101 1.00 0.00 H new ATOM 0 HH12 ARG B 40 17.093 -4.824 -13.708 1.00 0.00 H new ATOM 0 HH21 ARG B 40 15.484 -2.052 -15.194 1.00 0.00 H new ATOM 0 HH22 ARG B 40 16.145 -3.669 -15.457 1.00 0.00 H new ATOM 1348 N PHE B 41 11.781 -1.112 -8.475 1.00 0.00 N ATOM 1349 CA PHE B 41 11.494 -0.709 -7.107 1.00 0.00 C ATOM 1350 C PHE B 41 12.562 -1.231 -6.158 1.00 0.00 C ATOM 1351 O PHE B 41 13.040 -2.355 -6.307 1.00 0.00 O ATOM 1352 CB PHE B 41 10.121 -1.235 -6.674 1.00 0.00 C ATOM 1353 CG PHE B 41 9.064 -1.119 -7.736 1.00 0.00 C ATOM 1354 CD1 PHE B 41 8.350 0.057 -7.896 1.00 0.00 C ATOM 1355 CD2 PHE B 41 8.787 -2.187 -8.576 1.00 0.00 C ATOM 1356 CE1 PHE B 41 7.379 0.166 -8.871 1.00 0.00 C ATOM 1357 CE2 PHE B 41 7.818 -2.083 -9.553 1.00 0.00 C ATOM 1358 CZ PHE B 41 7.113 -0.905 -9.702 1.00 0.00 C ATOM 0 H PHE B 41 11.378 -2.011 -8.740 1.00 0.00 H new ATOM 0 HA PHE B 41 11.490 0.380 -7.069 1.00 0.00 H new ATOM 0 HB2 PHE B 41 10.218 -2.281 -6.384 1.00 0.00 H new ATOM 0 HB3 PHE B 41 9.795 -0.688 -5.789 1.00 0.00 H new ATOM 0 HD1 PHE B 41 8.555 0.898 -7.251 1.00 0.00 H new ATOM 0 HD2 PHE B 41 9.336 -3.110 -8.464 1.00 0.00 H new ATOM 0 HE1 PHE B 41 6.828 1.088 -8.984 1.00 0.00 H new ATOM 0 HE2 PHE B 41 7.611 -2.922 -10.201 1.00 0.00 H new ATOM 0 HZ PHE B 41 6.355 -0.821 -10.467 1.00 0.00 H new ATOM 1368 N THR B 42 12.937 -0.410 -5.191 1.00 0.00 N ATOM 1369 CA THR B 42 13.935 -0.793 -4.209 1.00 0.00 C ATOM 1370 C THR B 42 13.261 -1.370 -2.970 1.00 0.00 C ATOM 1371 O THR B 42 13.852 -2.146 -2.221 1.00 0.00 O ATOM 1372 CB THR B 42 14.797 0.416 -3.811 1.00 0.00 C ATOM 1373 OG1 THR B 42 14.019 1.617 -3.924 1.00 0.00 O ATOM 1374 CG2 THR B 42 16.032 0.518 -4.695 1.00 0.00 C ATOM 0 H THR B 42 12.562 0.530 -5.066 1.00 0.00 H new ATOM 0 HA THR B 42 14.578 -1.552 -4.656 1.00 0.00 H new ATOM 0 HB THR B 42 15.124 0.284 -2.780 1.00 0.00 H new ATOM 0 HG1 THR B 42 14.009 2.082 -3.062 1.00 0.00 H new ATOM 0 HG21 THR B 42 16.625 1.381 -4.393 1.00 0.00 H new ATOM 0 HG22 THR B 42 16.630 -0.387 -4.591 1.00 0.00 H new ATOM 0 HG23 THR B 42 15.727 0.633 -5.735 1.00 0.00 H new ATOM 1382 N ILE B 43 12.012 -0.977 -2.768 1.00 0.00 N ATOM 1383 CA ILE B 43 11.226 -1.443 -1.638 1.00 0.00 C ATOM 1384 C ILE B 43 10.051 -2.267 -2.140 1.00 0.00 C ATOM 1385 O ILE B 43 9.304 -1.811 -3.001 1.00 0.00 O ATOM 1386 CB ILE B 43 10.693 -0.259 -0.798 1.00 0.00 C ATOM 1387 CG1 ILE B 43 11.851 0.587 -0.255 1.00 0.00 C ATOM 1388 CG2 ILE B 43 9.813 -0.755 0.343 1.00 0.00 C ATOM 1389 CD1 ILE B 43 12.698 -0.125 0.777 1.00 0.00 C ATOM 0 H ILE B 43 11.517 -0.329 -3.381 1.00 0.00 H new ATOM 0 HA ILE B 43 11.872 -2.053 -1.006 1.00 0.00 H new ATOM 0 HB ILE B 43 10.085 0.369 -1.449 1.00 0.00 H new ATOM 0 HG12 ILE B 43 12.487 0.891 -1.086 1.00 0.00 H new ATOM 0 HG13 ILE B 43 11.447 1.498 0.187 1.00 0.00 H new ATOM 0 HG21 ILE B 43 9.450 0.096 0.919 1.00 0.00 H new ATOM 0 HG22 ILE B 43 8.965 -1.305 -0.064 1.00 0.00 H new ATOM 0 HG23 ILE B 43 10.394 -1.411 0.991 1.00 0.00 H new ATOM 0 HD11 ILE B 43 13.496 0.538 1.113 1.00 0.00 H new ATOM 0 HD12 ILE B 43 12.076 -0.405 1.628 1.00 0.00 H new ATOM 0 HD13 ILE B 43 13.133 -1.021 0.335 1.00 0.00 H new ATOM 1401 N SER B 44 9.897 -3.476 -1.622 1.00 0.00 N ATOM 1402 CA SER B 44 8.804 -4.343 -2.030 1.00 0.00 C ATOM 1403 C SER B 44 8.314 -5.170 -0.845 1.00 0.00 C ATOM 1404 O SER B 44 9.023 -6.046 -0.351 1.00 0.00 O ATOM 1405 CB SER B 44 9.250 -5.262 -3.175 1.00 0.00 C ATOM 1406 OG SER B 44 8.178 -6.064 -3.645 1.00 0.00 O ATOM 0 H SER B 44 10.516 -3.878 -0.918 1.00 0.00 H new ATOM 0 HA SER B 44 7.981 -3.722 -2.385 1.00 0.00 H new ATOM 0 HB2 SER B 44 9.642 -4.660 -3.995 1.00 0.00 H new ATOM 0 HB3 SER B 44 10.063 -5.903 -2.833 1.00 0.00 H new ATOM 0 HG SER B 44 8.494 -6.637 -4.375 1.00 0.00 H new ATOM 1412 N HIS B 45 7.109 -4.874 -0.382 1.00 0.00 N ATOM 1413 CA HIS B 45 6.524 -5.592 0.740 1.00 0.00 C ATOM 1414 C HIS B 45 5.193 -6.194 0.346 1.00 0.00 C ATOM 1415 O HIS B 45 4.289 -5.488 -0.094 1.00 0.00 O ATOM 1416 CB HIS B 45 6.326 -4.665 1.945 1.00 0.00 C ATOM 1417 CG HIS B 45 7.597 -4.258 2.621 1.00 0.00 C ATOM 1418 ND1 HIS B 45 8.390 -5.116 3.350 1.00 0.00 N ATOM 1419 CD2 HIS B 45 8.204 -3.049 2.678 1.00 0.00 C ATOM 1420 CE1 HIS B 45 9.430 -4.416 3.818 1.00 0.00 C ATOM 1421 NE2 HIS B 45 9.365 -3.155 3.437 1.00 0.00 N ATOM 0 H HIS B 45 6.516 -4.139 -0.767 1.00 0.00 H new ATOM 0 HA HIS B 45 7.214 -6.388 1.019 1.00 0.00 H new ATOM 0 HB2 HIS B 45 5.799 -3.769 1.617 1.00 0.00 H new ATOM 0 HB3 HIS B 45 5.685 -5.164 2.672 1.00 0.00 H new ATOM 0 HD1 HIS B 45 8.216 -6.109 3.506 1.00 0.00 H new ATOM 0 HD2 HIS B 45 7.844 -2.145 2.209 1.00 0.00 H new ATOM 0 HE1 HIS B 45 10.219 -4.830 4.428 1.00 0.00 H new ATOM 1429 N MET B 46 5.081 -7.501 0.484 1.00 0.00 N ATOM 1430 CA MET B 46 3.844 -8.178 0.156 1.00 0.00 C ATOM 1431 C MET B 46 2.846 -7.937 1.274 1.00 0.00 C ATOM 1432 O MET B 46 3.227 -7.848 2.441 1.00 0.00 O ATOM 1433 CB MET B 46 4.070 -9.684 -0.026 1.00 0.00 C ATOM 1434 CG MET B 46 5.203 -10.033 -0.980 1.00 0.00 C ATOM 1435 SD MET B 46 4.763 -9.792 -2.713 1.00 0.00 S ATOM 1436 CE MET B 46 3.515 -11.060 -2.929 1.00 0.00 C ATOM 0 H MET B 46 5.827 -8.111 0.819 1.00 0.00 H new ATOM 0 HA MET B 46 3.461 -7.782 -0.784 1.00 0.00 H new ATOM 0 HB2 MET B 46 4.279 -10.129 0.947 1.00 0.00 H new ATOM 0 HB3 MET B 46 3.149 -10.137 -0.392 1.00 0.00 H new ATOM 0 HG2 MET B 46 6.072 -9.420 -0.743 1.00 0.00 H new ATOM 0 HG3 MET B 46 5.494 -11.072 -0.826 1.00 0.00 H new ATOM 0 HE1 MET B 46 3.402 -11.282 -3.990 1.00 0.00 H new ATOM 0 HE2 MET B 46 3.819 -11.963 -2.400 1.00 0.00 H new ATOM 0 HE3 MET B 46 2.565 -10.707 -2.529 1.00 0.00 H new ATOM 1446 N TYR B 47 1.578 -7.815 0.921 1.00 0.00 N ATOM 1447 CA TYR B 47 0.528 -7.584 1.913 1.00 0.00 C ATOM 1448 C TYR B 47 0.503 -8.717 2.934 1.00 0.00 C ATOM 1449 O TYR B 47 0.166 -8.516 4.100 1.00 0.00 O ATOM 1450 CB TYR B 47 -0.841 -7.459 1.235 1.00 0.00 C ATOM 1451 CG TYR B 47 -0.941 -6.300 0.268 1.00 0.00 C ATOM 1452 CD1 TYR B 47 -0.443 -5.049 0.603 1.00 0.00 C ATOM 1453 CD2 TYR B 47 -1.529 -6.459 -0.981 1.00 0.00 C ATOM 1454 CE1 TYR B 47 -0.523 -3.988 -0.277 1.00 0.00 C ATOM 1455 CE2 TYR B 47 -1.614 -5.401 -1.866 1.00 0.00 C ATOM 1456 CZ TYR B 47 -1.109 -4.169 -1.508 1.00 0.00 C ATOM 1457 OH TYR B 47 -1.183 -3.118 -2.392 1.00 0.00 O ATOM 0 H TYR B 47 1.245 -7.871 -0.042 1.00 0.00 H new ATOM 0 HA TYR B 47 0.747 -6.649 2.428 1.00 0.00 H new ATOM 0 HB2 TYR B 47 -1.057 -8.385 0.702 1.00 0.00 H new ATOM 0 HB3 TYR B 47 -1.607 -7.347 2.002 1.00 0.00 H new ATOM 0 HD1 TYR B 47 0.016 -4.902 1.570 1.00 0.00 H new ATOM 0 HD2 TYR B 47 -1.925 -7.423 -1.264 1.00 0.00 H new ATOM 0 HE1 TYR B 47 -0.128 -3.022 -0.000 1.00 0.00 H new ATOM 0 HE2 TYR B 47 -2.074 -5.539 -2.833 1.00 0.00 H new ATOM 0 HH TYR B 47 -1.126 -3.458 -3.310 1.00 0.00 H new ATOM 1467 N ALA B 48 0.913 -9.897 2.487 1.00 0.00 N ATOM 1468 CA ALA B 48 0.942 -11.085 3.327 1.00 0.00 C ATOM 1469 C ALA B 48 2.078 -11.050 4.346 1.00 0.00 C ATOM 1470 O ALA B 48 2.168 -11.930 5.200 1.00 0.00 O ATOM 1471 CB ALA B 48 1.071 -12.326 2.457 1.00 0.00 C ATOM 0 H ALA B 48 1.234 -10.056 1.532 1.00 0.00 H new ATOM 0 HA ALA B 48 0.006 -11.112 3.884 1.00 0.00 H new ATOM 0 HB1 ALA B 48 1.092 -13.213 3.090 1.00 0.00 H new ATOM 0 HB2 ALA B 48 0.220 -12.385 1.778 1.00 0.00 H new ATOM 0 HB3 ALA B 48 1.993 -12.271 1.879 1.00 0.00 H new ATOM 1477 N ASP B 49 2.951 -10.052 4.251 1.00 0.00 N ATOM 1478 CA ASP B 49 4.079 -9.937 5.174 1.00 0.00 C ATOM 1479 C ASP B 49 3.917 -8.739 6.101 1.00 0.00 C ATOM 1480 O ASP B 49 4.710 -8.540 7.026 1.00 0.00 O ATOM 1481 CB ASP B 49 5.397 -9.810 4.404 1.00 0.00 C ATOM 1482 CG ASP B 49 5.689 -11.021 3.542 1.00 0.00 C ATOM 1483 OD1 ASP B 49 5.769 -10.865 2.309 1.00 0.00 O ATOM 1484 OD2 ASP B 49 5.828 -12.133 4.099 1.00 0.00 O ATOM 0 H ASP B 49 2.901 -9.314 