USER MOD reduce.3.24.130724 H: found=0, std=0, add=1349, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1349 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 68 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 178 SER OG : rot 175:sc= -0.622 USER MOD Set 2.1: A 143 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 144 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 109 SER OG : rot 180:sc= -0.938 USER MOD Set 3.2: A 112 GLN : amide:sc= -5.95! C(o=-6.9!,f=-7.6!) USER MOD Set 4.1: A 49 ASN : amide:sc= -0.0494 K(o=-0.73,f=-1.7) USER MOD Set 4.2: A 53 SER OG : rot 2:sc= -0.677 USER MOD Set 5.1: A 44 THR OG1 : rot -64:sc= 0.749 USER MOD Set 5.2: A 48 SER OG : rot 171:sc= 0.28 USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.358 USER MOD Single : A 22 SER OG : rot 180:sc= 0.0744 USER MOD Single : A 23 SER OG : rot 180:sc= -0.172 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= -0.603 K(o=-0.6,f=-7.7!) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -0.439 X(o=-0.44,f=0) USER MOD Single : A 47 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0472) USER MOD Single : A 50 MET CE :methyl 170:sc= -0.807 (180deg=-1.17) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= -0.343 X(o=-0.34,f=-0.023) USER MOD Single : A 62 ASN : amide:sc= -0.176 K(o=-0.18,f=-1.6) USER MOD Single : A 64 ASN : amide:sc= -0.353 K(o=-0.35,f=-3.4!) USER MOD Single : A 67 LYS NZ :NH3+ 149:sc= -0.348 (180deg=-1.69!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=-0.024) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -0.149 K(o=-0.15,f=-1.1) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= -0.721 USER MOD Single : A 98 TYR OH : rot 15:sc= -0.69 USER MOD Single : A 101 TYR OH : rot 180:sc= -2.3! USER MOD Single : A 103 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=-0.039) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= -1.5 K(o=-1.5,f=-4.8!) USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 THR OG1 : rot -29:sc= -0.338 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 GLN : amide:sc= -0.121 K(o=-0.12,f=-2.4!) USER MOD Single : A 128 GLN : amide:sc= -0.851 X(o=-0.85,f=-1.1) USER MOD Single : A 129 LYS NZ :NH3+ -146:sc= -0.101 (180deg=-0.765) USER MOD Single : A 130 LYS NZ :NH3+ -145:sc= 0.131 (180deg=-0.484) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 138 THR OG1 : rot 180:sc= -1.29! USER MOD Single : A 139 THR OG1 : rot 75:sc= 0.934 USER MOD Single : A 145 ASN : amide:sc= -11! C(o=-11!,f=-9!) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 118:sc= 0.994 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 155 GLN : amide:sc= -2.87! C(o=-2.9!,f=-5.5!) USER MOD Single : A 156 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 GLN : amide:sc= 0 X(o=0,f=-0.053) USER MOD Single : A 160 GLN : amide:sc= -2 K(o=-2,f=-5.4!) USER MOD Single : A 162 MET CE :methyl 142:sc= -15.3! (180deg=-23.8!) USER MOD Single : A 163 THR OG1 : rot -0:sc= 0.304 USER MOD Single : A 164 THR OG1 : rot 180:sc= 0 USER MOD Single : A 165 HIS : no HD1:sc= -3.11 K(o=-3.1,f=-2.4) USER MOD Single : A 170 SER OG : rot 180:sc= 0 USER MOD Single : A 172 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 GLN : amide:sc= -3.16 K(o=-3.2,f=-8.6!) USER MOD Single : A 177 SER OG : rot 180:sc= 0 USER MOD Single : A 184 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 185 MET CE :methyl -169:sc= -4.41! (180deg=-4.83!) USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 20 20.323 14.747 3.791 1.00 1.47 N ATOM 2 CA LEU A 20 19.276 14.179 2.897 1.00 1.26 C ATOM 3 C LEU A 20 19.903 13.129 1.980 1.00 1.21 C ATOM 4 O LEU A 20 20.464 13.448 0.951 1.00 1.19 O ATOM 5 CB LEU A 20 18.671 15.297 2.044 1.00 1.09 C ATOM 6 CG LEU A 20 17.560 14.722 1.164 1.00 0.52 C ATOM 7 CD1 LEU A 20 16.249 14.698 1.950 1.00 0.96 C ATOM 8 CD2 LEU A 20 17.393 15.593 -0.083 1.00 0.95 C ATOM 0 HA LEU A 20 18.496 13.717 3.502 1.00 1.26 H new ATOM 0 HB2 LEU A 20 18.272 16.083 2.685 1.00 1.09 H new ATOM 0 HB3 LEU A 20 19.442 15.753 1.423 1.00 1.09 H new ATOM 0 HG LEU A 20 17.822 13.707 0.864 1.00 0.52 H new ATOM 0 HD11 LEU A 20 15.457 14.288 1.324 1.00 0.96 H new ATOM 0 HD12 LEU A 20 16.368 14.076 2.837 1.00 0.96 H new ATOM 0 HD13 LEU A 20 15.986 15.712 2.250 1.00 0.96 H new ATOM 0 HD21 LEU A 20 16.601 15.183 -0.710 1.00 0.95 H new ATOM 0 HD22 LEU A 20 17.131 16.608 0.215 1.00 0.95 H new ATOM 0 HD23 LEU A 20 18.328 15.609 -0.643 1.00 0.95 H new ATOM 20 N THR A 21 19.813 11.878 2.339 1.00 1.36 N ATOM 21 CA THR A 21 20.408 10.818 1.477 1.00 1.44 C ATOM 22 C THR A 21 19.320 10.213 0.588 1.00 1.26 C ATOM 23 O THR A 21 18.145 10.481 0.755 1.00 1.09 O ATOM 24 CB THR A 21 21.028 9.725 2.353 1.00 1.62 C ATOM 25 OG1 THR A 21 21.363 8.606 1.542 1.00 1.50 O ATOM 26 CG2 THR A 21 20.032 9.295 3.429 1.00 1.65 C ATOM 0 H THR A 21 19.356 11.545 3.188 1.00 1.36 H new ATOM 0 HA THR A 21 21.185 11.256 0.850 1.00 1.44 H new ATOM 0 HB THR A 21 21.927 10.113 2.832 1.00 1.62 H new ATOM 0 HG1 THR A 21 21.762 7.906 2.100 1.00 1.50 H new ATOM 0 HG21 THR A 21 20.479 8.518 4.049 1.00 1.65 H new ATOM 0 HG22 THR A 21 19.776 10.152 4.051 1.00 1.65 H new ATOM 0 HG23 THR A 21 19.130 8.908 2.956 1.00 1.65 H new ATOM 34 N SER A 22 19.702 9.405 -0.360 1.00 1.32 N ATOM 35 CA SER A 22 18.694 8.788 -1.269 1.00 1.20 C ATOM 36 C SER A 22 17.604 8.097 -0.446 1.00 1.00 C ATOM 37 O SER A 22 16.426 8.232 -0.719 1.00 0.89 O ATOM 38 CB SER A 22 19.386 7.766 -2.171 1.00 1.39 C ATOM 39 OG SER A 22 20.731 8.167 -2.393 1.00 2.58 O ATOM 0 H SER A 22 20.670 9.144 -0.546 1.00 1.32 H new ATOM 0 HA SER A 22 18.236 9.564 -1.882 1.00 1.20 H new ATOM 0 HB2 SER A 22 19.361 6.780 -1.708 1.00 1.39 H new ATOM 0 HB3 SER A 22 18.857 7.686 -3.121 1.00 1.39 H new ATOM 0 HG SER A 22 21.177 7.512 -2.970 1.00 2.58 H new ATOM 45 N SER A 23 17.981 7.362 0.564 1.00 0.97 N ATOM 46 CA SER A 23 16.956 6.678 1.400 1.00 0.79 C ATOM 47 C SER A 23 16.040 7.733 2.018 1.00 0.66 C ATOM 48 O SER A 23 14.850 7.533 2.152 1.00 0.59 O ATOM 49 CB SER A 23 17.645 5.882 2.508 1.00 0.88 C ATOM 50 OG SER A 23 16.667 5.412 3.426 1.00 1.55 O ATOM 0 H SER A 23 18.949 7.206 0.845 1.00 0.97 H new ATOM 0 HA SER A 23 16.371 5.996 0.784 1.00 0.79 H new ATOM 0 HB2 SER A 23 18.193 5.042 2.081 1.00 0.88 H new ATOM 0 HB3 SER A 23 18.373 6.509 3.023 1.00 0.88 H new ATOM 0 HG SER A 23 17.105 4.900 4.137 1.00 1.55 H new ATOM 56 N GLU A 24 16.582 8.866 2.384 1.00 0.64 N ATOM 57 CA GLU A 24 15.731 9.934 2.975 1.00 0.55 C ATOM 58 C GLU A 24 14.651 10.301 1.960 1.00 0.46 C ATOM 59 O GLU A 24 13.532 10.612 2.312 1.00 0.44 O ATOM 60 CB GLU A 24 16.582 11.168 3.290 1.00 0.60 C ATOM 61 CG GLU A 24 15.927 11.967 4.417 1.00 1.24 C ATOM 62 CD GLU A 24 14.544 12.442 3.969 1.00 2.50 C ATOM 63 OE1 GLU A 24 14.416 12.826 2.818 1.00 3.04 O ATOM 64 OE2 GLU A 24 13.635 12.408 4.782 1.00 3.36 O ATOM 0 H GLU A 24 17.572 9.094 2.299 1.00 0.64 H new ATOM 0 HA GLU A 24 15.277 9.579 3.900 1.00 0.55 H new ATOM 0 HB2 GLU A 24 17.587 10.864 3.582 1.00 0.60 H new ATOM 0 HB3 GLU A 24 16.683 11.790 2.400 1.00 0.60 H new ATOM 0 HG2 GLU A 24 15.839 11.350 5.311 1.00 1.24 H new ATOM 0 HG3 GLU A 24 16.549 12.822 4.680 1.00 1.24 H new ATOM 71 N ARG A 25 14.979 10.254 0.698 1.00 0.48 N ATOM 72 CA ARG A 25 13.970 10.584 -0.346 1.00 0.48 C ATOM 73 C ARG A 25 12.911 9.479 -0.377 1.00 0.55 C ATOM 74 O ARG A 25 11.754 9.723 -0.651 1.00 0.56 O ATOM 75 CB ARG A 25 14.655 10.676 -1.712 1.00 0.60 C ATOM 76 CG ARG A 25 14.574 12.114 -2.228 1.00 0.35 C ATOM 77 CD ARG A 25 15.964 12.576 -2.671 1.00 0.99 C ATOM 78 NE ARG A 25 15.857 13.308 -3.965 1.00 0.38 N ATOM 79 CZ ARG A 25 15.848 12.646 -5.091 1.00 1.52 C ATOM 80 NH1 ARG A 25 14.720 12.209 -5.581 1.00 2.53 N ATOM 81 NH2 ARG A 25 16.966 12.419 -5.724 1.00 2.30 N ATOM 0 H ARG A 25 15.902 10.001 0.345 1.00 0.48 H new ATOM 0 HA ARG A 25 13.501 11.541 -0.117 1.00 0.48 H new ATOM 0 HB2 ARG A 25 15.697 10.366 -1.630 1.00 0.60 H new ATOM 0 HB3 ARG A 25 14.175 9.998 -2.418 1.00 0.60 H new ATOM 0 HG2 ARG A 25 13.876 12.173 -3.063 1.00 0.35 H new ATOM 0 HG3 ARG A 25 14.193 12.771 -1.447 1.00 0.35 H new ATOM 0 HD2 ARG A 25 16.403 13.222 -1.911 1.00 0.99 H new ATOM 0 HD3 ARG A 25 16.626 11.717 -2.781 1.00 0.99 H new ATOM 0 HE ARG A 25 15.791 14.326 -3.971 1.00 0.38 H new ATOM 0 HH11 ARG A 25 13.846 12.385 -5.085 1.00 2.53 H new ATOM 0 HH12 ARG A 25 14.712 11.692 -6.460 1.00 2.53 H new ATOM 0 HH21 ARG A 25 17.848 12.759 -5.340 1.00 2.30 H new ATOM 0 HH22 ARG A 25 16.958 11.902 -6.603 1.00 2.30 H new ATOM 95 N ILE A 26 13.302 8.265 -0.093 1.00 0.62 N ATOM 96 CA ILE A 26 12.324 7.137 -0.095 1.00 0.70 C ATOM 97 C ILE A 26 11.284 7.365 1.017 1.00 0.59 C ATOM 98 O ILE A 26 10.096 7.233 0.805 1.00 0.52 O ATOM 99 CB ILE A 26 13.075 5.820 0.160 1.00 0.85 C ATOM 100 CG1 ILE A 26 13.998 5.511 -1.036 1.00 1.14 C ATOM 101 CG2 ILE A 26 12.080 4.670 0.370 1.00 0.69 C ATOM 102 CD1 ILE A 26 13.183 5.044 -2.251 1.00 0.27 C ATOM 0 H ILE A 26 14.260 8.005 0.141 1.00 0.62 H new ATOM 0 HA ILE A 26 11.817 7.086 -1.059 1.00 0.70 H new ATOM 0 HB ILE A 26 13.678 5.924 1.062 1.00 0.85 H new ATOM 0 HG12 ILE A 26 14.571 6.401 -1.298 1.00 1.14 H new ATOM 0 HG13 ILE A 26 14.716 4.740 -0.757 1.00 1.14 H new ATOM 0 HG21 ILE A 26 12.627 3.744 0.549 1.00 0.69 H new ATOM 0 HG22 ILE A 26 11.446 4.890 1.229 1.00 0.69 H new ATOM 0 HG23 ILE A 26 11.460 4.559 -0.519 1.00 0.69 H new ATOM 0 HD11 ILE A 26 13.857 4.832 -3.081 1.00 0.27 H new ATOM 0 HD12 ILE A 26 12.630 4.141 -1.993 1.00 0.27 H new ATOM 0 HD13 ILE A 26 12.483 5.827 -2.542 1.00 0.27 H new ATOM 114 N ASP A 27 11.729 7.700 2.202 1.00 0.60 N ATOM 115 CA ASP A 27 10.777 7.931 3.331 1.00 0.53 C ATOM 116 C ASP A 27 9.924 9.175 3.052 1.00 0.43 C ATOM 117 O ASP A 27 8.757 9.227 3.387 1.00 0.40 O ATOM 118 CB ASP A 27 11.574 8.140 4.624 1.00 0.68 C ATOM 119 CG ASP A 27 10.614 8.430 5.780 1.00 0.82 C ATOM 120 OD1 ASP A 27 10.058 9.517 5.802 1.00 0.46 O ATOM 121 OD2 ASP A 27 10.452 7.563 6.623 1.00 1.62 O ATOM 0 H ASP A 27 12.714 7.824 2.437 1.00 0.60 H new ATOM 0 HA ASP A 27 10.122 7.066 3.433 1.00 0.53 H new ATOM 0 HB2 ASP A 27 12.167 7.252 4.845 1.00 0.68 H new ATOM 0 HB3 ASP A 27 12.273 8.968 4.502 1.00 0.68 H new ATOM 126 N LYS A 28 10.499 10.178 2.446 1.00 0.47 N ATOM 127 CA LYS A 28 9.730 11.417 2.152 1.00 0.43 C ATOM 128 C LYS A 28 8.737 11.128 1.018 1.00 0.39 C ATOM 129 O LYS A 28 7.727 11.789 0.883 1.00 0.36 O ATOM 130 CB LYS A 28 10.719 12.528 1.752 1.00 0.57 C ATOM 131 CG LYS A 28 9.999 13.658 1.007 1.00 0.47 C ATOM 132 CD LYS A 28 9.974 13.332 -0.487 1.00 1.79 C ATOM 133 CE LYS A 28 10.837 14.342 -1.253 1.00 2.75 C ATOM 134 NZ LYS A 28 10.016 15.029 -2.293 1.00 3.17 N ATOM 0 H LYS A 28 11.472 10.191 2.141 1.00 0.47 H new ATOM 0 HA LYS A 28 9.170 11.745 3.028 1.00 0.43 H new ATOM 0 HB2 LYS A 28 11.205 12.926 2.643 1.00 0.57 H new ATOM 0 HB3 LYS A 28 11.503 12.112 1.120 1.00 0.57 H new ATOM 0 HG2 LYS A 28 8.983 13.771 1.385 1.00 0.47 H new ATOM 0 HG3 LYS A 28 10.509 14.606 1.177 1.00 0.47 H new ATOM 0 HD2 LYS A 28 10.346 12.321 -0.654 1.00 1.79 H new ATOM 0 HD3 LYS A 28 8.949 13.360 -0.858 1.00 1.79 H new ATOM 0 HE2 LYS A 28 11.252 15.076 -0.562 1.00 2.75 H new ATOM 0 HE3 LYS A 28 11.679 13.832 -1.721 1.00 2.75 H new ATOM 0 HZ1 LYS A 28 10.608 15.712 -2.808 1.00 3.17 H new ATOM 0 HZ2 LYS A 28 9.640 14.325 -2.960 1.00 3.17 H new ATOM 0 HZ3 LYS A 28 9.227 15.530 -1.837 1.00 3.17 H new ATOM 148 N GLN A 29 9.014 10.144 0.209 1.00 0.48 N ATOM 149 CA GLN A 29 8.082 9.813 -0.904 1.00 0.45 C ATOM 150 C GLN A 29 6.847 9.128 -0.329 1.00 0.29 C ATOM 151 O GLN A 29 5.727 9.449 -0.679 1.00 0.22 O ATOM 152 CB GLN A 29 8.777 8.876 -1.893 1.00 0.58 C ATOM 153 CG GLN A 29 9.827 9.657 -2.682 1.00 1.12 C ATOM 154 CD GLN A 29 9.384 9.776 -4.141 1.00 1.13 C ATOM 155 OE1 GLN A 29 8.666 8.932 -4.640 1.00 1.94 O ATOM 156 NE2 GLN A 29 9.785 10.795 -4.850 1.00 1.04 N ATOM 0 H GLN A 29 9.845 9.555 0.270 1.00 0.48 H new ATOM 0 HA GLN A 29 7.788 10.725 -1.423 1.00 0.45 H new ATOM 0 HB2 GLN A 29 9.247 8.050 -1.359 1.00 0.58 H new ATOM 0 HB3 GLN A 29 8.045 8.440 -2.573 1.00 0.58 H new ATOM 0 HG2 GLN A 29 9.960 10.648 -2.249 1.00 1.12 H new ATOM 0 HG3 GLN A 29 10.791 9.152 -2.624 1.00 1.12 H new ATOM 0 HE21 GLN A 29 10.388 11.503 -4.430 1.00 1.04 H new ATOM 0 HE22 GLN A 29 9.496 10.884 -5.824 1.00 1.04 H new ATOM 165 N ILE A 30 7.032 8.190 0.561 1.00 0.33 N ATOM 166 CA ILE A 30 5.852 7.510 1.153 1.00 0.22 C ATOM 167 C ILE A 30 5.062 8.533 1.963 1.00 0.16 C ATOM 168 O ILE A 30 3.862 8.441 2.075 1.00 0.15 O ATOM 169 CB ILE A 30 6.287 6.358 2.056 1.00 0.33 C ATOM 170 CG1 ILE A 30 7.066 5.329 1.229 1.00 0.56 C ATOM 171 CG2 ILE A 30 5.048 5.707 2.658 1.00 0.29 C ATOM 172 CD1 ILE A 30 7.368 4.092 2.081 1.00 1.06 C ATOM 0 H ILE A 30 7.940 7.870 0.899 1.00 0.33 H new ATOM 0 HA ILE A 30 5.233 7.098 0.356 1.00 0.22 H new ATOM 0 HB ILE A 30 6.927 6.732 2.855 1.00 0.33 H new ATOM 0 HG12 ILE A 30 6.487 5.043 0.351 1.00 0.56 H new ATOM 0 HG13 ILE A 30 7.996 5.769 0.869 1.00 0.56 H new ATOM 0 HG21 ILE A 30 5.348 4.883 3.305 1.00 0.29 H new ATOM 0 HG22 ILE A 30 4.497 6.444 3.242 1.00 0.29 H new ATOM 0 HG23 ILE A 30 4.411 5.328 1.859 1.00 0.29 H new ATOM 0 HD11 ILE A 30 7.922 3.366 1.485 1.00 1.06 H new ATOM 0 HD12 ILE A 30 7.965 4.383 2.946 1.00 1.06 H new ATOM 0 HD13 ILE A 30 6.433 3.646 2.419 1.00 1.06 H new ATOM 184 N ARG A 31 5.718 9.523 2.515 1.00 0.20 N ATOM 185 CA ARG A 31 4.978 10.561 3.291 1.00 0.23 C ATOM 186 C ARG A 31 3.906 11.154 2.374 1.00 0.23 C ATOM 187 O ARG A 31 2.824 11.519 2.798 1.00 0.23 O ATOM 188 CB ARG A 31 5.946 11.661 3.735 1.00 0.32 C ATOM 189 CG ARG A 31 5.544 12.171 5.120 1.00 0.74 C ATOM 190 CD ARG A 31 4.422 13.201 4.980 1.00 0.81 C ATOM 191 NE ARG A 31 4.896 14.524 5.477 1.00 0.51 N ATOM 192 CZ ARG A 31 4.830 15.574 4.703 1.00 1.77 C ATOM 193 NH1 ARG A 31 5.741 15.770 3.791 1.00 2.78 N ATOM 194 NH2 ARG A 31 3.852 16.428 4.844 1.00 2.40 N ATOM 0 H ARG A 31 6.728 9.656 2.462 1.00 0.20 H new ATOM 0 HA ARG A 31 4.521 10.122 4.178 1.00 0.23 H new ATOM 0 HB2 ARG A 31 6.965 11.274 3.761 1.00 0.32 H new ATOM 0 HB3 ARG A 31 5.934 12.481 3.017 1.00 0.32 H new ATOM 0 HG2 ARG A 31 5.213 11.340 5.743 1.00 0.74 H new ATOM 0 HG3 ARG A 31 6.404 12.620 5.617 1.00 0.74 H new ATOM 0 HD2 ARG A 31 4.116 13.281 3.937 1.00 0.81 H new ATOM 0 HD3 ARG A 31 3.547 12.880 5.546 1.00 0.81 H new ATOM 0 HE ARG A 31 5.272 14.609 6.421 1.00 0.51 H new ATOM 0 HH11 ARG A 31 6.505 15.103 3.682 1.00 2.78 H new ATOM 0 HH12 ARG A 31 5.689 16.590 3.187 1.00 2.78 H new ATOM 0 HH21 ARG A 31 3.140 16.275 5.558 1.00 2.40 H new ATOM 0 HH22 ARG A 31 3.800 17.248 4.240 1.00 2.40 H new ATOM 208 N TYR A 32 4.205 11.212 1.106 1.00 0.23 N ATOM 209 CA TYR A 32 3.230 11.734 0.118 1.00 0.24 C ATOM 210 C TYR A 32 2.150 10.676 -0.068 1.00 0.19 C ATOM 211 O TYR A 32 0.980 10.973 -0.207 1.00 0.21 O ATOM 212 CB TYR A 32 3.947 11.961 -1.215 1.00 0.28 C ATOM 213 CG TYR A 32 3.568 13.304 -1.783 1.00 0.40 C ATOM 214 CD1 TYR A 32 2.252 13.548 -2.187 1.00 0.55 C ATOM 215 CD2 TYR A 32 4.539 14.299 -1.916 1.00 1.29 C ATOM 216 CE1 TYR A 32 1.907 14.793 -2.725 1.00 0.45 C ATOM 217 CE2 TYR A 32 4.197 15.544 -2.452 1.00 1.46 C ATOM 218 CZ TYR A 32 2.881 15.792 -2.858 1.00 0.71 C ATOM 219 OH TYR A 32 2.541 17.020 -3.390 1.00 0.88 O ATOM 0 H TYR A 32 5.097 10.915 0.711 1.00 0.23 H new ATOM 0 HA TYR A 32 2.794 12.673 0.460 1.00 0.24 H new ATOM 0 HB2 TYR A 32 5.026 11.910 -1.070 1.00 0.28 H new ATOM 0 HB3 TYR A 32 3.682 11.172 -1.919 1.00 0.28 H new ATOM 0 HD1 TYR A 32 1.503 12.777 -2.084 1.00 0.55 H new ATOM 0 HD2 TYR A 32 5.555 14.106 -1.604 1.00 1.29 H new ATOM 0 HE1 TYR A 32 0.891 14.984 -3.037 1.00 0.45 H new ATOM 0 HE2 TYR A 32 4.948 16.314 -2.553 1.00 1.46 H new ATOM 0 HH TYR A 32 3.332 17.598 -3.411 1.00 0.88 H new ATOM 229 N ILE A 33 2.547 9.433 -0.069 1.00 0.16 N ATOM 230 CA ILE A 33 1.566 8.333 -0.241 1.00 0.18 C ATOM 231 C ILE A 33 0.505 8.409 0.862 1.00 0.26 C ATOM 232 O ILE A 33 -0.657 8.162 0.629 1.00 0.33 O ATOM 233 CB ILE A 33 2.294 6.989 -0.163 1.00 0.14 C ATOM 234 CG1 ILE A 33 3.358 6.929 -1.263 1.00 0.09 C ATOM 235 CG2 ILE A 33 1.290 5.853 -0.361 1.00 0.19 C ATOM 236 CD1 ILE A 33 4.063 5.572 -1.226 1.00 0.21 C ATOM 0 H ILE A 33 3.516 9.134 0.043 1.00 0.16 H new ATOM 0 HA ILE A 33 1.080 8.429 -1.212 1.00 0.18 H new ATOM 0 HB ILE A 33 2.769 6.885 0.813 1.00 0.14 H new ATOM 0 HG12 ILE A 33 2.896 7.083 -2.238 1.00 0.09 H new ATOM 0 HG13 ILE A 33 4.084 7.730 -1.124 1.00 0.09 H new ATOM 0 HG21 ILE A 33 1.808 4.896 -0.306 1.00 0.19 H new ATOM 0 HG22 ILE A 33 0.529 5.900 0.418 1.00 0.19 H new ATOM 0 HG23 ILE A 33 0.816 5.953 -1.337 1.00 0.19 H new ATOM 0 HD11 ILE A 33 4.819 5.533 -2.010 1.00 0.21 H new ATOM 0 HD12 ILE A 33 4.540 5.436 -0.255 1.00 0.21 H new ATOM 0 HD13 ILE A 33 3.333 4.778 -1.386 1.00 0.21 H new ATOM 248 N LEU A 34 0.901 8.750 2.059 1.00 0.32 N ATOM 249 CA LEU A 34 -0.071 8.838 3.185 1.00 0.41 C ATOM 250 C LEU A 34 -1.015 10.022 2.969 1.00 0.30 C ATOM 251 O LEU A 34 -2.220 9.873 2.984 1.00 0.18 O ATOM 252 CB LEU A 34 0.695 9.032 4.494 1.00 0.53 C ATOM 253 CG LEU A 34 0.469 7.824 5.405 1.00 0.72 C ATOM 254 CD1 LEU A 34 1.259 6.628 4.871 1.00 0.45 C ATOM 255 CD2 LEU A 34 0.948 8.159 6.818 1.00 1.04 C ATOM 0 H LEU A 34 1.865 8.973 2.306 1.00 0.32 H new ATOM 0 HA LEU A 34 -0.656 7.919 3.229 1.00 0.41 H new ATOM 0 HB2 LEU A 34 1.759 9.152 4.290 1.00 0.53 H new ATOM 0 HB3 LEU A 34 0.361 9.943 4.991 1.00 0.53 H new ATOM 0 HG LEU A 34 -0.593 7.578 5.427 1.00 0.72 H new ATOM 0 HD11 LEU A 34 1.098 5.767 5.520 1.00 0.45 H new ATOM 0 HD12 LEU A 34 0.922 6.390 3.862 1.00 0.45 H new ATOM 0 HD13 LEU A 34 2.321 6.873 4.850 1.00 0.45 H new ATOM 0 HD21 LEU A 34 0.788 7.300 7.470 1.00 1.04 H new ATOM 0 HD22 LEU A 34 2.010 8.404 6.794 1.00 1.04 H new ATOM 0 HD23 LEU A 34 0.388 9.013 7.199 1.00 1.04 H new ATOM 267 N ASP A 35 -0.482 11.199 2.760 1.00 0.37 N ATOM 268 CA ASP A 35 -1.362 12.385 2.537 1.00 0.30 C ATOM 269 C ASP A 35 -2.362 12.051 1.436 1.00 0.22 C ATOM 270 O ASP A 35 -3.453 12.582 1.384 1.00 0.12 O ATOM 271 CB ASP A 35 -0.514 13.587 2.115 1.00 0.41 C ATOM 272 CG ASP A 35 -1.228 14.879 2.513 1.00 0.85 C ATOM 273 OD1 ASP A 35 -1.784 14.915 3.599 1.00 1.19 O ATOM 274 OD2 ASP A 35 -1.206 15.812 1.726 1.00 1.49 O ATOM 0 H ASP A 35 0.520 11.389 2.734 1.00 0.37 H new ATOM 0 HA ASP A 35 -1.891 12.632 3.458 1.00 0.30 H new ATOM 0 HB2 ASP A 35 0.466 13.539 2.590 1.00 0.41 H new ATOM 0 HB3 ASP A 35 -0.347 13.568 1.038 1.00 0.41 H new ATOM 279 N GLY A 36 -1.999 11.152 0.568 1.00 0.30 N ATOM 280 CA GLY A 36 -2.926 10.755 -0.516 1.00 0.33 C ATOM 281 C GLY A 36 -4.040 9.897 0.082 1.00 0.25 C ATOM 282 O GLY A 36 -5.203 10.127 -0.157 1.00 0.26 O ATOM 0 H GLY A 36 -1.097 10.676 0.565 1.00 0.30 H new ATOM 0 HA2 GLY A 36 -3.346 11.639 -0.996 1.00 0.33 H new ATOM 0 HA3 GLY A 36 -2.391 10.198 -1.285 1.00 0.33 H new ATOM 286 N ILE A 37 -3.687 8.908 0.863 1.00 0.23 N ATOM 287 CA ILE A 37 -4.722 8.027 1.480 1.00 0.16 C ATOM 288 C ILE A 37 -5.756 8.865 2.228 1.00 0.16 C ATOM 289 O ILE A 37 -6.877 8.437 2.422 1.00 0.26 O ATOM 290 CB ILE A 37 -4.068 7.054 2.468 1.00 0.26 C ATOM 291 CG1 ILE A 37 -2.932 6.289 1.784 1.00 0.45 C ATOM 292 CG2 ILE A 37 -5.117 6.057 