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 109 SER OG : rot 132:sc= -3.12! USER MOD Set 1.2: A 112 GLN : amide:sc= -6! C(o=-9.1!,f=-6.9!) USER MOD Set 2.1: A 103 GLN : amide:sc= -0.415 K(o=-1,f=-2.3) USER MOD Set 2.2: A 117 GLN : amide:sc= -0.581 K(o=-1,f=-3.3!) USER MOD Set 3.1: A 49 ASN : amide:sc= -3.05! K(o=-6!,f=-2) USER MOD Set 3.2: A 53 SER OG : rot -140:sc= -2.9! USER MOD Set 4.1: A 21 THR OG1 : rot 180:sc= -0.459 USER MOD Set 4.2: A 23 SER OG : rot 180:sc= -1.18 USER MOD Single : A 22 SER OG : rot 100:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= -2.12! C(o=-2.1!,f=-6.1!) 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 44 THR OG1 : rot -54:sc= 0.29 USER MOD Single : A 46 ASN : amide:sc= -0.643 K(o=-0.64,f=-2.7!) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot 30:sc= 0.2 USER MOD Single : A 50 MET CE :methyl 157:sc= -2.52! (180deg=-4.24!) USER MOD Single : A 54 SER OG : rot 180:sc= -0.928 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= -0.0706 X(o=-0.071,f=0) USER MOD Single : A 62 ASN : amide:sc= -1.47 X(o=-1.5,f=-1.9) USER MOD Single : A 64 ASN : amide:sc= -0.926 X(o=-0.93,f=-1.2) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl 169:sc= -0.0897 (180deg=-0.444) USER MOD Single : A 71 LYS NZ :NH3+ -157:sc= 0 (180deg=-0.21) USER MOD Single : A 76 GLN : amide:sc= -0.261 X(o=-0.26,f=-0.073) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -7.49! C(o=-7.5!,f=-15!) 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 75:sc= -0.365 USER MOD Single : A 98 TYR OH : rot -148:sc= -0.421 USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -1.48 K(o=-1.5,f=-11!) USER MOD Single : A 108 SER OG : rot 180:sc= -0.426 USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 119 SER OG : rot -145:sc= 0.0417 USER MOD Single : A 120 THR OG1 : rot -11:sc= -1.65! USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 GLN : amide:sc= -0.499 K(o=-0.5,f=-1.1) USER MOD Single : A 129 LYS NZ :NH3+ 152:sc= -0.867 (180deg=-3!) USER MOD Single : A 130 LYS NZ :NH3+ 142:sc= -0.312 (180deg=-1.41) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 ASN : amide:sc= -0.393 K(o=-0.39,f=-1.6!) USER MOD Single : A 138 THR OG1 : rot 180:sc= -0.145 USER MOD Single : A 139 THR OG1 : rot -90:sc= -1.84! USER MOD Single : A 143 THR OG1 : rot 180:sc= 0.0123 USER MOD Single : A 144 THR OG1 : rot 109:sc= 0.994 USER MOD Single : A 145 ASN : amide:sc= -13.6! C(o=-14!,f=-7.2!) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 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=-0.11) USER MOD Single : A 155 GLN : amide:sc= -3.13 K(o=-3.1,f=-11!) USER MOD Single : A 156 ASN : amide:sc= -0.32 K(o=-0.32,f=-2.3!) USER MOD Single : A 157 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 160 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 162 MET CE :methyl -121:sc= -8.59! (180deg=-16.3!) USER MOD Single : A 163 THR OG1 : rot 70:sc= 0.393 USER MOD Single : A 164 THR OG1 : rot 180:sc= -0.526 USER MOD Single : A 165 HIS : no HD1:sc= -1.62 X(o=-1.6,f=-1.8) 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= -0.382 X(o=-0.38,f=-0.0088) USER MOD Single : A 177 SER OG : rot 180:sc= 0 USER MOD Single : A 178 SER OG : rot -77:sc= 0.767 USER MOD Single : A 184 GLN : amide:sc= -0.354 K(o=-0.35,f=-1.4) USER MOD Single : A 185 MET CE :methyl -153:sc= -0.84 (180deg=-1.65) USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 20 22.253 13.170 3.211 1.00 1.58 N ATOM 2 CA LEU A 20 21.052 12.987 2.349 1.00 1.29 C ATOM 3 C LEU A 20 21.308 11.859 1.349 1.00 1.24 C ATOM 4 O LEU A 20 22.436 11.484 1.093 1.00 2.06 O ATOM 5 CB LEU A 20 20.767 14.285 1.591 1.00 1.57 C ATOM 6 CG LEU A 20 19.256 14.457 1.419 1.00 1.35 C ATOM 7 CD1 LEU A 20 18.630 14.834 2.763 1.00 1.64 C ATOM 8 CD2 LEU A 20 18.984 15.564 0.399 1.00 1.72 C ATOM 0 HA LEU A 20 20.194 12.732 2.971 1.00 1.29 H new ATOM 0 HB2 LEU A 20 21.180 15.134 2.135 1.00 1.57 H new ATOM 0 HB3 LEU A 20 21.254 14.263 0.616 1.00 1.57 H new ATOM 0 HG LEU A 20 18.820 13.523 1.066 1.00 1.35 H new ATOM 0 HD11 LEU A 20 17.554 14.957 2.641 1.00 1.64 H new ATOM 0 HD12 LEU A 20 18.826 14.045 3.489 1.00 1.64 H new ATOM 0 HD13 LEU A 20 19.064 15.769 3.117 1.00 1.64 H new ATOM 0 HD21 LEU A 20 17.908 15.688 0.275 1.00 1.72 H new ATOM 0 HD22 LEU A 20 19.419 16.499 0.752 1.00 1.72 H new ATOM 0 HD23 LEU A 20 19.431 15.295 -0.558 1.00 1.72 H new ATOM 20 N THR A 21 20.269 11.313 0.780 1.00 0.49 N ATOM 21 CA THR A 21 20.449 10.211 -0.204 1.00 0.50 C ATOM 22 C THR A 21 19.089 9.837 -0.797 1.00 0.32 C ATOM 23 O THR A 21 18.060 10.311 -0.360 1.00 0.18 O ATOM 24 CB THR A 21 21.056 8.993 0.497 1.00 0.58 C ATOM 25 OG1 THR A 21 21.033 7.881 -0.387 1.00 0.82 O ATOM 26 CG2 THR A 21 20.247 8.667 1.753 1.00 0.56 C ATOM 0 H THR A 21 19.301 11.584 0.955 1.00 0.49 H new ATOM 0 HA THR A 21 21.117 10.537 -1.001 1.00 0.50 H new ATOM 0 HB THR A 21 22.086 9.212 0.780 1.00 0.58 H new ATOM 0 HG1 THR A 21 21.423 7.100 0.059 1.00 0.82 H new ATOM 0 HG21 THR A 21 20.681 7.800 2.250 1.00 0.56 H new ATOM 0 HG22 THR A 21 20.266 9.521 2.430 1.00 0.56 H new ATOM 0 HG23 THR A 21 19.216 8.448 1.475 1.00 0.56 H new ATOM 34 N SER A 22 19.076 8.993 -1.792 1.00 0.39 N ATOM 35 CA SER A 22 17.780 8.594 -2.412 1.00 0.37 C ATOM 36 C SER A 22 16.896 7.898 -1.371 1.00 0.32 C ATOM 37 O SER A 22 15.702 7.761 -1.553 1.00 0.52 O ATOM 38 CB SER A 22 18.045 7.637 -3.575 1.00 0.60 C ATOM 39 OG SER A 22 16.812 7.316 -4.208 1.00 2.11 O ATOM 0 H SER A 22 19.905 8.563 -2.202 1.00 0.39 H new ATOM 0 HA SER A 22 17.269 9.484 -2.779 1.00 0.37 H new ATOM 0 HB2 SER A 22 18.726 8.096 -4.291 1.00 0.60 H new ATOM 0 HB3 SER A 22 18.528 6.730 -3.212 1.00 0.60 H new ATOM 0 HG SER A 22 16.709 7.859 -5.017 1.00 2.11 H new ATOM 45 N SER A 23 17.467 7.454 -0.283 1.00 0.18 N ATOM 46 CA SER A 23 16.648 6.767 0.757 1.00 0.14 C ATOM 47 C SER A 23 15.988 7.808 1.663 1.00 0.29 C ATOM 48 O SER A 23 14.796 7.777 1.887 1.00 0.27 O ATOM 49 CB SER A 23 17.544 5.856 1.594 1.00 0.18 C ATOM 50 OG SER A 23 18.538 5.277 0.757 1.00 1.78 O ATOM 0 H SER A 23 18.461 7.537 -0.070 1.00 0.18 H new ATOM 0 HA SER A 23 15.876 6.170 0.272 1.00 0.14 H new ATOM 0 HB2 SER A 23 18.014 6.426 2.396 1.00 0.18 H new ATOM 0 HB3 SER A 23 16.948 5.074 2.065 1.00 0.18 H new ATOM 0 HG SER A 23 19.116 4.693 1.291 1.00 1.78 H new ATOM 56 N GLU A 24 16.749 8.729 2.189 1.00 0.51 N ATOM 57 CA GLU A 24 16.149 9.765 3.077 1.00 0.73 C ATOM 58 C GLU A 24 15.040 10.492 2.317 1.00 0.79 C ATOM 59 O GLU A 24 14.072 10.946 2.892 1.00 0.92 O ATOM 60 CB GLU A 24 17.224 10.769 3.496 1.00 0.92 C ATOM 61 CG GLU A 24 17.530 10.601 4.986 1.00 1.53 C ATOM 62 CD GLU A 24 17.392 11.952 5.690 1.00 1.19 C ATOM 63 OE1 