USER MOD reduce.3.24.130724 H: found=0, std=0, add=732, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 738 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 58 SER OG : rot 180:sc= 0.754 USER MOD Set 1.2: B 61 ASN : amide:sc= 1.09 K(o=1.8,f=0.024) USER MOD Set 2.1: A 58 SER OG : rot 180:sc= 0.76 USER MOD Set 2.2: A 61 ASN : amide:sc= 0.927 K(o=1.7,f=0.093) USER MOD Single : A 39 TYR OH : rot -107:sc= 0.117 USER MOD Single : A 42 THR OG1 : rot 92:sc= 1.24 USER MOD Single : A 45 LYS NZ :NH3+ -174:sc= 0.827 (180deg=0.707) USER MOD Single : A 48 MET CE :methyl 176:sc= -0.286 (180deg=-0.302) USER MOD Single : A 52 SER OG : rot -32:sc= 1.16 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 ASN : amide:sc=-0.00394 X(o=-0.0039,f=0.33) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= 0 K(o=0,f=-0.97) USER MOD Single : A 68 LYS NZ :NH3+ 160:sc= 1.22 (180deg=1.18) USER MOD Single : A 69 GLN : amide:sc= 0.356 X(o=0.36,f=-0.0016) USER MOD Single : A 72 MET CE :methyl -164:sc=-0.00428 (180deg=-0.219) USER MOD Single : A 78 ASN : amide:sc= 0.408 X(o=0.41,f=0) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : B 39 TYR OH : rot -110:sc= 0.117 USER MOD Single : B 42 THR OG1 : rot 88:sc= 1.25 USER MOD Single : B 45 LYS NZ :NH3+ -172:sc= 0.772 (180deg=0.697) USER MOD Single : B 48 MET CE :methyl 179:sc= -0.291 (180deg=-0.294) USER MOD Single : B 52 SER OG : rot -39:sc= 1.2 USER MOD Single : B 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 54 TYR OH : rot 180:sc= 0 USER MOD Single : B 56 ASN : amide:sc= 0 X(o=0,f=0.33) USER MOD Single : B 65 SER OG : rot 180:sc= 0 USER MOD Single : B 66 GLN : amide:sc= 0 K(o=0,f=-0.95) USER MOD Single : B 68 LYS NZ :NH3+ 160:sc= 1.22 (180deg=1.18) USER MOD Single : B 69 GLN : amide:sc= 0.365 X(o=0.37,f=-0.011) USER MOD Single : B 72 MET CE :methyl -165:sc=-0.00651 (180deg=-0.219) USER MOD Single : B 78 ASN : amide:sc= 0.411 X(o=0.41,f=0) USER MOD Single : B 80 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 38 15.774 -7.929 -50.708 1.00 0.00 N ATOM 2 CA ASP A 38 15.121 -8.363 -49.478 1.00 0.00 C ATOM 3 C ASP A 38 14.429 -7.199 -48.782 1.00 0.00 C ATOM 4 O ASP A 38 13.656 -7.394 -47.844 1.00 0.00 O ATOM 5 CB ASP A 38 16.137 -9.002 -48.528 1.00 0.00 C ATOM 6 CG ASP A 38 16.706 -10.310 -49.061 1.00 0.00 C ATOM 7 OD1 ASP A 38 16.028 -10.965 -49.818 1.00 0.00 O ATOM 8 OD2 ASP A 38 17.810 -10.643 -48.706 1.00 0.00 O ATOM 0 HA ASP A 38 14.367 -9.103 -49.747 1.00 0.00 H new ATOM 0 HB2 ASP A 38 16.953 -8.301 -48.353 1.00 0.00 H new ATOM 0 HB3 ASP A 38 15.661 -9.185 -47.565 1.00 0.00 H new ATOM 13 N TYR A 39 14.710 -5.986 -49.246 1.00 0.00 N ATOM 14 CA TYR A 39 14.155 -4.783 -48.635 1.00 0.00 C ATOM 15 C TYR A 39 12.763 -4.483 -49.175 1.00 0.00 C ATOM 16 O TYR A 39 11.782 -4.502 -48.433 1.00 0.00 O ATOM 17 CB TYR A 39 15.084 -3.589 -48.866 1.00 0.00 C ATOM 18 CG TYR A 39 14.580 -2.298 -48.259 1.00 0.00 C ATOM 19 CD1 TYR A 39 14.582 -2.131 -46.882 1.00 0.00 C ATOM 20 CD2 TYR A 39 14.114 -1.282 -49.080 1.00 0.00 C ATOM 21 CE1 TYR A 39 14.123 -0.952 -46.328 1.00 0.00 C ATOM 22 CE2 TYR A 39 13.654 -0.104 -48.526 1.00 0.00 C ATOM 23 CZ TYR A 39 13.656 0.063 -47.157 1.00 0.00 C ATOM 24 OH TYR A 39 13.198 1.237 -46.605 1.00 0.00 O ATOM 0 H TYR A 39 15.320 -5.809 -50.044 1.00 0.00 H new ATOM 0 HA TYR A 39 14.070 -4.960 -47.563 1.00 0.00 H new ATOM 0 HB2 TYR A 39 16.065 -3.817 -48.449 1.00 0.00 H new ATOM 0 HB3 TYR A 39 15.219 -3.447 -49.938 1.00 0.00 H new ATOM 0 HD1 TYR A 39 14.943 -2.923 -46.243 1.00 0.00 H new ATOM 0 HD2 TYR A 39 14.111 -1.412 -50.152 1.00 0.00 H new ATOM 0 HE1 TYR A 39 14.127 -0.819 -45.256 1.00 0.00 H new ATOM 0 HE2 TYR A 39 13.292 0.688 -49.165 1.00 0.00 H new ATOM 0 HH TYR A 39 12.221 1.272 -46.675 1.00 0.00 H new ATOM 34 N LEU A 40 12.685 -4.205 -50.472 1.00 0.00 N ATOM 35 CA LEU A 40 11.421 -3.842 -51.102 1.00 0.00 C ATOM 36 C LEU A 40 10.465 -5.027 -51.142 1.00 0.00 C ATOM 37 O LEU A 40 9.273 -4.885 -50.871 1.00 0.00 O ATOM 38 CB LEU A 40 11.668 -3.329 -52.526 1.00 0.00 C ATOM 39 CG LEU A 40 12.365 -1.966 -52.630 1.00 0.00 C ATOM 40 CD1 LEU A 40 12.658 -1.655 -54.092 1.00 0.00 C ATOM 41 CD2 LEU A 40 11.481 -0.895 -52.010 1.00 0.00 C ATOM 0 H LEU A 40 13.483 -4.224 -51.108 1.00 0.00 H new ATOM 0 HA LEU A 40 10.964 -3.052 -50.506 1.00 0.00 H new ATOM 0 HB2 LEU A 40 12.269 -4.066 -53.059 1.00 0.00 H new ATOM 0 HB3 LEU A 40 10.710 -3.267 -53.042 1.00 0.00 H new ATOM 0 HG LEU A 40 13.310 -1.989 -52.087 1.00 0.00 H new ATOM 0 HD11 LEU A 40 13.153 -0.687 -54.166 1.00 0.00 H new ATOM 0 HD12 LEU A 40 13.307 -2.427 -54.505 1.00 0.00 H new ATOM 0 HD13 LEU A 40 11.724 -1.628 -54.653 1.00 0.00 H new ATOM 0 HD21 LEU A 40 11.976 0.073 -52.084 1.00 0.00 H new ATOM 0 HD22 LEU A 40 10.529 -0.857 -52.540 1.00 0.00 H new ATOM 0 HD23 LEU A 40 11.303 -1.132 -50.961 1.00 0.00 H new ATOM 53 N PRO A 41 10.996 -6.198 -51.481 1.00 0.00 N ATOM 54 CA PRO A 41 10.201 -7.420 -51.509 1.00 0.00 C ATOM 55 C PRO A 41 9.411 -7.593 -50.218 1.00 0.00 C ATOM 56 O PRO A 41 8.245 -7.986 -50.240 1.00 0.00 O ATOM 57 CB PRO A 41 11.259 -8.515 -51.675 1.00 0.00 C ATOM 58 CG PRO A 41 12.340 -7.862 -52.466 1.00 0.00 C ATOM 59 CD PRO A 41 12.420 -6.465 -51.908 1.00 0.00 C ATOM 0 HA PRO A 41 9.452 -7.430 -52.301 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.627 -8.863 -50.710 1.00 0.00 H new ATOM 0 HB3 PRO A 41 10.855 -9.384 -52.194 1.00 0.00 H new ATOM 0 HG2 PRO A 41 13.288 -8.389 -52.355 1.00 0.00 H new ATOM 0 HG3 PRO A 41 12.103 -7.852 -53.530 1.00 0.00 H new ATOM 0 HD2 PRO A 41 13.113 -6.403 -51.069 1.00 0.00 H new ATOM 0 HD3 PRO A 41 12.760 -5.749 -52.656 1.00 0.00 H new ATOM 67 N THR A 42 10.054 -7.298 -49.093 1.00 0.00 N ATOM 68 CA THR A 42 9.418 -7.438 -47.788 1.00 0.00 C ATOM 69 C THR A 42 8.357 -6.367 -47.575 1.00 0.00 C ATOM 70 O THR A 42 7.243 -6.662 -47.141 1.00 0.00 O ATOM 71 CB THR A 42 10.459 -7.368 -46.655 1.00 0.00 C ATOM 72 OG1 THR A 42 11.404 -8.435 -46.804 1.00 0.00 O ATOM 73 CG2 THR A 42 9.779 -7.484 -45.299 1.00 0.00 C ATOM 0 H THR A 42 11.016 -6.960 -49.059 1.00 0.00 H new ATOM 0 HA THR A 42 8.937 -8.416 -47.766 1.00 0.00 H new ATOM 0 HB THR A 42 10.972 -6.408 -46.712 1.00 0.00 H new ATOM 0 HG1 THR A 42 12.164 -8.126 -47.340 1.00 0.00 H new ATOM 0 HG21 THR A 42 10.529 -7.433 -44.510 1.00 0.00 H new ATOM 0 HG22 THR A 42 9.068 -6.667 -45.177 1.00 0.00 H new ATOM 0 HG23 THR A 42 9.252 -8.436 -45.237 1.00 0.00 H new ATOM 81 N LEU A 43 8.708 -5.123 -47.882 1.00 0.00 N ATOM 82 CA LEU A 43 7.781 -4.007 -47.738 1.00 0.00 C ATOM 83 C LEU A 43 6.555 -4.191 -48.623 1.00 0.00 C ATOM 84 O LEU A 43 5.445 -3.810 -48.250 1.00 0.00 O ATOM 85 CB LEU A 43 8.479 -2.688 -48.091 1.00 0.00 C ATOM 86 CG LEU A 43 9.600 -2.253 -47.138 1.00 0.00 C ATOM 87 CD1 LEU A 43 10.275 -1.002 -47.684 1.00 0.00 C ATOM 88 CD2 LEU A 43 9.021 -2.001 -45.754 1.00 0.00 C ATOM 0 H LEU A 43 9.630 -4.862 -48.233 1.00 0.00 H new ATOM 0 HA LEU A 43 7.454 -3.977 -46.699 1.00 0.00 H new ATOM 0 HB2 LEU A 43 8.894 -2.775 -49.095 1.00 0.00 H new ATOM 0 HB3 LEU A 43 7.728 -1.898 -48.124 1.00 0.00 H new ATOM 0 HG LEU A 43 10.348 -3.042 -47.060 1.00 0.00 H new ATOM 0 HD11 LEU A 43 11.071 -0.693 -47.007 1.00 0.00 H new ATOM 0 HD12 LEU A 43 10.696 -1.215 -48.666 1.00 0.00 H new ATOM 0 HD13 LEU A 43 9.541 -0.201 -47.770 1.00 0.00 H new ATOM 0 HD21 LEU A 43 9.818 -1.692 -45.077 1.00 0.00 H new ATOM 0 HD22 LEU A 43 8.269 -1.214 -45.812 1.00 0.00 H new ATOM 0 HD23 LEU A 43 8.561 -2.916 -45.380 1.00 0.00 H new ATOM 100 N ARG A 44 6.761 -4.779 -49.796 1.00 0.00 N ATOM 101 CA ARG A 44 5.674 -5.007 -50.741 1.00 0.00 C ATOM 102 C ARG A 44 4.722 -6.083 -50.236 1.00 0.00 C ATOM 103 O ARG A 44 3.505 -5.967 -50.381 1.00 0.00 O ATOM 104 CB ARG A 44 6.224 -5.418 -52.100 1.00 0.00 C ATOM 105 CG ARG A 44 6.837 -4.287 -52.910 1.00 0.00 C ATOM 106 CD ARG A 44 7.253 -4.742 -54.261 1.00 0.00 C ATOM 107 NE ARG A 44 8.471 -5.535 -54.215 1.00 0.00 N ATOM 108 CZ ARG A 44 8.967 -6.236 -55.253 1.00 0.00 C ATOM 109 NH1 ARG A 44 8.339 -6.234 -56.408 1.00 0.00 N ATOM 110 NH2 ARG A 44 10.085 -6.927 -55.110 1.00 0.00 N ATOM 0 H ARG A 44 7.672 -5.107 -50.116 1.00 0.00 H new ATOM 0 HA ARG A 44 5.124 -4.071 -50.840 1.00 0.00 H new ATOM 0 HB2 ARG A 44 6.979 -6.190 -51.952 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.419 -5.867 -52.681 1.00 0.00 H new ATOM 0 HG2 ARG A 44 6.116 -3.475 -53.005 1.00 0.00 H new ATOM 0 HG3 ARG A 44 7.700 -3.886 -52.379 1.00 0.00 H new ATOM 0 HD2 ARG A 44 6.453 -5.332 -54.708 1.00 0.00 H new ATOM 0 HD3 ARG A 44 7.408 -3.876 -54.904 1.00 0.00 H new ATOM 0 HE ARG A 44 8.986 -5.562 -53.335 1.00 0.00 H new ATOM 0 HH11 ARG A 44 7.476 -5.702 -56.518 1.00 0.00 H new ATOM 0 HH12 ARG A 44 8.715 -6.765 -57.194 1.00 0.00 H new ATOM 0 HH21 ARG A 44 10.572 -6.929 -54.214 1.00 0.00 H new ATOM 0 HH22 ARG A 44 10.461 -7.458 -55.896 1.00 0.00 H new ATOM 124 N LYS A 45 5.283 -7.131 -49.641 1.00 0.00 N ATOM 125 CA LYS A 45 4.490 -8.112 -48.909 1.00 0.00 C ATOM 126 C LYS A 45 3.673 -7.449 -47.808 1.00 0.00 C ATOM 127 O LYS A 45 2.485 -7.730 -47.647 1.00 0.00 O ATOM 128 CB LYS A 45 5.392 -9.194 -48.315 1.00 0.00 C ATOM 129 CG LYS A 45 4.656 -10.249 -47.498 1.00 0.00 C ATOM 130 CD LYS A 45 5.613 -11.309 -46.974 1.00 0.00 C ATOM 131 CE LYS A 45 4.872 -12.386 -46.195 1.00 0.00 C ATOM 132 NZ LYS A 45 4.336 -11.870 -44.906 1.00 0.00 N ATOM 0 H LYS A 45 6.285 -7.323 -49.652 1.00 0.00 H new ATOM 0 HA LYS A 45 3.799 -8.575 -49.614 1.00 0.00 H new ATOM 0 HB2 LYS A 45 5.928 -9.688 -49.125 1.00 0.00 H new ATOM 0 HB3 LYS A 45 6.141 -8.718 -47.681 1.00 0.00 H new ATOM 0 HG2 LYS A 45 4.144 -9.773 -46.662 1.00 0.00 H new ATOM 0 HG3 LYS A 45 3.890 -10.720 -48.114 1.00 0.00 H new ATOM 0 HD2 LYS A 45 6.148 -11.763 -47.808 1.00 0.00 H new ATOM 0 HD3 LYS A 45 6.360 -10.842 -46.332 1.00 0.00 H new ATOM 0 HE2 LYS A 45 4.052 -12.772 -46.800 1.00 0.00 H new ATOM 0 HE3 LYS A 45 5.545 -13.221 -46.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 3.928 -12.656 -44.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 5.106 -11.432 -44.