USER MOD reduce.3.24.130724 H: found=0, std=0, add=982, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 983 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 14 TYR OH : rot 30:sc= 0.761 USER MOD Set 1.2: A 115 GLN : amide:sc= -3.74 K(o=-0.84,f=-1.5!) USER MOD Set 1.3: A 117 TYR OH : rot 93:sc= 2.14 USER MOD Set 2.1: A 83 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 92 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00856) USER MOD Set 3.1: A 53 SER OG : rot -14:sc= 0.507 USER MOD Set 3.2: A 57 ASN :FLIP amide:sc= -1.77! C(o=-1.8!,f=-1.3!) USER MOD Set 4.1: A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 ALA N :NH3+ -176:sc= 0 (180deg=-0.0303) USER MOD Single : A 5 THR OG1 : rot -82:sc= -9.81! USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= -0.596 K(o=-0.6,f=-1.4!) USER MOD Single : A 13 ASN :FLIP amide:sc= 0.631 F(o=-1.4,f=0.63) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 MET CE :methyl 139:sc= -1.68 (180deg=-4.06!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl -147:sc= -4.61! (180deg=-9.07!) USER MOD Single : A 24 ASN : amide:sc= -0.496 X(o=-0.5,f=-0.87) USER MOD Single : A 27 LYS NZ :NH3+ 176:sc= -2.6 (180deg=-2.62) USER MOD Single : A 39 THR OG1 : rot 81:sc= -5.31 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= 0.00508 X(o=0.0051,f=-0.12) USER MOD Single : A 45 ASN : amide:sc= -0.837 X(o=-0.84,f=-0.66) USER MOD Single : A 46 LYS NZ :NH3+ 155:sc= -0.044 (180deg=-0.614) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= -0.558 USER MOD Single : A 54 ASN : amide:sc= -0.45 X(o=-0.45,f=-0.02) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot -12:sc= 0.729! USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot -52:sc= 0.731 USER MOD Single : A 81 THR OG1 : rot 60:sc= 0.656 USER MOD Single : A 84 MET CE :methyl 171:sc= 0 (180deg=-0.204) USER MOD Single : A 87 ASN : amide:sc= -0.48 K(o=-0.48,f=-1.6) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 ASN : amide:sc= -0.179 K(o=-0.18,f=-1.4) USER MOD Single : A 100 LYS NZ :NH3+ 152:sc= 1.22 (180deg=0.0388!) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 116 THR OG1 : rot -53:sc= -0.521 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 TYR OH : rot 6:sc= -1.24 USER MOD Single : A 125 LYS NZ :NH3+ -115:sc= 0.135 (180deg=-2.33!) USER MOD Single : A 129 LYS NZ :NH3+ 166:sc= -4.15! (180deg=-4.5!) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 3.675 8.376 2.789 1.00 0.00 N ATOM 2 CA ALA A 1 3.802 9.714 3.291 1.00 0.00 C ATOM 3 C ALA A 1 5.286 10.066 3.050 1.00 0.00 C ATOM 4 O ALA A 1 5.528 11.030 2.360 1.00 0.00 O ATOM 5 CB ALA A 1 3.536 9.509 4.776 1.00 0.00 C ATOM 0 H1 ALA A 1 2.681 8.076 2.849 1.00 0.00 H new ATOM 0 H2 ALA A 1 3.987 8.346 1.797 1.00 0.00 H new ATOM 0 H3 ALA A 1 4.265 7.735 3.357 1.00 0.00 H new ATOM 0 HA ALA A 1 3.162 10.484 2.860 1.00 0.00 H new ATOM 0 HB1 ALA A 1 3.602 10.466 5.293 1.00 0.00 H new ATOM 0 HB2 ALA A 1 2.539 9.091 4.913 1.00 0.00 H new ATOM 0 HB3 ALA A 1 4.277 8.823 5.187 1.00 0.00 H new ATOM 13 N PHE A 2 6.246 9.278 3.630 1.00 0.00 N ATOM 14 CA PHE A 2 7.653 9.654 3.389 1.00 0.00 C ATOM 15 C PHE A 2 8.141 9.563 1.919 1.00 0.00 C ATOM 16 O PHE A 2 9.270 10.004 1.690 1.00 0.00 O ATOM 17 CB PHE A 2 8.764 8.905 4.162 1.00 0.00 C ATOM 18 CG PHE A 2 8.335 8.155 5.384 1.00 0.00 C ATOM 19 CD1 PHE A 2 7.475 7.088 5.407 1.00 0.00 C ATOM 20 CD2 PHE A 2 8.860 8.560 6.621 1.00 0.00 C ATOM 21 CE1 PHE A 2 7.129 6.436 6.570 1.00 0.00 C ATOM 22 CE2 PHE A 2 8.563 7.956 7.814 1.00 0.00 C ATOM 23 CZ PHE A 2 7.680 6.878 7.772 1.00 0.00 C ATOM 0 H PHE A 2 6.085 8.456 4.212 1.00 0.00 H new ATOM 0 HA PHE A 2 7.551 10.676 3.754 1.00 0.00 H new ATOM 0 HB2 PHE A 2 9.240 8.202 3.479 1.00 0.00 H new ATOM 0 HB3 PHE A 2 9.524 9.629 4.455 1.00 0.00 H new ATOM 0 HD1 PHE A 2 7.051 6.744 4.475 1.00 0.00 H new ATOM 0 HD2 PHE A 2 9.540 9.399 6.633 1.00 0.00 H new ATOM 0 HE1 PHE A 2 6.445 5.600 6.551 1.00 0.00 H new ATOM 0 HE2 PHE A 2 8.993 8.299 8.744 1.00 0.00 H new ATOM 0 HZ PHE A 2 7.417 6.374 8.690 1.00 0.00 H new ATOM 33 N ASP A 3 7.375 9.039 0.978 1.00 0.00 N ATOM 34 CA ASP A 3 7.833 8.950 -0.431 1.00 0.00 C ATOM 35 C ASP A 3 8.413 10.235 -0.922 1.00 0.00 C ATOM 36 O ASP A 3 7.677 11.226 -0.964 1.00 0.00 O ATOM 37 CB ASP A 3 6.758 8.402 -1.383 1.00 0.00 C ATOM 38 CG ASP A 3 5.508 9.229 -1.369 1.00 0.00 C ATOM 39 OD1 ASP A 3 5.166 9.905 -0.399 1.00 0.00 O ATOM 40 OD2 ASP A 3 4.821 9.174 -2.467 1.00 0.00 O ATOM 0 H ASP A 3 6.440 8.667 1.144 1.00 0.00 H new ATOM 0 HA ASP A 3 8.639 8.216 -0.432 1.00 0.00 H new ATOM 0 HB2 ASP A 3 7.157 8.369 -2.397 1.00 0.00 H new ATOM 0 HB3 ASP A 3 6.516 7.377 -1.102 1.00 0.00 H new ATOM 45 N GLY A 4 9.694 10.228 -1.274 1.00 0.00 N ATOM 46 CA GLY A 4 10.338 11.430 -1.723 1.00 0.00 C ATOM 47 C GLY A 4 11.704 11.786 -1.095 1.00 0.00 C ATOM 48 O GLY A 4 12.455 10.893 -0.788 1.00 0.00 O ATOM 0 H GLY A 4 10.293 9.403 -1.253 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.473 11.356 -2.802 1.00 0.00 H new ATOM 0 HA3 GLY A 4 9.658 12.263 -1.543 1.00 0.00 H new ATOM 52 N THR A 5 11.827 13.091 -0.966 1.00 0.00 N ATOM 53 CA THR A 5 12.886 13.840 -0.390 1.00 0.00 C ATOM 54 C THR A 5 12.442 14.272 0.976 1.00 0.00 C ATOM 55 O THR A 5 11.254 14.232 1.216 1.00 0.00 O ATOM 56 CB THR A 5 13.295 15.094 -1.212 1.00 0.00 C ATOM 57 OG1 THR A 5 12.086 15.814 -1.103 1.00 0.00 O ATOM 58 CG2 THR A 5 13.638 14.675 -2.623 1.00 0.00 C ATOM 0 H THR A 5 11.091 13.709 -1.308 1.00 0.00 H new ATOM 0 HA THR A 5 13.767 13.199 -0.363 1.00 0.00 H new ATOM 0 HB THR A 5 14.171 15.657 -0.891 1.00 0.00 H new ATOM 0 HG1 THR A 5 11.449 15.487 -1.772 1.00 0.00 H new ATOM 0 HG21 THR A 5 13.926 15.552 -3.203 1.00 0.00 H new ATOM 0 HG22 THR A 5 14.466 13.967 -2.601 1.00 0.00 H new ATOM 0 HG23 THR A 5 12.770 14.204 -3.084 1.00 0.00 H new ATOM 66 N TRP A 6 13.465 14.614 1.696 1.00 0.00 N ATOM 67 CA TRP A 6 13.439 14.979 3.083 1.00 0.00 C ATOM 68 C TRP A 6 14.827 15.434 3.447 1.00 0.00 C ATOM 69 O TRP A 6 15.686 15.164 2.638 1.00 0.00 O ATOM 70 CB TRP A 6 13.362 13.546 3.707 1.00 0.00 C ATOM 71 CG TRP A 6 11.953 13.095 3.649 1.00 0.00 C ATOM 72 CD1 TRP A 6 11.545 11.849 3.341 1.00 0.00 C ATOM 73 CD2 TRP A 6 10.718 13.815 3.836 1.00 0.00 C ATOM 74 NE1 TRP A 6 10.192 11.750 3.317 1.00 0.00 N ATOM 75 CE2 TRP A 6 9.617 12.932 3.610 1.00 0.00 C ATOM 76 CE3 TRP A 6 10.348 15.123 4.159 1.00 0.00 C ATOM 77 CZ2 TRP A 6 8.294 13.274 3.678 1.00 0.00 C ATOM 78 CZ3 TRP A 6 9.006 15.466 4.229 1.00 0.00 C ATOM 79 CH2 TRP A 6 7.994 14.553 3.990 1.00 0.00 C ATOM 0 H TRP A 6 14.406 14.649 1.305 1.00 0.00 H new ATOM 0 HA TRP A 6 12.684 15.715 3.360 1.00 0.00 H new ATOM 0 HB2 TRP A 6 14.005 12.857 3.159 1.00 0.00 H new ATOM 0 HB3 TRP A 6 13.715 13.560 4.738 1.00 0.00 H new ATOM 0 HD1 TRP A 6 12.215 11.027 3.137 1.00 0.00 H new ATOM 0 HE1 TRP A 6 9.679 10.894 3.105 1.00 0.00 H new ATOM 0 HE3 TRP A 6 11.107 15.867 4.354 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 7.518 12.547 3.489 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 8.741 16.483 4.479 1.00 0.00 H new ATOM 0 HH2 TRP A 6 6.962 14.864 4.053 1.00 0.00 H new ATOM 90 N LYS A 7 15.016 16.030 4.592 1.00 0.00 N ATOM 91 CA LYS A 7 16.367 16.564 4.861 1.00 0.00 C ATOM 92 C LYS A 7 16.462 16.669 6.349 1.00 0.00 C ATOM 93 O LYS A 7 16.013 15.775 7.058 1.00 0.00 O ATOM 94 CB LYS A 7 16.389 17.915 4.110 1.00 0.00 C ATOM 95 CG LYS A 7 15.664 17.914 2.787 1.00 0.00 C ATOM 96 CD LYS A 7 15.775 19.042 1.785 1.00 0.00 C ATOM 97 CE LYS A 7 16.893 18.960 0.714 1.00 0.00 C ATOM 98 NZ LYS A 7 18.061 19.829 0.939 1.00 0.00 N ATOM 0 H LYS A 7 14.319 16.164 5.324 1.00 0.00 H new ATOM 0 HA LYS A 7 17.219 15.971 4.528 1.00 0.00 H new ATOM 0 HB2 LYS A 7 15.947 18.678 4.750 1.00 0.00 H new ATOM 0 HB3 LYS A 7 17.426 18.204 3.940 1.00 0.00 H new ATOM 0 HG2 LYS A 7 15.971 17.007 2.267 1.00 0.00 H new ATOM 0 HG3 LYS A 7 14.604 17.807 3.016 1.00 0.00 H new ATOM 0 HD2 LYS A 7 14.820 19.121 1.265 1.00 0.00 H new ATOM 0 HD3 LYS A 7 15.913 19.969 2.341 1.00 0.00 H new ATOM 0 HE2 LYS A 7 17.238 17.928 0.654 1.00 0.00 H new ATOM 0 HE3 LYS A 7 16.461 19.208 -0.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 18.746 19.697 0.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 17.755 20.823 0.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 18.508 19.582 1.845 1.00 0.00 H new ATOM 112 N VAL A 8 17.040 17.775 6.758 1.00 0.00 N ATOM 113 CA VAL A 8 17.124 18.100 8.147 1.00 0.00 C ATOM 114 C VAL A 8 17.217 19.632 8.247 1.00 0.00 C ATOM 115 O VAL A 8 18.231 20.185 8.591 1.00 0.00 O ATOM 116 CB VAL A 8 18.119 17.322 8.988 1.00 0.00 C ATOM 117 CG1 VAL A 8 18.321 18.024 10.339 1.00 0.00 C ATOM 118 CG2 VAL A 8 17.751 15.824 9.190 1.00 0.00 C ATOM 0 H VAL A 8 17.460 18.465 6.135 1.00 0.00 H new ATOM 0 HA VAL A 8 16.216 17.746 8.635 1.00 0.00 H new ATOM 0 HB VAL A 8 19.054 17.314 8.428 1.00 0.00 H new ATOM 0 HG11 VAL A 8 19.036 17.461 10.938 1.00 0.00 H new ATOM 0 HG12 VAL A 8 18.701 19.032 10.172 1.00 0.00 H new ATOM 0 HG13 VAL A 8 17.369 18.078 10.867 1.00 0.00 H new ATOM 0 HG21 VAL A 8 18.513 15.341 9.802 1.00 0.00 H new ATOM 0 HG22 VAL A 8 16.785 15.751 9.689 1.00 0.00 H new ATOM 0 HG23 VAL A 8 17.697 15.329 8.221 1.00 0.00 H new ATOM 128 N ASP A 9 16.080 20.231 7.878 1.00 0.00 N ATOM 129 CA ASP A 9 15.924 21.663 7.813 1.00 0.00 C ATOM 130 C ASP A 9 16.414 22.293 9.115 1.00 0.00 C ATOM 131 O ASP A 9 17.043 23.329 9.145 1.00 0.00 O ATOM 132 CB ASP A 9 14.400 21.910 7.814 1.00 0.00 C ATOM 133 CG ASP A 9 13.901 23.258 7.423 1.00 0.00 C ATOM 134 OD1 ASP A 9 14.852 24.149 7.248 1.00 0.00 O ATOM 135 OD2 ASP A 9 12.720 23.462 7.294 1.00 0.00 O ATOM 0 H ASP A 9 15.239 19.716 7.615 1.00 0.00 H new ATOM 0 HA ASP A 9 16.458 22.066 6.953 1.00 0.00 H new ATOM 0 HB2 ASP A 9 13.945 21.180 7.144 1.00 0.00 H new ATOM 0 HB3 ASP A 9 14.030 21.697 8.817 1.00 0.00 H new ATOM 140 N ARG A 10 16.045 21.582 10.171 1.00 0.00 N ATOM 141 CA ARG A 10 16.389 22.096 11.439 1.00 0.00 C ATOM 142 C ARG A 10 16.797 20.937 12.306 1.00 0.00 C ATOM 143 O ARG A 10 16.454 19.787 11.944 1.00 0.00 O ATOM 144 CB ARG A 10 15.130 22.811 11.953 1.00 0.00 C ATOM 145 CG ARG A 10 13.821 22.337 11.318 1.00 0.00 C ATOM 146 CD ARG A 10 13.242 23.306 10.268 1.00 0.00 C ATOM 147 NE ARG A 10 12.297 24.220 10.891 1.00 0.00 N ATOM 148 CZ ARG A 10 11.109 23.901 11.408 1.00 0.00 C ATOM 149 NH1 ARG A 10 10.705 22.637 11.371 1.00 0.00 N ATOM 150 NH2 ARG A 10 10.301 24.798 11.969 1.00 0.00 N ATOM 0 H ARG A 10 15.536 20.698 10.158 1.00 0.00 H new ATOM 0 HA ARG A 10 17.221 22.800 11.426 1.00 0.00 H new ATOM 0 HB2 ARG A 10 15.065 22.673 13.032 1.00 0.00 H new ATOM 0 HB3 ARG A 10 15.238 23.881 11.775 1.00 0.00 H new ATOM 0 HG2 ARG A 10 13.988 21.368 10.849 1.00 0.00 H new ATOM 0 HG3 ARG A 10 13.082 22.187 12.105 1.00 0.00 H new ATOM 0 HD2 ARG A 10 14.049 23.870 9.800 1.00 0.00 H new ATOM 0 HD3 ARG A 10 12.746 22.743 9.478 1.00 0.00 H new ATOM 0 HE ARG A 10 12.570 25.202 10.937 1.00 0.00 H new ATOM 0 HH11 ARG A 10 11.301 21.923 10.951 1.00 0.00 H new ATOM 0 HH12 ARG A 10 9.799 22.379 11.763 1.00 0.00 H new ATOM 0 HH21 ARG A 10 10.581 25.778 12.017 1.00 0.00 H new ATOM 0 HH22 ARG A 10 9.401 24.506 12.351 1.00 0.00 H new ATOM 164 N ASN A 11 17.485 21.185 13.384 1.00 0.00 N ATOM 165 CA ASN A 11 17.880 20.063 14.217 1.00 0.00 C ATOM 166 C ASN A 11 18.023 20.497 15.651 1.00 0.00 C ATOM 167 O ASN A 11 18.680 21.529 15.885 1.00 0.00 O ATOM 168 CB ASN A 11 19.248 19.577 13.737 1.00 0.00 C ATOM 169 CG ASN A 11 20.107 20.592 13.010 1.00 0.00 C ATOM 170 OD1 ASN A 11 20.045 21.765 13.360 1.00 0.00 O ATOM 171 ND2 ASN A 11 20.873 20.135 12.040 1.00 0.00 N ATOM 0 H ASN A 11 17.778 22.108 13.705 1.00 0.00 H new ATOM 0 HA ASN A 11 17.124 19.280 14.148 1.00 0.00 H new ATOM 0 HB2 ASN A 11 19.805 19.215 14.602 1.00 0.00 H new ATOM 0 HB3 ASN A 11 19.095 18.724 13.077 1.00 0.00 H new ATOM 0 HD21 ASN A 11 21.473 20.775 11.519 1.00 0.00 H new ATOM 0 HD22 ASN A 11 20.866 19.141 11.810 1.00 0.00 H new ATOM 178 N GLU A 12 17.419 19.713 16.515 1.00 0.00 N ATOM 179 CA GLU A 12 17.453 19.997 17.933 1.00 0.00 C ATOM 180 C GLU A 12 17.886 18.736 18.668 1.00 0.00 C ATOM 181 O GLU A 12 17.729 17.641 18.175 1.00 0.00 O ATOM 182 CB GLU A 12 16.126 20.515 18.585 1.00 0.00 C ATOM 183 CG GLU A 12 15.082 19.462 18.986 1.00 0.00 C ATOM 184 CD GLU A 12 14.247 19.807 20.230 1.00 0.00 C ATOM 185 OE1 GLU A 12 14.659 19.744 21.364 1.00 0.00 O ATOM 186 OE2 GLU A 12 13.042 20.174 19.980 1.00 0.00 O ATOM 0 H GLU A 12 16.898 18.874 16.261 1.00 0.00 H new ATOM 0 HA GLU A 12 18.154 20.826 18.030 1.00 0.00 H new ATOM 0 HB2 GLU A 12 16.388 21.087 19.475 1.00 0.00 H new ATOM 0 HB3 GLU A 12 15.656 21.208 17.888 1.00 0.00 H new ATOM 0 HG2 GLU A 12 14.405 19.307 18.146 1.00 0.00 H new ATOM 0 HG3 GLU A 12 15.593 18.516 19.163 1.00 0.00 H new ATOM 193 N ASN A 13 18.445 18.983 19.860 1.00 0.00 N ATOM 194 CA ASN A 13 18.924 17.887 20.682 1.00 0.00 C ATOM 195 C ASN A 13 20.007 17.083 19.942 1.00 0.00 C ATOM 196 O ASN A 13 20.322 16.012 20.423 1.00 0.00 O ATOM 197 CB ASN A 13 17.724 17.010 21.082 1.00 0.00 C ATOM 198 CG ASN A 13 16.802 17.578 22.155 1.00 0.00 C ATOM 199 OD1 ASN A 13 17.010 18.845 22.497 1.00 0.00 O flip ATOM 200 ND2 ASN A 13 15.952 16.830 22.614 1.00 0.00 N flip ATOM 0 H ASN A 13 18.571 19.912 20.261 1.00 0.00 H new ATOM 0 HA ASN A 13 19.391 18.275 21.588 1.00 0.00 H new ATOM 0 HB2 ASN A 13 17.130 16.814 20.189 1.00 0.00 H new ATOM 0 HB3 ASN A 13 18.103 16.049 21.430 1.00 0.00 H new ATOM 0 HD21 ASN A 13 15.881 15.870 22.276 1.00 0.00 H new ATOM 0 HD22 ASN A 13 15.313 17.165 23.335 1.00 0.00 H new ATOM 207 N TYR A 14 20.496 17.643 18.840 1.00 0.00 N ATOM 208 CA TYR A 14 21.524 17.037 18.003 1.00 0.00 C ATOM 209 C TYR A 14 22.969 17.295 18.382 1.00 0.00 C ATOM 210 O TYR A 14 23.883 16.598 17.970 1.00 0.00 O ATOM 211 CB TYR A 14 21.196 17.503 16.569 1.00 0.00 C ATOM 212 CG TYR A 14 21.462 16.534 15.494 1.00 0.00 C ATOM 213 CD1 TYR A 14 22.783 16.225 15.157 1.00 0.00 C ATOM 214 CD2 TYR A 14 20.374 15.948 14.836 1.00 