GLU A 24 16.561 12.737 5.264 1.00 0.99 O ATOM 64 OE2 GLU A 24 18.122 12.179 6.641 1.00 1.86 O ATOM 0 H GLU A 24 17.755 8.809 2.043 1.00 0.51 H new ATOM 0 HA GLU A 24 15.736 9.290 3.967 1.00 0.73 H new ATOM 0 HB2 GLU A 24 18.129 10.614 2.909 1.00 0.92 H new ATOM 0 HB3 GLU A 24 16.884 11.785 3.296 1.00 0.92 H new ATOM 0 HG2 GLU A 24 16.847 9.876 5.429 1.00 1.53 H new ATOM 0 HG3 GLU A 24 18.539 10.211 5.119 1.00 1.53 H new ATOM 71 N ARG A 25 15.171 10.595 1.023 1.00 0.75 N ATOM 72 CA ARG A 25 14.121 11.282 0.223 1.00 0.91 C ATOM 73 C ARG A 25 12.975 10.304 -0.036 1.00 0.74 C ATOM 74 O ARG A 25 11.820 10.682 -0.059 1.00 0.91 O ATOM 75 CB ARG A 25 14.711 11.741 -1.111 1.00 1.07 C ATOM 76 CG ARG A 25 14.787 13.268 -1.139 1.00 1.45 C ATOM 77 CD ARG A 25 15.490 13.718 -2.419 1.00 1.21 C ATOM 78 NE ARG A 25 14.581 14.601 -3.201 1.00 1.70 N ATOM 79 CZ ARG A 25 14.803 15.886 -3.252 1.00 2.40 C ATOM 80 NH1 ARG A 25 15.744 16.355 -4.025 1.00 2.04 N ATOM 81 NH2 ARG A 25 14.084 16.702 -2.529 1.00 3.86 N ATOM 0 H ARG A 25 15.959 10.233 0.486 1.00 0.75 H new ATOM 0 HA ARG A 25 13.751 12.150 0.769 1.00 0.91 H new ATOM 0 HB2 ARG A 25 15.705 11.315 -1.247 1.00 1.07 H new ATOM 0 HB3 ARG A 25 14.095 11.382 -1.936 1.00 1.07 H new ATOM 0 HG2 ARG A 25 13.785 13.694 -1.093 1.00 1.45 H new ATOM 0 HG3 ARG A 25 15.329 13.632 -0.266 1.00 1.45 H new ATOM 0 HD2 ARG A 25 16.409 14.250 -2.174 1.00 1.21 H new ATOM 0 HD3 ARG A 25 15.773 12.851 -3.015 1.00 1.21 H new ATOM 0 HE ARG A 25 13.784 14.201 -3.697 1.00 1.70 H new ATOM 0 HH11 ARG A 25 16.306 15.717 -4.589 1.00 2.04 H new ATOM 0 HH12 ARG A 25 15.918 17.359 -4.065 1.00 2.04 H new ATOM 0 HH21 ARG A 25 13.349 16.335 -1.924 1.00 3.86 H new ATOM 0 HH22 ARG A 25 14.257 17.706 -2.569 1.00 3.86 H new ATOM 95 N ILE A 26 13.278 9.047 -0.224 1.00 0.44 N ATOM 96 CA ILE A 26 12.195 8.058 -0.469 1.00 0.41 C ATOM 97 C ILE A 26 11.252 8.071 0.747 1.00 0.26 C ATOM 98 O ILE A 26 10.058 7.895 0.618 1.00 0.23 O ATOM 99 CB ILE A 26 12.818 6.657 -0.734 1.00 0.43 C ATOM 100 CG1 ILE A 26 12.726 6.370 -2.244 1.00 0.82 C ATOM 101 CG2 ILE A 26 12.091 5.547 0.050 1.00 0.34 C ATOM 102 CD1 ILE A 26 13.222 4.953 -2.568 1.00 0.15 C ATOM 0 H ILE A 26 14.224 8.666 -0.218 1.00 0.44 H new ATOM 0 HA ILE A 26 11.613 8.314 -1.354 1.00 0.41 H new ATOM 0 HB ILE A 26 13.855 6.664 -0.398 1.00 0.43 H new ATOM 0 HG12 ILE A 26 11.694 6.482 -2.577 1.00 0.82 H new ATOM 0 HG13 ILE A 26 13.319 7.101 -2.793 1.00 0.82 H new ATOM 0 HG21 ILE A 26 12.558 4.585 -0.164 1.00 0.34 H new ATOM 0 HG22 ILE A 26 12.157 5.753 1.118 1.00 0.34 H new ATOM 0 HG23 ILE A 26 11.043 5.516 -0.249 1.00 0.34 H new ATOM 0 HD11 ILE A 26 13.146 4.777 -3.641 1.00 0.15 H new ATOM 0 HD12 ILE A 26 14.262 4.851 -2.257 1.00 0.15 H new ATOM 0 HD13 ILE A 26 12.611 4.223 -2.037 1.00 0.15 H new ATOM 114 N ASP A 27 11.780 8.300 1.919 1.00 0.19 N ATOM 115 CA ASP A 27 10.916 8.351 3.133 1.00 0.14 C ATOM 116 C ASP A 27 9.921 9.504 2.974 1.00 0.20 C ATOM 117 O ASP A 27 8.752 9.384 3.290 1.00 0.25 O ATOM 118 CB ASP A 27 11.797 8.589 4.369 1.00 0.18 C ATOM 119 CG ASP A 27 10.919 8.814 5.604 1.00 0.33 C ATOM 120 OD1 ASP A 27 10.588 7.839 6.257 1.00 1.66 O ATOM 121 OD2 ASP A 27 10.596 9.957 5.877 1.00 1.17 O ATOM 0 H ASP A 27 12.774 8.454 2.088 1.00 0.19 H new ATOM 0 HA ASP A 27 10.375 7.412 3.255 1.00 0.14 H new ATOM 0 HB2 ASP A 27 