2.964 1.00 0.17 C ATOM 293 CD1 ILE A 37 -3.424 5.673 0.471 1.00 0.49 C ATOM 0 H ILE A 37 -2.723 8.673 1.100 1.00 0.23 H new ATOM 0 HA ILE A 37 -5.212 7.469 0.682 1.00 0.16 H new ATOM 0 HB ILE A 37 -3.663 7.619 3.307 1.00 0.26 H new ATOM 0 HG12 ILE A 37 -2.097 6.962 1.588 1.00 0.45 H new ATOM 0 HG13 ILE A 37 -2.562 5.506 2.445 1.00 0.45 H new ATOM 0 HG21 ILE A 37 -4.656 5.363 3.667 1.00 0.17 H new ATOM 0 HG22 ILE A 37 -5.924 6.595 3.462 1.00 0.17 H new ATOM 0 HG23 ILE A 37 -5.520 5.501 2.117 1.00 0.17 H new ATOM 0 HD11 ILE A 37 -2.607 5.132 -0.006 1.00 0.49 H new ATOM 0 HD12 ILE A 37 -4.244 4.985 0.677 1.00 0.49 H new ATOM 0 HD13 ILE A 37 -3.772 6.464 -0.194 1.00 0.49 H new ATOM 305 N SER A 38 -5.412 10.056 2.638 1.00 0.17 N ATOM 306 CA SER A 38 -6.408 10.892 3.351 1.00 0.31 C ATOM 307 C SER A 38 -7.521 11.188 2.363 1.00 0.36 C ATOM 308 O SER A 38 -8.696 11.033 2.646 1.00 0.46 O ATOM 309 CB SER A 38 -5.758 12.197 3.813 1.00 0.37 C ATOM 310 OG SER A 38 -5.637 12.186 5.230 1.00 0.36 O ATOM 0 H SER A 38 -4.493 10.479 2.510 1.00 0.17 H new ATOM 0 HA SER A 38 -6.793 10.378 4.231 1.00 0.31 H new ATOM 0 HB2 SER A 38 -4.776 12.310 3.354 1.00 0.37 H new ATOM 0 HB3 SER A 38 -6.359 13.049 3.494 1.00 0.37 H new ATOM 0 HG SER A 38 -5.219 13.020 5.529 1.00 0.36 H new ATOM 316 N ALA A 39 -7.144 11.576 1.181 1.00 0.35 N ATOM 317 CA ALA A 39 -8.152 11.854 0.142 1.00 0.48 C ATOM 318 C ALA A 39 -8.754 10.528 -0.318 1.00 0.38 C ATOM 319 O ALA A 39 -9.833 10.484 -0.875 1.00 0.39 O ATOM 320 CB ALA A 39 -7.494 12.562 -1.044 1.00 0.60 C ATOM 0 H ALA A 39 -6.175 11.712 0.894 1.00 0.35 H new ATOM 0 HA ALA A 39 -8.933 12.499 0.545 1.00 0.48 H new ATOM 0 HB1 ALA A 39 -8.244 12.765 -1.808 1.00 0.60 H new ATOM 0 HB2 ALA A 39 -7.054 13.501 -0.709 1.00 0.60 H new ATOM 0 HB3 ALA A 39 -6.714 11.925 -1.461 1.00 0.60 H new ATOM 326 N LEU A 40 -8.066 9.438 -0.084 1.00 0.30 N ATOM 327 CA LEU A 40 -8.606 8.121 -0.502 1.00 0.23 C ATOM 328 C LEU A 40 -9.336 7.461 0.667 1.00 0.17 C ATOM 329 O LEU A 40 -9.877 6.385 0.530 1.00 0.18 O ATOM 330 CB LEU A 40 -7.469 7.201 -0.962 1.00 0.24 C ATOM 331 CG LEU A 40 -6.580 7.919 -1.982 1.00 0.37 C ATOM 332 CD1 LEU A 40 -5.602 6.915 -2.594 1.00 0.49 C ATOM 333 CD2 LEU A 40 -7.441 8.529 -3.090 1.00 0.28 C ATOM 0 H LEU A 40 -7.157 9.410 0.378 1.00 0.30 H new ATOM 0 HA LEU A 40 -9.300 8.280 -1.327 1.00 0.23 H new ATOM 0 HB2 LEU A 40 -6.872 6.893 -0.103 1.00 0.24 H new ATOM 0 HB3 LEU A 40 -7.882 6.295 -1.405 1.00 0.24 H new ATOM 0 HG LEU A 40 -6.029 8.714 -1.480 1.00 0.37 H new ATOM 0 HD11 LEU A 40 -4.967 7.422 -3.321 1.00 0.49 H new ATOM 0 HD12 LEU A 40 -4.982 6.486 -1.807 1.00 0.49 H new ATOM 0 HD13 LEU A 40 -6.159 6.121 -3.091 1.00 0.49 H new ATOM 0 HD21 LEU A 40 -6.800 9.037 -3.810 1.00 0.28 H new ATOM 0 HD22 LEU A 40 -7.998 7.739 -3.594 1.00 0.28 H new ATOM 0 HD23 LEU A 40 -8.139 9.245 -2.656 1.00 0.28 H new ATOM 345 N ARG A 41 -9.364 8.086 1.815 1.00 0.29 N ATOM 346 CA ARG A 41 -10.072 7.467 2.968 1.00 0.39 C ATOM 347 C ARG A 41 -10.957 8.504 3.662 1.00 0.53 C ATOM 348 O ARG A 41 -11.472 8.269 4.733 1.00 0.68 O ATOM 349 CB ARG A 41 -9.065 6.905 3.969 1.00 0.39 C ATOM 350 CG ARG A 41 -9.748 5.816 4.797 1.00 0.40 C ATOM 351 CD ARG A 41 -8.783 5.313 5.873 1.00 0.52 C ATOM 352 NE ARG A 41 -9.501 5.188 7.173 1.00 0.77 N ATOM 353 CZ ARG A 41 -9.161 5.945 8.182 1.00 1.11 C ATOM 354 NH1 ARG A 41 -8.822 7.189 7.978 1.00 2.24 N ATOM 355 NH2 ARG A 41 -9.162 5.460 9.394 1.00 0.97 N ATOM 0 H ARG A 41 -8.931 8.990 2.001 1.00 0.29 H new ATOM 0 HA ARG A 41 -10.695 6.655 2.594 1.00 0.39 H new ATOM 0 HB2 ARG A 41 -8.201 6.495 3.446 1.00 0.39 H new ATOM 0 HB3 ARG A 41 -8.697 7.698 4.619 1.00 0.39 H new ATOM 0 HG2 ARG A 41 -10.653 6.210 5.260 1.00 0.40 H new ATOM 0 HG3 ARG A 41 -10.053 4.992 4.152 1.00 0.40 H new ATOM 0 HD2 ARG A 41 -8.369 4.348 5.581 1.00 0.52 H new ATOM 0 HD3 ARG A 41 -7.945 6.002 5.974 1.00 0.52 H new ATOM 0 HE ARG A 41 -10.258 4.512 7.275 1.00 0.77 H new ATOM 0 HH11 ARG A 41 -8.823 7.569 7.031 1.00 2.24 H new ATOM 0 HH12 ARG A 41 -8.556 7.781 8.765 1.00 2.24 H new ATOM 0 HH21 ARG A 41 -9.429 4.489 9.554 1.00 0.97 H new ATOM 0 HH22 ARG A 41 -8.896 6.052 10.181 1.00 0.97 H new ATOM 369 N LYS A 42 -11.153 9.645 3.063 1.00 0.58 N ATOM 370 CA LYS A 42 -12.031 10.661 3.700 1.00 0.71 C ATOM 371 C LYS A 42 -13.464 10.424 3.211 1.00 0.66 C ATOM 372 O LYS A 42 -14.415 10.463 3.973 1.00 0.70 O ATOM 373 CB LYS A 42 -11.573 12.066 3.296 1.00 0.82 C ATOM 374 CG LYS A 42 -12.027 13.080 4.351 1.00 0.89 C ATOM 375 CD LYS A 42 -10.986 14.197 4.469 1.00 1.23 C ATOM 376 CE LYS A 42 -11.693 15.551 4.524 1.00 1.90 C ATOM 377 NZ LYS A 42 -10.870 16.511 5.315 1.00 2.08 N ATOM 0 H LYS A 42 -10.746 9.915 2.167 1.00 0.58 H new ATOM 0 HA LYS A 42 -11.982 10.576 4.786 1.00 0.71 H new ATOM 0 HB2 LYS A 42 -10.488 12.091 3.197 1.00 0.82 H new ATOM 0 HB3 LYS A 42 -11.988 12.329 2.323 1.00 0.82 H new ATOM 0 HG2 LYS A 42 -12.995 13.498 4.075 1.00 0.89 H new ATOM 0 HG3 LYS A 42 -12.156 12.586 5.314 1.00 0.89 H new ATOM 0 HD2 LYS A 42 -10.383 14.053 5.366 1.00 1.23 H new ATOM 0 HD3 LYS A 42 -10.305 14.165 3.619 1.00 1.23 H new ATOM 0 HE2 LYS A 42 -11.848 15.934 3.515 1.00 1.90 H new ATOM 0 HE3 LYS A 42 -12.678 15.441 4.977 1.00 1.90 H new ATOM 0 HZ1 LYS A 42 -11.351 17.432 5.352 1.00 2.08 H new ATOM 0 HZ2 LYS A 42 -10.744 16.147 6.281 1.00 2.08 H new ATOM 0 HZ3 LYS A 42 -9.940 16.624 4.864 1.00 2.08 H new ATOM 391 N GLU A 43 -13.616 10.164 1.938 1.00 0.57 N ATOM 392 CA GLU A 43 -14.968 9.922 1.367 1.00 0.53 C ATOM 393 C GLU A 43 -15.337 8.445 1.507 1.00 0.47 C ATOM 394 O GLU A 43 -16.438 8.109 1.916 1.00 0.50 O ATOM 395 CB GLU A 43 -14.952 10.299 -0.119 1.00 0.53 C ATOM 396 CG GLU A 43 -16.046 11.332 -0.399 1.00 0.67 C ATOM 397 CD GLU A 43 -16.107 11.619 -1.900 1.00 1.23 C ATOM 398 OE1 GLU A 43 -15.054 11.735 -2.505 1.00 1.90 O ATOM 399 OE2 GLU A 43 -17.206 11.714 -2.421 1.00 1.30 O ATOM 0 H GLU A 43 -12.851 10.109 1.266 1.00 0.57 H new ATOM 0 HA GLU A 43 -15.702 10.525 1.901 1.00 0.53 H new ATOM 0 HB2 GLU A 43 -13.977 10.704 -0.391 1.00 0.53 H new ATOM 0 HB3 GLU A 43 -15.111 9.411 -0.731 1.00 0.53 H new ATOM 0 HG2 GLU A 43 -17.009 10.960 -0.050 1.00 0.67 H new ATOM 0 HG3 GLU A 43 -15.841 12.251 0.149 1.00 0.67 H new ATOM 406 N THR A 44 -14.427 7.561 1.162 1.00 0.40 N ATOM 407 CA THR A 44 -14.717 6.094 1.246 1.00 0.35 C ATOM 408 C THR A 44 -14.553 5.560 2.677 1.00 0.35 C ATOM 409 O THR A 44 -14.199 4.417 2.885 1.00 0.29 O ATOM 410 CB THR A 44 -13.777 5.334 0.309 1.00 0.25 C ATOM 411 OG1 THR A 44 -14.143 3.961 0.289 1.00 0.23 O ATOM 412 CG2 THR A 44 -12.338 5.472 0.799 1.00 0.30 C ATOM 0 H THR A 44 -13.493 7.795 0.825 1.00 0.40 H new ATOM 0 HA THR A 44 -15.754 5.941 0.948 1.00 0.35 H new ATOM 0 HB THR A 44 -13.854 5.748 -0.696 1.00 0.25 H new ATOM 0 HG1 THR A 44 -14.010 3.574 1.180 1.00 0.23 H new ATOM 0 HG21 THR A 44 -11.672 4.929 0.129 1.00 0.30 H new ATOM 0 HG22 THR A 44 -12.058 6.525 0.814 1.00 0.30 H new ATOM 0 HG23 THR A 44 -12.255 5.060 1.805 1.00 0.30 H new ATOM 420 N CYS A 45 -14.842 6.362 3.655 1.00 0.55 N ATOM 421 CA CYS A 45 -14.750 5.909 5.063 1.00 0.59 C ATOM 422 C CYS A 45 -15.806 6.688 5.834 1.00 0.72 C ATOM 423 O CYS A 45 -16.577 6.132 6.592 1.00 0.82 O ATOM 424 CB CYS A 45 -13.357 6.193 5.624 1.00 0.62 C ATOM 425 SG CYS A 45 -12.622 4.653 6.239 1.00 0.50 S ATOM 0 H CYS A 45 -15.143 7.329 3.536 1.00 0.55 H new ATOM 0 HA CYS A 45 -14.916 4.835 5.145 1.00 0.59 H new ATOM 0 HB2 CYS A 45 -12.724 6.626 4.850 1.00 0.62 H new ATOM 0 HB3 CYS A 45 -13.421 6.924 6.430 1.00 0.62 H new ATOM 430 N ASN A 46 -15.885 7.974 5.606 1.00 0.73 N ATOM 431 CA ASN A 46 -16.931 8.768 6.286 1.00 0.86 C ATOM 432 C ASN A 46 -18.287 8.334 5.725 1.00 0.83 C ATOM 433 O ASN A 46 -19.128 7.822 6.439 1.00 0.80 O ATOM 434 CB ASN A 46 -16.710 10.257 6.007 1.00 0.98 C ATOM 435 CG ASN A 46 -15.663 10.811 6.976 1.00 1.08 C ATOM 436 OD1 ASN A 46 -15.911 11.778 7.669 1.00 1.67 O ATOM 437 ND2 ASN A 46 -14.495 10.235 7.054 1.00 2.06 N ATOM 0 H ASN A 46 -15.272 8.498 4.982 1.00 0.73 H new ATOM 0 HA ASN A 46 -16.894 8.606 7.363 1.00 0.86 H new ATOM 0 HB2 ASN A 46 -16.379 10.399 4.978 1.00 0.98 H new ATOM 0 HB3 ASN A 46 -17.648 10.801 6.119 1.00 0.98 H new ATOM 0 HD21 ASN A 46 -13.790 10.596 7.697 1.00 2.06 H new ATOM 0 HD22 ASN A 46 -14.287 9.423 6.472 1.00 2.06 H new ATOM 444 N LYS A 47 -18.503 8.518 4.445 1.00 0.86 N ATOM 445 CA LYS A 47 -19.799 8.098 3.843 1.00 0.85 C ATOM 446 C LYS A 47 -19.664 6.692 3.247 1.00 0.92 C ATOM 447 O LYS A 47 -20.333 6.351 2.292 1.00 1.21 O ATOM 448 CB LYS A 47 -20.199 9.084 2.743 1.00 0.90 C ATOM 449 CG LYS A 47 -21.326 9.987 3.252 1.00 1.06 C ATOM 450 CD LYS A 47 -20.988 11.450 2.954 1.00 1.52 C ATOM 451 CE LYS A 47 -21.938 11.985 1.881 1.00 2.06 C ATOM 452 NZ LYS A 47 -21.691 11.277 0.591 1.00 2.32 N ATOM 0 H LYS A 47 -17.838 8.940 3.796 1.00 0.86 H new ATOM 0 HA LYS A 47 -20.566 8.088 4.617 1.00 0.85 H new ATOM 0 HB2 LYS A 47 -19.339 9.687 2.450 1.00 0.90 H new ATOM 0 HB3 LYS A 47 -20.525 8.542 1.855 1.00 0.90 H new ATOM 0 HG2 LYS A 47 -22.267 9.716 2.773 1.00 1.06 H new ATOM 0 HG3 LYS A 47 -21.462 9.846 4.324 1.00 1.06 H new ATOM 0 HD2 LYS A 47 -21.075 12.047 3.862 1.00 1.52 H new ATOM 0 HD3 LYS A 47 -19.955 11.534 2.615 1.00 1.52 H new ATOM 0 HE2 LYS A 47 -22.972 11.841 2.193 1.00 2.06 H new ATOM 0 HE3 LYS A 47 -21.790 13.057 1.752 1.00 2.06 H new ATOM 0 HZ1 LYS A 47 -22.240 11.733 -0.166 1.00 2.32 H new ATOM 0 HZ2 LYS A 47 -20.678 11.321 0.359 1.00 2.32 H new ATOM 0 HZ3 LYS A 47 -21.983 10.283 0.679 1.00 2.32 H new ATOM 466 N SER A 48 -18.792 5.881 3.780 1.00 0.74 N ATOM 467 CA SER A 48 -18.610 4.513 3.211 1.00 0.82 C ATOM 468 C SER A 48 -19.564 3.513 3.876 1.00 1.15 C ATOM 469 O SER A 48 -19.472 2.325 3.649 1.00 1.35 O ATOM 470 CB SER A 48 -17.168 4.059 3.440 1.00 0.43 C ATOM 471 OG SER A 48 -16.599 3.666 2.198 1.00 1.14 O ATOM 0 H SER A 48 -18.200 6.103 4.580 1.00 0.74 H new ATOM 0 HA SER A 48 -18.830 4.549 2.144 1.00 0.82 H new ATOM 0 HB2 SER A 48 -16.585 4.868 3.881 1.00 0.43 H new ATOM 0 HB3 SER A 48 -17.143 3.227 4.144 1.00 0.43 H new ATOM 0 HG SER A 48 -15.639 3.508 2.314 1.00 1.14 H new ATOM 477 N ASN A 49 -20.469 3.972 4.701 1.00 1.36 N ATOM 478 CA ASN A 49 -21.425 3.037 5.378 1.00 1.76 C ATOM 479 C ASN A 49 -20.694 1.799 5.926 1.00 1.65 C ATOM 480 O ASN A 49 -21.292 0.763 6.140 1.00 2.10 O ATOM 481 CB ASN A 49 -22.488 2.588 4.373 1.00 2.10 C ATOM 482 CG ASN A 49 -23.082 3.813 3.675 1.00 3.20 C ATOM 483 OD1 ASN A 49 -23.106 4.893 4.234 1.00 3.41 O ATOM 484 ND2 ASN A 49 -23.568 3.692 2.469 1.00 4.22 N ATOM 0 H ASN A 49 -20.590 4.957 4.938 1.00 1.36 H new ATOM 0 HA ASN A 49 -21.889 3.563 6.212 1.00 1.76 H new ATOM 0 HB2 ASN A 49 -22.047 1.916 3.637 1.00 2.10 H new ATOM 0 HB3 ASN A 49 -23.274 2.031 4.883 1.00 2.10 H new ATOM 0 HD21 ASN A 49 -23.967 4.503 1.996 1.00 4.22 H new ATOM 0 HD22 ASN A 49 -23.548 2.787 2.000 1.00 4.22 H new ATOM 491 N MET A 50 -19.410 1.893 6.154 1.00 1.27 N ATOM 492 CA MET A 50 -18.657 0.722 6.683 1.00 1.31 C ATOM 493 C MET A 50 -17.284 1.185 7.175 1.00 1.13 C ATOM 494 O MET A 50 -16.268 0.597 6.858 1.00 0.95 O ATOM 495 CB MET A 50 -18.480 -0.312 5.571 1.00 1.19 C ATOM 496 CG MET A 50 -19.515 -1.424 5.747 1.00 1.58 C ATOM 497 SD MET A 50 -20.395 -1.688 4.186 1.00 2.29 S ATOM 498 CE MET A 50 -19.098 -2.634 3.350 1.00 0.93 C ATOM 0 H MET A 50 -18.852 2.732 5.996 1.00 1.27 H new ATOM 0 HA MET A 50 -19.208 0.274 7.510 1.00 1.31 H new ATOM 0 HB2 MET A 50 -18.599 0.161 4.596 1.00 1.19 H new ATOM 0 HB3 MET A 50 -17.473 -0.728 5.602 1.00 1.19 H new ATOM 0 HG2 MET A 50 -19.024 -2.346 6.060 1.00 1.58 H new ATOM 0 HG3 MET A 50 -20.221 -1.156 6.533 1.00 1.58 H new ATOM 0 HE1 MET A 50 -19.494 -3.057 2.427 1.00 0.93 H new ATOM 0 HE2 MET A 50 -18.260 -1.976 3.118 1.00 0.93 H new ATOM 0 HE3 MET A 50 -18.758 -3.439 4.001 1.00 0.93 H new ATOM 508 N CYS A 51 -17.246 2.239 7.942 1.00 1.24 N ATOM 509 CA CYS A 51 -15.941 2.748 8.453 1.00 1.16 C ATOM 510 C CYS A 51 -16.222 3.782 9.544 1.00 1.52 C ATOM 511 O CYS A 51 -15.820 3.631 10.681 1.00 1.90 O ATOM 512 CB CYS A 51 -15.166 3.393 7.294 1.00 1.04 C ATOM 513 SG CYS A 51 -13.671 4.216 7.910 1.00 1.22 S ATOM 0 H CYS A 51 -18.064 2.772 8.238 1.00 1.24 H new ATOM 0 HA CYS A 51 -15.344 1.935 8.866 1.00 1.16 H new ATOM 0 HB2 CYS A 51 -14.894 2.632 6.562 1.00 1.04 H new ATOM 0 HB3 CYS A 51 -15.801 4.116 6.781 1.00 1.04 H new ATOM 518 N GLU A 52 -16.925 4.823 9.205 1.00 1.89 N ATOM 519 CA GLU A 52 -17.257 5.865 10.214 1.00 2.27 C ATOM 520 C GLU A 52 -18.745 6.192 10.099 1.00 2.02 C ATOM 521 O GLU A 52 -19.179 7.284 10.407 1.00 2.42 O ATOM 522 CB GLU A 52 -16.430 7.124 9.944 1.00 2.87 C ATOM 523 CG GLU A 52 -14.997 6.910 10.436 1.00 2.91 C ATOM 524 CD GLU A 52 -15.007 6.632 11.940 1.00 2.51 C ATOM 525 OE1 GLU A 52 -15.984 6.982 12.582 1.00 2.66 O ATOM 526 OE2 GLU A 52 -14.037 6.073 12.425 1.00 2.75 O ATOM 0 H GLU A 52 -17.286 4.999 8.267 1.00 1.89 H new ATOM 0 HA GLU A 52 -17.030 5.502 11.217 1.00 2.27 H new ATOM 0 HB2 GLU A 52 -16.430 7.350 8.878 1.00 2.87 H new ATOM 0 HB3 GLU A 52 -16.876 7.980 10.451 1.00 2.87 H new ATOM 0 HG2 GLU A 52 -14.540 6.075 9.905 1.00 2.91 H new ATOM 0 HG3 GLU A 52 -14.393 7.792 10.223 1.00 2.91 H new ATOM 533 N SER A 53 -19.528 5.250 9.645 1.00 1.49 N ATOM 534 CA SER A 53 -20.986 5.495 9.493 1.00 1.52 C ATOM 535 C SER A 53 -21.732 4.972 10.723 1.00 1.75 C ATOM 536 O SER A 53 -22.815 5.424 11.042 1.00 2.67 O ATOM 537 CB SER A 53 -21.495 4.768 8.250 1.00 1.16 C ATOM 538 OG SER A 53 -20.995 5.416 7.087 1.00 1.55 O ATOM 0 H SER A 53 -19.216 4.318 9.372 1.00 1.49 H new ATOM 0 HA SER A 53 -21.161 6.566 9.393 1.00 1.52 H new ATOM 0 HB2 SER A 53 -21.173 3.727 8.267 1.00 1.16 H new ATOM 0 HB3 SER A 53 -22.585 4.764 8.238 1.00 1.16 H new ATOM 0 HG SER A 53 -20.417 6.162 7.351 1.00 1.55 H new ATOM 544 N SER A 54 -21.170 4.017 11.415 1.00 1.28 N ATOM 545 CA SER A 54 -21.860 3.464 12.613 1.00 1.92 C ATOM 546 C SER A 54 -20.912 3.482 13.814 1.00 1.70 C ATOM 547 O SER A 54 -19.948 4.221 13.850 1.00 1.74 O ATOM 548 CB SER A 54 -22.294 2.027 12.328 1.00 3.09 C ATOM 549 OG SER A 54 -22.661 1.909 10.960 1.00 3.53 O ATOM 0 H SER A 54 -20.265 3.598 11.202 1.00 1.28 H new ATOM 0 HA SER A 54 -22.735 4.074 12.839 1.00 1.92 H new ATOM 0 HB2 SER A 54 -21.482 1.337 12.559 1.00 3.09 H new ATOM 0 HB3 SER A 54 -23.135 1.756 12.967 1.00 3.09 H new ATOM 0 HG SER A 54 -22.938 0.988 10.774 1.00 3.53 H new ATOM 555 N LYS A 55 -21.184 2.672 14.802 1.00 2.60 N ATOM 556 CA LYS A 55 -20.304 2.639 16.005 1.00 3.04 C ATOM 557 C LYS A 55 -19.130 1.691 15.754 1.00 2.87 C ATOM 558 O LYS A 55 -18.024 1.927 16.199 1.00 3.36 O ATOM 559 CB LYS A 55 -21.107 2.151 17.216 1.00 4.24 C ATOM 560 CG LYS A 55 -22.481 2.833 17.239 1.00 4.45 C ATOM 561 CD LYS A 55 -22.303 4.353 17.241 1.00 4.90 C ATOM 562 CE LYS A 55 -23.125 4.964 18.379 1.00 6.07 C ATOM 563 NZ LYS A 55 -23.182 6.444 18.214 1.00 6.67 N ATOM 0 H LYS A 55 -21.978 2.032 14.828 1.00 2.60 H new ATOM 0 HA LYS A 55 -19.925 3.641 16.203 1.00 3.04 H new ATOM 0 HB2 LYS A 55 -21.229 1.069 17.171 1.00 4.24 H new ATOM 0 HB3 LYS A 55 -20.566 2.372 18.136 1.00 4.24 H new ATOM 0 HG2 LYS A 55 -23.064 2.527 16.371 1.00 4.45 H new ATOM 0 HG3 LYS A 55 -23.038 2.521 18.123 1.00 4.45 H new ATOM 0 HD2 LYS A 55 -21.250 4.606 17.363 1.00 4.90 H new ATOM 0 HD3 LYS A 55 -22.622 4.768 16.285 1.00 4.90 H new ATOM 0 HE2 LYS A 55 -24.133 4.548 18.377 1.00 6.07 H new ATOM 0 HE3 LYS A 55 -22.678 4.712 19.341 1.00 6.07 H new ATOM 0 HZ1 LYS A 55 -23.740 6.858 18.987 1.00 6.67 H new ATOM 0 HZ2 LYS A 55 -22.218 6.833 18.236 1.00 6.67 H new ATOM 0 HZ3 LYS A 55 -23.628 6.675 17.303 1.00 6.67 H new ATOM 577 N GLU A 56 -19.358 0.623 15.038 1.00 2.44 N ATOM 578 CA GLU A 56 -18.247 -0.334 14.756 1.00 2.20 C ATOM 579 C GLU A 56 -17.818 -0.197 13.290 1.00 1.47 C ATOM 580 O GLU A 56 -16.975 0.613 12.958 1.00 1.66 O ATOM 581 CB GLU A 56 -18.682 -1.786 15.042 1.00 2.32 C ATOM 582 CG GLU A 56 -20.199 -1.950 14.877 1.00 2.57 C ATOM 583 CD GLU A 56 -20.553 -3.439 14.851 1.00 2.81 C ATOM 584 OE1 GLU A 56 -19.901 -4.195 15.552 1.00 3.19 O ATOM 585 OE2 GLU A 56 -21.470 -3.799 14.132 1.00 2.88 O ATOM 0 H GLU A 56 -20.262 0.372 14.637 1.00 2.44 H new ATOM 0 HA GLU A 56 -17.408 -0.097 15.410 1.00 2.20 H new ATOM 0 HB2 GLU A 56 -18.164 -2.465 14.364 1.00 2.32 H new ATOM 0 HB3 GLU A 56 -18.391 -2.063 16.055 1.00 2.32 H new ATOM 0 HG2 GLU A 56 -20.720 -1.456 15.697 1.00 2.57 H new ATOM 0 HG3 GLU A 56 -20.529 -1.471 13.955 1.00 2.57 H new ATOM 592 N ALA A 57 -18.387 -0.976 12.404 1.00 1.14 N ATOM 593 CA ALA A 57 -18.003 -0.875 10.966 1.00 0.61 C ATOM 594 C ALA A 57 -16.479 -0.949 10.825 1.00 1.42 C ATOM 595 O ALA A 57 -15.910 -0.459 9.871 1.00 2.12 O ATOM 596 CB ALA A 57 -18.502 0.456 10.402 1.00 1.11 C ATOM 0 H ALA A 57 -19.099 -1.675 12.615 1.00 1.14 H new ATOM 0 HA ALA A 57 -18.453 -1.701 10.415 1.00 0.61 H new ATOM 0 HB1 ALA A 57 -18.223 0.533 9.351 1.00 1.11 H new ATOM 0 HB2 ALA A 57 -19.587 0.506 10.494 1.00 1.11 H new ATOM 0 HB3 ALA A 57 -18.052 1.278 10.958 1.00 1.11 H new ATOM 602 N LEU A 58 -15.816 -1.557 11.769 1.00 2.18 N ATOM 603 CA LEU A 58 -14.332 -1.659 11.689 1.00 3.20 C ATOM 604 C LEU A 58 -13.945 -2.481 10.457 1.00 2.72 C ATOM 605 O LEU A 58 -13.670 -1.943 9.402 1.00 3.46 O ATOM 606 CB LEU A 58 -13.797 -2.342 12.951 1.00 4.28 C ATOM 607 CG LEU A 58 -13.707 -1.323 14.088 1.00 5.57 C ATOM 608 CD1 LEU A 58 -14.949 -1.435 14.973 1.00 5.92 C ATOM 609 CD2 LEU A 58 -12.458 -1.609 14.927 1.00 6.53 C ATOM 0 H LEU A 58 -16.237 -1.988 12.592 1.00 2.18 H new ATOM 0 HA LEU A 58 -13.902 -0.661 11.609 1.00 3.20 H new ATOM 0 HB2 LEU A 58 -14.453 -3.164 13.237 1.00 4.28 H new ATOM 0 HB3 LEU A 58 -12.814 -2.771 12.755 1.00 4.28 H new ATOM 0 HG LEU A 58 -13.647 -0.317 13.672 1.00 5.57 H new ATOM 0 HD11 LEU A 58 -14.885 -0.709 15.783 1.00 5.92 H new ATOM 0 HD12 LEU A 58 -15.840 -1.236 14.377 1.00 5.92 H new ATOM 0 HD13 LEU A 58 -15.009 -2.440 15.390 1.00 5.92 H new ATOM 0 HD21 LEU A 58 -12.391 -0.884 15.738 1.00 6.53 H new ATOM 0 HD22 LEU A 58 -12.521 -2.615 15.343 1.00 6.53 H new ATOM 0 HD23 LEU A 58 -11.571 -1.532 14.298 1.00 6.53 H new ATOM 621 N ALA A 59 -13.922 -3.781 10.579 1.00 1.54 N ATOM 622 CA ALA A 59 -13.554 -4.634 9.416 1.00 1.00 C ATOM 623 C ALA A 59 -13.588 -6.103 9.840 1.00 0.56 C ATOM 624 O ALA A 59 -12.636 -6.623 10.386 1.00 0.62 O ATOM 625 CB ALA A 59 -12.147 -4.271 8.938 1.00 1.30 C ATOM 0 H ALA A 59 -14.143 -4.288 11.436 1.00 1.54 H new ATOM 0 HA ALA A 59 -14.262 -4.470 8.604 1.00 1.00 H new ATOM 0 HB1 ALA A 59 -11.879 -4.897 8.086 1.00 1.30 H new ATOM 0 HB2 ALA A 59 -12.123 -3.223 8.640 1.00 1.30 H new ATOM 0 HB3 ALA A 59 -11.435 -4.435 9.747 1.00 1.30 H new ATOM 631 N GLU A 60 -14.679 -6.775 9.599 1.00 1.16 N ATOM 632 CA GLU A 60 -14.769 -8.206 9.993 1.00 1.67 C ATOM 633 C GLU A 60 -13.741 -9.018 9.205 1.00 1.33 C ATOM 634 O GLU A 60 -13.321 -10.079 9.623 1.00 1.47 O ATOM 635 CB GLU A 60 -16.174 -8.725 9.694 1.00 2.31 C ATOM 636 CG GLU A 60 -16.542 -9.807 10.709 1.00 3.17 C ATOM 637 CD GLU A 60 -17.105 -11.026 9.974 1.00 3.77 C ATOM 638 OE1 GLU A 60 -16.665 -11.279 8.865 1.00 3.33 O ATOM 639 OE2 GLU A 60 -17.966 -11.684 10.533 1.00 