0.00 C ATOM 215 CE1 TYR A 14 23.006 15.306 14.140 1.00 0.00 C ATOM 216 CE2 TYR A 14 20.632 15.029 13.820 1.00 0.00 C ATOM 217 CZ TYR A 14 21.952 14.705 13.469 1.00 0.00 C ATOM 218 OH TYR A 14 22.263 13.810 12.477 1.00 0.00 O ATOM 0 H TYR A 14 20.181 18.551 18.497 1.00 0.00 H new ATOM 0 HA TYR A 14 21.481 15.955 18.131 1.00 0.00 H new ATOM 0 HB2 TYR A 14 20.142 17.777 16.530 1.00 0.00 H new ATOM 0 HB3 TYR A 14 21.768 18.408 16.364 1.00 0.00 H new ATOM 0 HD1 TYR A 14 23.609 16.689 15.675 1.00 0.00 H new ATOM 0 HD2 TYR A 14 19.360 16.202 15.109 1.00 0.00 H new ATOM 0 HE1 TYR A 14 24.020 15.055 13.866 1.00 0.00 H new ATOM 0 HE2 TYR A 14 19.809 14.562 13.299 1.00 0.00 H new ATOM 0 HH TYR A 14 23.116 13.374 12.685 1.00 0.00 H new ATOM 228 N GLU A 15 23.257 18.319 19.188 1.00 0.00 N ATOM 229 CA GLU A 15 24.643 18.577 19.550 1.00 0.00 C ATOM 230 C GLU A 15 25.120 17.612 20.629 1.00 0.00 C ATOM 231 O GLU A 15 26.185 17.039 20.535 1.00 0.00 O ATOM 232 CB GLU A 15 24.800 20.028 20.050 1.00 0.00 C ATOM 233 CG GLU A 15 26.276 20.404 20.083 1.00 0.00 C ATOM 234 CD GLU A 15 26.541 21.746 20.718 1.00 0.00 C ATOM 235 OE1 GLU A 15 26.537 22.737 20.017 1.00 0.00 O ATOM 236 OE2 GLU A 15 26.746 21.688 21.991 1.00 0.00 O ATOM 0 H GLU A 15 22.573 18.961 19.588 1.00 0.00 H new ATOM 0 HA GLU A 15 25.254 18.429 18.660 1.00 0.00 H new ATOM 0 HB2 GLU A 15 24.256 20.709 19.395 1.00 0.00 H new ATOM 0 HB3 GLU A 15 24.367 20.129 21.045 1.00 0.00 H new ATOM 0 HG2 GLU A 15 26.826 19.638 20.629 1.00 0.00 H new ATOM 0 HG3 GLU A 15 26.664 20.410 19.064 1.00 0.00 H new ATOM 243 N LYS A 16 24.322 17.420 21.679 1.00 0.00 N ATOM 244 CA LYS A 16 24.648 16.530 22.774 1.00 0.00 C ATOM 245 C LYS A 16 24.350 15.093 22.356 1.00 0.00 C ATOM 246 O LYS A 16 24.874 14.118 22.853 1.00 0.00 O ATOM 247 CB LYS A 16 23.840 16.920 24.012 1.00 0.00 C ATOM 248 CG LYS A 16 24.444 16.505 25.344 1.00 0.00 C ATOM 249 CD LYS A 16 23.580 17.008 26.481 1.00 0.00 C ATOM 250 CE LYS A 16 22.826 16.003 27.338 1.00 0.00 C ATOM 251 NZ LYS A 16 21.984 16.670 28.345 1.00 0.00 N ATOM 0 H LYS A 16 23.422 17.888 21.787 1.00 0.00 H new ATOM 0 HA LYS A 16 25.707 16.610 23.020 1.00 0.00 H new ATOM 0 HB2 LYS A 16 23.709 18.002 24.013 1.00 0.00 H new ATOM 0 HB3 LYS A 16 22.847 16.479 23.930 1.00 0.00 H new ATOM 0 HG2 LYS A 16 24.528 15.419 25.392 1.00 0.00 H new ATOM 0 HG3 LYS A 16 25.453 16.907 25.437 1.00 0.00 H new ATOM 0 HD2 LYS A 16 24.218 17.592 27.144 1.00 0.00 H new ATOM 0 HD3 LYS A 16 22.847 17.694 26.058 1.00 0.00 H new ATOM 0 HE2 LYS A 16 22.203 15.376 26.700 1.00 0.00 H new ATOM 0 HE3 LYS A 16 23.537 15.344 27.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 21.485 15.953 28.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 22.582 17.249 28.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 21.289 17.280 27.868 1.00 0.00 H new ATOM 265 N PHE A 17 23.441 14.879 21.366 1.00 0.00 N ATOM 266 CA PHE A 17 23.019 13.579 20.831 1.00 0.00 C ATOM 267 C PHE A 17 24.148 12.724 20.257 1.00 0.00 C ATOM 268 O PHE A 17 24.270 11.505 20.521 1.00 0.00 O ATOM 269 CB PHE A 17 21.942 13.863 19.761 1.00 0.00 C ATOM 270 CG PHE A 17 21.966 12.836 18.671 1.00 0.00 C ATOM 271 CD1 PHE A 17 21.363 11.614 18.895 1.00 0.00 C ATOM 272 CD2 PHE A 17 22.574 13.081 17.457 1.00 0.00 C ATOM 273 CE1 PHE A 17 21.359 10.624 17.923 1.00 0.00 C ATOM 274 CE2 PHE A 17 22.573 12.112 16.483 1.00 0.00 C ATOM 275 CZ PHE A 17 21.969 10.886 16.716 1.00 0.00 C ATOM 0 H PHE A 17 22.966 15.655 20.905 1.00 0.00 H new ATOM 0 HA PHE A 17 22.633 12.981 21.656 1.00 0.00 H new ATOM 0 HB2 PHE A 17 20.958 13.876 20.229 1.00 0.00 H new ATOM 0 HB3 PHE A 17 22.104 14.852 19.334 1.00 0.00 H new ATOM 0 HD1 PHE A 17 20.885 11.425 19.845 1.00 0.00 H new ATOM 0 HD2 PHE A 17 23.050 14.033 17.273 1.00 0.00 H new ATOM 0 HE1 PHE A 17 20.888 9.670 18.108 1.00 0.00 H new ATOM 0 HE2 PHE A 17 23.045 12.306 15.531 1.00 0.00 H new ATOM 0 HZ PHE A 17 21.977 10.130 15.945 1.00 0.00 H new ATOM 285 N MET A 18 24.975 13.387 19.468 1.00 0.00 N ATOM 286 CA MET A 18 26.122 12.844 18.804 1.00 0.00 C ATOM 287 C MET A 18 27.258 12.673 19.815 1.00 0.00 C ATOM 288 O MET A 18 27.889 11.645 19.883 1.00 0.00 O ATOM 289 CB MET A 18 26.630 13.852 17.736 1.00 0.00 C ATOM 290 CG MET A 18 26.215 13.347 16.395 1.00 0.00 C ATOM 291 SD MET A 18 27.065 14.115 15.004 1.00 0.00 S ATOM 292 CE MET A 18 25.930 13.532 13.747 1.00 0.00 C ATOM 0 H MET A 18 24.846 14.379 19.269 1.00 0.00 H new ATOM 0 HA MET A 18 25.843 11.893 18.350 1.00 0.00 H new ATOM 0 HB2 MET A 18 26.212 14.842 17.917 1.00 0.00 H new ATOM 0 HB3 MET A 18 27.714 13.949 17.788 1.00 0.00 H new ATOM 0 HG2 MET A 18 26.386 12.271 16.358 1.00 0.00 H new ATOM 0 HG3 MET A 18 25.143 13.504 16.279 1.00 0.00 H new ATOM 0 HE1 MET A 18 25.746 14.328 13.026 1.00 0.00 H new ATOM 0 HE2 MET A 18 26.364 12.672 13.236 1.00 0.00 H new ATOM 0 HE3 MET A 18 24.989 13.240 14.214 1.00 0.00 H new ATOM 302 N GLU A 19 27.435 13.740 20.560 1.00 0.00 N ATOM 303 CA GLU A 19 28.455 13.869 21.578 1.00 0.00 C ATOM 304 C GLU A 19 28.589 12.679 22.522 1.00 0.00 C ATOM 305 O GLU A 19 29.648 12.131 22.786 1.00 0.00 O ATOM 306 CB GLU A 19 28.043 15.038 22.503 1.00 0.00 C ATOM 307 CG GLU A 19 29.240 15.890 22.939 1.00 0.00 C ATOM 308 CD GLU A 19 29.645 16.929 21.939 1.00 0.00 C ATOM 309 OE1 GLU A 19 28.926 17.162 20.985 1.00 0.00 O ATOM 310 OE2 GLU A 19 30.761 17.555 22.116 1.00 0.00 O ATOM 0 H GLU A 19 26.852 14.572 20.471 1.00 0.00 H new ATOM 0 HA GLU A 19 29.392 13.990 21.034 1.00 0.00 H new ATOM 0 HB2 GLU A 19 27.321 15.669 21.986 1.00 0.00 H new ATOM 0 HB3 GLU A 19 27.543 14.640 23.386 1.00 0.00 H new ATOM 0 HG2 GLU A 19 28.999 16.382 23.881 1.00 0.00 H new ATOM 0 HG3 GLU A 19 30.089 15.234 23.130 1.00 0.00 H new ATOM 317 N LYS A 20 27.419 12.306 23.059 1.00 0.00 N ATOM 318 CA LYS A 20 27.319 11.213 24.048 1.00 0.00 C ATOM 319 C LYS A 20 27.823 9.868 23.577 1.00 0.00 C ATOM 320 O LYS A 20 28.157 9.000 24.373 1.00 0.00 O ATOM 321 CB LYS A 20 25.911 11.203 24.661 1.00 0.00 C ATOM 322 CG LYS A 20 25.470 12.540 25.158 1.00 0.00 C ATOM 323 CD LYS A 20 25.694 12.633 26.644 1.00 0.00 C ATOM 324 CE LYS A 20 26.994 13.265 27.013 1.00 0.00 C ATOM 325 NZ LYS A 20 27.482 12.616 28.237 1.00 0.00 N ATOM 0 H LYS A 20 26.526 12.742 22.828 1.00 0.00 H new ATOM 0 HA LYS A 20 28.028 11.428 24.848 1.00 0.00 H new ATOM 0 HB2 LYS A 20 25.200 10.849 23.914 1.00 0.00 H new ATOM 0 HB3 LYS A 20 25.887 10.491 25.486 1.00 0.00 H new ATOM 0 HG2 LYS A 20 26.024 13.328 24.648 1.00 0.00 H new ATOM 0 HG3 LYS A 20 24.415 12.693 24.930 1.00 0.00 H new ATOM 0 HD2 LYS A 20 24.881 13.206 27.090 1.00 0.00 H new ATOM 0 HD3 LYS A 20 25.651 11.632 27.073 1.00 0.00 H new ATOM 0 HE2 LYS A 20 27.717 13.149 26.206 1.00 0.00 H new ATOM 0 HE3 LYS A 20 26.865 14.335 27.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 28.390 13.040 28.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 26.788 12.749 29.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 27.614 11.599 28.062 1.00 0.00 H new ATOM 339 N MET A 21 27.886 9.705 22.237 1.00 0.00 N ATOM 340 CA MET A 21 28.376 8.461 21.674 1.00 0.00 C ATOM 341 C MET A 21 29.925 8.490 21.567 1.00 0.00 C ATOM 342 O MET A 21 30.530 7.543 21.078 1.00 0.00 O ATOM 343 CB MET A 21 27.722 8.007 20.372 1.00 0.00 C ATOM 344 CG MET A 21 26.428 8.723 20.004 1.00 0.00 C ATOM 345 SD MET A 21 25.213 7.526 19.401 1.00 0.00 S ATOM 346 CE MET A 21 23.906 7.892 20.595 1.00 0.00 C ATOM 0 H MET A 21 27.608 10.409 21.553 1.00 0.00 H new ATOM 0 HA MET A 21 28.069 7.692 22.383 1.00 0.00 H new ATOM 0 HB2 MET A 21 28.436 8.144 19.560 1.00 0.00 H new ATOM 0 HB3 MET A 21 27.519 6.938 20.441 1.00 0.00 H new ATOM 0 HG2 MET A 21 26.033 9.249 20.873 1.00 0.00 H new ATOM 0 HG3 MET A 21 26.623 9.474 19.238 1.00 0.00 H new ATOM 0 HE1 MET A 21 23.350 6.981 20.817 1.00 0.00 H new ATOM 0 HE2 MET A 21 24.349 8.279 21.512 1.00 0.00 H new ATOM 0 HE3 MET A 21 23.229 8.637 20.177 1.00 0.00 H new ATOM 356 N GLY A 22 30.456 9.615 22.049 1.00 0.00 N ATOM 357 CA GLY A 22 31.893 9.899 22.069 1.00 0.00 C ATOM 358 C GLY A 22 32.295 10.770 20.863 1.00 0.00 C ATOM 359 O GLY A 22 33.440 10.776 20.410 1.00 0.00 O ATOM 0 H GLY A 22 29.891 10.367 22.443 1.00 0.00 H new ATOM 0 HA2 GLY A 22 32.155 10.410 22.996 1.00 0.00 H new ATOM 0 HA3 GLY A 22 32.453 8.964 22.051 1.00 0.00 H new ATOM 363 N ILE A 23 31.317 11.508 20.354 1.00 0.00 N ATOM 364 CA ILE A 23 31.574 12.377 19.204 1.00 0.00 C ATOM 365 C ILE A 23 32.542 13.469 19.579 1.00 0.00 C ATOM 366 O ILE A 23 33.283 13.922 18.722 1.00 0.00 O ATOM 367 CB ILE A 23 30.261 12.868 18.625 1.00 0.00 C ATOM 368 CG1 ILE A 23 29.665 11.814 17.743 1.00 0.00 C ATOM 369 CG2 ILE A 23 30.479 14.175 17.834 1.00 0.00 C ATOM 370 CD1 ILE A 23 29.928 10.394 18.233 1.00 0.00 C ATOM 0 H ILE A 23 30.360 11.527 20.706 1.00 0.00 H new ATOM 0 HA ILE A 23 32.062 11.820 18.405 1.00 0.00 H new ATOM 0 HB ILE A 23 29.569 13.073 19.442 1.00 0.00 H new ATOM 0 HG12 ILE A 23 28.589 11.973 17.675 1.00 0.00 H new ATOM 0 HG13 ILE A 23 30.068 11.923 16.736 1.00 0.00 H new ATOM 0 HG21 ILE A 23 29.528 14.515 17.424 1.00 0.00 H new ATOM 0 HG22 ILE A 23 30.882 14.939 18.498 1.00 0.00 H new ATOM 0 HG23 ILE A 23 31.181 13.995 17.020 1.00 0.00 H new ATOM 0 HD11 ILE A 23 29.469 9.682 17.548 1.00 0.00 H new ATOM 0 HD12 ILE A 23 31.003 10.216 18.274 1.00 0.00 H new ATOM 0 HD13 ILE A 23 29.501 10.267 19.228 1.00 0.00 H new ATOM 382 N ASN A 24 32.515 13.871 20.856 1.00 0.00 N ATOM 383 CA ASN A 24 33.388 14.905 21.345 1.00 0.00 C ATOM 384 C ASN A 24 33.493 16.090 20.441 1.00 0.00 C ATOM 385 O ASN A 24 32.537 16.407 19.753 1.00 0.00 O ATOM 386 CB ASN A 24 34.744 14.318 21.833 1.00 0.00 C ATOM 387 CG ASN A 24 35.312 15.087 22.992 1.00 0.00 C ATOM 388 OD1 ASN A 24 34.650 15.474 23.972 1.00 0.00 O ATOM 389 ND2 ASN A 24 36.600 15.349 22.916 1.00 0.00 N ATOM 0 H ASN A 24 31.888 13.483 21.561 1.00 0.00 H new ATOM 0 HA ASN A 24 32.918 15.330 22.232 1.00 0.00 H new ATOM 0 HB2 ASN A 24 34.603 13.277 22.124 1.00 0.00 H new ATOM 0 HB3 ASN A 24 35.458 14.325 21.010 1.00 0.00 H new ATOM 0 HD21 ASN A 24 37.059 15.871 23.662 1.00 0.00 H new ATOM 0 HD22 ASN A 24 37.139 15.030 22.111 1.00 0.00 H new ATOM 396 N VAL A 25 34.622 16.758 20.409 1.00 0.00 N ATOM 397 CA VAL A 25 34.880 17.929 19.573 1.00 0.00 C ATOM 398 C VAL A 25 34.947 17.766 18.070 1.00 0.00 C ATOM 399 O VAL A 25 34.801 18.765 17.356 1.00 0.00 O ATOM 400 CB VAL A 25 35.898 18.924 20.126 1.00 0.00 C ATOM 401 CG1 VAL A 25 35.455 19.376 21.518 1.00 0.00 C ATOM 402 CG2 VAL A 25 37.287 18.340 20.239 1.00 0.00 C ATOM 0 H VAL A 25 35.424 16.498 20.984 1.00 0.00 H new ATOM 0 HA VAL A 25 33.903 18.399 19.681 1.00 0.00 H new ATOM 0 HB VAL A 25 35.940 19.758 19.426 1.00 0.00 H new ATOM 0 HG11 VAL A 25 36.179 20.087 21.917 1.00 0.00 H new ATOM 0 HG12 VAL A 25 34.477 19.853 21.452 1.00 0.00 H new ATOM 0 HG13 VAL A 25 35.393 18.511 22.179 1.00 0.00 H new ATOM 0 HG21 VAL A 25 37.967 19.093 20.638 1.00 0.00 H new ATOM 0 HG22 VAL A 25 37.267 17.479 20.908 1.00 0.00 H new ATOM 0 HG23 VAL A 25 37.631 18.026 19.254 1.00 0.00 H new ATOM 412 N VAL A 26 35.172 16.589 17.510 1.00 0.00 N ATOM 413 CA VAL A 26 35.270 16.283 16.115 1.00 0.00 C ATOM 414 C VAL A 26 34.173 16.860 15.263 1.00 0.00 C ATOM 415 O VAL A 26 34.310 17.206 14.090 1.00 0.00 O ATOM 416 CB VAL A 26 35.514 14.782 15.877 1.00 0.00 C ATOM 417 CG1 VAL A 26 35.081 14.378 14.485 1.00 0.00 C ATOM 418 CG2 VAL A 26 36.983 14.547 16.058 1.00 0.00 C ATOM 0 H VAL A 26 35.301 15.756 18.084 1.00 0.00 H new ATOM 0 HA VAL A 26 36.158 16.808 15.763 1.00 0.00 H new ATOM 0 HB VAL A 26 34.932 14.183 16.578 1.00 0.00 H new ATOM 0 HG11 VAL A 26 35.264 13.313 14.342 1.00 0.00 H new ATOM 0 HG12 VAL A 26 34.018 14.584 14.361 1.00 0.00 H new ATOM 0 HG13 VAL A 26 35.649 14.946 13.748 1.00 0.00 H new ATOM 0 HG21 VAL A 26 37.205 13.492 15.898 1.00 0.00 H new ATOM 0 HG22 VAL A 26 37.539 15.148 15.338 1.00 0.00 H new ATOM 0 HG23 VAL A 26 37.275 14.830 17.069 1.00 0.00 H new ATOM 428 N LYS A 27 33.008 16.965 15.924 1.00 0.00 N ATOM 429 CA LYS A 27 31.823 17.517 15.317 1.00 0.00 C ATOM 430 C LYS A 27 31.931 19.058 15.353 1.00 0.00 C ATOM 431 O LYS A 27 31.364 19.768 14.489 1.00 0.00 O ATOM 432 CB LYS A 27 30.521 16.947 15.878 1.00 0.00 C ATOM 433 CG LYS A 27 29.900 17.826 16.959 1.00 0.00 C ATOM 434 CD LYS A 27 30.655 17.948 18.296 1.00 0.00 C ATOM 435 CE LYS A 27 30.267 19.164 19.125 1.00 0.00 C ATOM 436 NZ LYS A 27 28.797 19.368 19.230 1.00 0.00 N ATOM 0 H LYS A 27 32.879 16.666 16.891 1.00 0.00 H new ATOM 0 HA LYS A 27 31.772 17.207 14.273 1.00 0.00 H new ATOM 0 HB2 LYS A 27 29.806 16.822 15.065 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.713 15.956 16.290 1.00 0.00 H new ATOM 0 HG2 LYS A 27 29.778 18.828 16.549 1.00 0.00 H new ATOM 0 HG3 LYS A 27 28.901 17.444 17.170 1.00 0.00 H new ATOM 0 HD2 LYS A 27 30.475 17.049 18.885 1.00 0.00 H new ATOM 0 HD3 LYS A 27 31.725 17.987 18.093 1.00 0.00 H new ATOM 0 HE2 LYS A 27 30.683 19.058 20.127 1.00 0.00 H new ATOM 0 HE3 LYS A 27 30.718 20.053 18.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 28.602 20.171 19.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 28.406 19.567 18.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 28.354 18.509 19.615 1.00 0.00 H new ATOM 595 N LYS A 37 19.645 15.805 2.719 1.00 0.00 N ATOM 596 CA LYS A 37 18.574 15.009 2.204 1.00 0.00 C ATOM 597 C LYS A 37 18.638 13.561 2.695 1.00 0.00 C ATOM 598 O LYS A 37 19.228 12.738 2.013 1.00 0.00 O ATOM 599 CB LYS A 37 18.442 15.018 0.704 1.00 0.00 C ATOM 600 CG LYS A 37 17.008 15.204 0.209 1.00 0.00 C ATOM 601 CD LYS A 37 16.972 14.866 -1.253 1.00 0.00 C ATOM 602 CE LYS A 37 17.991 15.623 -2.092 1.00 0.00 C ATOM 603 NZ LYS A 37 17.993 15.290 -3.525 1.00 0.00 N ATOM 0 HA LYS A 37 17.684 15.495 2.603 1.00 0.00 H new ATOM 0 HB2 LYS A 37 19.062 15.818 0.299 1.00 0.00 H new ATOM 0 HB3 LYS A 37 18.833 14.080 0.309 1.00 0.00 H new ATOM 0 HG2 LYS A 37 16.327 14.560 0.765 1.00 0.00 H new ATOM 0 HG3 LYS A 37 16.680 16.231 0.371 1.00 0.00 H new ATOM 0 HD2 LYS A 37 17.143 13.796 -1.372 1.00 0.00 H new ATOM 0 HD3 LYS A 37 15.974 15.074 -1.638 1.00 0.00 H new ATOM 0 HE2 LYS A 37 17.805 16.692 -1.984 1.00 0.00 H new ATOM 0 HE3 LYS A 37 18.985 15.430 -1.