12.452 7.732 4.529 1.00 0.18 H new ATOM 0 HB3 ASP A 27 12.439 9.455 4.207 1.00 0.18 H new ATOM 126 N LYS A 28 10.382 10.622 2.481 1.00 0.21 N ATOM 127 CA LYS A 28 9.478 11.788 2.294 1.00 0.27 C ATOM 128 C LYS A 28 8.474 11.488 1.182 1.00 0.25 C ATOM 129 O LYS A 28 7.385 12.027 1.155 1.00 0.26 O ATOM 130 CB LYS A 28 10.307 13.018 1.904 1.00 0.35 C ATOM 131 CG LYS A 28 10.697 13.806 3.157 1.00 1.81 C ATOM 132 CD LYS A 28 9.435 14.203 3.921 1.00 2.79 C ATOM 133 CE LYS A 28 9.564 15.644 4.419 1.00 3.39 C ATOM 134 NZ LYS A 28 8.315 16.394 4.101 1.00 3.59 N ATOM 0 H LYS A 28 11.350 10.776 2.199 1.00 0.21 H new ATOM 0 HA LYS A 28 8.944 11.982 3.224 1.00 0.27 H new ATOM 0 HB2 LYS A 28 11.203 12.707 1.366 1.00 0.35 H new ATOM 0 HB3 LYS A 28 9.734 13.653 1.229 1.00 0.35 H new ATOM 0 HG2 LYS A 28 11.345 13.202 3.792 1.00 1.81 H new ATOM 0 HG3 LYS A 28 11.262 14.696 2.879 1.00 1.81 H new ATOM 0 HD2 LYS A 28 8.562 14.108 3.275 1.00 2.79 H new ATOM 0 HD3 LYS A 28 9.282 13.529 4.764 1.00 2.79 H new ATOM 0 HE2 LYS A 28 9.743 15.654 5.494 1.00 3.39 H new ATOM 0 HE3 LYS A 28 10.421 16.127 3.949 1.00 3.39 H new ATOM 0 HZ1 LYS A 28 8.403 17.373 4.439 1.00 3.59 H new ATOM 0 HZ2 LYS A 28 8.163 16.395 3.072 1.00 3.59 H new ATOM 0 HZ3 LYS A 28 7.507 15.937 4.569 1.00 3.59 H new ATOM 148 N GLN A 29 8.829 10.637 0.261 1.00 0.23 N ATOM 149 CA GLN A 29 7.888 10.316 -0.845 1.00 0.23 C ATOM 150 C GLN A 29 6.777 9.404 -0.323 1.00 0.14 C ATOM 151 O GLN A 29 5.664 9.430 -0.812 1.00 0.11 O ATOM 152 CB GLN A 29 8.647 9.628 -1.983 1.00 0.28 C ATOM 153 CG GLN A 29 9.644 10.615 -2.592 1.00 1.07 C ATOM 154 CD GLN A 29 8.886 11.689 -3.375 1.00 1.06 C ATOM 155 OE1 GLN A 29 8.594 11.516 -4.541 1.00 0.91 O ATOM 156 NE2 GLN A 29 8.554 12.801 -2.779 1.00 2.17 N ATOM 0 H GLN A 29 9.726 10.152 0.227 1.00 0.23 H new ATOM 0 HA GLN A 29 7.443 11.236 -1.224 1.00 0.23 H new ATOM 0 HB2 GLN A 29 9.171 8.749 -1.607 1.00 0.28 H new ATOM 0 HB3 GLN A 29 7.948 9.282 -2.745 1.00 0.28 H new ATOM 0 HG2 GLN A 29 10.241 11.077 -1.806 1.00 1.07 H new ATOM 0 HG3 GLN A 29 10.336 10.090 -3.251 1.00 1.07 H new ATOM 0 HE21 GLN A 29 8.799 12.947 -1.800 1.00 2.17 H new ATOM 0 HE22 GLN A 29 8.050 13.524 -3.292 1.00 2.17 H new ATOM 165 N ILE A 30 7.050 8.613 0.683 1.00 0.21 N ATOM 166 CA ILE A 30 5.977 7.735 1.229 1.00 0.15 C ATOM 167 C ILE A 30 5.010 8.615 2.010 1.00 0.12 C ATOM 168 O ILE A 30 3.809 8.443 1.950 1.00 0.06 O ATOM 169 CB ILE A 30 6.550 6.681 2.173 1.00 0.17 C ATOM 170 CG1 ILE A 30 7.784 5.999 1.533 1.00 0.51 C ATOM 171 CG2 ILE A 30 5.458 5.662 2.493 1.00 0.25 C ATOM 172 CD1 ILE A 30 7.387 4.752 0.725 1.00 0.49 C ATOM 0 H ILE A 30 7.957 8.538 1.143 1.00 0.21 H new ATOM 0 HA ILE A 30 5.481 7.222 0.405 1.00 0.15 H new ATOM 0 HB ILE A 30 6.880 7.151 3.099 1.00 0.17 H new ATOM 0 HG12 ILE A 30 8.295 6.708 0.881 1.00 0.51 H new ATOM 0 HG13 ILE A 30 8.490 5.717 2.314 1.00 0.51 H new ATOM 0 HG21 ILE A 30 5.855 4.903 3.167 1.00 0.25 H new ATOM 0 HG22 ILE A 30 4.618 6.167 2.969 1.00 0.25 H new ATOM 0 HG23 ILE A 30 5.121 5.188 1.571 1.00 0.25 H new ATOM 0 HD11 ILE A 30 8.279 4.300 0.291 1.00 0.49 H new ATOM 0 HD12 ILE A 30 6.899 4.032 1.383 1.00 0.49 H new ATOM 0 HD13 ILE A 30 6.701 5.038 -0.072 1.00 0.49 H new ATOM 184 N ARG A 31 5.530 9.575 2.733 1.00 0.24 N ATOM 185 CA ARG A 31 4.651 10.487 3.501 1.00 0.27 C ATOM 186 C ARG A 