3.549 1.00 0.00 H new ATOM 0 HA ASP B 49 4.099 -10.845 5.777 1.00 0.00 H new ATOM 0 HB2 ASP B 49 5.361 -8.921 3.774 1.00 0.00 H new ATOM 0 HB3 ASP B 49 6.214 -9.667 5.111 1.00 0.00 H new ATOM 1489 N ILE B 50 2.885 -7.947 5.864 1.00 0.00 N ATOM 1490 CA ILE B 50 2.638 -6.769 6.678 1.00 0.00 C ATOM 1491 C ILE B 50 1.601 -7.078 7.756 1.00 0.00 C ATOM 1492 O ILE B 50 0.573 -7.687 7.475 1.00 0.00 O ATOM 1493 CB ILE B 50 2.152 -5.588 5.815 1.00 0.00 C ATOM 1494 CG1 ILE B 50 3.140 -5.322 4.675 1.00 0.00 C ATOM 1495 CG2 ILE B 50 1.974 -4.345 6.672 1.00 0.00 C ATOM 1496 CD1 ILE B 50 2.591 -4.426 3.587 1.00 0.00 C ATOM 0 H ILE B 50 2.207 -8.097 5.117 1.00 0.00 H new ATOM 0 HA ILE B 50 3.579 -6.487 7.151 1.00 0.00 H new ATOM 0 HB ILE B 50 1.186 -5.846 5.380 1.00 0.00 H new ATOM 0 HG12 ILE B 50 4.041 -4.867 5.087 1.00 0.00 H new ATOM 0 HG13 ILE B 50 3.436 -6.274 4.234 1.00 0.00 H new ATOM 0 HG21 ILE B 50 1.631 -3.519 6.049 1.00 0.00 H new ATOM 0 HG22 ILE B 50 1.237 -4.542 7.451 1.00 0.00 H new ATOM 0 HG23 ILE B 50 2.926 -4.081 7.132 1.00 0.00 H new ATOM 0 HD11 ILE B 50 3.348 -4.284 2.816 1.00 0.00 H new ATOM 0 HD12 ILE B 50 1.707 -4.888 3.147 1.00 0.00 H new ATOM 0 HD13 ILE B 50 2.322 -3.460 4.013 1.00 0.00 H new ATOM 1508 N LYS B 51 1.874 -6.664 8.985 1.00 0.00 N ATOM 1509 CA LYS B 51 0.957 -6.904 10.096 1.00 0.00 C ATOM 1510 C LYS B 51 -0.168 -5.875 10.085 1.00 0.00 C ATOM 1511 O LYS B 51 -1.339 -6.219 9.945 1.00 0.00 O ATOM 1512 CB LYS B 51 1.713 -6.848 11.428 1.00 0.00 C ATOM 1513 CG LYS B 51 0.834 -7.081 12.648 1.00 0.00 C ATOM 1514 CD LYS B 51 1.510 -6.605 13.927 1.00 0.00 C ATOM 1515 CE LYS B 51 2.692 -7.485 14.306 1.00 0.00 C ATOM 1516 NZ LYS B 51 3.994 -6.782 14.135 1.00 0.00 N ATOM 0 H LYS B 51 2.723 -6.160 9.241 1.00 0.00 H new ATOM 0 HA LYS B 51 0.522 -7.897 9.981 1.00 0.00 H new ATOM 0 HB2 LYS B 51 2.506 -7.596 11.416 1.00 0.00 H new ATOM 0 HB3 LYS B 51 2.194 -5.874 11.520 1.00 0.00 H new ATOM 0 HG2 LYS B 51 -0.113 -6.557 12.520 1.00 0.00 H new ATOM 0 HG3 LYS B 51 0.602 -8.143 12.732 1.00 0.00 H new ATOM 0 HD2 LYS B 51 1.849 -5.577 13.797 1.00 0.00 H new ATOM 0 HD3 LYS B 51 0.785 -6.601 14.741 1.00 0.00 H new ATOM 0 HE2 LYS B 51 2.587 -7.805 15.343 1.00 0.00 H new ATOM 0 HE3 LYS B 51 2.684 -8.386 13.692 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 4.773 -7.460 14.256 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 4.042 -6.367 13.183 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 4.077 -6.028 14.846 1.00 0.00 H new ATOM 1530 N CYS B 52 0.211 -4.616 10.217 1.00 0.00 N ATOM 1531 CA CYS B 52 -0.729 -3.504 10.223 1.00 0.00 C ATOM 1532 C CYS B 52 -0.030 -2.287 9.648 1.00 0.00 C ATOM 1533 O CYS B 52 1.137 -2.381 9.259 1.00 0.00 O ATOM 1534 CB CYS B 52 -1.219 -3.224 11.645 1.00 0.00 C ATOM 1535 SG CYS B 52 0.072 -3.354 12.905 1.00 0.00 S ATOM 0 H CYS B 52 1.185 -4.333 10.324 1.00 0.00 H new ATOM 0 HA CYS B 52 -1.601 -3.750 9.617 1.00 0.00 H new ATOM 0 HB2 CYS B 52 -1.648 -2.222 11.680 1.00 0.00 H new ATOM 0 HB3 CYS B 52 -2.020 -3.922 11.887 1.00 0.00 H new ATOM 0 HG CYS B 52 0.492 -2.165 13.220 1.00 0.00 H new ATOM 1541 N GLN B 53 -0.696 -1.146 9.584 1.00 0.00 N ATOM 1542 CA GLN B 53 -0.068 0.019 9.038 1.00 0.00 C ATOM 1543 C GLN B 53 -0.342 1.183 9.968 1.00 0.00 C ATOM 1544 O GLN B 53 -1.112 1.042 10.900 1.00 0.00 O ATOM 1545 CB GLN B 53 -0.625 0.252 7.631 1.00 0.00 C ATOM 1546 CG GLN B 53 -2.134 0.145 7.575 1.00 0.00 C ATOM 1547 CD GLN B 53 -2.747 0.966 6.468 1.00 0.00 C ATOM 1548 OE1 GLN B 53 -2.164 1.939 5.996 1.00 0.00 O ATOM 1549 NE2 GLN B 53 -3.952 0.599 6.071 1.00 0.00 N ATOM 0 H GLN B 53 -1.656 -1.014 9.901 1.00 0.00 H new ATOM 0 HA GLN B 53 1.012 -0.098 8.954 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -0.322 1.240 7.284 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -0.188 -0.475 6.947 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -2.413 -0.900 7.441 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -2.550 0.466 8.530 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -4.401 -0.216 6.489 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -4.434 1.130 5.346 1.00 0.00 H new ATOM 1558 N LYS B 54 0.350 2.282 9.776 1.00 0.00 N ATOM 1559 CA LYS B 54 0.145 3.488 10.566 1.00 0.00 C ATOM 1560 C LYS B 54 0.320 4.663 9.638 1.00 0.00 C ATOM 1561 O LYS B 54 0.825 4.507 8.531 1.00 0.00 O ATOM 1562 CB LYS B 54 1.142 3.624 11.724 1.00 0.00 C ATOM 1563 CG LYS B 54 1.285 2.395 12.593 1.00 0.00 C ATOM 1564 CD LYS B 54 1.200 2.774 14.056 1.00 0.00 C ATOM 1565 CE LYS B 54 2.344 2.197 14.852 1.00 0.00 C ATOM 1566 NZ LYS B 54 2.226 0.725 15.020 1.00 0.00 N ATOM 0 H LYS B 54 1.076 2.372 9.065 1.00 0.00 H new ATOM 0 HA LYS B 54 -0.850 3.444 11.009 1.00 0.00 H new ATOM 0 HB2 LYS B 54 2.120 3.876 11.314 1.00 0.00 H new ATOM 0 HB3 LYS B 54 0.835 4.460 12.352 1.00 0.00 H new ATOM 0 HG2 LYS B 54 0.502 1.676 12.350 1.00 0.00 H new ATOM 0 HG3 LYS B 54 2.239 1.907 12.391 1.00 0.00 H new ATOM 0 HD2 LYS B 54 1.203 3.860 14.151 1.00 0.00 H new ATOM 0 HD3 LYS B 54 0.255 2.420 14.469 1.00 0.00 H new ATOM 0 HE2 LYS B 54 3.285 2.430 14.353 1.00 0.00 H new ATOM 0 HE3 LYS B 54 2.377 2.671 15.833 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 3.153 0.329 15.275 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 1.541 0.515 15.774 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 1.901 0.299 14.129 1.00 0.00 H new ATOM 1580 N ILE B 55 -0.101 5.823 10.067 1.00 0.00 N ATOM 1581 CA ILE B 55 0.027 7.009 9.234 1.00 0.00 C ATOM 1582 C ILE B 55 0.456 8.194 10.055 1.00 0.00 C ATOM 1583 O ILE B 55 -0.128 8.434 11.083 1.00 0.00 O ATOM 1584 CB ILE B 55 -1.334 7.370 8.603 1.00 0.00 C ATOM 1585 CG1 ILE B 55 -2.415 7.170 9.656 1.00 0.00 C ATOM 1586 CG2 ILE B 55 -1.608 6.541 7.364 1.00 0.00 C ATOM 1587 CD1 ILE B 55 -3.830 7.432 9.222 1.00 0.00 C ATOM 0 H ILE B 55 -0.533 5.981 10.978 1.00 0.00 H new ATOM 0 HA ILE B 55 0.768 6.785 8.466 1.00 0.00 H new ATOM 0 HB ILE B 55 -1.324 8.411 8.280 1.00 0.00 H new ATOM 0 HG12 ILE B 55 -2.353 6.144 10.018 1.00 0.00 H new ATOM 0 HG13 ILE B 55 -2.192 7.820 10.502 1.00 0.00 H new ATOM 0 HG21 ILE B 55 -2.575 6.821 6.945 1.00 0.00 H new ATOM 0 HG22 ILE B 55 -0.827 6.721 6.626 1.00 0.00 H new ATOM 0 HG23 ILE B 55 -1.620 5.484 7.629 1.00 0.00 H new ATOM 0 HD11 ILE B 55 -4.506 7.255 10.059 1.00 0.00 H new ATOM 0 HD12 ILE B 55 -3.924 8.467 8.892 1.00 0.00 H new ATOM 0 HD13 ILE B 55 -4.088 6.764 8.400 1.00 0.00 H new ATOM 1599 N SER B 56 1.474 8.928 9.642 1.00 0.00 N ATOM 1600 CA SER B 56 1.832 10.108 10.394 1.00 0.00 C ATOM 1601 C SER B 56 0.639 11.029 10.227 1.00 0.00 C ATOM 1602 O SER B 56 0.358 11.493 9.099 1.00 0.00 O ATOM 1603 CB SER B 56 3.152 10.731 9.927 1.00 0.00 C ATOM 1604 OG SER B 56 2.969 11.594 8.835 1.00 0.00 O ATOM 0 H SER B 56 2.047 8.735 8.820 1.00 0.00 H new ATOM 0 HA SER B 56 2.026 9.887 11.444 1.00 0.00 H new ATOM 0 HB2 SER B 56 3.605 11.281 10.752 1.00 0.00 H new ATOM 0 HB3 SER B 56 3.849 9.940 9.651 1.00 0.00 H new ATOM 0 HG SER B 56 3.561 12.370 8.928 1.00 0.00 H new ATOM 1610 N PRO B 57 -0.096 11.215 11.353 1.00 0.00 N ATOM 1611 CA PRO B 57 -1.366 11.950 11.427 1.00 0.00 C ATOM 1612 C PRO B 57 -1.294 13.401 10.972 1.00 0.00 C ATOM 1613 O PRO B 57 -0.211 13.966 10.778 1.00 0.00 O ATOM 1614 CB PRO B 57 -1.718 11.922 12.919 1.00 0.00 C ATOM 1615 CG PRO B 57 -0.435 11.650 13.609 1.00 0.00 C ATOM 1616 CD PRO B 57 0.316 10.752 12.690 1.00 0.00 C ATOM 0 HA PRO B 57 -2.094 11.486 10.761 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -2.147 12.871 13.242 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -2.455 11.149 13.137 1.00 0.00 H new ATOM 0 HG2 PRO B 57 0.115 12.572 13.796 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -0.600 11.175 14.576 1.00 0.00 H new ATOM 0 HD2 PRO B 57 1.393 10.840 12.832 1.00 0.00 