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 18.718 15.855 -4.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 18.203 14.279 -3.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 17.059 15.501 -3.932 1.00 0.00 H new ATOM 617 N LEU A 38 18.012 13.383 3.847 1.00 0.00 N ATOM 618 CA LEU A 38 17.910 12.019 4.352 1.00 0.00 C ATOM 619 C LEU A 38 17.256 11.351 3.145 1.00 0.00 C ATOM 620 O LEU A 38 17.783 10.302 2.797 1.00 0.00 O ATOM 621 CB LEU A 38 16.817 11.833 5.395 1.00 0.00 C ATOM 622 CG LEU A 38 16.652 10.495 6.129 1.00 0.00 C ATOM 623 CD1 LEU A 38 16.307 9.384 5.170 1.00 0.00 C ATOM 624 CD2 LEU A 38 18.008 10.168 6.741 1.00 0.00 C ATOM 0 H LEU A 38 17.590 14.113 4.421 1.00 0.00 H new ATOM 0 HA LEU A 38 18.867 11.685 4.754 1.00 0.00 H new ATOM 0 HB2 LEU A 38 16.966 12.599 6.156 1.00 0.00 H new ATOM 0 HB3 LEU A 38 15.867 12.050 4.906 1.00 0.00 H new ATOM 0 HG LEU A 38 15.855 10.578 6.868 1.00 0.00 H new ATOM 0 HD11 LEU A 38 16.197 8.450 5.720 1.00 0.00 H new ATOM 0 HD12 LEU A 38 15.371 9.619 4.663 1.00 0.00 H new ATOM 0 HD13 LEU A 38 17.103 9.279 4.433 1.00 0.00 H new ATOM 0 HD21 LEU A 38 17.946 9.221 7.277 1.00 0.00 H new ATOM 0 HD22 LEU A 38 18.754 10.089 5.951 1.00 0.00 H new ATOM 0 HD23 LEU A 38 18.295 10.959 7.433 1.00 0.00 H new ATOM 636 N THR A 39 16.264 12.046 2.677 1.00 0.00 N ATOM 637 CA THR A 39 15.402 11.736 1.512 1.00 0.00 C ATOM 638 C THR A 39 14.754 10.407 1.748 1.00 0.00 C ATOM 639 O THR A 39 15.455 9.531 2.225 1.00 0.00 O ATOM 640 CB THR A 39 16.269 11.642 0.218 1.00 0.00 C ATOM 641 OG1 THR A 39 17.394 12.432 0.459 1.00 0.00 O ATOM 642 CG2 THR A 39 15.526 12.029 -1.062 1.00 0.00 C ATOM 0 H THR A 39 15.991 12.924 3.118 1.00 0.00 H new ATOM 0 HA THR A 39 14.654 12.520 1.391 1.00 0.00 H new ATOM 0 HB THR A 39 16.546 10.606 0.023 1.00 0.00 H new ATOM 0 HG1 THR A 39 18.044 11.923 0.987 1.00 0.00 H new ATOM 0 HG21 THR A 39 16.198 11.937 -1.915 1.00 0.00 H new ATOM 0 HG22 THR A 39 14.671 11.367 -1.201 1.00 0.00 H new ATOM 0 HG23 THR A 39 15.178 13.059 -0.984 1.00 0.00 H new ATOM 650 N ILE A 40 13.493 10.150 1.444 1.00 0.00 N ATOM 651 CA ILE A 40 12.972 8.799 1.692 1.00 0.00 C ATOM 652 C ILE A 40 12.059 8.245 0.631 1.00 0.00 C ATOM 653 O ILE A 40 11.113 8.832 0.165 1.00 0.00 O ATOM 654 CB ILE A 40 12.298 8.699 3.065 1.00 0.00 C ATOM 655 CG1 ILE A 40 13.235 9.144 4.195 1.00 0.00 C ATOM 656 CG2 ILE A 40 11.812 7.259 3.325 1.00 0.00 C ATOM 657 CD1 ILE A 40 12.620 9.284 5.607 1.00 0.00 C ATOM 0 H ILE A 40 12.832 10.816 1.044 1.00 0.00 H new ATOM 0 HA ILE A 40 13.863 8.172 1.663 1.00 0.00 H new ATOM 0 HB ILE A 40 11.441 9.373 3.054 1.00 0.00 H new ATOM 0 HG12 ILE A 40 14.057 8.430 4.253 1.00 0.00 H new ATOM 0 HG13 ILE A 40 13.667 10.106 3.917 1.00 0.00 H new ATOM 0 HG21 ILE A 40 11.336 7.207 4.304 1.00 0.00 H new ATOM 0 HG22 ILE A 40 11.094 6.973 2.557 1.00 0.00 H new ATOM 0 HG23 ILE A 40 12.662 6.578 3.298 1.00 0.00 H new ATOM 0 HD11 ILE A 40 13.390 9.604 6.309 1.00 0.00 H new ATOM 0 HD12 ILE A 40 11.820 10.024 5.584 1.00 0.00 H new ATOM 0 HD13 ILE A 40 12.216 8.323 5.925 1.00 0.00 H new ATOM 669 N THR A 41 12.338 7.007 0.207 1.00 0.00 N ATOM 670 CA THR A 41 11.552 6.325 -0.804 1.00 0.00 C ATOM 671 C THR A 41 11.374 4.877 -0.394 1.00 0.00 C ATOM 672 O THR A 41 12.282 4.060 -0.488 1.00 0.00 O ATOM 673 CB THR A 41 12.144 6.414 -2.206 1.00 0.00 C ATOM 674 OG1 THR A 41 12.679 7.673 -2.463 1.00 0.00 O ATOM 675 CG2 THR A 41 11.056 6.129 -3.223 1.00 0.00 C ATOM 0 H THR A 41 13.120 6.456 0.562 1.00 0.00 H new ATOM 0 HA THR A 41 10.588 6.831 -0.861 1.00 0.00 H new ATOM 0 HB THR A 41 12.948 5.681 -2.278 1.00 0.00 H new ATOM 0 HG1 THR A 41 13.050 7.692 -3.370 1.00 0.00 H new ATOM 0 HG21 THR A 41 11.472 6.191 -4.228 1.00 0.00 H new ATOM 0 HG22 THR A 41 10.656 5.129 -3.057 1.00 0.00 H new ATOM 0 HG23 THR A 41 10.257 6.862 -3.116 1.00 0.00 H new ATOM 683 N GLN A 42 10.179 4.589 0.063 1.00 0.00 N ATOM 684 CA GLN A 42 9.835 3.250 0.502 1.00 0.00 C ATOM 685 C GLN A 42 9.933 2.315 -0.657 1.00 0.00 C ATOM 686 O GLN A 42 9.860 2.780 -1.792 1.00 0.00 O ATOM 687 CB GLN A 42 8.366 3.310 0.955 1.00 0.00 C ATOM 688 CG GLN A 42 8.086 3.159 2.451 1.00 0.00 C ATOM 689 CD GLN A 42 6.632 3.464 2.787 1.00 0.00 C ATOM 690 OE1 GLN A 42 5.680 3.298 1.998 1.00 0.00 O ATOM 691 NE2 GLN A 42 6.477 3.927 4.017 1.00 0.00 N ATOM 0 H GLN A 42 9.421 5.267 0.142 1.00 0.00 H new ATOM 0 HA GLN A 42 10.497 2.909 1.298 1.00 0.00 H new ATOM 0 HB2 GLN A 42 7.951 4.264 0.629 1.00 0.00 H new ATOM 0 HB3 GLN A 42 7.819 2.528 0.429 1.00 0.00 H new ATOM 0 HG2 GLN A 42 8.327 2.143 2.765 1.00 0.00 H new ATOM 0 HG3 GLN A 42 8.737 3.829 3.012 1.00 0.00 H new ATOM 0 HE21 GLN A 42 7.288 4.045 4.624 1.00 0.00 H new ATOM 0 HE22 GLN A 42 5.546 4.166 4.358 1.00 0.00 H new ATOM 700 N GLU A 43 10.092 1.057 -0.402 1.00 0.00 N ATOM 701 CA GLU A 43 10.204 0.078 -1.481 1.00 0.00 C ATOM 702 C GLU A 43 9.550 -1.178 -0.976 1.00 0.00 C ATOM 703 O GLU A 43 10.060 -2.274 -1.212 1.00 0.00 O ATOM 704 CB GLU A 43 11.696 -0.079 -1.780 1.00 0.00 C ATOM 705 CG GLU A 43 12.156 0.492 -3.123 1.00 0.00 C ATOM 706 CD GLU A 43 12.374 -0.753 -3.926 1.00 0.00 C ATOM 707 OE1 GLU A 43 11.377 -1.577 -3.940 1.00 0.00 O ATOM 708 OE2 GLU A 43 13.399 -0.993 -4.527 1.00 0.00 O ATOM 0 H GLU A 43 10.150 0.664 0.538 1.00 0.00 H new ATOM 0 HA GLU A 43 9.713 0.362 -2.412 1.00 0.00 H new ATOM 0 HB2 GLU A 43 12.262 0.405 -0.985 1.00 0.00 H new ATOM 0 HB3 GLU A 43 11.947 -1.139 -1.749 1.00 0.00 H new ATOM 0 HG2 GLU A 43 11.403 1.141 -3.571 1.00 0.00 H new ATOM 0 HG3 GLU A 43 13.068 1.081 -3.026 1.00 0.00 H new ATOM 715 N GLY A 44 8.430 -1.017 -0.286 1.00 0.00 N ATOM 716 CA GLY A 44 7.693 -2.122 0.260 1.00 0.00 C ATOM 717 C GLY A 44 8.672 -2.942 1.103 1.00 0.00 C ATOM 718 O GLY A 44 9.114 -4.001 0.667 1.00 0.00 O ATOM 0 H GLY A 44 8.014 -0.106 -0.094 1.00 0.00 H new ATOM 0 HA2 GLY A 44 6.862 -1.767 0.870 1.00 0.00 H new ATOM 0 HA3 GLY A 44 7.266 -2.731 -0.536 1.00 0.00 H new ATOM 722 N ASN A 45 8.941 -2.366 2.278 1.00 0.00 N ATOM 723 CA ASN A 45 9.818 -2.866 3.303 1.00 0.00 C ATOM 724 C ASN A 45 11.154 -2.086 3.195 1.00 0.00 C ATOM 725 O ASN A 45 11.360 -1.214 4.036 1.00 0.00 O ATOM 726 CB ASN A 45 10.044 -4.389 3.283 1.00 0.00 C ATOM 727 CG ASN A 45 8.743 -5.174 3.326 1.00 0.00 C ATOM 728 OD1 ASN A 45 7.842 -4.928 4.167 1.00 0.00 O ATOM 729 ND2 ASN A 45 8.627 -6.123 2.428 1.00 0.00 N ATOM 0 H ASN A 45 8.515 -1.478 2.542 1.00 0.00 H new ATOM 0 HA ASN A 45 9.335 -2.698 4.266 1.00 0.00 H new ATOM 0 HB2 ASN A 45 10.597 -4.659 2.383 1.00 0.00 H new ATOM 0 HB3 ASN A 45 10.663 -4.672 4.134 1.00 0.00 H new ATOM 0 HD21 ASN A 45 7.782 -6.693 2.395 1.00 0.00 H new ATOM 0 HD22 ASN A 45 9.382 -6.291 1.763 1.00 0.00 H new ATOM 736 N LYS A 46 12.006 -2.368 2.236 1.00 0.00 N ATOM 737 CA LYS A 46 13.227 -1.571 2.212 1.00 0.00 C ATOM 738 C LYS A 46 12.779 -0.136 1.970 1.00 0.00 C ATOM 739 O LYS A 46 11.646 0.176 1.603 1.00 0.00 O ATOM 740 CB LYS A 46 14.119 -1.833 0.982 1.00 0.00 C ATOM 741 CG LYS A 46 14.631 -0.645 0.206 1.00 0.00 C ATOM 742 CD LYS A 46 15.300 -1.108 -1.108 1.00 0.00 C ATOM 743 CE LYS A 46 15.902 -2.478 -0.937 1.00 0.00 C ATOM 744 NZ LYS A 46 16.848 -2.883 -1.983 1.00 0.00 N ATOM 0 H LYS A 46 11.901 -3.081 1.514 1.00 0.00 H new ATOM 0 HA LYS A 46 13.768 -1.792 3.132 1.00 0.00 H new ATOM 0 HB2 LYS A 46 14.982 -2.411 1.314 1.00 0.00 H new ATOM 0 HB3 LYS A 46 13.558 -2.464 0.293 1.00 0.00 H new ATOM 0 HG2 LYS A 46 13.808 0.034 -0.017 1.00 0.00 H new ATOM 0 HG3 LYS A 46 15.348 -0.089 0.810 1.00 0.00 H new ATOM 0 HD2 LYS A 46 14.564 -1.125 -1.912 1.00 0.00 H new ATOM 0 HD3 LYS A 46 16.074 -0.398 -1.399 1.00 0.00 H new ATOM 0 HE2 LYS A 46 16.412 -2.515 0.025 1.00 0.00 H new ATOM 0 HE3 LYS A 46 15.095 -3.209 -0.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 17.505 -3.593 -1.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 16.326 -3.291 -2.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 17.385 -2.053 -2.306 1.00 0.00 H new ATOM 758 N PHE A 47 13.782 0.729 2.159 1.00 0.00 N ATOM 759 CA PHE A 47 13.518 2.111 1.855 1.00 0.00 C ATOM 760 C PHE A 47 14.795 2.879 1.456 1.00 0.00 C ATOM 761 O PHE A 47 15.495 3.440 2.259 1.00 0.00 O ATOM 762 CB PHE A 47 12.741 2.961 2.906 1.00 0.00 C ATOM 763 CG PHE A 47 13.142 2.822 4.333 1.00 0.00 C ATOM 764 CD1 PHE A 47 12.834 1.622 5.011 1.00 0.00 C ATOM 765 CD2 PHE A 47 13.794 3.799 5.042 1.00 0.00 C ATOM 766 CE1 PHE A 47 13.195 1.478 6.347 1.00 0.00 C ATOM 767 CE2 PHE A 47 14.155 3.662 6.363 1.00 0.00 C ATOM 768 CZ PHE A 47 13.865 2.500 7.050 1.00 0.00 C ATOM 0 H PHE A 47 14.718 0.506 2.498 1.00 0.00 H new ATOM 0 HA PHE A 47 12.831 2.000 1.016 1.00 0.00 H new ATOM 0 HB2 PHE A 47 12.840 4.011 2.629 1.00 0.00 H new ATOM 0 HB3 PHE A 47 11.683 2.709 2.827 1.00 0.00 H new ATOM 0 HD1 PHE A 47 12.322 0.822 4.496 1.00 0.00 H new ATOM 0 HD2 PHE A 47 14.036 4.723 4.538 1.00 0.00 H new ATOM 0 HE1 PHE A 47 12.955 0.558 6.860 1.00 0.00 H new ATOM 0 HE2 PHE A 47 14.668 4.469 6.865 1.00 0.00 H new ATOM 0 HZ PHE A 47 14.141 2.379 8.087 1.00 0.00 H new ATOM 778 N THR A 48 14.989 2.817 0.145 1.00 0.00 N ATOM 779 CA THR A 48 16.069 3.403 -0.561 1.00 0.00 C ATOM 780 C THR A 48 16.011 4.829 -0.209 1.00 0.00 C ATOM 781 O THR A 48 15.355 5.635 -0.906 1.00 0.00 O ATOM 782 CB THR A 48 15.958 3.312 -2.116 1.00 0.00 C ATOM 783 OG1 THR A 48 15.781 1.987 -2.521 1.00 0.00 O ATOM 784 CG2 THR A 48 17.183 3.919 -2.799 1.00 0.00 C ATOM 0 H THR A 48 14.345 2.321 -0.471 1.00 0.00 H new ATOM 0 HA THR A 48 16.986 2.879 -0.290 1.00 0.00 H new ATOM 0 HB THR A 48 15.085 3.889 -2.419 1.00 0.00 H new ATOM 0 HG1 THR A 48 15.712 1.950 -3.498 1.00 0.00 H new ATOM 0 HG21 THR A 48 17.073 3.839 -3.881 1.00 0.00 H new ATOM 0 HG22 THR A 48 17.272 4.969 -2.520 1.00 0.00 H new ATOM 0 HG23 THR A 48 18.078 3.382 -2.484 1.00 0.00 H new ATOM 792 N VAL A 49 16.683 5.167 0.855 1.00 0.00 N ATOM 793 CA VAL A 49 16.693 6.569 1.282 1.00 0.00 C ATOM 794 C VAL A 49 17.983 7.074 0.669 1.00 0.00 C ATOM 795 O VAL A 49 18.862 6.234 0.499 1.00 0.00 O ATOM 796 CB VAL A 49 16.828 6.762 2.789 1.00 0.00 C ATOM 797 CG1 VAL A 49 15.776 6.014 3.575 1.00 0.00 C ATOM 798 CG2 VAL A 49 18.216 6.360 3.321 1.00 0.00 C ATOM 0 H VAL A 49 17.221 4.526 1.438 1.00 0.00 H new ATOM 0 HA VAL A 49 15.766 7.063 0.992 1.00 0.00 H new ATOM 0 HB VAL A 49 16.686 7.833 2.938 1.00 0.00 H new ATOM 0 HG11 VAL A 49 15.924 6.190 4.640 1.00 0.00 H new ATOM 0 HG12 VAL A 49 14.786 6.365 3.283 1.00 0.00 H new ATOM 0 HG13 VAL A 49 15.858 4.947 3.369 1.00 0.00 H new ATOM 0 HG21 VAL A 49 18.253 6.519 4.399 1.00 0.00 H new ATOM 0 HG22 VAL A 49 18.398 5.308 3.103 1.00 0.00 H new ATOM 0 HG23 VAL A 49 18.981 6.968 2.838 1.00 0.00 H new ATOM 808 N LYS A 50 18.072 8.336 0.380 1.00 0.00 N ATOM 809 CA LYS A 50 19.342 8.829 -0.161 1.00 0.00 C ATOM 810 C LYS A 50 20.183 8.905 1.079 1.00 0.00 C ATOM 811 O LYS A 50 20.751 7.847 1.387 1.00 0.00 O ATOM 812 CB LYS A 50 19.303 10.182 -0.783 1.00 0.00 C ATOM 813 CG LYS A 50 19.242 10.208 -2.279 1.00 0.00 C ATOM 814 CD LYS A 50 19.147 11.655 -2.693 1.00 0.00 C ATOM 815 CE LYS A 50 19.249 11.643 -4.193 1.00 0.00 C ATOM 816 NZ LYS A 50 17.904 11.671 -4.783 1.00 0.00 N ATOM 0 H LYS A 50 17.332 9.029 0.495 1.00 0.00 H new ATOM 0 HA LYS A 50 19.687 8.183 -0.968 1.00 0.00 H new ATOM 0 HB2 LYS A 50 18.436 10.716 -0.393 1.00 0.00 H new ATOM 0 HB3 LYS A 50 20.187 10.734 -0.464 1.00 0.00 H new ATOM 0 HG2 LYS A 50 20.128 9.742 -2.709 1.00 0.00 H new ATOM 0 HG3 LYS A 50 18.380 9.647 -2.639 1.00 0.00 H new ATOM 0 HD2 LYS A 50 18.206 12.097 -2.366 1.00 0.00 H new ATOM 0 HD3 LYS A 50 19.948 12.245 -2.248 1.00 0.00 H new ATOM 0 HE2 LYS A 50 19.824 12.504 -4.535 1.00 0.00 H new ATOM 0 HE3 LYS A 50 19.783 10.752 -4.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 17.980 11.663 -5.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 17.369 10.836 -4.