31 3.664 11.134 2.527 1.00 0.18 C ATOM 187 O ARG A 31 2.566 11.510 2.890 1.00 0.13 O ATOM 188 CB ARG A 31 5.512 11.561 4.166 1.00 0.43 C ATOM 189 CG ARG A 31 4.653 12.380 5.119 1.00 0.40 C ATOM 190 CD ARG A 31 4.670 11.740 6.508 1.00 2.20 C ATOM 191 NE ARG A 31 3.301 11.269 6.854 1.00 3.49 N ATOM 192 CZ ARG A 31 2.321 12.126 6.947 1.00 3.93 C ATOM 193 NH1 ARG A 31 2.532 13.307 7.460 1.00 3.52 N ATOM 194 NH2 ARG A 31 1.129 11.800 6.529 1.00 5.10 N ATOM 0 H ARG A 31 6.529 9.761 2.820 1.00 0.24 H new ATOM 0 HA ARG A 31 4.104 9.942 4.271 1.00 0.27 H new ATOM 0 HB2 ARG A 31 6.336 11.098 4.709 1.00 0.43 H new ATOM 0 HB3 ARG A 31 5.954 12.209 3.409 1.00 0.43 H new ATOM 0 HG2 ARG A 31 5.028 13.402 5.174 1.00 0.40 H new ATOM 0 HG3 ARG A 31 3.630 12.435 4.746 1.00 0.40 H new ATOM 0 HD2 ARG A 31 5.369 10.904 6.526 1.00 2.20 H new ATOM 0 HD3 ARG A 31 5.016 12.461 7.248 1.00 2.20 H new ATOM 0 HE ARG A 31 3.129 10.277 7.018 1.00 3.49 H new ATOM 0 HH11 ARG A 31 3.463 13.561 7.789 1.00 3.52 H new ATOM 0 HH12 ARG A 31 1.765 13.976 7.532 1.00 3.52 H new ATOM 0 HH21 ARG A 31 0.963 10.876 6.130 1.00 5.10 H new ATOM 0 HH22 ARG A 31 0.363 12.469 6.601 1.00 5.10 H new ATOM 208 N TYR A 32 4.044 11.236 1.280 1.00 0.19 N ATOM 209 CA TYR A 32 3.135 11.823 0.264 1.00 0.21 C ATOM 210 C TYR A 32 2.110 10.758 -0.111 1.00 0.16 C ATOM 211 O TYR A 32 0.945 11.038 -0.310 1.00 0.19 O ATOM 212 CB TYR A 32 3.945 12.216 -0.974 1.00 0.33 C ATOM 213 CG TYR A 32 3.202 13.271 -1.755 1.00 0.09 C ATOM 214 CD1 TYR A 32 1.952 12.981 -2.314 1.00 1.14 C ATOM 215 CD2 TYR A 32 3.764 14.542 -1.921 1.00 0.76 C ATOM 216 CE1 TYR A 32 1.265 13.959 -3.040 1.00 1.44 C ATOM 217 CE2 TYR A 32 3.078 15.522 -2.648 1.00 0.46 C ATOM 218 CZ TYR A 32 1.827 15.230 -3.207 1.00 0.65 C ATOM 219 OH TYR A 32 1.148 16.196 -3.923 1.00 0.95 O ATOM 0 H TYR A 32 4.951 10.935 0.924 1.00 0.19 H new ATOM 0 HA TYR A 32 2.638 12.710 0.656 1.00 0.21 H new ATOM 0 HB2 TYR A 32 4.923 12.593 -0.676 1.00 0.33 H new ATOM 0 HB3 TYR A 32 4.118 11.341 -1.600 1.00 0.33 H new ATOM 0 HD1 TYR A 32 1.518 12.001 -2.184 1.00 1.14 H new ATOM 0 HD2 TYR A 32 4.727 14.767 -1.488 1.00 0.76 H new ATOM 0 HE1 TYR A 32 0.301 13.734 -3.472 1.00 1.44 H new ATOM 0 HE2 TYR A 32 3.513 16.502 -2.778 1.00 0.46 H new ATOM 0 HH TYR A 32 1.677 17.021 -3.943 1.00 0.95 H new ATOM 229 N ILE A 33 2.542 9.527 -0.190 1.00 0.14 N ATOM 230 CA ILE A 33 1.604 8.425 -0.532 1.00 0.19 C ATOM 231 C ILE A 33 0.438 8.438 0.458 1.00 0.21 C ATOM 232 O ILE A 33 -0.707 8.280 0.088 1.00 0.26 O ATOM 233 CB ILE A 33 2.336 7.084 -0.444 1.00 0.18 C ATOM 234 CG1 ILE A 33 3.474 7.058 -1.465 1.00 0.18 C ATOM 235 CG2 ILE A 33 1.359 5.945 -0.745 1.00 0.23 C ATOM 236 CD1 ILE A 33 4.200 5.714 -1.391 1.00 0.14 C ATOM 0 H ILE A 33 3.508 9.239 -0.031 1.00 0.14 H new ATOM 0 HA ILE A 33 1.228 8.562 -1.546 1.00 0.19 H new ATOM 0 HB ILE A 33 2.742 6.959 0.560 1.00 0.18 H new ATOM 0 HG12 ILE A 33 3.079 7.214 -2.469 1.00 0.18 H new ATOM 0 HG13 ILE A 33 4.172 7.871 -1.267 1.00 0.18 H new ATOM 0 HG21 ILE A 33 1.882 4.991 -0.682 1.00 0.23 H new ATOM 0 HG22 ILE A 33 0.546 5.962 -0.019 1.00 0.23 H new ATOM 0 HG23 ILE A 33 0.952 6.070 -1.749 1.00 0.23 H new ATOM 0 HD11 ILE A 33 5.011 5.698 -2.120 1.00 0.14 H new ATOM 0 HD12 ILE A 33 4.609 5.576 -0.390 1.00 0.14 H new ATOM 0 HD13 ILE A 33 3.499 4.909 -1.611 1.00 0.14 H new