H new ATOM 0 HD3 PRO B 57 0.058 9.705 12.850 1.00 0.00 H new ATOM 1624 N GLU B 58 -2.469 13.988 10.802 1.00 0.00 N ATOM 1625 CA GLU B 58 -2.593 15.379 10.429 1.00 0.00 C ATOM 1626 C GLU B 58 -1.998 16.231 11.541 1.00 0.00 C ATOM 1627 O GLU B 58 -2.155 15.922 12.721 1.00 0.00 O ATOM 1628 CB GLU B 58 -4.066 15.739 10.199 1.00 0.00 C ATOM 1629 CG GLU B 58 -4.563 15.475 8.780 1.00 0.00 C ATOM 1630 CD GLU B 58 -4.630 13.999 8.413 1.00 0.00 C ATOM 1631 OE1 GLU B 58 -4.429 13.138 9.298 1.00 0.00 O ATOM 1632 OE2 GLU B 58 -4.871 13.694 7.230 1.00 0.00 O ATOM 0 H GLU B 58 -3.361 13.508 10.920 1.00 0.00 H new ATOM 0 HA GLU B 58 -2.056 15.565 9.499 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -4.680 15.171 10.898 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -4.211 16.794 10.432 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -5.555 15.913 8.666 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -3.906 15.985 8.075 1.00 0.00 H new ATOM 1639 N GLY B 59 -1.326 17.298 11.168 1.00 0.00 N ATOM 1640 CA GLY B 59 -0.681 18.145 12.147 1.00 0.00 C ATOM 1641 C GLY B 59 0.817 18.073 11.979 1.00 0.00 C ATOM 1642 O GLY B 59 1.530 19.045 12.227 1.00 0.00 O ATOM 0 H GLY B 59 -1.212 17.598 10.200 1.00 0.00 H new ATOM 0 HA2 GLY B 59 -1.020 19.174 12.030 1.00 0.00 H new ATOM 0 HA3 GLY B 59 -0.959 17.830 13.153 1.00 0.00 H new ATOM 1646 N LYS B 60 1.293 16.904 11.558 1.00 0.00 N ATOM 1647 CA LYS B 60 2.705 16.714 11.289 1.00 0.00 C ATOM 1648 C LYS B 60 3.072 17.544 10.066 1.00 0.00 C ATOM 1649 O LYS B 60 2.260 17.692 9.154 1.00 0.00 O ATOM 1650 CB LYS B 60 3.033 15.238 11.005 1.00 0.00 C ATOM 1651 CG LYS B 60 3.421 14.402 12.223 1.00 0.00 C ATOM 1652 CD LYS B 60 4.277 13.221 11.800 1.00 0.00 C ATOM 1653 CE LYS B 60 5.195 12.759 12.911 1.00 0.00 C ATOM 1654 NZ LYS B 60 5.916 13.881 13.555 1.00 0.00 N ATOM 0 H LYS B 60 0.717 16.078 11.397 1.00 0.00 H new ATOM 0 HA LYS B 60 3.273 17.024 12.166 1.00 0.00 H new ATOM 0 HB2 LYS B 60 2.167 14.777 10.531 1.00 0.00 H new ATOM 0 HB3 LYS B 60 3.850 15.198 10.284 1.00 0.00 H new ATOM 0 HG2 LYS B 60 3.967 15.019 12.937 1.00 0.00 H new ATOM 0 HG3 LYS B 60 2.524 14.047 12.730 1.00 0.00 H new ATOM 0 HD2 LYS B 60 3.632 12.396 11.496 1.00 0.00 H new ATOM 0 HD3 LYS B 60 4.872 13.498 10.930 1.00 0.00 H new ATOM 0 HE2 LYS B 60 4.611 12.227 13.663 1.00 0.00 H new ATOM 0 HE3 LYS B 60 5.918 12.050 12.509 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 6.556 13.509 14.285 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 6.469 14.395 12.839 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 5.230 14.528 13.993 1.00 0.00 H new ATOM 1668 N ALA B 61 4.285 18.077 10.038 1.00 0.00 N ATOM 1669 CA ALA B 61 4.733 18.878 8.902 1.00 0.00 C ATOM 1670 C ALA B 61 4.991 17.989 7.690 1.00 0.00 C ATOM 1671 O ALA B 61 5.371 18.463 6.621 1.00 0.00 O ATOM 1672 CB ALA B 61 5.986 19.660 9.267 1.00 0.00 C ATOM 0 H ALA B 61 4.974 17.972 10.782 1.00 0.00 H new ATOM 0 HA ALA B 61 3.946 19.587 8.646 1.00 0.00 H new ATOM 0 HB1 ALA B 61 6.308 20.252 8.410 1.00 0.00 H new ATOM 0 HB2 ALA B 61 5.770 20.322 10.105 1.00 0.00 H new ATOM 0 HB3 ALA B 61 6.779 18.967 9.547 1.00 0.00 H new ATOM 1678 N LYS B 62 4.779 16.696 7.876 1.00 0.00 N ATOM 1679 CA LYS B 62 4.980 15.717 6.828 1.00 0.00 C ATOM 1680 C LYS B 62 4.001 14.558 7.000 1.00 0.00 C ATOM 1681 O LYS B 62 4.086 13.804 7.971 1.00 0.00 O ATOM 1682 CB LYS B 62 6.430 15.216 6.855 1.00 0.00 C ATOM 1683 CG LYS B 62 6.990 15.043 8.261 1.00 0.00 C ATOM 1684 CD LYS B 62 8.480 15.356 8.327 1.00 0.00 C ATOM 1685 CE LYS B 62 9.322 14.239 7.729 1.00 0.00 C ATOM 1686 NZ LYS B 62 9.616 14.471 6.293 1.00 0.00 N ATOM 0 H LYS B 62 4.462 16.299 8.760 1.00 0.00 H new ATOM 0 HA LYS B 62 4.793 16.181 5.860 1.00 0.00 H new ATOM 0 HB2 LYS B 62 6.486 14.262 6.331 1.00 0.00 H new ATOM 0 HB3 LYS B 62 7.058 15.918 6.307 1.00 0.00 H new ATOM 0 HG2 LYS B 62 6.452 15.696 8.948 1.00 0.00 H new ATOM 0 HG3 LYS B 62 6.820 14.020 8.595 1.00 0.00 H new ATOM 0 HD2 LYS B 62 8.679 16.286 7.794 1.00 0.00 H new ATOM 0 HD3 LYS B 62 8.772 15.515 9.365 1.00 0.00 H new ATOM 0 HE2 LYS B 62 10.258 14.155 8.282 1.00 0.00 H new ATOM 0 HE3 LYS B 62 8.798 13.290 7.843 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 10.470 13.942 6.024 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 8.813 14.147 5.717 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 9.771 15.486 6.130 1.00 0.00 H new ATOM 1700 N ILE B 63 3.049 14.454 6.079 1.00 0.00 N ATOM 1701 CA ILE B 63 2.047 13.387 6.099 1.00 0.00 C ATOM 1702 C ILE B 63 2.680 12.109 5.568 1.00 0.00 C ATOM 1703 O ILE B 63 3.140 12.076 4.423 1.00 0.00 O ATOM 1704 CB ILE B 63 0.826 13.768 5.235 1.00 0.00 C ATOM 1705 CG1 ILE B 63 0.280 15.128 5.668 1.00 0.00 C ATOM 1706 CG2 ILE B 63 -0.258 12.709 5.329 1.00 0.00 C ATOM 1707 CD1 ILE B 63 0.270 16.156 4.557 1.00 0.00 C ATOM 0 H ILE B 63 2.948 15.103 5.299 1.00 0.00 H new ATOM 0 HA ILE B 63 1.704 13.236 7.122 1.00 0.00 H new ATOM 0 HB ILE B 63 1.148 13.830 4.195 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -0.735 15.000 6.043 1.00 0.00 H new ATOM 0 HG13 ILE B 63 0.881 15.505 6.496 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -1.107 13.002 4.711 1.00 0.00 H new ATOM 0 HG22 ILE B 63 0.134 11.755 4.978 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -0.581 12.610 6.365 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -0.130 17.097 4.935 1.00 0.00 H new ATOM 0 HD12 ILE B 63 1.287 16.313 4.197 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -0.354 15.800 3.737 1.00 0.00 H new ATOM 1719 N GLN B 64 2.723 11.056 6.379 1.00 0.00 N ATOM 1720 CA GLN B 64 3.395 9.830 5.940 1.00 0.00 C ATOM 1721 C GLN B 64 2.651 8.563 6.335 1.00 0.00 C ATOM 1722 O GLN B 64 1.674 8.605 7.073 1.00 0.00 O ATOM 1723 CB GLN B 64 4.811 9.779 6.531 1.00 0.00 C ATOM 1724 CG GLN B 64 5.593 11.072 6.376 1.00 0.00 C ATOM 1725 CD GLN B 64 6.739 11.190 7.358 1.00 0.00 C ATOM 1726 OE1 GLN B 64 7.867 10.794 7.067 1.00 0.00 O ATOM 1727 NE2 GLN B 64 6.457 11.743 8.525 1.00 0.00 N ATOM 0 H GLN B 64 2.316 11.021 7.314 1.00 0.00 H new ATOM 0 HA GLN B 64 3.424 9.864 4.851 1.00 0.00 H new ATOM 0 HB2 GLN B 64 4.743 9.533 7.591 1.00 0.00 H new ATOM 0 HB3 GLN B 64 5.365 8.972 6.051 1.00 0.00 H new ATOM 0 HG2 GLN B 64 5.984 11.135 5.360 1.00 0.00 H new ATOM 0 HG3 GLN B 64 4.918 11.917 6.510 1.00 0.00 H new ATOM 0 HE21 GLN B 64 5.507 12.057 8.724 1.00 0.00 H new ATOM 0 HE22 GLN B 64 7.189 11.855 9.226 1.00 0.00 H new ATOM 1736 N LEU B 65 3.102 7.444 5.785 1.00 0.00 N ATOM 1737 CA LEU B 65 2.542 6.137 6.095 1.00 0.00 C ATOM 1738 C LEU B 65 3.636 5.249 6.688 1.00 0.00 C ATOM 1739 O LEU B 65 4.812 5.413 6.368 1.00 0.00 O ATOM 1740 CB LEU B 65 1.983 5.461 4.843 1.00 0.00 C ATOM 1741 CG LEU B 65 1.184 4.182 5.114 1.00 0.00 C ATOM 1742 CD1 LEU B 65 -0.290 4.480 5.296 1.00 0.00 C ATOM 1743 CD2 LEU B 65 1.389 3.169 4.012 1.00 0.00 C ATOM 0 H LEU B 65 3.867 7.417 5.111 1.00 0.00 H new ATOM 0 HA LEU B 65 1.729 6.275 6.808 1.00 0.00 H new ATOM 0 HB2 LEU B 65 1.343 6.170 4.318 1.00 0.00 H new ATOM 0 HB3 LEU B 65 2.810 5.223 4.174 1.00 0.00 H new ATOM 0 HG LEU B 65 1.558 3.755 6.044 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -0.828 3.551 5.487 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -0.423 5.156 6.140 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -0.681 4.947 4.392 1.00 0.00 H new ATOM 0 HD21 LEU B 65 0.810 2.272 4.231 1.00 0.00 H new ATOM 0 HD22 LEU B 65 1.059 3.592 3.063 1.00 0.00 H new ATOM 0 HD23 LEU B 65 2.446 2.912 3.946 1.00 0.00 H new ATOM 1755 N GLN B 66 3.250 4.329 7.556 1.00 0.00 N ATOM 1756 CA GLN B 66 4.187 3.415 8.185 1.00 0.00 C ATOM 1757 C GLN B 66 3.702 1.977 8.060 1.00 0.00 C ATOM 1758 O GLN B 66 2.606 1.648 8.502 1.00 0.00 O ATOM 1759 CB GLN B 66 4.337 3.773 9.657 1.00 0.00 C