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 3.599 -11.161 -45.095 1.00 0.00 H new ATOM 146 N GLU A 46 4.316 -6.566 -47.051 1.00 0.00 N ATOM 147 CA GLU A 46 3.643 -5.840 -45.980 1.00 0.00 C ATOM 148 C GLU A 46 2.474 -5.024 -46.518 1.00 0.00 C ATOM 149 O GLU A 46 1.415 -4.952 -45.893 1.00 0.00 O ATOM 150 CB GLU A 46 4.627 -4.937 -45.252 1.00 0.00 C ATOM 0 H GLU A 46 5.304 -6.336 -47.160 1.00 0.00 H new ATOM 0 HA GLU A 46 3.248 -6.571 -45.275 1.00 0.00 H new ATOM 155 N LEU A 47 2.672 -4.412 -47.680 1.00 0.00 N ATOM 156 CA LEU A 47 1.623 -3.626 -48.320 1.00 0.00 C ATOM 157 C LEU A 47 0.429 -4.497 -48.689 1.00 0.00 C ATOM 158 O LEU A 47 -0.721 -4.093 -48.521 1.00 0.00 O ATOM 159 CB LEU A 47 2.169 -2.938 -49.577 1.00 0.00 C ATOM 160 CG LEU A 47 3.138 -1.774 -49.331 1.00 0.00 C ATOM 161 CD1 LEU A 47 3.792 -1.370 -50.645 1.00 0.00 C ATOM 162 CD2 LEU A 47 2.383 -0.606 -48.715 1.00 0.00 C ATOM 0 H LEU A 47 3.550 -4.445 -48.199 1.00 0.00 H new ATOM 0 HA LEU A 47 1.290 -2.870 -47.608 1.00 0.00 H new ATOM 0 HB2 LEU A 47 2.676 -3.686 -50.187 1.00 0.00 H new ATOM 0 HB3 LEU A 47 1.327 -2.568 -50.161 1.00 0.00 H new ATOM 0 HG LEU A 47 3.921 -2.082 -48.638 1.00 0.00 H new ATOM 0 HD11 LEU A 47 4.480 -0.543 -50.470 1.00 0.00 H new ATOM 0 HD12 LEU A 47 4.341 -2.218 -51.054 1.00 0.00 H new ATOM 0 HD13 LEU A 47 3.024 -1.059 -51.353 1.00 0.00 H new ATOM 0 HD21 LEU A 47 3.072 0.221 -48.540 1.00 0.00 H new ATOM 0 HD22 LEU A 47 1.594 -0.284 -49.395 1.00 0.00 H new ATOM 0 HD23 LEU A 47 1.942 -0.917 -47.768 1.00 0.00 H new ATOM 174 N MET A 48 0.710 -5.694 -49.192 1.00 0.00 N ATOM 175 CA MET A 48 -0.339 -6.656 -49.511 1.00 0.00 C ATOM 176 C MET A 48 -1.156 -7.011 -48.276 1.00 0.00 C ATOM 177 O MET A 48 -2.381 -7.108 -48.337 1.00 0.00 O ATOM 178 CB MET A 48 0.269 -7.915 -50.127 1.00 0.00 C ATOM 179 CG MET A 48 0.887 -7.706 -51.503 1.00 0.00 C ATOM 180 SD MET A 48 1.813 -9.146 -52.074 1.00 0.00 S ATOM 181 CE MET A 48 0.481 -10.285 -52.436 1.00 0.00 C ATOM 0 H MET A 48 1.656 -6.022 -49.388 1.00 0.00 H new ATOM 0 HA MET A 48 -1.011 -6.196 -50.236 1.00 0.00 H new ATOM 0 HB2 MET A 48 1.034 -8.302 -49.453 1.00 0.00 H new ATOM 0 HB3 MET A 48 -0.505 -8.679 -50.202 1.00 0.00 H new ATOM 0 HG2 MET A 48 0.099 -7.478 -52.220 1.00 0.00 H new ATOM 0 HG3 MET A 48 1.550 -6.841 -51.472 1.00 0.00 H new ATOM 0 HE1 MET A 48 0.891 -11.199 -52.867 1.00 0.00 H new ATOM 0 HE2 MET A 48 -0.053 -10.525 -51.516 1.00 0.00 H new ATOM 0 HE3 MET A 48 -0.207 -9.826 -53.146 1.00 0.00 H new ATOM 191 N GLU A 49 -0.470 -7.203 -47.154 1.00 0.00 N ATOM 192 CA GLU A 49 -1.137 -7.440 -45.879 1.00 0.00 C ATOM 193 C GLU A 49 -2.011 -6.256 -45.487 1.00 0.00 C ATOM 194 O GLU A 49 -3.131 -6.432 -45.006 1.00 0.00 O ATOM 195 CB GLU A 49 -0.106 -7.711 -44.781 1.00 0.00 C ATOM 196 CG GLU A 49 0.661 -9.015 -44.946 1.00 0.00 C ATOM 197 CD GLU A 49 1.773 -9.170 -43.946 1.00 0.00 C ATOM 198 OE1 GLU A 49 1.919 -8.311 -43.110 1.00 0.00 O ATOM 199 OE2 GLU A 49 2.477 -10.149 -44.019 1.00 0.00 O ATOM 0 H GLU A 49 0.549 -7.199 -47.102 1.00 0.00 H new ATOM 0 HA GLU A 49 -1.776 -8.315 -45.994 1.00 0.00 H new ATOM 0 HB2 GLU A 49 0.606 -6.886 -44.756 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -0.615 -7.722 -43.817 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -0.030 -9.852 -44.846 1.00 0.00 H new ATOM 0 HG3 GLU A 49 1.076 -9.062 -45.953 1.00 0.00 H new ATOM 206 N VAL A 50 -1.495 -5.049 -45.695 1.00 0.00 N ATOM 207 CA VAL A 50 -2.252 -3.835 -45.423 1.00 0.00 C ATOM 208 C VAL A 50 -3.524 -3.778 -46.259 1.00 0.00 C ATOM 209 O VAL A 50 -4.564 -3.311 -45.795 1.00 0.00 O ATOM 210 CB VAL A 50 -1.392 -2.591 -45.718 1.00 0.00 C ATOM 211 CG1 VAL A 50 -2.252 -1.336 -45.714 1.00 0.00 C ATOM 212 CG2 VAL A 50 -0.272 -2.481 -44.695 1.00 0.00 C ATOM 0 H VAL A 50 -0.553 -4.887 -46.052 1.00 0.00 H new ATOM 0 HA VAL A 50 -2.528 -3.848 -44.369 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.950 -2.694 -46.709 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -1.628 -0.467 -45.924 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -3.024 -1.422 -46.478 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -2.720 -1.219 -44.737 1.00 0.00 H new ATOM 0 HG21 VAL A 50 0.332 -1.599 -44.910 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -0.699 -2.394 -43.696 1.00 0.00 H new ATOM 0 HG23 VAL A 50 0.355 -3.371 -44.745 1.00 0.00 H new ATOM 222 N LEU A 51 -3.435 -4.259 -47.495 1.00 0.00 N ATOM 223 CA LEU A 51 -4.575 -4.250 -48.404 1.00 0.00 C ATOM 224 C LEU A 51 -5.621 -5.275 -47.984 1.00 0.00 C ATOM 225 O LEU A 51 -6.822 -5.057 -48.156 1.00 0.00 O ATOM 226 CB LEU A 51 -4.112 -4.541 -49.837 1.00 0.00 C ATOM 227 CG LEU A 51 -3.243 -3.458 -50.488 1.00 0.00 C ATOM 228 CD1 LEU A 51 -2.700 -3.971 -51.814 1.00 0.00 C ATOM 229 CD2 LEU A 51 -4.069 -2.196 -50.688 1.00 0.00 C ATOM 0 H LEU A 51 -2.584 -4.660 -47.890 1.00 0.00 H new ATOM 0 HA LEU A 51 -5.028 -3.259 -48.364 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -3.553 -5.477 -49.836 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -4.993 -4.697 -50.459 1.00 0.00 H new ATOM 0 HG LEU A 51 -2.400 -3.218 -49.840 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -2.082 -3.201 -52.277 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -2.098 -4.863 -51.640 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -3.530 -4.217 -52.476 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -3.451 -1.426 -51.151 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -4.919 -2.416 -51.334 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -4.429 -1.840 -49.723 1.00 0.00 H new ATOM 241 N SER A 52 -5.160 -6.393 -47.433 1.00 0.00 N ATOM 242 CA SER A 52 -6.058 -7.416 -46.910 1.00 0.00 C ATOM 243 C SER A 52 -6.764 -6.936 -45.648 1.00 0.00 C ATOM 244 O SER A 52 -7.781 -7.498 -45.242 1.00 0.00 O ATOM 245 CB SER A 52 -5.286 -8.686 -46.614 1.00 0.00 C ATOM 246 OG SER A 52 -4.456 -8.521 -45.497 1.00 0.00 O ATOM 0 H SER A 52 -4.169 -6.614 -47.337 1.00 0.00 H new ATOM 0 HA SER A 52 -6.813 -7.620 -47.669 1.00 0.00 H new ATOM 0 HB2 SER A 52 -5.982 -9.506 -46.436 1.00 0.00 H new ATOM 0 HB3 SER A 52 -4.685 -8.961 -47.481 1.00 0.00 H new ATOM 0 HG SER A 52 -4.148 -7.592 -45.452 1.00 0.00 H new ATOM 252 N LYS A 53 -6.219 -5.892 -45.032 1.00 0.00 N ATOM 253 CA LYS A 53 -6.872 -5.243 -43.901 1.00 0.00 C ATOM 254 C LYS A 53 -7.748 -4.084 -44.360 1.00 0.00 C ATOM 255 O LYS A 53 -8.808 -3.831 -43.789 1.00 0.00 O ATOM 256 CB LYS A 53 -5.832 -4.750 -42.894 1.00 0.00 C ATOM 257 CG LYS A 53 -5.080 -5.859 -42.171 1.00 0.00 C ATOM 258 CD LYS A 53 -4.051 -5.291 -41.205 1.00 0.00 C ATOM 259 CE LYS A 53 -3.292 -6.398 -40.488 1.00 0.00 C ATOM 260 NZ LYS A 53 -2.263 -5.857 -39.560 1.00 0.00 N ATOM 0 H LYS A 53 -5.326 -5.477 -45.297 1.00 0.00 H new ATOM 0 HA LYS A 53 -7.512 -5.981 -43.417 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -5.112 -4.119 -43.414 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -6.330 -4.123 -42.154 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -5.787 -6.485 -41.626 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -4.583 -6.499 -42.900 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -3.349 -4.660 -41.749 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -4.549 -4.656 -40.472 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -3.995 -7.016 -39.930 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -2.813 -7.044 -41.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -1.769 -6.644 -39.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -1.577 -5.288 -40.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -2.722 -5.261 -38.842 1.00 0.00 H new ATOM 274 N TYR A 54 -7.298 -3.384 -45.396 1.00 0.00 N ATOM 275 CA TYR A 54 -8.022 -2.229 -45.912 1.00 0.00 C ATOM 276 C TYR A 54 -9.245 -2.658 -46.712 1.00 0.00 C ATOM 277 O TYR A 54 -10.381 -2.441 -46.292 1.00 0.00 O ATOM 278 CB TYR A 54 -7.102 -1.361 -46.773 1.00 0.00 C ATOM 279 CG TYR A 54 -6.185 -0.463 -45.973 1.00 0.00 C ATOM 280 CD1 TYR A 54 -6.138 -0.572 -44.591 1.00 0.00 C ATOM 281 CD2 TYR A 54 -5.390 0.470 -46.622 1.00 0.00 C ATOM 282 CE1 TYR A 54 -5.301 0.248 -43.861 1.00 0.00 C ATOM 283 CE2 TYR A 54 -4.552 1.291 -45.891 1.00 0.00 C ATOM 284 CZ TYR A 54 -4.506 1.182 -44.516 1.00 0.00 C ATOM 285 OH TYR A 54 -3.671 1.999 -43.789 1.00 0.00 O ATOM 0 H TYR A 54 -6.434 -3.597 -45.895 1.00 0.00 H new ATOM 0 HA TYR A 54 -8.364 -1.641 -45.060 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -6.498 -2.008 -47.409 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -7.712 -0.745 -47.434 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -6.757 -1.299 -44.086 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -5.426 0.555 -47.698 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -5.264 0.164 -42.785 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -3.933 2.018 -46.396 1.00 0.00 H new ATOM 0 HH TYR A 54 -3.184 2.593 -44.397 1.00 0.00 H new ATOM 295 N VAL A 55 -9.005 -3.269 -47.867 1.00 0.00 N ATOM 296 CA VAL A 55 -10.075 -3.576 -48.808 1.00 0.00 C ATOM 297 C VAL A 55 -10.353 -5.074 -48.858 1.00 0.00 C ATOM 298 O VAL A 55 -11.244 -5.526 -49.575 1.00 0.00 O ATOM 299 CB VAL A 55 -9.707 -3.079 -50.218 1.00 0.00 C ATOM 300 CG1 VAL A 55 -9.514 -1.569 -50.217 1.00 0.00 C ATOM 301 CG2 VAL A 55 -8.448 -3.782 -50.703 1.00 0.00 C ATOM 0 H VAL A 55 -8.077 -3.562 -48.174 1.00 0.00 H new ATOM 0 HA VAL A 55 -10.974 -3.065 -48.463 1.00 0.00 H new ATOM 0 HB VAL A 55 -10.524 -3.315 -50.900 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -9.254 -1.235 -51.221 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -10.438 -1.084 -49.901 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -8.712 -1.305 -49.528 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -8.194 -3.425 -51.701 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -7.626 -3.567 -50.021 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -8.621 -4.858 -50.735 1.00 0.00 H new ATOM 311 N ASN A 56 -9.582 -5.838 -48.092 1.00 0.00 N ATOM 312 CA ASN A 56 -9.796 -7.277 -47.984 1.00 0.00 C ATOM 313 C ASN A 56 -9.539 -7.972 -49.315 1.00 0.00 C ATOM 314 O ASN A 56 -10.188 -8.966 -49.642 1.00 0.00 O ATOM 315 CB ASN A 56 -11.199 -7.573 -47.488 1.00 0.00 C ATOM 316 CG ASN A 56 -11.460 -7.004 -46.121 1.00 0.00 C ATOM 317 OD1 ASN A 56 -10.646 -7.160 -45.204 1.00 0.00 O ATOM 318 ND2 ASN A 56 -12.582 -6.347 -45.967 1.00 0.00 N ATOM 0 H ASN A 56 -8.803 -5.485 -47.536 1.00 0.00 H new ATOM 0 HA ASN A 56 -9.084 -7.669 -47.258 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -11.923 -7.164 -48.192 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -11.352 -8.652 -47.464 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -12.814 -5.939 -45.061 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -13.224 -6.243 -46.753 1.00 0.00 H new ATOM 325 N VAL A 57 -8.590 -7.444 -50.080 1.00 0.00 N ATOM 326 CA VAL A 57 -8.225 -8.031 -51.364 1.00 0.00 C ATOM 327 C VAL A 57 -7.497 -9.357 -51.176 1.00 0.00 C ATOM 328 O VAL A 57 -6.787 -9.552 -50.190 1.00 0.00 O ATOM 329 CB VAL A 57 -7.328 -7.064 -52.158 1.00 0.00 C ATOM 330 CG1 VAL A 57 -5.962 -6.942 -51.498 1.00 0.00 C ATOM 331 CG2 VAL A 57 -7.192 -7.545 -53.594 1.00 0.00 C ATOM 0 H VAL A 57 -8.059 -6.609 -49.833 1.00 0.00 H new ATOM 0 HA VAL A 57 -9.145 -8.214 -51.919 1.00 0.00 H new ATOM 0 HB VAL A 57 -7.790 -6.077 -52.164 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -5.341 -6.255 -52.072 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -6.081 -6.562 -50.483 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -5.485 -7.921 -51.465 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -6.556 -6.856 -54.150 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -6.745 -8.539 -53.604 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -8.177 -7.585 -54.059 1.00 0.00 H new ATOM 341 N SER A 58 -7.680 -10.265 -52.129 1.00 0.00 N ATOM 342 CA SER A 58 -7.058 -11.582 -52.060 1.00 0.00 C ATOM 343 C SER A 58 -5.799 -11.643 -52.917 1.00 0.00 C ATOM 344 O SER A 58 -5.558 -10.763 -53.745 1.00 0.00 O ATOM 345 CB SER A 58 -8.039 -12.647 -52.511 1.00 0.00 C ATOM 346 OG SER A 58 -8.257 -12.576 -53.893 1.00 0.00 O ATOM 0 H SER A 58 -8.254 -10.113 -52.958 1.00 0.00 H new ATOM 0 HA SER A 58 -6.775 -11.766 -51.024 1.00 0.00 H new ATOM 0 HB2 SER A 58 -7.656 -13.633 -52.250 1.00 0.00 H new ATOM 0 HB3 SER A 58 -8.985 -12.522 -51.983 1.00 0.00 H new ATOM 0 HG SER A 58 -8.892 -13.273 -54.160 1.00 0.00 H new ATOM 352 N LEU A 59 -5.000 -12.683 -52.713 1.00 0.00 N ATOM 353 CA LEU A 59 -3.723 -12.817 -53.404 1.00 0.00 C ATOM 354 C LEU A 59 -3.918 -12.873 -54.914 1.00 0.00 C ATOM 355 O LEU A 59 -3.145 -12.285 -55.672 1.00 0.00 O ATOM 356 CB LEU A 59 -2.992 -14.078 -52.929 1.00 0.00 C ATOM 357 CG LEU A 59 -2.525 -14.066 -51.468 1.00 0.00 C ATOM 358 CD1 LEU A 59 -1.971 -15.436 -51.100 1.00 0.00 C ATOM 359 CD2 LEU A 59 -1.473 -12.982 -51.280 1.00 0.00 C ATOM 0 H LEU A 59 -5.214 -13.448 -52.073 1.00 0.00 H new ATOM 0 HA LEU A 59 -3.121 -11.940 -53.167 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -3.651 -14.934 -53.073 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -2.123 -14.234 -53.568 1.00 0.00 H new ATOM 0 HG LEU A 59 -3.366 -13.847 -50.810 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -1.639 -15.427 -50.062 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -2.749 -16.189 -51.226 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -1.128 -15.674 -51.748 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -1.141 -12.973 -50.242 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -0.623 -13.184 -51.931 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -1.901 -12.012 -51.532 1.00 0.00 H new ATOM 371 N ASP A 60 -4.954 -13.584 -55.346 1.00 0.00 N ATOM 372 CA ASP A 60 -5.236 -13.741 -56.768 1.00 0.00 C ATOM 373 C ASP A 60 -5.617 -12.410 -57.404 1.00 0.00 C ATOM 374 O ASP A 60 -5.549 -12.252 -58.623 1.00 0.00 O ATOM 375 CB ASP A 60 -6.360 -14.757 -56.983 1.00 0.00 C ATOM 376 CG ASP A 60 -5.935 -16.186 -56.672 1.00 0.00 C ATOM 377 OD1 ASP A 60 -4.754 -16.428 -56.585 1.00 0.00 O ATOM 378 OD2 ASP A 60 -6.794 -17.022 -56.525 1.00 0.00 O ATOM 0 H ASP A 60 -5.613 -14.061 -54.731 1.00 0.00 H new ATOM 0 HA ASP A 60 -4.327 -14.105 -57.247 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -7.209 -14.491 -56.353 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -6.700 -14.701 -58.017 1.00 0.00 H new ATOM 383 N ASN A 61 -6.020 -11.456 -56.571 1.00 0.00 N ATOM 384 CA ASN A 61 -6.476 -10.159 -57.056 1.00 0.00 C ATOM 385 C ASN A 61 -5.392 -9.101 -56.900 1.00 0.00 C ATOM 386 O ASN A 61 -5.658 -7.904 -57.015 1.00 0.00 O ATOM 387 CB ASN A 61 -7.744 -9.735 -56.336 1.00 0.00 C ATOM 388 CG ASN A 61 -8.946 -10.527 -56.768 1.00 0.00 C ATOM 389 OD1 ASN A 61 -9.413 -10.398 -57.906 1.00 0.00 O ATOM 390 ND2 ASN A 61 -9.457 -11.344 -55.883 1.00 0.00 N ATOM 0 H ASN A 61 -6.040 -11.557 -55.556 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.698 -10.258 -58.119 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -7.604 -9.852 -55.261 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -7.926 -8.676 -56.521 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -10.274 -11.907 -56.120 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -9.039 -11.418 -54.956 1.00 0.00 H new ATOM 397 N ILE A 62 -4.168 -9.548 -56.638 1.00 0.00 N ATOM 398 CA ILE A 62 -3.026 -8.646 -56.547 1.00 0.00 C ATOM 399 C ILE A 62 -1.998 -8.949 -57.631 1.00 0.00 C ATOM 400 O ILE A 62 -1.520 -10.077 -57.748 1.00 0.00 O ATOM 401 CB ILE A 62 -2.359 -8.744 -55.164 1.00 0.00 C ATOM 402 CG1 ILE A 62 -3.343 -8.335 -54.065 1.00 0.00 C ATOM 403 CG2 ILE A 62 -1.110 -7.876 -55.113 1.00 0.00 C ATOM 404 CD1 ILE A 62 -2.856 -8.634 -52.666 1.00 0.00 C ATOM 0 H ILE A 62 -3.942 -10.531 -56.485 1.00 0.00 H new ATOM 0 HA ILE A 62 -3.400 -7.632 -56.691 1.00 0.00 H new ATOM 0 HB ILE A 62 -2.065 -9.780 -54.995 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -3.543 -7.267 -54.149 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -4.289 -8.851 -54.228 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -0.651 -7.957 -54.128 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -0.403 -8.211 -55.872 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -1.381 -6.837 -55.303 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -3.607 -8.316 -51.943 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.683 -9.705 -52.562 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -1.926 -8.097 -52.482 1.00 0.00 H new ATOM 416 N ARG A 63 -1.662 -7.935 -58.420 1.00 0.00 N ATOM 417 CA ARG A 63 -0.519 -8.011 -59.321 1.00 0.00 C ATOM 418 C ARG A 63 0.523 -6.954 -58.981 1.00 0.00 C ATOM 419 O ARG A 63 0.207 -5.769 -58.874 1.00 0.00 O ATOM 420 CB ARG A 63 -0.963 -7.834 -60.766 1.00 0.00 C ATOM 421 CG ARG A 63 -1.936 -8.889 -61.270 1.00 0.00 C ATOM 422 CD ARG A 63 -1.290 -10.221 -61.382 1.00 0.00 C ATOM 423 NE ARG A 63 -2.214 -11.232 -61.871 1.00 0.00 N ATOM 424 CZ ARG A 63 -3.051 -11.945 -61.092 1.00 0.00 C ATOM 425 NH1 ARG A 63 -3.067 -11.748 -59.792 1.00 0.00 N ATOM 426 NH2 ARG A 63 -3.854 -12.844 -61.634 1.00 0.00 N ATOM 0 H ARG A 63 -2.166 -7.049 -58.454 1.00 0.00 H new ATOM 0 HA ARG A 63 -0.071 -8.997 -59.198 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -1.427 -6.853 -60.871 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -0.080 -7.839 -61.405 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -2.787 -8.953 -60.592 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -2.325 -8.590 -62.243 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -0.435 -10.155 -62.055 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -0.906 -10.521 -60.407 1.00 0.00 H new ATOM 0 HE ARG A 63 -2.230 -11.414 -62.874 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -2.446 -11.056 -59.373 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -3.701 -12.288 -59.202 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -3.840 -12.998 -62.642 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -4.487 -13.384 -61.044 1.00 0.00 H new ATOM 440 N ILE A 64 1.767 -7.390 -58.811 1.00 0.00 N ATOM 441 CA ILE A 64 2.865 -6.477 -58.517 1.00 0.00 C ATOM 442 C ILE A 64 4.059 -6.741 -59.425 1.00 0.00 C ATOM 443 O ILE A 64 4.486 -7.883 -59.588 1.00 0.00 O ATOM 444 CB ILE A 64 3.301 -6.598 -57.045 1.00 0.00 C ATOM 445 CG1 ILE A 64 2.144 -6.232 -56.113 1.00 0.00 C ATOM 446 CG2 ILE A 64 4.509 -5.715 -56.774 1.00 0.00 C ATOM 447 CD1 ILE A 64 2.436 -6.476 -54.650 1.00 0.00 C ATOM 0 H ILE A 64 2.040 -8.371 -58.872 1.00 0.00 H new ATOM 0 HA ILE A 64 2.503 -5.465 -58.699 1.00 0.00 H new ATOM 0 HB ILE A 64 3.583 -7.633 -56.851 1.00 0.00 H new ATOM 0 HG12 ILE A 64 1.896 -5.180 -56.253 1.00 0.00 H new ATOM 0 HG13 ILE A 64 1.264 -6.808 -56.399 1.00 0.00 H new ATOM 0 HG21 ILE A 64 4.804 -5.813 -55.729 1.00 0.00 H new ATOM 0 HG22 ILE A 64 5.336 -6.023 -57.415 1.00 0.00 H new ATOM 0 HG23 ILE A 64 4.255 -4.676 -56.984 1.00 0.00 H new ATOM 0 HD11 ILE A 64 1.569 -6.192 -54.054 1.00 0.00 H new ATOM 0 HD12 ILE A 64 2.654 -7.532 -54.494 1.00 0.00 H new ATOM 0 HD13 ILE A 64 3.296 -5.879 -54.346 1.00 0.00 H new ATOM 459 N SER A 65 4.595 -5.677 -60.014 1.00 0.00 N ATOM 460 CA SER A 65 5.742 -5.791 -60.906 1.00 0.00 C ATOM 461 C SER A 65 6.699 -4.619 -60.726 1.00 0.00 C ATOM 462 O SER A 65 6.272 -3.490 -60.483 1.00 0.00 O ATOM 463 CB SER A 65 5.278 -5.860 -62.347 1.00 0.00 C ATOM 464 OG SER A 65 6.369 -5.938 -63.223 1.00 0.00 O ATOM 0 H SER A 65 4.252 -4.724 -59.889 1.00 0.00 H new ATOM 0 HA SER A 65 6.274 -6.708 -60.653 1.00 0.00 H new ATOM 0 HB2 SER A 65 4.634 -6.729 -62.484 1.00 0.00 H new ATOM 0 HB3 SER A 65 4.680 -4.980 -62.583 1.00 0.00 H new ATOM 0 HG SER A 65 6.044 -5.983 -64.147 1.00 0.00 H new ATOM 470 N GLN A 66 7.993 -4.894 -60.848 1.00 0.00 N ATOM 471 CA GLN A 66 9.004 -3.844 -60.828 1.00 0.00 C ATOM 472 C GLN A 66 9.759 -3.780 -62.149 1.00 0.00 C ATOM 473 O GLN A 66 10.268 -4.790 -62.633 1.00 0.00 O ATOM 474 CB GLN A 66 9.986 -4.068 -59.675 1.00 0.00 C ATOM 475 CG GLN A 66 11.060 -3.001 -59.556 1.00 0.00 C ATOM 476 CD GLN A 66 11.987 -3.240 -58.379 1.00 0.00 C ATOM 477 OE1 GLN A 66 11.653 -3.979 -57.449 1.00 0.00 O ATOM 478 NE2 GLN A 66 13.158 -2.614 -58.412 1.00 0.00 N ATOM 0 H GLN A 66 8.367 -5.836 -60.962 1.00 0.00 H new ATOM 0 HA GLN A 66 8.492 -2.893 -60.680 1.00 0.00 H new ATOM 0 HB2 GLN A 66 9.427 -4.111 -58.740 1.00 0.00 H new ATOM 0 HB3 GLN A 66 10.466 -5.038 -59.805 1.00 0.00 H new ATOM 0 HG2 GLN A 66 11.645 -2.974 -60.476 1.00 0.00 H new ATOM 0 HG3 GLN A 66 10.588 -2.024 -59.450 1.00 0.00 H new ATOM 0 HE21 GLN A 66 13.392 -2.012 -59.201 1.00 0.00 H new ATOM 0 HE22 GLN A 66 13.823 -2.735 -57.648 1.00 0.00 H new ATOM 487 N GLU A 67 9.826 -2.586 -62.729 1.00 0.00 N ATOM 488 CA GLU A 67 10.416 -2.408 -64.051 1.00 0.00 C ATOM 489 C GLU A 67 11.386 -1.235 -64.068 1.00 0.00 C ATOM 490 O GLU A 67 11.235 -0.280 -63.306 1.00 0.00 O ATOM 491 CB GLU A 67 9.321 -2.193 -65.098 1.00 0.00 C ATOM 492 CG GLU A 67 8.382 -3.378 -65.279 1.00 0.00 C ATOM 493 CD GLU A 67 7.357 -3.153 -66.356 1.00 0.00 C ATOM 494 OE1 GLU A 67 7.320 -2.075 -66.898 1.00 0.00 O ATOM 495 OE2 GLU A 67 6.612 -4.062 -66.638 1.00 0.00 O ATOM 0 H GLU A 67 9.479 -1.726 -62.304 1.00 0.00 H new ATOM 0 HA GLU A 67 10.971 -3.314 -64.293 1.00 0.00 H new ATOM 0 HB2 GLU A 67 8.733 -1.319 -64.817 1.00 0.00 H new ATOM 0 HB3 GLU A 67 9.790 -1.967 -66.056 1.00 0.00 H new ATOM 0 HG2 GLU A 67 8.967 -4.265 -65.521 1.00 0.00 H new ATOM 0 HG3 GLU A 67 7.873 -3.579 -64.336 1.00 0.00 H new ATOM 502 N LYS A 68 12.384 -1.311 -64.942 1.00 0.00 N ATOM 503 CA LYS A 68 13.282 -0.187 -65.180 1.00 0.00 C ATOM 504 C LYS A 68 12.671 0.810 -66.155 1.00 0.00 C ATOM 505 O LYS A 68 12.335 0.460 -67.287 1.00 0.00 O ATOM 506 CB LYS A 68 14.630 -0.681 -65.708 1.00 0.00 C ATOM 507 CG LYS A 68 15.382 -1.600 -64.754 1.00 0.00 C ATOM 508 CD LYS A 68 15.958 -0.823 -63.579 1.00 0.00 C ATOM 509 CE LYS A 68 16.804 -1.717 -62.685 1.00 0.00 C ATOM 510 NZ LYS A 68 17.415 -0.960 -61.559 1.00 0.00 N ATOM 0 H LYS A 68 12.591 -2.141 -65.498 1.00 0.00 H new ATOM 0 HA LYS A 68 13.439 0.321 -64.228 1.00 0.00 H new ATOM 0 HB2 LYS A 68 14.467 -1.208 -66.648 1.00 0.00 H new ATOM 0 HB3 LYS A 68 15.257 0.182 -65.931 1.00 0.00 H new ATOM 0 HG2 LYS A 68 14.710 -2.375 -64.386 1.00 0.00 H new ATOM 0 HG3 LYS A 68 16.187 -2.104 -65.289 1.00 0.00 H new ATOM 0 HD2 LYS A 68 16.565 0.003 -63.949 1.00 0.00 H new ATOM 0 HD3 LYS A 68 15.147 -0.386 -62.997 1.00 0.00 H new ATOM 0 HE2 LYS A 68 16.186 -2.522 -62.288 1.00 0.00 H new ATOM 0 HE3 LYS A 68 17.591 -2.183 -63.