ATOM 248 N LEU A 34 0.728 8.629 1.717 1.00 0.17 N ATOM 249 CA LEU A 34 -0.352 8.653 2.741 1.00 0.21 C ATOM 250 C LEU A 34 -1.197 9.918 2.571 1.00 0.21 C ATOM 251 O LEU A 34 -2.408 9.880 2.667 1.00 0.25 O ATOM 252 CB LEU A 34 0.278 8.649 4.134 1.00 0.20 C ATOM 253 CG LEU A 34 0.018 7.304 4.811 1.00 0.36 C ATOM 254 CD1 LEU A 34 1.183 6.357 4.529 1.00 0.37 C ATOM 255 CD2 LEU A 34 -0.114 7.515 6.321 1.00 0.53 C ATOM 0 H LEU A 34 1.671 8.770 2.080 1.00 0.17 H new ATOM 0 HA LEU A 34 -0.988 7.776 2.619 1.00 0.21 H new ATOM 0 HB2 LEU A 34 1.351 8.829 4.059 1.00 0.20 H new ATOM 0 HB3 LEU A 34 -0.139 9.457 4.735 1.00 0.20 H new ATOM 0 HG LEU A 34 -0.903 6.871 4.420 1.00 0.36 H new ATOM 0 HD11 LEU A 34 0.997 5.398 5.012 1.00 0.37 H new ATOM 0 HD12 LEU A 34 1.279 6.209 3.453 1.00 0.37 H new ATOM 0 HD13 LEU A 34 2.105 6.788 4.920 1.00 0.37 H new ATOM 0 HD21 LEU A 34 -0.300 6.557 6.807 1.00 0.53 H new ATOM 0 HD22 LEU A 34 0.808 7.947 6.710 1.00 0.53 H new ATOM 0 HD23 LEU A 34 -0.945 8.191 6.523 1.00 0.53 H new ATOM 267 N ASP A 35 -0.574 11.040 2.311 1.00 0.18 N ATOM 268 CA ASP A 35 -1.357 12.300 2.128 1.00 0.18 C ATOM 269 C ASP A 35 -2.435 12.050 1.083 1.00 0.21 C ATOM 270 O ASP A 35 -3.525 12.583 1.153 1.00 0.19 O ATOM 271 CB ASP A 35 -0.428 13.422 1.657 1.00 0.15 C ATOM 272 CG ASP A 35 -0.792 14.728 2.367 1.00 0.45 C ATOM 273 OD1 ASP A 35 -1.852 14.779 2.970 1.00 1.03 O ATOM 274 OD2 ASP A 35 -0.003 15.656 2.296 1.00 0.56 O ATOM 0 H ASP A 35 0.437 11.138 2.218 1.00 0.18 H new ATOM 0 HA ASP A 35 -1.814 12.597 3.072 1.00 0.18 H new ATOM 0 HB2 ASP A 35 0.609 13.160 1.867 1.00 0.15 H new ATOM 0 HB3 ASP A 35 -0.513 13.548 0.578 1.00 0.15 H new ATOM 279 N GLY A 36 -2.144 11.216 0.131 1.00 0.26 N ATOM 280 CA GLY A 36 -3.152 10.896 -0.904 1.00 0.29 C ATOM 281 C GLY A 36 -4.192 9.974 -0.274 1.00 0.31 C ATOM 282 O GLY A 36 -5.374 10.177 -0.411 1.00 0.31 O ATOM 0 H GLY A 36 -1.247 10.741 0.026 1.00 0.26 H new ATOM 0 HA2 GLY A 36 -3.623 11.807 -1.273 1.00 0.29 H new ATOM 0 HA3 GLY A 36 -2.681 10.412 -1.759 1.00 0.29 H new ATOM 286 N ILE A 37 -3.745 8.966 0.426 1.00 0.32 N ATOM 287 CA ILE A 37 -4.689 8.018 1.085 1.00 0.33 C ATOM 288 C ILE A 37 -5.663 8.785 1.987 1.00 0.31 C ATOM 289 O ILE A 37 -6.725 8.295 2.313 1.00 0.30 O ATOM 290 CB ILE A 37 -3.895 7.021 1.934 1.00 0.35 C ATOM 291 CG1 ILE A 37 -2.958 6.215 1.029 1.00 0.36 C ATOM 292 CG2 ILE A 37 -4.859 6.070 2.650 1.00 0.30 C ATOM 293 CD1 ILE A 37 -3.778 5.400 0.029 1.00 0.27 C ATOM 0 H ILE A 37 -2.757 8.757 0.571 1.00 0.32 H new ATOM 0 HA ILE A 37 -5.254 7.488 0.318 1.00 0.33 H new ATOM 0 HB ILE A 37 -3.308 7.564 2.675 1.00 0.35 H new ATOM 0 HG12 ILE A 37 -2.283 6.887 0.498 1.00 0.36 H new ATOM 0 HG13 ILE A 37 -2.338 5.551 1.631 1.00 0.36 H new ATOM 0 HG21 ILE A 37 -4.291 5.362 3.253 1.00 0.30 H new ATOM 0 HG22 ILE A 37 -5.524 6.644 3.295 1.00 0.30 H new ATOM 0 HG23 ILE A 37 -5.449 5.526 1.912 1.00 0.30 H new ATOM 0 HD11 ILE A 37 -3.107 4.829 -0.612 1.00 0.27 H new ATOM 0 HD12 ILE A 37 -4.434 4.716 0.568 1.00 0.27 H new ATOM 0 HD13 ILE A 37 -4.379 6.073 -0.583 1.00 0.27 H new ATOM 305 N SER A 38 -5.328 9.987 2.383 1.00 0.33 N ATOM 306 CA SER A 38 -6.261 10.760 3.239 1.00 0.32 C ATOM 307 C SER A 38 -7.472 11.082 2.385 1.00 0.31 C ATOM 308 O SER A 38 -8.609 10.933 2.793 1.00 0.30 O ATOM 309 CB SER A 38 -5.592 12.053 3.708 1.00 0.35 