ATOM 1760 CG GLN B 66 5.395 2.962 10.386 1.00 0.00 C ATOM 1761 CD GLN B 66 5.655 3.474 11.788 1.00 0.00 C ATOM 1762 OE1 GLN B 66 4.972 3.090 12.739 1.00 0.00 O ATOM 1763 NE2 GLN B 66 6.647 4.338 11.924 1.00 0.00 N ATOM 0 H GLN B 66 2.281 4.195 7.844 1.00 0.00 H new ATOM 0 HA GLN B 66 5.150 3.504 7.682 1.00 0.00 H new ATOM 0 HB2 GLN B 66 4.584 4.831 9.739 1.00 0.00 H new ATOM 0 HB3 GLN B 66 3.378 3.630 10.155 1.00 0.00 H new ATOM 0 HG2 GLN B 66 5.079 1.920 10.436 1.00 0.00 H new ATOM 0 HG3 GLN B 66 6.324 2.986 9.816 1.00 0.00 H new ATOM 0 HE21 GLN B 66 7.186 4.628 11.108 1.00 0.00 H new ATOM 0 HE22 GLN B 66 6.873 4.714 12.845 1.00 0.00 H new ATOM 1772 N LEU B 67 4.508 1.130 7.448 1.00 0.00 N ATOM 1773 CA LEU B 67 4.152 -0.271 7.296 1.00 0.00 C ATOM 1774 C LEU B 67 4.764 -1.105 8.406 1.00 0.00 C ATOM 1775 O LEU B 67 5.975 -1.300 8.435 1.00 0.00 O ATOM 1776 CB LEU B 67 4.641 -0.811 5.956 1.00 0.00 C ATOM 1777 CG LEU B 67 3.836 -0.374 4.741 1.00 0.00 C ATOM 1778 CD1 LEU B 67 4.321 -1.114 3.509 1.00 0.00 C ATOM 1779 CD2 LEU B 67 2.354 -0.623 4.966 1.00 0.00 C ATOM 0 H LEU B 67 5.411 1.385 7.049 1.00 0.00 H new ATOM 0 HA LEU B 67 3.065 -0.339 7.344 1.00 0.00 H new ATOM 0 HB2 LEU B 67 5.676 -0.501 5.815 1.00 0.00 H new ATOM 0 HB3 LEU B 67 4.638 -1.900 6.000 1.00 0.00 H new ATOM 0 HG LEU B 67 3.980 0.696 4.588 1.00 0.00 H new ATOM 0 HD11 LEU B 67 3.741 -0.797 2.642 1.00 0.00 H new ATOM 0 HD12 LEU B 67 5.375 -0.891 3.342 1.00 0.00 H new ATOM 0 HD13 LEU B 67 4.196 -2.187 3.656 1.00 0.00 H new ATOM 0 HD21 LEU B 67 1.794 -0.304 4.087 1.00 0.00 H new ATOM 0 HD22 LEU B 67 2.186 -1.686 5.138 1.00 0.00 H new ATOM 0 HD23 LEU B 67 2.018 -0.057 5.835 1.00 0.00 H new ATOM 1791 N VAL B 68 3.939 -1.583 9.322 1.00 0.00 N ATOM 1792 CA VAL B 68 4.432 -2.415 10.405 1.00 0.00 C ATOM 1793 C VAL B 68 4.323 -3.873 10.001 1.00 0.00 C ATOM 1794 O VAL B 68 3.229 -4.435 9.924 1.00 0.00 O ATOM 1795 CB VAL B 68 3.685 -2.171 11.732 1.00 0.00 C ATOM 1796 CG1 VAL B 68 4.070 -3.216 12.769 1.00 0.00 C ATOM 1797 CG2 VAL B 68 4.000 -0.786 12.254 1.00 0.00 C ATOM 0 H VAL B 68 2.934 -1.411 9.338 1.00 0.00 H new ATOM 0 HA VAL B 68 5.474 -2.148 10.582 1.00 0.00 H new ATOM 0 HB VAL B 68 2.614 -2.251 11.544 1.00 0.00 H new ATOM 0 HG11 VAL B 68 3.531 -3.024 13.697 1.00 0.00 H new ATOM 0 HG12 VAL B 68 3.813 -4.208 12.399 1.00 0.00 H new ATOM 0 HG13 VAL B 68 5.143 -3.165 12.956 1.00 0.00 H new ATOM 0 HG21 VAL B 68 3.469 -0.621 13.191 1.00 0.00 H new ATOM 0 HG22 VAL B 68 5.073 -0.697 12.424 1.00 0.00 H new ATOM 0 HG23 VAL B 68 3.685 -0.041 11.523 1.00 0.00 H new ATOM 1807 N LEU B 69 5.464 -4.478 9.735 1.00 0.00 N ATOM 1808 CA LEU B 69 5.512 -5.859 9.305 1.00 0.00 C ATOM 1809 C LEU B 69 5.168 -6.808 10.456 1.00 0.00 C ATOM 1810 O LEU B 69 4.923 -6.374 11.587 1.00 0.00 O ATOM 1811 CB LEU B 69 6.873 -6.190 8.705 1.00 0.00 C ATOM 1812 CG LEU B 69 7.305 -5.329 7.513 1.00 0.00 C ATOM 1813 CD1 LEU B 69 8.194 -6.137 6.590 1.00 0.00 C ATOM 1814 CD2 LEU B 69 6.117 -4.763 6.749 1.00 0.00 C ATOM 0 H LEU B 69 6.377 -4.029 9.810 1.00 0.00 H new ATOM 0 HA LEU B 69 4.759 -5.998 8.529 1.00 0.00 H new ATOM 0 HB2 LEU B 69 7.626 -6.097 9.488 1.00 0.00 H new ATOM 0 HB3 LEU B 69 6.866 -7.234 8.391 1.00 0.00 H new ATOM 0 HG LEU B 69 7.864 -4.479 7.905 1.00 0.00 H new ATOM 0 HD11 LEU B 69 8.498 -5.519 5.745 1.00 0.00 H new ATOM 0 HD12 LEU B 69 9.079 -6.468 7.134 1.00 0.00 H new ATOM 0 HD13 LEU B 69 7.646 -7.006 6.226 1.00 0.00 H new ATOM 0 HD21 LEU B 69 6.475 -4.160 5.914 1.00 0.00 H new ATOM 0 HD22 LEU B 69 5.505 -5.581 6.370 1.00 0.00 H new ATOM 0 HD23 LEU B 69 5.519 -4.141 7.415 1.00 0.00 H new ATOM 1826 N HIS B 70 5.156 -8.101 10.167 1.00 0.00 N ATOM 1827 CA HIS B 70 4.796 -9.115 11.157 1.00 0.00 C ATOM 1828 C HIS B 70 5.731 -9.152 12.366 1.00 0.00 C ATOM 1829 O HIS B 70 5.259 -9.194 13.503 1.00 0.00 O ATOM 1830 CB HIS B 70 4.724 -10.494 10.506 1.00 0.00 C ATOM 1831 CG HIS B 70 3.522 -10.670 9.631 1.00 0.00 C ATOM 1832 ND1 HIS B 70 2.290 -10.112 9.895 1.00 0.00 N ATOM 1833 CD2 HIS B 70 3.382 -11.342 8.464 1.00 0.00 C ATOM 1834 CE1 HIS B 70 1.460 -10.454 8.902 1.00 0.00 C ATOM 1835 NE2 HIS B 70 2.074 -11.202 8.010 1.00 0.00 N ATOM 0 H HIS B 70 5.393 -8.478 9.249 1.00 0.00 H new ATOM 0 HA HIS B 70 3.814 -8.832 11.536 1.00 0.00 H new ATOM 0 HB2 HIS B 70 5.624 -10.656 9.913 1.00 0.00 H new ATOM 0 HB3 HIS B 70 4.713 -11.256 11.285 1.00 0.00 H new ATOM 0 HD2 HIS B 70 4.162 -11.898 7.965 1.00 0.00 H new ATOM 0 HE1 HIS B 70 0.424 -10.156 8.841 1.00 0.00 H new ATOM 0 HE2 HIS B 70 1.673 -11.598 7.160 1.00 0.00 H new ATOM 1843 N ALA B 71 7.036 -9.107 12.140 1.00 0.00 N ATOM 1844 CA ALA B 71 7.995 -9.171 13.243 1.00 0.00 C ATOM 1845 C ALA B 71 8.015 -7.876 14.052 1.00 0.00 C ATOM 1846 O ALA B 71 8.411 -7.864 15.215 1.00 0.00 O ATOM 1847 CB ALA B 71 9.385 -9.488 12.714 1.00 0.00 C ATOM 0 H ALA B 71 7.456 -9.027 11.214 1.00 0.00 H new ATOM 0 HA ALA B 71 7.677 -9.970 13.912 1.00 0.00 H new ATOM 0 HB1 ALA B 71 10.089 -9.533 13.545 1.00 0.00 H new ATOM 0 HB2 ALA B 71 9.368 -10.449 12.200 1.00 0.00 H new ATOM 0 HB3 ALA B 71 9.695 -8.710 12.017 1.00 0.00 H new ATOM 1853 N GLY B 72 7.545 -6.801 13.443 1.00 0.00 N ATOM 1854 CA GLY B 72 7.534 -5.510 14.105 1.00 0.00 C ATOM 1855 C GLY B 72 8.374 -4.521 13.339 1.00 0.00 C ATOM 1856 O GLY B 72 8.780 -3.482 13.853 1.00 0.00 O ATOM 0 H GLY B 72 7.168 -6.797 12.495 1.00 0.00 H new ATOM 0 HA2 GLY B 72 6.511 -5.143 14.184 1.00 0.00 H new ATOM 0 HA3 GLY B 72 7.916 -5.612 15.121 1.00 0.00 H new ATOM 1860 N ASP B 73 8.607 -4.874 12.089 1.00 0.00 N ATOM 1861 CA ASP B 73 9.394 -4.086 11.163 1.00 0.00 C ATOM 1862 C ASP B 73 8.569 -2.900 10.716 1.00 0.00 C ATOM 1863 O ASP B 73 7.345 -2.958 10.762 1.00 0.00 O ATOM 1864 CB ASP B 73 9.764 -4.950 9.951 1.00 0.00 C ATOM 1865 CG ASP B 73 9.951 -6.417 10.303 1.00 0.00 C ATOM 1866 OD1 ASP B 73 11.096 -6.903 10.245 1.00 0.00 O ATOM 1867 OD2 ASP B 73 8.937 -7.087 10.640 1.00 0.00 O ATOM 0 H ASP B 73 8.246 -5.736 11.681 1.00 0.00 H new ATOM 0 HA ASP B 73 10.308 -3.738 11.644 1.00 0.00 H new ATOM 0 HB2 ASP B 73 8.983 -4.860 9.196 1.00 0.00 H new ATOM 0 HB3 ASP B 73 10.683 -4.568 9.507 1.00 0.00 H new ATOM 1872 N THR B 74 9.206 -1.829 10.289 1.00 0.00 N ATOM 1873 CA THR B 74 8.454 -0.668 9.860 1.00 0.00 C ATOM 1874 C THR B 74 9.064 -0.007 8.633 1.00 0.00 C ATOM 1875 O THR B 74 10.266 0.259 8.581 1.00 0.00 O ATOM 1876 CB THR B 74 8.352 0.380 10.990 1.00 0.00 C ATOM 1877 OG1 THR B 74 9.649 0.625 11.546 1.00 0.00 O ATOM 1878 CG2 THR B 74 7.409 -0.075 12.092 1.00 0.00 C ATOM 0 H THR B 74 10.220 -1.738 10.230 1.00 0.00 H new ATOM 0 HA THR B 74 7.459 -1.031 9.602 1.00 0.00 H new ATOM 0 HB THR B 74 7.953 1.297 10.556 1.00 0.00 H new ATOM 0 HG1 THR B 74 9.578 1.292 12.261 1.00 0.00 H new ATOM 0 HG21 THR B 74 7.363 0.688 12.869 1.00 0.00 H new ATOM 0 HG22 THR B 74 6.413 -0.231 11.677 1.00 0.00 H new ATOM 0 HG23 THR B 74 7.774 -1.008 12.521 1.00 0.00 H new ATOM 1886 N THR B 75 8.220 0.247 7.651 1.00 0.00 N ATOM 1887 CA THR B 75 8.635 0.902 6.429 1.00 0.00 C ATOM 1888 C THR B 75 7.908 2.236 6.295 1.00 0.00 C ATOM 1889 O THR B 75 6.705 2.273 6.035 1.00 0.00 O ATOM 1890 CB THR B 75 8.346 0.026 5.197 1.00 0.00 C ATOM 1891 OG1 THR B 75 8.491 -1.359 5.543 1.00 0.00 O ATOM 1892 CG2 THR B 75 9.293 0.370 4.058 1.00 0.00 C ATOM 0 H THR B 75 7.230 0.005 7.679 1.00 0.00 H new ATOM 0 HA THR B 75 9.711 1.068 6.479 1.00 0.00 H new ATOM 0 HB THR B 75 7.324 0.216 4.869 1.00 0.00 H new ATOM 0 HG1 THR B 75 8.922 -1.837 4.804 1.00 0.00 H new ATOM 0 HG21 THR B 75 9.071 -0.261 3.197 1.00 0.00 H new ATOM 0 HG22 THR B 75 9.166 1.417 3.783 1.00 0.00 H new ATOM 0 HG23 THR B 75 10.322 0.201 4.376 1.00 0.00 H new ATOM 1900 N ASN B 76 8.634 3.322 6.509 1.00 0.00 N ATOM 1901 CA ASN B 76 8.058 4.660 6.430 1.00 0.00 C ATOM 1902 C ASN B 76 