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 17.689 -1.621 -60.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 18.258 -0.454 -61.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 16.726 -0.275 -61.187 1.00 0.00 H new ATOM 524 N GLN A 69 12.528 2.054 -65.710 1.00 0.00 N ATOM 525 CA GLN A 69 11.925 3.097 -66.531 1.00 0.00 C ATOM 526 C GLN A 69 12.558 4.453 -66.252 1.00 0.00 C ATOM 527 O GLN A 69 12.458 4.980 -65.144 1.00 0.00 O ATOM 528 CB GLN A 69 10.414 3.165 -66.286 1.00 0.00 C ATOM 529 CG GLN A 69 9.682 4.146 -67.185 1.00 0.00 C ATOM 530 CD GLN A 69 9.636 3.684 -68.629 1.00 0.00 C ATOM 531 OE1 GLN A 69 9.152 2.590 -68.930 1.00 0.00 O ATOM 532 NE2 GLN A 69 10.139 4.517 -69.532 1.00 0.00 N ATOM 0 H GLN A 69 12.822 2.364 -64.784 1.00 0.00 H new ATOM 0 HA GLN A 69 12.106 2.844 -67.576 1.00 0.00 H new ATOM 0 HB2 GLN A 69 9.989 2.172 -66.429 1.00 0.00 H new ATOM 0 HB3 GLN A 69 10.238 3.441 -65.246 1.00 0.00 H new ATOM 0 HG2 GLN A 69 8.665 4.282 -66.817 1.00 0.00 H new ATOM 0 HG3 GLN A 69 10.173 5.118 -67.133 1.00 0.00 H new ATOM 0 HE21 GLN A 69 10.529 5.412 -69.238 1.00 0.00 H new ATOM 0 HE22 GLN A 69 10.135 4.262 -70.520 1.00 0.00 H new ATOM 541 N ASP A 70 13.212 5.015 -67.264 1.00 0.00 N ATOM 542 CA ASP A 70 13.706 6.384 -67.191 1.00 0.00 C ATOM 543 C ASP A 70 14.766 6.531 -66.108 1.00 0.00 C ATOM 544 O ASP A 70 14.879 7.580 -65.473 1.00 0.00 O ATOM 545 CB ASP A 70 12.554 7.356 -66.921 1.00 0.00 C ATOM 546 CG ASP A 70 11.507 7.356 -68.027 1.00 0.00 C ATOM 547 OD1 ASP A 70 11.818 6.926 -69.113 1.00 0.00 O ATOM 548 OD2 ASP A 70 10.407 7.785 -67.776 1.00 0.00 O ATOM 0 H ASP A 70 13.412 4.542 -68.145 1.00 0.00 H new ATOM 0 HA ASP A 70 14.160 6.623 -68.153 1.00 0.00 H new ATOM 0 HB2 ASP A 70 12.077 7.093 -65.977 1.00 0.00 H new ATOM 0 HB3 ASP A 70 12.954 8.363 -66.807 1.00 0.00 H new ATOM 553 N GLY A 71 15.544 5.473 -65.900 1.00 0.00 N ATOM 554 CA GLY A 71 16.696 5.532 -65.009 1.00 0.00 C ATOM 555 C GLY A 71 16.291 5.246 -63.568 1.00 0.00 C ATOM 556 O GLY A 71 17.131 5.238 -62.667 1.00 0.00 O ATOM 0 H GLY A 71 15.397 4.563 -66.338 1.00 0.00 H new ATOM 0 HA2 GLY A 71 17.445 4.808 -65.330 1.00 0.00 H new ATOM 0 HA3 GLY A 71 17.158 6.517 -65.071 1.00 0.00 H new ATOM 560 N MET A 72 15.001 5.014 -63.355 1.00 0.00 N ATOM 561 CA MET A 72 14.469 4.812 -62.013 1.00 0.00 C ATOM 562 C MET A 72 13.774 3.463 -61.892 1.00 0.00 C ATOM 563 O MET A 72 13.431 2.837 -62.896 1.00 0.00 O ATOM 564 CB MET A 72 13.506 5.942 -61.652 1.00 0.00 C ATOM 565 CG MET A 72 14.139 7.326 -61.628 1.00 0.00 C ATOM 566 SD MET A 72 12.919 8.647 -61.479 1.00 0.00 S ATOM 567 CE MET A 72 12.222 8.651 -63.128 1.00 0.00 C ATOM 0 H MET A 72 14.303 4.961 -64.097 1.00 0.00 H new ATOM 0 HA MET A 72 15.304 4.821 -61.313 1.00 0.00 H new ATOM 0 HB2 MET A 72 12.684 5.945 -62.368 1.00 0.00 H new ATOM 0 HB3 MET A 72 13.075 5.736 -60.672 1.00 0.00 H new ATOM 0 HG2 MET A 72 14.838 7.387 -60.794 1.00 0.00 H new ATOM 0 HG3 MET A 72 14.717 7.472 -62.540 1.00 0.00 H new ATOM 0 HE1 MET A 72 11.669 9.577 -63.287 1.00 0.00 H new ATOM 0 HE2 MET A 72 13.024 8.577 -63.862 1.00 0.00 H new ATOM 0 HE3 MET A 72 11.548 7.802 -63.240 1.00 0.00 H new ATOM 577 N ASP A 73 13.568 3.016 -60.657 1.00 0.00 N ATOM 578 CA ASP A 73 12.812 1.797 -60.399 1.00 0.00 C ATOM 579 C ASP A 73 11.350 2.107 -60.110 1.00 0.00 C ATOM 580 O ASP A 73 11.034 2.843 -59.174 1.00 0.00 O ATOM 581 CB ASP A 73 13.420 1.029 -59.223 1.00 0.00 C ATOM 582 CG ASP A 73 14.800 0.465 -59.533 1.00 0.00 C ATOM 583 OD1 ASP A 73 15.135 0.370 -60.690 1.00 0.00 O ATOM 584 OD2 ASP A 73 15.504 0.132 -58.611 1.00 0.00 O ATOM 0 H ASP A 73 13.915 3.481 -59.818 1.00 0.00 H new ATOM 0 HA ASP A 73 12.863 1.179 -61.296 1.00 0.00 H new ATOM 0 HB2 ASP A 73 13.489 1.691 -58.360 1.00 0.00 H new ATOM 0 HB3 ASP A 73 12.753 0.212 -58.945 1.00 0.00 H new ATOM 589 N VAL A 74 10.459 1.541 -60.918 1.00 0.00 N ATOM 590 CA VAL A 74 9.030 1.795 -60.780 1.00 0.00 C ATOM 591 C VAL A 74 8.289 0.542 -60.331 1.00 0.00 C ATOM 592 O VAL A 74 8.316 -0.484 -61.011 1.00 0.00 O ATOM 593 CB VAL A 74 8.442 2.283 -62.117 1.00 0.00 C ATOM 594 CG1 VAL A 74 6.944 2.513 -61.988 1.00 0.00 C ATOM 595 CG2 VAL A 74 9.147 3.557 -62.558 1.00 0.00 C ATOM 0 H VAL A 74 10.702 0.903 -61.676 1.00 0.00 H new ATOM 0 HA VAL A 74 8.903 2.567 -60.021 1.00 0.00 H new ATOM 0 HB VAL A 74 8.602 1.516 -62.875 1.00 0.00 H new ATOM 0 HG11 VAL A 74 6.545 2.858 -62.942 1.00 0.00 H new ATOM 0 HG12 VAL A 74 6.456 1.580 -61.706 1.00 0.00 H new ATOM 0 HG13 VAL A 74 6.756 3.266 -61.223 1.00 0.00 H new ATOM 0 HG21 VAL A 74 8.726 3.897 -63.504 1.00 0.00 H new ATOM 0 HG22 VAL A 74 9.009 4.330 -61.801 1.00 0.00 H new ATOM 0 HG23 VAL A 74 10.211 3.359 -62.685 1.00 0.00 H new ATOM 605 N LEU A 75 7.628 0.631 -59.182 1.00 0.00 N ATOM 606 CA LEU A 75 6.748 -0.435 -58.719 1.00 0.00 C ATOM 607 C LEU A 75 5.324 -0.230 -59.219 1.00 0.00 C ATOM 608 O LEU A 75 4.786 0.875 -59.153 1.00 0.00 O ATOM 609 CB LEU A 75 6.754 -0.501 -57.187 1.00 0.00 C ATOM 610 CG LEU A 75 8.130 -0.684 -56.534 1.00 0.00 C ATOM 611 CD1 LEU A 75 7.994 -0.574 -55.021 1.00 0.00 C ATOM 612 CD2 LEU A 75 8.707 -2.034 -56.935 1.00 0.00 C ATOM 0 H LEU A 75 7.685 1.432 -58.553 1.00 0.00 H new ATOM 0 HA LEU A 75 7.122 -1.376 -59.123 1.00 0.00 H new ATOM 0 HB2 LEU A 75 6.308 0.415 -56.801 1.00 0.00 H new ATOM 0 HB3 LEU A 75 6.112 -1.324 -56.875 1.00 0.00 H new ATOM 0 HG LEU A 75 8.811 0.096 -56.875 1.00 0.00 H new ATOM 0 HD11 LEU A 75 8.972 -0.704 -54.557 1.00 0.00 H new ATOM 0 HD12 LEU A 75 7.597 0.408 -54.762 1.00 0.00 H new ATOM 0 HD13 LEU A 75 7.315 -1.347 -54.660 1.00 0.00 H new ATOM 0 HD21 LEU A 75 9.685 -2.164 -56.471 1.00 0.00 H new ATOM 0 HD22 LEU A 75 8.039 -2.828 -56.602 1.00 0.00 H new ATOM 0 HD23 LEU A 75 8.811 -2.078 -58.019 1.00 0.00 H new ATOM 624 N GLU A 76 4.718 -1.302 -59.720 1.00 0.00 N ATOM 625 CA GLU A 76 3.350 -1.243 -60.221 1.00 0.00 C ATOM 626 C GLU A 76 2.441 -2.191 -59.451 1.00 0.00 C ATOM 627 O GLU A 76 2.680 -3.398 -59.407 1.00 0.00 O ATOM 628 CB GLU A 76 3.314 -1.584 -61.712 1.00 0.00 C ATOM 629 CG GLU A 76 1.929 -1.514 -62.340 1.00 0.00 C ATOM 630 CD GLU A 76 1.919 -1.927 -63.785 1.00 0.00 C ATOM 631 OE1 GLU A 76 2.638 -1.339 -64.556 1.00 0.00 O ATOM 632 OE2 GLU A 76 1.192 -2.833 -64.119 1.00 0.00 O ATOM 0 H GLU A 76 5.153 -2.222 -59.790 1.00 0.00 H new ATOM 0 HA GLU A 76 2.985 -0.226 -60.077 1.00 0.00 H new ATOM 0 HB2 GLU A 76 3.976 -0.901 -62.244 1.00 0.00 H new ATOM 0 HB3 GLU A 76 3.713 -2.589 -61.852 1.00 0.00 H new ATOM 0 HG2 GLU A 76 1.249 -2.156 -61.780 1.00 0.00 H new ATOM 0 HG3 GLU A 76 1.549 -0.496 -62.256 1.00 0.00 H new ATOM 639 N LEU A 77 1.395 -1.638 -58.844 1.00 0.00 N ATOM 640 CA LEU A 77 0.446 -2.435 -58.076 1.00 0.00 C ATOM 641 C LEU A 77 -0.954 -2.346 -58.670 1.00 0.00 C ATOM 642 O LEU A 77 -1.487 -1.254 -58.867 1.00 0.00 O ATOM 643 CB LEU A 77 0.419 -1.966 -56.616 1.00 0.00 C ATOM 644 CG LEU A 77 -0.756 -2.478 -55.774 1.00 0.00 C ATOM 645 CD1 LEU A 77 -0.657 -3.991 -55.630 1.00 0.00 C ATOM 646 CD2 LEU A 77 -0.742 -1.797 -54.414 1.00 0.00 C ATOM 0 H LEU A 77 1.184 -0.640 -58.870 1.00 0.00 H new ATOM 0 HA LEU A 77 0.772 -3.474 -58.116 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.348 -2.276 -56.137 1.00 0.00 H new ATOM 0 HB3 LEU A 77 0.403 -0.876 -56.604 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.699 -2.240 -56.267 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.492 -4.355 -55.032 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -0.689 -4.453 -56.617 1.00 0.00 H new ATOM 0 HD13 LEU A 77 0.281 -4.249 -55.139 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -1.577 -2.161 -53.816 1.00 0.00 H new ATOM 0 HD22 LEU A 77 0.195 -2.022 -53.904 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -0.833 -0.719 -54.546 1.00 0.00 H new ATOM 658 N ASN A 78 -1.545 -3.502 -58.954 1.00 0.00 N ATOM 659 CA ASN A 78 -2.889 -3.556 -59.518 1.00 0.00 C ATOM 660 C ASN A 78 -3.848 -4.287 -58.586 1.00 0.00 C ATOM 661 O ASN A 78 -3.705 -5.486 -58.347 1.00 0.00 O ATOM 662 CB ASN A 78 -2.867 -4.216 -60.885 1.00 0.00 C ATOM 663 CG ASN A 78 -2.037 -3.454 -61.881 1.00 0.00 C ATOM 664 OD1 ASN A 78 -2.396 -2.342 -62.285 1.00 0.00 O ATOM 665 ND2 ASN A 78 -0.933 -4.031 -62.284 1.00 0.00 N ATOM 0 H ASN A 78 -1.114 -4.414 -58.803 1.00 0.00 H new ATOM 0 HA ASN A 78 -3.247 -2.533 -59.632 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -2.475 -5.228 -60.789 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -3.887 -4.303 -61.259 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -0.329 -3.562 -62.959 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -0.677 -4.950 -61.923 1.00 0.00 H new ATOM 672 N ILE A 79 -4.826 -3.555 -58.062 1.00 0.00 N ATOM 673 CA ILE A 79 -5.786 -4.121 -57.122 1.00 0.00 C ATOM 674 C ILE A 79 -7.140 -4.343 -57.783 1.00 0.00 C ATOM 675 O ILE A 79 -7.816 -3.389 -58.169 1.00 0.00 O ATOM 676 CB ILE A 79 -5.956 -3.208 -55.894 1.00 0.00 C ATOM 677 CG1 ILE A 79 -4.605 -2.966 -55.217 1.00 0.00 C ATOM 678 CG2 ILE A 79 -6.946 -3.816 -54.912 1.00 0.00 C ATOM 679 CD1 ILE A 79 -4.626 -1.854 -54.193 1.00 0.00 C ATOM 0 H ILE A 79 -4.974 -2.568 -58.273 1.00 0.00 H new ATOM 0 HA ILE A 79 -5.393 -5.084 -56.798 1.00 0.00 H new ATOM 0 HB ILE A 79 -6.350 -2.248 -56.228 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -4.282 -3.887 -54.732 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -3.864 -2.730 -55.980 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -7.054 -3.158 -54.050 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -7.913 -3.938 -55.399 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -6.581 -4.789 -54.582 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -3.633 -1.742 -53.757 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -4.918 -0.921 -54.675 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -5.342 -2.096 -53.408 1.00 0.00 H new ATOM 691 N THR A 80 -7.531 -5.606 -57.911 1.00 0.00 N ATOM 692 CA THR A 80 -8.812 -5.955 -58.514 1.00 0.00 C ATOM 693 C THR A 80 -9.897 -6.099 -57.455 1.00 0.00 C ATOM 694 O THR A 80 -9.832 -6.983 -56.601 1.00 0.00 O ATOM 695 CB THR A 80 -8.706 -7.258 -59.328 1.00 0.00 C ATOM 696 OG1 THR A 80 -7.749 -7.089 -60.381 1.00 0.00 O ATOM 697 CG2 THR A 80 -10.055 -7.624 -59.927 1.00 0.00 C ATOM 0 H THR A 80 -6.978 -6.407 -57.605 1.00 0.00 H new ATOM 0 HA THR A 80 -9.084 -5.142 -59.187 1.00 0.00 H new ATOM 0 HB THR A 80 -8.387 -8.060 -58.663 1.00 0.00 H new ATOM 0 