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 17.409 12.534 -4.479 1.00 0.00 H new ATOM 830 N GLU A 51 20.197 10.066 1.696 1.00 0.00 N ATOM 831 CA GLU A 51 20.931 10.316 2.918 1.00 0.00 C ATOM 832 C GLU A 51 22.224 10.939 2.471 1.00 0.00 C ATOM 833 O GLU A 51 22.996 10.230 1.857 1.00 0.00 O ATOM 834 CB GLU A 51 21.285 9.057 3.662 1.00 0.00 C ATOM 835 CG GLU A 51 21.639 9.215 5.138 1.00 0.00 C ATOM 836 CD GLU A 51 21.201 8.034 5.908 1.00 0.00 C ATOM 837 OE1 GLU A 51 20.035 7.726 5.840 1.00 0.00 O ATOM 838 OE2 GLU A 51 22.167 7.387 6.641 1.00 0.00 O ATOM 0 H GLU A 51 19.687 10.881 1.355 1.00 0.00 H new ATOM 0 HA GLU A 51 20.325 10.929 3.585 1.00 0.00 H new ATOM 0 HB2 GLU A 51 20.445 8.367 3.585 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.130 8.588 3.157 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.715 9.348 5.247 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.165 10.112 5.537 1.00 0.00 H new ATOM 845 N SER A 52 22.365 12.195 2.769 1.00 0.00 N ATOM 846 CA SER A 52 23.617 12.824 2.354 1.00 0.00 C ATOM 847 C SER A 52 23.910 13.955 3.300 1.00 0.00 C ATOM 848 O SER A 52 24.687 14.842 2.993 1.00 0.00 O ATOM 849 CB SER A 52 23.446 13.268 0.920 1.00 0.00 C ATOM 850 OG SER A 52 24.742 13.426 0.404 1.00 0.00 O ATOM 0 H SER A 52 21.693 12.784 3.261 1.00 0.00 H new ATOM 0 HA SER A 52 24.470 12.146 2.393 1.00 0.00 H new ATOM 0 HB2 SER A 52 22.886 12.529 0.347 1.00 0.00 H new ATOM 0 HB3 SER A 52 22.888 14.203 0.865 1.00 0.00 H new ATOM 0 HG SER A 52 24.689 13.714 -0.531 1.00 0.00 H new ATOM 856 N SER A 53 23.320 13.962 4.474 1.00 0.00 N ATOM 857 CA SER A 53 23.410 15.012 5.447 1.00 0.00 C ATOM 858 C SER A 53 24.824 15.556 5.589 1.00 0.00 C ATOM 859 O SER A 53 25.694 14.739 5.755 1.00 0.00 O ATOM 860 CB SER A 53 22.839 14.684 6.837 1.00 0.00 C ATOM 861 OG SER A 53 23.324 13.482 7.361 1.00 0.00 O ATOM 0 H SER A 53 22.733 13.189 4.787 1.00 0.00 H new ATOM 0 HA SER A 53 22.761 15.782 5.030 1.00 0.00 H new ATOM 0 HB2 SER A 53 23.081 15.496 7.523 1.00 0.00 H new ATOM 0 HB3 SER A 53 21.752 14.633 6.774 1.00 0.00 H new ATOM 0 HG SER A 53 23.762 12.968 6.650 1.00 0.00 H new ATOM 867 N ASN A 54 24.876 16.862 5.510 1.00 0.00 N ATOM 868 CA ASN A 54 26.102 17.652 5.611 1.00 0.00 C ATOM 869 C ASN A 54 27.367 16.864 5.749 1.00 0.00 C ATOM 870 O ASN A 54 28.078 17.069 6.747 1.00 0.00 O ATOM 871 CB ASN A 54 25.976 18.631 6.816 1.00 0.00 C ATOM 872 CG ASN A 54 26.725 19.908 6.646 1.00 0.00 C ATOM 873 OD1 ASN A 54 26.177 21.010 6.837 1.00 0.00 O ATOM 874 ND2 ASN A 54 28.016 19.809 6.278 1.00 0.00 N ATOM 0 H ASN A 54 24.044 17.435 5.369 1.00 0.00 H new ATOM 0 HA ASN A 54 26.191 18.176 4.659 1.00 0.00 H new ATOM 0 HB2 ASN A 54 24.922 18.859 6.976 1.00 0.00 H new ATOM 0 HB3 ASN A 54 26.333 18.130 7.716 1.00 0.00 H new ATOM 0 HD21 ASN A 54 28.575 20.652 6.148 1.00 0.00 H new ATOM 0 HD22 ASN A 54 28.435 18.891 6.130 1.00 0.00 H new ATOM 881 N PHE A 55 27.621 16.014 4.793 1.00 0.00 N ATOM 882 CA PHE A 55 28.756 15.144 4.714 1.00 0.00 C ATOM 883 C PHE A 55 28.918 14.290 3.501 1.00 0.00 C ATOM 884 O PHE A 55 30.061 13.934 3.271 1.00 0.00 O ATOM 885 CB PHE A 55 28.608 14.007 5.752 1.00 0.00 C ATOM 886 CG PHE A 55 28.731 14.452 7.155 1.00 0.00 C ATOM 887 CD1 PHE A 55 29.929 14.997 7.643 1.00 0.00 C ATOM 888 CD2 PHE A 55 27.664 14.351 8.039 1.00 0.00 C ATOM 889 CE1 PHE A 55 30.066 15.428 8.965 1.00 0.00 C ATOM 890 CE2 PHE A 55 27.748 14.763 9.359 1.00 0.00 C ATOM 891 CZ PHE A 55 28.965 15.301 9.805 1.00 0.00 C ATOM 0 H PHE A 55 26.995 15.905 3.995 1.00 0.00 H new ATOM 0 HA PHE A 55 29.564 15.870 4.804 1.00 0.00 H new ATOM 0 HB2 PHE A 55 27.637 13.530 5.617 1.00 0.00 H new ATOM 0 HB3 PHE A 55 29.366 13.249 5.555 1.00 0.00 H new ATOM 0 HD1 PHE A 55 30.773 15.086 6.975 1.00 0.00 H new ATOM 0 HD2 PHE A 55 26.733 13.935 7.683 1.00 0.00 H new ATOM 0 HE1 PHE A 55 30.996 15.846 9.322 1.00 0.00 H new ATOM 0 HE2 PHE A 55 26.902 14.673 10.025 1.00 0.00 H new ATOM 0 HZ PHE A 55 29.049 15.626 10.831 1.00 0.00 H new ATOM 901 N ARG A 56 27.815 14.023 2.842 1.00 0.00 N ATOM 902 CA ARG A 56 27.765 13.199 1.641 1.00 0.00 C ATOM 903 C ARG A 56 27.543 11.772 2.093 1.00 0.00 C ATOM 904 O ARG A 56 28.269 10.927 1.602 1.00 0.00 O ATOM 905 CB ARG A 56 29.050 13.198 0.833 1.00 0.00 C ATOM 906 CG ARG A 56 28.957 12.676 -0.610 1.00 0.00 C ATOM 907 CD ARG A 56 28.746 13.769 -1.641 1.00 0.00 C ATOM 908 NE ARG A 56 27.980 13.325 -2.806 1.00 0.00 N ATOM 909 CZ ARG A 56 28.457 12.980 -4.000 1.00 0.00 C ATOM 910 NH1 ARG A 56 29.751 12.995 -4.282 1.00 0.00 N ATOM 911 NH2 ARG A 56 27.646 12.600 -4.964 1.00 0.00 N ATOM 0 H ARG A 56 26.902 14.378 3.127 1.00 0.00 H new ATOM 0 HA ARG A 56 26.977 13.605 1.007 1.00 0.00 H new ATOM 0 HB2 ARG A 56 29.433 14.218 0.802 1.00 0.00 H new ATOM 0 HB3 ARG A 56 29.787 12.597 1.366 1.00 0.00 H new ATOM 0 HG2 ARG A 56 29.871 12.133 -0.850 1.00 0.00 H new ATOM 0 HG3 ARG A 56 28.136 11.962 -0.677 1.00 0.00 H new ATOM 0 HD2 ARG A 56 28.229 14.606 -1.172 1.00 0.00 H new ATOM 0 HD3 ARG A 56 29.716 14.139 -1.972 1.00 0.00 H new ATOM 0 HE ARG A 56 26.968 13.274 -2.690 1.00 0.00 H new ATOM 0 HH11 ARG A 56 30.425 13.279 -3.571 1.00 0.00 H new ATOM 0 HH12 ARG A 56 30.074 12.723 -5.210 1.00 0.00 H new ATOM 0 HH21 ARG A 56 26.640 12.567 -4.801 1.00 0.00 H new ATOM 0 HH22 ARG A 56 28.024 12.338 -5.875 1.00 0.00 H new ATOM 925 N ASN A 57 26.602 11.671 2.967 1.00 0.00 N ATOM 926 CA ASN A 57 26.150 10.491 3.627 1.00 0.00 C ATOM 927 C ASN A 57 26.306 9.322 2.678 1.00 0.00 C ATOM 928 O ASN A 57 27.430 8.793 2.666 1.00 0.00 O ATOM 929 CB ASN A 57 24.759 10.653 4.265 1.00 0.00 C ATOM 930 CG ASN A 57 24.837 10.253 5.748 1.00 0.00 C ATOM 931 OD1 ASN A 57 24.646 11.181 6.639 1.00 0.00 O flip ATOM 932 ND2 ASN A 57 25.081 9.074 6.059 1.00 0.00 N flip ATOM 0 H ASN A 57 26.078 12.492 3.268 1.00 0.00 H new ATOM 0 HA ASN A 57 26.773 10.284 4.497 1.00 0.00 H new ATOM 0 HB2 ASN A 57 24.420 11.685 4.171 1.00 0.00 H new ATOM 0 HB3 ASN A 57 24.032 10.030 3.745 1.00 0.00 H new ATOM 0 HD21 ASN A 57 25.225 8.374 5.331 1.00 0.00 H new ATOM 0 HD22 ASN A 57 25.137 8.807 7.042 1.00 0.00 H new ATOM 939 N ILE A 58 25.315 8.915 1.927 1.00 0.00 N ATOM 940 CA ILE A 58 25.383 7.845 0.995 1.00 0.00 C ATOM 941 C ILE A 58 23.957 7.306 0.751 1.00 0.00 C ATOM 942 O ILE A 58 23.211 7.200 1.729 1.00 0.00 O ATOM 943 CB ILE A 58 26.165 6.653 1.429 1.00 0.00 C ATOM 944 CG1 ILE A 58 27.209 6.309 0.364 1.00 0.00 C ATOM 945 CG2 ILE A 58 25.304 5.403 1.613 1.00 0.00 C ATOM 946 CD1 ILE A 58 28.616 6.518 0.836 1.00 0.00 C ATOM 0 H ILE A 58 24.394 9.352 1.959 1.00 0.00 H new ATOM 0 HA ILE A 58 25.875 8.281 0.126 1.00 0.00 H new ATOM 0 HB ILE A 58 26.613 6.921 2.386 1.00 0.00 H new ATOM 0 HG12 ILE A 58 27.083 5.269 0.062 1.00 0.00 H new ATOM 0 HG13 ILE A 58 27.033 6.921 -0.521 1.00 0.00 H new ATOM 0 HG21 ILE A 58 25.933 4.571 1.929 1.00 0.00 H new ATOM 0 HG22 ILE A 58 24.545 5.593 2.372 1.00 0.00 H new ATOM 0 HG23 ILE A 58 24.819 5.153 0.669 1.00 0.00 H new ATOM 0 HD11 ILE A 58 29.310 6.257 0.037 1.00 0.00 H new ATOM 0 HD12 ILE A 58 28.756 7.563 1.112 1.00 0.00 H new ATOM 0 HD13 ILE A 58 28.807 5.886 1.703 1.00 0.00 H new ATOM 958 N ASP A 59 23.675 6.996 -0.505 1.00 0.00 N ATOM 959 CA ASP A 59 22.369 6.475 -0.817 1.00 0.00 C ATOM 960 C ASP A 59 22.237 5.234 0.029 1.00 0.00 C ATOM 961 O ASP A 59 22.907 4.262 -0.305 1.00 0.00 O ATOM 962 CB ASP A 59 22.263 5.938 -2.262 1.00 0.00 C ATOM 963 CG ASP A 59 23.512 5.454 -2.904 1.00 0.00 C ATOM 964 OD1 ASP A 59 24.254 6.391 -3.417 1.00 0.00 O ATOM 965 OD2 ASP A 59 23.749 4.252 -2.906 1.00 0.00 O ATOM 0 H ASP A 59 24.313 7.094 -1.295 1.00 0.00 H new ATOM 0 HA ASP A 59 21.635 7.266 -0.663 1.00 0.00 H new ATOM 0 HB2 ASP A 59 21.543 5.119 -2.265 1.00 0.00 H new ATOM 0 HB3 ASP A 59 21.848 6.730 -2.886 1.00 0.00 H new ATOM 970 N VAL A 60 21.429 5.239 1.066 1.00 0.00 N ATOM 971 CA VAL A 60 21.288 4.088 1.888 1.00 0.00 C ATOM 972 C VAL A 60 20.094 3.269 1.415 1.00 0.00 C ATOM 973 O VAL A 60 19.367 3.621 0.490 1.00 0.00 O ATOM 974 CB VAL A 60 21.132 4.416 3.381 1.00 0.00 C ATOM 975 CG1 VAL A 60 21.722 3.355 4.295 1.00 0.00 C ATOM 976 CG2 VAL A 60 21.857 5.704 3.717 1.00 0.00 C ATOM 0 H VAL A 60 20.863 6.038 1.350 1.00 0.00 H new ATOM 0 HA VAL A 60 22.212 3.518 1.791 1.00 0.00 H new ATOM 0 HB VAL A 60 20.057 4.485 3.546 1.00 0.00 H new ATOM 0 HG11 VAL A 60 21.578 3.649 5.335 1.00 0.00 H new ATOM 0 HG12 VAL A 60 21.224 2.402 4.115 1.00 0.00 H new ATOM 0 HG13 VAL A 60 22.788 3.252 4.092 1.00 0.00 H new ATOM 0 HG21 VAL A 60 21.737 5.923 4.778 1.00 0.00 H new ATOM 0 HG22 VAL A 60 22.917 5.596 3.486 1.00 0.00 H new ATOM 0 HG23 VAL A 60 21.439 6.521 3.129 1.00 0.00 H new ATOM 986 N VAL A 61 19.883 2.148 2.055 1.00 0.00 N ATOM 987 CA VAL A 61 18.780 1.210 1.758 1.00 0.00 C ATOM 988 C VAL A 61 18.735 0.238 2.903 1.00 0.00 C ATOM 989 O VAL A 61 19.858 -0.182 3.252 1.00 0.00 O ATOM 990 CB VAL A 61 18.990 0.524 0.432 1.00 0.00 C ATOM 991 CG1 VAL A 61 20.495 0.353 0.140 1.00 0.00 C ATOM 992 CG2 VAL A 61 18.279 -0.834 0.397 1.00 0.00 C ATOM 0 H VAL A 61 20.478 1.835 2.822 1.00 0.00 H new ATOM 0 HA VAL A 61 17.827 1.731 1.665 1.00 0.00 H new ATOM 0 HB VAL A 61 18.556 1.154 -0.345 1.00 0.00 H new ATOM 0 HG11 VAL A 61 20.625 -0.144 -0.821 1.00 0.00 H new ATOM 0 HG12 VAL A 61 20.973 1.332 0.110 1.00 0.00 H new ATOM 0 HG13 VAL A 61 20.952 -0.250 0.925 1.00 0.00 H new ATOM 0 HG21 VAL A 61 18.447 -1.308 -0.570 1.00 0.00 H new ATOM 0 HG22 VAL A 61 18.675 -1.472 1.187 1.00 0.00 H new ATOM 0 HG23 VAL A 61 17.210 -0.689 0.549 1.00 0.00 H new ATOM 1002 N PHE A 62 17.611 -0.102 3.467 1.00 0.00 N ATOM 1003 CA PHE A 62 17.667 -0.998 4.581 1.00 0.00 C ATOM 1004 C PHE A 62 16.897 -2.275 4.444 1.00 0.00 C ATOM 1005 O PHE A 62 17.187 -3.212 5.236 1.00 0.00 O ATOM 1006 CB PHE A 62 17.090 -0.273 5.831 1.00 0.00 C ATOM 1007 CG PHE A 62 17.739 1.050 6.178 1.00 0.00 C ATOM 1008 CD1 PHE A 62 19.045 1.116 6.643 1.00 0.00 C ATOM 1009 CD2 PHE A 62 17.060 2.248 6.046 1.00 0.00 C ATOM 1010 CE1 PHE A 62 19.673 2.326 6.973 1.00 0.00 C ATOM 1011 CE2 PHE A 62 17.627 3.482 6.358 1.00 0.00 C ATOM 1012 CZ PHE A 62 18.954 3.515 6.828 1.00 0.00 C ATOM 0 H PHE A 62 16.682 0.213 3.188 1.00 0.00 H new ATOM 0 HA PHE A 62 18.720 -1.271 4.657 1.00 0.00 H new ATOM 0 HB2 PHE A 62 16.025 -0.104 5.671 1.00 0.00 H new ATOM 0 HB3 PHE A 62 17.182 -0.938 6.689 1.00 0.00 H new ATOM 0 HD1 PHE A 62 19.601 0.197 6.755 1.00 0.00 H new ATOM 0 HD2 PHE A 62 16.043 2.226 5.684 1.00 0.00 H new ATOM 0 HE1 PHE A 62 20.692 2.338 7.332 1.00 0.00 H new ATOM 0 HE2 PHE A 62 17.061 4.394 6.242 1.00 0.00 H new ATOM 0 HZ PHE A 62 19.416 4.459 7.076 1.00 0.00 H new ATOM 1022 N GLU A 63 15.953 -2.363 3.524 1.00 0.00 N ATOM 1023 CA GLU A 63 15.196 -3.627 3.464 1.00 0.00 C ATOM 1024 C GLU A 63 14.545 -3.690 4.846 1.00 0.00 C ATOM 1025 O GLU A 63 14.303 -4.792 5.364 1.00 0.00 O ATOM 1026 CB GLU A 63 16.024 -4.889 3.217 1.00 0.00 C ATOM 1027 CG GLU A 63 15.454 -5.759 2.048 1.00 0.00 C ATOM 1028 CD GLU A 63 15.531 -7.237 2.208 1.00 0.00 C ATOM 1029 OE1 GLU A 63 14.614 -7.782 2.949 1.00 0.00 O ATOM 1030 OE2 GLU A 63 16.406 -7.899 1.674 1.00 0.00 O ATOM 0 H GLU A 63 15.695 -1.642 2.850 1.00 0.00 H new ATOM 0 HA GLU A 63 14.513 -3.617 2.614 1.00 0.00 H new ATOM 0 HB2 GLU A 63 17.052 -4.607 2.988 1.00 0.00 H new ATOM 0 HB3 GLU A 63 16.053 -5.485 4.129 1.00 0.00 H new ATOM 0 HG2 GLU A 63 14.408 -5.488 1.902 1.00 0.00 H new ATOM 0 HG3 GLU A 63 15.984 -5.489 1.135 1.00 0.00 H new ATOM 1037 N LEU A 64 14.288 -2.505 5.426 1.00 0.00 N ATOM 1038 CA LEU A 64 13.712 -2.325 6.729 1.00 0.00 C ATOM 1039 C LEU A 64 14.799 -2.623 7.780 1.00 0.00 C ATOM 1040 O LEU A 64 15.505 -1.656 8.100 1.00 0.00 O ATOM 1041 CB LEU A 64 12.426 -3.113 7.030 1.00 0.00 C ATOM 1042 CG LEU A 64 11.080 -2.338 6.874 1.00 0.00 C ATOM 1043 CD1 LEU A 64 10.001 -3.047 7.713 1.00 0.00 C ATOM 1044 CD2 LEU A 64 11.149 -0.919 7.384 1.00 0.00 C ATOM 0 H LEU A 64 14.493 -1.620 4.962 1.00 0.00 H new ATOM 0 HA LEU A 64 13.375 -1.289 6.766 1.00 0.00 H new ATOM 0 HB2 LEU A 64 12.397 -3.982 6.373 1.00 0.00 H new ATOM 0 HB3 LEU A 64 12.487 -3.488 8.052 1.00 0.00 H new ATOM 0 HG LEU A 64 10.855 -2.320 5.808 1.00 0.00 H new ATOM 0 HD11 LEU A 64 9.055 -2.515 7.613 1.00 0.00 H new ATOM 0 HD12 LEU A 64 9.881 -4.071 7.360 1.00 0.00 H new ATOM 0 HD13 LEU A 64 10.303 -3.057 8.760 1.00 0.00 H new ATOM 0 HD21 LEU A 64 10.182 -0.436 7.247 1.00 0.00 H new ATOM 0 HD22 LEU A 64 11.404 -0.925 8.444 1.00 0.00 H new ATOM 0 HD23 LEU A 64 11.911 -0.370 6.831 1.00 0.00 H new ATOM 1056 N GLY A 65 14.934 -3.836 8.273 1.00 0.00 N ATOM 1057 CA GLY A 65 15.982 -4.066 9.289 1.00 0.00 C ATOM 1058 C GLY A 65 17.128 -4.993 8.960 1.00 0.00 C ATOM 1059 O GLY A 65 16.992 -6.203 9.034 1.00 0.00 O ATOM 0 H GLY A 65 14.374 -4.649 8.016 1.00 0.00 H new ATOM 0 HA2 GLY A 65 16.407 -3.097 9.549 1.00 0.00 H new ATOM 0 HA3 GLY A 65 15.494 -4.451 10.184 1.00 0.00 H new ATOM 1063 N VAL A 66 18.278 -4.402 8.593 1.00 0.00 N ATOM 1064 CA VAL A 66 19.485 -5.148 8.244 1.00 0.00 C ATOM 1065 C VAL A 66 20.613 -4.537 9.099 1.00 0.00 C ATOM 1066 O VAL A 66 20.964 -3.361 8.948 1.00 0.00 O ATOM 1067 CB VAL A 66 19.811 -5.099 6.768 1.00 0.00 C ATOM 1068 CG1 VAL A 66 18.691 -5.767 5.965 1.00 0.00 C ATOM 1069 CG2 VAL A 66 20.072 -3.699 6.235 1.00 0.00 C ATOM 0 H VAL A 66 18.390 -3.390 8.532 1.00 0.00 H new ATOM 0 HA VAL A 66 19.348 -6.210 8.450 1.00 0.00 H new ATOM 0 HB VAL A 66 20.747 -5.645 6.646 1.00 0.00 H new ATOM 0 HG11 VAL A 66 18.932 -5.728 4.903 1.00 0.00 H new ATOM 0 HG12 VAL A 66 18.590 -6.807 6.277 1.00 0.00 H new ATOM 0 HG13 VAL A 66 17.753 -5.242 6.143 1.00 0.00 H new ATOM 0 HG21 VAL A 66 20.298 -3.751 5.170 1.00 0.00 H new ATOM 0 HG22 VAL A 66 19.188 -3.081 6.388 1.00 0.00 H new ATOM 0 HG23 VAL A 66 20.918 -3.260 6.764 1.00 0.00 H new ATOM 1079 N ASP A 67 21.198 -5.311 10.003 1.00 0.00 N ATOM 1080 CA ASP A 67 22.265 -4.801 10.836 1.00 0.00 C ATOM 1081 C ASP A 67 23.432 -4.393 10.015 1.00 0.00 C ATOM 1082 O ASP A 67 23.822 -5.110 9.079 1.00 0.00 O ATOM 1083 CB ASP A 67 22.539 -5.774 12.002 1.00 0.00 C ATOM 1084 CG ASP A 67 23.404 -6.925 11.625 1.00 0.00 C ATOM 1085 OD1 ASP A 67 23.030 -7.803 10.863 1.00 0.00 O ATOM 1086 OD2 ASP A 67 24.609 -6.939 12.169 1.00 0.00 O ATOM 0 H ASP A 67 20.951 -6.286 10.173 1.00 0.00 H new ATOM 0 HA ASP A 67 21.969 -3.873 11.325 1.00 0.00 H new ATOM 0 HB2 ASP A 67 23.011 -5.227 12.818 1.00 0.00 H new ATOM 0 HB3 ASP A 67 21.589 -6.152 12.380 1.00 0.00 H new ATOM 1091 N PHE A 68 24.045 -3.245 10.306 1.00 0.00 N ATOM 1092 CA PHE A 68 25.195 -2.767 9.551 1.00 0.00 C ATOM 1093 C PHE A 68 26.475 -2.738 10.385 1.00 0.00 C ATOM 1094 O PHE A 68 27.138 -3.773 10.402 1.00 0.00 O ATOM 1095 CB PHE A 68 24.916 -1.420 8.809 1.00 0.00 C ATOM 1096 CG PHE A 68 24.272 -1.495 7.474 1.00 0.00 C ATOM 1097 CD1 PHE A 68 24.260 -2.622 6.637 1.00 0.00 C ATOM 1098 CD2 PHE A 68 23.620 -0.343 7.003 1.00 0.00 C ATOM 1099 CE1 PHE A 68 23.611 -2.550 5.390 1.00 0.00 C ATOM 1100 CE2 PHE A 68 22.986 -0.285 5.778 1.00 0.00 C ATOM 1101 CZ PHE A 68 22.982 -1.411 4.956 1.00 0.00 C ATOM 0 H PHE A 68 23.759 -2.628 11.066 1.00 0.00 H new ATOM 0 HA PHE A 68 25.369 -3.503 8.766 1.00 0.00 H new ATOM 0 HB2 PHE A 68 24.286 -0.805 9.452 1.00 0.00 H new ATOM 0 HB3 PHE A 68 25.865 -0.895 8.696 1.00 0.00 H new ATOM 0 HD1 PHE A 68 24.744 -3.536 6.947 1.00 0.00 H new ATOM 0 HD2 PHE A 68 23.615 0.538 7.628 1.00 0.00 H new ATOM 0 HE1 PHE A 68 23.608 -3.422 4.753 1.00 0.00 H new ATOM 0 HE2 PHE A 68 22.498 0.624 5.459 1.00 0.00 H new ATOM 0 HZ PHE A 68 22.492 -1.387 3.994 1.00 0.00 H new ATOM 1111 N ALA A 69 26.707 -1.600 10.987 1.00 0.00 N ATOM 1112 CA ALA A 69 27.809 -1.236 11.836 1.00 0.00 C ATOM 1113 C ALA A 69 28.567 -0.047 11.227 1.00 0.00 C ATOM 1114 O ALA A 69 29.721 -0.093 10.821 1.00 0.00 O ATOM 1115 CB ALA A 69 28.820 -2.330 12.024 1.00 0.00 C ATOM 0 H ALA A 69 26.056 -0.822 10.881 1.00 0.00 H new ATOM 0 HA ALA A 69 27.360 -1.003 12.802 1.00 0.00 H new ATOM 0 HB1 ALA A 69 29.620 -1.978 12.676 1.00 0.00 H new ATOM 0 HB2 ALA