8.027 5.183 5.003 1.00 0.00 C ATOM 1903 O ASN B 76 8.992 5.035 4.253 1.00 0.00 O ATOM 1904 CB ASN B 76 8.841 5.639 7.304 1.00 0.00 C ATOM 1905 CG ASN B 76 8.302 5.728 8.715 1.00 0.00 C ATOM 1906 OD1 ASN B 76 7.701 4.786 9.231 1.00 0.00 O ATOM 1907 ND2 ASN B 76 8.520 6.863 9.350 1.00 0.00 N ATOM 0 H ASN B 76 9.627 3.305 6.740 1.00 0.00 H new ATOM 0 HA ASN B 76 7.033 4.582 6.792 1.00 0.00 H new ATOM 0 HB2 ASN B 76 9.886 5.332 7.338 1.00 0.00 H new ATOM 0 HB3 ASN B 76 8.814 6.628 6.847 1.00 0.00 H new ATOM 0 HD21 ASN B 76 8.186 6.985 10.306 1.00 0.00 H new ATOM 0 HD22 ASN B 76 9.023 7.619 8.885 1.00 0.00 H new ATOM 1914 N PHE B 77 6.904 5.787 4.641 1.00 0.00 N ATOM 1915 CA PHE B 77 6.718 6.370 3.321 1.00 0.00 C ATOM 1916 C PHE B 77 6.192 7.793 3.460 1.00 0.00 C ATOM 1917 O PHE B 77 5.039 8.004 3.835 1.00 0.00 O ATOM 1918 CB PHE B 77 5.748 5.529 2.488 1.00 0.00 C ATOM 1919 CG PHE B 77 6.297 4.183 2.114 1.00 0.00 C ATOM 1920 CD1 PHE B 77 7.447 4.080 1.348 1.00 0.00 C ATOM 1921 CD2 PHE B 77 5.666 3.023 2.529 1.00 0.00 C ATOM 1922 CE1 PHE B 77 7.957 2.845 1.003 1.00 0.00 C ATOM 1923 CE2 PHE B 77 6.171 1.785 2.187 1.00 0.00 C ATOM 1924 CZ PHE B 77 7.318 1.695 1.424 1.00 0.00 C ATOM 0 H PHE B 77 6.096 5.886 5.255 1.00 0.00 H new ATOM 0 HA PHE B 77 7.680 6.388 2.808 1.00 0.00 H new ATOM 0 HB2 PHE B 77 4.823 5.393 3.048 1.00 0.00 H new ATOM 0 HB3 PHE B 77 5.493 6.075 1.579 1.00 0.00 H new ATOM 0 HD1 PHE B 77 7.950 4.977 1.017 1.00 0.00 H new ATOM 0 HD2 PHE B 77 4.769 3.087 3.127 1.00 0.00 H new ATOM 0 HE1 PHE B 77 8.854 2.778 0.405 1.00 0.00 H new ATOM 0 HE2 PHE B 77 5.669 0.887 2.516 1.00 0.00 H new ATOM 0 HZ PHE B 77 7.715 0.727 1.157 1.00 0.00 H new ATOM 1934 N HIS B 78 7.047 8.760 3.172 1.00 0.00 N ATOM 1935 CA HIS B 78 6.685 10.167 3.279 1.00 0.00 C ATOM 1936 C HIS B 78 6.078 10.676 1.982 1.00 0.00 C ATOM 1937 O HIS B 78 6.706 10.625 0.929 1.00 0.00 O ATOM 1938 CB HIS B 78 7.929 10.997 3.643 1.00 0.00 C ATOM 1939 CG HIS B 78 7.745 12.492 3.580 1.00 0.00 C ATOM 1940 ND1 HIS B 78 8.768 13.376 3.314 1.00 0.00 N ATOM 1941 CD2 HIS B 78 6.634 13.254 3.755 1.00 0.00 C ATOM 1942 CE1 HIS B 78 8.261 14.614 3.332 1.00 0.00 C ATOM 1943 NE2 HIS B 78 6.971 14.595 3.596 1.00 0.00 N ATOM 0 H HIS B 78 8.004 8.596 2.860 1.00 0.00 H new ATOM 0 HA HIS B 78 5.937 10.271 4.065 1.00 0.00 H new ATOM 0 HB2 HIS B 78 8.243 10.728 4.652 1.00 0.00 H new ATOM 0 HB3 HIS B 78 8.741 10.718 2.971 1.00 0.00 H new ATOM 0 HD1 HIS B 78 9.741 13.130 3.135 1.00 0.00 H new ATOM 0 HD2 HIS B 78 5.647 12.879 3.981 1.00 0.00 H new ATOM 0 HE1 HIS B 78 8.835 15.511 3.153 1.00 0.00 H new ATOM 1951 N PHE B 79 4.858 11.173 2.067 1.00 0.00 N ATOM 1952 CA PHE B 79 4.185 11.725 0.907 1.00 0.00 C ATOM 1953 C PHE B 79 4.631 13.170 0.737 1.00 0.00 C ATOM 1954 O PHE B 79 3.934 14.105 1.122 1.00 0.00 O ATOM 1955 CB PHE B 79 2.668 11.629 1.072 1.00 0.00 C ATOM 1956 CG PHE B 79 2.173 10.212 1.150 1.00 0.00 C ATOM 1957 CD1 PHE B 79 2.190 9.523 2.352 1.00 0.00 C ATOM 1958 CD2 PHE B 79 1.697 9.569 0.020 1.00 0.00 C ATOM 1959 CE1 PHE B 79 1.741 8.218 2.424 1.00 0.00 C ATOM 1960 CE2 PHE B 79 1.246 8.265 0.087 1.00 0.00 C ATOM 1961 CZ PHE B 79 1.268 7.588 1.290 1.00 0.00 C ATOM 0 H PHE B 79 4.313 11.206 2.928 1.00 0.00 H new ATOM 0 HA PHE B 79 4.449 11.158 0.014 1.00 0.00 H new ATOM 0 HB2 PHE B 79 2.372 12.161 1.976 1.00 0.00 H new ATOM 0 HB3 PHE B 79 2.185 12.131 0.234 1.00 0.00 H new ATOM 0 HD1 PHE B 79 2.558 10.011 3.242 1.00 0.00 H new ATOM 0 HD2 PHE B 79 1.678 10.093 -0.924 1.00 0.00 H new ATOM 0 HE1 PHE B 79 1.760 7.691 3.367 1.00 0.00 H new ATOM 0 HE2 PHE B 79 0.876 7.775 -0.802 1.00 0.00 H new ATOM 0 HZ PHE B 79 0.916 6.568 1.344 1.00 0.00 H new ATOM 1971 N SER B 80 5.822 13.326 0.180 1.00 0.00 N ATOM 1972 CA SER B 80 6.431 14.632 -0.029 1.00 0.00 C ATOM 1973 C SER B 80 5.769 15.432 -1.152 1.00 0.00 C ATOM 1974 O SER B 80 6.212 16.532 -1.474 1.00 0.00 O ATOM 1975 CB SER B 80 7.919 14.437 -0.311 1.00 0.00 C ATOM 1976 OG SER B 80 8.154 13.187 -0.937 1.00 0.00 O ATOM 0 H SER B 80 6.397 12.547 -0.142 1.00 0.00 H new ATOM 0 HA SER B 80 6.287 15.219 0.878 1.00 0.00 H new ATOM 0 HB2 SER B 80 8.281 15.242 -0.950 1.00 0.00 H new ATOM 0 HB3 SER B 80 8.481 14.493 0.621 1.00 0.00 H new ATOM 0 HG SER B 80 7.547 13.084 -1.699 1.00 0.00 H new ATOM 1982 N ASN B 81 4.722 14.882 -1.752 1.00 0.00 N ATOM 1983 CA ASN B 81 4.018 15.580 -2.820 1.00 0.00 C ATOM 1984 C ASN B 81 3.112 16.652 -2.229 1.00 0.00 C ATOM 1985 O ASN B 81 2.009 16.363 -1.770 1.00 0.00 O ATOM 1986 CB ASN B 81 3.199 14.605 -3.670 1.00 0.00 C ATOM 1987 CG ASN B 81 2.527 15.296 -4.843 1.00 0.00 C ATOM 1988 OD1 ASN B 81 2.989 16.330 -5.319 1.00 0.00 O ATOM 1989 ND2 ASN B 81 1.431 14.731 -5.318 1.00 0.00 N ATOM 0 H ASN B 81 4.344 13.963 -1.521 1.00 0.00 H new ATOM 0 HA ASN B 81 4.758 16.051 -3.467 1.00 0.00 H new ATOM 0 HB2 ASN B 81 3.850 13.813 -4.041 1.00 0.00 H new ATOM 0 HB3 ASN B 81 2.441 14.130 -3.047 1.00 0.00 H new ATOM 0 HD21 ASN B 81 0.940 15.154 -6.106 1.00 0.00 H new ATOM 0 HD22 ASN B 81 1.076 13.872 -4.897 1.00 0.00 H new ATOM 1996 N GLU B 82 3.579 17.893 -2.266 1.00 0.00 N ATOM 1997 CA GLU B 82 2.841 19.033 -1.718 1.00 0.00 C ATOM 1998 C GLU B 82 1.491 19.239 -2.409 1.00 0.00 C ATOM 1999 O GLU B 82 0.669 20.031 -1.952 1.00 0.00 O ATOM 2000 CB GLU B 82 3.675 20.317 -1.849 1.00 0.00 C ATOM 2001 CG GLU B 82 5.165 20.126 -1.585 1.00 0.00 C ATOM 2002 CD GLU B 82 5.956 19.887 -2.858 1.00 0.00 C ATOM 2003 OE1 GLU B 82 6.857 20.693 -3.171 1.00 0.00 O ATOM 2004 OE2 GLU B 82 5.672 18.895 -3.558 1.00 0.00 O ATOM 0 H GLU B 82 4.479 18.142 -2.676 1.00 0.00 H new ATOM 0 HA GLU B 82 2.651 18.812 -0.668 1.00 0.00 H new ATOM 0 HB2 GLU B 82 3.544 20.720 -2.853 1.00 0.00 H new ATOM 0 HB3 GLU B 82 3.287 21.061 -1.153 1.00 0.00 H new ATOM 0 HG2 GLU B 82 5.557 21.008 -1.078 1.00 0.00 H new ATOM 0 HG3 GLU B 82 5.306 19.282 -0.910 1.00 0.00 H new ATOM 2011 N SER B 83 1.261 18.526 -3.502 1.00 0.00 N ATOM 2012 CA SER B 83 0.021 18.656 -4.246 1.00 0.00 C ATOM 2013 C SER B 83 -1.112 17.813 -3.645 1.00 0.00 C ATOM 2014 O SER B 83 -2.166 18.346 -3.300 1.00 0.00 O ATOM 2015 CB SER B 83 0.263 18.274 -5.706 1.00 0.00 C ATOM 2016 OG SER B 83 1.381 18.981 -6.226 1.00 0.00 O ATOM 0 H SER B 83 1.919 17.851 -3.892 1.00 0.00 H new ATOM 0 HA SER B 83 -0.300 19.696 -4.186 1.00 0.00 H new ATOM 0 HB2 SER B 83 0.436 17.201 -5.784 1.00 0.00 H new ATOM 0 HB3 SER B 83 -0.624 18.498 -6.299 1.00 0.00 H new ATOM 0 HG SER B 83 1.524 18.724 -7.161 1.00 0.00 H new ATOM 2022 N THR B 84 -0.903 16.508 -3.508 1.00 0.00 N ATOM 2023 CA THR B 84 -1.948 15.636 -2.977 1.00 0.00 C ATOM 2024 C THR B 84 -1.436 14.698 -1.884 1.00 0.00 C ATOM 2025 O THR B 84 -1.934 13.585 -1.742 1.00 0.00 O ATOM 2026 CB THR B 84 -2.570 14.798 -4.111 1.00 0.00 C ATOM 2027 OG1 THR B 84 -1.593 14.561 -5.135 1.00 0.00 O ATOM 2028 CG2 THR B 84 -3.780 15.502 -4.708 1.00 0.00 C ATOM 0 H THR B 84 -0.033 16.035 -3.753 1.00 0.00 H new ATOM 0 HA THR B 84 -2.699 16.287 -2.531 1.00 0.00 H new ATOM 0 HB THR B 84 -2.897 13.846 -3.692 1.00 0.00 H new ATOM 0 HG1 THR B 84 -0.872 14.003 -4.776 1.00 0.00 H new ATOM 0 HG21 THR B 84 -4.200 14.890 -5.506 1.00 0.00 H new ATOM 0 HG22 THR B 84 -4.531 15.654 -3.933 1.00 0.00 H new ATOM 0 HG23 THR B 84 -3.476 16.467 -5.113 1.00 0.00 H new ATOM 2036 N ALA B 85 -0.489 15.176 -1.086 1.00 0.00 N ATOM 2037 CA ALA B 85 0.115 14.379 -0.012 1.00 0.00 C ATOM 2038 C ALA B 85 -0.924 13.702 0.876 1.00 0.00 C ATOM 2039 O ALA B 85 -0.928 12.483 1.027 1.00 0.00 O ATOM 2040 CB ALA B 85 1.014 15.255 0.844 1.00 0.00 C ATOM 0 H ALA B 85 -0.116 16.122 -1.160 1.00 0.00 H new ATOM 0 HA ALA B 85 0.698 13.593 -0.493 1.00 0.00 H new ATOM 0 HB1 ALA B 85 1.458 14.655 1.638 1.00 0.00 H new ATOM 0 HB2 ALA B 85 1.805 15.679 0.225 1.00 0.00 H new ATOM 0 HB3 ALA B 85 0.426 16.060 