4.83 O ATOM 0 H GLU A 60 -15.510 -6.395 9.147 1.00 1.16 H new ATOM 0 HA GLU A 60 -14.565 -8.306 11.059 1.00 1.67 H new ATOM 0 HB2 GLU A 60 -16.893 -7.907 9.741 1.00 2.31 H new ATOM 0 HB3 GLU A 60 -16.217 -9.130 8.683 1.00 2.31 H new ATOM 0 HG2 GLU A 60 -15.663 -10.092 11.288 1.00 3.17 H new ATOM 0 HG3 GLU A 60 -17.278 -9.423 11.415 1.00 3.17 H new ATOM 646 N ASN A 61 -13.328 -8.528 8.068 1.00 1.05 N ATOM 647 CA ASN A 61 -12.324 -9.271 7.257 1.00 1.11 C ATOM 648 C ASN A 61 -10.978 -8.546 7.333 1.00 1.70 C ATOM 649 O ASN A 61 -10.788 -7.661 8.143 1.00 3.24 O ATOM 650 CB ASN A 61 -12.795 -9.337 5.803 1.00 0.75 C ATOM 651 CG ASN A 61 -13.399 -10.715 5.526 1.00 1.34 C ATOM 652 OD1 ASN A 61 -13.234 -11.258 4.451 1.00 1.38 O ATOM 653 ND2 ASN A 61 -14.097 -11.307 6.456 1.00 2.44 N ATOM 0 H ASN A 61 -13.643 -7.645 7.666 1.00 1.05 H new ATOM 0 HA ASN A 61 -12.212 -10.283 7.645 1.00 1.11 H new ATOM 0 HB2 ASN A 61 -13.534 -8.559 5.613 1.00 0.75 H new ATOM 0 HB3 ASN A 61 -11.958 -9.153 5.129 1.00 0.75 H new ATOM 0 HD21 ASN A 61 -14.504 -12.226 6.281 1.00 2.44 H new ATOM 0 HD22 ASN A 61 -14.235 -10.851 7.358 1.00 2.44 H new ATOM 660 N ASN A 62 -10.040 -8.911 6.501 1.00 0.83 N ATOM 661 CA ASN A 62 -8.712 -8.236 6.541 1.00 1.28 C ATOM 662 C ASN A 62 -8.024 -8.360 5.178 1.00 1.46 C ATOM 663 O ASN A 62 -6.816 -8.276 5.074 1.00 2.54 O ATOM 664 CB ASN A 62 -7.839 -8.898 7.611 1.00 1.53 C ATOM 665 CG ASN A 62 -7.180 -7.820 8.474 1.00 2.28 C ATOM 666 OD1 ASN A 62 -6.597 -6.887 7.961 1.00 3.19 O ATOM 667 ND2 ASN A 62 -7.245 -7.912 9.774 1.00 2.40 N ATOM 0 H ASN A 62 -10.136 -9.644 5.798 1.00 0.83 H new ATOM 0 HA ASN A 62 -8.852 -7.181 6.779 1.00 1.28 H new ATOM 0 HB2 ASN A 62 -8.445 -9.556 8.233 1.00 1.53 H new ATOM 0 HB3 ASN A 62 -7.076 -9.518 7.140 1.00 1.53 H new ATOM 0 HD21 ASN A 62 -6.806 -7.200 10.358 1.00 2.40 H new ATOM 0 HD22 ASN A 62 -7.735 -8.696 10.206 1.00 2.40 H new ATOM 674 N LEU A 63 -8.781 -8.560 4.133 1.00 1.01 N ATOM 675 CA LEU A 63 -8.166 -8.690 2.777 1.00 0.99 C ATOM 676 C LEU A 63 -7.044 -9.731 2.819 1.00 0.88 C ATOM 677 O LEU A 63 -6.881 -10.439 3.793 1.00 0.88 O ATOM 678 CB LEU A 63 -7.598 -7.336 2.336 1.00 1.28 C ATOM 679 CG LEU A 63 -8.589 -6.647 1.393 1.00 1.01 C ATOM 680 CD1 LEU A 63 -8.026 -5.296 0.949 1.00 1.07 C ATOM 681 CD2 LEU A 63 -8.818 -7.525 0.161 1.00 0.70 C ATOM 0 H LEU A 63 -9.798 -8.639 4.158 1.00 1.01 H new ATOM 0 HA LEU A 63 -8.927 -9.009 2.065 1.00 0.99 H new ATOM 0 HB2 LEU A 63 -7.411 -6.707 3.207 1.00 1.28 H new ATOM 0 HB3 LEU A 63 -6.641 -7.478 1.834 1.00 1.28 H new ATOM 0 HG LEU A 63 -9.533 -6.494 1.916 1.00 1.01 H new ATOM 0 HD11 LEU A 63 -8.734 -4.809 0.278 1.00 1.07 H new ATOM 0 HD12 LEU A 63 -7.862 -4.665 1.823 1.00 1.07 H new ATOM 0 HD13 LEU A 63 -7.080 -5.449 0.429 1.00 1.07 H new ATOM 0 HD21 LEU A 63 -9.523 -7.034 -0.510 1.00 0.70 H new ATOM 0 HD22 LEU A 63 -7.871 -7.679 -0.357 1.00 0.70 H new ATOM 0 HD23 LEU A 63 -9.223 -8.488 0.471 1.00 0.70 H new ATOM 693 N ASN A 64 -6.271 -9.833 1.773 1.00 0.81 N ATOM 694 CA ASN A 64 -5.169 -10.836 1.769 1.00 0.74 C ATOM 695 C ASN A 64 -3.875 -10.194 1.270 1.00 0.64 C ATOM 696 O ASN A 64 -3.269 -10.652 0.321 1.00 0.58 O ATOM 697 CB ASN A 64 -5.545 -12.002 0.851 1.00 0.80 C ATOM 698 CG ASN A 64 -4.989 -13.305 1.428 1.00 1.49 C ATOM 699 OD1 ASN A 64 -4.426 -13.316 2.505 1.00 2.07 O ATOM 700 ND2 ASN A 64 -5.123 -14.414 0.752 1.00 1.86 N ATOM 0 H ASN A 64 -6.353 -9.270 0.927 1.00 0.81 H new ATOM 0 HA ASN A 64 -5.017 -11.201 2.785 1.00 0.74 H new ATOM 0 HB2 ASN A 64 -6.629 -12.068 0.754 1.00 0.80 H new ATOM 0 HB3 ASN A 64 -5.145 -11.835 -0.149 1.00 0.80 H new ATOM 0 HD21 ASN A 64 -4.755 -15.288 1.128 1.00 1.86 H new ATOM 0 HD22 ASN A 64 -5.595 -14.406 -0.152 1.00 1.86 H new ATOM 707 N LEU A 65 -3.434 -9.145 1.909 1.00 0.85 N ATOM 708 CA LEU A 65 -2.168 -8.493 1.471 1.00 0.84 C ATOM 709 C LEU A 65 -1.272 -8.209 2.691 1.00 0.91 C ATOM 710 O LEU A 65 -0.887 -7.078 2.910 1.00 1.08 O ATOM 711 CB LEU A 65 -2.493 -7.179 0.756 1.00 0.59 C ATOM 712 CG LEU A 65 -3.180 -6.215 1.726 1.00 0.38 C ATOM 713 CD1 LEU A 65 -2.552 -4.825 1.594 1.00 0.25 C ATOM 714 CD2 LEU A 65 -4.672 -6.130 1.391 1.00 0.23 C ATOM 0 H LEU A 65 -3.893 -8.713 2.711 1.00 0.85 H new ATOM 0 HA LEU A 65 -1.639 -9.159 0.789 1.00 0.84 H new ATOM 0 HB2 LEU A 65 -1.578 -6.729 0.369 1.00 0.59 H new ATOM 0 HB3 LEU A 65 -3.140 -7.371 -0.100 1.00 0.59 H new ATOM 0 HG LEU A 65 -3.055 -6.577 2.746 1.00 0.38 H new ATOM 0 HD11 LEU A 65 -3.041 -4.138 2.285 1.00 0.25 H new ATOM 0 HD12 LEU A 65 -1.489 -4.882 1.830 1.00 0.25 H new ATOM 0 HD13 LEU A 65 -2.678 -4.464 0.573 1.00 0.25 H new ATOM 0 HD21 LEU A 65 -5.161 -5.443 2.082 1.00 0.23 H new ATOM 0 HD22 LEU A 65 -4.796 -5.768 0.371 1.00 0.23 H new ATOM 0 HD23 LEU A 65 -5.122 -7.119 1.482 1.00 0.23 H new ATOM 726 N PRO A 66 -0.957 -9.240 3.453 1.00 1.35 N ATOM 727 CA PRO A 66 -0.103 -9.098 4.647 1.00 1.46 C ATOM 728 C PRO A 66 1.372 -9.014 4.243 1.00 0.93 C ATOM 729 O PRO A 66 1.740 -9.341 3.132 1.00 1.03 O ATOM 730 CB PRO A 66 -0.363 -10.383 5.435 1.00 2.37 C ATOM 731 CG PRO A 66 -0.873 -11.423 4.414 1.00 2.73 C ATOM 732 CD PRO A 66 -1.415 -10.631 3.211 1.00 2.07 C ATOM 0 HA PRO A 66 -0.322 -8.196 5.218 1.00 1.46 H new ATOM 0 HB2 PRO A 66 0.548 -10.731 5.922 1.00 2.37 H new ATOM 0 HB3 PRO A 66 -1.100 -10.215 6.220 1.00 2.37 H new ATOM 0 HG2 PRO A 66 -0.068 -12.091 4.107 1.00 2.73 H new ATOM 0 HG3 PRO A 66 -1.654 -12.045 4.852 1.00 2.73 H new ATOM 0 HD2 PRO A 66 -1.026 -11.020 2.270 1.00 2.07 H new ATOM 0 HD3 PRO A 66 -2.502 -10.688 3.154 1.00 2.07 H new ATOM 740 N LYS A 67 2.219 -8.588 5.140 1.00 0.99 N ATOM 741 CA LYS A 67 3.673 -8.491 4.817 1.00 1.12 C ATOM 742 C LYS A 67 4.396 -7.755 5.945 1.00 0.84 C ATOM 743 O LYS A 67 5.167 -6.844 5.717 1.00 1.22 O ATOM 744 CB LYS A 67 3.866 -7.736 3.496 1.00 1.55 C ATOM 745 CG LYS A 67 4.614 -8.632 2.505 1.00 2.51 C ATOM 746 CD LYS A 67 4.354 -8.149 1.077 1.00 3.32 C ATOM 747 CE LYS A 67 4.554 -9.310 0.099 1.00 4.19 C ATOM 748 NZ LYS A 67 3.659 -10.439 0.480 1.00 3.33 N ATOM 0 H LYS A 67 1.967 -8.302 6.086 1.00 0.99 H new ATOM 0 HA LYS A 67 4.087 -9.494 4.714 1.00 1.12 H new ATOM 0 HB2 LYS A 67 2.899 -7.447 3.084 1.00 1.55 H new ATOM 0 HB3 LYS A 67 4.427 -6.817 3.668 1.00 1.55 H new ATOM 0 HG2 LYS A 67 5.683 -8.612 2.717 1.00 2.51 H new ATOM 0 HG3 LYS A 67 4.286 -9.666 2.615 1.00 2.51 H new ATOM 0 HD2 LYS A 67 3.339 -7.760 0.993 1.00 3.32 H new ATOM 0 HD3 LYS A 67 5.031 -7.331 0.830 1.00 3.32 H new ATOM 0 HE2 LYS A 67 4.335 -8.985 -0.918 1.00 4.19 H new ATOM 0 HE3 LYS A 67 5.594 -9.636 0.112 1.00 4.19 H new ATOM 0 HZ1 LYS A 67 3.382 -10.966 -0.373 1.00 3.33 H new ATOM 0 HZ2 LYS A 67 4.161 -11.075 1.132 1.00 3.33 H new ATOM 0 HZ3 LYS A 67 2.808 -10.065 0.947 1.00 3.33 H new ATOM 762 N MET A 68 4.151 -8.147 7.165 1.00 1.03 N ATOM 763 CA MET A 68 4.819 -7.480 8.318 1.00 0.88 C ATOM 764 C MET A 68 4.347 -8.127 9.615 1.00 0.89 C ATOM 765 O MET A 68 3.167 -8.181 9.901 1.00 0.82 O ATOM 766 CB MET A 68 4.459 -5.992 8.329 1.00 0.74 C ATOM 767 CG MET A 68 5.704 -5.157 8.021 1.00 0.57 C ATOM 768 SD MET A 68 5.213 -3.443 7.714 1.00 0.94 S ATOM 769 CE MET A 68 6.810 -2.850 7.104 1.00 0.22 C ATOM 0 H MET A 68 3.514 -8.904 7.414 1.00 1.03 H new ATOM 0 HA MET A 68 5.900 -7.589 8.226 1.00 0.88 H new ATOM 0 HB2 MET A 68 3.683 -5.790 7.591 1.00 0.74 H new ATOM 0 HB3 MET A 68 4.054 -5.713 9.302 1.00 0.74 H new ATOM 0 HG2 MET A 68 6.403 -5.203 8.856 1.00 0.57 H new ATOM 0 HG3 MET A 68 6.221 -5.561 7.150 1.00 0.57 H new ATOM 0 HE1 MET A 68 6.733 -1.793 6.850 1.00 0.22 H new ATOM 0 HE2 MET A 68 7.567 -2.983 7.877 1.00 0.22 H new ATOM 0 HE3 MET A 68 7.094 -3.416 6.217 1.00 0.22 H new ATOM 779 N ALA A 69 5.257 -8.627 10.406 1.00 1.13 N ATOM 780 CA ALA A 69 4.848 -9.274 11.682 1.00 1.22 C ATOM 781 C ALA A 69 6.077 -9.845 12.394 1.00 1.80 C ATOM 782 O ALA A 69 6.062 -10.970 12.849 1.00 3.59 O ATOM 783 CB ALA A 69 3.869 -10.404 11.374 1.00 1.23 C ATOM 0 H ALA A 69 6.261 -8.615 10.224 1.00 1.13 H new ATOM 0 HA ALA A 69 4.373 -8.536 12.328 1.00 1.22 H new ATOM 0 HB1 ALA A 69 3.564 -10.884 12.304 1.00 1.23 H new ATOM 0 HB2 ALA A 69 2.992 -9.998 10.870 1.00 1.23 H new ATOM 0 HB3 ALA A 69 4.352 -11.138 10.728 1.00 1.23 H new ATOM 789 N GLU A 70 7.131 -9.063 12.491 1.00 1.07 N ATOM 790 CA GLU A 70 8.392 -9.515 13.174 1.00 1.63 C ATOM 791 C GLU A 70 9.260 -10.313 12.194 1.00 1.75 C ATOM 792 O GLU A 70 10.432 -10.039 12.026 1.00 2.04 O ATOM 793 CB GLU A 70 8.086 -10.378 14.409 1.00 2.02 C ATOM 794 CG GLU A 70 6.972 -9.733 15.239 1.00 0.95 C ATOM 795 CD GLU A 70 5.961 -10.802 15.660 1.00 1.96 C ATOM 796 OE1 GLU A 70 6.228 -11.493 16.630 1.00 2.23 O ATOM 797 OE2 GLU A 70 4.937 -10.912 15.005 1.00 2.83 O ATOM 0 H GLU A 70 7.171 -8.114 12.119 1.00 1.07 H new ATOM 0 HA GLU A 70 8.929 -8.626 13.504 1.00 1.63 H new ATOM 0 HB2 GLU A 70 7.785 -11.378 14.098 1.00 2.02 H new ATOM 0 HB3 GLU A 70 8.984 -10.489 15.016 1.00 2.02 H new ATOM 0 HG2 GLU A 70 7.394 -9.250 16.120 1.00 0.95 H new ATOM 0 HG3 GLU A 70 6.475 -8.957 14.658 1.00 0.95 H new ATOM 804 N LYS A 71 8.702 -11.298 11.541 1.00 1.65 N ATOM 805 CA LYS A 71 9.500 -12.105 10.576 1.00 1.99 C ATOM 806 C LYS A 71 10.201 -11.172 9.583 1.00 1.71 C ATOM 807 O LYS A 71 11.265 -11.473 9.080 1.00 1.95 O ATOM 808 CB LYS A 71 8.566 -13.048 9.813 1.00 2.24 C ATOM 809 CG LYS A 71 9.259 -14.396 9.597 1.00 2.72 C ATOM 810 CD LYS A 71 8.281 -15.532 9.911 1.00 2.31 C ATOM 811 CE LYS A 71 8.251 -15.780 11.421 1.00 1.37 C ATOM 812 NZ LYS A 71 6.920 -16.328 11.816 1.00 1.18 N ATOM 0 H LYS A 71 7.726 -11.578 11.636 1.00 1.65 H new ATOM 0 HA LYS A 71 10.247 -12.685 11.117 1.00 1.99 H new ATOM 0 HB2 LYS A 71 7.640 -13.189 10.371 1.00 2.24 H new ATOM 0 HB3 LYS A 71 8.295 -12.609 8.853 1.00 2.24 H new ATOM 0 HG2 LYS A 71 9.607 -14.477 8.567 1.00 2.72 H new ATOM 0 HG3 LYS A 71 10.138 -14.471 10.238 1.00 2.72 H new ATOM 0 HD2 LYS A 71 7.283 -15.276 9.554 1.00 2.31 H new ATOM 0 HD3 LYS A 71 8.583 -16.440 9.389 1.00 2.31 H new ATOM 0 HE2 LYS A 71 9.040 -16.479 11.700 1.00 1.37 H new ATOM 0 HE3 LYS A 71 8.445 -14.850 11.956 1.00 1.37 H new ATOM 0 HZ1 LYS A 71 6.904 -16.495 12.842 1.00 1.18 H new ATOM 0 HZ2 LYS A 71 6.176 -15.647 11.564 1.00 1.18 H new ATOM 0 HZ3 LYS A 71 6.752 -17.225 11.317 1.00 1.18 H new ATOM 826 N ASP A 72 9.613 -10.041 9.302 1.00 1.23 N ATOM 827 CA ASP A 72 10.247 -9.091 8.345 1.00 1.05 C ATOM 828 C ASP A 72 11.544 -8.549 8.948 1.00 1.02 C ATOM 829 O ASP A 72 12.555 -8.448 8.281 1.00 1.28 O ATOM 830 CB ASP A 72 9.289 -7.930 8.066 1.00 0.99 C ATOM 831 CG ASP A 72 8.024 -8.463 7.393 1.00 1.34 C ATOM 832 OD1 ASP A 72 7.459 -9.414 7.907 1.00 2.12 O ATOM 833 OD2 ASP A 72 7.641 -7.910 6.374 1.00 1.74 O ATOM 0 H ASP A 72 8.722 -9.734 9.693 1.00 1.23 H new ATOM 0 HA ASP A 72 10.469 -9.610 7.412 1.00 1.05 H new ATOM 0 HB2 ASP A 72 9.033 -7.424 8.997 1.00 0.99 H new ATOM 0 HB3 ASP A 72 9.772 -7.192 7.425 1.00 0.99 H new ATOM 838 N GLY A 73 11.526 -8.200 10.206 1.00 1.01 N ATOM 839 CA GLY A 73 12.760 -7.666 10.848 1.00 1.43 C ATOM 840 C GLY A 73 12.641 -6.148 11.012 1.00 1.32 C ATOM 841 O GLY A 73 13.625 -5.453 11.156 1.00 1.54 O ATOM 0 H GLY A 73 10.711 -8.262 10.816 1.00 1.01 H new ATOM 0 HA2 GLY A 73 12.908 -8.136 11.820 1.00 1.43 H new ATOM 0 HA3 GLY A 73 13.632 -7.909 10.240 1.00 1.43 H new ATOM 845 N CYS A 74 11.445 -5.628 10.992 1.00 1.03 N ATOM 846 CA CYS A 74 11.276 -4.156 11.147 1.00 0.95 C ATOM 847 C CYS A 74 10.965 -3.829 12.608 1.00 1.14 C ATOM 848 O CYS A 74 10.383 -2.808 12.917 1.00 1.13 O ATOM 849 CB CYS A 74 10.126 -3.678 10.257 1.00 0.85 C ATOM 850 SG CYS A 74 10.776 -3.201 8.636 1.00 0.61 S ATOM 0 H CYS A 74 10.580 -6.156 10.875 1.00 1.03 H new ATOM 0 HA CYS A 74 12.196 -3.651 10.852 1.00 0.95 H new ATOM 0 HB2 CYS A 74 9.385 -4.470 10.145 1.00 0.85 H new ATOM 0 HB3 CYS A 74 9.620 -2.832 10.721 1.00 0.85 H new ATOM 855 N PHE A 75 11.354 -4.687 13.512 1.00 1.37 N ATOM 856 CA PHE A 75 11.084 -4.425 14.953 1.00 1.58 C ATOM 857 C PHE A 75 12.367 -4.653 15.755 1.00 1.67 C ATOM 858 O PHE A 75 13.422 -4.885 15.199 1.00 1.73 O ATOM 859 CB PHE A 75 9.992 -5.377 15.449 1.00 1.79 C ATOM 860 CG PHE A 75 8.690 -5.053 14.756 1.00 1.69 C ATOM 861 CD1 PHE A 75 8.528 -5.354 13.399 1.00 2.67 C ATOM 862 CD2 PHE A 75 7.644 -4.454 15.470 1.00 1.75 C ATOM 863 CE1 PHE A 75 7.322 -5.056 12.754 1.00 2.54 C ATOM 864 CE2 PHE A 75 6.437 -4.157 14.826 1.00 1.84 C ATOM 865 CZ PHE A 75 6.277 -4.458 13.469 1.00 1.59 C ATOM 0 H PHE A 75 11.847 -5.558 13.314 1.00 1.37 H new ATOM 0 HA PHE A 75 10.750 -3.395 15.083 1.00 1.58 H new ATOM 0 HB2 PHE A 75 10.276 -6.410 15.248 1.00 1.79 H new ATOM 0 HB3 PHE A 75 9.875 -5.283 16.529 1.00 1.79 H new ATOM 0 HD1 PHE A 75 9.334 -5.817 12.849 1.00 2.67 H new ATOM 0 HD2 PHE A 75 7.769 -4.221 16.517 1.00 1.75 H new ATOM 0 HE1 PHE A 75 7.198 -5.287 11.706 1.00 2.54 H new ATOM 0 HE2 PHE A 75 5.630 -3.696 15.376 1.00 1.84 H new ATOM 0 HZ PHE A 75 5.346 -4.229 12.972 1.00 1.59 H new ATOM 875 N GLN A 76 12.287 -4.589 17.054 1.00 1.83 N ATOM 876 CA GLN A 76 13.504 -4.801 17.887 1.00 1.90 C ATOM 877 C GLN A 76 13.942 -6.262 17.783 1.00 1.96 C ATOM 878 O GLN A 76 15.101 -6.585 17.953 1.00 1.93 O ATOM 879 CB GLN A 76 13.187 -4.466 19.344 1.00 2.27 C ATOM 880 CG GLN A 76 14.485 -4.412 20.154 1.00 2.75 C ATOM 881 CD GLN A 76 14.204 -3.789 21.522 1.00 3.04 C ATOM 882 OE1 GLN A 76 13.279 -4.186 22.204 1.00 3.66 O ATOM 883 NE2 GLN A 76 14.965 -2.823 21.957 1.00 3.00 N ATOM 0 H GLN A 76 11.431 -4.399 17.576 1.00 1.83 H new ATOM 0 HA GLN A 76 14.307 -4.155 17.532 1.00 1.90 H new ATOM 0 HB2 GLN A 76 12.670 -3.508 19.403 1.00 2.27 H new ATOM 0 HB3 GLN A 76 12.517 -5.217 19.762 1.00 2.27 H new ATOM 0 HG2 GLN A 76 14.893 -5.416 20.276 1.00 2.75 H new ATOM 0 HG3 GLN A 76 15.234 -3.826 19.622 1.00 2.75 H new ATOM 0 HE21 GLN A 76 15.741 -2.489 21.386 1.00 3.00 H new ATOM 0 HE22 GLN A 76 14.784 -2.402 22.868 1.00 3.00 H new ATOM 892 N SER A 77 13.025 -7.148 17.503 1.00 2.14 N ATOM 893 CA SER A 77 13.389 -8.588 17.385 1.00 2.38 C ATOM 894 C SER A 77 14.353 -8.769 16.210 1.00 2.18 C ATOM 895 O SER A 77 13.942 -8.985 15.088 1.00 2.17 O ATOM 896 CB SER A 77 12.125 -9.412 17.135 1.00 2.65 C ATOM 897 OG SER A 77 12.243 -10.668 17.790 1.00 3.63 O ATOM 0 H SER A 77 12.039 -6.936 17.351 1.00 2.14 H new ATOM 0 HA SER A 77 13.866 -8.923 18.306 1.00 2.38 H new ATOM 0 HB2 SER A 77 11.250 -8.877 17.505 1.00 2.65 H new ATOM 0 HB3 SER A 77 11.980 -9.560 16.065 1.00 2.65 H new ATOM 0 HG SER A 77 11.433 -11.197 17.632 1.00 3.63 H new ATOM 903 N GLY A 78 15.631 -8.678 16.457 1.00 2.25 N ATOM 904 CA GLY A 78 16.615 -8.841 15.349 1.00 2.16 C ATOM 905 C GLY A 78 16.281 -7.858 14.224 1.00 1.80 C ATOM 906 O GLY A 78 16.013 -8.249 13.105 1.00 1.73 O ATOM 0 H GLY A 78 16.036 -8.498 17.376 1.00 2.25 H new ATOM 0 HA2 GLY A 78 17.626 -8.661 15.716 1.00 2.16 H new ATOM 0 HA3 GLY A 78 16.590 -9.864 14.973 1.00 2.16 H new ATOM 910 N PHE A 79 16.295 -6.582 14.511 1.00 1.57 N ATOM 911 CA PHE A 79 15.977 -5.571 13.459 1.00 1.25 C ATOM 912 C PHE A 79 16.808 -5.849 12.203 1.00 1.03 C ATOM 913 O PHE A 79 17.776 -6.582 12.237 1.00 1.60 O ATOM 914 CB PHE A 79 16.304 -4.171 13.985 1.00 1.26 C ATOM 915 CG PHE A 79 15.927 -3.138 12.950 1.00 1.02 C ATOM 916 CD1 PHE A 79 14.592 -2.995 12.557 1.00 0.95 C ATOM 917 CD2 PHE A 79 16.915 -2.321 12.384 1.00 1.05 C ATOM 918 CE1 PHE A 79 14.243 -2.036 11.597 1.00 0.92 C ATOM 919 CE2 PHE A 79 16.566 -1.363 11.426 1.00 0.82 C ATOM 920 CZ PHE A 79 15.230 -1.219 11.032 1.00 0.75 C ATOM 0 H PHE A 79 16.513 -6.196 15.430 1.00 1.57 H new ATOM 0 HA PHE A 79 14.918 -5.632 13.210 1.00 1.25 H new ATOM 0 HB2 PHE A 79 15.763 -3.985 14.913 1.00 1.26 H new ATOM 0 HB3 PHE A 79 17.367 -4.098 14.216 1.00 1.26 H new ATOM 0 HD1 PHE A 79 13.830 -3.624 12.994 1.00 0.95 H new ATOM 0 HD2 PHE A 79 17.946 -2.431 12.687 1.00 1.05 H new ATOM 0 HE1 PHE A 79 13.213 -1.927 11.293 1.00 0.92 H new ATOM 0 HE2 PHE A 79 17.328 -0.734 10.990 1.00 0.82 H new ATOM 0 HZ PHE A 79 14.961 -0.479 10.293 1.00 0.75 H new ATOM 930 N ASN A 80 16.440 -5.268 11.096 1.00 0.54 N ATOM 931 CA ASN A 80 17.210 -5.495 9.842 1.00 0.58 C ATOM 932 C ASN A 80 17.206 -4.212 9.011 1.00 0.48 C ATOM 933 O ASN A 80 16.651 -3.206 9.409 1.00 0.90 O ATOM 934 CB ASN A 80 16.563 -6.624 9.037 1.00 0.64 C ATOM 935 CG ASN A 80 17.040 -7.975 9.573 1.00 0.39 C ATOM 936 OD1 ASN A 80 16.240 -8.818 9.929 1.00 1.52 O ATOM 937 ND2 ASN A 80 18.321 -8.220 9.644 1.00 1.39 N ATOM 0 H ASN A 80 15.638 -4.645 11.005 1.00 0.54 H new ATOM 0 HA ASN A 80 18.235 -5.771 10.089 1.00 0.58 H new ATOM 0 HB2 ASN A 80 15.477 -6.557 9.105 1.00 0.64 H new ATOM 0 HB3 ASN A 80 16.822 -6.527 7.983 1.00 0.64 H new ATOM 0 HD21 ASN A 80 18.650 -9.118 9.998 1.00 1.39 H new ATOM 0 HD22 ASN A 80 18.993 -7.513 9.345 1.00 1.39 H new ATOM 944 N GLU A 81 17.820 -4.236 7.863 1.00 0.89 N ATOM 945 CA GLU A 81 17.849 -3.015 7.012 1.00 0.73 C ATOM 946 C GLU A 81 17.584 -3.402 5.557 1.00 0.82 C ATOM 947 O GLU A 81 16.667 -2.910 4.929 1.00 0.84 O ATOM 948 CB GLU A 81 19.223 -2.352 7.120 1.00 0.77 C ATOM 949 CG GLU A 81 19.486 -1.949 8.571 1.00 0.53 C ATOM 950 CD GLU A 81 20.614 -0.917 8.620 1.00 0.93 C ATOM 951 OE1 GLU A 81 21.712 -1.248 8.205 1.00 0.90 O ATOM 952 OE2 GLU A 81 20.360 0.188 9.071 1.00 1.83 O ATOM 0 H GLU A 81 18.303 -5.047 7.477 1.00 0.89 H new ATOM 0 HA GLU A 81 17.081 -2.319 7.349 1.00 0.73 H new ATOM 0 HB2 GLU A 81 19.997 -3.038 6.777 1.00 0.77 H new ATOM 0 HB3 GLU A 81 19.266 -1.475 6.475 1.00 0.77 H new ATOM 0 HG2 GLU A 81 18.580 -1.534 9.014 1.00 0.53 H new ATOM 0 HG3 GLU A 81 19.756 -2.826 9.159 1.00 0.53 H new ATOM 959 N GLU A 82 18.386 -4.276 5.017 1.00 0.89 N ATOM 960 CA GLU A 82 18.190 -4.693 3.602 1.00 0.98 C ATOM 961 C GLU A 82 17.047 -5.708 3.509 1.00 1.00 C ATOM 962 O GLU A 82 16.436 -5.870 2.473 1.00 0.99 O ATOM 963 CB GLU A 82 19.478 -5.331 3.078 1.00 1.22 C ATOM 964 CG GLU A 82 19.307 -5.686 1.599 1.00 1.23 C ATOM 965 CD GLU A 82 19.356 -7.206 1.428 1.00 1.04 C ATOM 966 OE1 GLU A 82 20.447 -7.730 1.274 1.00 1.95 O ATOM 967 OE2 GLU A 82 18.302 -7.820 1.454 1.00 1.69 O ATOM 0 H GLU A 82 19.170 -4.720 5.496 1.00 0.89 H new ATOM 0 HA GLU A 82 17.941 -3.817 3.002 1.00 0.98 H new ATOM 0 HB2 GLU A 82 20.314 -4.643 3.203 1.00 1.22 H new ATOM 0 HB3 GLU A 82 19.713 -6.227 3.653 1.00 1.22 H new ATOM 0 HG2 GLU A 82 18.358 -5.299 1.229 1.00 1.23 H new ATOM 0 HG3 GLU A 82 20.095 -5.218 1.009 1.00 1.23 H new ATOM 974 N THR A 83 16.745 -6.389 4.582 1.00 1.05 N ATOM 975 CA THR A 83 15.639 -7.383 4.537 1.00 1.12 C ATOM 976 C THR A 83 14.312 -6.643 4.641 1.00 0.98 C ATOM 977 O THR A 83 13.355 -6.959 3.962 1.00 1.04 O ATOM 978 CB THR A 83 15.770 -8.363 5.705 1.00 1.27 C ATOM 979 OG1 THR A 83 17.016 -9.039 5.616 1.00 1.41 O ATOM 980 CG2 THR A 83 14.629 -9.381 5.647 1.00 1.28 C ATOM 0 H THR A 83 17.215 -6.299 5.483 1.00 1.05 H new ATOM 0 HA THR A 83 15.685 -7.941 3.602 1.00 1.12 H new ATOM 0 HB THR A 83 15.720 -7.817 6.647 1.00 1.27 H new ATOM 0 HG1 THR A 83 17.102 -9.666 6.364 1.00 1.41 H new ATOM 0 HG21 THR A 83 14.722 -10.079 6.479 1.00 1.28 H new ATOM 0 HG22 THR A 83 13.674 -8.861 5.715 1.00 1.28 H new ATOM 0 HG23 THR A 83 14.678 -9.929 4.706 1.00 1.28 H new ATOM 988 N CYS A 84 14.248 -5.652 5.484 1.00 0.80 N ATOM 989 CA CYS A 84 12.983 -4.891 5.624 1.00 0.70 C ATOM 990 C CYS A 84 12.738 -4.094 4.343 1.00 0.53 C ATOM 991 O CYS A 84 11.663 -4.121 3.777 1.00 0.52 O ATOM 992 CB CYS A 84 13.082 -3.938 6.818 1.00 0.63 C ATOM 993 SG CYS A 84 12.150 -4.621 8.212 1.00 1.56 S ATOM 0 H CYS A 84 15.015 -5.339 6.079 1.00 0.80 H new ATOM 0 HA CYS A 84 12.155 -5.580 5.791 1.00 0.70 H new ATOM 0 HB2 CYS A 84 14.126 -3.796 7.099 1.00 0.63 H new ATOM 0 HB3 CYS A 84 12.689 -2.958 6.549 1.00 0.63 H new ATOM 998 N LEU A 85 13.733 -3.391 3.875 1.00 0.43 N ATOM 999 CA LEU A 85 13.563 -2.598 2.627 1.00 0.32 C ATOM 1000 C LEU A 85 13.155 -3.533 1.486 1.00 0.43 C ATOM 1001 O LEU A 85 12.375 -3.174 0.629 1.00 0.43 O ATOM 1002 CB LEU A 85 14.882 -1.901 2.279 1.00 0.40 C ATOM 1003 CG LEU A 85 14.650 -0.853 1.188 1.00 0.42 C ATOM 1004 CD1 LEU A 85 13.581 0.145 1.643 1.00 0.49 C ATOM 1005 CD2 LEU A 85 15.958 -0.107 0.920 1.00 0.79 C ATOM 0 H LEU A 85 14.656 -3.332 4.304 1.00 0.43 H new ATOM 0 HA LEU A 85 12.788 -1.845 2.774 1.00 0.32 H new ATOM 0 HB2 LEU A 85 15.297 -1.426 3.168 1.00 0.40 H new ATOM 0 HB3 LEU A 85 15.612 -2.636 1.939 1.00 0.40 H new ATOM 0 HG LEU A 85 14.313 -1.349 0.278 1.00 0.42 H new ATOM 0 HD11 LEU A 85 13.421 0.888 0.862 1.00 0.49 H new ATOM 0 HD12 LEU A 85 12.648 -0.384 1.837 1.00 0.49 H new ATOM 0 HD13 LEU A 85 13.912 0.643 2.555 1.00 0.49 H new ATOM 0 HD21 LEU A 85 15.798 0.641 0.143 1.00 0.79 H new ATOM 0 HD22 LEU A 85 16.290 0.385 1.834 1.00 0.79 H new ATOM 0 HD23 LEU A 85 16.719 -0.814 0.591 1.00 0.79 H new ATOM 1017 N VAL A 86 13.665 -4.735 1.470 1.00 0.52 N ATOM 1018 CA VAL A 86 13.286 -5.683 0.385 1.00 0.62 C ATOM 1019 C VAL A 86 11.769 -5.893 0.431 1.00 0.62 C ATOM 1020 O VAL A 86 11.085 -5.725 -0.555 1.00 0.66 O ATOM 1021 CB VAL A 86 14.025 -7.021 0.587 1.00 0.70 C ATOM 1022 CG1 VAL A 86 13.405 -8.132 -0.277 1.00 0.75 C ATOM 1023 CG2 VAL A 86 15.495 -6.851 0.192 1.00 0.74 C ATOM 0 H VAL A 86 14.324 -5.099 2.158 1.00 0.52 H new ATOM 0 HA VAL A 86 13.567 -5.280 -0.588 1.00 0.62 H new ATOM 0 HB VAL A 86 13.940 -7.304 1.636 1.00 0.70 H new ATOM 0 HG11 VAL A 86 13.946 -9.064 -0.114 1.00 0.75 H new ATOM 0 HG12 VAL A 86 12.359 -8.267 -0.001 1.00 0.75 H new ATOM 0 HG13 VAL A 86 13.470 -7.854 -1.329 1.00 0.75 H new ATOM 0 HG21 VAL A 86 16.021 -7.795 0.333 1.00 0.74 H new ATOM 0 HG22 VAL A 86 15.558 -6.553 -0.855 1.00 0.74 H new ATOM 0 HG23 VAL A 86 15.953 -6.083 0.816 1.00 0.74 H new ATOM 1033 N LYS A 87 11.238 -6.257 1.565 1.00 0.61 N ATOM 1034 CA LYS A 87 9.767 -6.472 1.653 1.00 0.63 C ATOM 1035 C LYS A 87 9.040 -5.167 1.323 1.00 0.46 C ATOM 1036 O LYS A 87 7.875 -5.169 0.985 1.00 0.35 O ATOM 1037 CB LYS A 87 9.391 -6.924 3.065 1.00 0.72 C ATOM 1038 CG LYS A 87 8.271 -7.963 2.988 1.00 1.00 C ATOM 1039 CD LYS A 87 8.878 -9.367 2.925 1.00 0.80 C ATOM 1040 CE LYS A 87 9.368 -9.774 4.316 1.00 1.18 C ATOM 1041 NZ LYS A 87 10.369 -10.870 4.188 1.00 2.23 N ATOM 0 H LYS A 87 11.755 -6.414 2.430 1.00 0.61 H new ATOM 0 HA LYS A 87 9.474 -7.243 0.941 1.00 0.63 H new ATOM 0 HB2 LYS A 87 10.261 -7.348 3.566 1.00 0.72 H new ATOM 0 HB3 LYS A 87 9.067 -6.068 3.658 1.00 0.72 H new ATOM 0 HG2 LYS A 87 7.620 -7.876 3.858 1.00 1.00 H new ATOM 0 HG3 LYS A 87 7.654 -7.783 2.108 1.00 1.00 H new ATOM 0 HD2 LYS A 87 8.136 -10.080 2.566 1.00 0.80 H new ATOM 0 HD3 LYS A 87 9.706 -9.385 2.216 1.00 0.80 H new ATOM 0 HE2 LYS A 87 9.813 -8.917 4.822 1.00 1.18 H new ATOM 0 HE3 LYS A 87 8.528 -10.104 4.927 1.00 1.18 H new ATOM 0 HZ1 LYS A 87 10.703 -11.147 5.133 1.00 2.23 H new ATOM 0 HZ2 LYS A 87 9.929 -11.689 3.722 1.00 2.23 H new ATOM 0 HZ3 LYS A 87 11.175 -10.540 3.620 1.00 2.23 H new ATOM 1055 N ILE A 88 9.715 -4.050 1.407 1.00 0.46 N ATOM 1056 CA ILE A 88 9.048 -2.758 1.076 1.00 0.35 C ATOM 1057 C ILE A 88 8.920 -2.669 -0.447 1.00 0.30 C ATOM 1058 O ILE A 88 7.931 -2.200 -0.974 1.00 0.18 O ATOM 1059 CB ILE A 88 9.884 -1.587 1.606 1.00 0.39 C ATOM 1060 CG1 ILE A 88 9.843 -1.590 3.139 1.00 0.50 C ATOM 1061 CG2 ILE A 88 9.319 -0.261 1.084 1.00 0.30 C ATOM 1062 CD1 ILE A 88 8.411 -1.346 3.621 1.00 0.33 C ATOM 0 H ILE A 88 10.693 -3.977 1.689 1.00 0.46 H new ATOM 0 HA ILE A 88 8.062 -2.710 1.539 1.00 0.35 H new ATOM 0 HB ILE A 88 10.913 -1.696 1.263 1.00 0.39 H new ATOM 0 HG12 ILE A 88 10.207 -2.544 3.520 1.00 0.50 H new ATOM 0 HG13 ILE A 88 10.505 -0.818 3.531 1.00 0.50 H new ATOM 0 HG21 ILE A 88 9.919 0.565 1.465 1.00 0.30 H new ATOM 0 HG22 ILE A 88 9.347 -0.257 -0.006 1.00 0.30 H new ATOM 0 HG23 ILE A 88 8.289 -0.147 1.421 1.00 0.30 H new ATOM 0 HD11 ILE A 88 8.388 -1.349 4.711 1.00 0.33 H new ATOM 0 HD12 ILE A 88 8.063 -0.381 3.254 1.00 0.33 H new ATOM 0 HD13 ILE A 88 7.760 -2.134 3.242 1.00 0.33 H new ATOM 1074 N ILE A 89 9.907 -3.146 -1.154 1.00 0.44 N ATOM 1075 CA ILE A 89 9.840 -3.127 -2.642 1.00 0.47 C ATOM 1076 C ILE A 89 8.735 -4.084 -3.060 1.00 0.44 C ATOM 1077 O ILE A 89 7.761 -3.718 -3.689 1.00 0.40 O ATOM 1078 CB ILE A 89 11.168 -3.637 -3.204 1.00 0.56 C ATOM 1079 CG1 ILE A 89 12.318 -2.819 -2.605 1.00 0.42 C ATOM 1080 CG2 ILE A 89 11.175 -3.496 -4.731 1.00 0.77 C ATOM 1081 CD1 ILE A 89 13.655 -3.312 -3.161 1.00 0.79 C ATOM 0 H ILE A 89 10.759 -3.549 -0.764 1.00 0.44 H new ATOM 0 HA ILE A 89 9.647 -2.119 -3.010 1.00 0.47 H new ATOM 0 HB ILE A 89 11.292 -4.688 -2.944 1.00 0.56 H new ATOM 0 HG12 ILE A 89 12.185 -1.763 -2.839 1.00 0.42 H new ATOM 0 HG13 ILE A 89 12.311 -2.908 -1.519 1.00 0.42 H new ATOM 0 HG21 ILE A 89 12.123 -3.861 -5.126 1.00 0.77 H new ATOM 0 HG22 ILE A 89 10.357 -4.080 -5.154 1.00 0.77 H new ATOM 0 HG23 ILE A 89 11.049 -2.447 -5.000 1.00 0.77 H new ATOM 0 HD11 ILE A 89 14.467 -2.726 -2.730 1.00 0.79 H new ATOM 0 HD12 ILE A 89 13.791 -4.363 -2.904 1.00 0.79 H new ATOM 0 HD13 ILE A 89 13.662 -3.200 -4.245 1.00 0.79 H new ATOM 1093 N THR A 90 8.898 -5.315 -2.686 1.00 0.47 N ATOM 1094 CA THR A 90 7.895 -6.360 -3.008 1.00 0.39 C ATOM 1095 C THR A 90 6.543 -5.984 -2.390 1.00 0.32 C ATOM 1096 O THR A 90 5.506 -6.462 -2.805 1.00 0.22 O ATOM 1097 CB THR A 90 8.360 -7.692 -2.411 1.00 0.45 C ATOM 1098 OG1 THR A 90 9.311 -7.458 -1.381 1.00 1.65 O ATOM 1099 CG2 THR A 90 8.989 -8.556 -3.496 1.00 1.79 C ATOM 0 H THR A 90 9.704 -5.650 -2.158 1.00 0.47 H new ATOM 0 HA THR A 90 7.790 -6.446 -4.090 1.00 0.39 H new ATOM 0 HB THR A 90 7.497 -8.210 -1.993 1.00 0.45 H new ATOM 0 HG1 THR A 90 9.602 -8.314 -1.004 1.00 1.65 H new ATOM 0 HG21 THR A 90 9.317 -9.501 -3.064 1.00 1.79 H new ATOM 0 HG22 THR A 90 8.255 -8.750 -4.278 1.00 1.79 H new ATOM 0 HG23 THR A 90 9.846 -8.036 -3.924 1.00 1.79 H new ATOM 1107 N GLY A 91 6.550 -5.140 -1.393 1.00 0.37 N ATOM 1108 CA GLY A 91 5.270 -4.742 -0.740 1.00 0.30 C ATOM 1109 C GLY A 91 4.586 -3.658 -1.568 1.00 0.22 C ATOM 1110 O GLY A 91 3.376 -3.549 -1.586 1.00 0.15 O ATOM 0 H GLY A 91 7.388 -4.709 -1.003 1.00 0.37 H new ATOM 0 HA2 GLY A 91 4.615 -5.608 -0.644 1.00 0.30 H new ATOM 0 HA3 GLY A 91 5.463 -4.375 0.268 1.00 0.30 H new ATOM 1114 N LEU A 92 5.348 -2.853 -2.252 1.00 0.26 N ATOM 1115 CA LEU A 92 4.735 -1.778 -3.076 1.00 0.24 C ATOM 1116 C LEU A 92 4.309 -2.353 -4.432 1.00 0.20 C ATOM 1117 O LEU A 92 3.465 -1.801 -5.109 1.00 0.22 O ATOM 1118 CB LEU A 92 5.748 -0.652 -3.284 1.00 0.35 C ATOM 1119 CG LEU A 92 5.944 0.101 -1.966 1.00 0.15 C ATOM 1120 CD1 LEU A 92 7.351 0.700 -1.922 1.00 0.09 C ATOM 1121 CD2 LEU A 92 4.910 1.224 -1.868 1.00 0.35 C ATOM 0 H LEU A 92 6.367 -2.893 -2.276 1.00 0.26 H new ATOM 0 HA LEU A 92 3.859 -1.381 -2.564 1.00 0.24 H new ATOM 0 HB2 LEU A 92 6.698 -1.061 -3.627 1.00 0.35 H new ATOM 0 HB3 LEU A 92 5.397 0.031 -4.058 1.00 0.35 H new ATOM 0 HG LEU A 92 5.818 -0.588 -1.131 1.00 0.15 H new ATOM 0 HD11 LEU A 92 7.489 1.236 -0.983 1.00 0.09 H new ATOM 0 HD12 LEU A 92 8.089 -0.099 -1.996 1.00 0.09 H new ATOM 0 HD13 LEU A 92 7.479 1.390 -2.756 1.00 0.09 H new ATOM 0 HD21 LEU A 92 5.046 1.763 -0.930 1.00 0.35 H new ATOM 0 HD22 LEU A 92 5.039 1.912 -2.704 1.00 0.35 H new ATOM 0 HD23 LEU A 92 3.907 0.799 -1.900 1.00 0.35 H new ATOM 1133 N LEU A 93 4.875 -3.466 -4.827 1.00 0.15 N ATOM 1134 CA LEU A 93 4.485 -4.085 -6.130 1.00 0.10 C ATOM 1135 C LEU A 93 3.091 -4.700 -5.969 1.00 0.07 C ATOM 1136 O LEU A 93 2.152 -4.382 -6.690 1.00 0.05 O ATOM 1137 CB LEU A 93 5.496 -5.179 -6.495 1.00 0.17 C ATOM 1138 CG LEU A 93 6.863 -4.545 -6.771 1.00 0.26 C ATOM 1139 CD1 LEU A 93 7.980 -5.505 -6.347 1.00 0.36 C ATOM 1140 CD2 LEU A 93 6.988 -4.251 -8.268 1.00 0.22 C ATOM 0 H LEU A 93 5.590 -3.972 -4.304 1.00 0.15 H new ATOM 0 HA LEU A 93 4.474 -3.335 -6.921 1.00 0.10 H new ATOM 0 HB2 LEU A 93 5.576 -5.900 -5.682 1.00 0.17 H new ATOM 0 HB3 LEU A 93 5.154 -5.726 -7.373 1.00 0.17 H new ATOM 0 HG LEU A 93 6.952 -3.619 -6.202 1.00 0.26 H new ATOM 0 HD11 LEU A 93 8.949 -5.047 -6.547 1.00 0.36 H new ATOM 0 HD12 LEU A 93 7.892 -5.718 -5.282 1.00 0.36 H new ATOM 0 HD13 LEU A 93 7.895 -6.434 -6.911 1.00 0.36 H new ATOM 0 HD21 LEU A 93 7.959 -3.800 -8.470 1.00 0.22 H new ATOM 0 HD22 LEU A 93 6.896 -5.180 -8.830 1.00 0.22 H new ATOM 0 HD23 LEU A 93 6.198 -3.564 -8.571 1.00 0.22 H new ATOM 1152 N GLU A 94 2.935 -5.560 -4.999 1.00 0.15 N ATOM 1153 CA GLU A 94 1.602 -6.165 -4.758 1.00 0.22 C ATOM 1154 C GLU A 94 0.648 -5.024 -4.414 1.00 0.21 C ATOM 1155 O GLU A 94 -0.473 -4.960 -4.880 1.00 0.24 O ATOM 1156 CB GLU A 94 1.692 -7.154 -3.591 1.00 0.30 C ATOM 1157 CG GLU A 94 1.379 -8.566 -4.090 1.00 0.52 C ATOM 1158 CD GLU A 94 0.151 -9.106 -3.355 1.00 0.80 C ATOM 1159 OE1 GLU A 94 0.208 -9.206 -2.141 1.00 1.06 O ATOM 1160 OE2 GLU A 94 -0.826 -9.411 -4.020 1.00 1.78 O ATOM 0 H GLU A 94 3.674 -5.867 -4.366 1.00 0.15 H new ATOM 0 HA GLU A 94 1.249 -6.707 -5.635 1.00 0.22 H new ATOM 0 HB2 GLU A 94 2.690 -7.125 -3.153 1.00 0.30 H new ATOM 0 HB3 GLU A 94 0.991 -6.871 -2.806 1.00 0.30 H new ATOM 0 HG2 GLU A 94 1.196 -8.551 -5.164 1.00 0.52 H new ATOM 0 HG3 GLU A 94 2.234 -9.221 -3.921 1.00 0.52 H new ATOM 1167 N PHE A 95 1.109 -4.090 -3.629 1.00 0.19 N ATOM 1168 CA PHE A 95 0.258 -2.921 -3.283 1.00 0.23 C ATOM 1169 C PHE A 95 -0.155 -2.240 -4.584 1.00 0.24 C ATOM 1170 O PHE A 95 -1.220 -1.679 -4.693 1.00 0.33 O ATOM 1171 CB PHE A 95 1.072 -1.931 -2.452 1.00 0.19 C ATOM 1172 CG PHE A 95 0.935 -2.234 -0.981 1.00 0.26 C ATOM 1173 CD1 PHE A 95 0.848 -3.558 -0.535 1.00 0.97 C ATOM 1174 CD2 PHE A 95 0.906 -1.182 -0.061 1.00 0.48 C ATOM 1175 CE1 PHE A 95 0.729 -3.828 0.831 1.00 1.07 C ATOM 1176 CE2 PHE A 95 0.787 -1.450 1.304 1.00 0.38 C ATOM 1177 CZ PHE A 95 0.699 -2.774 1.753 1.00 0.43 C ATOM 0 H PHE A 95 2.040 -4.087 -3.212 1.00 0.19 H new ATOM 0 HA PHE A 95 -0.615 -3.244 -2.716 1.00 0.23 H new ATOM 0 HB2 PHE A 95 2.121 -1.980 -2.743 1.00 0.19 H new ATOM 0 HB3 PHE A 95 0.733 -0.915 -2.653 1.00 0.19 H new ATOM 0 HD1 PHE A 95 0.873 -4.370 -1.246 1.00 0.97 H new ATOM 0 HD2 PHE A 95 0.976 -0.161 -0.406 1.00 0.48 H new ATOM 0 HE1 PHE A 95 0.660 -4.849 1.176 1.00 1.07 H new ATOM 0 HE2 PHE A 95 0.763 -0.636 2.014 1.00 0.38 H new ATOM 0 HZ PHE A 95 0.608 -2.982 2.809 1.00 0.43 H new ATOM 1187 N GLU A 96 0.704 -2.295 -5.567 1.00 0.17 N ATOM 1188 CA GLU A 96 0.404 -1.665 -6.881 1.00 0.19 C ATOM 1189 C GLU A 96 -0.869 -2.277 -7.458 1.00 0.22 C ATOM 1190 O GLU A 96 -1.727 -1.573 -7.955 1.00 0.24 O ATOM 1191 CB GLU A 96 1.570 -1.907 -7.837 1.00 0.18 C ATOM 1192 CG GLU A 96 1.615 -0.790 -8.881 1.00 0.50 C ATOM 1193 CD GLU A 96 0.387 -0.890 -9.789 1.00 1.27 C ATOM 1194 OE1 GLU A 96 0.359 -1.787 -10.616 1.00 1.37 O ATOM 1195 OE2 GLU A 96 -0.503 -0.070 -9.643 1.00 2.11 O ATOM 0 H GLU A 96 1.612 -2.756 -5.512 1.00 0.17 H new ATOM 0 HA GLU A 96 0.261 -0.592 -6.749 1.00 0.19 H new ATOM 0 HB2 GLU A 96 2.508 -1.939 -7.283 1.00 0.18 H new ATOM 0 HB3 GLU A 96 1.457 -2.874 -8.328 1.00 0.18 H new ATOM 0 HG2 GLU A 96 1.638 0.182 -8.388 1.00 0.50 H new ATOM 0 HG3 GLU A 96 2.526 -0.868 -9.474 1.00 0.50 H new ATOM 1202 N VAL A 97 -1.016 -3.577 -7.397 1.00 0.23 N ATOM 1203 CA VAL A 97 -2.272 -4.179 -7.942 1.00 0.26 C ATOM 1204 C VAL A 97 -3.445 -3.657 -7.108 1.00 0.29 C ATOM 1205 O VAL A 97 -4.539 -3.447 -7.606 1.00 0.40 O ATOM 1206 CB VAL A 97 -2.211 -5.717 -7.903 1.00 0.25 C ATOM 1207 CG1 VAL A 97 -2.173 -6.230 -6.461 1.00 0.31 C ATOM 1208 CG2 VAL A 97 -3.449 -6.290 -8.599 1.00 0.38 C ATOM 0 H VAL A 97 -0.341 -4.233 -7.005 1.00 0.23 H new ATOM 0 HA VAL A 97 -2.399 -3.894 -8.986 1.00 0.26 H new ATOM 0 HB VAL A 97 -1.302 -6.037 -8.413 1.00 0.25 H new ATOM 0 HG11 VAL A 97 -2.130 -7.319 -6.463 1.00 0.31 H new ATOM 0 HG12 VAL A 97 -1.292 -5.833 -5.957 1.00 0.31 H new ATOM 0 HG13 VAL A 97 -3.070 -5.903 -5.935 1.00 0.31 H new ATOM 0 HG21 VAL A 97 -3.409 -7.379 -8.573 1.00 0.38 H new ATOM 0 HG22 VAL A 97 -4.347 -5.947 -8.085 1.00 0.38 H new ATOM 0 HG23 VAL A 97 -3.473 -5.952 -9.635 1.00 0.38 H new ATOM 1218 N TYR A 98 -3.219 -3.401 -5.844 1.00 0.20 N ATOM 1219 CA TYR A 98 -4.310 -2.853 -4.997 1.00 0.23 C ATOM 1220 C TYR A 98 -4.579 -1.424 -5.458 1.00 0.19 C ATOM 1221 O TYR A 98 -5.683 -0.923 -5.371 1.00 0.26 O ATOM 1222 CB TYR A 98 -3.886 -2.870 -3.528 1.00 0.24 C ATOM 1223 CG TYR A 98 -4.132 -4.249 -2.966 1.00 0.39 C ATOM 1224 CD1 TYR A 98 -5.426 -4.633 -2.596 1.00 0.82 C ATOM 1225 CD2 TYR A 98 -3.068 -5.148 -2.825 1.00 0.38 C ATOM 1226 CE1 TYR A 98 -5.657 -5.913 -2.082 1.00 1.10 C ATOM 1227 CE2 TYR A 98 -3.299 -6.430 -2.310 1.00 0.65 C ATOM 1228 CZ TYR A 98 -4.594 -6.813 -1.939 1.00 0.98 C ATOM 1229 OH TYR A 98 -4.820 -8.077 -1.432 1.00 1.29 O ATOM 0 H TYR A 98 -2.329 -3.548 -5.368 1.00 0.20 H new ATOM 0 HA TYR A 98 -5.213 -3.455 -5.093 1.00 0.23 H new ATOM 0 HB2 TYR A 98 -2.832 -2.608 -3.436 1.00 0.24 H new ATOM 0 HB3 TYR A 98 -4.449 -2.127 -2.964 1.00 0.24 H new ATOM 0 HD1 TYR A 98 -6.247 -3.940 -2.708 1.00 0.82 H new ATOM 0 HD2 TYR A 98 -2.070 -4.853 -3.113 1.00 0.38 H new ATOM 0 HE1 TYR A 98 -6.656 -6.207 -1.795 1.00 1.10 H new ATOM 0 HE2 TYR A 98 -2.478 -7.123 -2.199 1.00 0.65 H new ATOM 0 HH TYR A 98 -5.781 -8.269 -1.447 1.00 1.29 H new ATOM 1239 N LEU A 99 -3.578 -0.785 -6.002 1.00 0.17 N ATOM 1240 CA LEU A 99 -3.769 0.583 -6.532 1.00 0.27 C ATOM 1241 C LEU A 99 -4.590 0.446 -7.804 1.00 0.41 C ATOM 1242 O LEU A 99 -5.343 1.321 -8.168 1.00 0.48 O ATOM 1243 CB LEU A 99 -2.413 1.220 -6.838 1.00 0.29 C ATOM 1244 CG LEU A 99 -1.636 1.408 -5.533 1.00 0.28 C ATOM 1245 CD1 LEU A 99 -0.298 2.090 -5.828 1.00 0.46 C ATOM 1246 CD2 LEU A 99 -2.451 2.278 -4.575 1.00 0.58 C ATOM 0 H LEU A 99 -2.634 -1.159 -6.099 1.00 0.17 H new ATOM 0 HA LEU A 99 -4.276 1.221 -5.808 1.00 0.27 H new ATOM 0 HB2 LEU A 99 -1.848 0.588 -7.523 1.00 0.29 H new ATOM 0 HB3 LEU A 99 -2.553 2.181 -7.333 1.00 0.29 H new ATOM 0 HG LEU A 99 -1.454 0.435 -5.076 1.00 0.28 H new ATOM 0 HD11 LEU A 99 0.255 2.224 -4.898 1.00 0.46 H new ATOM 0 HD12 LEU A 99 0.284 1.470 -6.510 1.00 0.46 H new ATOM 0 HD13 LEU A 99 -0.478 3.063 -6.286 1.00 0.46 H new ATOM 0 HD21 LEU A 99 -1.898 2.412 -3.645 1.00 0.58 H new ATOM 0 HD22 LEU A 99 -2.633 3.250 -5.032 1.00 0.58 H new ATOM 0 HD23 LEU A 99 -3.404 1.792 -4.364 1.00 0.58 H new ATOM 1258 N GLU A 100 -4.495 -0.694 -8.451 1.00 0.49 N ATOM 1259 CA GLU A 100 -5.319 -0.939 -9.657 1.00 0.64 C ATOM 1260 C GLU A 100 -6.764 -0.863 -9.185 1.00 0.58 C ATOM 1261 O GLU A 100 -7.643 -0.360 -9.857 1.00 0.63 O ATOM 1262 CB GLU A 100 -5.025 -2.344 -10.194 1.00 0.76 C ATOM 1263 CG GLU A 100 -5.191 -2.370 -11.712 1.00 0.89 C ATOM 1264 CD GLU A 100 -6.375 -3.266 -12.080 1.00 2.39 C ATOM 1265 OE1 GLU A 100 -7.398 -3.164 -11.424 1.00 2.47 O ATOM 1266 OE2 GLU A 100 -6.239 -4.041 -13.013 1.00 3.72 O ATOM 0 H GLU A 100 -3.877 -1.461 -8.187 1.00 0.49 H new ATOM 0 HA GLU A 100 -5.113 -0.220 -10.450 1.00 0.64 H new ATOM 0 HB2 GLU A 100 -4.011 -2.639 -9.926 1.00 0.76 H new ATOM 0 HB3 GLU A 100 -5.699 -3.066 -9.734 1.00 0.76 H new ATOM 0 HG2 GLU A 100 -5.355 -1.360 -12.088 1.00 0.89 H new ATOM 0 HG3 GLU A 100 -4.280 -2.741 -12.182 1.00 0.89 H new ATOM 1273 N TYR A 101 -6.984 -1.346 -7.991 1.00 0.49 N ATOM 1274 CA TYR A 101 -8.335 -1.306 -7.389 1.00 0.45 C ATOM 1275 C TYR A 101 -8.787 0.142 -7.266 1.00 0.41 C ATOM 1276 O TYR A 101 -9.869 0.511 -7.675 1.00 0.42 O ATOM 1277 CB TYR A 101 -8.266 -1.931 -5.995 1.00 0.39 C ATOM 1278 CG TYR A 101 -9.348 -2.964 -5.854 1.00 0.46 C ATOM 1279 CD1 TYR A 101 -9.399 -4.046 -6.740 1.00 0.64 C ATOM 1280 CD2 TYR A 101 -10.302 -2.840 -4.840 1.00 0.39 C ATOM 1281 CE1 TYR A 101 -10.407 -5.004 -6.614 1.00 0.73 C ATOM 1282 CE2 TYR A 101 -11.310 -3.800 -4.713 1.00 0.45 C ATOM 1283 CZ TYR A 101 -11.365 -4.880 -5.600 1.00 0.62 C ATOM 1284 OH TYR A 101 -12.364 -5.822 -5.475 1.00 0.70 O ATOM 0 H TYR A 101 -6.268 -1.772 -7.403 1.00 0.49 H new ATOM 0 HA TYR A 101 -9.040 -1.856 -8.013 1.00 0.45 H new ATOM 0 HB2 TYR A 101 -7.289 -2.389 -5.838 1.00 0.39 H new ATOM 0 HB3 TYR A 101 -8.383 -1.160 -5.233 1.00 0.39 H new ATOM 0 HD1 TYR A 101 -8.659 -4.140 -7.521 1.00 0.64 H new ATOM 0 HD2 TYR A 101 -10.260 -2.005 -4.157 1.00 0.39 H new ATOM 0 HE1 TYR A 101 -10.448 -5.839 -7.297 1.00 0.73 H new ATOM 0 HE2 TYR A 101 -12.047 -3.708 -3.929 1.00 0.45 H new ATOM 0 HH TYR A 101 -12.943 -5.586 -4.720 1.00 0.70 H new ATOM 1294 N LEU A 102 -7.966 0.955 -6.679 1.00 0.36 N ATOM 1295 CA LEU A 102 -8.330 2.383 -6.486 1.00 0.33 C ATOM 1296 C LEU A 102 -7.840 3.219 -7.668 1.00 0.41 C ATOM 1297 O LEU A 102 -7.840 4.431 -7.616 1.00 0.41 O ATOM 1298 CB LEU A 102 -7.675 2.889 -5.201 1.00 0.26 C ATOM 1299 CG LEU A 102 -7.853 1.851 -4.087 1.00 0.19 C ATOM 1300 CD1 LEU A 102 -6.530 1.664 -3.347 1.00 0.17 C ATOM 1301 CD2 LEU A 102 -8.923 2.333 -3.118 1.00 0.11 C ATOM 0 H LEU A 102 -7.048 0.692 -6.320 1.00 0.36 H new ATOM 0 HA LEU A 102 -9.414 2.473 -6.418 1.00 0.33 H new ATOM 0 HB2 LEU A 102 -6.615 3.076 -5.371 1.00 0.26 H new ATOM 0 HB3 LEU A 102 -8.122 3.837 -4.903 1.00 0.26 H new ATOM 0 HG LEU A 102 -8.158 0.898 -4.519 1.00 0.19 H new ATOM 0 HD11 LEU A 102 -6.657 0.926 -2.555 1.00 0.17 H new ATOM 0 HD12 LEU A 102 -5.768 1.319 -4.046 1.00 0.17 H new ATOM 0 HD13 LEU A 102 -6.219 2.614 -2.911 1.00 0.17 H new ATOM 0 HD21 LEU A 102 -9.053 1.598 -2.324 1.00 0.11 H new ATOM 0 HD22 LEU A 102 -8.619 3.285 -2.684 1.00 0.11 H new ATOM 0 HD23 LEU A 102 -9.865 2.462 -3.651 1.00 0.11 H new ATOM 1313 N GLN A 103 -7.417 2.594 -8.731 1.00 0.50 N ATOM 1314 CA GLN A 103 -6.925 3.377 -9.895 1.00 0.58 C ATOM 1315 C GLN A 103 -8.121 3.838 -10.730 1.00 0.48 C ATOM 1316 O GLN A 103 -8.072 4.850 -11.402 1.00 0.36 O ATOM 1317 CB GLN A 103 -6.011 2.500 -10.755 1.00 0.78 C ATOM 1318 CG GLN A 103 -5.508 3.307 -11.954 1.00 1.03 C ATOM 1319 CD GLN A 103 -4.918 2.357 -12.998 1.00 1.15 C ATOM 1320 OE1 GLN A 103 -5.357 2.332 -14.131 1.00 1.57 O ATOM 1321 NE2 GLN A 103 -3.932 1.570 -12.664 1.00 1.94 N ATOM 0 H GLN A 103 -7.391 1.580 -8.843 1.00 0.50 H new ATOM 0 HA GLN A 103 -6.365 4.243 -9.543 1.00 0.58 H new ATOM 0 HB2 GLN A 103 -5.168 2.145 -10.163 1.00 0.78 H new ATOM 0 HB3 GLN A 103 -6.553 1.619 -11.098 1.00 0.78 H new ATOM 0 HG2 GLN A 103 -6.327 3.880 -12.390 1.00 1.03 H new ATOM 0 HG3 GLN A 103 -4.753 4.024 -11.632 1.00 1.03 H new ATOM 0 HE21 GLN A 103 -3.563 1.590 -11.713 1.00 1.94 H new ATOM 0 HE22 GLN A 103 -3.530 0.935 -13.354 1.00 1.94 H new ATOM 1330 N ASN A 104 -9.191 3.093 -10.696 1.00 0.59 N ATOM 1331 CA ASN A 104 -10.395 3.474 -11.491 1.00 0.54 C