A 69 28.338 -3.197 12.476 1.00 0.00 H new ATOM 0 HB3 ALA A 69 29.237 -2.610 11.057 1.00 0.00 H new ATOM 1121 N TYR A 70 27.832 1.055 11.185 1.00 0.00 N ATOM 1122 CA TYR A 70 28.367 2.285 10.650 1.00 0.00 C ATOM 1123 C TYR A 70 28.242 3.411 11.646 1.00 0.00 C ATOM 1124 O TYR A 70 27.122 3.729 12.005 1.00 0.00 O ATOM 1125 CB TYR A 70 27.600 2.682 9.367 1.00 0.00 C ATOM 1126 CG TYR A 70 27.809 4.173 9.053 1.00 0.00 C ATOM 1127 CD1 TYR A 70 29.034 4.803 9.145 1.00 0.00 C ATOM 1128 CD2 TYR A 70 26.754 4.989 8.648 1.00 0.00 C ATOM 1129 CE1 TYR A 70 29.242 6.155 8.865 1.00 0.00 C ATOM 1130 CE2 TYR A 70 26.916 6.353 8.352 1.00 0.00 C ATOM 1131 CZ TYR A 70 28.166 6.941 8.462 1.00 0.00 C ATOM 1132 OH TYR A 70 28.356 8.279 8.179 1.00 0.00 O ATOM 0 H TYR A 70 26.869 1.116 11.515 1.00 0.00 H new ATOM 0 HA TYR A 70 29.421 2.117 10.427 1.00 0.00 H new ATOM 0 HB2 TYR A 70 27.944 2.076 8.529 1.00 0.00 H new ATOM 0 HB3 TYR A 70 26.537 2.477 9.494 1.00 0.00 H new ATOM 0 HD1 TYR A 70 29.885 4.213 9.453 1.00 0.00 H new ATOM 0 HD2 TYR A 70 25.770 4.554 8.558 1.00 0.00 H new ATOM 0 HE1 TYR A 70 30.227 6.587 8.960 1.00 0.00 H new ATOM 0 HE2 TYR A 70 26.067 6.943 8.039 1.00 0.00 H new ATOM 0 HH TYR A 70 27.503 8.681 7.911 1.00 0.00 H new ATOM 1142 N SER A 71 29.388 3.971 12.054 1.00 0.00 N ATOM 1143 CA SER A 71 29.362 5.049 13.005 1.00 0.00 C ATOM 1144 C SER A 71 28.390 6.151 12.622 1.00 0.00 C ATOM 1145 O SER A 71 28.538 6.721 11.536 1.00 0.00 O ATOM 1146 CB SER A 71 30.698 5.738 13.233 1.00 0.00 C ATOM 1147 OG SER A 71 30.968 6.850 12.438 1.00 0.00 O ATOM 0 H SER A 71 30.317 3.692 11.739 1.00 0.00 H new ATOM 0 HA SER A 71 29.055 4.537 13.917 1.00 0.00 H new ATOM 0 HB2 SER A 71 30.750 6.045 14.278 1.00 0.00 H new ATOM 0 HB3 SER A 71 31.490 5.006 13.076 1.00 0.00 H new ATOM 0 HG SER A 71 30.310 6.902 11.714 1.00 0.00 H new ATOM 1153 N LEU A 72 27.457 6.382 13.494 1.00 0.00 N ATOM 1154 CA LEU A 72 26.397 7.340 13.380 1.00 0.00 C ATOM 1155 C LEU A 72 26.972 8.716 13.077 1.00 0.00 C ATOM 1156 O LEU A 72 27.142 9.655 13.877 1.00 0.00 O ATOM 1157 CB LEU A 72 25.497 7.376 14.620 1.00 0.00 C ATOM 1158 CG LEU A 72 26.104 7.931 15.883 1.00 0.00 C ATOM 1159 CD1 LEU A 72 27.620 7.837 15.959 1.00 0.00 C ATOM 1160 CD2 LEU A 72 25.601 9.357 16.137 1.00 0.00 C ATOM 0 H LEU A 72 27.413 5.866 14.373 1.00 0.00 H new ATOM 0 HA LEU A 72 25.760 7.029 12.552 1.00 0.00 H new ATOM 0 HB2 LEU A 72 24.612 7.965 14.381 1.00 0.00 H new ATOM 0 HB3 LEU A 72 25.158 6.360 14.824 1.00 0.00 H new ATOM 0 HG LEU A 72 25.759 7.283 16.689 1.00 0.00 H new ATOM 0 HD11 LEU A 72 27.964 8.261 16.902 1.00 0.00 H new ATOM 0 HD12 LEU A 72 27.923 6.792 15.899 1.00 0.00 H new ATOM 0 HD13 LEU A 72 28.061 8.391 15.130 1.00 0.00 H new ATOM 0 HD21 LEU A 72 26.049 9.743 17.053 1.00 0.00 H new ATOM 0 HD22 LEU A 72 25.880 9.996 15.299 1.00 0.00 H new ATOM 0 HD23 LEU A 72 24.516 9.347 16.240 1.00 0.00 H new ATOM 1172 N ALA A 73 27.315 8.878 11.778 1.00 0.00 N ATOM 1173 CA ALA A 73 27.886 10.065 11.188 1.00 0.00 C ATOM 1174 C ALA A 73 28.985 10.606 12.054 1.00 0.00 C ATOM 1175 O ALA A 73 28.792 11.662 12.665 1.00 0.00 O ATOM 1176 CB ALA A 73 26.760 11.061 10.858 1.00 0.00 C ATOM 0 H ALA A 73 27.185 8.132 11.095 1.00 0.00 H new ATOM 0 HA ALA A 73 28.371 9.837 10.239 1.00 0.00 H new ATOM 0 HB1 ALA A 73 27.188 11.959 10.412 1.00 0.00 H new ATOM 0 HB2 ALA A 73 26.064 10.603 10.155 1.00 0.00 H new ATOM 0 HB3 ALA A 73 26.230 11.327 11.773 1.00 0.00 H new ATOM 1182 N ASP A 74 30.119 9.915 12.127 1.00 0.00 N ATOM 1183 CA ASP A 74 31.296 10.257 12.909 1.00 0.00 C ATOM 1184 C ASP A 74 31.132 9.796 14.365 1.00 0.00 C ATOM 1185 O ASP A 74 30.262 10.334 15.038 1.00 0.00 O ATOM 1186 CB ASP A 74 31.831 11.637 12.862 1.00 0.00 C ATOM 1187 CG ASP A 74 33.166 11.642 12.092 1.00 0.00 C ATOM 1188 OD1 ASP A 74 34.219 11.213 12.704 1.00 0.00 O ATOM 1189 OD2 ASP A 74 33.207 12.072 10.866 1.00 0.00 O ATOM 0 H ASP A 74 30.245 9.046 11.607 1.00 0.00 H new ATOM 0 HA ASP A 74 32.072 9.703 12.380 1.00 0.00 H new ATOM 0 HB2 ASP A 74 31.115 12.300 12.376 1.00 0.00 H new ATOM 0 HB3 ASP A 74 31.980 12.016 13.873 1.00 0.00 H new ATOM 1194 N GLY A 75 31.942 8.841 14.810 1.00 0.00 N ATOM 1195 CA GLY A 75 31.855 8.351 16.168 1.00 0.00 C ATOM 1196 C GLY A 75 32.344 6.877 16.325 1.00 0.00 C ATOM 1197 O GLY A 75 33.539 6.639 16.295 1.00 0.00 O ATOM 0 H GLY A 75 32.664 8.395 14.245 1.00 0.00 H new ATOM 0 HA2 GLY A 75 32.448 8.994 16.818 1.00 0.00 H new ATOM 0 HA3 GLY A 75 30.821 8.422 16.507 1.00 0.00 H new ATOM 1201 N THR A 76 31.477 5.904 16.489 1.00 0.00 N ATOM 1202 CA THR A 76 31.905 4.541 16.634 1.00 0.00 C ATOM 1203 C THR A 76 31.131 3.535 15.796 1.00 0.00 C ATOM 1204 O THR A 76 31.755 2.713 15.105 1.00 0.00 O ATOM 1205 CB THR A 76 31.686 4.134 18.118 1.00 0.00 C ATOM 1206 OG1 THR A 76 32.962 3.929 18.683 1.00 0.00 O ATOM 1207 CG2 THR A 76 30.914 2.859 18.333 1.00 0.00 C ATOM 0 H THR A 76 30.466 6.038 16.525 1.00 0.00 H new ATOM 0 HA THR A 76 32.943 4.513 16.302 1.00 0.00 H new ATOM 0 HB THR A 76 31.101 4.935 18.570 1.00 0.00 H new ATOM 0 HG1 THR A 76 32.866 3.671 19.624 1.00 0.00 H new ATOM 0 HG21 THR A 76 30.818 2.668 19.402 1.00 0.00 H new ATOM 0 HG22 THR A 76 29.922 2.955 17.891 1.00 0.00 H new ATOM 0 HG23 THR A 76 31.442 2.030 17.862 1.00 0.00 H new ATOM 1215 N GLU A 77 29.806 3.572 15.840 1.00 0.00 N ATOM 1216 CA GLU A 77 28.968 2.616 15.067 1.00 0.00 C ATOM 1217 C GLU A 77 27.531 3.151 15.082 1.00 0.00 C ATOM 1218 O GLU A 77 27.361 4.341 15.331 1.00 0.00 O ATOM 1219 CB GLU A 77 29.003 1.262 15.756 1.00 0.00 C ATOM 1220 CG GLU A 77 29.665 0.154 14.893 1.00 0.00 C ATOM 1221 CD GLU A 77 30.684 -0.663 15.657 1.00 0.00 C ATOM 1222 OE1 GLU A 77 31.335 -0.164 16.544 1.00 0.00 O ATOM 1223 OE2 GLU A 77 30.797 -1.912 15.290 1.00 0.00 O ATOM 0 H GLU A 77 29.275 4.243 16.394 1.00 0.00 H new ATOM 0 HA GLU A 77 29.333 2.512 14.045 1.00 0.00 H new ATOM 0 HB2 GLU A 77 29.546 1.354 16.697 1.00 0.00 H new ATOM 0 HB3 GLU A 77 27.985 0.961 16.004 1.00 0.00 H new ATOM 0 HG2 GLU A 77 28.891 -0.510 14.508 1.00 0.00 H new ATOM 0 HG3 GLU A 77 30.149 0.613 14.031 1.00 0.00 H new ATOM 1230 N LEU A 78 26.595 2.255 14.850 1.00 0.00 N ATOM 1231 CA LEU A 78 25.163 2.405 14.832 1.00 0.00 C ATOM 1232 C LEU A 78 24.664 1.358 13.780 1.00 0.00 C ATOM 1233 O LEU A 78 24.129 1.644 12.711 1.00 0.00 O ATOM 1234 CB LEU A 78 24.661 3.788 14.393 1.00 0.00 C ATOM 1235 CG LEU A 78 23.595 4.403 15.330 1.00 0.00 C ATOM 1236 CD1 LEU A 78 22.810 5.491 14.646 1.00 0.00 C ATOM 1237 CD2 LEU A 78 22.575 3.277 15.544 1.00 0.00 C ATOM 0 H LEU A 78 26.857 1.291 14.646 1.00 0.00 H new ATOM 0 HA LEU A 78 24.789 2.268 15.846 1.00 0.00 H new ATOM 0 HB2 LEU A 78 25.511 4.468 14.332 1.00 0.00 H new ATOM 0 HB3 LEU A 78 24.244 3.709 13.389 1.00 0.00 H new ATOM 0 HG LEU A 78 24.077 4.800 16.223 1.00 0.00 H new ATOM 0 HD11 LEU A 78 22.072 5.897 15.338 1.00 0.00 H new ATOM 0 HD12 LEU A 78 23.487 6.285 14.331 1.00 0.00 H new ATOM 0 HD13 LEU A 78 22.302 5.080 13.774 1.00 0.00 H new ATOM 0 HD21 LEU A 78 21.779 3.627 16.201 1.00 0.00 H new ATOM 0 HD22 LEU A 78 22.151 2.983 14.584 1.00 0.00 H new ATOM 0 HD23 LEU A 78 23.070 2.419 16.000 1.00 0.00 H new ATOM 1249 N THR A 79 24.907 0.140 14.197 1.00 0.00 N ATOM 1250 CA THR A 79 24.595 -1.097 13.488 1.00 0.00 C ATOM 1251 C THR A 79 23.147 -1.459 13.774 1.00 0.00 C ATOM 1252 O THR A 79 22.791 -2.658 13.787 1.00 0.00 O ATOM 1253 CB THR A 79 25.398 -2.358 13.940 1.00 0.00 C ATOM 1254 OG1 THR A 79 25.135 -3.331 12.986 1.00 0.00 O ATOM 1255 CG2 THR A 79 25.119 -2.811 15.380 1.00 0.00 C ATOM 0 H THR A 79 25.356 -0.035 15.096 1.00 0.00 H new ATOM 0 HA THR A 79 24.838 -0.883 12.447 1.00 0.00 H new ATOM 0 HB THR A 79 26.463 -2.131 13.987 1.00 0.00 H new ATOM 0 HG1 THR A 79 24.166 -3.417 12.865 1.00 0.00 H new ATOM 0 HG21 THR A 79 25.719 -3.692 15.607 1.00 0.00 H new ATOM 0 HG22 THR A 79 25.377 -2.008 16.070 1.00 0.00 H new ATOM 0 HG23 THR A 79 24.062 -3.055 15.486 1.00 0.00 H new ATOM 1263 N GLY A 80 22.282 -0.499 14.004 1.00 0.00 N ATOM 1264 CA GLY A 80 20.913 -0.841 14.275 1.00 0.00 C ATOM 1265 C GLY A 80 20.252 -1.126 12.912 1.00 0.00 C ATOM 1266 O GLY A 80 20.799 -0.725 11.897 1.00 0.00 O ATOM 0 H GLY A 80 22.497 0.498 14.009 1.00 0.00 H new ATOM 0 HA2 GLY A 80 20.853 -1.714 14.925 1.00 0.00 H new ATOM 0 HA3 GLY A 80 20.404 -0.026 14.789 1.00 0.00 H new ATOM 1270 N THR A 81 19.131 -1.790 13.036 1.00 0.00 N ATOM 1271 CA THR A 81 18.290 -2.175 11.895 1.00 0.00 C ATOM 1272 C THR A 81 17.070 -1.243 11.802 1.00 0.00 C ATOM 1273 O THR A 81 15.949 -1.587 12.092 1.00 0.00 O ATOM 1274 CB THR A 81 17.693 -3.558 12.231 1.00 0.00 C ATOM 1275 OG1 THR A 81 17.027 -3.525 13.495 1.00 0.00 O ATOM 1276 CG2 THR A 81 18.704 -4.714 12.195 1.00 0.00 C ATOM 0 H THR A 81 18.758 -2.089 13.937 1.00 0.00 H new ATOM 0 HA THR A 81 18.884 -2.148 10.982 1.00 0.00 H new ATOM 0 HB THR A 81 16.977 -3.764 11.435 1.00 0.00 H new ATOM 0 HG1 THR A 81 16.300 -2.868 13.465 1.00 0.00 H new ATOM 0 HG21 THR A 81 18.199 -5.647 12.443 1.00 0.00 H new ATOM 0 HG22 THR A 81 19.135 -4.789 11.197 1.00 0.00 H new ATOM 0 HG23 THR A 81 19.497 -4.527 12.919 1.00 0.00 H new ATOM 1284 N TRP A 82 17.470 -0.070 11.404 1.00 0.00 N ATOM 1285 CA TRP A 82 16.615 1.078 11.265 1.00 0.00 C ATOM 1286 C TRP A 82 15.339 0.637 10.517 1.00 0.00 C ATOM 1287 O TRP A 82 15.293 0.693 9.256 1.00 0.00 O ATOM 1288 CB TRP A 82 17.115 2.259 10.415 1.00 0.00 C ATOM 1289 CG TRP A 82 18.406 2.893 10.720 1.00 0.00 C ATOM 1290 CD1 TRP A 82 19.579 2.380 11.122 1.00 0.00 C ATOM 1291 CD2 TRP A 82 18.634 4.303 10.625 1.00 0.00 C ATOM 1292 NE1 TRP A 82 20.488 3.395 11.274 1.00 0.00 N ATOM 1293 CE2 TRP A 82 19.983 4.616 10.986 1.00 0.00 C ATOM 1294 CE3 TRP A 82 17.877 5.439 10.273 1.00 0.00 C ATOM 1295 CZ2 TRP A 82 20.506 5.907 10.995 1.00 0.00 C ATOM 1296 CZ3 TRP A 82 18.394 6.700 10.288 1.00 0.00 C ATOM 1297 CH2 TRP A 82 19.710 6.968 10.645 1.00 0.00 C ATOM 0 H TRP A 82 18.441 0.123 11.157 1.00 0.00 H new ATOM 0 HA TRP A 82 16.514 1.424 12.294 1.00 0.00 H new ATOM 0 HB2 TRP A 82 17.158 1.918 9.381 1.00 0.00 H new ATOM 0 HB3 TRP A 82 16.353 3.037 10.462 1.00 0.00 H new ATOM 0 HD1 TRP A 82 19.776 1.333 11.298 1.00 0.00 H new ATOM 0 HE1 TRP A 82 21.451 3.244 11.575 1.00 0.00 H new ATOM 0 HE3 TRP A 82 16.846 5.305 9.980 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 21.535 6.072 11.277 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 17.754 7.525 10.011 1.00 0.00 H new ATOM 0 HH2 TRP A 82 20.093 7.978 10.647 1.00 0.00 H new ATOM 1308 N THR A 83 14.287 0.220 11.185 1.00 0.00 N ATOM 1309 CA THR A 83 13.046 -0.183 10.499 1.00 0.00 C ATOM 1310 C THR A 83 12.094 0.979 10.793 1.00 0.00 C ATOM 1311 O THR A 83 12.393 1.886 11.523 1.00 0.00 O ATOM 1312 CB THR A 83 12.321 -1.425 11.028 1.00 0.00 C ATOM 1313 OG1 THR A 83 12.166 -1.313 12.425 1.00 0.00 O ATOM 1314 CG2 THR A 83 12.958 -2.772 10.674 1.00 0.00 C ATOM 0 H THR A 83 14.250 0.146 12.202 1.00 0.00 H new ATOM 0 HA THR A 83 13.307 -0.412 9.466 1.00 0.00 H new ATOM 0 HB THR A 83 11.359 -1.438 10.516 1.00 0.00 H new ATOM 0 HG1 THR A 83 11.701 -2.105 12.767 1.00 0.00 H new ATOM 0 HG21 THR A 83 12.362 -3.579 11.099 1.00 0.00 H new ATOM 0 HG22 THR A 83 12.998 -2.882 9.590 1.00 0.00 H new ATOM 0 HG23 THR A 83 13.969 -2.814 11.080 1.00 0.00 H new ATOM 1322 N MET A 84 10.933 0.913 10.206 1.00 0.00 N ATOM 1323 CA MET A 84 9.908 1.925 10.406 1.00 0.00 C ATOM 1324 C MET A 84 8.687 1.102 10.803 1.00 0.00 C ATOM 1325 O MET A 84 8.924 0.093 11.468 1.00 0.00 O ATOM 1326 CB MET A 84 9.761 2.580 9.009 1.00 0.00 C ATOM 1327 CG MET A 84 9.192 1.664 7.913 1.00 0.00 C ATOM 1328 SD MET A 84 8.158 2.443 6.659 1.00 0.00 S ATOM 1329 CE MET A 84 8.018 1.106 5.452 1.00 0.00 C ATOM 0 H MET A 84 10.660 0.161 9.574 1.00 0.00 H new ATOM 0 HA MET A 84 10.090 2.701 11.149 1.00 0.00 H new ATOM 0 HB2 MET A 84 9.116 3.454 9.101 1.00 0.00 H new ATOM 0 HB3 MET A 84 10.739 2.939 8.689 1.00 0.00 H new ATOM 0 HG2 MET A 84 10.027 1.177 7.410 1.00 0.00 H new ATOM 0 HG3 MET A 84 8.609 0.879 8.395 1.00 0.00 H new ATOM 0 HE1 MET A 84 7.280 1.374 4.696 1.00 0.00 H new ATOM 0 HE2 MET A 84 8.985 0.944 4.975 1.00 0.00 H new ATOM 0 HE3 MET A 84 7.704 0.192 5.956 1.00 0.00 H new ATOM 1339 N GLU A 85 7.492 1.506 10.416 1.00 0.00 N ATOM 1340 CA GLU A 85 6.320 0.732 10.780 1.00 0.00 C ATOM 1341 C GLU A 85 5.156 1.386 10.128 1.00 0.00 C ATOM 1342 O GLU A 85 4.075 1.517 10.713 1.00 0.00 O ATOM 1343 CB GLU A 85 6.134 0.847 12.311 1.00 0.00 C ATOM 1344 CG GLU A 85 5.369 -0.394 12.764 1.00 0.00 C ATOM 1345 CD GLU A 85 4.413 -0.317 13.917 1.00 0.00 C ATOM 1346 OE1 GLU A 85 3.363 0.272 13.814 1.00 0.00 O ATOM 1347 OE2 GLU A 85 4.825 -0.932 15.004 1.00 0.00 O ATOM 0 H GLU A 85 7.308 2.344 9.864 1.00 0.00 H new ATOM 0 HA GLU A 85 6.416 -0.312 10.481 1.00 0.00 H new ATOM 0 HB2 GLU A 85 7.100 0.909 12.813 1.00 0.00 H new ATOM 0 HB3 GLU A 85 5.584 1.753 12.565 1.00 0.00 H new ATOM 0 HG2 GLU A 85 4.808 -0.758 11.904 1.00 0.00 H new ATOM 0 HG3 GLU A 85 6.108 -1.157 13.009 1.00 0.00 H new ATOM 1354 N GLY A 86 5.384 1.802 8.901 1.00 0.00 N ATOM 1355 CA GLY A 86 4.341 2.445 8.174 1.00 0.00 C ATOM 1356 C GLY A 86 4.270 3.841 8.710 1.00 0.00 C ATOM 1357 O GLY A 86 4.827 4.763 8.116 1.00 0.00 O ATOM 0 H GLY A 86 6.269 1.704 8.404 1.00 0.00 H new ATOM 0 HA2 GLY A 86 4.554 2.447 7.105 1.00 0.00 H new ATOM 0 HA3 GLY A 86 3.392 1.926 8.309 1.00 0.00 H new ATOM 1361 N ASN A 87 3.602 4.033 9.827 1.00 0.00 N ATOM 1362 CA ASN A 87 3.459 5.301 10.443 1.00 0.00 C ATOM 1363 C ASN A 87 4.708 5.910 11.061 1.00 0.00 C ATOM 1364 O ASN A 87 4.739 6.945 11.697 1.00 0.00 O ATOM 1365 CB ASN A 87 2.147 5.440 11.224 1.00 0.00 C ATOM 1366 CG ASN A 87 1.982 6.849 11.709 1.00 0.00 C ATOM 1367 OD1 ASN A 87 2.268 7.795 10.944 1.00 0.00 O ATOM 1368 ND2 ASN A 87 1.539 7.047 12.942 1.00 0.00 N ATOM 0 H ASN A 87 3.137 3.279 10.333 1.00 0.00 H new ATOM 0 HA ASN A 87 3.344 5.998 9.613 1.00 0.00 H new ATOM 0 HB2 ASN A 87 1.305 5.165 10.588 1.00 0.00 H new ATOM 0 HB3 ASN A 87 2.144 4.753 12.070 1.00 0.00 H new ATOM 0 HD21 ASN A 87 1.421 7.997 13.295 1.00 0.00 H new ATOM 0 HD22 ASN A 87 1.316 6.250 13.538 1.00 0.00 H new ATOM 1375 N LYS A 88 5.821 5.243 10.879 1.00 0.00 N ATOM 1376 CA LYS A 88 7.014 5.757 11.448 1.00 0.00 C ATOM 1377 C LYS A 88 8.221 4.812 11.334 1.00 0.00 C ATOM 1378 O LYS A 88 8.071 3.659 11.640 1.00 0.00 O ATOM 1379 CB LYS A 88 7.011 5.948 12.952 1.00 0.00 C ATOM 1380 CG LYS A 88 6.363 4.880 13.807 1.00 0.00 C ATOM 1381 CD LYS A 88 6.631 5.248 15.251 1.00 0.00 C ATOM 1382 CE LYS A 88 5.333 5.188 16.054 1.00 0.00 C ATOM 1383 NZ LYS A 88 5.094 3.904 16.702 1.00 0.00 N ATOM 0 H LYS A 88 5.914 4.372 10.357 1.00 0.00 H new ATOM 0 HA LYS A 88 7.077 6.687 10.883 1.00 0.00 H new ATOM 0 HB2 LYS A 88 8.046 6.052 13.277 1.00 0.00 H new ATOM 0 HB3 LYS A 88 6.513 6.894 13.167 1.00 0.00 H new ATOM 0 HG2 LYS A 88 5.291 4.829 13.614 1.00 0.00 H new ATOM 0 HG3 LYS A 88 6.776 3.898 13.576 1.00 0.00 H new ATOM 0 HD2 LYS A 88 7.365 4.565 15.679 1.00 0.00 H new ATOM 0 HD3 LYS A 88 7.057 6.250 15.307 1.00 0.00 H new ATOM 0 HE2 LYS A 88 5.352 5.969 16.814 1.00 0.00 H new ATOM 0 HE3 LYS A 88 4.497 5.409 15.