HG1 THR A 80 -7.681 -7.919 -60.897 1.00 0.00 H new ATOM 0 HG21 THR A 80 -9.961 -8.547 -60.499 1.00 0.00 H new ATOM 0 HG22 THR A 80 -10.782 -7.765 -59.127 1.00 0.00 H new ATOM 0 HG23 THR A 80 -10.390 -6.822 -60.585 1.00 0.00 H new ATOM 705 N LEU A 81 -10.897 -5.226 -57.516 1.00 0.00 N ATOM 706 CA LEU A 81 -12.006 -5.264 -56.571 1.00 0.00 C ATOM 707 C LEU A 81 -13.329 -5.507 -57.285 1.00 0.00 C ATOM 708 O LEU A 81 -13.988 -6.474 -57.015 1.00 0.00 O ATOM 709 CB LEU A 81 -12.077 -3.949 -55.784 1.00 0.00 C ATOM 710 CG LEU A 81 -10.822 -3.586 -54.980 1.00 0.00 C ATOM 711 CD1 LEU A 81 -10.996 -2.205 -54.362 1.00 0.00 C ATOM 712 CD2 LEU A 81 -10.583 -4.639 -53.909 1.00 0.00 C ATOM 0 H LEU A 81 -10.962 -4.483 -58.211 1.00 0.00 H new ATOM 0 HA LEU A 81 -11.830 -6.090 -55.882 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -12.285 -3.139 -56.483 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -12.922 -4.003 -55.098 1.00 0.00 H new ATOM 0 HG LEU A 81 -9.953 -3.561 -55.637 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -10.104 -1.947 -53.791 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -11.146 -1.469 -55.152 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -11.862 -2.209 -53.700 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -9.691 -4.381 -53.338 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -11.443 -4.680 -53.241 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -10.443 -5.612 -54.380 1.00 0.00 H new TER 724 LEU A 81 ATOM 725 N ASP B 38 -15.774 7.929 -50.708 1.00 0.00 N ATOM 726 CA ASP B 38 -15.121 8.363 -49.478 1.00 0.00 C ATOM 727 C ASP B 38 -14.429 7.199 -48.782 1.00 0.00 C ATOM 728 O ASP B 38 -13.656 7.394 -47.844 1.00 0.00 O ATOM 729 CB ASP B 38 -16.137 9.002 -48.528 1.00 0.00 C ATOM 730 CG ASP B 38 -16.706 10.310 -49.061 1.00 0.00 C ATOM 731 OD1 ASP B 38 -16.028 10.965 -49.818 1.00 0.00 O ATOM 732 OD2 ASP B 38 -17.810 10.643 -48.706 1.00 0.00 O ATOM 0 HA ASP B 38 -14.367 9.103 -49.747 1.00 0.00 H new ATOM 0 HB2 ASP B 38 -16.953 8.301 -48.353 1.00 0.00 H new ATOM 0 HB3 ASP B 38 -15.661 9.185 -47.565 1.00 0.00 H new ATOM 737 N TYR B 39 -14.710 5.986 -49.246 1.00 0.00 N ATOM 738 CA TYR B 39 -14.155 4.783 -48.635 1.00 0.00 C ATOM 739 C TYR B 39 -12.763 4.483 -49.175 1.00 0.00 C ATOM 740 O TYR B 39 -11.782 4.502 -48.433 1.00 0.00 O ATOM 741 CB TYR B 39 -15.084 3.589 -48.866 1.00 0.00 C ATOM 742 CG TYR B 39 -14.580 2.298 -48.259 1.00 0.00 C ATOM 743 CD1 TYR B 39 -14.582 2.131 -46.882 1.00 0.00 C ATOM 744 CD2 TYR B 39 -14.114 1.282 -49.080 1.00 0.00 C ATOM 745 CE1 TYR B 39 -14.123 0.952 -46.328 1.00 0.00 C ATOM 746 CE2 TYR B 39 -13.654 0.104 -48.526 1.00 0.00 C ATOM 747 CZ TYR B 39 -13.656 -0.063 -47.157 1.00 0.00 C ATOM 748 OH TYR B 39 -13.198 -1.237 -46.605 1.00 0.00 O ATOM 0 H TYR B 39 -15.320 5.809 -50.044 1.00 0.00 H new ATOM 0 HA TYR B 39 -14.070 4.960 -47.563 1.00 0.00 H new ATOM 0 HB2 TYR B 39 -16.065 3.817 -48.449 1.00 0.00 H new ATOM 0 HB3 TYR B 39 -15.219 3.447 -49.938 1.00 0.00 H new ATOM 0 HD1 TYR B 39 -14.943 2.923 -46.243 1.00 0.00 H new ATOM 0 HD2 TYR B 39 -14.111 1.412 -50.152 1.00 0.00 H new ATOM 0 HE1 TYR B 39 -14.127 0.819 -45.256 1.00 0.00 H new ATOM 0 HE2 TYR B 39 -13.292 -0.688 -49.165 1.00 0.00 H new ATOM 0 HH TYR B 39 -12.226 -1.294 -46.718 1.00 0.00 H new ATOM 758 N LEU B 40 -12.685 4.205 -50.472 1.00 0.00 N ATOM 759 CA LEU B 40 -11.421 3.842 -51.102 1.00 0.00 C ATOM 760 C LEU B 40 -10.465 5.027 -51.142 1.00 0.00 C ATOM 761 O LEU B 40 -9.273 4.885 -50.871 1.00 0.00 O ATOM 762 CB LEU B 40 -11.668 3.329 -52.526 1.00 0.00 C ATOM 763 CG LEU B 40 -12.365 1.966 -52.630 1.00 0.00 C ATOM 764 CD1 LEU B 40 -12.658 1.655 -54.092 1.00 0.00 C ATOM 765 CD2 LEU B 40 -11.481 0.895 -52.010 1.00 0.00 C ATOM 0 H LEU B 40 -13.483 4.224 -51.108 1.00 0.00 H new ATOM 0 HA LEU B 40 -10.964 3.052 -50.506 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -12.269 4.066 -53.059 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -10.710 3.267 -53.042 1.00 0.00 H new ATOM 0 HG LEU B 40 -13.310 1.989 -52.087 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -13.153 0.687 -54.166 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -13.307 2.427 -54.505 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -11.724 1.628 -54.653 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -11.976 -0.073 -52.084 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -10.529 0.857 -52.540 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -11.303 1.132 -50.961 1.00 0.00 H new ATOM 777 N PRO B 41 -10.996 6.198 -51.481 1.00 0.00 N ATOM 778 CA PRO B 41 -10.201 7.420 -51.509 1.00 0.00 C ATOM 779 C PRO B 41 -9.411 7.593 -50.218 1.00 0.00 C ATOM 780 O PRO B 41 -8.245 7.986 -50.240 1.00 0.00 O ATOM 781 CB PRO B 41 -11.259 8.515 -51.675 1.00 0.00 C ATOM 782 CG PRO B 41 -12.340 7.862 -52.466 1.00 0.00 C ATOM 783 CD PRO B 41 -12.420 6.465 -51.908 1.00 0.00 C ATOM 0 HA PRO B 41 -9.452 7.430 -52.301 1.00 0.00 H new ATOM 0 HB2 PRO B 41 -11.627 8.863 -50.710 1.00 0.00 H new ATOM 0 HB3 PRO B 41 -10.855 9.384 -52.194 1.00 0.00 H new ATOM 0 HG2 PRO B 41 -13.288 8.389 -52.355 1.00 0.00 H new ATOM 0 HG3 PRO B 41 -12.103 7.852 -53.530 1.00 0.00 H new ATOM 0 HD2 PRO B 41 -13.113 6.403 -51.069 1.00 0.00 H new ATOM 0 HD3 PRO B 41 -12.760 5.749 -52.656 1.00 0.00 H new ATOM 791 N THR B 42 -10.054 7.298 -49.093 1.00 0.00 N ATOM 792 CA THR B 42 -9.418 7.438 -47.788 1.00 0.00 C ATOM 793 C THR B 42 -8.357 6.367 -47.575 1.00 0.00 C ATOM 794 O THR B 42 -7.243 6.662 -47.141 1.00 0.00 O ATOM 795 CB THR B 42 -10.459 7.368 -46.655 1.00 0.00 C ATOM 796 OG1 THR B 42 -11.404 8.435 -46.804 1.00 0.00 O ATOM 797 CG2 THR B 42 -9.779 7.484 -45.299 1.00 0.00 C ATOM 0 H THR B 42 -11.016 6.960 -49.059 1.00 0.00 H new ATOM 0 HA THR B 42 -8.937 8.416 -47.766 1.00 0.00 H new ATOM 0 HB THR B 42 -10.972 6.408 -46.712 1.00 0.00 H new ATOM 0 HG1 THR B 42 -12.133 8.147 -47.392 1.00 0.00 H new ATOM 0 HG21 THR B 42 -10.529 7.433 -44.510 1.00 0.00 H new ATOM 0 HG22 THR B 42 -9.068 6.667 -45.177 1.00 0.00 H new ATOM 0 HG23 THR B 42 -9.252 8.436 -45.237 1.00 0.00 H new ATOM 805 N LEU B 43 -8.708 5.123 -47.882 1.00 0.00 N ATOM 806 CA LEU B 43 -7.781 4.007 -47.738 1.00 0.00 C ATOM 807 C LEU B 43 -6.555 4.191 -48.623 1.00 0.00 C ATOM 808 O LEU B 43 -5.445 3.810 -48.250 1.00 0.00 O ATOM 809 CB LEU B 43 -8.479 2.688 -48.091 1.00 0.00 C ATOM 810 CG LEU B 43 -9.600 2.253 -47.138 1.00 0.00 C ATOM 811 CD1 LEU B 43 -10.275 1.002 -47.684 1.00 0.00 C ATOM 812 CD2 LEU B 43 -9.021 2.001 -45.754 1.00 0.00 C ATOM 0 H LEU B 43 -9.630 4.862 -48.233 1.00 0.00 H new ATOM 0 HA LEU B 43 -7.454 3.977 -46.699 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -8.894 2.775 -49.095 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -7.728 1.898 -48.124 1.00 0.00 H new ATOM 0 HG LEU B 43 -10.348 3.042 -47.060 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -11.071 0.693 -47.007 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -10.696 1.215 -48.666 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -9.541 0.201 -47.770 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -9.818 1.692 -45.077 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -8.269 1.214 -45.812 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -8.561 2.916 -45.380 1.00 0.00 H new ATOM 824 N ARG B 44 -6.761 4.779 -49.796 1.00 0.00 N ATOM 825 CA ARG B 44 -5.674 5.007 -50.741 1.00 0.00 C ATOM 826 C ARG B 44 -4.722 6.083 -50.236 1.00 0.00 C ATOM 827 O ARG B 44 -3.505 5.967 -50.381 1.00 0.00 O ATOM 828 CB ARG B 44 -6.224 5.418 -52.100 1.00 0.00 C ATOM 829 CG ARG B 44 -6.837 4.287 -52.910 1.00 0.00 C ATOM 830 CD ARG B 44 -7.253 4.742 -54.261 1.00 0.00 C ATOM 831 NE ARG B 44 -8.471 5.535 -54.215 1.00 0.00 N ATOM 832 CZ ARG B 44 -8.967 6.236 -55.253 1.00 0.00 C ATOM 833 NH1 ARG B 44 -8.339 6.234 -56.408 1.00 0.00 N ATOM 834 NH2 ARG B 44 -10.085 6.927 -55.110 1.00 0.00 N ATOM 0 H ARG B 44 -7.672 5.107 -50.116 1.00 0.00 H new ATOM 0 HA ARG B 44 -5.124 4.071 -50.840 1.00 0.00 H new ATOM 0 HB2 ARG B 44 -6.979 6.190 -51.952 1.00 0.00 H new ATOM 0 HB3 ARG B 44 -5.419 5.867 -52.681 1.00 0.00 H new ATOM 0 HG2 ARG B 44 -6.116 3.475 -53.005 1.00 0.00 H new ATOM 0 HG3 ARG B 44 -7.700 3.886 -52.379 1.00 0.00 H new ATOM 0 HD2 ARG B 44 -6.453 5.332 -54.708 1.00 0.00 H new ATOM 0 HD3 ARG B 44 -7.408 3.876 -54.904 1.00 0.00 H new ATOM 0 HE ARG B 44 -8.986 5.562 -53.335 1.00 0.00 H new ATOM 0 HH11 ARG B 44 -7.476 5.702 -56.518 1.00 0.00 H new ATOM 0 HH12 ARG B 44 -8.715 6.765 -57.194 1.00 0.00 H new ATOM 0 HH21 ARG B 44 -10.572 6.929 -54.214 1.00 0.00 H new ATOM 0 HH22 ARG B 44 -10.461 7.458 -55.896 1.00 0.00 H new ATOM 848 N LYS B 45 -5.283 7.131 -49.641 1.00 0.00 N ATOM 849 CA LYS B 45 -4.490 8.112 -48.909 1.00 0.00 C ATOM 850 C LYS B 45 -3.673 7.449 -47.808 1.00 0.00 C ATOM 851 O LYS B 45 -2.485 7.730 -47.647 1.00 0.00 O ATOM 852 CB LYS B 45 -5.392 9.194 -48.315 1.00 0.00 C ATOM 853 CG LYS B 45 -4.656 10.249 -47.498 1.00 0.00 C ATOM 854 CD LYS B 45 -5.613 11.309 -46.974 1.00 0.00 C ATOM 855 CE LYS B 45 -4.872 12.386 -46.195 1.00 0.00 C ATOM 856 NZ LYS B 45 -4.336 11.870 -44.906 1.00 0.00 N ATOM 0 H LYS B 45 -6.285 7.323 -49.652 1.00 0.00 H new ATOM 0 HA LYS B 45 -3.799 8.575 -49.614 1.00 0.00 H new ATOM 0 HB2 LYS B 45 -5.928 9.688 -49.125 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -6.141 8.718 -47.681 1.00 0.00 H new ATOM 0 HG2 LYS B 45 -4.144 9.773 -46.662 1.00 0.00 H new ATOM 0 HG3 LYS B 45 -3.890 10.720 -48.114 1.00 0.00 H new ATOM 0 HD2 LYS B 45 -6.148 11.763 -47.808 1.00 0.00 H new ATOM 0 HD3 LYS B 45 -6.360 10.842 -46.332 1.00 0.00 H new ATOM 0 HE2 LYS B 45 -4.052 12.772 -46.800 1.00 0.00 H new ATOM 0 HE3 LYS B 45 -5.545 13.221 -46.000 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 -3.958 12.661 -44.346 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 -5.098 11.402 -44.375 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 -3.576 11.186 -45.095 1.00 0.00 H new ATOM 870 N GLU B 46 -4.316 6.566 -47.051 1.00 0.00 N ATOM 871 CA GLU B 46 -3.643 5.840 -45.980 1.00 0.00 C ATOM 872 C GLU B 46 -2.474 5.024 -46.518 1.00 0.00 C ATOM 873 O GLU B 46 -1.415 4.952 -45.893 1.00 0.00 O ATOM 874 CB GLU B 46 -4.627 4.937 -45.252 1.00 0.00 C ATOM 0 H GLU B 46 -5.304 6.336 -47.160 1.00 0.00 H new ATOM 0 HA GLU B 46 -3.248 6.571 -45.275 1.00 0.00 H new ATOM 879 N LEU B 47 -2.672 4.412 -47.680 1.00 0.00 N ATOM 880 CA LEU B 47 -1.623 3.626 -48.320 1.00 0.00 C ATOM 881 C LEU B 47 -0.429 4.497 -48.689 1.00 0.00 C ATOM 882 O LEU B 47 0.721 4.093 -48.521 1.00 0.00 O ATOM 883 CB LEU B 47 -2.169 2.938 -49.577 1.00 0.00 C ATOM 884 CG LEU B 47 -3.138 1.774 -49.331 1.00 0.00 C ATOM 885 CD1 LEU B 47 -3.792 1.370 -50.645 1.00 0.00 C ATOM 886 CD2 LEU B 47 -2.383 0.606 -48.715 