ATOM 1332 C ASN A 104 -11.630 3.539 -10.583 1.00 0.46 C ATOM 1333 O ASN A 104 -12.596 4.210 -10.888 1.00 0.47 O ATOM 1334 CB ASN A 104 -10.625 2.434 -12.588 1.00 0.65 C ATOM 1335 CG ASN A 104 -11.114 3.129 -13.860 1.00 0.74 C ATOM 1336 OD1 ASN A 104 -10.412 3.939 -14.432 1.00 0.29 O ATOM 1337 ND2 ASN A 104 -12.298 2.845 -14.332 1.00 1.80 N ATOM 0 H ASN A 104 -9.285 2.235 -10.152 1.00 0.59 H new ATOM 0 HA ASN A 104 -10.232 4.455 -11.938 1.00 0.54 H new ATOM 0 HB2 ASN A 104 -9.701 1.893 -12.790 1.00 0.65 H new ATOM 0 HB3 ASN A 104 -11.359 1.699 -12.258 1.00 0.65 H new ATOM 0 HD21 ASN A 104 -12.632 3.303 -15.180 1.00 1.80 H new ATOM 0 HD22 ASN A 104 -12.888 2.165 -13.853 1.00 1.80 H new ATOM 1344 N ARG A 105 -11.616 2.849 -9.471 1.00 0.41 N ATOM 1345 CA ARG A 105 -12.796 2.883 -8.559 1.00 0.41 C ATOM 1346 C ARG A 105 -13.114 4.333 -8.196 1.00 0.25 C ATOM 1347 O ARG A 105 -14.229 4.665 -7.847 1.00 0.33 O ATOM 1348 CB ARG A 105 -12.479 2.097 -7.285 1.00 0.44 C ATOM 1349 CG ARG A 105 -13.122 0.712 -7.365 1.00 0.62 C ATOM 1350 CD ARG A 105 -14.274 0.627 -6.362 1.00 0.88 C ATOM 1351 NE ARG A 105 -14.709 -0.791 -6.223 1.00 1.80 N ATOM 1352 CZ ARG A 105 -15.535 -1.129 -5.272 1.00 2.55 C ATOM 1353 NH1 ARG A 105 -16.808 -0.860 -5.384 1.00 2.43 N ATOM 1354 NH2 ARG A 105 -15.089 -1.736 -4.206 1.00 3.79 N ATOM 0 H ARG A 105 -10.840 2.266 -9.157 1.00 0.41 H new ATOM 0 HA ARG A 105 -13.655 2.435 -9.058 1.00 0.41 H new ATOM 0 HB2 ARG A 105 -11.400 2.002 -7.163 1.00 0.44 H new ATOM 0 HB3 ARG A 105 -12.852 2.633 -6.412 1.00 0.44 H new ATOM 0 HG2 ARG A 105 -13.490 0.528 -8.374 1.00 0.62 H new ATOM 0 HG3 ARG A 105 -12.381 -0.058 -7.150 1.00 0.62 H new ATOM 0 HD2 ARG A 105 -13.958 1.018 -5.395 1.00 0.88 H new ATOM 0 HD3 ARG A 105 -15.108 1.243 -6.697 1.00 0.88 H new ATOM 0 HE ARG A 105 -14.361 -1.497 -6.871 1.00 1.80 H new ATOM 0 HH11 ARG A 105 -17.158 -0.385 -6.216 1.00 2.43 H new ATOM 0 HH12 ARG A 105 -17.453 -1.125 -4.639 1.00 2.43 H new ATOM 0 HH21 ARG A 105 -14.095 -1.946 -4.117 1.00 3.79 H new ATOM 0 HH22 ARG A 105 -15.735 -2.000 -3.462 1.00 3.79 H new ATOM 1368 N PHE A 106 -12.142 5.198 -8.276 1.00 0.12 N ATOM 1369 CA PHE A 106 -12.388 6.626 -7.934 1.00 0.20 C ATOM 1370 C PHE A 106 -12.737 7.402 -9.206 1.00 0.33 C ATOM 1371 O PHE A 106 -12.093 8.372 -9.552 1.00 0.19 O ATOM 1372 CB PHE A 106 -11.128 7.217 -7.295 1.00 0.22 C ATOM 1373 CG PHE A 106 -11.287 7.258 -5.790 1.00 0.33 C ATOM 1374 CD1 PHE A 106 -11.890 6.186 -5.116 1.00 1.02 C ATOM 1375 CD2 PHE A 106 -10.833 8.369 -5.071 1.00 1.81 C ATOM 1376 CE1 PHE A 106 -12.035 6.229 -3.724 1.00 0.78 C ATOM 1377 CE2 PHE A 106 -10.980 8.411 -3.679 1.00 2.08 C ATOM 1378 CZ PHE A 106 -11.582 7.341 -3.006 1.00 0.86 C ATOM 0 H PHE A 106 -11.188 4.978 -8.563 1.00 0.12 H new ATOM 0 HA PHE A 106 -13.218 6.698 -7.231 1.00 0.20 H new ATOM 0 HB2 PHE A 106 -10.258 6.617 -7.562 1.00 0.22 H new ATOM 0 HB3 PHE A 106 -10.952 8.222 -7.679 1.00 0.22 H new ATOM 0 HD1 PHE A 106 -12.242 5.328 -5.670 1.00 1.02 H new ATOM 0 HD2 PHE A 106 -10.369 9.195 -5.590 1.00 1.81 H new ATOM 0 HE1 PHE A 106 -12.497 5.403 -3.204 1.00 0.78 H new ATOM 0 HE2 PHE A 106 -10.629 9.269 -3.125 1.00 2.08 H new ATOM 0 HZ PHE A 106 -11.697 7.374 -1.933 1.00 0.86 H new ATOM 1388 N GLU A 107 -13.758 6.983 -9.905 1.00 0.90 N ATOM 1389 CA GLU A 107 -14.152 7.696 -11.153 1.00 1.08 C ATOM 1390 C GLU A 107 -14.693 9.084 -10.803 1.00 1.16 C ATOM 1391 O GLU A 107 -14.732 9.974 -11.630 1.00 1.24 O ATOM 1392 CB GLU A 107 -15.236 6.898 -11.880 1.00 1.32 C ATOM 1393 CG GLU A 107 -16.469 6.770 -10.983 1.00 1.12 C ATOM 1394 CD GLU A 107 -17.719 7.157 -11.776 1.00 0.61 C ATOM 1395 OE1 GLU A 107 -18.072 6.422 -12.683 1.00 1.21 O ATOM 1396 OE2 GLU A 107 -18.300 8.183 -11.463 1.00 0.50 O ATOM 0 H GLU A 107 -14.336 6.177 -9.665 1.00 0.90 H new ATOM 0 HA GLU A 107 -13.280 7.798 -11.799 1.00 1.08 H new ATOM 0 HB2 GLU A 107 -15.503 7.394 -12.813 1.00 1.32 H new ATOM 0 HB3 GLU A 107 -14.860 5.909 -12.141 1.00 1.32 H new ATOM 0 HG2 GLU A 107 -16.560 5.748 -10.616 1.00 1.12 H new ATOM 0 HG3 GLU A 107 -16.365 7.414 -10.110 1.00 1.12 H new ATOM 1403 N SER A 108 -15.100 9.283 -9.579 1.00 1.17 N ATOM 1404 CA SER A 108 -15.622 10.618 -9.176 1.00 1.31 C ATOM 1405 C SER A 108 -14.452 11.450 -8.665 1.00 1.18 C ATOM 1406 O SER A 108 -14.269 12.592 -9.037 1.00 1.27 O ATOM 1407 CB SER A 108 -16.662 10.453 -8.068 1.00 1.45 C ATOM 1408 OG SER A 108 -17.764 11.312 -8.327 1.00 1.67 O ATOM 0 H SER A 108 -15.093 8.579 -8.841 1.00 1.17 H new ATOM 0 HA SER A 108 -16.093 11.112 -10.026 1.00 1.31 H new ATOM 0 HB2 SER A 108 -16.997 9.417 -8.019 1.00 1.45 H new ATOM 0 HB3 SER A 108 -16.220 10.691 -7.100 1.00 1.45 H new ATOM 0 HG SER A 108 -18.434 11.207 -7.619 1.00 1.67 H new ATOM 1414 N SER A 109 -13.638 10.864 -7.835 1.00 0.98 N ATOM 1415 CA SER A 109 -12.450 11.586 -7.312 1.00 0.90 C ATOM 1416 C SER A 109 -11.214 10.951 -7.943 1.00 0.68 C ATOM 1417 O SER A 109 -10.279 10.565 -7.273 1.00 0.69 O ATOM 1418 CB SER A 109 -12.389 11.452 -5.788 1.00 0.96 C ATOM 1419 OG SER A 109 -12.342 12.748 -5.206 1.00 1.55 O ATOM 0 H SER A 109 -13.746 9.909 -7.495 1.00 0.98 H new ATOM 0 HA SER A 109 -12.503 12.646 -7.558 1.00 0.90 H new ATOM 0 HB2 SER A 109 -13.261 10.908 -5.424 1.00 0.96 H new ATOM 0 HB3 SER A 109 -11.510 10.877 -5.496 1.00 0.96 H new ATOM 0 HG SER A 109 -12.304 12.667 -4.230 1.00 1.55 H new ATOM 1425 N GLU A 110 -11.226 10.816 -9.239 1.00 0.59 N ATOM 1426 CA GLU A 110 -10.085 10.184 -9.945 1.00 0.42 C ATOM 1427 C GLU A 110 -8.767 10.857 -9.545 1.00 0.19 C ATOM 1428 O GLU A 110 -7.851 10.214 -9.071 1.00 0.23 O ATOM 1429 CB GLU A 110 -10.291 10.327 -11.455 1.00 0.54 C ATOM 1430 CG GLU A 110 -9.656 9.135 -12.174 1.00 0.40 C ATOM 1431 CD GLU A 110 -10.010 9.188 -13.662 1.00 0.69 C ATOM 1432 OE1 GLU A 110 -10.953 9.883 -14.004 1.00 0.78 O ATOM 1433 OE2 GLU A 110 -9.330 8.532 -14.435 1.00 1.12 O ATOM 0 H GLU A 110 -11.989 11.121 -9.844 1.00 0.59 H new ATOM 0 HA GLU A 110 -10.036 9.130 -9.671 1.00 0.42 H new ATOM 0 HB2 GLU A 110 -11.355 10.378 -11.684 1.00 0.54 H new ATOM 0 HB3 GLU A 110 -9.844 11.257 -11.807 1.00 0.54 H new ATOM 0 HG2 GLU A 110 -8.574 9.154 -12.046 1.00 0.40 H new ATOM 0 HG3 GLU A 110 -10.012 8.202 -11.738 1.00 0.40 H new ATOM 1440 N GLU A 111 -8.659 12.143 -9.751 1.00 0.31 N ATOM 1441 CA GLU A 111 -7.396 12.872 -9.408 1.00 0.17 C ATOM 1442 C GLU A 111 -6.890 12.471 -8.017 1.00 0.33 C ATOM 1443 O GLU A 111 -5.709 12.534 -7.740 1.00 0.62 O ATOM 1444 CB GLU A 111 -7.662 14.380 -9.428 1.00 0.22 C ATOM 1445 CG GLU A 111 -7.261 14.949 -10.790 1.00 0.80 C ATOM 1446 CD GLU A 111 -5.763 15.255 -10.793 1.00 1.91 C ATOM 1447 OE1 GLU A 111 -4.990 14.334 -10.586 1.00 3.44 O ATOM 1448 OE2 GLU A 111 -5.413 16.404 -11.004 1.00 1.92 O ATOM 0 H GLU A 111 -9.396 12.727 -10.145 1.00 0.31 H new ATOM 0 HA GLU A 111 -6.636 12.610 -10.144 1.00 0.17 H new ATOM 0 HB2 GLU A 111 -8.717 14.577 -9.236 1.00 0.22 H new ATOM 0 HB3 GLU A 111 -7.096 14.871 -8.636 1.00 0.22 H new ATOM 0 HG2 GLU A 111 -7.499 14.235 -11.579 1.00 0.80 H new ATOM 0 HG3 GLU A 111 -7.829 15.856 -10.999 1.00 0.80 H new ATOM 1455 N GLN A 112 -7.764 12.068 -7.140 1.00 0.55 N ATOM 1456 CA GLN A 112 -7.320 11.676 -5.772 1.00 0.71 C ATOM 1457 C GLN A 112 -6.554 10.352 -5.834 1.00 0.42 C ATOM 1458 O GLN A 112 -5.429 10.251 -5.384 1.00 0.37 O ATOM 1459 CB GLN A 112 -8.546 11.511 -4.870 1.00 1.05 C ATOM 1460 CG GLN A 112 -9.262 12.858 -4.730 1.00 1.34 C ATOM 1461 CD GLN A 112 -9.726 13.043 -3.284 1.00 2.36 C ATOM 1462 OE1 GLN A 112 -10.393 12.189 -2.734 1.00 3.46 O ATOM 1463 NE2 GLN A 112 -9.399 14.131 -2.641 1.00 2.14 N ATOM 0 H GLN A 112 -8.767 11.992 -7.310 1.00 0.55 H new ATOM 0 HA GLN A 112 -6.667 12.450 -5.369 1.00 0.71 H new ATOM 0 HB2 GLN A 112 -9.224 10.769 -5.292 1.00 1.05 H new ATOM 0 HB3 GLN A 112 -8.243 11.145 -3.889 1.00 1.05 H new ATOM 0 HG2 GLN A 112 -8.592 13.669 -5.014 1.00 1.34 H new ATOM 0 HG3 GLN A 112 -10.117 12.899 -5.405 1.00 1.34 H new ATOM 0 HE21 GLN A 112 -8.839 14.848 -3.103 1.00 2.14 H new ATOM 0 HE22 GLN A 112 -9.703 14.264 -1.677 1.00 2.14 H new ATOM 1472 N ALA A 113 -7.157 9.338 -6.386 1.00 0.36 N ATOM 1473 CA ALA A 113 -6.476 8.013 -6.479 1.00 0.18 C ATOM 1474 C ALA A 113 -5.252 8.111 -7.400 1.00 0.09 C ATOM 1475 O ALA A 113 -4.384 7.259 -7.386 1.00 0.31 O ATOM 1476 CB ALA A 113 -7.457 6.992 -7.055 1.00 0.45 C ATOM 0 H ALA A 113 -8.098 9.368 -6.780 1.00 0.36 H new ATOM 0 HA ALA A 113 -6.150 7.705 -5.486 1.00 0.18 H new ATOM 0 HB1 ALA A 113 -6.970 6.020 -7.127 1.00 0.45 H new ATOM 0 HB2 ALA A 113 -8.326 6.914 -6.402 1.00 0.45 H new ATOM 0 HB3 ALA A 113 -7.776 7.313 -8.047 1.00 0.45 H new ATOM 1482 N ARG A 114 -5.182 9.133 -8.211 1.00 0.25 N ATOM 1483 CA ARG A 114 -4.026 9.273 -9.145 1.00 0.39 C ATOM 1484 C ARG A 114 -2.815 9.852 -8.411 1.00 0.34 C ATOM 1485 O ARG A 114 -1.726 9.321 -8.481 1.00 0.25 O ATOM 1486 CB ARG A 114 -4.416 10.207 -10.291 1.00 0.56 C ATOM 1487 CG ARG A 114 -3.582 9.872 -11.529 1.00 0.67 C ATOM 1488 CD ARG A 114 -4.510 9.457 -12.671 1.00 0.55 C ATOM 1489 NE ARG A 114 -3.823 8.453 -13.530 1.00 1.09 N ATOM 1490 CZ ARG A 114 -4.378 8.059 -14.644 1.00 1.67 C ATOM 1491 NH1 ARG A 114 -5.441 7.305 -14.611 1.00 2.94 N ATOM 1492 NH2 ARG A 114 -3.869 8.423 -15.790 1.00 1.14 N ATOM 0 H ARG A 114 -5.876 9.878 -8.267 1.00 0.25 H new ATOM 0 HA ARG A 114 -3.765 8.290 -9.536 1.00 0.39 H new ATOM 0 HB2 ARG A 114 -5.477 10.101 -10.515 1.00 0.56 H new ATOM 0 HB3 ARG A 114 -4.253 11.245 -10.000 1.00 0.56 H new ATOM 0 HG2 ARG A 114 -2.987 10.736 -11.825 1.00 0.67 H new ATOM 0 HG3 ARG A 114 -2.883 9.067 -11.303 1.00 0.67 H new ATOM 0 HD2 ARG A 114 -5.433 9.037 -12.270 1.00 0.55 H new ATOM 0 HD3 ARG A 114 -4.787 10.329 -13.263 1.00 0.55 H new ATOM 0 HE ARG A 114 -2.919 8.073 -13.248 1.00 1.09 H new ATOM 0 HH11 ARG A 114 -5.839 7.023 -13.715 1.00 2.94 H new ATOM 0 HH12 ARG A 114 -5.875 6.997 -15.481 1.00 2.94 H new ATOM 0 HH21 ARG A 114 -3.038 9.015 -15.814 1.00 1.14 H new ATOM 0 HH22 ARG A 114 -4.302 8.116 -16.661 1.00 1.14 H new ATOM 1506 N ALA A 115 -2.988 10.940 -7.715 1.00 0.61 N ATOM 1507 CA ALA A 115 -1.835 11.549 -6.990 1.00 0.63 C ATOM 1508 C ALA A 115 -1.198 10.510 -6.061 1.00 0.63 C ATOM 1509 O ALA A 115 -0.060 10.645 -5.655 1.00 0.68 O ATOM 1510 CB ALA A 115 -2.325 12.742 -6.166 1.00 0.64 C ATOM 0 H ALA A 115 -3.875 11.434 -7.616 1.00 0.61 H new ATOM 0 HA ALA A 115 -1.092 11.886 -7.713 1.00 0.63 H new ATOM 0 HB1 ALA A 115 -1.484 13.188 -5.636 1.00 0.64 H new ATOM 0 HB2 ALA A 115 -2.770 13.484 -6.829 1.00 0.64 H new ATOM 0 HB3 ALA A 115 -3.070 12.405 -5.446 1.00 0.64 H new ATOM 1516 N VAL A 116 -1.921 9.481 -5.711 1.00 0.62 N ATOM 1517 CA VAL A 116 -1.356 8.445 -4.798 1.00 0.63 C ATOM 1518 C VAL A 116 -0.597 7.381 -5.601 1.00 0.68 C ATOM 1519 O VAL A 116 0.584 7.176 -5.409 1.00 1.09 O ATOM 1520 CB VAL A 116 -2.499 7.785 -4.023 1.00 0.64 C ATOM 1521 CG1 VAL A 116 -1.944 6.674 -3.127 1.00 1.49 C ATOM 1522 CG2 VAL A 116 -3.193 8.838 -3.156 1.00 2.11 C ATOM 0 H VAL A 116 -2.879 9.312 -6.018 1.00 0.62 H new ATOM 0 HA VAL A 116 -0.661 8.919 -4.105 1.00 0.63 H new ATOM 0 HB VAL A 116 -3.213 7.356 -4.726 1.00 0.64 H new ATOM 0 HG11 VAL A 116 -2.761 6.207 -2.577 1.00 1.49 H new ATOM 0 HG12 VAL A 116 -1.446 5.925 -3.743 1.00 1.49 H new ATOM 0 HG13 VAL A 116 -1.229 7.098 -2.422 1.00 1.49 H new ATOM 0 HG21 VAL A 116 -4.008 8.373 -2.602 1.00 2.11 H new ATOM 0 HG22 VAL A 116 -2.474 9.264 -2.456 1.00 2.11 H new ATOM 0 HG23 VAL A 116 -3.591 9.628 -3.792 1.00 2.11 H new ATOM 1532 N GLN A 117 -1.268 6.692 -6.483 1.00 0.28 N ATOM 1533 CA GLN A 117 -0.591 5.626 -7.282 1.00 0.29 C ATOM 1534 C GLN A 117 0.705 6.158 -7.906 1.00 0.30 C ATOM 1535 O GLN A 117 1.738 5.521 -7.853 1.00 0.32 O ATOM 1536 CB GLN A 117 -1.530 5.156 -8.394 1.00 0.31 C ATOM 1537 CG GLN A 117 -0.917 3.941 -9.091 1.00 0.49 C ATOM 1538 CD GLN A 117 -1.682 3.643 -10.381 1.00 0.65 C ATOM 1539 OE1 GLN A 117 -2.825 4.029 -10.525 1.00 1.32 O ATOM 1540 NE2 GLN A 117 -1.095 2.968 -11.330 1.00 0.89 N ATOM 0 H GLN A 117 -2.259 6.820 -6.687 1.00 0.28 H new ATOM 0 HA GLN A 117 -0.346 4.795 -6.621 1.00 0.29 H new ATOM 0 HB2 GLN A 117 -2.504 4.899 -7.979 1.00 0.31 H new ATOM 0 HB3 GLN A 117 -1.692 5.959 -9.113 1.00 0.31 H new ATOM 0 HG2 GLN A 117 0.133 4.130 -9.315 1.00 0.49 H new ATOM 0 HG3 GLN A 117 -0.950 3.075 -8.429 1.00 0.49 H new ATOM 0 HE21 GLN A 117 -0.135 2.645 -11.207 1.00 0.89 H new ATOM 0 HE22 GLN A 117 -1.596 2.763 -12.195 1.00 0.89 H new ATOM 1549 N MET A 118 0.651 7.309 -8.515 1.00 0.29 N ATOM 1550 CA MET A 118 1.867 7.880 -9.169 1.00 0.33 C ATOM 1551 C MET A 118 3.077 7.822 -8.228 1.00 0.32 C ATOM 1552 O MET A 118 4.103 7.262 -8.556 1.00 0.34 O ATOM 1553 CB MET A 118 1.597 9.336 -9.550 1.00 0.33 C ATOM 1554 CG MET A 118 0.611 9.383 -10.720 1.00 0.46 C ATOM 1555 SD MET A 118 1.369 10.239 -12.126 1.00 0.98 S ATOM 1556 CE MET A 118 0.354 11.734 -12.053 1.00 1.69 C ATOM 0 H MET A 118 -0.188 7.885 -8.590 1.00 0.29 H new ATOM 0 HA MET A 118 2.090 7.290 -10.058 1.00 0.33 H new ATOM 0 HB2 MET A 118 1.190 9.877 -8.696 1.00 0.33 H new ATOM 0 HB3 MET A 118 2.529 9.830 -9.826 1.00 0.33 H new ATOM 0 HG2 MET A 118 0.326 8.371 -11.009 1.00 0.46 H new ATOM 0 HG3 MET A 118 -0.302 9.897 -10.418 1.00 0.46 H new ATOM 0 HE1 MET A 118 0.655 12.417 -12.847 1.00 1.69 H new ATOM 0 HE2 MET A 118 -0.695 11.468 -12.182 1.00 1.69 H new ATOM 0 HE3 MET A 118 0.489 12.219 -11.086 1.00 1.69 H new ATOM 1566 N SER A 119 2.975 8.415 -7.071 1.00 0.46 N ATOM 1567 CA SER A 119 4.129 8.413 -6.126 1.00 0.53 C ATOM 1568 C SER A 119 4.496 6.979 -5.730 1.00 0.47 C ATOM 1569 O SER A 119 5.656 6.650 -5.568 1.00 0.39 O ATOM 1570 CB SER A 119 3.758 9.205 -4.874 1.00 0.66 C ATOM 1571 OG SER A 119 4.795 9.075 -3.911 1.00 1.54 O ATOM 0 H SER A 119 2.143 8.901 -6.738 1.00 0.46 H new ATOM 0 HA SER A 119 4.987 8.872 -6.617 1.00 0.53 H new ATOM 0 HB2 SER A 119 3.609 10.255 -5.125 1.00 0.66 H new ATOM 0 HB3 SER A 119 2.817 8.839 -4.464 1.00 0.66 H new ATOM 0 HG SER A 119 4.560 9.583 -3.107 1.00 1.54 H new ATOM 1577 N THR A 120 3.526 6.125 -5.559 1.00 0.51 N ATOM 1578 CA THR A 120 3.838 4.724 -5.157 1.00 0.48 C ATOM 1579 C THR A 120 4.661 4.040 -6.250 1.00 0.46 C ATOM 1580 O THR A 120 5.385 3.099 -5.994 1.00 0.42 O ATOM 1581 CB THR A 120 2.538 3.948 -4.929 1.00 0.54 C ATOM 1582 OG1 THR A 120 1.891 3.736 -6.177 1.00 1.44 O ATOM 1583 CG2 THR A 120 1.616 4.744 -4.002 1.00 1.00 C ATOM 0 H THR A 120 2.535 6.334 -5.679 1.00 0.51 H new ATOM 0 HA THR A 120 4.414 4.740 -4.232 1.00 0.48 H new ATOM 0 HB THR A 120 2.766 2.987 -4.468 1.00 0.54 H new ATOM 0 HG1 THR A 120 2.118 4.465 -6.791 1.00 1.44 H new ATOM 0 HG21 THR A 120 0.692 4.188 -3.843 1.00 1.00 H new ATOM 0 HG22 THR A 120 2.113 4.905 -3.045 1.00 1.00 H new ATOM 0 HG23 THR A 120 1.386 5.707 -4.457 1.00 1.00 H new ATOM 1591 N LYS A 121 4.573 4.510 -7.460 1.00 0.49 N ATOM 1592 CA LYS A 121 5.369 3.893 -8.556 1.00 0.48 C ATOM 1593 C LYS A 121 6.748 4.549 -8.569 1.00 0.49 C ATOM 1594 O LYS A 121 7.728 3.965 -8.986 1.00 0.53 O ATOM 1595 CB LYS A 121 4.676 4.132 -9.899 1.00 0.51 C ATOM 1596 CG LYS A 121 3.327 3.411 -9.914 1.00 0.66 C ATOM 1597 CD LYS A 121 2.780 3.383 -11.343 1.00 1.52 C ATOM 1598 CE LYS A 121 3.518 2.314 -12.152 1.00 0.59 C ATOM 1599 NZ LYS A 121 2.768 1.025 -12.094 1.00 1.73 N ATOM 0 H LYS A 121 3.984 5.295 -7.739 1.00 0.49 H new ATOM 0 HA LYS A 121 5.460 2.819 -8.395 1.00 0.48 H new ATOM 0 HB2 LYS A 121 4.531 5.200 -10.060 1.00 0.51 H new ATOM 0 HB3 LYS A 121 5.303 3.769 -10.713 1.00 0.51 H new ATOM 0 HG2 LYS A 121 3.441 2.395 -9.537 1.00 0.66 H new ATOM 0 HG3 LYS A 121 2.624 3.919 -9.254 1.00 0.66 H new ATOM 0 HD2 LYS A 121 1.711 3.171 -11.330 1.00 1.52 H new ATOM 0 HD3 LYS A 121 2.906 4.359 -11.811 1.00 1.52 H new ATOM 0 HE2 LYS A 121 3.623 2.637 -13.188 1.00 0.59 H new ATOM 0 HE3 LYS A 121 4.525 2.177 -11.757 1.00 0.59 H new ATOM 0 HZ1 LYS A 121 3.275 0.303 -12.645 1.00 1.73 H new ATOM 0 HZ2 LYS A 121 2.690 0.713 -11.105 1.00 1.73 H new ATOM 0 HZ3 LYS A 121 1.816 1.159 -12.491 1.00 1.73 H new ATOM 1613 N VAL A 122 6.821 5.764 -8.104 1.00 0.46 N ATOM 1614 CA VAL A 122 8.120 6.480 -8.070 1.00 0.49 C ATOM 1615 C VAL A 122 9.000 5.887 -6.972 1.00 0.48 C ATOM 1616 O VAL A 122 10.207 5.993 -7.010 1.00 0.47 O ATOM 1617 CB VAL A 122 7.853 7.952 -7.777 1.00 0.53 C ATOM 1618 CG1 VAL A 122 9.178 8.706 -7.678 1.00 0.58 C ATOM 1619 CG2 VAL A 122 7.018 8.541 -8.913 1.00 0.54 C ATOM 0 H VAL A 122 6.028 6.294 -7.743 1.00 0.46 H new ATOM 0 HA VAL A 122 8.631 6.378 -9.027 1.00 0.49 H new ATOM 0 HB VAL A 122 7.316 8.046 -6.833 1.00 0.53 H new ATOM 0 HG11 VAL A 122 8.983 9.758 -7.469 1.00 0.58 H new ATOM 0 HG12 VAL A 122 9.779 8.281 -6.874 1.00 0.58 H new ATOM 0 HG13 VAL A 122 9.718 8.618 -8.621 1.00 0.58 H new ATOM 0 HG21 VAL A 122 6.822 9.594 -8.712 1.00 0.54 H new ATOM 0 HG22 VAL A 122 7.563 8.446 -9.852 1.00 0.54 H new ATOM 0 HG23 VAL A 122 6.073 8.003 -8.986 1.00 0.54 H new ATOM 1629 N LEU A 123 8.406 5.260 -5.995 1.00 0.49 N ATOM 1630 CA LEU A 123 9.216 4.653 -4.902 1.00 0.48 C ATOM 1631 C LEU A 123 9.605 3.237 -5.310 1.00 0.39 C ATOM 1632 O LEU A 123 10.706 2.786 -5.071 1.00 0.53 O ATOM 1633 CB LEU A 123 8.392 4.614 -3.620 1.00 0.51 C ATOM 1634 CG LEU A 123 8.649 5.891 -2.827 1.00 0.74 C ATOM 1635 CD1 LEU A 123 7.674 5.966 -1.654 1.00 1.47 C ATOM 1636 CD2 LEU A 123 10.086 5.879 -2.303 1.00 2.67 C ATOM 0 H LEU A 123 7.397 5.142 -5.906 1.00 0.49 H new ATOM 0 HA LEU A 123 10.114 5.246 -4.728 1.00 0.48 H new ATOM 0 HB2 LEU A 123 7.332 4.524 -3.856 1.00 0.51 H new ATOM 0 HB3 LEU A 123 8.661 3.741 -3.026 1.00 0.51 H new ATOM 0 HG LEU A 123 8.505 6.759 -3.471 1.00 0.74 H new ATOM 0 HD11 LEU A 123 7.857 6.878 -1.087 1.00 1.47 H new ATOM 0 HD12 LEU A 123 6.651 5.972 -2.031 1.00 1.47 H new ATOM 0 HD13 LEU A 123 7.817 5.101 -1.006 1.00 1.47 H new ATOM 0 HD21 LEU A 123 10.274 6.790 -1.735 1.00 2.67 H new ATOM 0 HD22 LEU A 123 10.231 5.013 -1.657 1.00 2.67 H new ATOM 0 HD23 LEU A 123 10.779 5.825 -3.143 1.00 2.67 H new ATOM 1648 N ILE A 124 8.707 2.540 -5.941 1.00 0.17 N ATOM 1649 CA ILE A 124 9.012 1.157 -6.396 1.00 0.12 C ATOM 1650 C ILE A 124 10.159 1.227 -7.399 1.00 0.17 C ATOM 1651 O ILE A 124 11.025 0.375 -7.438 1.00 0.24 O ATOM 1652 CB ILE A 124 7.771 0.566 -7.072 1.00 0.12 C ATOM 1653 CG1 ILE A 124 6.648 0.431 -6.045 1.00 0.35 C ATOM 1654 CG2 ILE A 124 8.098 -0.813 -7.649 1.00 0.54 C ATOM 1655 CD1 ILE A 124 5.296 0.450 -6.760 1.00 0.75 C ATOM 0 H ILE A 124 7.768 2.870 -6.163 1.00 0.17 H new ATOM 0 HA ILE A 124 9.293 0.528 -5.551 1.00 0.12 H new ATOM 0 HB ILE A 124 7.455 1.227 -7.879 1.00 0.12 H new ATOM 0 HG12 ILE A 124 6.762 -0.498 -5.486 1.00 0.35 H new ATOM 0 HG13 ILE A 124 6.701 1.246 -5.323 1.00 0.35 H new ATOM 0 HG21 ILE A 124 7.211 -1.227 -8.128 1.00 0.54 H new ATOM 0 HG22 ILE A 124 8.897 -0.720 -8.384 1.00 0.54 H new ATOM 0 HG23 ILE A 124 8.420 -1.476 -6.846 1.00 0.54 H new ATOM 0 HD11 ILE A 124 4.495 0.354 -6.027 1.00 0.75 H new ATOM 0 HD12 ILE A 124 5.183 1.390 -7.299 1.00 0.75 H new ATOM 0 HD13 ILE A 124 5.245 -0.381 -7.464 1.00 0.75 H new ATOM 1667 N GLN A 125 10.166 2.246 -8.210 1.00 0.14 N ATOM 1668 CA GLN A 125 11.241 2.393 -9.216 1.00 0.20 C ATOM 1669 C GLN A 125 12.444 3.093 -8.584 1.00 