1.284 1.00 0.00 H new ATOM 2046 N VAL B 86 -1.805 14.506 1.452 1.00 0.00 N ATOM 2047 CA VAL B 86 -2.839 14.010 2.350 1.00 0.00 C ATOM 2048 C VAL B 86 -3.757 12.987 1.674 1.00 0.00 C ATOM 2049 O VAL B 86 -3.988 11.900 2.204 1.00 0.00 O ATOM 2050 CB VAL B 86 -3.696 15.175 2.884 1.00 0.00 C ATOM 2051 CG1 VAL B 86 -4.873 14.662 3.698 1.00 0.00 C ATOM 2052 CG2 VAL B 86 -2.863 16.128 3.718 1.00 0.00 C ATOM 0 H VAL B 86 -1.824 15.516 1.312 1.00 0.00 H new ATOM 0 HA VAL B 86 -2.324 13.515 3.173 1.00 0.00 H new ATOM 0 HB VAL B 86 -4.083 15.717 2.021 1.00 0.00 H new ATOM 0 HG11 VAL B 86 -5.459 15.506 4.062 1.00 0.00 H new ATOM 0 HG12 VAL B 86 -5.500 14.028 3.071 1.00 0.00 H new ATOM 0 HG13 VAL B 86 -4.505 14.084 4.546 1.00 0.00 H new ATOM 0 HG21 VAL B 86 -3.493 16.940 4.081 1.00 0.00 H new ATOM 0 HG22 VAL B 86 -2.437 15.592 4.566 1.00 0.00 H new ATOM 0 HG23 VAL B 86 -2.059 16.539 3.107 1.00 0.00 H new ATOM 2062 N LYS B 87 -4.253 13.322 0.491 1.00 0.00 N ATOM 2063 CA LYS B 87 -5.181 12.444 -0.218 1.00 0.00 C ATOM 2064 C LYS B 87 -4.504 11.191 -0.764 1.00 0.00 C ATOM 2065 O LYS B 87 -5.095 10.113 -0.731 1.00 0.00 O ATOM 2066 CB LYS B 87 -5.911 13.205 -1.324 1.00 0.00 C ATOM 2067 CG LYS B 87 -7.384 13.460 -1.009 1.00 0.00 C ATOM 2068 CD LYS B 87 -7.572 14.391 0.189 1.00 0.00 C ATOM 2069 CE LYS B 87 -7.516 13.643 1.520 1.00 0.00 C ATOM 2070 NZ LYS B 87 -8.770 12.903 1.826 1.00 0.00 N ATOM 0 H LYS B 87 -4.032 14.189 0.002 1.00 0.00 H new ATOM 0 HA LYS B 87 -5.916 12.105 0.511 1.00 0.00 H new ATOM 0 HB2 LYS B 87 -5.411 14.159 -1.490 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -5.837 12.641 -2.254 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -7.869 13.895 -1.883 1.00 0.00 H new ATOM 0 HG3 LYS B 87 -7.879 12.510 -0.809 1.00 0.00 H new ATOM 0 HD2 LYS B 87 -6.799 15.159 0.174 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -8.531 14.902 0.102 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -6.682 12.941 1.501 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -7.316 14.354 2.322 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -8.551 12.082 2.426 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 -9.430 13.531 2.327 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 -9.206 12.578 0.940 1.00 0.00 H new ATOM 2084 N GLU B 88 -3.279 11.311 -1.261 1.00 0.00 N ATOM 2085 CA GLU B 88 -2.574 10.143 -1.768 1.00 0.00 C ATOM 2086 C GLU B 88 -2.243 9.224 -0.601 1.00 0.00 C ATOM 2087 O GLU B 88 -2.206 8.002 -0.745 1.00 0.00 O ATOM 2088 CB GLU B 88 -1.315 10.535 -2.546 1.00 0.00 C ATOM 2089 CG GLU B 88 -1.625 11.147 -3.901 1.00 0.00 C ATOM 2090 CD GLU B 88 -0.384 11.544 -4.673 1.00 0.00 C ATOM 2091 OE1 GLU B 88 0.126 12.655 -4.440 1.00 0.00 O ATOM 2092 OE2 GLU B 88 0.063 10.758 -5.537 1.00 0.00 O ATOM 0 H GLU B 88 -2.762 12.188 -1.323 1.00 0.00 H new ATOM 0 HA GLU B 88 -3.218 9.616 -2.472 1.00 0.00 H new ATOM 0 HB2 GLU B 88 -0.736 11.245 -1.956 1.00 0.00 H new ATOM 0 HB3 GLU B 88 -0.691 9.653 -2.686 1.00 0.00 H new ATOM 0 HG2 GLU B 88 -2.200 10.434 -4.492 1.00 0.00 H new ATOM 0 HG3 GLU B 88 -2.254 12.026 -3.760 1.00 0.00 H new ATOM 2099 N ARG B 89 -2.022 9.828 0.567 1.00 0.00 N ATOM 2100 CA ARG B 89 -1.756 9.069 1.778 1.00 0.00 C ATOM 2101 C ARG B 89 -2.998 8.270 2.127 1.00 0.00 C ATOM 2102 O ARG B 89 -2.919 7.091 2.453 1.00 0.00 O ATOM 2103 CB ARG B 89 -1.379 10.000 2.939 1.00 0.00 C ATOM 2104 CG ARG B 89 -1.159 9.282 4.265 1.00 0.00 C ATOM 2105 CD ARG B 89 -2.374 9.393 5.175 1.00 0.00 C ATOM 2106 NE ARG B 89 -2.063 10.093 6.421 1.00 0.00 N ATOM 2107 CZ ARG B 89 -2.866 10.996 6.990 1.00 0.00 C ATOM 2108 NH1 ARG B 89 -4.041 11.292 6.446 1.00 0.00 N ATOM 2109 NH2 ARG B 89 -2.495 11.606 8.109 1.00 0.00 N ATOM 0 H ARG B 89 -2.023 10.840 0.695 1.00 0.00 H new ATOM 0 HA ARG B 89 -0.914 8.398 1.607 1.00 0.00 H new ATOM 0 HB2 ARG B 89 -0.470 10.542 2.676 1.00 0.00 H new ATOM 0 HB3 ARG B 89 -2.167 10.742 3.066 1.00 0.00 H new ATOM 0 HG2 ARG B 89 -0.940 8.231 4.077 1.00 0.00 H new ATOM 0 HG3 ARG B 89 -0.289 9.704 4.767 1.00 0.00 H new ATOM 0 HD2 ARG B 89 -3.172 9.921 4.652 1.00 0.00 H new ATOM 0 HD3 ARG B 89 -2.748 8.395 5.403 1.00 0.00 H new ATOM 0 HE ARG B 89 -1.179 9.879 6.883 1.00 0.00 H new ATOM 0 HH11 ARG B 89 -4.337 10.828 5.587 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -4.648 11.983 6.887 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -1.595 11.385 8.536 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -3.110 12.295 8.542 1.00 0.00 H new ATOM 2123 N ASP B 90 -4.145 8.937 2.038 1.00 0.00 N ATOM 2124 CA ASP B 90 -5.434 8.313 2.315 1.00 0.00 C ATOM 2125 C ASP B 90 -5.684 7.169 1.350 1.00 0.00 C ATOM 2126 O ASP B 90 -6.178 6.118 1.743 1.00 0.00 O ATOM 2127 CB ASP B 90 -6.570 9.331 2.190 1.00 0.00 C ATOM 2128 CG ASP B 90 -6.877 10.031 3.494 1.00 0.00 C ATOM 2129 OD1 ASP B 90 -7.560 11.077 3.457 1.00 0.00 O ATOM 2130 OD2 ASP B 90 -6.445 9.526 4.557 1.00 0.00 O ATOM 0 H ASP B 90 -4.207 9.920 1.773 1.00 0.00 H new ATOM 0 HA ASP B 90 -5.408 7.932 3.336 1.00 0.00 H new ATOM 0 HB2 ASP B 90 -6.304 10.074 1.438 1.00 0.00 H new ATOM 0 HB3 ASP B 90 -7.468 8.825 1.835 1.00 0.00 H new ATOM 2135 N ALA B 91 -5.329 7.383 0.086 1.00 0.00 N ATOM 2136 CA ALA B 91 -5.508 6.372 -0.942 1.00 0.00 C ATOM 2137 C ALA B 91 -4.748 5.101 -0.587 1.00 0.00 C ATOM 2138 O ALA B 91 -5.303 4.009 -0.622 1.00 0.00 O ATOM 2139 CB ALA B 91 -5.059 6.908 -2.293 1.00 0.00 C ATOM 0 H ALA B 91 -4.914 8.253 -0.248 1.00 0.00 H new ATOM 0 HA ALA B 91 -6.568 6.125 -1.003 1.00 0.00 H new ATOM 0 HB1 ALA B 91 -5.199 6.140 -3.054 1.00 0.00 H new ATOM 0 HB2 ALA B 91 -5.651 7.786 -2.551 1.00 0.00 H new ATOM 0 HB3 ALA B 91 -4.005 7.182 -2.244 1.00 0.00 H new ATOM 2145 N VAL B 92 -3.480 5.253 -0.223 1.00 0.00 N ATOM 2146 CA VAL B 92 -2.650 4.112 0.145 1.00 0.00 C ATOM 2147 C VAL B 92 -3.139 3.510 1.452 1.00 0.00 C ATOM 2148 O VAL B 92 -3.200 2.296 1.614 1.00 0.00 O ATOM 2149 CB VAL B 92 -1.169 4.521 0.312 1.00 0.00 C ATOM 2150 CG1 VAL B 92 -0.317 3.332 0.733 1.00 0.00 C ATOM 2151 CG2 VAL B 92 -0.633 5.127 -0.970 1.00 0.00 C ATOM 0 H VAL B 92 -3.005 6.154 -0.175 1.00 0.00 H new ATOM 0 HA VAL B 92 -2.726 3.380 -0.659 1.00 0.00 H new ATOM 0 HB VAL B 92 -1.117 5.273 1.100 1.00 0.00 H new ATOM 0 HG11 VAL B 92 0.720 3.648 0.843 1.00 0.00 H new ATOM 0 HG12 VAL B 92 -0.680 2.942 1.684 1.00 0.00 H new ATOM 0 HG13 VAL B 92 -0.380 2.552 -0.026 1.00 0.00 H new ATOM 0 HG21 VAL B 92 0.411 5.408 -0.831 1.00 0.00 H new ATOM 0 HG22 VAL B 92 -0.708 4.398 -1.776 1.00 0.00 H new ATOM 0 HG23 VAL B 92 -1.216 6.012 -1.226 1.00 0.00 H new ATOM 2161 N LYS B 93 -3.525 4.389 2.353 1.00 0.00 N ATOM 2162 CA LYS B 93 -4.000 4.018 3.670 1.00 0.00 C ATOM 2163 C LYS B 93 -5.264 3.171 3.589 1.00 0.00 C ATOM 2164 O LYS B 93 -5.315 2.061 4.124 1.00 0.00 O ATOM 2165 CB LYS B 93 -4.244 5.304 4.458 1.00 0.00 C ATOM 2166 CG LYS B 93 -5.200 5.177 5.621 1.00 0.00 C ATOM 2167 CD LYS B 93 -5.403 6.520 6.290 1.00 0.00 C ATOM 2168 CE LYS B 93 -6.862 6.772 6.605 1.00 0.00 C ATOM 2169 NZ LYS B 93 -7.603 7.331 5.438 1.00 0.00 N ATOM 0 H LYS B 93 -3.518 5.396 2.189 1.00 0.00 H new ATOM 0 HA LYS B 93 -3.253 3.406 4.175 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -3.287 5.668 4.833 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -4.627 6.062 3.775 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -6.157 4.790 5.272 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -4.810 4.460 6.343 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -4.820 6.561 7.210 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -5.029 7.311 5.640 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -7.331 5.839 6.917 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -6.936 7.463 7.445 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -8.407 7.897 5.776 