1.00 0.00 C ATOM 0 H LEU B 47 -3.550 4.445 -48.199 1.00 0.00 H new ATOM 0 HA LEU B 47 -1.290 2.870 -47.608 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -2.676 3.686 -50.187 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.327 2.568 -50.161 1.00 0.00 H new ATOM 0 HG LEU B 47 -3.921 2.082 -48.638 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -4.480 0.543 -50.470 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -4.341 2.218 -51.054 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -3.024 1.059 -51.353 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -3.072 -0.221 -48.540 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.594 0.284 -49.395 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -1.942 0.917 -47.768 1.00 0.00 H new ATOM 898 N MET B 48 -0.710 5.694 -49.192 1.00 0.00 N ATOM 899 CA MET B 48 0.339 6.656 -49.511 1.00 0.00 C ATOM 900 C MET B 48 1.156 7.011 -48.276 1.00 0.00 C ATOM 901 O MET B 48 2.381 7.108 -48.337 1.00 0.00 O ATOM 902 CB MET B 48 -0.269 7.915 -50.127 1.00 0.00 C ATOM 903 CG MET B 48 -0.887 7.706 -51.503 1.00 0.00 C ATOM 904 SD MET B 48 -1.813 9.146 -52.074 1.00 0.00 S ATOM 905 CE MET B 48 -0.481 10.285 -52.436 1.00 0.00 C ATOM 0 H MET B 48 -1.656 6.022 -49.388 1.00 0.00 H new ATOM 0 HA MET B 48 1.011 6.196 -50.236 1.00 0.00 H new ATOM 0 HB2 MET B 48 -1.034 8.302 -49.453 1.00 0.00 H new ATOM 0 HB3 MET B 48 0.505 8.679 -50.202 1.00 0.00 H new ATOM 0 HG2 MET B 48 -0.099 7.478 -52.220 1.00 0.00 H new ATOM 0 HG3 MET B 48 -1.550 6.841 -51.472 1.00 0.00 H new ATOM 0 HE1 MET B 48 -0.894 11.219 -52.817 1.00 0.00 H new ATOM 0 HE2 MET B 48 0.085 10.484 -51.526 1.00 0.00 H new ATOM 0 HE3 MET B 48 0.178 9.847 -53.185 1.00 0.00 H new ATOM 915 N GLU B 49 0.470 7.203 -47.154 1.00 0.00 N ATOM 916 CA GLU B 49 1.137 7.440 -45.879 1.00 0.00 C ATOM 917 C GLU B 49 2.011 6.256 -45.487 1.00 0.00 C ATOM 918 O GLU B 49 3.131 6.432 -45.006 1.00 0.00 O ATOM 919 CB GLU B 49 0.106 7.711 -44.781 1.00 0.00 C ATOM 920 CG GLU B 49 -0.661 9.015 -44.946 1.00 0.00 C ATOM 921 CD GLU B 49 -1.773 9.170 -43.946 1.00 0.00 C ATOM 922 OE1 GLU B 49 -1.919 8.311 -43.110 1.00 0.00 O ATOM 923 OE2 GLU B 49 -2.477 10.149 -44.019 1.00 0.00 O ATOM 0 H GLU B 49 -0.549 7.199 -47.102 1.00 0.00 H new ATOM 0 HA GLU B 49 1.776 8.315 -45.994 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -0.606 6.886 -44.756 1.00 0.00 H new ATOM 0 HB3 GLU B 49 0.615 7.722 -43.817 1.00 0.00 H new ATOM 0 HG2 GLU B 49 0.030 9.852 -44.846 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -1.076 9.062 -45.953 1.00 0.00 H new ATOM 930 N VAL B 50 1.495 5.049 -45.695 1.00 0.00 N ATOM 931 CA VAL B 50 2.252 3.835 -45.423 1.00 0.00 C ATOM 932 C VAL B 50 3.524 3.778 -46.259 1.00 0.00 C ATOM 933 O VAL B 50 4.564 3.311 -45.795 1.00 0.00 O ATOM 934 CB VAL B 50 1.392 2.591 -45.718 1.00 0.00 C ATOM 935 CG1 VAL B 50 2.252 1.336 -45.714 1.00 0.00 C ATOM 936 CG2 VAL B 50 0.272 2.481 -44.695 1.00 0.00 C ATOM 0 H VAL B 50 0.553 4.887 -46.052 1.00 0.00 H new ATOM 0 HA VAL B 50 2.528 3.848 -44.369 1.00 0.00 H new ATOM 0 HB VAL B 50 0.950 2.694 -46.709 1.00 0.00 H new ATOM 0 HG11 VAL B 50 1.628 0.467 -45.924 1.00 0.00 H new ATOM 0 HG12 VAL B 50 3.024 1.422 -46.478 1.00 0.00 H new ATOM 0 HG13 VAL B 50 2.720 1.219 -44.737 1.00 0.00 H new ATOM 0 HG21 VAL B 50 -0.332 1.599 -44.910 1.00 0.00 H new ATOM 0 HG22 VAL B 50 0.699 2.394 -43.696 1.00 0.00 H new ATOM 0 HG23 VAL B 50 -0.355 3.371 -44.745 1.00 0.00 H new ATOM 946 N LEU B 51 3.435 4.259 -47.495 1.00 0.00 N ATOM 947 CA LEU B 51 4.575 4.250 -48.404 1.00 0.00 C ATOM 948 C LEU B 51 5.621 5.275 -47.984 1.00 0.00 C ATOM 949 O LEU B 51 6.822 5.057 -48.156 1.00 0.00 O ATOM 950 CB LEU B 51 4.112 4.541 -49.837 1.00 0.00 C ATOM 951 CG LEU B 51 3.243 3.458 -50.488 1.00 0.00 C ATOM 952 CD1 LEU B 51 2.700 3.971 -51.814 1.00 0.00 C ATOM 953 CD2 LEU B 51 4.069 2.196 -50.688 1.00 0.00 C ATOM 0 H LEU B 51 2.584 4.660 -47.890 1.00 0.00 H new ATOM 0 HA LEU B 51 5.028 3.259 -48.364 1.00 0.00 H new ATOM 0 HB2 LEU B 51 3.553 5.477 -49.836 1.00 0.00 H new ATOM 0 HB3 LEU B 51 4.993 4.697 -50.459 1.00 0.00 H new ATOM 0 HG LEU B 51 2.400 3.218 -49.840 1.00 0.00 H new ATOM 0 HD11 LEU B 51 2.082 3.201 -52.277 1.00 0.00 H new ATOM 0 HD12 LEU B 51 2.098 4.863 -51.640 1.00 0.00 H new ATOM 0 HD13 LEU B 51 3.530 4.217 -52.476 1.00 0.00 H new ATOM 0 HD21 LEU B 51 3.451 1.426 -51.151 1.00 0.00 H new ATOM 0 HD22 LEU B 51 4.919 2.416 -51.334 1.00 0.00 H new ATOM 0 HD23 LEU B 51 4.429 1.840 -49.723 1.00 0.00 H new ATOM 965 N SER B 52 5.160 6.393 -47.433 1.00 0.00 N ATOM 966 CA SER B 52 6.058 7.416 -46.910 1.00 0.00 C ATOM 967 C SER B 52 6.764 6.936 -45.648 1.00 0.00 C ATOM 968 O SER B 52 7.781 7.498 -45.242 1.00 0.00 O ATOM 969 CB SER B 52 5.286 8.686 -46.614 1.00 0.00 C ATOM 970 OG SER B 52 4.456 8.521 -45.497 1.00 0.00 O ATOM 0 H SER B 52 4.169 6.614 -47.337 1.00 0.00 H new ATOM 0 HA SER B 52 6.813 7.620 -47.669 1.00 0.00 H new ATOM 0 HB2 SER B 52 5.982 9.506 -46.436 1.00 0.00 H new ATOM 0 HB3 SER B 52 4.685 8.961 -47.481 1.00 0.00 H new ATOM 0 HG SER B 52 4.060 7.625 -45.513 1.00 0.00 H new ATOM 976 N LYS B 53 6.219 5.892 -45.032 1.00 0.00 N ATOM 977 CA LYS B 53 6.872 5.243 -43.901 1.00 0.00 C ATOM 978 C LYS B 53 7.748 4.084 -44.360 1.00 0.00 C ATOM 979 O LYS B 53 8.808 3.831 -43.789 1.00 0.00 O ATOM 980 CB LYS B 53 5.832 4.750 -42.894 1.00 0.00 C ATOM 981 CG LYS B 53 5.080 5.859 -42.171 1.00 0.00 C ATOM 982 CD LYS B 53 4.051 5.291 -41.205 1.00 0.00 C ATOM 983 CE LYS B 53 3.292 6.398 -40.488 1.00 0.00 C ATOM 984 NZ LYS B 53 2.263 5.857 -39.560 1.00 0.00 N ATOM 0 H LYS B 53 5.326 5.477 -45.297 1.00 0.00 H new ATOM 0 HA LYS B 53 7.512 5.981 -43.417 1.00 0.00 H new ATOM 0 HB2 LYS B 53 5.112 4.119 -43.414 1.00 0.00 H new ATOM 0 HB3 LYS B 53 6.330 4.123 -42.154 1.00 0.00 H new ATOM 0 HG2 LYS B 53 5.787 6.485 -41.626 1.00 0.00 H new ATOM 0 HG3 LYS B 53 4.583 6.499 -42.900 1.00 0.00 H new ATOM 0 HD2 LYS B 53 3.349 4.660 -41.749 1.00 0.00 H new ATOM 0 HD3 LYS B 53 4.549 4.656 -40.472 1.00 0.00 H new ATOM 0 HE2 LYS B 53 3.995 7.016 -39.930 1.00 0.00 H new ATOM 0 HE3 LYS B 53 2.813 7.044 -41.223 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 1.769 6.644 -39.092 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 1.577 5.288 -40.096 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 2.722 5.261 -38.842 1.00 0.00 H new ATOM 998 N TYR B 54 7.298 3.384 -45.396 1.00 0.00 N ATOM 999 CA TYR B 54 8.022 2.229 -45.912 1.00 0.00 C ATOM 1000 C TYR B 54 9.245 2.658 -46.712 1.00 0.00 C ATOM 1001 O TYR B 54 10.381 2.441 -46.292 1.00 0.00 O ATOM 1002 CB TYR B 54 7.102 1.361 -46.773 1.00 0.00 C ATOM 1003 CG TYR B 54 6.185 0.463 -45.973 1.00 0.00 C ATOM 1004 CD1 TYR B 54 6.138 0.572 -44.591 1.00 0.00 C ATOM 1005 CD2 TYR B 54 5.390 -0.470 -46.622 1.00 0.00 C ATOM 1006 CE1 TYR B 54 5.301 -0.248 -43.861 1.00 0.00 C ATOM 1007 CE2 TYR B 54 4.552 -1.291 -45.891 1.00 0.00 C ATOM 1008 CZ TYR B 54 4.506 -1.182 -44.516 1.00 0.00 C ATOM 1009 OH TYR B 54 3.671 -1.999 -43.789 1.00 0.00 O ATOM 0 H TYR B 54 6.434 3.597 -45.895 1.00 0.00 H new ATOM 0 HA TYR B 54 8.364 1.641 -45.060 1.00 0.00 H new ATOM 0 HB2 TYR B 54 6.498 2.008 -47.409 1.00 0.00 H new ATOM 0 HB3 TYR B 54 7.712 0.745 -47.434 1.00 0.00 H new ATOM 0 HD1 TYR B 54 6.757 1.299 -44.086 1.00 0.00 H new ATOM 0 HD2 TYR B 54 5.426 -0.555 -47.698 1.00 0.00 H new ATOM 0 HE1 TYR B 54 5.264 -0.164 -42.785 1.00 0.00 H new ATOM 0 HE2 TYR B 54 3.933 -2.018 -46.396 1.00 0.00 H new ATOM 0 HH TYR B 54 3.184 -2.593 -44.397 1.00 0.00 H new ATOM 1019 N VAL B 55 9.005 3.269 -47.867 1.00 0.00 N ATOM 1020 CA VAL B 55 10.075 3.576 -48.808 1.00 0.00 C ATOM 1021 C VAL B 55 10.353 5.074 -48.858 1.00 0.00 C ATOM 1022 O VAL B 55 11.244 5.526 -49.575 1.00 0.00 O ATOM 1023 CB VAL B 55 9.707 3.079 -50.218 1.00 0.00 C ATOM 1024 CG1 VAL B 55 9.514 1.569 -50.217 1.00 0.00 C ATOM 1025 CG2 VAL B 55 8.448 3.782 -50.703 1.00 0.00 C ATOM 0 H VAL B 55 8.077 3.562 -48.174 1.00 0.00 H new ATOM 0 HA VAL B 55 10.974 3.065 -48.463 1.00 0.00 H new ATOM 0 HB VAL B 55 10.524 3.315 -50.900 1.00 0.00 H new ATOM 0 HG11 VAL B 55 9.254 1.235 -51.221 1.00 0.00 H new ATOM 0 HG12 VAL B 55 10.438 1.084 -49.901 1.00 0.00 H new ATOM 0 HG13 VAL B 55 8.712 1.305 -49.528 1.00 0.00 H new ATOM 0 HG21 VAL B 55 8.194 3.425 -51.701 1.00 0.00 H new ATOM 0 HG22 VAL B 55 7.626 3.567 -50.021 1.00 0.00 H new ATOM 0 HG23 VAL B 55 8.621 4.858 -50.735 1.00 0.00 H new ATOM 1035 N ASN B 56 9.582 5.838 -48.092 1.00 0.00 N ATOM 1036 CA ASN B 56 9.796 7.277 -47.984 1.00 0.00 C ATOM 1037 C ASN B 56 9.539 7.972 -49.315 1.00 0.00 C ATOM 1038 O ASN B 56 10.188 8.966 -49.642 1.00 0.00 O ATOM 1039 CB ASN B 56 11.199 7.573 -47.488 1.00 0.00 C ATOM 1040 CG ASN B 56 11.460 7.004 -46.121 1.00 0.00 C ATOM 1041 OD1 ASN B 56 10.646 7.160 -45.204 1.00 0.00 O ATOM 1042 ND2 ASN B 56 12.582 6.347 -45.967 1.00 0.00 N ATOM 0 H ASN B 56 8.803 5.485 -47.536 1.00 0.00 H new ATOM 0 HA ASN B 56 9.084 7.669 -47.258 1.00 0.00 H new ATOM 0 HB2 ASN B 56 11.923 7.164 -48.192 1.00 0.00 H new ATOM 0 HB3 ASN B 56 11.352 8.652 -47.464 1.00 0.00 H new ATOM 0 HD21 ASN B 56 12.814 5.939 -45.061 1.00 0.00 H new ATOM 0 HD22 ASN B 56 13.224 6.243 -46.753 1.00 0.00 H new ATOM 1049 N VAL B 57 8.590 7.444 -50.080 1.00 0.00 N ATOM 1050 CA VAL B 57 8.225 8.031 -51.364 1.00 0.00 C ATOM 1051 C VAL B 57 7.497 9.357 -51.176 1.00 0.00 C ATOM 1052 O VAL B 57 6.787 9.552 -50.190 1.00 0.00 O ATOM 1053 CB VAL B 57 7.328 7.064 -52.158 1.00 0.00 C ATOM 1054 CG1 VAL B 57 5.962 6.942 -51.498 1.00 0.00 C ATOM 1055 CG2 VAL B 57 7.192 7.545 -53.594 1.00 0.00 C ATOM 0 H VAL B 57 8.059 6.609 -49.833 1.00 0.00 H new ATOM 0 HA VAL B 57 9.145 8.214 -51.919 1.00 0.00 H new ATOM 0 HB VAL B 57 7.790 6.077 -52.164 1.00 0.00 H new ATOM 0 HG11 VAL B 57 5.341 6.255 -52.072 1.00 0.00 H new ATOM 0 HG12 VAL B 57 6.081 6.562 -50.483 1.00 0.00 H new ATOM 0 HG13 VAL B 57 5.485 7.921 -51.465 1.00 0.00 H new ATOM 0 HG21 VAL B 57 6.556 6.856 -54.150 1.00 0.00 H new ATOM 0 HG22 VAL B 57 6.745 8.539 -53.604 1.00 0.00 H new ATOM 0 HG23 VAL B 57 8.177 7.585 -54.059 1.00 0.00 H new ATOM 1065 N SER B 58 7.680 10.265 -52.129 1.00 0.00 N ATOM 1066 CA SER B 58 7.058 11.582 -52.060 1.00 0.00 C ATOM 1067 C SER B 58 5.799 11.643 -52.917 1.00 0.00 C ATOM 1068 O SER B 58 5.558 10.763 -53.745 1.00 0.00 O ATOM 1069 CB SER B 58 8.039 12.647 -52.511 1.00 0.00 C ATOM 1070 OG SER B 58 8.257 12.576 -53.893 1.00 0.00 O ATOM 0 H SER B 58 8.254 10.113 -52.958 1.00 0.00 H new ATOM 0 HA SER B 58 6.775 11.766 -51.024 1.00 0.00 H new ATOM 0 HB2 SER B 58 7.656 13.633 -52.250 1.00 0.00 H new ATOM 0 HB3 SER B 58 8.985 12.522 -51.983 1.00 0.00 H new ATOM 0 HG SER B 58 8.892 13.273 -54.160 1.00 0.00 H new ATOM 1076 N LEU B 59 5.000 12.683 -52.713 1.00 