0.27 C ATOM 1670 O GLN A 125 13.577 2.830 -8.932 1.00 0.42 O ATOM 1671 CB GLN A 125 10.708 3.225 -10.376 1.00 0.31 C ATOM 1672 CG GLN A 125 10.307 2.291 -11.517 1.00 0.34 C ATOM 1673 CD GLN A 125 10.305 3.062 -12.840 1.00 0.47 C ATOM 1674 OE1 GLN A 125 10.777 4.179 -12.906 1.00 0.19 O ATOM 1675 NE2 GLN A 125 9.788 2.506 -13.901 1.00 1.30 N ATOM 0 H GLN A 125 9.465 2.987 -8.216 1.00 0.14 H new ATOM 0 HA GLN A 125 11.554 1.413 -9.576 1.00 0.20 H new ATOM 0 HB2 GLN A 125 9.850 3.814 -10.053 1.00 0.31 H new ATOM 0 HB3 GLN A 125 11.468 3.928 -10.715 1.00 0.31 H new ATOM 0 HG2 GLN A 125 11.002 1.453 -11.575 1.00 0.34 H new ATOM 0 HG3 GLN A 125 9.318 1.873 -11.327 1.00 0.34 H new ATOM 0 HE21 GLN A 125 9.392 1.568 -13.844 1.00 1.30 H new ATOM 0 HE22 GLN A 125 9.780 3.010 -14.788 1.00 1.30 H new ATOM 1684 N PHE A 126 12.211 3.980 -7.654 1.00 0.21 N ATOM 1685 CA PHE A 126 13.353 4.682 -7.006 1.00 0.30 C ATOM 1686 C PHE A 126 14.272 3.650 -6.353 1.00 0.59 C ATOM 1687 O PHE A 126 15.477 3.773 -6.379 1.00 0.83 O ATOM 1688 CB PHE A 126 12.828 5.643 -5.935 1.00 0.21 C ATOM 1689 CG PHE A 126 12.875 7.064 -6.452 1.00 0.23 C ATOM 1690 CD1 PHE A 126 12.525 7.347 -7.780 1.00 0.43 C ATOM 1691 CD2 PHE A 126 13.270 8.101 -5.599 1.00 0.47 C ATOM 1692 CE1 PHE A 126 12.571 8.665 -8.252 1.00 0.67 C ATOM 1693 CE2 PHE A 126 13.317 9.417 -6.071 1.00 0.70 C ATOM 1694 CZ PHE A 126 12.967 9.700 -7.397 1.00 0.76 C ATOM 0 H PHE A 126 11.286 4.247 -7.318 1.00 0.21 H new ATOM 0 HA PHE A 126 13.906 5.246 -7.757 1.00 0.30 H new ATOM 0 HB2 PHE A 126 11.805 5.378 -5.666 1.00 0.21 H new ATOM 0 HB3 PHE A 126 13.429 5.556 -5.030 1.00 0.21 H new ATOM 0 HD1 PHE A 126 12.220 6.548 -8.439 1.00 0.43 H new ATOM 0 HD2 PHE A 126 13.539 7.885 -4.576 1.00 0.47 H new ATOM 0 HE1 PHE A 126 12.301 8.882 -9.275 1.00 0.67 H new ATOM 0 HE2 PHE A 126 13.624 10.216 -5.412 1.00 0.70 H new ATOM 0 HZ PHE A 126 13.003 10.717 -7.760 1.00 0.76 H new ATOM 1704 N LEU A 127 13.706 2.631 -5.769 1.00 0.61 N ATOM 1705 CA LEU A 127 14.537 1.586 -5.108 1.00 0.92 C ATOM 1706 C LEU A 127 15.033 0.586 -6.154 1.00 0.95 C ATOM 1707 O LEU A 127 16.141 0.100 -6.087 1.00 1.20 O ATOM 1708 CB LEU A 127 13.684 0.847 -4.073 1.00 0.98 C ATOM 1709 CG LEU A 127 13.658 1.641 -2.766 1.00 1.00 C ATOM 1710 CD1 LEU A 127 12.535 1.112 -1.871 1.00 0.41 C ATOM 1711 CD2 LEU A 127 14.998 1.482 -2.046 1.00 1.60 C ATOM 0 H LEU A 127 12.699 2.476 -5.721 1.00 0.61 H new ATOM 0 HA LEU A 127 15.391 2.056 -4.620 1.00 0.92 H new ATOM 0 HB2 LEU A 127 12.670 0.715 -4.450 1.00 0.98 H new ATOM 0 HB3 LEU A 127 14.090 -0.149 -3.897 1.00 0.98 H new ATOM 0 HG LEU A 127 13.485 2.695 -2.985 1.00 1.00 H new ATOM 0 HD11 LEU A 127 12.516 1.677 -0.939 1.00 0.41 H new ATOM 0 HD12 LEU A 127 11.579 1.223 -2.383 1.00 0.41 H new ATOM 0 HD13 LEU A 127 12.709 0.058 -1.653 1.00 0.41 H new ATOM 0 HD21 LEU A 127 14.980 2.048 -1.114 1.00 1.60 H new ATOM 0 HD22 LEU A 127 15.171 0.428 -1.827 1.00 1.60 H new ATOM 0 HD23 LEU A 127 15.800 1.857 -2.682 1.00 1.60 H new ATOM 1723 N GLN A 128 14.216 0.273 -7.117 1.00 0.77 N ATOM 1724 CA GLN A 128 14.631 -0.701 -8.164 1.00 0.94 C ATOM 1725 C GLN A 128 15.925 -0.223 -8.823 1.00 1.09 C ATOM 1726 O GLN A 128 16.748 -1.011 -9.242 1.00 1.44 O ATOM 1727 CB GLN A 128 13.532 -0.804 -9.225 1.00 0.89 C ATOM 1728 CG GLN A 128 12.600 -1.971 -8.891 1.00 0.67 C ATOM 1729 CD GLN A 128 11.437 -1.995 -9.885 1.00 1.22 C ATOM 1730 OE1 GLN A 128 10.311 -2.258 -9.514 1.00 2.18 O ATOM 1731 NE2 GLN A 128 11.665 -1.728 -11.142 1.00 1.74 N ATOM 0 H GLN A 128 13.275 0.651 -7.226 1.00 0.77 H new ATOM 0 HA GLN A 128 14.794 -1.677 -7.707 1.00 0.94 H new ATOM 0 HB2 GLN A 128 12.965 0.126 -9.267 1.00 0.89 H new ATOM 0 HB3 GLN A 128 13.976 -0.951 -10.209 1.00 0.89 H new ATOM 0 HG2 GLN A 128 13.148 -2.912 -8.934 1.00 0.67 H new ATOM 0 HG3 GLN A 128 12.221 -1.868 -7.874 1.00 0.67 H new ATOM 0 HE21 GLN A 128 12.611 -1.507 -11.453 1.00 1.74 H new ATOM 0 HE22 GLN A 128 10.897 -1.740 -11.813 1.00 1.74 H new ATOM 1740 N LYS A 129 16.102 1.063 -8.929 1.00 0.84 N ATOM 1741 CA LYS A 129 17.334 1.596 -9.572 1.00 0.97 C ATOM 1742 C LYS A 129 18.428 1.823 -8.524 1.00 1.09 C ATOM 1743 O LYS A 129 19.398 1.094 -8.456 1.00 1.13 O ATOM 1744 CB LYS A 129 17.011 2.926 -10.258 1.00 0.85 C ATOM 1745 CG LYS A 129 16.033 2.684 -11.411 1.00 1.11 C ATOM 1746 CD LYS A 129 15.710 4.013 -12.095 1.00 1.32 C ATOM 1747 CE LYS A 129 16.202 3.977 -13.545 1.00 1.85 C ATOM 1748 NZ LYS A 129 17.660 3.656 -13.579 1.00 2.44 N ATOM 0 H LYS A 129 15.445 1.770 -8.597 1.00 0.84 H new ATOM 0 HA LYS A 129 17.690 0.873 -10.305 1.00 0.97 H new ATOM 0 HB2 LYS A 129 16.577 3.622 -9.540 1.00 0.85 H new ATOM 0 HB3 LYS A 129 17.926 3.385 -10.634 1.00 0.85 H new ATOM 0 HG2 LYS A 129 16.467 1.989 -12.130 1.00 1.11 H new ATOM 0 HG3 LYS A 129 15.119 2.225 -11.036 1.00 1.11 H new ATOM 0 HD2 LYS A 129 14.636 4.195 -12.069 1.00 1.32 H new ATOM 0 HD3 LYS A 129 16.186 4.834 -11.559 1.00 1.32 H new ATOM 0 HE2 LYS A 129 15.643 3.231 -14.109 1.00 1.85 H new ATOM 0 HE3 LYS A 129 16.021 4.940 -14.024 1.00 1.85 H new ATOM 0 HZ1 LYS A 129 18.108 4.159 -14.372 1.00 2.44 H new ATOM 0 HZ2 LYS A 129 18.102 3.954 -12.686 1.00 2.44 H new ATOM 0 HZ3 LYS A 129 17.787 2.631 -13.703 1.00 2.44 H new ATOM 1762 N LYS A 130 18.293 2.848 -7.727 1.00 1.40 N ATOM 1763 CA LYS A 130 19.340 3.148 -6.706 1.00 1.57 C ATOM 1764 C LYS A 130 19.031 2.459 -5.372 1.00 1.26 C ATOM 1765 O LYS A 130 19.254 3.022 -4.319 1.00 1.45 O ATOM 1766 CB LYS A 130 19.406 4.661 -6.485 1.00 2.31 C ATOM 1767 CG LYS A 130 18.067 5.151 -5.934 1.00 2.29 C ATOM 1768 CD LYS A 130 18.304 5.943 -4.650 1.00 2.55 C ATOM 1769 CE LYS A 130 17.085 5.808 -3.735 1.00 2.83 C ATOM 1770 NZ LYS A 130 17.413 4.900 -2.600 1.00 2.16 N ATOM 0 H LYS A 130 17.502 3.492 -7.738 1.00 1.40 H new ATOM 0 HA LYS A 130 20.295 2.772 -7.073 1.00 1.57 H new ATOM 0 HB2 LYS A 130 20.209 4.904 -5.789 1.00 2.31 H new ATOM 0 HB3 LYS A 130 19.633 5.167 -7.423 1.00 2.31 H new ATOM 0 HG2 LYS A 130 17.565 5.776 -6.672 1.00 2.29 H new ATOM 0 HG3 LYS A 130 17.411 4.303 -5.735 1.00 2.29 H new ATOM 0 HD2 LYS A 130 19.196 5.575 -4.142 1.00 2.55 H new ATOM 0 HD3 LYS A 130 18.481 6.993 -4.885 1.00 2.55 H new ATOM 0 HE2 LYS A 130 16.790 6.787 -3.358 1.00 2.83 H new ATOM 0 HE3 LYS A 130 16.238 5.414 -4.296 1.00 2.83 H new ATOM 0 HZ1 LYS A 130 16.571 4.346 -2.344 1.00 2.16 H new ATOM 0 HZ2 LYS A 130 18.179 4.255 -2.881 1.00 2.16 H new ATOM 0 HZ3 LYS A 130 17.718 5.464 -1.781 1.00 2.16 H new ATOM 1784 N ALA A 131 18.530 1.251 -5.390 1.00 0.96 N ATOM 1785 CA ALA A 131 18.231 0.556 -4.098 1.00 1.10 C ATOM 1786 C ALA A 131 19.450 0.628 -3.171 1.00 1.68 C ATOM 1787 O ALA A 131 19.316 0.587 -1.969 1.00 3.11 O ATOM 1788 CB ALA A 131 17.892 -0.912 -4.364 1.00 0.81 C ATOM 0 H ALA A 131 18.316 0.718 -6.233 1.00 0.96 H new ATOM 0 HA ALA A 131 17.382 1.048 -3.624 1.00 1.10 H new ATOM 0 HB1 ALA A 131 17.675 -1.412 -3.420 1.00 0.81 H new ATOM 0 HB2 ALA A 131 17.020 -0.972 -5.015 1.00 0.81 H new ATOM 0 HB3 ALA A 131 18.739 -1.399 -4.847 1.00 0.81 H new ATOM 1794 N LYS A 132 20.619 0.746 -3.748 1.00 0.91 N ATOM 1795 CA LYS A 132 21.902 0.835 -2.975 1.00 1.64 C ATOM 1796 C LYS A 132 21.966 -0.190 -1.836 1.00 1.74 C ATOM 1797 O LYS A 132 21.182 -0.187 -0.910 1.00 1.72 O ATOM 1798 CB LYS A 132 22.093 2.249 -2.430 1.00 2.20 C ATOM 1799 CG LYS A 132 20.886 2.677 -1.594 1.00 2.41 C ATOM 1800 CD LYS A 132 21.209 3.991 -0.878 1.00 3.30 C ATOM 1801 CE LYS A 132 20.373 4.099 0.398 1.00 3.69 C ATOM 1802 NZ LYS A 132 21.276 4.289 1.569 1.00 3.32 N ATOM 0 H LYS A 132 20.743 0.786 -4.760 1.00 0.91 H new ATOM 0 HA LYS A 132 22.714 0.601 -3.664 1.00 1.64 H new ATOM 0 HB2 LYS A 132 22.996 2.290 -1.821 1.00 2.20 H new ATOM 0 HB3 LYS A 132 22.234 2.946 -3.256 1.00 2.20 H new ATOM 0 HG2 LYS A 132 20.012 2.803 -2.233 1.00 2.41 H new ATOM 0 HG3 LYS A 132 20.640 1.904 -0.866 1.00 2.41 H new ATOM 0 HD2 LYS A 132 22.271 4.032 -0.634 1.00 3.30 H new ATOM 0 HD3 LYS A 132 21.000 4.836 -1.535 1.00 3.30 H new ATOM 0 HE2 LYS A 132 19.679 4.936 0.321 1.00 3.69 H new ATOM 0 HE3 LYS A 132 19.773 3.198 0.530 1.00 3.69 H new ATOM 0 HZ1 LYS A 132 20.708 4.363 2.437 1.00 3.32 H new ATOM 0 HZ2 LYS A 132 21.921 3.477 1.645 1.00 3.32 H new ATOM 0 HZ3 LYS A 132 21.830 5.160 1.443 1.00 3.32 H new ATOM 1816 N ASN A 133 22.920 -1.071 -1.897 1.00 1.90 N ATOM 1817 CA ASN A 133 23.054 -2.101 -0.831 1.00 1.99 C ATOM 1818 C ASN A 133 21.767 -2.920 -0.779 1.00 1.65 C ATOM 1819 O ASN A 133 21.252 -3.234 0.276 1.00 1.70 O ATOM 1820 CB ASN A 133 23.294 -1.426 0.521 1.00 2.27 C ATOM 1821 CG ASN A 133 24.564 -0.576 0.451 1.00 3.22 C ATOM 1822 OD1 ASN A 133 25.658 -1.087 0.589 1.00 3.04 O ATOM 1823 ND2 ASN A 133 24.464 0.707 0.244 1.00 4.67 N ATOM 0 H ASN A 133 23.616 -1.124 -2.641 1.00 1.90 H new ATOM 0 HA ASN A 133 23.901 -2.752 -1.051 1.00 1.99 H new ATOM 0 HB2 ASN A 133 22.440 -0.802 0.784 1.00 2.27 H new ATOM 0 HB3 ASN A 133 23.391 -2.179 1.303 1.00 2.27 H new ATOM 0 HD21 ASN A 133 25.304 1.283 0.198 1.00 4.67 H new ATOM 0 HD22 ASN A 133 23.545 1.135 0.128 1.00 4.67 H new ATOM 1830 N LEU A 134 21.251 -3.267 -1.922 1.00 1.34 N ATOM 1831 CA LEU A 134 19.999 -4.066 -1.974 1.00 1.01 C ATOM 1832 C LEU A 134 20.054 -5.005 -3.175 1.00 0.82 C ATOM 1833 O LEU A 134 21.105 -5.266 -3.728 1.00 1.13 O ATOM 1834 CB LEU A 134 18.794 -3.134 -2.114 1.00 0.95 C ATOM 1835 CG LEU A 134 17.753 -3.484 -1.049 1.00 1.25 C ATOM 1836 CD1 LEU A 134 18.087 -2.752 0.251 1.00 1.34 C ATOM 1837 CD2 LEU A 134 16.365 -3.053 -1.532 1.00 1.94 C ATOM 0 H LEU A 134 21.647 -3.029 -2.831 1.00 1.34 H new ATOM 0 HA LEU A 134 19.900 -4.644 -1.055 1.00 1.01 H new ATOM 0 HB2 LEU A 134 19.108 -2.096 -2.003 1.00 0.95 H new ATOM 0 HB3 LEU A 134 18.359 -3.231 -3.109 1.00 0.95 H new ATOM 0 HG LEU A 134 17.761 -4.560 -0.874 1.00 1.25 H new ATOM 0 HD11 LEU A 134 17.345 -3.001 1.010 1.00 1.34 H new ATOM 0 HD12 LEU A 134 19.075 -3.056 0.596 1.00 1.34 H new ATOM 0 HD13 LEU A 134 18.079 -1.676 0.075 1.00 1.34 H new ATOM 0 HD21 LEU A 134 15.622 -3.302 -0.774 1.00 1.94 H new ATOM 0 HD22 LEU A 134 16.358 -1.977 -1.707 1.00 1.94 H new ATOM 0 HD23 LEU A 134 16.125 -3.573 -2.460 1.00 1.94 H new ATOM 1849 N ASP A 135 18.931 -5.522 -3.577 1.00 0.65 N ATOM 1850 CA ASP A 135 18.921 -6.454 -4.740 1.00 1.09 C ATOM 1851 C ASP A 135 17.907 -6.011 -5.794 1.00 1.19 C ATOM 1852 O ASP A 135 17.844 -6.577 -6.866 1.00 1.58 O ATOM 1853 CB ASP A 135 18.568 -7.863 -4.258 1.00 1.20 C ATOM 1854 CG ASP A 135 19.793 -8.505 -3.605 1.00 2.11 C ATOM 1855 OD1 ASP A 135 20.042 -8.216 -2.446 1.00 3.32 O ATOM 1856 OD2 ASP A 135 20.461 -9.278 -4.273 1.00 2.09 O ATOM 0 H ASP A 135 18.020 -5.342 -3.154 1.00 0.65 H new ATOM 0 HA ASP A 135 19.912 -6.448 -5.193 1.00 1.09 H new ATOM 0 HB2 ASP A 135 17.745 -7.819 -3.545 1.00 1.20 H new ATOM 0 HB3 ASP A 135 18.230 -8.471 -5.097 1.00 1.20 H new ATOM 1861 N ALA A 136 17.096 -5.028 -5.482 1.00 1.82 N ATOM 1862 CA ALA A 136 16.044 -4.534 -6.426 1.00 2.33 C ATOM 1863 C ALA A 136 14.770 -5.332 -6.210 1.00 2.03 C ATOM 1864 O ALA A 136 13.684 -4.869 -6.488 1.00 2.42 O ATOM 1865 CB ALA A 136 16.484 -4.635 -7.892 1.00 2.73 C ATOM 0 H ALA A 136 17.121 -4.535 -4.589 1.00 1.82 H new ATOM 0 HA ALA A 136 15.871 -3.478 -6.216 1.00 2.33 H new ATOM 0 HB1 ALA A 136 15.687 -4.265 -8.537 1.00 2.73 H new ATOM 0 HB2 ALA A 136 17.382 -4.036 -8.044 1.00 2.73 H new ATOM 0 HB3 ALA A 136 16.696 -5.676 -8.137 1.00 2.73 H new ATOM 1871 N ILE A 137 14.897 -6.505 -5.669 1.00 1.54 N ATOM 1872 CA ILE A 137 13.715 -7.330 -5.373 1.00 1.28 C ATOM 1873 C ILE A 137 12.854 -7.478 -6.609 1.00 1.83 C ATOM 1874 O ILE A 137 13.042 -8.380 -7.402 1.00 2.63 O ATOM 1875 CB ILE A 137 12.951 -6.680 -4.213 1.00 0.78 C ATOM 1876 CG1 ILE A 137 13.772 -6.807 -2.917 1.00 0.65 C ATOM 1877 CG2 ILE A 137 11.606 -7.379 -4.017 1.00 0.59 C ATOM 1878 CD1 ILE A 137 15.124 -6.086 -3.047 1.00 0.87 C ATOM 0 H ILE A 137 15.789 -6.930 -5.417 1.00 1.54 H new ATOM 0 HA ILE A 137 14.014 -8.335 -5.077 1.00 1.28 H new ATOM 0 HB ILE A 137 12.786 -5.628 -4.446 1.00 0.78 H new ATOM 0 HG12 ILE A 137 13.210 -6.385 -2.084 1.00 0.65 H new ATOM 0 HG13 ILE A 137 13.938 -7.860 -2.689 1.00 0.65 H new ATOM 0 HG21 ILE A 137 11.070 -6.911 -3.191 1.00 0.59 H new ATOM 0 HG22 ILE A 137 11.015 -7.293 -4.929 1.00 0.59 H new ATOM 0 HG23 ILE A 137 11.773 -8.432 -3.791 1.00 0.59 H new ATOM 0 HD11 ILE A 137 15.683 -6.192 -2.118 1.00 0.87 H new ATOM 0 HD12 ILE A 137 15.694 -6.526 -3.865 1.00 0.87 H new ATOM 0 HD13 ILE A 137 14.954 -5.029 -3.250 1.00 0.87 H new ATOM 1890 N THR A 138 11.922 -6.611 -6.789 1.00 2.42 N ATOM 1891 CA THR A 138 11.055 -6.701 -7.979 1.00 3.04 C ATOM 1892 C THR A 138 10.156 -7.927 -7.874 1.00 1.33 C ATOM 1893 O THR A 138 10.559 -8.970 -7.400 1.00 1.37 O ATOM 1894 CB THR A 138 11.905 -6.813 -9.246 1.00 4.80 C ATOM 1895 OG1 THR A 138 13.238 -6.403 -8.977 1.00 5.71 O ATOM 1896 CG2 THR A 138 11.312 -5.924 -10.326 1.00 6.27 C ATOM 0 H THR A 138 11.718 -5.835 -6.159 1.00 2.42 H new ATOM 0 HA THR A 138 10.444 -5.800 -8.031 1.00 3.04 H new ATOM 0 HB THR A 138 11.913 -7.850 -9.582 1.00 4.80 H new ATOM 0 HG1 THR A 138 13.775 -6.480 -9.793 1.00 5.71 H new ATOM 0 HG21 THR A 138 11.914 -6.000 -11.231 1.00 6.27 H new ATOM 0 HG22 THR A 138 10.292 -6.243 -10.541 1.00 6.27 H new ATOM 0 HG23 THR A 138 11.304 -4.890 -9.982 1.00 6.27 H new ATOM 1904 N THR A 139 8.941 -7.796 -8.324 1.00 1.97 N ATOM 1905 CA THR A 139 7.960 -8.919 -8.286 1.00 0.58 C ATOM 1906 C THR A 139 6.573 -8.300 -8.526 1.00 2.01 C ATOM 1907 O THR A 139 5.929 -7.869 -7.590 1.00 3.68 O ATOM 1908 CB THR A 139 8.025 -9.639 -6.915 1.00 2.66 C ATOM 1909 OG1 THR A 139 8.971 -10.695 -6.991 1.00 4.41 O ATOM 1910 CG2 THR A 139 6.662 -10.235 -6.527 1.00 4.25 C ATOM 0 H THR A 139 8.576 -6.934 -8.728 1.00 1.97 H new ATOM 0 HA THR A 139 8.179 -9.667 -9.048 1.00 0.58 H new ATOM 0 HB THR A 139 8.313 -8.906 -6.161 1.00 2.66 H new ATOM 0 HG1 THR A 139 9.878 -10.323 -6.981 1.00 4.41 H new ATOM 0 HG21 THR A 139 6.744 -10.732 -5.561 1.00 4.25 H new ATOM 0 HG22 THR A 139 5.921 -9.438 -6.463 1.00 4.25 H new ATOM 0 HG23 THR A 139 6.353 -10.958 -7.282 1.00 4.25 H new ATOM 1918 N PRO A 140 6.156 -8.249 -9.772 1.00 2.80 N ATOM 1919 CA PRO A 140 4.862 -7.654 -10.131 1.00 4.12 C ATOM 1920 C PRO A 140 3.717 -8.573 -9.744 1.00 2.59 C ATOM 1921 O PRO A 140 2.643 -8.126 -9.391 1.00 2.38 O ATOM 1922 CB PRO A 140 4.948 -7.466 -11.649 1.00 5.87 C ATOM 1923 CG PRO A 140 6.032 -8.449 -12.148 1.00 5.93 C ATOM 1924 CD PRO A 140 6.916 -8.780 -10.931 1.00 4.18 C ATOM 0 HA PRO A 140 4.669 -6.716 -9.611 1.00 4.12 H new ATOM 0 HB2 PRO A 140 3.988 -7.674 -12.121 1.00 5.87 H new ATOM 0 HB3 PRO A 140 5.211 -6.438 -11.899 1.00 5.87 H new ATOM 0 HG2 PRO A 140 5.578 -9.353 -12.555 1.00 5.93 H new ATOM 0 HG3 PRO A 140 6.623 -8.001 -12.947 1.00 5.93 H new ATOM 0 HD2 PRO A 140 7.082 -9.853 -10.840 1.00 4.18 H new ATOM 0 HD3 PRO A 140 7.897 -8.311 -11.012 1.00 4.18 H new ATOM 1932 N ASP A 141 3.924 -9.853 -9.811 1.00 1.85 N ATOM 1933 CA ASP A 141 2.842 -10.786 -9.454 1.00 1.70 C ATOM 1934 C ASP A 141 1.603 -10.442 -10.294 1.00 1.28 C ATOM 1935 O ASP A 141 0.550 -10.217 -9.743 1.00 1.34 O ATOM 1936 CB ASP A 141 2.538 -10.624 -7.962 1.00 3.45 C ATOM 1937 CG ASP A 141 2.627 -11.983 -7.264 1.00 4.48 C ATOM 1938 OD1 ASP A 141 3.606 -12.677 -7.483 1.00 4.34 O ATOM 1939 OD2 ASP A 141 1.711 -12.307 -6.525 1.00 5.80 O ATOM 0 H ASP A 141 4.800 -10.289 -10.099 1.00 1.85 H new ATOM 0 HA ASP A 141 3.132 -11.818 -9.652 1.00 1.70 H new ATOM 0 HB2 ASP A 141 3.244 -9.927 -7.511 1.00 3.45 H new ATOM 0 HB3 ASP A 141 1.542 -10.201 -7.828 1.00 3.45 H new ATOM 1944 N PRO A 142 1.768 -10.395 -11.610 1.00 0.98 N ATOM 1945 CA PRO A 142 0.661 -10.071 -12.531 1.00 0.85 C ATOM 1946 C PRO A 142 -0.240 -11.291 -12.688 1.00 1.13 C ATOM 1947 O PRO A 142 -1.413 -11.259 -12.371 1.00 1.52 O ATOM 1948 CB PRO A 142 1.361 -9.750 -13.852 1.00 0.85 C ATOM 1949 CG PRO A 142 2.738 -10.448 -13.793 1.00 0.90 C ATOM 1950 CD PRO A 142 3.056 -10.658 -12.302 1.00 1.03 C ATOM 0 HA PRO A 142 0.035 -9.249 -12.183 1.00 0.85 H new ATOM 0 HB2 PRO A 142 0.778 -10.111 -14.699 1.00 0.85 H new ATOM 0 HB3 PRO A 142 1.476 -8.674 -13.980 1.00 0.85 H new ATOM 0 HG2 PRO A 142 2.713 -11.400 -14.323 1.00 0.90 H new ATOM 0 HG3 PRO A 142 3.504 -9.837 -14.271 1.00 0.90 H new ATOM 0 HD2 PRO A 142 3.411 -11.671 -12.110 1.00 1.03 H new ATOM 0 HD3 PRO A 142 3.836 -9.977 -11.962 1.00 1.03 H new ATOM 1958 N THR A 143 0.309 -12.377 -13.159 1.00 1.01 N ATOM 1959 CA THR A 143 -0.506 -13.605 -13.311 1.00 1.42 C ATOM 1960 C THR A 143 -1.001 -14.007 -11.927 1.00 1.48 C ATOM 1961 O THR A 143 -2.047 -14.607 -11.779 1.00 1.89 O ATOM 1962 CB THR A 143 0.350 -14.726 -13.905 1.00 1.60 C ATOM 1963 OG1 THR A 143 1.285 -15.172 -12.932 1.00 1.96 O ATOM 1964 CG2 THR A 143 1.095 -14.198 -15.129 1.00 1.19 C ATOM 0 H THR A 143 1.285 -12.463 -13.443 1.00 1.01 H new ATOM 0 HA THR A 143 -1.348 -13.425 -13.979 1.00 1.42 H new ATOM 0 HB THR A 143 -0.289 -15.558 -14.200 1.00 1.60 H new ATOM 0 HG1 THR A 143 1.833 -15.891 -13.310 1.00 1.96 H new ATOM 0 HG21 THR A 143 1.706 -14.994 -15.555 1.00 1.19 H new ATOM 0 HG22 THR A 143 0.376 -13.855 -15.873 1.00 1.19 H new ATOM 0 HG23 THR A 143 1.736 -13.367 -14.834 1.00 1.19 H new ATOM 1972 N THR A 144 -0.266 -13.655 -10.903 1.00 1.22 N ATOM 1973 CA THR A 144 -0.715 -13.995 -9.530 1.00 1.40 C ATOM 1974 C THR A 144 -1.720 -12.937 -9.080 1.00 1.16 C ATOM 1975 O THR A 144 -2.594 -13.193 -8.276 1.00 1.43 O ATOM 1976 CB THR A 144 0.480 -13.990 -8.586 1.00 1.51 C ATOM 1977 OG1 THR A 144 1.517 -14.793 -9.132 1.00 1.72 O ATOM 1978 CG2 THR A 144 0.064 -14.540 -7.221 1.00 1.92 C ATOM 0 H THR A 144 0.619 -13.151 -10.962 1.00 1.22 H new ATOM 0 HA THR A 144 -1.174 -14.984 -9.519 1.00 1.40 H new ATOM 0 HB THR A 144 0.840 -12.968 -8.463 1.00 1.51 H new ATOM 0 HG1 THR A 144 2.287 -14.789 -8.526 1.00 1.72 H new ATOM 0 HG21 THR A 144 0.923 -14.534 -6.549 1.00 1.92 H new ATOM 0 HG22 THR A 144 -0.727 -13.917 -6.804 1.00 1.92 H new ATOM 0 HG23 THR A 144 -0.300 -15.561 -7.336 1.00 1.92 H new ATOM 1986 N ASN A 145 -1.615 -11.749 -9.619 1.00 0.80 N ATOM 1987 CA ASN A 145 -2.583 -10.682 -9.249 1.00 0.83 C ATOM 1988 C ASN A 145 -3.846 -10.861 -10.085 1.00 1.01 C ATOM 1989 O ASN A 145 -4.824 -10.172 -9.900 1.00 0.93 O ATOM 1990 CB ASN A 145 -1.988 -9.297 -9.501 1.00 0.96 C ATOM 1991 CG ASN A 145 -1.269 -8.828 -8.234 1.00 0.56 C ATOM 1992 OD1 ASN A 145 -0.137 -8.391 -8.288 1.00 0.42 O ATOM 1993 ND2 ASN A 145 -1.890 -8.902 -7.084 1.00 0.61 N ATOM 0 H ASN A 145 -0.903 -11.476 -10.296 1.00 0.80 H new ATOM 0 HA ASN A 145 -2.817 -10.761 -8.187 1.00 0.83 H new ATOM 0 HB2 ASN A 145 -1.291 -9.333 -10.338 1.00 0.96 H new ATOM 0 HB3 ASN A 145 -2.775 -8.592 -9.771 1.00 0.96 H new ATOM 0 HD21 ASN A 145 -1.423 -8.592 -6.232 1.00 0.61 H new ATOM 0 HD22 ASN A 145 -2.841 -9.269 -7.040 1.00 0.61 H new ATOM 2000 N ALA A 146 -3.848 -11.804 -10.986 1.00 1.43 N ATOM 2001 CA ALA A 146 -5.067 -12.048 -11.781 1.00 1.77 C ATOM 2002 C ALA A 146 -5.975 -12.922 -10.928 1.00 1.87 C ATOM 2003 O ALA A 146 -7.176 -12.875 -11.032 1.00 2.09 O ATOM 2004 CB ALA A 146 -4.705 -12.766 -13.083 1.00 2.03 C ATOM 0 H ALA A 146 -3.057 -12.411 -11.200 1.00 1.43 H