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -6.966 7.934 4.879 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -7.953 6.553 4.844 1.00 0.00 H new ATOM 2183 N ASP B 94 -6.268 3.689 2.897 1.00 0.00 N ATOM 2184 CA ASP B 94 -7.544 3.003 2.741 1.00 0.00 C ATOM 2185 C ASP B 94 -7.396 1.733 1.913 1.00 0.00 C ATOM 2186 O ASP B 94 -8.024 0.711 2.196 1.00 0.00 O ATOM 2187 CB ASP B 94 -8.570 3.937 2.105 1.00 0.00 C ATOM 2188 CG ASP B 94 -9.358 4.716 3.141 1.00 0.00 C ATOM 2189 OD1 ASP B 94 -10.588 4.503 3.240 1.00 0.00 O ATOM 2190 OD2 ASP B 94 -8.750 5.523 3.883 1.00 0.00 O ATOM 0 H ASP B 94 -6.222 4.594 2.429 1.00 0.00 H new ATOM 0 HA ASP B 94 -7.893 2.714 3.732 1.00 0.00 H new ATOM 0 HB2 ASP B 94 -8.061 4.634 1.440 1.00 0.00 H new ATOM 0 HB3 ASP B 94 -9.257 3.355 1.491 1.00 0.00 H new ATOM 2195 N LEU B 95 -6.540 1.791 0.913 1.00 0.00 N ATOM 2196 CA LEU B 95 -6.308 0.640 0.051 1.00 0.00 C ATOM 2197 C LEU B 95 -5.545 -0.423 0.815 1.00 0.00 C ATOM 2198 O LEU B 95 -5.682 -1.609 0.543 1.00 0.00 O ATOM 2199 CB LEU B 95 -5.530 1.034 -1.208 1.00 0.00 C ATOM 2200 CG LEU B 95 -6.362 1.153 -2.488 1.00 0.00 C ATOM 2201 CD1 LEU B 95 -7.088 -0.151 -2.777 1.00 0.00 C ATOM 2202 CD2 LEU B 95 -7.350 2.305 -2.380 1.00 0.00 C ATOM 0 H LEU B 95 -5.993 2.618 0.674 1.00 0.00 H new ATOM 0 HA LEU B 95 -7.276 0.247 -0.260 1.00 0.00 H new ATOM 0 HB2 LEU B 95 -5.038 1.989 -1.025 1.00 0.00 H new ATOM 0 HB3 LEU B 95 -4.744 0.297 -1.374 1.00 0.00 H new ATOM 0 HG LEU B 95 -5.686 1.359 -3.318 1.00 0.00 H new ATOM 0 HD11 LEU B 95 -7.674 -0.047 -3.690 1.00 0.00 H new ATOM 0 HD12 LEU B 95 -6.360 -0.953 -2.902 1.00 0.00 H new ATOM 0 HD13 LEU B 95 -7.751 -0.390 -1.946 1.00 0.00 H new ATOM 0 HD21 LEU B 95 -7.932 2.373 -3.299 1.00 0.00 H new ATOM 0 HD22 LEU B 95 -8.021 2.132 -1.538 1.00 0.00 H new ATOM 0 HD23 LEU B 95 -6.807 3.237 -2.225 1.00 0.00 H new ATOM 2214 N LEU B 96 -4.741 0.002 1.774 1.00 0.00 N ATOM 2215 CA LEU B 96 -3.994 -0.938 2.578 1.00 0.00 C ATOM 2216 C LEU B 96 -4.942 -1.688 3.492 1.00 0.00 C ATOM 2217 O LEU B 96 -4.950 -2.908 3.478 1.00 0.00 O ATOM 2218 CB LEU B 96 -2.893 -0.252 3.357 1.00 0.00 C ATOM 2219 CG LEU B 96 -1.562 -0.168 2.616 1.00 0.00 C ATOM 2220 CD1 LEU B 96 -0.544 0.582 3.442 1.00 0.00 C ATOM 2221 CD2 LEU B 96 -1.046 -1.555 2.270 1.00 0.00 C ATOM 0 H LEU B 96 -4.592 0.983 2.010 1.00 0.00 H new ATOM 0 HA LEU B 96 -3.506 -1.654 1.917 1.00 0.00 H new ATOM 0 HB2 LEU B 96 -3.218 0.757 3.613 1.00 0.00 H new ATOM 0 HB3 LEU B 96 -2.741 -0.785 4.295 1.00 0.00 H new ATOM 0 HG LEU B 96 -1.725 0.376 1.686 1.00 0.00 H new ATOM 0 HD11 LEU B 96 0.400 0.633 2.899 1.00 0.00 H new ATOM 0 HD12 LEU B 96 -0.906 1.592 3.636 1.00 0.00 H new ATOM 0 HD13 LEU B 96 -0.390 0.064 4.388 1.00 0.00 H new ATOM 0 HD21 LEU B 96 -0.096 -1.469 1.742 1.00 0.00 H new ATOM 0 HD22 LEU B 96 -0.902 -2.128 3.186 1.00 0.00 H new ATOM 0 HD23 LEU B 96 -1.770 -2.064 1.634 1.00 0.00 H new ATOM 2233 N GLN B 97 -5.755 -0.976 4.286 1.00 0.00 N ATOM 2234 CA GLN B 97 -6.749 -1.646 5.125 1.00 0.00 C ATOM 2235 C GLN B 97 -7.647 -2.535 4.266 1.00 0.00 C ATOM 2236 O GLN B 97 -8.348 -3.413 4.770 1.00 0.00 O ATOM 2237 CB GLN B 97 -7.594 -0.625 5.883 1.00 0.00 C ATOM 2238 CG GLN B 97 -7.755 0.694 5.168 1.00 0.00 C ATOM 2239 CD GLN B 97 -7.907 1.868 6.112 1.00 0.00 C ATOM 2240 OE1 GLN B 97 -8.439 2.913 5.749 1.00 0.00 O ATOM 2241 NE2 GLN B 97 -7.481 1.692 7.337 1.00 0.00 N ATOM 0 H GLN B 97 -5.743 0.041 4.362 1.00 0.00 H new ATOM 0 HA GLN B 97 -6.224 -2.266 5.852 1.00 0.00 H new ATOM 0 HB2 GLN B 97 -8.581 -1.050 6.065 1.00 0.00 H new ATOM 0 HB3 GLN B 97 -7.140 -0.445 6.857 1.00 0.00 H new ATOM 0 HG2 GLN B 97 -6.889 0.861 4.527 1.00 0.00 H new ATOM 0 HG3 GLN B 97 -8.628 0.643 4.517 1.00 0.00 H new ATOM 0 HE21 GLN B 97 -7.044 0.810 7.603 1.00 0.00 H new ATOM 0 HE22 GLN B 97 -7.586 2.437 8.026 1.00 0.00 H new ATOM 2250 N GLN B 98 -7.639 -2.267 2.967 1.00 0.00 N ATOM 2251 CA GLN B 98 -8.406 -3.036 2.008 1.00 0.00 C ATOM 2252 C GLN B 98 -7.672 -4.285 1.529 1.00 0.00 C ATOM 2253 O GLN B 98 -8.211 -5.383 1.592 1.00 0.00 O ATOM 2254 CB GLN B 98 -8.757 -2.154 0.808 1.00 0.00 C ATOM 2255 CG GLN B 98 -10.069 -1.430 0.984 1.00 0.00 C ATOM 2256 CD GLN B 98 -10.835 -1.978 2.163 1.00 0.00 C ATOM 2257 OE1 GLN B 98 -10.785 -1.433 3.262 1.00 0.00 O ATOM 2258 NE2 GLN B 98 -11.512 -3.084 1.950 1.00 0.00 N ATOM 0 H GLN B 98 -7.098 -1.508 2.552 1.00 0.00 H new ATOM 0 HA GLN B 98 -9.312 -3.371 2.514 1.00 0.00 H new ATOM 0 HB2 GLN B 98 -7.962 -1.425 0.653 1.00 0.00 H new ATOM 0 HB3 GLN B 98 -8.804 -2.770 -0.090 1.00 0.00 H new ATOM 0 HG2 GLN B 98 -9.884 -0.366 1.129 1.00 0.00 H new ATOM 0 HG3 GLN B 98 -10.668 -1.530 0.079 1.00 0.00 H new ATOM 0 HE21 GLN B 98 -11.526 -3.502 1.020 1.00 0.00 H new ATOM 0 HE22 GLN B 98 -12.024 -3.524 2.715 1.00 0.00 H new ATOM 2267 N LEU B 99 -6.445 -4.113 1.062 1.00 0.00 N ATOM 2268 CA LEU B 99 -5.666 -5.221 0.513 1.00 0.00 C ATOM 2269 C LEU B 99 -4.850 -5.989 1.558 1.00 0.00 C ATOM 2270 O LEU B 99 -4.582 -7.176 1.380 1.00 0.00 O ATOM 2271 CB LEU B 99 -4.740 -4.689 -0.575 1.00 0.00 C ATOM 2272 CG LEU B 99 -5.453 -3.949 -1.703 1.00 0.00 C ATOM 2273 CD1 LEU B 99 -4.527 -2.931 -2.350 1.00 0.00 C ATOM 2274 CD2 LEU B 99 -5.971 -4.929 -2.741 1.00 0.00 C ATOM 0 H LEU B 99 -5.962 -3.214 1.051 1.00 0.00 H new ATOM 0 HA LEU B 99 -6.382 -5.936 0.107 1.00 0.00 H new ATOM 0 HB2 LEU B 99 -4.012 -4.018 -0.119 1.00 0.00 H new ATOM 0 HB3 LEU B 99 -4.182 -5.523 -1.000 1.00 0.00 H new ATOM 0 HG LEU B 99 -6.303 -3.416 -1.276 1.00 0.00 H new ATOM 0 HD11 LEU B 99 -5.056 -2.415 -3.151 1.00 0.00 H new ATOM 0 HD12 LEU B 99 -4.205 -2.206 -1.603 1.00 0.00 H new ATOM 0 HD13 LEU B 99 -3.655 -3.441 -2.760 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -6.476 -4.382 -3.537 1.00 0.00 H new ATOM 0 HD22 LEU B 99 -5.136 -5.491 -3.160 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -6.673 -5.618 -2.272 1.00 0.00 H new ATOM 2286 N LEU B 100 -4.464 -5.325 2.639 1.00 0.00 N ATOM 2287 CA LEU B 100 -3.647 -5.954 3.680 1.00 0.00 C ATOM 2288 C LEU B 100 -4.261 -7.255 4.228 1.00 0.00 C ATOM 2289 O LEU B 100 -3.616 -8.297 4.164 1.00 0.00 O ATOM 2290 CB LEU B 100 -3.350 -4.970 4.828 1.00 0.00 C ATOM 2291 CG LEU B 100 -2.172 -4.022 4.570 1.00 0.00 C ATOM 2292 CD1 LEU B 100 -2.028 -2.979 5.682 1.00 0.00 C ATOM 2293 CD2 LEU B 100 -0.890 -4.818 4.419 1.00 0.00 C ATOM 0 H LEU B 100 -4.701 -4.350 2.822 1.00 0.00 H new ATOM 0 HA LEU B 100 -2.708 -6.228 3.200 1.00 0.00 H new ATOM 0 HB2 LEU B 100 -4.243 -4.375 5.018 1.00 0.00 H new ATOM 0 HB3 LEU B 100 -3.148 -5.541 5.734 1.00 0.00 H new ATOM 0 HG LEU B 100 -2.372 -3.484 3.644 1.00 0.00 H new ATOM 0 HD11 LEU B 100 -1.183 -2.327 5.462 1.00 0.00 H new ATOM 0 HD12 LEU B 100 -2.939 -2.384 5.743 1.00 0.00 H new ATOM 0 HD13 LEU B 100 -1.860 -3.483 6.634 1.00 0.00 H new ATOM 0 HD21 LEU B 100 -0.059 -4.137 4.236 1.00 0.00 H new ATOM 0 HD22 LEU B 100 -0.703 -5.383 5.332 1.00 0.00 H new ATOM 0 HD23 LEU B 100 -0.986 -5.507 3.580 1.00 0.00 H new ATOM 2305 N PRO B 101 -5.507 -7.239 4.749 1.00 0.00 N ATOM 2306 CA PRO B 101 -6.129 -8.445 5.321 1.00 0.00 C ATOM 2307 C PRO B 101 -6.461 -9.538 4.295 1.00 0.00 C ATOM 2308 O PRO B 101 -6.158 -10.709 4.524 1.00 0.00 O ATOM 2309 CB PRO B 101 -7.409 -7.916 5.974 1.00 0.00 C ATOM 2310 CG PRO B 101 -7.721 -6.657 5.244 1.00 0.00 C ATOM 2311 CD PRO B 101 -6.399 -6.067 4.845 1.00 0.00 C ATOM 0 HA PRO B 101 -5.442 -8.939 6.008 1.00 0.00 H new ATOM 0 HB2 PRO B 101 -8.223 -8.635 5.886 1.00 0.00 H new ATOM 0 HB3 PRO B 101 -7.262 -7.729 7.038 1.00 0.00 H new ATOM 0 HG2 PRO B 101 -8.338 -6.857 4.368 1.00 0.00 H new ATOM 0 HG3 PRO B 101 -8.280 -5.968 5.877 1.00 0.00 H new ATOM 0 HD2 PRO B 101 -6.467 -5.537 3.895 1.00 0.00 H new ATOM 0 HD3 PRO B 101 -6.041 -5.351 5.584 1.00 0.00 H new ATOM 2319 N LYS B 102 -7.082 -9.170 