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 4.197 3.941 17.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 5.043 3.156 15.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 5.872 3.698 17.361 1.00 0.00 H new ATOM 1397 N LEU A 89 9.339 5.422 10.921 1.00 0.00 N ATOM 1398 CA LEU A 89 10.653 4.871 10.767 1.00 0.00 C ATOM 1399 C LEU A 89 11.025 4.490 12.216 1.00 0.00 C ATOM 1400 O LEU A 89 10.180 4.523 13.093 1.00 0.00 O ATOM 1401 CB LEU A 89 11.644 5.970 10.275 1.00 0.00 C ATOM 1402 CG LEU A 89 12.391 5.745 8.972 1.00 0.00 C ATOM 1403 CD1 LEU A 89 11.627 4.934 7.968 1.00 0.00 C ATOM 1404 CD2 LEU A 89 12.707 7.073 8.250 1.00 0.00 C ATOM 0 H LEU A 89 9.323 6.410 10.666 1.00 0.00 H new ATOM 0 HA LEU A 89 10.692 4.048 10.053 1.00 0.00 H new ATOM 0 HB2 LEU A 89 11.085 6.901 10.180 1.00 0.00 H new ATOM 0 HB3 LEU A 89 12.385 6.122 11.059 1.00 0.00 H new ATOM 0 HG LEU A 89 13.291 5.217 9.287 1.00 0.00 H new ATOM 0 HD11 LEU A 89 12.225 4.816 7.064 1.00 0.00 H new ATOM 0 HD12 LEU A 89 11.405 3.952 8.387 1.00 0.00 H new ATOM 0 HD13 LEU A 89 10.695 5.443 7.722 1.00 0.00 H new ATOM 0 HD21 LEU A 89 13.242 6.865 7.323 1.00 0.00 H new ATOM 0 HD22 LEU A 89 11.777 7.594 8.023 1.00 0.00 H new ATOM 0 HD23 LEU A 89 13.326 7.699 8.893 1.00 0.00 H new ATOM 1416 N VAL A 90 12.297 4.175 12.363 1.00 0.00 N ATOM 1417 CA VAL A 90 12.968 3.841 13.577 1.00 0.00 C ATOM 1418 C VAL A 90 14.457 3.707 13.181 1.00 0.00 C ATOM 1419 O VAL A 90 14.747 2.705 12.546 1.00 0.00 O ATOM 1420 CB VAL A 90 12.517 2.541 14.222 1.00 0.00 C ATOM 1421 CG1 VAL A 90 12.689 2.630 15.735 1.00 0.00 C ATOM 1422 CG2 VAL A 90 11.061 2.211 14.026 1.00 0.00 C ATOM 0 H VAL A 90 12.928 4.148 11.562 1.00 0.00 H new ATOM 0 HA VAL A 90 12.755 4.611 14.319 1.00 0.00 H new ATOM 0 HB VAL A 90 13.129 1.778 13.742 1.00 0.00 H new ATOM 0 HG11 VAL A 90 12.364 1.696 16.194 1.00 0.00 H new ATOM 0 HG12 VAL A 90 13.738 2.805 15.972 1.00 0.00 H new ATOM 0 HG13 VAL A 90 12.087 3.452 16.122 1.00 0.00 H new ATOM 0 HG21 VAL A 90 10.832 1.267 14.521 1.00 0.00 H new ATOM 0 HG22 VAL A 90 10.447 3.003 14.455 1.00 0.00 H new ATOM 0 HG23 VAL A 90 10.848 2.123 12.961 1.00 0.00 H new ATOM 1432 N GLY A 91 15.234 4.712 13.544 1.00 0.00 N ATOM 1433 CA GLY A 91 16.644 4.760 13.248 1.00 0.00 C ATOM 1434 C GLY A 91 17.359 3.559 13.884 1.00 0.00 C ATOM 1435 O GLY A 91 18.473 3.202 13.530 1.00 0.00 O ATOM 0 H GLY A 91 14.894 5.524 14.058 1.00 0.00 H new ATOM 0 HA2 GLY A 91 16.797 4.754 12.169 1.00 0.00 H new ATOM 0 HA3 GLY A 91 17.071 5.689 13.626 1.00 0.00 H new ATOM 1439 N LYS A 92 16.647 2.984 14.796 1.00 0.00 N ATOM 1440 CA LYS A 92 17.046 1.804 15.543 1.00 0.00 C ATOM 1441 C LYS A 92 18.436 1.961 16.071 1.00 0.00 C ATOM 1442 O LYS A 92 18.817 3.120 16.190 1.00 0.00 O ATOM 1443 CB LYS A 92 16.814 0.488 14.838 1.00 0.00 C ATOM 1444 CG LYS A 92 15.307 0.224 14.947 1.00 0.00 C ATOM 1445 CD LYS A 92 15.016 -0.242 16.363 1.00 0.00 C ATOM 1446 CE LYS A 92 14.186 -1.487 16.390 1.00 0.00 C ATOM 1447 NZ LYS A 92 12.832 -1.247 15.865 1.00 0.00 N ATOM 0 H LYS A 92 15.725 3.329 15.064 1.00 0.00 H new ATOM 0 HA LYS A 92 16.367 1.741 16.393 1.00 0.00 H new ATOM 0 HB2 LYS A 92 17.129 0.540 13.796 1.00 0.00 H new ATOM 0 HB3 LYS A 92 17.387 -0.313 15.304 1.00 0.00 H new ATOM 0 HG2 LYS A 92 14.744 1.129 14.720 1.00 0.00 H new ATOM 0 HG3 LYS A 92 14.999 -0.533 14.225 1.00 0.00 H new ATOM 0 HD2 LYS A 92 15.956 -0.423 16.884 1.00 0.00 H new ATOM 0 HD3 LYS A 92 14.498 0.549 16.905 1.00 0.00 H new ATOM 0 HE2 LYS A 92 14.674 -2.263 15.800 1.00 0.00 H new ATOM 0 HE3 LYS A 92 14.120 -1.859 17.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 12.264 -2.113 15.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 12.383 -0.477 16.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 12.891 -0.981 14.861 1.00 0.00 H new ATOM 1461 N PHE A 93 19.124 0.876 16.400 1.00 0.00 N ATOM 1462 CA PHE A 93 20.432 1.041 17.022 1.00 0.00 C ATOM 1463 C PHE A 93 21.050 -0.228 17.580 1.00 0.00 C ATOM 1464 O PHE A 93 20.625 -1.328 17.240 1.00 0.00 O ATOM 1465 CB PHE A 93 20.012 1.795 18.323 1.00 0.00 C ATOM 1466 CG PHE A 93 18.722 1.202 18.902 1.00 0.00 C ATOM 1467 CD1 PHE A 93 18.699 -0.167 19.244 1.00 0.00 C ATOM 1468 CD2 PHE A 93 17.565 1.904 19.120 1.00 0.00 C ATOM 1469 CE1 PHE A 93 17.579 -0.774 19.771 1.00 0.00 C ATOM 1470 CE2 PHE A 93 16.425 1.298 19.663 1.00 0.00 C ATOM 1471 CZ PHE A 93 16.413 -0.053 19.994 1.00 0.00 C ATOM 0 H PHE A 93 18.818 -0.086 16.256 1.00 0.00 H new ATOM 0 HA PHE A 93 21.133 1.472 16.307 1.00 0.00 H new ATOM 0 HB2 PHE A 93 20.811 1.729 19.061 1.00 0.00 H new ATOM 0 HB3 PHE A 93 19.866 2.853 18.105 1.00 0.00 H new ATOM 0 HD1 PHE A 93 19.589 -0.759 19.088 1.00 0.00 H new ATOM 0 HD2 PHE A 93 17.532 2.953 18.866 1.00 0.00 H new ATOM 0 HE1 PHE A 93 17.609 -1.826 20.014 1.00 0.00 H new ATOM 0 HE2 PHE A 93 15.538 1.891 19.828 1.00 0.00 H new ATOM 0 HZ PHE A 93 15.533 -0.522 20.408 1.00 0.00 H new ATOM 1481 N LYS A 94 21.983 0.172 18.411 1.00 0.00 N ATOM 1482 CA LYS A 94 22.867 -0.527 19.333 1.00 0.00 C ATOM 1483 C LYS A 94 24.215 -0.327 18.704 1.00 0.00 C ATOM 1484 O LYS A 94 24.924 -1.241 18.339 1.00 0.00 O ATOM 1485 CB LYS A 94 22.596 -1.987 19.496 1.00 0.00 C ATOM 1486 CG LYS A 94 21.991 -1.907 20.893 1.00 0.00 C ATOM 1487 CD LYS A 94 21.553 -3.180 21.536 1.00 0.00 C ATOM 1488 CE LYS A 94 21.324 -3.084 23.034 1.00 0.00 C ATOM 1489 NZ LYS A 94 22.589 -3.233 23.784 1.00 0.00 N ATOM 0 H LYS A 94 22.175 1.172 18.467 1.00 0.00 H new ATOM 0 HA LYS A 94 22.750 -0.137 20.344 1.00 0.00 H new ATOM 0 HB2 LYS A 94 21.906 -2.382 18.751 1.00 0.00 H new ATOM 0 HB3 LYS A 94 23.497 -2.599 19.452 1.00 0.00 H new ATOM 0 HG2 LYS A 94 22.723 -1.436 21.548 1.00 0.00 H new ATOM 0 HG3 LYS A 94 21.129 -1.241 20.847 1.00 0.00 H new ATOM 0 HD2 LYS A 94 20.630 -3.513 21.061 1.00 0.00 H new ATOM 0 HD3 LYS A 94 22.305 -3.946 21.345 1.00 0.00 H new ATOM 0 HE2 LYS A 94 20.869 -2.123 23.273 1.00 0.00 H new ATOM 0 HE3 LYS A 94 20.621 -3.856 23.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 22.398 -3.163 24.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 23.010 -4.160 23.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 23.250 -2.481 23.503 1.00 0.00 H new ATOM 1503 N ARG A 95 24.547 0.938 18.537 1.00 0.00 N ATOM 1504 CA ARG A 95 25.723 1.399 17.871 1.00 0.00 C ATOM 1505 C ARG A 95 27.003 0.970 18.530 1.00 0.00 C ATOM 1506 O ARG A 95 27.995 1.636 18.294 1.00 0.00 O ATOM 1507 CB ARG A 95 25.720 2.925 17.625 1.00 0.00 C ATOM 1508 CG ARG A 95 25.930 3.618 18.928 1.00 0.00 C ATOM 1509 CD ARG A 95 24.627 3.540 19.746 1.00 0.00 C ATOM 1510 NE ARG A 95 24.681 2.386 20.575 1.00 0.00 N ATOM 1511 CZ ARG A 95 25.739 2.022 21.343 1.00 0.00 C ATOM 1512 NH1 ARG A 95 26.680 2.902 21.564 1.00 0.00 N ATOM 1513 NH2 ARG A 95 25.689 0.783 21.774 1.00 0.00 N ATOM 0 H ARG A 95 23.966 1.701 18.884 1.00 0.00 H new ATOM 0 HA ARG A 95 25.688 0.906 16.900 1.00 0.00 H new ATOM 0 HB2 ARG A 95 26.507 3.196 16.921 1.00 0.00 H new ATOM 0 HB3 ARG A 95 24.774 3.234 17.180 1.00 0.00 H new ATOM 0 HG2 ARG A 95 26.749 3.152 19.476 1.00 0.00 H new ATOM 0 HG3 ARG A 95 26.210 4.658 18.762 1.00 0.00 H new ATOM 0 HD2 ARG A 95 24.507 4.437 20.353 1.00 0.00 H new ATOM 0 HD3 ARG A 95 23.765 3.488 19.081 1.00 0.00 H new ATOM 0 HE ARG A 95 23.858 1.783 20.594 1.00 0.00 H new ATOM 0 HH11 ARG A 95 26.608 3.837 21.163 1.00 0.00 H new ATOM 0 HH12 ARG A 95 27.486 2.654 22.138 1.00 0.00 H new ATOM 0 HH21 ARG A 95 24.900 0.187 21.524 1.00 0.00 H new ATOM 0 HH22 ARG A 95 26.439 0.416 22.359 1.00 0.00 H new ATOM 1527 N VAL A 96 27.116 -0.058 19.296 1.00 0.00 N ATOM 1528 CA VAL A 96 28.370 -0.513 19.831 1.00 0.00 C ATOM 1529 C VAL A 96 29.154 0.473 20.663 1.00 0.00 C ATOM 1530 O VAL A 96 29.990 -0.043 21.423 1.00 0.00 O ATOM 1531 CB VAL A 96 29.230 -0.926 18.638 1.00 0.00 C ATOM 1532 CG1 VAL A 96 30.471 -1.697 19.043 1.00 0.00 C ATOM 1533 CG2 VAL A 96 28.368 -1.624 17.577 1.00 0.00 C ATOM 0 H VAL A 96 26.320 -0.629 19.581 1.00 0.00 H new ATOM 0 HA VAL A 96 28.128 -1.318 20.524 1.00 0.00 H new ATOM 0 HB VAL A 96 29.628 -0.024 18.173 1.00 0.00 H new ATOM 0 HG11 VAL A 96 31.041 -1.963 18.153 1.00 0.00 H new ATOM 0 HG12 VAL A 96 31.086 -1.079 19.697 1.00 0.00 H new ATOM 0 HG13 VAL A 96 30.179 -2.605 19.571 1.00 0.00 H new ATOM 0 HG21 VAL A 96 28.994 -1.913 16.732 1.00 0.00 H new ATOM 0 HG22 VAL A 96 27.908 -2.513 18.009 1.00 0.00 H new ATOM 0 HG23 VAL A 96 27.589 -0.942 17.235 1.00 0.00 H new ATOM 1543 N ASP A 97 28.957 1.773 20.624 1.00 0.00 N ATOM 1544 CA ASP A 97 29.784 2.591 21.584 1.00 0.00 C ATOM 1545 C ASP A 97 29.511 2.144 23.020 1.00 0.00 C ATOM 1546 O ASP A 97 30.283 2.496 23.926 1.00 0.00 O ATOM 1547 CB ASP A 97 29.620 4.095 21.412 1.00 0.00 C ATOM 1548 CG ASP A 97 30.260 4.981 22.489 1.00 0.00 C ATOM 1549 OD1 ASP A 97 31.450 4.999 22.744 1.00 0.00 O ATOM 1550 OD2 ASP A 97 29.407 5.737 23.129 1.00 0.00 O ATOM 0 H ASP A 97 28.310 2.278 20.018 1.00 0.00 H new ATOM 0 HA ASP A 97 30.830 2.399 21.346 1.00 0.00 H new ATOM 0 HB2 ASP A 97 30.039 4.376 20.446 1.00 0.00 H new ATOM 0 HB3 ASP A 97 28.554 4.320 21.374 1.00 0.00 H new ATOM 1555 N ASN A 98 28.442 1.402 23.134 1.00 0.00 N ATOM 1556 CA ASN A 98 27.937 0.959 24.393 1.00 0.00 C ATOM 1557 C ASN A 98 26.663 0.140 24.521 1.00 0.00 C ATOM 1558 O ASN A 98 26.677 -0.959 25.097 1.00 0.00 O ATOM 1559 CB ASN A 98 27.712 2.294 25.203 1.00 0.00 C ATOM 1560 CG ASN A 98 27.258 2.137 26.628 1.00 0.00 C ATOM 1561 OD1 ASN A 98 26.092 1.710 26.921 1.00 0.00 O ATOM 1562 ND2 ASN A 98 28.128 2.456 27.563 1.00 0.00 N ATOM 0 H ASN A 98 27.892 1.086 22.335 1.00 0.00 H new ATOM 0 HA ASN A 98 28.676 0.231 24.728 1.00 0.00 H new ATOM 0 HB2 ASN A 98 28.645 2.858 25.201 1.00 0.00 H new ATOM 0 HB3 ASN A 98 26.974 2.896 24.673 1.00 0.00 H new ATOM 0 HD21 ASN A 98 27.876 2.364 28.547 1.00 0.00 H new ATOM 0 HD22 ASN A 98 29.054 2.795 27.303 1.00 0.00 H new ATOM 1569 N GLY A 99 25.591 0.703 23.981 1.00 0.00 N ATOM 1570 CA GLY A 99 24.254 0.199 23.915 1.00 0.00 C ATOM 1571 C GLY A 99 23.055 1.187 23.862 1.00 0.00 C ATOM 1572 O GLY A 99 21.981 0.878 24.381 1.00 0.00 O ATOM 0 H GLY A 99 25.660 1.618 23.536 1.00 0.00 H new ATOM 0 HA2 GLY A 99 24.190 -0.437 23.032 1.00 0.00 H new ATOM 0 HA3 GLY A 99 24.106 -0.444 24.782 1.00 0.00 H new ATOM 1576 N LYS A 100 23.284 2.324 23.226 1.00 0.00 N ATOM 1577 CA LYS A 100 22.329 3.378 23.001 1.00 0.00 C ATOM 1578 C LYS A 100 21.194 2.875 22.073 1.00 0.00 C ATOM 1579 O LYS A 100 21.294 1.736 21.721 1.00 0.00 O ATOM 1580 CB LYS A 100 22.983 4.518 22.225 1.00 0.00 C ATOM 1581 CG LYS A 100 23.597 5.605 23.062 1.00 0.00 C ATOM 1582 CD LYS A 100 25.107 5.398 22.915 1.00 0.00 C ATOM 1583 CE LYS A 100 26.030 6.593 23.071 1.00 0.00 C ATOM 1584 NZ LYS A 100 26.009 7.262 24.352 1.00 0.00 N ATOM 0 H LYS A 100 24.199 2.541 22.832 1.00 0.00 H new ATOM 0 HA LYS A 100 21.960 3.696 23.976 1.00 0.00 H new ATOM 0 HB2 LYS A 100 23.757 4.099 21.582 1.00 0.00 H new ATOM 0 HB3 LYS A 100 22.234 4.966 21.572 1.00 0.00 H new ATOM 0 HG2 LYS A 100 23.296 6.593 22.712 1.00 0.00 H new ATOM 0 HG3 LYS A 100 23.286 5.527 24.104 1.00 0.00 H new ATOM 0 HD2 LYS A 100 25.410 4.650 23.648 1.00 0.00 H new ATOM 0 HD3 LYS A 100 25.286 4.970 21.929 1.00 0.00 H new ATOM 0 HE2 LYS A 100 27.050 6.264 22.875 1.00 0.00 H new ATOM 0 HE3 LYS A 100 25.777 7.322 22.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 26.933 7.706 24.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 25.268 7.992 24.