0.00 N ATOM 1077 CA LEU B 59 3.723 12.817 -53.404 1.00 0.00 C ATOM 1078 C LEU B 59 3.918 12.873 -54.914 1.00 0.00 C ATOM 1079 O LEU B 59 3.145 12.285 -55.672 1.00 0.00 O ATOM 1080 CB LEU B 59 2.992 14.078 -52.929 1.00 0.00 C ATOM 1081 CG LEU B 59 2.525 14.066 -51.468 1.00 0.00 C ATOM 1082 CD1 LEU B 59 1.971 15.436 -51.100 1.00 0.00 C ATOM 1083 CD2 LEU B 59 1.473 12.982 -51.280 1.00 0.00 C ATOM 0 H LEU B 59 5.214 13.448 -52.073 1.00 0.00 H new ATOM 0 HA LEU B 59 3.121 11.940 -53.167 1.00 0.00 H new ATOM 0 HB2 LEU B 59 3.651 14.934 -53.073 1.00 0.00 H new ATOM 0 HB3 LEU B 59 2.123 14.234 -53.568 1.00 0.00 H new ATOM 0 HG LEU B 59 3.366 13.847 -50.810 1.00 0.00 H new ATOM 0 HD11 LEU B 59 1.639 15.427 -50.062 1.00 0.00 H new ATOM 0 HD12 LEU B 59 2.749 16.189 -51.226 1.00 0.00 H new ATOM 0 HD13 LEU B 59 1.128 15.674 -51.748 1.00 0.00 H new ATOM 0 HD21 LEU B 59 1.141 12.973 -50.242 1.00 0.00 H new ATOM 0 HD22 LEU B 59 0.623 13.184 -51.931 1.00 0.00 H new ATOM 0 HD23 LEU B 59 1.901 12.012 -51.532 1.00 0.00 H new ATOM 1095 N ASP B 60 4.954 13.584 -55.346 1.00 0.00 N ATOM 1096 CA ASP B 60 5.236 13.741 -56.768 1.00 0.00 C ATOM 1097 C ASP B 60 5.617 12.410 -57.404 1.00 0.00 C ATOM 1098 O ASP B 60 5.549 12.252 -58.623 1.00 0.00 O ATOM 1099 CB ASP B 60 6.360 14.757 -56.983 1.00 0.00 C ATOM 1100 CG ASP B 60 5.935 16.186 -56.672 1.00 0.00 C ATOM 1101 OD1 ASP B 60 4.754 16.428 -56.585 1.00 0.00 O ATOM 1102 OD2 ASP B 60 6.794 17.022 -56.525 1.00 0.00 O ATOM 0 H ASP B 60 5.613 14.061 -54.731 1.00 0.00 H new ATOM 0 HA ASP B 60 4.327 14.105 -57.247 1.00 0.00 H new ATOM 0 HB2 ASP B 60 7.209 14.491 -56.353 1.00 0.00 H new ATOM 0 HB3 ASP B 60 6.700 14.701 -58.017 1.00 0.00 H new ATOM 1107 N ASN B 61 6.020 11.456 -56.571 1.00 0.00 N ATOM 1108 CA ASN B 61 6.476 10.159 -57.056 1.00 0.00 C ATOM 1109 C ASN B 61 5.392 9.101 -56.900 1.00 0.00 C ATOM 1110 O ASN B 61 5.658 7.904 -57.015 1.00 0.00 O ATOM 1111 CB ASN B 61 7.744 9.735 -56.336 1.00 0.00 C ATOM 1112 CG ASN B 61 8.946 10.527 -56.768 1.00 0.00 C ATOM 1113 OD1 ASN B 61 9.413 10.398 -57.906 1.00 0.00 O ATOM 1114 ND2 ASN B 61 9.457 11.344 -55.883 1.00 0.00 N ATOM 0 H ASN B 61 6.040 11.557 -55.556 1.00 0.00 H new ATOM 0 HA ASN B 61 6.698 10.258 -58.119 1.00 0.00 H new ATOM 0 HB2 ASN B 61 7.604 9.852 -55.261 1.00 0.00 H new ATOM 0 HB3 ASN B 61 7.926 8.676 -56.521 1.00 0.00 H new ATOM 0 HD21 ASN B 61 10.274 11.907 -56.120 1.00 0.00 H new ATOM 0 HD22 ASN B 61 9.039 11.418 -54.956 1.00 0.00 H new ATOM 1121 N ILE B 62 4.168 9.548 -56.638 1.00 0.00 N ATOM 1122 CA ILE B 62 3.026 8.646 -56.547 1.00 0.00 C ATOM 1123 C ILE B 62 1.998 8.949 -57.631 1.00 0.00 C ATOM 1124 O ILE B 62 1.520 10.077 -57.748 1.00 0.00 O ATOM 1125 CB ILE B 62 2.359 8.744 -55.164 1.00 0.00 C ATOM 1126 CG1 ILE B 62 3.343 8.335 -54.065 1.00 0.00 C ATOM 1127 CG2 ILE B 62 1.110 7.876 -55.113 1.00 0.00 C ATOM 1128 CD1 ILE B 62 2.856 8.634 -52.666 1.00 0.00 C ATOM 0 H ILE B 62 3.942 10.531 -56.485 1.00 0.00 H new ATOM 0 HA ILE B 62 3.400 7.632 -56.691 1.00 0.00 H new ATOM 0 HB ILE B 62 2.065 9.780 -54.995 1.00 0.00 H new ATOM 0 HG12 ILE B 62 3.543 7.267 -54.149 1.00 0.00 H new ATOM 0 HG13 ILE B 62 4.289 8.851 -54.228 1.00 0.00 H new ATOM 0 HG21 ILE B 62 0.651 7.957 -54.128 1.00 0.00 H new ATOM 0 HG22 ILE B 62 0.403 8.211 -55.872 1.00 0.00 H new ATOM 0 HG23 ILE B 62 1.381 6.837 -55.303 1.00 0.00 H new ATOM 0 HD11 ILE B 62 3.607 8.316 -51.943 1.00 0.00 H new ATOM 0 HD12 ILE B 62 2.683 9.705 -52.562 1.00 0.00 H new ATOM 0 HD13 ILE B 62 1.926 8.097 -52.482 1.00 0.00 H new ATOM 1140 N ARG B 63 1.662 7.935 -58.420 1.00 0.00 N ATOM 1141 CA ARG B 63 0.519 8.011 -59.321 1.00 0.00 C ATOM 1142 C ARG B 63 -0.523 6.954 -58.981 1.00 0.00 C ATOM 1143 O ARG B 63 -0.207 5.769 -58.874 1.00 0.00 O ATOM 1144 CB ARG B 63 0.963 7.834 -60.766 1.00 0.00 C ATOM 1145 CG ARG B 63 1.936 8.889 -61.270 1.00 0.00 C ATOM 1146 CD ARG B 63 1.290 10.221 -61.382 1.00 0.00 C ATOM 1147 NE ARG B 63 2.214 11.232 -61.871 1.00 0.00 N ATOM 1148 CZ ARG B 63 3.051 11.945 -61.092 1.00 0.00 C ATOM 1149 NH1 ARG B 63 3.067 11.748 -59.792 1.00 0.00 N ATOM 1150 NH2 ARG B 63 3.854 12.844 -61.634 1.00 0.00 N ATOM 0 H ARG B 63 2.166 7.049 -58.454 1.00 0.00 H new ATOM 0 HA ARG B 63 0.071 8.997 -59.198 1.00 0.00 H new ATOM 0 HB2 ARG B 63 1.427 6.853 -60.871 1.00 0.00 H new ATOM 0 HB3 ARG B 63 0.080 7.839 -61.405 1.00 0.00 H new ATOM 0 HG2 ARG B 63 2.787 8.953 -60.592 1.00 0.00 H new ATOM 0 HG3 ARG B 63 2.325 8.590 -62.243 1.00 0.00 H new ATOM 0 HD2 ARG B 63 0.435 10.155 -62.055 1.00 0.00 H new ATOM 0 HD3 ARG B 63 0.906 10.521 -60.407 1.00 0.00 H new ATOM 0 HE ARG B 63 2.230 11.414 -62.874 1.00 0.00 H new ATOM 0 HH11 ARG B 63 2.446 11.056 -59.373 1.00 0.00 H new ATOM 0 HH12 ARG B 63 3.701 12.288 -59.202 1.00 0.00 H new ATOM 0 HH21 ARG B 63 3.840 12.998 -62.642 1.00 0.00 H new ATOM 0 HH22 ARG B 63 4.487 13.384 -61.044 1.00 0.00 H new ATOM 1164 N ILE B 64 -1.767 7.390 -58.811 1.00 0.00 N ATOM 1165 CA ILE B 64 -2.865 6.477 -58.517 1.00 0.00 C ATOM 1166 C ILE B 64 -4.059 6.741 -59.425 1.00 0.00 C ATOM 1167 O ILE B 64 -4.486 7.883 -59.588 1.00 0.00 O ATOM 1168 CB ILE B 64 -3.301 6.598 -57.045 1.00 0.00 C ATOM 1169 CG1 ILE B 64 -2.144 6.232 -56.113 1.00 0.00 C ATOM 1170 CG2 ILE B 64 -4.509 5.715 -56.774 1.00 0.00 C ATOM 1171 CD1 ILE B 64 -2.436 6.476 -54.650 1.00 0.00 C ATOM 0 H ILE B 64 -2.040 8.371 -58.872 1.00 0.00 H new ATOM 0 HA ILE B 64 -2.503 5.465 -58.699 1.00 0.00 H new ATOM 0 HB ILE B 64 -3.583 7.633 -56.851 1.00 0.00 H new ATOM 0 HG12 ILE B 64 -1.896 5.180 -56.253 1.00 0.00 H new ATOM 0 HG13 ILE B 64 -1.264 6.808 -56.399 1.00 0.00 H new ATOM 0 HG21 ILE B 64 -4.804 5.813 -55.729 1.00 0.00 H new ATOM 0 HG22 ILE B 64 -5.336 6.023 -57.415 1.00 0.00 H new ATOM 0 HG23 ILE B 64 -4.255 4.676 -56.984 1.00 0.00 H new ATOM 0 HD11 ILE B 64 -1.569 6.192 -54.054 1.00 0.00 H new ATOM 0 HD12 ILE B 64 -2.654 7.532 -54.494 1.00 0.00 H new ATOM 0 HD13 ILE B 64 -3.296 5.879 -54.346 1.00 0.00 H new ATOM 1183 N SER B 65 -4.595 5.677 -60.014 1.00 0.00 N ATOM 1184 CA SER B 65 -5.742 5.791 -60.906 1.00 0.00 C ATOM 1185 C SER B 65 -6.699 4.619 -60.726 1.00 0.00 C ATOM 1186 O SER B 65 -6.272 3.490 -60.483 1.00 0.00 O ATOM 1187 CB SER B 65 -5.278 5.860 -62.347 1.00 0.00 C ATOM 1188 OG SER B 65 -6.369 5.938 -63.223 1.00 0.00 O ATOM 0 H SER B 65 -4.252 4.724 -59.889 1.00 0.00 H new ATOM 0 HA SER B 65 -6.274 6.708 -60.653 1.00 0.00 H new ATOM 0 HB2 SER B 65 -4.634 6.729 -62.484 1.00 0.00 H new ATOM 0 HB3 SER B 65 -4.680 4.980 -62.583 1.00 0.00 H new ATOM 0 HG SER B 65 -6.044 5.983 -64.147 1.00 0.00 H new ATOM 1194 N GLN B 66 -7.993 4.894 -60.848 1.00 0.00 N ATOM 1195 CA GLN B 66 -9.004 3.844 -60.828 1.00 0.00 C ATOM 1196 C GLN B 66 -9.759 3.780 -62.149 1.00 0.00 C ATOM 1197 O GLN B 66 -10.268 4.790 -62.633 1.00 0.00 O ATOM 1198 CB GLN B 66 -9.986 4.068 -59.675 1.00 0.00 C ATOM 1199 CG GLN B 66 -11.060 3.001 -59.556 1.00 0.00 C ATOM 1200 CD GLN B 66 -11.987 3.240 -58.379 1.00 0.00 C ATOM 1201 OE1 GLN B 66 -11.653 3.979 -57.449 1.00 0.00 O ATOM 1202 NE2 GLN B 66 -13.158 2.614 -58.412 1.00 0.00 N ATOM 0 H GLN B 66 -8.367 5.836 -60.962 1.00 0.00 H new ATOM 0 HA GLN B 66 -8.492 2.893 -60.680 1.00 0.00 H new ATOM 0 HB2 GLN B 66 -9.427 4.111 -58.740 1.00 0.00 H new ATOM 0 HB3 GLN B 66 -10.466 5.038 -59.805 1.00 0.00 H new ATOM 0 HG2 GLN B 66 -11.645 2.974 -60.476 1.00 0.00 H new ATOM 0 HG3 GLN B 66 -10.588 2.024 -59.450 1.00 0.00 H new ATOM 0 HE21 GLN B 66 -13.392 2.012 -59.201 1.00 0.00 H new ATOM 0 HE22 GLN B 66 -13.823 2.735 -57.648 1.00 0.00 H new ATOM 1211 N GLU B 67 -9.826 2.586 -62.729 1.00 0.00 N ATOM 1212 CA GLU B 67 -10.416 2.408 -64.051 1.00 0.00 C ATOM 1213 C GLU B 67 -11.386 1.235 -64.068 1.00 0.00 C ATOM 1214 O GLU B 67 -11.235 0.280 -63.306 1.00 0.00 O ATOM 1215 CB GLU B 67 -9.321 2.193 -65.098 1.00 0.00 C ATOM 1216 CG GLU B 67 -8.382 3.378 -65.279 1.00 0.00 C ATOM 1217 CD GLU B 67 -7.357 3.153 -66.356 1.00 0.00 C ATOM 1218 OE1 GLU B 67 -7.320 2.075 -66.898 1.00 0.00 O ATOM 1219 OE2 GLU B 67 -6.612 4.062 -66.638 1.00 0.00 O ATOM 0 H GLU B 67 -9.479 1.726 -62.304 1.00 0.00 H new ATOM 0 HA GLU B 67 -10.971 3.314 -64.293 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -8.733 1.319 -64.817 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -9.790 1.967 -66.056 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -8.967 4.265 -65.521 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -7.873 3.579 -64.336 1.00 0.00 H new ATOM 1226 N LYS B 68 -12.384 1.311 -64.942 1.00 0.00 N ATOM 1227 CA LYS B 68 -13.282 0.187 -65.180 1.00 0.00 C ATOM 1228 C LYS B 68 -12.671 -0.810 -66.155 1.00 0.00 C ATOM 1229 O LYS B 68 -12.335 -0.460 -67.287 1.00 0.00 O ATOM 1230 CB LYS B 68 -14.630 0.681 -65.708 1.00 0.00 C ATOM 1231 CG LYS B 68 -15.382 1.600 -64.754 1.00 0.00 C ATOM 1232 CD LYS B 68 -15.958 0.823 -63.579 1.00 0.00 C ATOM 1233 CE LYS B 68 -16.804 1.717 -62.685 1.00 0.00 C ATOM 1234 NZ LYS B 68 -17.415 0.960 -61.559 1.00 0.00 N ATOM 0 H LYS B 68 -12.591 2.141 -65.498 1.00 0.00 H new ATOM 0 HA LYS B 68 -13.439 -0.321 -64.228 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -14.467 1.208 -66.648 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -15.257 -0.182 -65.931 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -14.710 2.375 -64.386 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -16.187 2.104 -65.289 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -16.565 -0.003 -63.949 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -15.147 0.386 -62.997 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -16.186 2.522 -62.288 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -17.591 2.183 -63.278 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -17.689 1.621 -60.804 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -18.258 0.454 -61.898 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -16.726 0.275 -61.187 1.00 0.00 H new ATOM 1248 N GLN B 69 -12.528 -2.054 -65.710 1.00 0.00 N ATOM 1249 CA GLN B 69 -11.925 -3.097 -66.531 1.00 0.00 C ATOM 1250 C GLN B 69 -12.558 -4.453 -66.252 1.00 0.00 C ATOM 1251 O GLN B 69 -12.458 -4.980 -65.144 1.00 0.00 O ATOM 1252 CB GLN B 69 -10.414 -3.165 -66.286 1.00 0.00 C ATOM 1253 CG GLN B 69 -9.682 -4.146 -67.185 1.00 0.00 C ATOM 1254 CD GLN B 69 -9.636 -3.684 -68.629 1.00 0.00 C ATOM 1255 OE1 GLN B 69 -9.152 -2.590 -68.930 1.00 0.00 O ATOM 1256 NE2 GLN B 69 -10.139 -4.517 -69.532 1.00 0.00 N ATOM 0 H GLN B 69 -12.822 -2.364 -64.784 1.00 0.00 H new ATOM 0 HA GLN B 69 -12.106 -2.844 -67.576 1.00 0.00 H new ATOM 0 HB2 GLN B 69 -9.989 -2.172 -66.429 1.00 0.00 H new ATOM 0 HB3 GLN B 69 -10.238 -3.441 -65.246 1.00 0.00 H new ATOM 0 HG2 GLN B 69 -8.665 -4.282 -66.817 1.00 0.00 H new ATOM 0 HG3 GLN B 69 -10.173 -5.118 -67.133 