new ATOM 0 HA ALA A 146 -5.563 -11.114 -12.045 1.00 1.77 H new ATOM 0 HB1 ALA A 146 -5.610 -12.943 -13.665 1.00 2.03 H new ATOM 0 HB2 ALA A 146 -4.017 -12.148 -13.660 1.00 2.03 H new ATOM 0 HB3 ALA A 146 -4.230 -13.719 -12.853 1.00 2.03 H new ATOM 2010 N SER A 147 -5.391 -13.698 -10.054 1.00 1.77 N ATOM 2011 CA SER A 147 -6.194 -14.556 -9.151 1.00 1.96 C ATOM 2012 C SER A 147 -6.612 -13.707 -7.952 1.00 1.70 C ATOM 2013 O SER A 147 -7.751 -13.724 -7.526 1.00 1.71 O ATOM 2014 CB SER A 147 -5.327 -15.725 -8.679 1.00 2.08 C ATOM 2015 OG SER A 147 -6.164 -16.791 -8.249 1.00 2.70 O ATOM 0 H SER A 147 -4.381 -13.771 -9.930 1.00 1.77 H new ATOM 0 HA SER A 147 -7.074 -14.947 -9.661 1.00 1.96 H new ATOM 0 HB2 SER A 147 -4.679 -16.061 -9.488 1.00 2.08 H new ATOM 0 HB3 SER A 147 -4.679 -15.405 -7.863 1.00 2.08 H new ATOM 0 HG SER A 147 -5.610 -17.541 -7.948 1.00 2.70 H new ATOM 2021 N LEU A 148 -5.694 -12.948 -7.419 1.00 1.47 N ATOM 2022 CA LEU A 148 -6.023 -12.072 -6.262 1.00 1.22 C ATOM 2023 C LEU A 148 -7.066 -11.056 -6.708 1.00 1.17 C ATOM 2024 O LEU A 148 -8.130 -10.965 -6.151 1.00 1.15 O ATOM 2025 CB LEU A 148 -4.762 -11.325 -5.811 1.00 0.92 C ATOM 2026 CG LEU A 148 -5.144 -10.153 -4.888 1.00 0.71 C ATOM 2027 CD1 LEU A 148 -6.050 -10.645 -3.756 1.00 0.84 C ATOM 2028 CD2 LEU A 148 -3.890 -9.535 -4.291 1.00 0.56 C ATOM 0 H LEU A 148 -4.726 -12.898 -7.738 1.00 1.47 H new ATOM 0 HA LEU A 148 -6.404 -12.673 -5.437 1.00 1.22 H new ATOM 0 HB2 LEU A 148 -4.093 -12.008 -5.287 1.00 0.92 H new ATOM 0 HB3 LEU A 148 -4.220 -10.952 -6.680 1.00 0.92 H new ATOM 0 HG LEU A 148 -5.676 -9.406 -5.477 1.00 0.71 H new ATOM 0 HD11 LEU A 148 -6.313 -9.807 -3.110 1.00 0.84 H new ATOM 0 HD12 LEU A 148 -6.957 -11.077 -4.178 1.00 0.84 H new ATOM 0 HD13 LEU A 148 -5.525 -11.402 -3.173 1.00 0.84 H new ATOM 0 HD21 LEU A 148 -4.167 -8.707 -3.639 1.00 0.56 H new ATOM 0 HD22 LEU A 148 -3.353 -10.287 -3.713 1.00 0.56 H new ATOM 0 HD23 LEU A 148 -3.249 -9.167 -5.092 1.00 0.56 H new ATOM 2040 N LEU A 149 -6.732 -10.282 -7.697 1.00 1.16 N ATOM 2041 CA LEU A 149 -7.663 -9.243 -8.215 1.00 1.13 C ATOM 2042 C LEU A 149 -8.983 -9.902 -8.596 1.00 1.31 C ATOM 2043 O LEU A 149 -10.043 -9.444 -8.234 1.00 1.43 O ATOM 2044 CB LEU A 149 -7.027 -8.608 -9.456 1.00 1.22 C ATOM 2045 CG LEU A 149 -7.706 -7.277 -9.797 1.00 1.11 C ATOM 2046 CD1 LEU A 149 -7.711 -6.358 -8.573 1.00 1.03 C ATOM 2047 CD2 LEU A 149 -6.929 -6.604 -10.932 1.00 1.24 C ATOM 0 H LEU A 149 -5.834 -10.325 -8.179 1.00 1.16 H new ATOM 0 HA LEU A 149 -7.849 -8.481 -7.458 1.00 1.13 H new ATOM 0 HB2 LEU A 149 -5.964 -8.444 -9.281 1.00 1.22 H new ATOM 0 HB3 LEU A 149 -7.110 -9.291 -10.302 1.00 1.22 H new ATOM 0 HG LEU A 149 -8.736 -7.463 -10.102 1.00 1.11 H new ATOM 0 HD11 LEU A 149 -8.196 -5.416 -8.828 1.00 1.03 H new ATOM 0 HD12 LEU A 149 -8.255 -6.838 -7.760 1.00 1.03 H new ATOM 0 HD13 LEU A 149 -6.685 -6.165 -8.259 1.00 1.03 H new ATOM 0 HD21 LEU A 149 -7.402 -5.655 -11.184 1.00 1.24 H new ATOM 0 HD22 LEU A 149 -5.902 -6.424 -10.613 1.00 1.24 H new ATOM 0 HD23 LEU A 149 -6.928 -7.253 -11.808 1.00 1.24 H new ATOM 2059 N THR A 150 -8.925 -10.986 -9.313 1.00 1.31 N ATOM 2060 CA THR A 150 -10.177 -11.691 -9.704 1.00 1.48 C ATOM 2061 C THR A 150 -10.962 -12.033 -8.428 1.00 1.37 C ATOM 2062 O THR A 150 -12.171 -12.149 -8.436 1.00 1.36 O ATOM 2063 CB THR A 150 -9.788 -12.966 -10.474 1.00 1.79 C ATOM 2064 OG1 THR A 150 -9.424 -12.611 -11.800 1.00 1.79 O ATOM 2065 CG2 THR A 150 -10.947 -13.959 -10.529 1.00 1.60 C ATOM 0 H THR A 150 -8.063 -11.417 -9.647 1.00 1.31 H new ATOM 0 HA THR A 150 -10.805 -11.069 -10.342 1.00 1.48 H new ATOM 0 HB THR A 150 -8.954 -13.439 -9.955 1.00 1.79 H new ATOM 0 HG1 THR A 150 -8.487 -12.852 -11.958 1.00 1.79 H new ATOM 0 HG21 THR A 150 -10.639 -14.848 -11.080 1.00 1.60 H new ATOM 0 HG22 THR A 150 -11.233 -14.241 -9.516 1.00 1.60 H new ATOM 0 HG23 THR A 150 -11.798 -13.498 -11.031 1.00 1.60 H new ATOM 2073 N LYS A 151 -10.266 -12.201 -7.338 1.00 1.31 N ATOM 2074 CA LYS A 151 -10.933 -12.544 -6.047 1.00 1.26 C ATOM 2075 C LYS A 151 -11.420 -11.280 -5.315 1.00 1.11 C ATOM 2076 O LYS A 151 -12.395 -11.328 -4.590 1.00 1.22 O ATOM 2077 CB LYS A 151 -9.941 -13.288 -5.152 1.00 1.29 C ATOM 2078 CG LYS A 151 -10.655 -13.776 -3.890 1.00 1.32 C ATOM 2079 CD LYS A 151 -9.755 -13.551 -2.673 1.00 1.32 C ATOM 2080 CE LYS A 151 -10.123 -12.225 -2.004 1.00 1.28 C ATOM 2081 NZ LYS A 151 -9.944 -12.348 -0.530 1.00 1.88 N ATOM 0 H LYS A 151 -9.251 -12.115 -7.285 1.00 1.31 H new ATOM 0 HA LYS A 151 -11.798 -13.170 -6.265 1.00 1.26 H new ATOM 0 HB2 LYS A 151 -9.514 -14.134 -5.690 1.00 1.29 H new ATOM 0 HB3 LYS A 151 -9.114 -12.631 -4.883 1.00 1.29 H new ATOM 0 HG2 LYS A 151 -11.596 -13.242 -3.763 1.00 1.32 H new ATOM 0 HG3 LYS A 151 -10.899 -14.834 -3.984 1.00 1.32 H new ATOM 0 HD2 LYS A 151 -9.871 -14.372 -1.965 1.00 1.32 H new ATOM 0 HD3 LYS A 151 -8.709 -13.538 -2.979 1.00 1.32 H new ATOM 0 HE2 LYS A 151 -9.495 -11.423 -2.392 1.00 1.28 H new ATOM 0 HE3 LYS A 151 -11.155 -11.962 -2.235 1.00 1.28 H new ATOM 0 HZ1 LYS A 151 -10.194 -11.447 -0.074 1.00 1.88 H new ATOM 0 HZ2 LYS A 151 -10.561 -13.103 -0.167 1.00 1.88 H new ATOM 0 HZ3 LYS A 151 -8.952 -12.580 -0.319 1.00 1.88 H new ATOM 2095 N LEU A 152 -10.772 -10.146 -5.484 1.00 0.89 N ATOM 2096 CA LEU A 152 -11.249 -8.923 -4.778 1.00 0.77 C ATOM 2097 C LEU A 152 -12.541 -8.475 -5.446 1.00 0.84 C ATOM 2098 O LEU A 152 -13.531 -8.193 -4.800 1.00 0.93 O ATOM 2099 CB LEU A 152 -10.216 -7.790 -4.893 1.00 0.61 C ATOM 2100 CG LEU A 152 -8.810 -8.293 -4.553 1.00 0.82 C ATOM 2101 CD1 LEU A 152 -7.777 -7.360 -5.187 1.00 0.70 C ATOM 2102 CD2 LEU A 152 -8.612 -8.300 -3.036 1.00 0.89 C ATOM 0 H LEU A 152 -9.948 -10.022 -6.072 1.00 0.89 H new ATOM 0 HA LEU A 152 -11.402 -9.148 -3.723 1.00 0.77 H new ATOM 0 HB2 LEU A 152 -10.226 -7.385 -5.905 1.00 0.61 H new ATOM 0 HB3 LEU A 152 -10.487 -6.976 -4.221 1.00 0.61 H new ATOM 0 HG LEU A 152 -8.687 -9.305 -4.938 1.00 0.82 H new ATOM 0 HD11 LEU A 152 -6.774 -7.713 -4.949 1.00 0.70 H new ATOM 0 HD12 LEU A 152 -7.911 -7.350 -6.269 1.00 0.70 H new ATOM 0 HD13 LEU A 152 -7.909 -6.351 -4.796 1.00 0.70 H new ATOM 0 HD21 LEU A 152 -7.610 -8.659 -2.802 1.00 0.89 H new ATOM 0 HD22 LEU A 152 -8.735 -7.289 -2.648 1.00 0.89 H new ATOM 0 HD23 LEU A 152 -9.350 -8.957 -2.576 1.00 0.89 H new ATOM 2114 N GLN A 153 -12.527 -8.404 -6.746 1.00 0.81 N ATOM 2115 CA GLN A 153 -13.734 -7.970 -7.487 1.00 0.88 C ATOM 2116 C GLN A 153 -14.824 -9.038 -7.373 1.00 1.05 C ATOM 2117 O GLN A 153 -15.985 -8.734 -7.181 1.00 1.42 O ATOM 2118 CB GLN A 153 -13.373 -7.761 -8.960 1.00 0.99 C ATOM 2119 CG GLN A 153 -12.586 -6.458 -9.115 1.00 0.98 C ATOM 2120 CD GLN A 153 -12.397 -6.148 -10.601 1.00 1.58 C ATOM 2121 OE1 GLN A 153 -11.491 -6.657 -11.229 1.00 3.10 O ATOM 2122 NE2 GLN A 153 -13.221 -5.328 -11.194 1.00 1.11 N ATOM 0 H GLN A 153 -11.722 -8.631 -7.329 1.00 0.81 H new ATOM 0 HA GLN A 153 -14.104 -7.036 -7.064 1.00 0.88 H new ATOM 0 HB2 GLN A 153 -12.780 -8.601 -9.322 1.00 0.99 H new ATOM 0 HB3 GLN A 153 -14.279 -7.725 -9.565 1.00 0.99 H new ATOM 0 HG2 GLN A 153 -13.116 -5.640 -8.627 1.00 0.98 H new ATOM 0 HG3 GLN A 153 -11.616 -6.546 -8.625 1.00 0.98 H new ATOM 0 HE21 GLN A 153 -13.982 -4.900 -10.667 1.00 1.11 H new ATOM 0 HE22 GLN A 153 -13.104 -5.115 -12.185 1.00 1.11 H new ATOM 2131 N ALA A 154 -14.462 -10.286 -7.491 1.00 0.84 N ATOM 2132 CA ALA A 154 -15.478 -11.373 -7.391 1.00 0.99 C ATOM 2133 C ALA A 154 -16.259 -11.231 -6.083 1.00 0.84 C ATOM 2134 O ALA A 154 -17.365 -11.716 -5.953 1.00 0.91 O ATOM 2135 CB ALA A 154 -14.776 -12.731 -7.420 1.00 1.28 C ATOM 0 H ALA A 154 -13.505 -10.601 -7.653 1.00 0.84 H new ATOM 0 HA ALA A 154 -16.167 -11.300 -8.232 1.00 0.99 H new ATOM 0 HB1 ALA A 154 -15.518 -13.526 -7.347 1.00 1.28 H new ATOM 0 HB2 ALA A 154 -14.224 -12.835 -8.354 1.00 1.28 H new ATOM 0 HB3 ALA A 154 -14.085 -12.801 -6.580 1.00 1.28 H new ATOM 2141 N GLN A 155 -15.692 -10.572 -5.110 1.00 1.08 N ATOM 2142 CA GLN A 155 -16.398 -10.400 -3.810 1.00 0.99 C ATOM 2143 C GLN A 155 -17.775 -9.773 -4.046 1.00 0.86 C ATOM 2144 O GLN A 155 -18.003 -9.103 -5.035 1.00 0.81 O ATOM 2145 CB GLN A 155 -15.571 -9.484 -2.905 1.00 0.82 C ATOM 2146 CG GLN A 155 -14.250 -10.171 -2.553 1.00 1.14 C ATOM 2147 CD GLN A 155 -14.201 -10.445 -1.049 1.00 1.63 C ATOM 2148 OE1 GLN A 155 -15.108 -11.033 -0.495 1.00 2.07 O ATOM 2149 NE2 GLN A 155 -13.168 -10.042 -0.360 1.00 1.76 N ATOM 0 H GLN A 155 -14.767 -10.144 -5.160 1.00 1.08 H new ATOM 0 HA GLN A 155 -16.524 -11.373 -3.335 1.00 0.99 H new ATOM 0 HB2 GLN A 155 -15.378 -8.537 -3.408 1.00 0.82 H new ATOM 0 HB3 GLN A 155 -16.127 -9.255 -1.996 1.00 0.82 H new ATOM 0 HG2 GLN A 155 -14.155 -11.105 -3.107 1.00 1.14 H new ATOM 0 HG3 GLN A 155 -13.411 -9.540 -2.846 1.00 1.14 H new ATOM 0 HE21 GLN A 155 -12.406 -9.548 -0.825 1.00 1.76 H new ATOM 0 HE22 GLN A 155 -13.123 -10.221 0.643 1.00 1.76 H new ATOM 2158 N ASN A 156 -18.692 -9.980 -3.140 1.00 0.82 N ATOM 2159 CA ASN A 156 -20.053 -9.393 -3.303 1.00 0.72 C ATOM 2160 C ASN A 156 -19.955 -7.868 -3.268 1.00 0.53 C ATOM 2161 O ASN A 156 -18.899 -7.312 -3.047 1.00 0.57 O ATOM 2162 CB ASN A 156 -20.952 -9.871 -2.158 1.00 0.71 C ATOM 2163 CG ASN A 156 -21.532 -11.243 -2.502 1.00 0.67 C ATOM 2164 OD1 ASN A 156 -22.397 -11.356 -3.347 1.00 0.81 O ATOM 2165 ND2 ASN A 156 -21.090 -12.300 -1.876 1.00 0.94 N ATOM 0 H ASN A 156 -18.557 -10.531 -2.292 1.00 0.82 H new ATOM 0 HA ASN A 156 -20.476 -9.710 -4.256 1.00 0.72 H new ATOM 0 HB2 ASN A 156 -20.380 -9.928 -1.232 1.00 0.71 H new ATOM 0 HB3 ASN A 156 -21.757 -9.156 -1.991 1.00 0.71 H new ATOM 0 HD21 ASN A 156 -21.471 -13.220 -2.097 1.00 0.94 H new ATOM 0 HD22 ASN A 156 -20.364 -12.206 -1.166 1.00 0.94 H new ATOM 2172 N GLN A 157 -21.047 -7.186 -3.475 1.00 0.53 N ATOM 2173 CA GLN A 157 -21.012 -5.697 -3.439 1.00 0.45 C ATOM 2174 C GLN A 157 -20.653 -5.251 -2.023 1.00 0.40 C ATOM 2175 O GLN A 157 -20.015 -4.237 -1.817 1.00 0.41 O ATOM 2176 CB GLN A 157 -22.388 -5.144 -3.817 1.00 0.51 C ATOM 2177 CG GLN A 157 -22.360 -3.616 -3.758 1.00 0.24 C ATOM 2178 CD GLN A 157 -23.305 -3.047 -4.817 1.00 0.60 C ATOM 2179 OE1 GLN A 157 -24.427 -3.495 -4.951 1.00 1.55 O ATOM 2180 NE2 GLN A 157 -22.897 -2.071 -5.581 1.00 0.60 N ATOM 0 H GLN A 157 -21.961 -7.595 -3.667 1.00 0.53 H new ATOM 0 HA GLN A 157 -20.271 -5.324 -4.146 1.00 0.45 H new ATOM 0 HB2 GLN A 157 -22.661 -5.474 -4.819 1.00 0.51 H new ATOM 0 HB3 GLN A 157 -23.146 -5.531 -3.136 1.00 0.51 H new ATOM 0 HG2 GLN A 157 -22.659 -3.274 -2.767 1.00 0.24 H new ATOM 0 HG3 GLN A 157 -21.346 -3.253 -3.928 1.00 0.24 H new ATOM 0 HE21 GLN A 157 -21.956 -1.695 -5.469 1.00 0.60 H new ATOM 0 HE22 GLN A 157 -23.520 -1.684 -6.290 1.00 0.60 H new ATOM 2189 N TRP A 158 -21.056 -6.014 -1.046 1.00 0.41 N ATOM 2190 CA TRP A 158 -20.746 -5.664 0.366 1.00 0.48 C ATOM 2191 C TRP A 158 -19.237 -5.779 0.594 1.00 0.54 C ATOM 2192 O TRP A 158 -18.558 -4.807 0.869 1.00 0.54 O ATOM 2193 CB TRP A 158 -21.475 -6.644 1.286 1.00 0.52 C ATOM 2194 CG TRP A 158 -21.350 -6.190 2.703 1.00 0.76 C ATOM 2195 CD1 TRP A 158 -20.185 -6.072 3.380 1.00 0.92 C ATOM 2196 CD2 TRP A 158 -22.404 -5.795 3.630 1.00 1.03 C ATOM 2197 NE1 TRP A 158 -20.456 -5.628 4.663 1.00 1.17 N ATOM 2198 CE2 TRP A 158 -21.809 -5.442 4.864 1.00 1.22 C ATOM 2199 CE3 TRP A 158 -23.803 -5.707 3.518 1.00 1.27 C ATOM 2200 CZ2 TRP A 158 -22.576 -5.021 5.952 1.00 1.50 C ATOM 2201 CZ3 TRP A 158 -24.578 -5.284 4.609 1.00 1.59 C ATOM 2202 CH2 TRP A 158 -23.965 -4.940 5.823 1.00 1.66 C ATOM 0 H TRP A 158 -21.592 -6.873 -1.168 1.00 0.41 H new ATOM 0 HA TRP A 158 -21.068 -4.645 0.579 1.00 0.48 H new ATOM 0 HB2 TRP A 158 -22.526 -6.708 1.006 1.00 0.52 H new ATOM 0 HB3 TRP A 158 -21.054 -7.643 1.176 1.00 0.52 H new ATOM 0 HD1 TRP A 158 -19.204 -6.289 2.984 1.00 0.92 H new ATOM 0 HE1 TRP A 158 -19.743 -5.459 5.373 1.00 1.17 H new ATOM 0 HE3 TRP A 158 -24.284 -5.967 2.587 1.00 1.27 H new ATOM 0 HZ2 TRP A 158 -22.100 -4.760 6.886 1.00 1.50 H new ATOM 0 HZ3 TRP A 158 -25.652 -5.223 4.513 1.00 1.59 H new ATOM 0 HH2 TRP A 158 -24.567 -4.613 6.658 1.00 1.66 H new ATOM 2213 N LEU A 159 -18.708 -6.966 0.475 1.00 0.64 N ATOM 2214 CA LEU A 159 -17.246 -7.155 0.676 1.00 0.73 C ATOM 2215 C LEU A 159 -16.471 -6.284 -0.318 1.00 0.67 C ATOM 2216 O LEU A 159 -15.300 -6.019 -0.138 1.00 0.65 O ATOM 2217 CB LEU A 159 -16.888 -8.626 0.461 1.00 0.82 C ATOM 2218 CG LEU A 159 -17.217 -9.417 1.726 1.00 1.04 C ATOM 2219 CD1 LEU A 159 -17.432 -10.888 1.366 1.00 1.04 C ATOM 2220 CD2 LEU A 159 -16.054 -9.298 2.716 1.00 1.23 C ATOM 0 H LEU A 159 -19.227 -7.814 0.247 1.00 0.64 H new ATOM 0 HA LEU A 159 -16.979 -6.862 1.692 1.00 0.73 H new ATOM 0 HB2 LEU A 159 -17.443 -9.027 -0.387 1.00 0.82 H new ATOM 0 HB3 LEU A 159 -15.829 -8.723 0.223 1.00 0.82 H new ATOM 0 HG LEU A 159 -18.124 -9.018 2.180 1.00 1.04 H new ATOM 0 HD11 LEU A 159 -17.667 -11.453 2.268 1.00 1.04 H new ATOM 0 HD12 LEU A 159 -18.258 -10.973 0.660 1.00 1.04 H new ATOM 0 HD13 LEU A 159 -16.525 -11.288 0.913 1.00 1.04 H new ATOM 0 HD21 LEU A 159 -16.286 -9.862 3.620 1.00 1.23 H new ATOM 0 HD22 LEU A 159 -15.147 -9.698 2.262 1.00 1.23 H new ATOM 0 HD23 LEU A 159 -15.900 -8.250 2.972 1.00 1.23 H new ATOM 2232 N GLN A 160 -17.113 -5.830 -1.363 1.00 0.64 N ATOM 2233 CA GLN A 160 -16.407 -4.971 -2.352 1.00 0.60 C ATOM 2234 C GLN A 160 -16.112 -3.618 -1.707 1.00 0.55 C ATOM 2235 O GLN A 160 -14.992 -3.147 -1.710 1.00 0.62 O ATOM 2236 CB GLN A 160 -17.295 -4.769 -3.581 1.00 0.62 C ATOM 2237 CG GLN A 160 -16.718 -5.546 -4.765 1.00 0.72 C ATOM 2238 CD GLN A 160 -16.625 -4.625 -5.982 1.00 0.40 C ATOM 2239 OE1 GLN A 160 -15.835 -3.702 -6.001 1.00 1.34 O ATOM 2240 NE2 GLN A 160 -17.403 -4.840 -7.006 1.00 0.95 N ATOM 0 H GLN A 160 -18.094 -6.018 -1.572 1.00 0.64 H new ATOM 0 HA GLN A 160 -15.476 -5.447 -2.658 1.00 0.60 H new ATOM 0 HB2 GLN A 160 -18.309 -5.109 -3.369 1.00 0.62 H new ATOM 0 HB3 GLN A 160 -17.359 -3.709 -3.825 1.00 0.62 H new ATOM 0 HG2 GLN A 160 -15.731 -5.934 -4.513 1.00 0.72 H new ATOM 0 HG3 GLN A 160 -17.350 -6.405 -4.993 1.00 0.72 H new ATOM 0 HE21 GLN A 160 -18.066 -5.615 -6.989 1.00 0.95 H new ATOM 0 HE22 GLN A 160 -17.349 -4.233 -7.824 1.00 0.95 H new ATOM 2249 N ASP A 161 -17.110 -2.992 -1.146 1.00 0.50 N ATOM 2250 CA ASP A 161 -16.886 -1.675 -0.493 1.00 0.47 C ATOM 2251 C ASP A 161 -15.824 -1.833 0.596 1.00 0.44 C ATOM 2252 O ASP A 161 -14.968 -0.988 0.769 1.00 0.30 O ATOM 2253 CB ASP A 161 -18.193 -1.185 0.133 1.00 0.50 C ATOM 2254 CG ASP A 161 -18.006 0.243 0.646 1.00 0.49 C ATOM 2255 OD1 ASP A 161 -17.128 0.923 0.141 1.00 0.43 O ATOM 2256 OD2 ASP A 161 -18.742 0.631 1.538 1.00 0.91 O ATOM 0 H ASP A 161 -18.069 -3.337 -1.112 1.00 0.50 H new ATOM 0 HA ASP A 161 -16.549 -0.949 -1.233 1.00 0.47 H new ATOM 0 HB2 ASP A 161 -18.996 -1.216 -0.603 1.00 0.50 H new ATOM 0 HB3 ASP A 161 -18.486 -1.842 0.952 1.00 0.50 H new ATOM 2261 N MET A 162 -15.868 -2.914 1.328 1.00 0.60 N ATOM 2262 CA MET A 162 -14.853 -3.128 2.401 1.00 0.59 C ATOM 2263 C MET A 162 -13.474 -3.332 1.767 1.00 0.50 C ATOM 2264 O MET A 162 -12.460 -3.012 2.347 1.00 0.40 O ATOM 2265 CB MET A 162 -15.227 -4.372 3.217 1.00 0.70 C ATOM 2266 CG MET A 162 -14.131 -4.670 4.247 1.00 1.58 C ATOM 2267 SD MET A 162 -13.206 -6.145 3.744 1.00 0.66 S ATOM 2268 CE MET A 162 -11.632 -5.327 3.381 1.00 0.66 C ATOM 0 H MET A 162 -16.561 -3.656 1.230 1.00 0.60 H new ATOM 0 HA MET A 162 -14.828 -2.256 3.055 1.00 0.59 H new ATOM 0 HB2 MET A 162 -16.180 -4.213 3.722 1.00 0.70 H new ATOM 0 HB3 MET A 162 -15.357 -5.227 2.554 1.00 0.70 H new ATOM 0 HG2 MET A 162 -13.457 -3.818 4.332 1.00 1.58 H new ATOM 0 HG3 MET A 162 -14.575 -4.825 5.230 1.00 1.58 H new ATOM 0 HE1 MET A 162 -10.808 -5.965 3.702 1.00 0.66 H new ATOM 0 HE2 MET A 162 -11.555 -5.146 2.309 1.00 0.66 H new ATOM 0 HE3 MET A 162 -11.584 -4.377 3.914 1.00 0.66 H new ATOM 2278 N THR A 163 -13.429 -3.871 0.582 1.00 0.57 N ATOM 2279 CA THR A 163 -12.116 -4.108 -0.085 1.00 0.54 C ATOM 2280 C THR A 163 -11.273 -2.827 -0.065 1.00 0.40 C ATOM 2281 O THR A 163 -10.135 -2.831 0.358 1.00 0.40 O ATOM 2282 CB THR A 163 -12.357 -4.548 -1.528 1.00 0.62 C ATOM 2283 OG1 THR A 163 -13.349 -5.567 -1.551 1.00 0.95 O ATOM 2284 CG2 THR A 163 -11.054 -5.089 -2.117 1.00 0.74 C ATOM 0 H THR A 163 -14.246 -4.159 0.044 1.00 0.57 H new ATOM 0 HA THR A 163 -11.576 -4.889 0.451 1.00 0.54 H new ATOM 0 HB THR A 163 -12.697 -3.697 -2.119 1.00 0.62 H new ATOM 0 HG1 THR A 163 -13.643 -5.758 -0.636 1.00 0.95 H new ATOM 0 HG21 THR A 163 -11.223 -5.404 -3.147 1.00 0.74 H new ATOM 0 HG22 THR A 163 -10.294 -4.308 -2.096 1.00 0.74 H new ATOM 0 HG23 THR A 163 -10.715 -5.941 -1.528 1.00 0.74 H new ATOM 2292 N THR A 164 -11.819 -1.732 -0.518 1.00 0.32 N ATOM 2293 CA THR A 164 -11.042 -0.456 -0.526 1.00 0.21 C ATOM 2294 C THR A 164 -10.684 -0.056 0.911 1.00 0.21 C ATOM 2295 O THR A 164 -9.692 0.603 1.153 1.00 0.22 O ATOM 2296 CB THR A 164 -11.892 0.649 -1.167 1.00 0.15 C ATOM 2297 OG1 THR A 164 -12.141 0.323 -2.527 1.00 0.85 O ATOM 2298 CG2 THR A 164 -11.154 1.988 -1.091 1.00 1.20 C ATOM 0 H THR A 164 -12.769 -1.664 -0.883 1.00 0.32 H new ATOM 0 HA THR A 164 -10.125 -0.594 -1.098 1.00 0.21 H new ATOM 0 HB THR A 164 -12.837 0.731 -0.629 1.00 0.15 H new ATOM 0 HG1 THR A 164 -12.685 1.027 -2.938 1.00 0.85 H new ATOM 0 HG21 THR A 164 -11.765 2.766 -1.548 1.00 1.20 H new ATOM 0 HG22 THR A 164 -10.965 2.241 -0.048 1.00 1.20 H new ATOM 0 HG23 THR A 164 -10.206 1.911 -1.623 1.00 1.20 H new ATOM 2306 N HIS A 165 -11.490 -0.438 1.861 1.00 0.22 N ATOM 2307 CA HIS A 165 -11.209 -0.069 3.279 1.00 0.22 C ATOM 2308 C HIS A 165 -9.898 -0.716 3.749 1.00 0.25 C ATOM 2309 O HIS A 165 -8.962 -0.039 4.123 1.00 0.29 O ATOM 2310 CB HIS A 165 -12.371 -0.546 4.161 1.00 0.23 C ATOM 2311 CG HIS A 165 -12.055 -0.307 5.614 1.00 0.37 C ATOM 2312 ND1 HIS A 165 -11.939 -1.348 6.522 1.00 0.55 N ATOM 2313 CD2 HIS A 165 -11.825 0.842 6.328 1.00 0.43 C ATOM 2314 CE1 HIS A 165 -11.652 -0.810 7.720 1.00 0.68 C ATOM 2315 NE2 HIS A 165 -11.570 0.523 7.659 1.00 0.62 N ATOM 0 H HIS A 165 -12.335 -0.992 1.718 1.00 0.22 H new ATOM 0 HA HIS A 165 -11.108 1.014 3.356 1.00 0.22 H new ATOM 0 HB2 HIS A 165 -13.284 -0.017 3.889 1.00 0.23 H new ATOM 0 HB3 HIS A 165 -12.554 -1.607 3.991 1.00 0.23 H new ATOM 0 HD2 HIS A 165 -11.840 1.842 5.920 1.00 0.43 H new ATOM 0 HE1 HIS A 165 -11.505 -1.385 8.622 1.00 0.68 H new ATOM 0 HE2 HIS A 165 -11.365 1.167 8.423 1.00 0.62 H new ATOM 2323 N LEU A 166 -9.834 -2.019 3.759 1.00 0.24 N ATOM 2324 CA LEU A 166 -8.595 -2.703 4.236 1.00 0.27 C ATOM 2325 C LEU A 166 -7.382 -2.230 3.441 1.00 0.28 C ATOM 2326 O LEU A 166 -6.306 -2.079 3.986 1.00 0.28 O ATOM 2327 CB LEU A 166 -8.736 -4.215 4.061 1.00 0.29 C ATOM 2328 CG LEU A 166 -9.153 -4.870 5.385 1.00 1.39 C ATOM 2329 CD1 LEU A 166 -8.012 -4.749 6.395 1.00 1.31 C ATOM 2330 CD2 LEU A 166 -10.402 -4.185 5.951 1.00 2.46 C ATOM 0 H LEU A 166 -10.585 -2.641 3.458 1.00 0.24 H new ATOM 0 HA LEU A 166 -8.455 -2.459 5.289 1.00 0.27 H new ATOM 0 HB2 LEU A 166 -9.477 -4.431 3.292 1.00 0.29 H new ATOM 0 HB3 LEU A 166 -7.791 -4.638 3.720 1.00 0.29 H new ATOM 0 HG LEU A 166 -9.377 -5.921 5.200 1.00 1.39 H new ATOM 0 HD11 LEU