C ATOM 310 OG SER A 38 -4.965 11.830 4.964 1.00 0.67 O ATOM 0 H SER A 38 -4.454 10.459 2.150 1.00 0.33 H new ATOM 0 HA SER A 38 -6.545 10.190 4.124 1.00 0.32 H new ATOM 0 HB2 SER A 38 -4.856 12.382 2.975 1.00 0.35 H new ATOM 0 HB3 SER A 38 -6.332 12.848 3.795 1.00 0.35 H new ATOM 0 HG SER A 38 -4.534 12.657 5.266 1.00 0.67 H new ATOM 316 N ALA A 39 -7.223 11.495 1.178 1.00 0.32 N ATOM 317 CA ALA A 39 -8.335 11.799 0.256 1.00 0.33 C ATOM 318 C ALA A 39 -8.945 10.478 -0.221 1.00 0.24 C ATOM 319 O ALA A 39 -10.069 10.433 -0.677 1.00 0.18 O ATOM 320 CB ALA A 39 -7.814 12.592 -0.945 1.00 0.41 C ATOM 0 H ALA A 39 -6.289 11.635 0.792 1.00 0.32 H new ATOM 0 HA ALA A 39 -9.090 12.396 0.768 1.00 0.33 H new ATOM 0 HB1 ALA A 39 -8.640 12.813 -1.621 1.00 0.41 H new ATOM 0 HB2 ALA A 39 -7.369 13.525 -0.599 1.00 0.41 H new ATOM 0 HB3 ALA A 39 -7.062 12.004 -1.471 1.00 0.41 H new ATOM 326 N LEU A 40 -8.210 9.395 -0.113 1.00 0.26 N ATOM 327 CA LEU A 40 -8.757 8.086 -0.558 1.00 0.19 C ATOM 328 C LEU A 40 -9.354 7.329 0.634 1.00 0.15 C ATOM 329 O LEU A 40 -9.899 6.256 0.477 1.00 0.17 O ATOM 330 CB LEU A 40 -7.651 7.229 -1.182 1.00 0.21 C ATOM 331 CG LEU A 40 -6.851 8.053 -2.189 1.00 0.22 C ATOM 332 CD1 LEU A 40 -5.815 7.159 -2.867 1.00 0.50 C ATOM 333 CD2 LEU A 40 -7.789 8.637 -3.243 1.00 0.21 C ATOM 0 H LEU A 40 -7.262 9.367 0.262 1.00 0.26 H new ATOM 0 HA LEU A 40 -9.533 8.277 -1.299 1.00 0.19 H new ATOM 0 HB2 LEU A 40 -6.989 6.852 -0.402 1.00 0.21 H new ATOM 0 HB3 LEU A 40 -8.088 6.361 -1.676 1.00 0.21 H new ATOM 0 HG LEU A 40 -6.347 8.867 -1.668 1.00 0.22 H new ATOM 0 HD11 LEU A 40 -5.243 7.746 -3.586 1.00 0.50 H new ATOM 0 HD12 LEU A 40 -5.141 6.749 -2.115 1.00 0.50 H new ATOM 0 HD13 LEU A 40 -6.321 6.344 -3.384 1.00 0.50 H new ATOM 0 HD21 LEU A 40 -7.212 9.224 -3.958 1.00 0.21 H new ATOM 0 HD22 LEU A 40 -8.299 7.827 -3.765 1.00 0.21 H new ATOM 0 HD23 LEU A 40 -8.526 9.278 -2.759 1.00 0.21 H new ATOM 345 N ARG A 41 -9.261 7.868 1.819 1.00 0.19 N ATOM 346 CA ARG A 41 -9.835 7.160 2.997 1.00 0.22 C ATOM 347 C ARG A 41 -10.656 8.135 3.842 1.00 0.33 C ATOM 348 O ARG A 41 -11.110 7.804 4.919 1.00 0.54 O ATOM 349 CB ARG A 41 -8.716 6.569 3.852 1.00 0.30 C ATOM 350 CG ARG A 41 -9.266 5.379 4.639 1.00 0.40 C ATOM 351 CD ARG A 41 -8.151 4.770 5.490 1.00 0.50 C ATOM 352 NE ARG A 41 -8.740 4.157 6.713 1.00 0.88 N ATOM 353 CZ ARG A 41 -8.735 2.860 6.857 1.00 2.40 C ATOM 354 NH1 ARG A 41 -9.484 2.116 6.090 1.00 3.55 N ATOM 355 NH2 ARG A 41 -7.980 2.309 7.768 1.00 2.96 N ATOM 0 H ARG A 41 -8.815 8.763 2.021 1.00 0.19 H new ATOM 0 HA ARG A 41 -10.479 6.356 2.641 1.00 0.22 H new ATOM 0 HB2 ARG A 41 -7.887 6.251 3.220 1.00 0.30 H new ATOM 0 HB3 ARG A 41 -8.325 7.324 4.535 1.00 0.30 H new ATOM 0 HG2 ARG A 41 -10.090 5.701 5.276 1.00 0.40 H new ATOM 0 HG3 ARG A 41 -9.666 4.631 3.955 1.00 0.40 H new ATOM 0 HD2 ARG A 41 -7.611 4.017 4.916 1.00 0.50 H new ATOM 0 HD3 ARG A 41 -7.429 5.538 5.767 1.00 0.50 H new ATOM 0 HE ARG A 41 -9.147 4.750 7.437 1.00 0.88 H new ATOM 0 HH11 ARG A 41 -10.073 2.548 5.378 1.00 3.55 H new ATOM 0 HH12 ARG A 41 -9.480 1.102 6.202 1.00 3.55 H new ATOM 0 HH21 ARG A 41 -7.395 2.892 8.366 1.00 2.96 H new ATOM 0 HH22 ARG A 41 -7.975 1.295 7.882 1.00 2.96 H new ATOM 369 N LYS A 42 -10.865 9.331 3.366 1.00 0.24 N ATOM 370 CA LYS A 42 -11.670 10.302 4.147 1.00 0.33 C ATOM 