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 25.810 6.570 25.102 1.00 0.00 H new ATOM 1598 N GLU A 101 20.353 3.819 21.804 1.00 0.00 N ATOM 1599 CA GLU A 101 19.195 3.476 20.966 1.00 0.00 C ATOM 1600 C GLU A 101 18.633 4.709 20.296 1.00 0.00 C ATOM 1601 O GLU A 101 17.490 5.022 20.469 1.00 0.00 O ATOM 1602 CB GLU A 101 18.228 2.592 21.736 1.00 0.00 C ATOM 1603 CG GLU A 101 18.742 1.141 21.938 1.00 0.00 C ATOM 1604 CD GLU A 101 19.328 0.834 23.300 1.00 0.00 C ATOM 1605 OE1 GLU A 101 19.495 1.870 24.057 1.00 0.00 O ATOM 1606 OE2 GLU A 101 19.610 -0.296 23.660 1.00 0.00 O ATOM 0 H GLU A 101 20.415 4.787 22.119 1.00 0.00 H new ATOM 0 HA GLU A 101 19.489 2.853 20.121 1.00 0.00 H new ATOM 0 HB2 GLU A 101 18.036 3.040 22.711 1.00 0.00 H new ATOM 0 HB3 GLU A 101 17.276 2.561 21.206 1.00 0.00 H new ATOM 0 HG2 GLU A 101 17.916 0.454 21.756 1.00 0.00 H new ATOM 0 HG3 GLU A 101 19.500 0.936 21.182 1.00 0.00 H new ATOM 1613 N LEU A 102 19.584 5.321 19.590 1.00 0.00 N ATOM 1614 CA LEU A 102 19.474 6.560 18.854 1.00 0.00 C ATOM 1615 C LEU A 102 18.060 6.497 18.277 1.00 0.00 C ATOM 1616 O LEU A 102 17.335 7.427 18.503 1.00 0.00 O ATOM 1617 CB LEU A 102 20.446 6.536 17.635 1.00 0.00 C ATOM 1618 CG LEU A 102 21.871 6.774 18.098 1.00 0.00 C ATOM 1619 CD1 LEU A 102 22.693 5.497 18.049 1.00 0.00 C ATOM 1620 CD2 LEU A 102 22.434 7.827 17.162 1.00 0.00 C ATOM 0 H LEU A 102 20.521 4.924 19.519 1.00 0.00 H new ATOM 0 HA LEU A 102 19.689 7.431 19.473 1.00 0.00 H new ATOM 0 HB2 LEU A 102 20.377 5.575 17.124 1.00 0.00 H new ATOM 0 HB3 LEU A 102 20.157 7.301 16.915 1.00 0.00 H new ATOM 0 HG LEU A 102 21.901 7.104 19.136 1.00 0.00 H new ATOM 0 HD11 LEU A 102 23.708 5.705 18.387 1.00 0.00 H new ATOM 0 HD12 LEU A 102 22.240 4.748 18.698 1.00 0.00 H new ATOM 0 HD13 LEU A 102 22.721 5.121 17.026 1.00 0.00 H new ATOM 0 HD21 LEU A 102 23.465 8.048 17.440 1.00 0.00 H new ATOM 0 HD22 LEU A 102 22.406 7.455 16.138 1.00 0.00 H new ATOM 0 HD23 LEU A 102 21.836 8.736 17.235 1.00 0.00 H new ATOM 1632 N ILE A 103 17.795 5.408 17.604 1.00 0.00 N ATOM 1633 CA ILE A 103 16.475 5.174 17.071 1.00 0.00 C ATOM 1634 C ILE A 103 16.152 6.151 15.955 1.00 0.00 C ATOM 1635 O ILE A 103 14.992 6.109 15.533 1.00 0.00 O ATOM 1636 CB ILE A 103 15.470 5.333 18.239 1.00 0.00 C ATOM 1637 CG1 ILE A 103 15.132 3.955 18.751 1.00 0.00 C ATOM 1638 CG2 ILE A 103 14.260 6.161 17.940 1.00 0.00 C ATOM 1639 CD1 ILE A 103 14.741 2.889 17.730 1.00 0.00 C ATOM 0 H ILE A 103 18.472 4.670 17.411 1.00 0.00 H new ATOM 0 HA ILE A 103 16.416 4.173 16.643 1.00 0.00 H new ATOM 0 HB ILE A 103 15.957 5.920 19.018 1.00 0.00 H new ATOM 0 HG12 ILE A 103 15.993 3.585 19.308 1.00 0.00 H new ATOM 0 HG13 ILE A 103 14.311 4.054 19.462 1.00 0.00 H new ATOM 0 HG21 ILE A 103 13.624 6.208 18.824 1.00 0.00 H new ATOM 0 HG22 ILE A 103 14.568 7.169 17.661 1.00 0.00 H new ATOM 0 HG23 ILE A 103 13.705 5.711 17.117 1.00 0.00 H new ATOM 0 HD11 ILE A 103 14.527 1.953 18.245 1.00 0.00 H new ATOM 0 HD12 ILE A 103 13.855 3.215 17.185 1.00 0.00 H new ATOM 0 HD13 ILE A 103 15.562 2.738 17.029 1.00 0.00 H new ATOM 1651 N ALA A 104 17.068 6.966 15.490 1.00 0.00 N ATOM 1652 CA ALA A 104 16.916 7.940 14.434 1.00 0.00 C ATOM 1653 C ALA A 104 15.689 7.673 13.621 1.00 0.00 C ATOM 1654 O ALA A 104 15.750 7.177 12.493 1.00 0.00 O ATOM 1655 CB ALA A 104 18.168 8.052 13.539 1.00 0.00 C ATOM 0 H ALA A 104 18.014 6.966 15.870 1.00 0.00 H new ATOM 0 HA ALA A 104 16.796 8.908 14.921 1.00 0.00 H new ATOM 0 HB1 ALA A 104 17.995 8.799 12.764 1.00 0.00 H new ATOM 0 HB2 ALA A 104 19.023 8.350 14.145 1.00 0.00 H new ATOM 0 HB3 ALA A 104 18.371 7.087 13.075 1.00 0.00 H new ATOM 1661 N VAL A 105 14.491 7.967 14.098 1.00 0.00 N ATOM 1662 CA VAL A 105 13.252 7.720 13.398 1.00 0.00 C ATOM 1663 C VAL A 105 13.090 8.721 12.242 1.00 0.00 C ATOM 1664 O VAL A 105 14.020 8.810 11.471 1.00 0.00 O ATOM 1665 CB VAL A 105 12.028 7.752 14.307 1.00 0.00 C ATOM 1666 CG1 VAL A 105 10.781 7.167 13.604 1.00 0.00 C ATOM 1667 CG2 VAL A 105 12.188 7.000 15.607 1.00 0.00 C ATOM 0 H VAL A 105 14.355 8.398 15.013 1.00 0.00 H new ATOM 0 HA VAL A 105 13.312 6.706 13.002 1.00 0.00 H new ATOM 0 HB VAL A 105 11.907 8.812 14.531 1.00 0.00 H new ATOM 0 HG11 VAL A 105 9.929 7.207 14.282 1.00 0.00 H new ATOM 0 HG12 VAL A 105 10.560 7.750 12.710 1.00 0.00 H new ATOM 0 HG13 VAL A 105 10.974 6.131 13.324 1.00 0.00 H new ATOM 0 HG21 VAL A 105 11.269 7.078 16.188 1.00 0.00 H new ATOM 0 HG22 VAL A 105 12.397 5.951 15.397 1.00 0.00 H new ATOM 0 HG23 VAL A 105 13.014 7.428 16.176 1.00 0.00 H new ATOM 1677 N ARG A 106 11.995 9.423 12.104 1.00 0.00 N ATOM 1678 CA ARG A 106 11.666 10.332 11.018 1.00 0.00 C ATOM 1679 C ARG A 106 10.124 10.321 11.061 1.00 0.00 C ATOM 1680 O ARG A 106 9.602 11.341 10.725 1.00 0.00 O ATOM 1681 CB ARG A 106 12.104 9.876 9.677 1.00 0.00 C ATOM 1682 CG ARG A 106 12.738 11.050 8.948 1.00 0.00 C ATOM 1683 CD ARG A 106 14.228 11.038 8.791 1.00 0.00 C ATOM 1684 NE ARG A 106 14.604 9.679 8.394 1.00 0.00 N ATOM 1685 CZ ARG A 106 15.771 9.094 8.585 1.00 0.00 C ATOM 1686 NH1 ARG A 106 16.745 9.724 9.196 1.00 0.00 N ATOM 1687 NH2 ARG A 106 15.970 7.872 8.152 1.00 0.00 N ATOM 0 H ARG A 106 11.248 9.376 12.797 1.00 0.00 H new ATOM 0 HA ARG A 106 12.156 11.296 11.151 1.00 0.00 H new ATOM 0 HB2 ARG A 106 12.819 9.058 9.770 1.00 0.00 H new ATOM 0 HB3 ARG A 106 11.254 9.494 9.111 1.00 0.00 H new ATOM 0 HG2 ARG A 106 12.295 11.109 7.954 1.00 0.00 H new ATOM 0 HG3 ARG A 106 12.462 11.963 9.475 1.00 0.00 H new ATOM 0 HD2 ARG A 106 14.543 11.761 8.038 1.00 0.00 H new ATOM 0 HD3 ARG A 106 14.717 11.317 9.725 1.00 0.00 H new ATOM 0 HE ARG A 106 13.889 9.127 7.920 1.00 0.00 H new ATOM 0 HH11 ARG A 106 16.605 10.678 9.530 1.00 0.00 H new ATOM 0 HH12 ARG A 106 17.643 9.261 9.337 1.00 0.00 H new ATOM 0 HH21 ARG A 106 15.223 7.374 7.668 1.00 0.00 H new ATOM 0 HH22 ARG A 106 16.872 7.419 8.299 1.00 0.00 H new ATOM 1701 N GLU A 107 9.659 9.172 11.481 1.00 0.00 N ATOM 1702 CA GLU A 107 8.298 8.830 11.599 1.00 0.00 C ATOM 1703 C GLU A 107 7.408 9.327 10.442 1.00 0.00 C ATOM 1704 O GLU A 107 6.794 8.509 9.792 1.00 0.00 O ATOM 1705 CB GLU A 107 7.615 9.495 12.807 1.00 0.00 C ATOM 1706 CG GLU A 107 8.394 9.402 14.119 1.00 0.00 C ATOM 1707 CD GLU A 107 7.824 10.167 15.332 1.00 0.00 C ATOM 1708 OE1 GLU A 107 6.511 10.245 15.294 1.00 0.00 O ATOM 1709 OE2 GLU A 107 8.479 10.648 16.226 1.00 0.00 O ATOM 0 H GLU A 107 10.278 8.412 11.764 1.00 0.00 H new ATOM 0 HA GLU A 107 8.357 7.743 11.653 1.00 0.00 H new ATOM 0 HB2 GLU A 107 7.445 10.547 12.576 1.00 0.00 H new ATOM 0 HB3 GLU A 107 6.636 9.038 12.950 1.00 0.00 H new ATOM 0 HG2 GLU A 107 8.474 8.349 14.391 1.00 0.00 H new ATOM 0 HG3 GLU A 107 9.406 9.763 13.937 1.00 0.00 H new ATOM 1716 N ILE A 108 7.395 10.642 10.382 1.00 0.00 N ATOM 1717 CA ILE A 108 6.590 11.441 9.491 1.00 0.00 C ATOM 1718 C ILE A 108 5.132 11.486 9.856 1.00 0.00 C ATOM 1719 O ILE A 108 4.509 10.458 9.987 1.00 0.00 O ATOM 1720 CB ILE A 108 6.790 10.802 8.099 1.00 0.00 C ATOM 1721 CG1 ILE A 108 6.749 12.050 7.226 1.00 0.00 C ATOM 1722 CG2 ILE A 108 5.663 9.905 7.653 1.00 0.00 C ATOM 1723 CD1 ILE A 108 7.053 11.779 5.791 1.00 0.00 C ATOM 0 H ILE A 108 7.982 11.212 10.991 1.00 0.00 H new ATOM 0 HA ILE A 108 6.904 12.484 9.536 1.00 0.00 H new ATOM 0 HB ILE A 108 7.680 10.174 8.067 1.00 0.00 H new ATOM 0 HG12 ILE A 108 5.761 12.505 7.301 1.00 0.00 H new ATOM 0 HG13 ILE A 108 7.464 12.777 7.610 1.00 0.00 H new ATOM 0 HG21 ILE A 108 5.889 9.501 6.666 1.00 0.00 H new ATOM 0 HG22 ILE A 108 5.547 9.086 8.363 1.00 0.00 H new ATOM 0 HG23 ILE A 108 4.738 10.479 7.607 1.00 0.00 H new ATOM 0 HD11 ILE A 108 7.006 12.711 5.227 1.00 0.00 H new ATOM 0 HD12 ILE A 108 8.052 11.352 5.705 1.00 0.00 H new ATOM 0 HD13 ILE A 108 6.323 11.076 5.391 1.00 0.00 H new ATOM 1735 N SER A 109 4.644 12.715 9.996 1.00 0.00 N ATOM 1736 CA SER A 109 3.242 12.863 10.322 1.00 0.00 C ATOM 1737 C SER A 109 2.927 14.305 10.395 1.00 0.00 C ATOM 1738 O SER A 109 3.341 15.092 11.211 1.00 0.00 O ATOM 1739 CB SER A 109 2.974 12.179 11.659 1.00 0.00 C ATOM 1740 OG SER A 109 1.680 12.438 12.130 1.00 0.00 O ATOM 0 H SER A 109 5.173 13.581 9.894 1.00 0.00 H new ATOM 0 HA SER A 109 2.612 12.401 9.561 1.00 0.00 H new ATOM 0 HB2 SER A 109 3.112 11.103 11.550 1.00 0.00 H new ATOM 0 HB3 SER A 109 3.703 12.521 12.394 1.00 0.00 H new ATOM 0 HG SER A 109 1.546 11.982 12.987 1.00 0.00 H new ATOM 1746 N GLY A 110 2.061 14.689 9.450 1.00 0.00 N ATOM 1747 CA GLY A 110 1.559 16.016 9.306 1.00 0.00 C ATOM 1748 C GLY A 110 2.684 17.018 9.227 1.00 0.00 C ATOM 1749 O GLY A 110 3.034 17.602 10.235 1.00 0.00 O ATOM 0 H GLY A 110 1.692 14.044 8.751 1.00 0.00 H new ATOM 0 HA2 GLY A 110 0.947 16.081 8.406 1.00 0.00 H new ATOM 0 HA3 GLY A 110 0.912 16.257 10.150 1.00 0.00 H new ATOM 1753 N ASN A 111 3.199 17.167 8.020 1.00 0.00 N ATOM 1754 CA ASN A 111 4.295 18.086 7.774 1.00 0.00 C ATOM 1755 C ASN A 111 5.390 17.832 8.844 1.00 0.00 C ATOM 1756 O ASN A 111 5.636 18.660 9.699 1.00 0.00 O ATOM 1757 CB ASN A 111 3.905 19.556 7.633 1.00 0.00 C ATOM 1758 CG ASN A 111 4.941 20.460 6.958 1.00 0.00 C ATOM 1759 OD1 ASN A 111 5.005 20.626 5.737 1.00 0.00 O ATOM 1760 ND2 ASN A 111 5.809 21.089 7.740 1.00 0.00 N ATOM 0 H ASN A 111 2.876 16.663 7.194 1.00 0.00 H new ATOM 0 HA ASN A 111 4.690 17.872 6.781 1.00 0.00 H new ATOM 0 HB2 ASN A 111 2.976 19.613 7.065 1.00 0.00 H new ATOM 0 HB3 ASN A 111 3.696 19.954 8.626 1.00 0.00 H new ATOM 0 HD21 ASN A 111 6.516 21.699 7.330 1.00 0.00 H new ATOM 0 HD22 ASN A 111 5.769 20.962 8.751 1.00 0.00 H new ATOM 1767 N GLU A 112 5.989 16.662 8.718 1.00 0.00 N ATOM 1768 CA GLU A 112 7.016 16.295 9.649 1.00 0.00 C ATOM 1769 C GLU A 112 7.976 15.332 8.896 1.00 0.00 C ATOM 1770 O GLU A 112 7.770 15.038 7.740 1.00 0.00 O ATOM 1771 CB GLU A 112 6.439 15.421 10.817 1.00 0.00 C ATOM 1772 CG GLU A 112 6.456 16.066 12.199 1.00 0.00 C ATOM 1773 CD GLU A 112 6.344 17.568 12.324 1.00 0.00 C ATOM 1774 OE1 GLU A 112 7.223 18.356 12.120 1.00 0.00 O ATOM 1775 OE2 GLU A 112 5.136 17.941 12.682 1.00 0.00 O ATOM 0 H GLU A 112 5.783 15.971 7.996 1.00 0.00 H new ATOM 0 HA GLU A 112 7.477 17.205 10.034 1.00 0.00 H new ATOM 0 HB2 GLU A 112 5.410 15.156 10.573 1.00 0.00 H new ATOM 0 HB3 GLU A 112 7.005 14.491 10.864 1.00 0.00 H new ATOM 0 HG2 GLU A 112 5.638 15.629 12.773 1.00 0.00 H new ATOM 0 HG3 GLU A 112 7.383 15.767 12.687 1.00 0.00 H new ATOM 1782 N LEU A 113 8.933 14.902 9.697 1.00 0.00 N ATOM 1783 CA LEU A 113 9.961 13.932 9.447 1.00 0.00 C ATOM 1784 C LEU A 113 10.743 13.835 10.784 1.00 0.00 C ATOM 1785 O LEU A 113 11.937 13.640 10.842 1.00 0.00 O ATOM 1786 CB LEU A 113 10.957 14.203 8.328 1.00 0.00 C ATOM 1787 CG LEU A 113 10.661 13.509 6.986 1.00 0.00 C ATOM 1788 CD1 LEU A 113 12.045 13.279 6.373 1.00 0.00 C ATOM 1789 CD2 LEU A 113 10.147 12.099 7.170 1.00 0.00 C ATOM 0 H LEU A 113 9.009 15.272 10.644 1.00 0.00 H new ATOM 0 HA LEU A 113 9.457 13.029 9.104 1.00 0.00 H new ATOM 0 HB2 LEU A 113 11.000 15.279 8.158 1.00 0.00 H new ATOM 0 HB3 LEU A 113 11.946 13.894 8.665 1.00 0.00 H new ATOM 0 HG LEU A 113 9.944 14.108 6.424 1.00 0.00 H new ATOM 0 HD11 LEU A 113 11.938 12.786 5.407 1.00 0.00 H new ATOM 0 HD12 LEU A 113 12.547 14.237 6.237 1.00 0.00 H new ATOM 0 HD13 LEU A 113 12.637 12.650 7.038 1.00 0.00 H new ATOM 0 HD21 LEU A 113 9.953 11.652 6.195 1.00 0.00 H new ATOM 0 HD22 LEU A 113 10.893 11.506 7.699 1.00 0.00 H new ATOM 0 HD23 LEU A 113 9.224 12.121 7.749 1.00 0.00 H new ATOM 1801 N ILE A 114 10.032 13.967 11.845 1.00 0.00 N ATOM 1802 CA ILE A 114 10.546 13.825 13.181 1.00 0.00 C ATOM 1803 C ILE A 114 11.514 12.634 13.250 1.00 0.00 C ATOM 1804 O ILE A 114 11.167 11.478 13.444 1.00 0.00 O ATOM 1805 CB ILE A 114 9.425 13.343 14.083 1.00 0.00 C ATOM 1806 CG1 ILE A 114 8.313 12.593 13.332 1.00 0.00 C ATOM 1807 CG2 ILE A 114 8.989 14.357 15.105 1.00 0.00 C ATOM 1808 CD1 ILE A 114 6.882 13.083 13.528 1.00 0.00 C ATOM 0 H ILE A 114 9.036 14.185 11.818 1.00 0.00 H new ATOM 0 HA ILE A 114 10.993 14.779 13.459 1.00 0.00 H new ATOM 0 HB ILE A 114 9.852 12.560 14.710 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.540 12.632 12.267 1.00 0.00 H new ATOM 0 HG13 ILE A 114 8.354 11.545 13.628 1.00 0.00 H new ATOM 0 HG21 ILE A 114 8.185 13.940 15.712 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.832 14.613 15.746 1.00 0.00 H new ATOM 0 HG23 ILE A 114 8.633 15.254 14.599 1.00 0.00 H new ATOM 0 HD11 ILE A 114 6.202 12.465 12.941 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.615 13.015 14.583 1.00 0.00 H new ATOM 0 HD13 ILE A 114 6.804 14.120 13.200 1.00 0.00 H new ATOM 1820 N GLN A 115 12.763 13.030 13.071 1.00 0.00 N ATOM 1821 CA GLN A 115 13.949 12.248 13.075 1.00 0.00 C ATOM 1822 C GLN A 115 14.122 11.505 14.401 1.00 0.00 C ATOM 1823 O GLN A 115 14.926 10.587 14.413 1.00 0.00 O ATOM 1824 CB GLN A 115 15.083 13.237 12.796 1.00 0.00 C ATOM 1825 CG GLN A 115 15.078 13.674 11.325 1.00 0.00 C ATOM 1826 CD GLN A 115 16.260 13.094 10.605 1.00 0.00 C ATOM 1827 OE1 GLN A 115 17.149 12.435 11.128 1.00 0.00 O ATOM 1828 NE2 GLN A 115 16.288 13.347 9.299 1.00 0.00 N ATOM 0 H GLN A 115 12.973 14.014 12.903 1.00 0.00 H new ATOM 0 HA GLN A 115 13.928 11.461 12.321 1.00 0.00 H new ATOM 0 HB2 GLN A 115 14.976 14.110 13.439 1.00 0.00 H new ATOM 0 HB3 GLN A 115 16.041 12.777 13.040 1.00 0.00 H new ATOM 0 HG2 GLN A 115 14.155 13.348 10.845 1.00 0.00 H new ATOM 0 HG3 GLN A 115 15.103 14.762 11.262 1.00 0.00 H new ATOM 0 HE21 GLN A 115 15.544 13.897 8.870 1.00 0.00 H new ATOM 0 HE22 GLN A 115 17.054 12.991 8.727 1.00 0.00 H new ATOM 1837 N THR A 116 13.337 11.946 15.348 1.00 0.00 N ATOM 1838 CA THR A 116 13.194 11.414 16.700 1.00 0.00 C ATOM 1839 C THR A 116 14.218 10.395 17.058 1.00 0.00 C ATOM 1840 O THR A 116 13.791 9.261 17.292 1.00 0.00 O ATOM 1841 CB THR A 116 11.804 10.730 16.792 1.00 0.00 C ATOM 1842 OG1 THR A 116 10.811 11.715 16.507 1.00 0.00 O ATOM 1843 CG2 THR A 116 11.528 10.222 18.178 1.00 0.00 C ATOM 0 H THR A 116 12.728 12.750 15.193 1.00 0.00 H new ATOM 0 HA THR A 116 13.315 12.250 17.388 1.00 0.00 H new ATOM 0 HB THR A 116 11.787 9.895 16.092 1.00 0.00 H new ATOM 0 HG1 THR A 116 10.943 12.491 17.091 1.00 0.00 H new ATOM 0 HG21 THR A 116 10.546 9.750 18.204 1.00 0.00 H new ATOM 0 HG22 THR A 116 12.289 9.493 18.456 1.00 0.00 H new ATOM 0 HG23 THR A 116 11.549 11.054 18.881 1.00 0.00 H new ATOM 1851 N TYR A 117 15.501 10.756 17.135 1.00 0.00 N ATOM 1852 CA TYR A 117 16.397 9.741 17.563 1.00 0.00 C ATOM 1853 C TYR A 117 16.700 9.886 19.070 1.00 0.00 C ATOM 1854 O TYR A 117 17.462 10.792 19.486 1.00 0.00 O ATOM 1855 CB TYR A 117 17.796 9.807 16.957 1.00 0.00 C ATOM 1856 CG TYR A 117 18.289 10.540 15.741 1.00 0.00 C ATOM 1857 CD1 TYR A 117 17.663 11.509 14.994 1.00 0.00 C ATOM 1858 CD2 TYR A 117 19.582 10.190 15.296 1.00 0.00 C ATOM 1859 CE1 TYR A 117 18.298 12.094 13.885 1.00 0.00 C ATOM 1860 CE2 TYR A 117 20.224 10.745 14.200 1.00 0.00 C ATOM 1861 CZ TYR A 117 19.584 11.718 13.472 1.00 0.00 C ATOM 1862 OH TYR A 117 20.178 12.312 12.367 1.00 0.00 O ATOM 0 H TYR A 117 15.897 11.671 16.921 1.00 0.00 H new ATOM 0 HA TYR A 117 15.881 8.828 17.266 1.00 0.00 H new ATOM 0 HB2 TYR A 117 18.429 10.166 17.768 1.00 0.00 H new ATOM 0 HB3 TYR A 117 18.066 8.766 16.778 1.00 0.00 H new ATOM 0 HD1 TYR A 117 16.666 11.826 15.264 1.00 0.00 H new ATOM 0 HD2 TYR A 117 20.112 9.431 15.852 1.00 0.00 H new ATOM 0 HE1 TYR A 117 17.777 12.861 13.331 1.00 0.00 H new ATOM 0 HE2 TYR A 117 21.215 10.417 13.922 