A 166 -8.308 -5.214 7.335 1.00 1.31 H new ATOM 0 HD12 LEU A 166 -7.126 -5.250 6.005 1.00 1.31 H new ATOM 0 HD13 LEU A 166 -7.787 -3.696 6.566 1.00 1.31 H new ATOM 0 HD21 LEU A 166 -10.684 -4.661 6.890 1.00 2.46 H new ATOM 0 HD22 LEU A 166 -10.190 -3.131 6.129 1.00 2.46 H new ATOM 0 HD23 LEU A 166 -11.221 -4.275 5.238 1.00 2.46 H new ATOM 2342 N ILE A 167 -7.523 -2.009 2.159 1.00 0.28 N ATOM 2343 CA ILE A 167 -6.342 -1.565 1.375 1.00 0.29 C ATOM 2344 C ILE A 167 -5.801 -0.273 1.980 1.00 0.28 C ATOM 2345 O ILE A 167 -4.643 -0.173 2.326 1.00 0.35 O ATOM 2346 CB ILE A 167 -6.725 -1.319 -0.082 1.00 0.29 C ATOM 2347 CG1 ILE A 167 -7.285 -2.612 -0.682 1.00 0.39 C ATOM 2348 CG2 ILE A 167 -5.474 -0.880 -0.855 1.00 0.38 C ATOM 2349 CD1 ILE A 167 -7.985 -2.302 -2.008 1.00 0.46 C ATOM 0 H ILE A 167 -8.390 -2.115 1.633 1.00 0.28 H new ATOM 0 HA ILE A 167 -5.581 -2.345 1.408 1.00 0.29 H new ATOM 0 HB ILE A 167 -7.484 -0.539 -0.146 1.00 0.29 H new ATOM 0 HG12 ILE A 167 -6.480 -3.329 -0.843 1.00 0.39 H new ATOM 0 HG13 ILE A 167 -7.987 -3.073 0.013 1.00 0.39 H new ATOM 0 HG21 ILE A 167 -5.735 -0.701 -1.898 1.00 0.38 H new ATOM 0 HG22 ILE A 167 -5.079 0.037 -0.417 1.00 0.38 H new ATOM 0 HG23 ILE A 167 -4.718 -1.664 -0.799 1.00 0.38 H new ATOM 0 HD11 ILE A 167 -8.383 -3.223 -2.433 1.00 0.46 H new ATOM 0 HD12 ILE A 167 -8.801 -1.601 -1.833 1.00 0.46 H new ATOM 0 HD13 ILE A 167 -7.270 -1.861 -2.702 1.00 0.46 H new ATOM 2361 N LEU A 168 -6.639 0.714 2.117 1.00 0.19 N ATOM 2362 CA LEU A 168 -6.180 1.998 2.711 1.00 0.18 C ATOM 2363 C LEU A 168 -5.749 1.756 4.164 1.00 0.20 C ATOM 2364 O LEU A 168 -5.036 2.547 4.749 1.00 0.21 O ATOM 2365 CB LEU A 168 -7.322 3.017 2.678 1.00 0.13 C ATOM 2366 CG LEU A 168 -7.861 3.147 1.250 1.00 0.18 C ATOM 2367 CD1 LEU A 168 -9.176 3.925 1.273 1.00 0.45 C ATOM 2368 CD2 LEU A 168 -6.846 3.896 0.384 1.00 0.80 C ATOM 0 H LEU A 168 -7.621 0.687 1.844 1.00 0.19 H new ATOM 0 HA LEU A 168 -5.337 2.385 2.138 1.00 0.18 H new ATOM 0 HB2 LEU A 168 -8.120 2.704 3.351 1.00 0.13 H new ATOM 0 HB3 LEU A 168 -6.968 3.985 3.032 1.00 0.13 H new ATOM 0 HG LEU A 168 -8.029 2.153 0.835 1.00 0.18 H new ATOM 0 HD11 LEU A 168 -9.561 4.019 0.258 1.00 0.45 H new ATOM 0 HD12 LEU A 168 -9.902 3.394 1.889 1.00 0.45 H new ATOM 0 HD13 LEU A 168 -9.004 4.918 1.689 1.00 0.45 H new ATOM 0 HD21 LEU A 168 -7.231 3.987 -0.631 1.00 0.80 H new ATOM 0 HD22 LEU A 168 -6.677 4.890 0.799 1.00 0.80 H new ATOM 0 HD23 LEU A 168 -5.906 3.345 0.367 1.00 0.80 H new ATOM 2380 N ARG A 169 -6.181 0.667 4.752 1.00 0.21 N ATOM 2381 CA ARG A 169 -5.798 0.377 6.164 1.00 0.24 C ATOM 2382 C ARG A 169 -4.329 -0.047 6.226 1.00 0.25 C ATOM 2383 O ARG A 169 -3.612 0.303 7.145 1.00 0.25 O ATOM 2384 CB ARG A 169 -6.677 -0.753 6.710 1.00 0.24 C ATOM 2385 CG ARG A 169 -7.054 -0.452 8.163 1.00 0.38 C ATOM 2386 CD ARG A 169 -8.405 -1.093 8.487 1.00 1.60 C ATOM 2387 NE ARG A 169 -8.797 -0.743 9.883 1.00 2.07 N ATOM 2388 CZ ARG A 169 -8.392 -1.481 10.881 1.00 1.53 C ATOM 2389 NH1 ARG A 169 -8.980 -2.620 11.131 1.00 2.25 N ATOM 2390 NH2 ARG A 169 -7.401 -1.081 11.629 1.00 0.71 N ATOM 0 H ARG A 169 -6.782 -0.031 4.314 1.00 0.21 H new ATOM 0 HA ARG A 169 -5.940 1.275 6.766 1.00 0.24 H new ATOM 0 HB2 ARG A 169 -7.577 -0.853 6.103 1.00 0.24 H new ATOM 0 HB3 ARG A 169 -6.145 -1.703 6.651 1.00 0.24 H new ATOM 0 HG2 ARG A 169 -6.287 -0.837 8.835 1.00 0.38 H new ATOM 0 HG3 ARG A 169 -7.104 0.625 8.320 1.00 0.38 H new ATOM 0 HD2 ARG A 169 -9.163 -0.744 7.786 1.00 1.60 H new ATOM 0 HD3 ARG A 169 -8.343 -2.175 8.376 1.00 1.60 H new ATOM 0 HE ARG A 169 -9.382 0.074 10.058 1.00 2.07 H new ATOM 0 HH11 ARG A 169 -9.755 -2.933 10.547 1.00 2.25 H new ATOM 0 HH12 ARG A 169 -8.664 -3.197 11.911 1.00 2.25 H new ATOM 0 HH21 ARG A 169 -6.942 -0.191 11.434 1.00 0.71 H new ATOM 0 HH22 ARG A 169 -7.085 -1.658 12.409 1.00 0.71 H new ATOM 2404 N SER A 170 -3.863 -0.783 5.251 1.00 0.28 N ATOM 2405 CA SER A 170 -2.443 -1.201 5.263 1.00 0.31 C ATOM 2406 C SER A 170 -1.607 -0.005 4.844 1.00 0.30 C ATOM 2407 O SER A 170 -0.580 0.279 5.404 1.00 0.25 O ATOM 2408 CB SER A 170 -2.238 -2.352 4.278 1.00 0.36 C ATOM 2409 OG SER A 170 -1.973 -3.547 5.000 1.00 0.72 O ATOM 0 H SER A 170 -4.408 -1.108 4.452 1.00 0.28 H new ATOM 0 HA SER A 170 -2.149 -1.540 6.256 1.00 0.31 H new ATOM 0 HB2 SER A 170 -3.126 -2.478 3.658 1.00 0.36 H new ATOM 0 HB3 SER A 170 -1.409 -2.128 3.607 1.00 0.36 H new ATOM 0 HG SER A 170 -1.843 -4.287 4.371 1.00 0.72 H new ATOM 2415 N PHE A 171 -2.054 0.720 3.867 1.00 0.35 N ATOM 2416 CA PHE A 171 -1.286 1.908 3.427 1.00 0.34 C ATOM 2417 C PHE A 171 -0.993 2.804 4.631 1.00 0.32 C ATOM 2418 O PHE A 171 0.143 3.083 4.938 1.00 0.44 O ATOM 2419 CB PHE A 171 -2.097 2.664 2.383 1.00 0.42 C ATOM 2420 CG PHE A 171 -1.709 2.142 1.031 1.00 0.36 C ATOM 2421 CD1 PHE A 171 -1.940 0.801 0.713 1.00 0.54 C ATOM 2422 CD2 PHE A 171 -1.098 2.990 0.106 1.00 0.48 C ATOM 2423 CE1 PHE A 171 -1.564 0.305 -0.537 1.00 0.45 C ATOM 2424 CE2 PHE A 171 -0.716 2.497 -1.144 1.00 0.55 C ATOM 2425 CZ PHE A 171 -0.949 1.155 -1.468 1.00 0.34 C ATOM 0 H PHE A 171 -2.917 0.542 3.354 1.00 0.35 H new ATOM 0 HA PHE A 171 -0.338 1.599 2.987 1.00 0.34 H new ATOM 0 HB2 PHE A 171 -3.164 2.524 2.554 1.00 0.42 H new ATOM 0 HB3 PHE A 171 -1.901 3.734 2.449 1.00 0.42 H new ATOM 0 HD1 PHE A 171 -2.409 0.148 1.434 1.00 0.54 H new ATOM 0 HD2 PHE A 171 -0.921 4.026 0.356 1.00 0.48 H new ATOM 0 HE1 PHE A 171 -1.746 -0.730 -0.786 1.00 0.45 H new ATOM 0 HE2 PHE A 171 -0.241 3.151 -1.860 1.00 0.55 H new ATOM 0 HZ PHE A 171 -0.655 0.774 -2.435 1.00 0.34 H new ATOM 2435 N LYS A 172 -2.000 3.238 5.331 1.00 0.25 N ATOM 2436 CA LYS A 172 -1.751 4.101 6.519 1.00 0.23 C ATOM 2437 C LYS A 172 -0.751 3.416 7.464 1.00 0.25 C ATOM 2438 O LYS A 172 0.324 3.927 7.723 1.00 0.30 O ATOM 2439 CB LYS A 172 -3.068 4.344 7.260 1.00 0.30 C ATOM 2440 CG LYS A 172 -3.077 5.762 7.835 1.00 0.88 C ATOM 2441 CD LYS A 172 -3.372 6.765 6.718 1.00 0.59 C ATOM 2442 CE LYS A 172 -4.037 8.007 7.312 1.00 0.74 C ATOM 2443 NZ LYS A 172 -3.277 9.222 6.900 1.00 1.67 N ATOM 0 H LYS A 172 -2.980 3.035 5.135 1.00 0.25 H new ATOM 0 HA LYS A 172 -1.337 5.053 6.188 1.00 0.23 H new ATOM 0 HB2 LYS A 172 -3.910 4.211 6.580 1.00 0.30 H new ATOM 0 HB3 LYS A 172 -3.187 3.615 8.061 1.00 0.30 H new ATOM 0 HG2 LYS A 172 -3.830 5.843 8.619 1.00 0.88 H new ATOM 0 HG3 LYS A 172 -2.114 5.986 8.294 1.00 0.88 H new ATOM 0 HD2 LYS A 172 -2.448 7.042 6.210 1.00 0.59 H new ATOM 0 HD3 LYS A 172 -4.024 6.312 5.971 1.00 0.59 H new ATOM 0 HE2 LYS A 172 -5.070 8.078 6.971 1.00 0.74 H new ATOM 0 HE3 LYS A 172 -4.065 7.933 8.399 1.00 0.74 H new ATOM 0 HZ1 LYS A 172 -3.729 10.067 7.304 1.00 1.67 H new ATOM 0 HZ2 LYS A 172 -2.299 9.153 7.246 1.00 1.67 H new ATOM 0 HZ3 LYS A 172 -3.273 9.294 5.862 1.00 1.67 H new ATOM 2457 N GLU A 173 -1.097 2.269 7.986 1.00 0.26 N ATOM 2458 CA GLU A 173 -0.171 1.566 8.926 1.00 0.33 C ATOM 2459 C GLU A 173 1.058 1.033 8.181 1.00 0.36 C ATOM 2460 O GLU A 173 2.147 1.542 8.335 1.00 0.37 O ATOM 2461 CB GLU A 173 -0.907 0.401 9.589 1.00 0.36 C ATOM 2462 CG GLU A 173 -1.436 0.846 10.955 1.00 0.88 C ATOM 2463 CD GLU A 173 -1.427 -0.340 11.920 1.00 0.89 C ATOM 2464 OE1 GLU A 173 -1.458 -1.464 11.448 1.00 1.32 O ATOM 2465 OE2 GLU A 173 -1.391 -0.103 13.116 1.00 1.05 O ATOM 0 H GLU A 173 -1.978 1.788 7.804 1.00 0.26 H new ATOM 0 HA GLU A 173 0.161 2.276 9.683 1.00 0.33 H new ATOM 0 HB2 GLU A 173 -1.732 0.071 8.957 1.00 0.36 H new ATOM 0 HB3 GLU A 173 -0.235 -0.449 9.706 1.00 0.36 H new ATOM 0 HG2 GLU A 173 -0.819 1.653 11.350 1.00 0.88 H new ATOM 0 HG3 GLU A 173 -2.448 1.238 10.854 1.00 0.88 H new ATOM 2472 N PHE A 174 0.882 -0.003 7.396 1.00 0.38 N ATOM 2473 CA PHE A 174 2.020 -0.627 6.631 1.00 0.44 C ATOM 2474 C PHE A 174 3.043 0.422 6.161 1.00 0.44 C ATOM 2475 O PHE A 174 4.195 0.389 6.556 1.00 0.49 O ATOM 2476 CB PHE A 174 1.454 -1.359 5.411 1.00 0.46 C ATOM 2477 CG PHE A 174 2.461 -2.353 4.899 1.00 0.40 C ATOM 2478 CD1 PHE A 174 3.508 -1.921 4.082 1.00 0.56 C ATOM 2479 CD2 PHE A 174 2.344 -3.704 5.239 1.00 1.14 C ATOM 2480 CE1 PHE A 174 4.448 -2.841 3.603 1.00 0.67 C ATOM 2481 CE2 PHE A 174 3.283 -4.627 4.762 1.00 1.08 C ATOM 2482 CZ PHE A 174 4.336 -4.194 3.943 1.00 0.40 C ATOM 0 H PHE A 174 -0.020 -0.455 7.247 1.00 0.38 H new ATOM 0 HA PHE A 174 2.536 -1.319 7.297 1.00 0.44 H new ATOM 0 HB2 PHE A 174 0.529 -1.870 5.679 1.00 0.46 H new ATOM 0 HB3 PHE A 174 1.207 -0.642 4.628 1.00 0.46 H new ATOM 0 HD1 PHE A 174 3.592 -0.877 3.820 1.00 0.56 H new ATOM 0 HD2 PHE A 174 1.531 -4.035 5.868 1.00 1.14 H new ATOM 0 HE1 PHE A 174 5.258 -2.507 2.972 1.00 0.67 H new ATOM 0 HE2 PHE A 174 3.196 -5.671 5.024 1.00 1.08 H new ATOM 0 HZ PHE A 174 5.061 -4.905 3.575 1.00 0.40 H new ATOM 2492 N LEU A 175 2.654 1.342 5.317 1.00 0.38 N ATOM 2493 CA LEU A 175 3.640 2.358 4.842 1.00 0.38 C ATOM 2494 C LEU A 175 4.238 3.094 6.045 1.00 0.35 C ATOM 2495 O LEU A 175 5.424 3.350 6.094 1.00 0.40 O ATOM 2496 CB LEU A 175 2.963 3.379 3.921 1.00 0.35 C ATOM 2497 CG LEU A 175 2.696 2.760 2.542 1.00 0.35 C ATOM 2498 CD1 LEU A 175 1.427 3.363 1.952 1.00 0.50 C ATOM 2499 CD2 LEU A 175 3.856 3.067 1.595 1.00 0.24 C ATOM 0 H LEU A 175 1.711 1.434 4.941 1.00 0.38 H new ATOM 0 HA LEU A 175 4.425 1.844 4.288 1.00 0.38 H new ATOM 0 HB2 LEU A 175 2.025 3.713 4.365 1.00 0.35 H new ATOM 0 HB3 LEU A 175 3.597 4.259 3.815 1.00 0.35 H new ATOM 0 HG LEU A 175 2.588 1.682 2.659 1.00 0.35 H new ATOM 0 HD11 LEU A 175 1.237 2.924 0.973 1.00 0.50 H new ATOM 0 HD12 LEU A 175 0.585 3.156 2.612 1.00 0.50 H new ATOM 0 HD13 LEU A 175 1.550 4.441 1.848 1.00 0.50 H new ATOM 0 HD21 LEU A 175 3.657 2.623 0.620 1.00 0.24 H new ATOM 0 HD22 LEU A 175 3.962 4.146 1.488 1.00 0.24 H new ATOM 0 HD23 LEU A 175 4.778 2.650 2.001 1.00 0.24 H new ATOM 2511 N GLN A 176 3.432 3.446 7.014 1.00 0.29 N ATOM 2512 CA GLN A 176 3.974 4.171 8.201 1.00 0.25 C ATOM 2513 C GLN A 176 5.141 3.384 8.807 1.00 0.37 C ATOM 2514 O GLN A 176 6.109 3.954 9.274 1.00 0.51 O ATOM 2515 CB GLN A 176 2.871 4.341 9.247 1.00 0.21 C ATOM 2516 CG GLN A 176 2.233 5.722 9.090 1.00 0.26 C ATOM 2517 CD GLN A 176 0.861 5.732 9.766 1.00 1.48 C ATOM 2518 OE1 GLN A 176 -0.101 6.217 9.204 1.00 2.68 O ATOM 2519 NE2 GLN A 176 0.728 5.214 10.956 1.00 1.61 N ATOM 0 H GLN A 176 2.429 3.264 7.035 1.00 0.29 H new ATOM 0 HA GLN A 176 4.330 5.152 7.887 1.00 0.25 H new ATOM 0 HB2 GLN A 176 2.117 3.564 9.126 1.00 0.21 H new ATOM 0 HB3 GLN A 176 3.285 4.231 10.249 1.00 0.21 H new ATOM 0 HG2 GLN A 176 2.874 6.483 9.535 1.00 0.26 H new ATOM 0 HG3 GLN A 176 2.131 5.969 8.033 1.00 0.26 H new ATOM 0 HE21 GLN A 176 1.535 4.807 11.428 1.00 1.61 H new ATOM 0 HE22 GLN A 176 -0.183 5.216 11.414 1.00 1.61 H new ATOM 2528 N SER A 177 5.063 2.080 8.805 1.00 0.32 N ATOM 2529 CA SER A 177 6.171 1.267 9.380 1.00 0.42 C ATOM 2530 C SER A 177 7.390 1.362 8.467 1.00 0.47 C ATOM 2531 O SER A 177 8.516 1.351 8.919 1.00 0.55 O ATOM 2532 CB SER A 177 5.733 -0.192 9.497 1.00 0.45 C ATOM 2533 OG SER A 177 5.249 -0.431 10.813 1.00 0.81 O ATOM 0 H SER A 177 4.280 1.544 8.430 1.00 0.32 H new ATOM 0 HA SER A 177 6.424 1.646 10.370 1.00 0.42 H new ATOM 0 HB2 SER A 177 4.955 -0.410 8.765 1.00 0.45 H new ATOM 0 HB3 SER A 177 6.571 -0.854 9.279 1.00 0.45 H new ATOM 0 HG SER A 177 4.965 -1.366 10.892 1.00 0.81 H new ATOM 2539 N SER A 178 7.177 1.456 7.183 1.00 0.44 N ATOM 2540 CA SER A 178 8.332 1.558 6.247 1.00 0.53 C ATOM 2541 C SER A 178 9.036 2.901 6.461 1.00 0.47 C ATOM 2542 O SER A 178 10.207 3.052 6.179 1.00 0.34 O ATOM 2543 CB SER A 178 7.832 1.463 4.805 1.00 0.61 C ATOM 2544 OG SER A 178 6.660 0.658 4.766 1.00 1.95 O ATOM 0 H SER A 178 6.257 1.467 6.743 1.00 0.44 H new ATOM 0 HA SER A 178 9.032 0.745 6.438 1.00 0.53 H new ATOM 0 HB2 SER A 178 7.617 2.458 4.416 1.00 0.61 H new ATOM 0 HB3 SER A 178 8.604 1.032 4.168 1.00 0.61 H new ATOM 0 HG SER A 178 6.291 0.662 3.858 1.00 1.95 H new ATOM 2550 N LEU A 179 8.326 3.877 6.964 1.00 0.57 N ATOM 2551 CA LEU A 179 8.949 5.209 7.205 1.00 0.54 C ATOM 2552 C LEU A 179 9.796 5.149 8.480 1.00 0.54 C ATOM 2553 O LEU A 179 10.883 5.688 8.541 1.00 0.56 O ATOM 2554 CB LEU A 179 7.850 6.257 7.384 1.00 0.55 C ATOM 2555 CG LEU A 179 7.658 7.027 6.079 1.00 0.19 C ATOM 2556 CD1 LEU A 179 6.345 6.597 5.424 1.00 0.50 C ATOM 2557 CD2 LEU A 179 7.612 8.527 6.375 1.00 0.48 C ATOM 0 H LEU A 179 7.341 3.807 7.218 1.00 0.57 H new ATOM 0 HA LEU A 179 9.578 5.476 6.356 1.00 0.54 H new ATOM 0 HB2 LEU A 179 6.917 5.774 7.674 1.00 0.55 H new ATOM 0 HB3 LEU A 179 8.116 6.944 8.187 1.00 0.55 H new ATOM 0 HG LEU A 179 8.488 6.815 5.405 1.00 0.19 H new ATOM 0 HD11 LEU A 179 6.206 7.146 4.492 1.00 0.50 H new ATOM 0 HD12 LEU A 179 6.376 5.528 5.214 1.00 0.50 H new ATOM 0 HD13 LEU A 179 5.515 6.811 6.098 1.00 0.50 H new ATOM 0 HD21 LEU A 179 7.475 9.077 5.444 1.00 0.48 H new ATOM 0 HD22 LEU A 179 6.781 8.740 7.048 1.00 0.48 H new ATOM 0 HD23 LEU A 179 8.547 8.834 6.844 1.00 0.48 H new ATOM 2569 N ARG A 180 9.303 4.499 9.502 1.00 0.55 N ATOM 2570 CA ARG A 180 10.075 4.407 10.776 1.00 0.55 C ATOM 2571 C ARG A 180 11.222 3.406 10.617 1.00 0.60 C ATOM 2572 O ARG A 180 12.193 3.442 11.345 1.00 0.62 O ATOM 2573 CB ARG A 180 9.149 3.941 11.902 1.00 0.55 C ATOM 2574 CG ARG A 180 9.157 4.972 13.034 1.00 0.72 C ATOM 2575 CD ARG A 180 7.719 5.356 13.384 1.00 0.89 C ATOM 2576 NE ARG A 180 7.717 6.653 14.118 1.00 1.69 N ATOM 2577 CZ ARG A 180 6.587 7.198 14.478 1.00 2.40 C ATOM 2578 NH1 ARG A 180 5.988 6.795 15.564 1.00 2.28 N ATOM 2579 NH2 ARG A 180 6.057 8.144 13.752 1.00 3.62 N ATOM 0 H ARG A 180 8.398 4.028 9.509 1.00 0.55 H new ATOM 0 HA ARG A 180 10.483 5.388 11.019 1.00 0.55 H new ATOM 0 HB2 ARG A 180 8.136 3.811 11.522 1.00 0.55 H new ATOM 0 HB3 ARG A 180 9.476 2.971 12.277 1.00 0.55 H new ATOM 0 HG2 ARG A 180 9.659 4.562 13.910 1.00 0.72 H new ATOM 0 HG3 ARG A 180 9.717 5.856 12.731 1.00 0.72 H new ATOM 0 HD2 ARG A 180 7.122 5.439 12.476 1.00 0.89 H new ATOM 0 HD3 ARG A 180 7.262 4.578 13.996 1.00 0.89 H new ATOM 0 HE ARG A 180 8.599 7.115 14.339 1.00 1.69 H new ATOM 0 HH11 ARG A 180 6.403 6.055 16.131 1.00 2.28 H new ATOM 0 HH12 ARG A 180 5.105 7.220 15.847 1.00 2.28 H new ATOM 0 HH21 ARG A 180 6.526 8.458 12.902 1.00 3.62 H new ATOM 0 HH22 ARG A 180 5.174 8.569 14.034 1.00 3.62 H new ATOM 2593 N ALA A 181 11.124 2.518 9.668 1.00 0.61 N ATOM 2594 CA ALA A 181 12.213 1.527 9.466 1.00 0.65 C ATOM 2595 C ALA A 181 13.308 2.176 8.626 1.00 0.64 C ATOM 2596 O ALA A 181 14.484 1.964 8.845 1.00 0.66 O ATOM 2597 CB ALA A 181 11.659 0.300 8.738 1.00 0.70 C ATOM 0 H ALA A 181 10.337 2.437 9.025 1.00 0.61 H new ATOM 0 HA ALA A 181 12.620 1.213 10.427 1.00 0.65 H new ATOM 0 HB1 ALA A 181 12.458 -0.427 8.590 1.00 0.70 H new ATOM 0 HB2 ALA A 181 10.865 -0.150 9.335 1.00 0.70 H new ATOM 0 HB3 ALA A 181 11.259 0.601 7.770 1.00 0.70 H new ATOM 2603 N LEU A 182 12.927 2.979 7.672 1.00 0.62 N ATOM 2604 CA LEU A 182 13.945 3.655 6.827 1.00 0.61 C ATOM 2605 C LEU A 182 14.656 4.710 7.670 1.00 0.57 C ATOM 2606 O LEU A 182 15.840 4.944 7.528 1.00 0.62 O ATOM 2607 CB LEU A 182 13.262 4.321 5.631 1.00 0.61 C ATOM 2608 CG LEU A 182 13.865 3.781 4.334 1.00 0.54 C ATOM 2609 CD1 LEU A 182 13.585 2.281 4.228 1.00 1.50 C ATOM 2610 CD2 LEU A 182 13.235 4.502 3.142 1.00 0.43 C ATOM 0 H LEU A 182 11.957 3.195 7.443 1.00 0.62 H new ATOM 0 HA LEU A 182 14.667 2.926 6.459 1.00 0.61 H new ATOM 0 HB2 LEU A 182 12.190 4.125 5.655 1.00 0.61 H new ATOM 0 HB3 LEU A 182 13.390 5.402 5.681 1.00 0.61 H new ATOM 0 HG LEU A 182 14.942 3.951 4.335 1.00 0.54 H new ATOM 0 HD11 LEU A 182 14.015 1.895 3.304 1.00 1.50 H new ATOM 0 HD12 LEU A 182 14.032 1.766 5.078 1.00 1.50 H new ATOM 0 HD13 LEU A 182 12.508 2.111 4.226 1.00 1.50 H new ATOM 0 HD21 LEU A 182 13.664 4.118 2.216 1.00 0.43 H new ATOM 0 HD22 LEU A 182 12.158 4.331 3.141 1.00 0.43 H new ATOM 0 HD23 LEU A 182 13.433 5.571 3.217 1.00 0.43 H new ATOM 2622 N ARG A 183 13.940 5.341 8.560 1.00 0.52 N ATOM 2623 CA ARG A 183 14.565 6.371 9.431 1.00 0.52 C ATOM 2624 C ARG A 183 15.320 5.672 10.564 1.00 0.61 C ATOM 2625 O ARG A 183 16.233 6.221 11.147 1.00 0.74 O ATOM 2626 CB ARG A 183 13.477 7.272 10.020 1.00 0.48 C ATOM 2627 CG ARG A 183 13.108 8.356 9.008 1.00 1.37 C ATOM 2628 CD ARG A 183 12.102 9.321 9.639 1.00 1.77 C ATOM 2629 NE ARG A 183 12.742 10.655 9.822 1.00 1.14 N ATOM 2630 CZ ARG A 183 12.010 11.695 10.112 1.00 1.92 C ATOM 2631 NH1 ARG A 183 11.592 11.879 11.334 1.00 2.09 N ATOM 2632 NH2 ARG A 183 11.696 12.551 9.179 1.00 2.95 N ATOM 0 H ARG A 183 12.945 5.185 8.720 1.00 0.52 H new ATOM 0 HA ARG A 183 15.256 6.979 8.847 1.00 0.52 H new ATOM 0 HB2 ARG A 183 12.597 6.680 10.272 1.00 0.48 H new ATOM 0 HB3 ARG A 183 13.829 7.728 10.945 1.00 0.48 H new ATOM 0 HG2 ARG A 183 14.001 8.897 8.697 1.00 1.37 H new ATOM 0 HG3 ARG A 183 12.682 7.903 8.113 1.00 1.37 H new ATOM 0 HD2 ARG A 183 11.221 9.412 9.003 1.00 1.77 H new ATOM 0 HD3 ARG A 183 11.763 8.933 10.600 1.00 1.77 H new ATOM 0 HE ARG A 183 13.752 10.754 9.720 1.00 1.14 H new ATOM 0 HH11 ARG A 183 11.838 11.209 12.063 1.00 2.09 H new ATOM 0 HH12 ARG A 183 11.020 12.692 11.560 1.00 2.09 H new ATOM 0 HH21 ARG A 183 12.023 12.407 8.224 1.00 2.95 H new ATOM 0 HH22 ARG A 183 11.124 13.364 9.405 1.00 2.95 H new ATOM 2646 N GLN A 184 14.948 4.457 10.872 1.00 0.57 N ATOM 2647 CA GLN A 184 15.641 3.712 11.952 1.00 0.65 C ATOM 2648 C GLN A 184 16.985 3.215 11.422 1.00 0.67 C ATOM 2649 O GLN A 184 17.924 3.011 12.166 1.00 0.80 O ATOM 2650 CB GLN A 184 14.769 2.521 12.361 1.00 0.56 C ATOM 2651 CG GLN A 184 15.482 1.688 13.424 1.00 1.61 C ATOM 2652 CD GLN A 184 15.183 2.266 14.808 1.00 1.12 C ATOM 2653 OE1 GLN A 184 15.851 3.175 15.256 1.00 1.05 O ATOM 2654 NE2 GLN A 184 14.201 1.769 15.511 1.00 1.74 N ATOM 0 H GLN A 184 14.189 3.950 10.416 1.00 0.57 H new ATOM 0 HA GLN A 184 15.809 4.355 12.816 1.00 0.65 H new ATOM 0 HB2 GLN A 184 13.813 2.876 12.747 1.00 0.56 H new ATOM 0 HB3 GLN A 184 14.552 1.903 11.490 1.00 0.56 H new ATOM 0 HG2 GLN A 184 15.151 0.651 13.372 1.00 1.61 H new ATOM 0 HG3 GLN A 184 16.557 1.689 13.242 1.00 1.61 H new ATOM 0 HE21 GLN A 184 13.640 1.005 15.134 1.00 1.74 H new ATOM 0 HE22 GLN A 184 13.995 2.145 16.437 1.00 1.74 H new ATOM 2663 N MET A 185 17.083 3.021 10.137 1.00 0.61 N ATOM 2664 CA MET A 185 18.360 2.538 9.551 1.00 0.74 C ATOM 2665 C MET A 185 19.460 3.576 9.785 1.00 1.20 C ATOM 2666 O MET A 185 20.620 3.220 9.664 1.00 1.51 O ATOM 2667 CB MET A 185 18.174 2.316 8.051 1.00 0.64 C ATOM 2668 CG MET A 185 17.418 1.007 7.824 1.00 0.64 C ATOM 2669 SD MET A 185 16.945 0.875 6.081 1.00 0.66 S ATOM 2670 CE MET A 185 15.291 0.191 6.348 1.00 0.58 C ATOM 2671 OXT MET A 185 19.122 4.710 10.082 1.00 2.17 O ATOM 0 H MET A 185 16.330 3.177 9.467 1.00 0.61 H new ATOM 0 HA MET A 185 18.647 1.600 10.026 1.00 0.74 H new ATOM 0 HB2 MET A 185 17.622 3.148 7.614 1.00 0.64 H new ATOM 0 HB3 MET A 185 19.143 2.280 7.554 1.00 0.64 H new ATOM 0 HG2 MET A 185 18.043 0.160 8.107 1.00 0.64 H new ATOM 0 HG3 MET A 185 16.531 0.973 8.456 1.00 0.64 H new ATOM 0 HE1 MET A 185 14.882 -0.154 5.398 1.00 0.58 H new ATOM 0 HE2 MET A 185 15.351 -0.646 7.043 1.00 0.58 H new ATOM 0 HE3 MET A 185 14.641 0.961 6.764 1.00 0.58 H new TER 2681 MET A 185