1.00 0.00 H new ATOM 0 HE21 GLN B 69 -10.529 -5.412 -69.238 1.00 0.00 H new ATOM 0 HE22 GLN B 69 -10.135 -4.262 -70.520 1.00 0.00 H new ATOM 1265 N ASP B 70 -13.212 -5.015 -67.264 1.00 0.00 N ATOM 1266 CA ASP B 70 -13.706 -6.384 -67.191 1.00 0.00 C ATOM 1267 C ASP B 70 -14.766 -6.531 -66.108 1.00 0.00 C ATOM 1268 O ASP B 70 -14.879 -7.580 -65.473 1.00 0.00 O ATOM 1269 CB ASP B 70 -12.554 -7.356 -66.921 1.00 0.00 C ATOM 1270 CG ASP B 70 -11.507 -7.356 -68.027 1.00 0.00 C ATOM 1271 OD1 ASP B 70 -11.818 -6.926 -69.113 1.00 0.00 O ATOM 1272 OD2 ASP B 70 -10.407 -7.785 -67.776 1.00 0.00 O ATOM 0 H ASP B 70 -13.412 -4.542 -68.145 1.00 0.00 H new ATOM 0 HA ASP B 70 -14.160 -6.623 -68.153 1.00 0.00 H new ATOM 0 HB2 ASP B 70 -12.077 -7.093 -65.977 1.00 0.00 H new ATOM 0 HB3 ASP B 70 -12.954 -8.363 -66.807 1.00 0.00 H new ATOM 1277 N GLY B 71 -15.544 -5.473 -65.900 1.00 0.00 N ATOM 1278 CA GLY B 71 -16.696 -5.532 -65.009 1.00 0.00 C ATOM 1279 C GLY B 71 -16.291 -5.246 -63.568 1.00 0.00 C ATOM 1280 O GLY B 71 -17.131 -5.238 -62.667 1.00 0.00 O ATOM 0 H GLY B 71 -15.397 -4.563 -66.338 1.00 0.00 H new ATOM 0 HA2 GLY B 71 -17.445 -4.808 -65.330 1.00 0.00 H new ATOM 0 HA3 GLY B 71 -17.158 -6.517 -65.071 1.00 0.00 H new ATOM 1284 N MET B 72 -15.001 -5.014 -63.355 1.00 0.00 N ATOM 1285 CA MET B 72 -14.469 -4.812 -62.013 1.00 0.00 C ATOM 1286 C MET B 72 -13.774 -3.463 -61.892 1.00 0.00 C ATOM 1287 O MET B 72 -13.431 -2.837 -62.896 1.00 0.00 O ATOM 1288 CB MET B 72 -13.506 -5.942 -61.652 1.00 0.00 C ATOM 1289 CG MET B 72 -14.139 -7.326 -61.628 1.00 0.00 C ATOM 1290 SD MET B 72 -12.919 -8.647 -61.479 1.00 0.00 S ATOM 1291 CE MET B 72 -12.222 -8.651 -63.128 1.00 0.00 C ATOM 0 H MET B 72 -14.303 -4.961 -64.097 1.00 0.00 H new ATOM 0 HA MET B 72 -15.304 -4.821 -61.313 1.00 0.00 H new ATOM 0 HB2 MET B 72 -12.684 -5.945 -62.368 1.00 0.00 H new ATOM 0 HB3 MET B 72 -13.075 -5.736 -60.672 1.00 0.00 H new ATOM 0 HG2 MET B 72 -14.838 -7.387 -60.794 1.00 0.00 H new ATOM 0 HG3 MET B 72 -14.717 -7.472 -62.540 1.00 0.00 H new ATOM 0 HE1 MET B 72 -11.654 -9.569 -63.281 1.00 0.00 H new ATOM 0 HE2 MET B 72 -13.025 -8.595 -63.863 1.00 0.00 H new ATOM 0 HE3 MET B 72 -11.562 -7.792 -63.246 1.00 0.00 H new ATOM 1301 N ASP B 73 -13.568 -3.016 -60.657 1.00 0.00 N ATOM 1302 CA ASP B 73 -12.812 -1.797 -60.399 1.00 0.00 C ATOM 1303 C ASP B 73 -11.350 -2.107 -60.110 1.00 0.00 C ATOM 1304 O ASP B 73 -11.034 -2.843 -59.174 1.00 0.00 O ATOM 1305 CB ASP B 73 -13.420 -1.029 -59.223 1.00 0.00 C ATOM 1306 CG ASP B 73 -14.800 -0.465 -59.533 1.00 0.00 C ATOM 1307 OD1 ASP B 73 -15.135 -0.370 -60.690 1.00 0.00 O ATOM 1308 OD2 ASP B 73 -15.504 -0.132 -58.611 1.00 0.00 O ATOM 0 H ASP B 73 -13.915 -3.481 -59.818 1.00 0.00 H new ATOM 0 HA ASP B 73 -12.863 -1.179 -61.296 1.00 0.00 H new ATOM 0 HB2 ASP B 73 -13.489 -1.691 -58.360 1.00 0.00 H new ATOM 0 HB3 ASP B 73 -12.753 -0.212 -58.945 1.00 0.00 H new ATOM 1313 N VAL B 74 -10.459 -1.541 -60.918 1.00 0.00 N ATOM 1314 CA VAL B 74 -9.030 -1.795 -60.780 1.00 0.00 C ATOM 1315 C VAL B 74 -8.289 -0.542 -60.331 1.00 0.00 C ATOM 1316 O VAL B 74 -8.316 0.484 -61.011 1.00 0.00 O ATOM 1317 CB VAL B 74 -8.442 -2.283 -62.117 1.00 0.00 C ATOM 1318 CG1 VAL B 74 -6.944 -2.513 -61.988 1.00 0.00 C ATOM 1319 CG2 VAL B 74 -9.147 -3.557 -62.558 1.00 0.00 C ATOM 0 H VAL B 74 -10.702 -0.903 -61.676 1.00 0.00 H new ATOM 0 HA VAL B 74 -8.903 -2.567 -60.021 1.00 0.00 H new ATOM 0 HB VAL B 74 -8.602 -1.516 -62.875 1.00 0.00 H new ATOM 0 HG11 VAL B 74 -6.545 -2.858 -62.942 1.00 0.00 H new ATOM 0 HG12 VAL B 74 -6.456 -1.580 -61.706 1.00 0.00 H new ATOM 0 HG13 VAL B 74 -6.756 -3.266 -61.223 1.00 0.00 H new ATOM 0 HG21 VAL B 74 -8.726 -3.897 -63.504 1.00 0.00 H new ATOM 0 HG22 VAL B 74 -9.009 -4.330 -61.801 1.00 0.00 H new ATOM 0 HG23 VAL B 74 -10.211 -3.359 -62.685 1.00 0.00 H new ATOM 1329 N LEU B 75 -7.628 -0.631 -59.182 1.00 0.00 N ATOM 1330 CA LEU B 75 -6.748 0.435 -58.719 1.00 0.00 C ATOM 1331 C LEU B 75 -5.324 0.230 -59.219 1.00 0.00 C ATOM 1332 O LEU B 75 -4.786 -0.875 -59.153 1.00 0.00 O ATOM 1333 CB LEU B 75 -6.754 0.501 -57.187 1.00 0.00 C ATOM 1334 CG LEU B 75 -8.130 0.684 -56.534 1.00 0.00 C ATOM 1335 CD1 LEU B 75 -7.994 0.574 -55.021 1.00 0.00 C ATOM 1336 CD2 LEU B 75 -8.707 2.034 -56.935 1.00 0.00 C ATOM 0 H LEU B 75 -7.685 -1.432 -58.553 1.00 0.00 H new ATOM 0 HA LEU B 75 -7.122 1.376 -59.123 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -6.308 -0.415 -56.801 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -6.112 1.324 -56.875 1.00 0.00 H new ATOM 0 HG LEU B 75 -8.811 -0.096 -56.875 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -8.972 0.704 -54.557 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -7.597 -0.408 -54.762 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -7.315 1.347 -54.660 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -9.685 2.164 -56.471 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -8.039 2.828 -56.602 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -8.811 2.078 -58.019 1.00 0.00 H new ATOM 1348 N GLU B 76 -4.718 1.302 -59.720 1.00 0.00 N ATOM 1349 CA GLU B 76 -3.350 1.243 -60.221 1.00 0.00 C ATOM 1350 C GLU B 76 -2.441 2.191 -59.451 1.00 0.00 C ATOM 1351 O GLU B 76 -2.680 3.398 -59.407 1.00 0.00 O ATOM 1352 CB GLU B 76 -3.314 1.584 -61.712 1.00 0.00 C ATOM 1353 CG GLU B 76 -1.929 1.514 -62.340 1.00 0.00 C ATOM 1354 CD GLU B 76 -1.919 1.927 -63.785 1.00 0.00 C ATOM 1355 OE1 GLU B 76 -2.638 1.339 -64.556 1.00 0.00 O ATOM 1356 OE2 GLU B 76 -1.192 2.833 -64.119 1.00 0.00 O ATOM 0 H GLU B 76 -5.153 2.222 -59.790 1.00 0.00 H new ATOM 0 HA GLU B 76 -2.985 0.226 -60.077 1.00 0.00 H new ATOM 0 HB2 GLU B 76 -3.976 0.901 -62.244 1.00 0.00 H new ATOM 0 HB3 GLU B 76 -3.713 2.589 -61.852 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -1.249 2.156 -61.780 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -1.549 0.496 -62.256 1.00 0.00 H new ATOM 1363 N LEU B 77 -1.395 1.638 -58.844 1.00 0.00 N ATOM 1364 CA LEU B 77 -0.446 2.435 -58.076 1.00 0.00 C ATOM 1365 C LEU B 77 0.954 2.346 -58.670 1.00 0.00 C ATOM 1366 O LEU B 77 1.487 1.254 -58.867 1.00 0.00 O ATOM 1367 CB LEU B 77 -0.419 1.966 -56.616 1.00 0.00 C ATOM 1368 CG LEU B 77 0.756 2.478 -55.774 1.00 0.00 C ATOM 1369 CD1 LEU B 77 0.657 3.991 -55.630 1.00 0.00 C ATOM 1370 CD2 LEU B 77 0.742 1.797 -54.414 1.00 0.00 C ATOM 0 H LEU B 77 -1.184 0.640 -58.870 1.00 0.00 H new ATOM 0 HA LEU B 77 -0.772 3.474 -58.116 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -1.348 2.276 -56.137 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -0.403 0.876 -56.604 1.00 0.00 H new ATOM 0 HG LEU B 77 1.699 2.240 -56.267 1.00 0.00 H new ATOM 0 HD11 LEU B 77 1.492 4.355 -55.032 1.00 0.00 H new ATOM 0 HD12 LEU B 77 0.689 4.453 -56.617 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -0.281 4.249 -55.139 1.00 0.00 H new ATOM 0 HD21 LEU B 77 1.577 2.161 -53.816 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -0.195 2.022 -53.904 1.00 0.00 H new ATOM 0 HD23 LEU B 77 0.833 0.719 -54.546 1.00 0.00 H new ATOM 1382 N ASN B 78 1.545 3.502 -58.954 1.00 0.00 N ATOM 1383 CA ASN B 78 2.889 3.556 -59.518 1.00 0.00 C ATOM 1384 C ASN B 78 3.848 4.287 -58.586 1.00 0.00 C ATOM 1385 O ASN B 78 3.705 5.486 -58.347 1.00 0.00 O ATOM 1386 CB ASN B 78 2.867 4.216 -60.885 1.00 0.00 C ATOM 1387 CG ASN B 78 2.037 3.454 -61.881 1.00 0.00 C ATOM 1388 OD1 ASN B 78 2.396 2.342 -62.285 1.00 0.00 O ATOM 1389 ND2 ASN B 78 0.933 4.031 -62.284 1.00 0.00 N ATOM 0 H ASN B 78 1.114 4.414 -58.803 1.00 0.00 H new ATOM 0 HA ASN B 78 3.247 2.533 -59.632 1.00 0.00 H new ATOM 0 HB2 ASN B 78 2.475 5.228 -60.789 1.00 0.00 H new ATOM 0 HB3 ASN B 78 3.887 4.303 -61.259 1.00 0.00 H new ATOM 0 HD21 ASN B 78 0.329 3.562 -62.959 1.00 0.00 H new ATOM 0 HD22 ASN B 78 0.677 4.950 -61.923 1.00 0.00 H new ATOM 1396 N ILE B 79 4.826 3.555 -58.062 1.00 0.00 N ATOM 1397 CA ILE B 79 5.786 4.121 -57.122 1.00 0.00 C ATOM 1398 C ILE B 79 7.140 4.343 -57.783 1.00 0.00 C ATOM 1399 O ILE B 79 7.816 3.389 -58.169 1.00 0.00 O ATOM 1400 CB ILE B 79 5.956 3.208 -55.894 1.00 0.00 C ATOM 1401 CG1 ILE B 79 4.605 2.966 -55.217 1.00 0.00 C ATOM 1402 CG2 ILE B 79 6.946 3.816 -54.912 1.00 0.00 C ATOM 1403 CD1 ILE B 79 4.626 1.854 -54.193 1.00 0.00 C ATOM 0 H ILE B 79 4.974 2.568 -58.273 1.00 0.00 H new ATOM 0 HA ILE B 79 5.393 5.084 -56.798 1.00 0.00 H new ATOM 0 HB ILE B 79 6.350 2.248 -56.228 1.00 0.00 H new ATOM 0 HG12 ILE B 79 4.282 3.887 -54.732 1.00 0.00 H new ATOM 0 HG13 ILE B 79 3.864 2.730 -55.980 1.00 0.00 H new ATOM 0 HG21 ILE B 79 7.054 3.158 -54.050 1.00 0.00 H new ATOM 0 HG22 ILE B 79 7.913 3.938 -55.399 1.00 0.00 H new ATOM 0 HG23 ILE B 79 6.581 4.789 -54.582 1.00 0.00 H new ATOM 0 HD11 ILE B 79 3.633 1.742 -53.757 1.00 0.00 H new ATOM 0 HD12 ILE B 79 4.918 0.921 -54.675 1.00 0.00 H new ATOM 0 HD13 ILE B 79 5.342 2.096 -53.408 1.00 0.00 H new ATOM 1415 N THR B 80 7.531 5.606 -57.911 1.00 0.00 N ATOM 1416 CA THR B 80 8.812 5.955 -58.514 1.00 0.00 C ATOM 1417 C THR B 80 9.897 6.099 -57.455 1.00 0.00 C ATOM 1418 O THR B 80 9.832 6.983 -56.601 1.00 0.00 O ATOM 1419 CB THR B 80 8.706 7.258 -59.328 1.00 0.00 C ATOM 1420 OG1 THR B 80 7.749 7.089 -60.381 1.00 0.00 O ATOM 1421 CG2 THR B 80 10.055 7.624 -59.927 1.00 0.00 C ATOM 0 H THR B 80 6.978 6.407 -57.605 1.00 0.00 H new ATOM 0 HA THR B 80 9.084 5.142 -59.187 1.00 0.00 H new ATOM 0 HB THR B 80 8.387 8.060 -58.663 1.00 0.00 H new ATOM 0 HG1 THR B 80 7.681 7.919 -60.897 1.00 0.00 H new ATOM 0 HG21 THR B 80 9.961 8.547 -60.499 1.00 0.00 H new ATOM 0 HG22 THR B 80 10.782 7.765 -59.127 1.00 0.00 H new ATOM 0 HG23 THR B 80 10.390 6.822 -60.585 1.00 0.00 H new ATOM 1429 N LEU B 81 10.897 5.226 -57.516 1.00 0.00 N ATOM 1430 CA LEU B 81 12.006 5.264 -56.571 1.00 0.00 C ATOM 1431 C LEU B 81 13.329 5.507 -57.285 1.00 0.00 C ATOM 1432 O LEU B 81 13.988 6.474 -57.015 1.00 0.00 O ATOM 1433 CB LEU B 81 12.077 3.949 -55.784 1.00 0.00 C ATOM 1434 CG LEU B 81 10.822 3.586 -54.980 1.00 0.00 C ATOM 1435 CD1 LEU B 81 10.996 2.205 -54.362 1.00 0.00 C ATOM 1436 CD2 LEU B 81 10.583 4.639 -53.909 1.00 0.00 C ATOM 0 H LEU B 81 10.962 4.483 -58.211 1.00 0.00 H new ATOM 0 HA LEU B 81 11.830 6.090 -55.882 1.00 0.00 H new ATOM 0 HB2 LEU B 81 12.285 3.139 -56.483 1.00 0.00 H new ATOM 0 HB3 LEU B 81 12.922 4.003 -55.098 1.00 0.00 H new ATOM 0 HG LEU B 81 9.953 3.561 -55.637 1.00 0.00 H new ATOM 0 HD11 LEU B 81 10.104 1.947 -53.791 1.00 0.00 H new ATOM 0 HD12 LEU B 81 11.146 1.469 -55.152 1.00 0.00 H new ATOM 0 HD13 LEU B 81 11.862 2.209 -53.700 1.00 0.00 H new ATOM 0 HD21 LEU B 81 9.691 4.381 -53.338 1.00 0.00 H new ATOM 0 HD22 LEU B 81 11.443 4.680 -53.241 1.00 0.00 H new ATOM 0 HD23 LEU B 81 10.443 5.612 -54.380 1.00 0.00 H new TER 1448 LEU B 81