1.00 0.00 H new ATOM 0 HH TYR A 117 20.719 13.076 12.658 1.00 0.00 H new ATOM 1872 N THR A 118 16.099 8.980 19.788 1.00 0.00 N ATOM 1873 CA THR A 118 16.151 8.945 21.245 1.00 0.00 C ATOM 1874 C THR A 118 17.079 7.887 21.729 1.00 0.00 C ATOM 1875 O THR A 118 16.648 6.824 22.191 1.00 0.00 O ATOM 1876 CB THR A 118 14.788 8.684 21.926 1.00 0.00 C ATOM 1877 OG1 THR A 118 13.784 9.386 21.166 1.00 0.00 O ATOM 1878 CG2 THR A 118 14.777 9.205 23.320 1.00 0.00 C ATOM 0 H THR A 118 15.546 8.226 19.382 1.00 0.00 H new ATOM 0 HA THR A 118 16.494 9.943 21.517 1.00 0.00 H new ATOM 0 HB THR A 118 14.598 7.611 21.959 1.00 0.00 H new ATOM 0 HG1 THR A 118 12.904 9.239 21.572 1.00 0.00 H new ATOM 0 HG21 THR A 118 13.806 9.008 23.775 1.00 0.00 H new ATOM 0 HG22 THR A 118 15.556 8.710 23.900 1.00 0.00 H new ATOM 0 HG23 THR A 118 14.960 10.279 23.308 1.00 0.00 H new ATOM 1886 N TYR A 119 18.400 8.098 21.677 1.00 0.00 N ATOM 1887 CA TYR A 119 19.395 7.170 22.118 1.00 0.00 C ATOM 1888 C TYR A 119 19.339 7.016 23.644 1.00 0.00 C ATOM 1889 O TYR A 119 19.969 6.051 24.071 1.00 0.00 O ATOM 1890 CB TYR A 119 20.845 7.668 21.849 1.00 0.00 C ATOM 1891 CG TYR A 119 21.152 9.023 22.375 1.00 0.00 C ATOM 1892 CD1 TYR A 119 20.660 10.214 21.905 1.00 0.00 C ATOM 1893 CD2 TYR A 119 22.039 9.086 23.476 1.00 0.00 C ATOM 1894 CE1 TYR A 119 21.035 11.421 22.514 1.00 0.00 C ATOM 1895 CE2 TYR A 119 22.431 10.248 24.096 1.00 0.00 C ATOM 1896 CZ TYR A 119 21.899 11.423 23.582 1.00 0.00 C ATOM 1897 OH TYR A 119 22.239 12.616 24.146 1.00 0.00 O ATOM 0 H TYR A 119 18.799 8.961 21.308 1.00 0.00 H new ATOM 0 HA TYR A 119 19.184 6.249 21.574 1.00 0.00 H new ATOM 0 HB2 TYR A 119 21.545 6.957 22.289 1.00 0.00 H new ATOM 0 HB3 TYR A 119 21.021 7.664 20.773 1.00 0.00 H new ATOM 0 HD1 TYR A 119 19.982 10.223 21.064 1.00 0.00 H new ATOM 0 HD2 TYR A 119 22.436 8.156 23.855 1.00 0.00 H new ATOM 0 HE1 TYR A 119 20.642 12.355 22.141 1.00 0.00 H new ATOM 0 HE2 TYR A 119 23.113 10.247 24.934 1.00 0.00 H new ATOM 0 HH TYR A 119 21.713 13.334 23.735 1.00 0.00 H new ATOM 1907 N GLU A 120 18.654 7.912 24.336 1.00 0.00 N ATOM 1908 CA GLU A 120 18.678 7.779 25.799 1.00 0.00 C ATOM 1909 C GLU A 120 17.899 8.866 26.464 1.00 0.00 C ATOM 1910 O GLU A 120 18.297 9.688 27.259 1.00 0.00 O ATOM 1911 CB GLU A 120 20.158 7.704 26.167 1.00 0.00 C ATOM 1912 CG GLU A 120 20.568 8.623 27.359 1.00 0.00 C ATOM 1913 CD GLU A 120 20.027 8.202 28.698 1.00 0.00 C ATOM 1914 OE1 GLU A 120 19.795 6.934 28.727 1.00 0.00 O ATOM 1915 OE2 GLU A 120 19.821 8.900 29.666 1.00 0.00 O ATOM 0 H GLU A 120 18.111 8.686 23.955 1.00 0.00 H new ATOM 0 HA GLU A 120 18.175 6.882 26.160 1.00 0.00 H new ATOM 0 HB2 GLU A 120 20.407 6.672 26.416 1.00 0.00 H new ATOM 0 HB3 GLU A 120 20.752 7.974 25.294 1.00 0.00 H new ATOM 0 HG2 GLU A 120 21.656 8.655 27.417 1.00 0.00 H new ATOM 0 HG3 GLU A 120 20.230 9.638 27.149 1.00 0.00 H new ATOM 1922 N GLY A 121 16.617 8.895 26.110 1.00 0.00 N ATOM 1923 CA GLY A 121 15.825 9.941 26.736 1.00 0.00 C ATOM 1924 C GLY A 121 15.984 11.332 26.228 1.00 0.00 C ATOM 1925 O GLY A 121 15.677 12.266 26.937 1.00 0.00 O ATOM 0 H GLY A 121 16.142 8.271 25.458 1.00 0.00 H new ATOM 0 HA2 GLY A 121 14.774 9.668 26.640 1.00 0.00 H new ATOM 0 HA3 GLY A 121 16.058 9.945 27.801 1.00 0.00 H new ATOM 1929 N VAL A 122 16.501 11.473 24.979 1.00 0.00 N ATOM 1930 CA VAL A 122 16.727 12.780 24.453 1.00 0.00 C ATOM 1931 C VAL A 122 15.906 13.032 23.194 1.00 0.00 C ATOM 1932 O VAL A 122 15.034 13.903 23.276 1.00 0.00 O ATOM 1933 CB VAL A 122 18.232 12.890 24.071 1.00 0.00 C ATOM 1934 CG1 VAL A 122 18.594 14.214 23.435 1.00 0.00 C ATOM 1935 CG2 VAL A 122 19.105 12.714 25.302 1.00 0.00 C ATOM 0 H VAL A 122 16.752 10.703 24.359 1.00 0.00 H new ATOM 0 HA VAL A 122 16.437 13.511 25.208 1.00 0.00 H new ATOM 0 HB VAL A 122 18.408 12.099 23.342 1.00 0.00 H new ATOM 0 HG11 VAL A 122 19.657 14.223 23.194 1.00 0.00 H new ATOM 0 HG12 VAL A 122 18.014 14.350 22.522 1.00 0.00 H new ATOM 0 HG13 VAL A 122 18.373 15.024 24.130 1.00 0.00 H new ATOM 0 HG21 VAL A 122 20.154 12.794 25.018 1.00 0.00 H new ATOM 0 HG22 VAL A 122 18.866 13.488 26.031 1.00 0.00 H new ATOM 0 HG23 VAL A 122 18.921 11.733 25.741 1.00 0.00 H new ATOM 1945 N GLU A 123 16.188 12.341 22.120 1.00 0.00 N ATOM 1946 CA GLU A 123 15.581 12.455 20.836 1.00 0.00 C ATOM 1947 C GLU A 123 16.156 13.653 20.117 1.00 0.00 C ATOM 1948 O GLU A 123 16.150 14.726 20.711 1.00 0.00 O ATOM 1949 CB GLU A 123 14.088 12.915 20.967 1.00 0.00 C ATOM 1950 CG GLU A 123 13.361 12.739 19.598 1.00 0.00 C ATOM 1951 CD GLU A 123 11.904 13.062 19.469 1.00 0.00 C ATOM 1952 OE1 GLU A 123 11.441 13.366 20.664 1.00 0.00 O ATOM 1953 OE2 GLU A 123 11.125 13.087 18.538 1.00 0.00 O ATOM 0 H GLU A 123 16.913 11.624 22.132 1.00 0.00 H new ATOM 0 HA GLU A 123 15.721 11.490 20.348 1.00 0.00 H new ATOM 0 HB2 GLU A 123 13.583 12.330 21.736 1.00 0.00 H new ATOM 0 HB3 GLU A 123 14.045 13.958 21.281 1.00 0.00 H new ATOM 0 HG2 GLU A 123 13.893 13.351 18.869 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.489 11.700 19.296 1.00 0.00 H new ATOM 1960 N ALA A 124 16.606 13.407 18.880 1.00 0.00 N ATOM 1961 CA ALA A 124 17.160 14.508 18.078 1.00 0.00 C ATOM 1962 C ALA A 124 16.373 14.665 16.785 1.00 0.00 C ATOM 1963 O ALA A 124 16.293 13.873 15.896 1.00 0.00 O ATOM 1964 CB ALA A 124 18.634 14.404 17.827 1.00 0.00 C ATOM 0 H ALA A 124 16.600 12.494 18.425 1.00 0.00 H new ATOM 0 HA ALA A 124 17.047 15.413 18.675 1.00 0.00 H new ATOM 0 HB1 ALA A 124 18.962 15.254 17.229 1.00 0.00 H new ATOM 0 HB2 ALA A 124 19.166 14.403 18.778 1.00 0.00 H new ATOM 0 HB3 ALA A 124 18.847 13.479 17.291 1.00 0.00 H new ATOM 1970 N LYS A 125 15.698 15.822 16.689 1.00 0.00 N ATOM 1971 CA LYS A 125 14.867 16.075 15.518 1.00 0.00 C ATOM 1972 C LYS A 125 14.632 17.541 15.441 1.00 0.00 C ATOM 1973 O LYS A 125 15.211 18.277 16.275 1.00 0.00 O ATOM 1974 CB LYS A 125 13.512 15.304 15.605 1.00 0.00 C ATOM 1975 CG LYS A 125 13.370 14.627 16.963 1.00 0.00 C ATOM 1976 CD LYS A 125 13.204 15.688 18.088 1.00 0.00 C ATOM 1977 CE LYS A 125 12.306 16.883 17.767 1.00 0.00 C ATOM 1978 NZ LYS A 125 12.151 17.786 18.922 1.00 0.00 N ATOM 0 H LYS A 125 15.713 16.568 17.385 1.00 0.00 H new ATOM 0 HA LYS A 125 15.374 15.721 14.621 1.00 0.00 H new ATOM 0 HB2 LYS A 125 12.683 15.994 15.448 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.460 14.557 14.813 1.00 0.00 H new ATOM 0 HG2 LYS A 125 12.508 13.960 16.955 1.00 0.00 H new ATOM 0 HG3 LYS A 125 14.247 14.012 17.162 1.00 0.00 H new ATOM 0 HD2 LYS A 125 12.807 15.189 18.972 1.00 0.00 H new ATOM 0 HD3 LYS A 125 14.192 16.064 18.352 1.00 0.00 H new ATOM 0 HE2 LYS A 125 12.727 17.437 16.928 1.00 0.00 H new ATOM 0 HE3 LYS A 125 11.325 16.525 17.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 11.159 17.783 19.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 12.760 17.462 19.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 12.424 18.751 18.647 1.00 0.00 H new ATOM 1992 N ARG A 126 13.812 17.953 14.495 1.00 0.00 N ATOM 1993 CA ARG A 126 13.373 19.304 14.173 1.00 0.00 C ATOM 1994 C ARG A 126 12.644 19.113 12.862 1.00 0.00 C ATOM 1995 O ARG A 126 11.585 19.691 12.802 1.00 0.00 O ATOM 1996 CB ARG A 126 14.381 20.404 14.081 1.00 0.00 C ATOM 1997 CG ARG A 126 14.564 20.927 15.458 1.00 0.00 C ATOM 1998 CD ARG A 126 14.957 22.389 15.378 1.00 0.00 C ATOM 1999 NE ARG A 126 13.827 23.196 15.019 1.00 0.00 N ATOM 2000 CZ ARG A 126 13.073 23.827 15.902 1.00 0.00 C ATOM 2001 NH1 ARG A 126 13.281 23.781 17.214 1.00 0.00 N ATOM 2002 NH2 ARG A 126 12.053 24.551 15.481 1.00 0.00 N ATOM 0 H ARG A 126 13.388 17.276 13.860 1.00 0.00 H new ATOM 0 HA ARG A 126 12.788 19.681 15.012 1.00 0.00 H new ATOM 0 HB2 ARG A 126 15.324 20.033 13.679 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.036 21.191 13.410 1.00 0.00 H new ATOM 0 HG2 ARG A 126 13.643 20.815 16.030 1.00 0.00 H new ATOM 0 HG3 ARG A 126 15.334 20.357 15.979 1.00 0.00 H new ATOM 0 HD2 ARG A 126 15.355 22.717 16.338 1.00 0.00 H new ATOM 0 HD3 ARG A 126 15.751 22.518 14.643 1.00 0.00 H new ATOM 0 HE ARG A 126 13.593 23.288 14.030 1.00 0.00 H new ATOM 0 HH11 ARG A 126 14.058 23.237 17.588 1.00 0.00 H new ATOM 0 HH12 ARG A 126 12.664 24.290 17.846 1.00 0.00 H new ATOM 0 HH21 ARG A 126 11.853 24.619 14.483 1.00 0.00 H new ATOM 0 HH22 ARG A 126 11.464 25.042 16.154 1.00 0.00 H new ATOM 2016 N ILE A 127 13.216 18.350 11.931 1.00 0.00 N ATOM 2017 CA ILE A 127 12.638 17.975 10.686 1.00 0.00 C ATOM 2018 C ILE A 127 13.422 18.269 9.471 1.00 0.00 C ATOM 2019 O ILE A 127 14.308 19.111 9.420 1.00 0.00 O ATOM 2020 CB ILE A 127 11.193 18.505 10.464 1.00 0.00 C ATOM 2021 CG1 ILE A 127 10.241 17.583 11.240 1.00 0.00 C ATOM 2022 CG2 ILE A 127 10.673 18.592 9.038 1.00 0.00 C ATOM 2023 CD1 ILE A 127 10.669 17.100 12.608 1.00 0.00 C ATOM 0 H ILE A 127 14.152 17.965 12.055 1.00 0.00 H new ATOM 0 HA ILE A 127 12.627 16.892 10.809 1.00 0.00 H new ATOM 0 HB ILE A 127 11.231 19.540 10.803 1.00 0.00 H new ATOM 0 HG12 ILE A 127 9.291 18.105 11.354 1.00 0.00 H new ATOM 0 HG13 ILE A 127 10.050 16.706 10.622 1.00 0.00 H new ATOM 0 HG21 ILE A 127 9.654 18.978 9.045 1.00 0.00 H new ATOM 0 HG22 ILE A 127 11.310 19.260 8.458 1.00 0.00 H new ATOM 0 HG23 ILE A 127 10.682 17.600 8.586 1.00 0.00 H new ATOM 0 HD11 ILE A 127 9.893 16.460 13.027 1.00 0.00 H new ATOM 0 HD12 ILE A 127 11.597 16.535 12.520 1.00 0.00 H new ATOM 0 HD13 ILE A 127 10.826 17.957 13.264 1.00 0.00 H new ATOM 2035 N PHE A 128 12.972 17.501 8.450 1.00 0.00 N ATOM 2036 CA PHE A 128 13.313 17.470 7.104 1.00 0.00 C ATOM 2037 C PHE A 128 13.334 18.867 6.464 1.00 0.00 C ATOM 2038 O PHE A 128 12.670 19.748 6.980 1.00 0.00 O ATOM 2039 CB PHE A 128 12.201 16.748 6.284 1.00 0.00 C ATOM 2040 CG PHE A 128 10.840 17.449 6.177 1.00 0.00 C ATOM 2041 CD1 PHE A 128 10.651 18.669 5.537 1.00 0.00 C ATOM 2042 CD2 PHE A 128 9.660 16.918 6.706 1.00 0.00 C ATOM 2043 CE1 PHE A 128 9.471 19.350 5.392 1.00 0.00 C ATOM 2044 CE2 PHE A 128 8.432 17.570 6.590 1.00 0.00 C ATOM 2045 CZ PHE A 128 8.330 18.804 5.923 1.00 0.00 C ATOM 0 H PHE A 128 12.254 16.802 8.639 1.00 0.00 H new ATOM 0 HA PHE A 128 14.289 16.986 7.076 1.00 0.00 H new ATOM 0 HB2 PHE A 128 12.578 16.586 5.274 1.00 0.00 H new ATOM 0 HB3 PHE A 128 12.040 15.765 6.726 1.00 0.00 H new ATOM 0 HD1 PHE A 128 11.529 19.129 5.108 1.00 0.00 H new ATOM 0 HD2 PHE A 128 9.700 15.970 7.222 1.00 0.00 H new ATOM 0 HE1 PHE A 128 9.440 20.296 4.871 1.00 0.00 H new ATOM 0 HE2 PHE A 128 7.548 17.121 7.018 1.00 0.00 H new ATOM 0 HZ PHE A 128 7.379 19.308 5.831 1.00 0.00 H new ATOM 2055 N LYS A 129 14.070 18.813 5.390 1.00 0.00 N ATOM 2056 CA LYS A 129 14.318 19.995 4.582 1.00 0.00 C ATOM 2057 C LYS A 129 13.697 19.757 3.227 1.00 0.00 C ATOM 2058 O LYS A 129 13.835 20.626 2.406 1.00 0.00 O ATOM 2059 CB LYS A 129 15.666 20.631 4.631 1.00 0.00 C ATOM 2060 CG LYS A 129 15.560 22.171 4.630 1.00 0.00 C ATOM 2061 CD LYS A 129 15.170 22.852 3.356 1.00 0.00 C ATOM 2062 CE LYS A 129 13.713 23.335 3.301 1.00 0.00 C ATOM 2063 NZ LYS A 129 12.738 22.688 4.204 1.00 0.00 N ATOM 0 H LYS A 129 14.515 17.963 5.044 1.00 0.00 H new ATOM 0 HA LYS A 129 13.820 20.838 5.060 1.00 0.00 H new ATOM 0 HB2 LYS A 129 16.194 20.301 5.526 1.00 0.00 H new ATOM 0 HB3 LYS A 129 16.256 20.304 3.775 1.00 0.00 H new ATOM 0 HG2 LYS A 129 14.837 22.455 5.394 1.00 0.00 H new ATOM 0 HG3 LYS A 129 16.525 22.571 4.940 1.00 0.00 H new ATOM 0 HD2 LYS A 129 15.827 23.708 3.203 1.00 0.00 H new ATOM 0 HD3 LYS A 129 15.342 22.166 2.527 1.00 0.00 H new ATOM 0 HE2 LYS A 129 13.706 24.404 3.512 1.00 0.00 H new ATOM 0 HE3 LYS A 129 13.357 23.210 2.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 11.867 23.255 4.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 12.517 21.735 3.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 13.143 22.618 5.159 1.00 0.00 H new ATOM 2077 N LYS A 130 13.002 18.663 3.218 1.00 0.00 N ATOM 2078 CA LYS A 130 12.358 18.060 2.112 1.00 0.00 C ATOM 2079 C LYS A 130 12.699 18.703 0.790 1.00 0.00 C ATOM 2080 O LYS A 130 12.867 19.921 0.565 1.00 0.00 O ATOM 2081 CB LYS A 130 10.841 17.932 2.195 1.00 0.00 C ATOM 2082 CG LYS A 130 10.080 17.927 0.838 1.00 0.00 C ATOM 2083 CD LYS A 130 9.423 19.230 0.441 1.00 0.00 C ATOM 2084 CE LYS A 130 7.953 18.993 0.024 1.00 0.00 C ATOM 2085 NZ LYS A 130 7.041 20.037 0.494 1.00 0.00 N ATOM 0 H LYS A 130 12.863 18.124 4.073 1.00 0.00 H new ATOM 0 HA LYS A 130 12.770 17.052 2.164 1.00 0.00 H new ATOM 0 HB2 LYS A 130 10.603 17.010 2.725 1.00 0.00 H new ATOM 0 HB3 LYS A 130 10.460 18.755 2.799 1.00 0.00 H new ATOM 0 HG2 LYS A 130 10.780 17.642 0.053 1.00 0.00 H new ATOM 0 HG3 LYS A 130 9.313 17.154 0.877 1.00 0.00 H new ATOM 0 HD2 LYS A 130 9.462 19.932 1.274 1.00 0.00 H new ATOM 0 HD3 LYS A 130 9.972 19.684 -0.384 1.00 0.00 H new ATOM 0 HE2 LYS A 130 7.896 18.933 -1.063 1.00 0.00 H new ATOM 0 HE3 LYS A 130 7.623 18.030 0.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 6.073 19.819 0.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 7.068 20.080 1.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 7.333 20.955 0.102 1.00 0.00 H new ATOM 2099 N GLU A 131 12.737 17.737 -0.155 1.00 0.00 N ATOM 2100 CA GLU A 131 13.133 18.086 -1.559 1.00 0.00 C ATOM 2101 C GLU A 131 12.343 17.467 -2.669 1.00 0.00 C ATOM 2102 O GLU A 131 12.811 17.078 -3.734 1.00 0.00 O ATOM 2103 CB GLU A 131 14.667 18.097 -1.483 1.00 0.00 C ATOM 2104 CG GLU A 131 15.649 18.736 -2.461 1.00 0.00 C ATOM 2105 CD GLU A 131 15.235 20.119 -2.974 1.00 0.00 C ATOM 2106 OE1 GLU A 131 14.119 20.296 -3.613 1.00 0.00 O ATOM 2107 OE2 GLU A 131 15.983 21.144 -2.791 1.00 0.00 O ATOM 2108 OXT GLU A 131 11.455 18.610 -2.100 1.00 0.00 O ATOM 0 H GLU A 131 12.513 16.755 0.004 1.00 0.00 H new ATOM 0 HA GLU A 131 12.818 19.061 -1.931 1.00 0.00 H new ATOM 0 HB2 GLU A 131 14.901 18.539 -0.515 1.00 0.00 H new ATOM 0 HB3 GLU A 131 14.957 17.048 -1.433 1.00 0.00 H new ATOM 0 HG2 GLU A 131 16.621 18.820 -1.975 1.00 0.00 H new ATOM 0 HG3 GLU A 131 15.776 18.070 -3.315 1.00 0.00 H new