3.174 1.00 0.00 N ATOM 2320 CA LYS B 102 -7.452 -10.154 2.149 1.00 0.00 C ATOM 2321 C LYS B 102 -6.236 -10.915 1.618 1.00 0.00 C ATOM 2322 O LYS B 102 -6.330 -12.104 1.305 1.00 0.00 O ATOM 2323 CB LYS B 102 -8.211 -9.499 0.984 1.00 0.00 C ATOM 2324 CG LYS B 102 -7.657 -8.150 0.559 1.00 0.00 C ATOM 2325 CD LYS B 102 -8.247 -7.678 -0.768 1.00 0.00 C ATOM 2326 CE LYS B 102 -9.769 -7.600 -0.736 1.00 0.00 C ATOM 2327 NZ LYS B 102 -10.276 -6.698 0.335 1.00 0.00 N ATOM 0 H LYS B 102 -7.339 -8.208 2.951 1.00 0.00 H new ATOM 0 HA LYS B 102 -8.114 -10.870 2.636 1.00 0.00 H new ATOM 0 HB2 LYS B 102 -8.191 -10.173 0.128 1.00 0.00 H new ATOM 0 HB3 LYS B 102 -9.256 -9.376 1.269 1.00 0.00 H new ATOM 0 HG2 LYS B 102 -7.869 -7.412 1.332 1.00 0.00 H new ATOM 0 HG3 LYS B 102 -6.573 -8.216 0.470 1.00 0.00 H new ATOM 0 HD2 LYS B 102 -7.841 -6.697 -1.014 1.00 0.00 H new ATOM 0 HD3 LYS B 102 -7.938 -8.358 -1.562 1.00 0.00 H new ATOM 0 HE2 LYS B 102 -10.131 -7.249 -1.702 1.00 0.00 H new ATOM 0 HE3 LYS B 102 -10.177 -8.600 -0.587 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 -11.053 -7.166 0.844 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 -9.506 -6.482 1.000 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 -10.624 -5.815 -0.091 1.00 0.00 H new ATOM 2341 N PHE B 103 -5.096 -10.243 1.526 1.00 0.00 N ATOM 2342 CA PHE B 103 -3.885 -10.881 1.029 1.00 0.00 C ATOM 2343 C PHE B 103 -2.997 -11.346 2.174 1.00 0.00 C ATOM 2344 O PHE B 103 -1.918 -11.888 1.945 1.00 0.00 O ATOM 2345 CB PHE B 103 -3.104 -9.932 0.123 1.00 0.00 C ATOM 2346 CG PHE B 103 -3.788 -9.649 -1.180 1.00 0.00 C ATOM 2347 CD1 PHE B 103 -4.556 -8.510 -1.335 1.00 0.00 C ATOM 2348 CD2 PHE B 103 -3.666 -10.521 -2.249 1.00 0.00 C ATOM 2349 CE1 PHE B 103 -5.190 -8.243 -2.529 1.00 0.00 C ATOM 2350 CE2 PHE B 103 -4.299 -10.259 -3.448 1.00 0.00 C ATOM 2351 CZ PHE B 103 -5.063 -9.117 -3.585 1.00 0.00 C ATOM 0 H PHE B 103 -4.985 -9.263 1.787 1.00 0.00 H new ATOM 0 HA PHE B 103 -4.190 -11.753 0.450 1.00 0.00 H new ATOM 0 HB2 PHE B 103 -2.941 -8.992 0.650 1.00 0.00 H new ATOM 0 HB3 PHE B 103 -2.122 -10.360 -0.077 1.00 0.00 H new ATOM 0 HD1 PHE B 103 -4.660 -7.821 -0.510 1.00 0.00 H new ATOM 0 HD2 PHE B 103 -3.070 -11.415 -2.144 1.00 0.00 H new ATOM 0 HE1 PHE B 103 -5.786 -7.349 -2.636 1.00 0.00 H new ATOM 0 HE2 PHE B 103 -4.197 -10.945 -4.276 1.00 0.00 H new ATOM 0 HZ PHE B 103 -5.561 -8.909 -4.521 1.00 0.00 H new ATOM 2361 N LYS B 104 -3.454 -11.142 3.402 1.00 0.00 N ATOM 2362 CA LYS B 104 -2.689 -11.545 4.574 1.00 0.00 C ATOM 2363 C LYS B 104 -2.673 -13.063 4.679 1.00 0.00 C ATOM 2364 O LYS B 104 -3.690 -13.680 4.989 1.00 0.00 O ATOM 2365 CB LYS B 104 -3.308 -10.929 5.831 1.00 0.00 C ATOM 2366 CG LYS B 104 -2.355 -10.821 7.006 1.00 0.00 C ATOM 2367 CD LYS B 104 -2.586 -9.541 7.792 1.00 0.00 C ATOM 2368 CE LYS B 104 -2.278 -8.312 6.951 1.00 0.00 C ATOM 2369 NZ LYS B 104 -2.579 -7.051 7.674 1.00 0.00 N ATOM 0 H LYS B 104 -4.349 -10.701 3.612 1.00 0.00 H new ATOM 0 HA LYS B 104 -1.663 -11.190 4.478 1.00 0.00 H new ATOM 0 HB2 LYS B 104 -3.681 -9.934 5.588 1.00 0.00 H new ATOM 0 HB3 LYS B 104 -4.168 -11.528 6.130 1.00 0.00 H new ATOM 0 HG2 LYS B 104 -2.486 -11.681 7.662 1.00 0.00 H new ATOM 0 HG3 LYS B 104 -1.327 -10.848 6.646 1.00 0.00 H new ATOM 0 HD2 LYS B 104 -3.621 -9.502 8.131 1.00 0.00 H new ATOM 0 HD3 LYS B 104 -1.958 -9.541 8.683 1.00 0.00 H new ATOM 0 HE2 LYS B 104 -1.226 -8.323 6.665 1.00 0.00 H new ATOM 0 HE3 LYS B 104 -2.859 -8.349 6.030 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 -2.047 -6.268 7.243 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 -3.598 -6.851 7.614 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 -2.304 -7.149 8.672 1.00 0.00 H new ATOM 2383 N ARG B 105 -1.511 -13.655 4.438 1.00 0.00 N ATOM 2384 CA ARG B 105 -1.368 -15.103 4.479 1.00 0.00 C ATOM 2385 C ARG B 105 -0.104 -15.508 5.226 1.00 0.00 C ATOM 2386 O ARG B 105 1.012 -15.270 4.758 1.00 0.00 O ATOM 2387 CB ARG B 105 -1.334 -15.674 3.057 1.00 0.00 C ATOM 2388 CG ARG B 105 -2.542 -16.533 2.708 1.00 0.00 C ATOM 2389 CD ARG B 105 -3.811 -15.703 2.606 1.00 0.00 C ATOM 2390 NE ARG B 105 -4.831 -16.148 3.551 1.00 0.00 N ATOM 2391 CZ ARG B 105 -6.082 -15.697 3.575 1.00 0.00 C ATOM 2392 NH1 ARG B 105 -6.466 -14.730 2.744 1.00 0.00 N ATOM 2393 NH2 ARG B 105 -6.941 -16.196 4.454 1.00 0.00 N ATOM 0 H ARG B 105 -0.652 -13.153 4.212 1.00 0.00 H new ATOM 0 HA ARG B 105 -2.228 -15.510 5.010 1.00 0.00 H new ATOM 0 HB2 ARG B 105 -1.269 -14.850 2.347 1.00 0.00 H new ATOM 0 HB3 ARG B 105 -0.430 -16.270 2.937 1.00 0.00 H new ATOM 0 HG2 ARG B 105 -2.364 -17.044 1.762 1.00 0.00 H new ATOM 0 HG3 ARG B 105 -2.672 -17.304 3.467 1.00 0.00 H new ATOM 0 HD2 ARG B 105 -3.575 -14.655 2.793 1.00 0.00 H new ATOM 0 HD3 ARG B 105 -4.205 -15.765 1.591 1.00 0.00 H new ATOM 0 HE ARG B 105 -4.566 -16.853 4.239 1.00 0.00 H new ATOM 0 HH11 ARG B 105 -5.799 -14.330 2.084 1.00 0.00 H new ATOM 0 HH12 ARG B 105 -7.427 -14.389 2.768 1.00 0.00 H new ATOM 0 HH21 ARG B 105 -6.641 -16.921 5.106 1.00 0.00 H new ATOM 0 HH22 ARG B 105 -7.902 -15.855 4.478 1.00 0.00 H new ATOM 2407 N LYS B 106 -0.296 -16.110 6.389 1.00 0.00 N ATOM 2408 CA LYS B 106 0.805 -16.578 7.230 1.00 0.00 C ATOM 2409 C LYS B 106 0.315 -17.735 8.088 1.00 0.00 C ATOM 2410 O LYS B 106 0.812 -18.853 7.993 1.00 0.00 O ATOM 2411 CB LYS B 106 1.335 -15.452 8.127 1.00 0.00 C ATOM 2412 CG LYS B 106 2.352 -14.544 7.451 1.00 0.00 C ATOM 2413 CD LYS B 106 3.593 -15.312 7.020 1.00 0.00 C ATOM 2414 CE LYS B 106 4.628 -14.396 6.384 1.00 0.00 C ATOM 2415 NZ LYS B 106 4.117 -13.754 5.144 1.00 0.00 N ATOM 0 H LYS B 106 -1.220 -16.290 6.781 1.00 0.00 H new ATOM 0 HA LYS B 106 1.622 -16.907 6.588 1.00 0.00 H new ATOM 0 HB2 LYS B 106 0.494 -14.847 8.468 1.00 0.00 H new ATOM 0 HB3 LYS B 106 1.791 -15.893 9.014 1.00 0.00 H new ATOM 0 HG2 LYS B 106 1.896 -14.071 6.581 1.00 0.00 H new ATOM 0 HG3 LYS B 106 2.638 -13.745 8.135 1.00 0.00 H new ATOM 0 HD2 LYS B 106 4.031 -15.811 7.884 1.00 0.00 H new ATOM 0 HD3 LYS B 106 3.311 -16.091 6.311 1.00 0.00 H new ATOM 0 HE2 LYS B 106 4.918 -13.625 7.098 1.00 0.00 H new ATOM 0 HE3 LYS B 106 5.526 -14.969 6.152 1.00 0.00 H new ATOM 0 HZ1 LYS B 106 4.908 -13.320 4.627 1.00 0.00 H new ATOM 0 HZ2 LYS B 106 3.663 -14.471 4.543 1.00 0.00 H new ATOM 0 HZ3 LYS B 106 3.422 -13.021 5.393 1.00 0.00 H new ATOM 2429 N ALA B 107 -0.668 -17.439 8.921 1.00 0.00 N ATOM 2430 CA ALA B 107 -1.282 -18.429 9.791 1.00 0.00 C ATOM 2431 C ALA B 107 -2.785 -18.375 9.587 1.00 0.00 C ATOM 2432 O ALA B 107 -3.572 -18.754 10.453 1.00 0.00 O ATOM 2433 CB ALA B 107 -0.915 -18.165 11.246 1.00 0.00 C ATOM 0 H ALA B 107 -1.064 -16.504 9.014 1.00 0.00 H new ATOM 0 HA ALA B 107 -0.916 -19.425 9.542 1.00 0.00 H new ATOM 0 HB1 ALA B 107 -1.384 -18.916 11.882 1.00 0.00 H new ATOM 0 HB2 ALA B 107 0.168 -18.215 11.363 1.00 0.00 H new ATOM 0 HB3 ALA B 107 -1.266 -17.174 11.536 1.00 0.00 H new ATOM 2439 N ASN B 108 -3.152 -17.890 8.411 1.00 0.00 N ATOM 2440 CA ASN B 108 -4.536 -17.722 8.007 1.00 0.00 C ATOM 2441 C ASN B 108 -4.569 -17.568 6.495 1.00 0.00 C ATOM 2442 O ASN B 108 -3.568 -17.056 5.945 1.00 0.00 O ATOM 2443 CB ASN B 108 -5.141 -16.487 8.696 1.00 0.00 C ATOM 2444 CG ASN B 108 -6.241 -15.813 7.888 1.00 0.00 C ATOM 2445 OD1 ASN B 108 -7.416 -16.155 8.004 1.00 0.00 O ATOM 2446 ND2 ASN B 108 -5.864 -14.839 7.068 1.00 0.00 N ATOM 2447 OXT ASN B 108 -5.571 -17.960 5.864 1.00 0.00 O ATOM 0 H ASN B 108 -2.483 -17.597 7.699 1.00 0.00 H new ATOM 0 HA ASN B 108 -5.128 -18.589 8.302 1.00 0.00 H new ATOM 0 HB2 ASN B 108 -5.543 -16.783 9.665 1.00 0.00 H new ATOM 0 HB3 ASN B 108 -4.348 -15.764 8.888 1.00 0.00 H new ATOM 0 HD21 ASN B 108 -6.559 -14.347 6.507 1.00 0.00 H new ATOM 0 HD22 ASN B 108 -4.879 -14.583 6.999 1.00 0.00 H new TER 2454 ASN B 108