371 C LYS A 42 -13.138 10.120 3.768 1.00 0.29 C ATOM 372 O LYS A 42 -14.019 10.122 4.608 1.00 0.40 O ATOM 373 CB LYS A 42 -11.219 11.724 3.801 1.00 0.36 C ATOM 374 CG LYS A 42 -12.107 12.738 4.526 1.00 0.56 C ATOM 375 CD LYS A 42 -12.824 13.615 3.498 1.00 1.81 C ATOM 376 CE LYS A 42 -12.870 15.059 4.001 1.00 2.22 C ATOM 377 NZ LYS A 42 -11.630 15.771 3.582 1.00 2.50 N ATOM 0 H LYS A 42 -10.513 9.674 2.472 1.00 0.24 H new ATOM 0 HA LYS A 42 -11.537 10.137 5.216 1.00 0.33 H new ATOM 0 HB2 LYS A 42 -10.178 11.866 4.090 1.00 0.36 H new ATOM 0 HB3 LYS A 42 -11.275 11.882 2.724 1.00 0.36 H new ATOM 0 HG2 LYS A 42 -12.836 12.219 5.149 1.00 0.56 H new ATOM 0 HG3 LYS A 42 -11.503 13.357 5.190 1.00 0.56 H new ATOM 0 HD2 LYS A 42 -12.305 13.569 2.540 1.00 1.81 H new ATOM 0 HD3 LYS A 42 -13.835 13.245 3.331 1.00 1.81 H new ATOM 0 HE2 LYS A 42 -13.747 15.567 3.600 1.00 2.22 H new ATOM 0 HE3 LYS A 42 -12.962 15.074 5.087 1.00 2.22 H new ATOM 0 HZ1 LYS A 42 -11.661 16.753 3.924 1.00 2.50 H new ATOM 0 HZ2 LYS A 42 -10.801 15.290 3.985 1.00 2.50 H new ATOM 0 HZ3 LYS A 42 -11.562 15.768 2.544 1.00 2.50 H new ATOM 391 N GLU A 43 -13.402 9.949 2.503 1.00 0.18 N ATOM 392 CA GLU A 43 -14.800 9.761 2.045 1.00 0.26 C ATOM 393 C GLU A 43 -15.169 8.283 2.143 1.00 0.27 C ATOM 394 O GLU A 43 -16.220 7.929 2.652 1.00 0.36 O ATOM 395 CB GLU A 43 -14.912 10.219 0.589 1.00 0.28 C ATOM 396 CG GLU A 43 -16.353 10.636 0.291 1.00 0.51 C ATOM 397 CD GLU A 43 -16.866 9.864 -0.926 1.00 1.32 C ATOM 398 OE1 GLU A 43 -17.021 8.659 -0.815 1.00 2.53 O ATOM 399 OE2 GLU A 43 -17.091 10.490 -1.948 1.00 1.10 O ATOM 0 H GLU A 43 -12.700 9.932 1.763 1.00 0.18 H new ATOM 0 HA GLU A 43 -15.477 10.345 2.668 1.00 0.26 H new ATOM 0 HB2 GLU A 43 -14.236 11.055 0.407 1.00 0.28 H new ATOM 0 HB3 GLU A 43 -14.610 9.413 -0.080 1.00 0.28 H new ATOM 0 HG2 GLU A 43 -16.987 10.437 1.155 1.00 0.51 H new ATOM 0 HG3 GLU A 43 -16.401 11.708 0.101 1.00 0.51 H new ATOM 406 N THR A 44 -14.312 7.421 1.652 1.00 0.20 N ATOM 407 CA THR A 44 -14.600 5.960 1.699 1.00 0.21 C ATOM 408 C THR A 44 -14.148 5.366 3.037 1.00 0.30 C ATOM 409 O THR A 44 -13.478 4.353 3.088 1.00 0.47 O ATOM 410 CB THR A 44 -13.881 5.256 0.541 1.00 0.12 C ATOM 411 OG1 THR A 44 -14.309 3.902 0.473 1.00 0.18 O ATOM 412 CG2 THR A 44 -12.368 5.302 0.759 1.00 0.15 C ATOM 0 H THR A 44 -13.423 7.671 1.220 1.00 0.20 H new ATOM 0 HA THR A 44 -15.675 5.809 1.601 1.00 0.21 H new ATOM 0 HB THR A 44 -14.122 5.765 -0.392 1.00 0.12 H new ATOM 0 HG1 THR A 44 -14.187 3.476 1.347 1.00 0.18 H new ATOM 0 HG21 THR A 44 -11.866 4.800 -0.068 1.00 0.15 H new ATOM 0 HG22 THR A 44 -12.039 6.340 0.807 1.00 0.15 H new ATOM 0 HG23 THR A 44 -12.120 4.799 1.694 1.00 0.15 H new ATOM 420 N CYS A 45 -14.528 5.984 4.114 1.00 0.29 N ATOM 421 CA CYS A 45 -14.158 5.475 5.458 1.00 0.43 C ATOM 422 C CYS A 45 -14.973 6.267 6.475 1.00 0.59 C ATOM 423 O CYS A 45 -15.565 5.716 7.381 1.00 0.68 O ATOM 424 CB CYS A 45 -12.661 5.671 5.702 1.00 0.49 C ATOM 425 SG CYS A 45 -11.934 4.129 6.319 1.00 0.96 S ATOM 0 H CYS A 45 -15.089 6.836 4.120 1.00 0.29 H new ATOM 0 HA CYS A 45 -14.368 4.409 5.543 1.00 0.43 H new ATOM 0 HB2 CYS A 45 -12.169 5.972 4.777 1.00 0.49 H new ATOM 0 HB3 CYS A 45 -12.502 6.473 6.423 1.00 0.49 H new ATOM 430 N ASN A 46 -15.048 7.562 6.306 1.00 0.64 N ATOM 431 CA ASN A 46 -15.873 8.369 7.236 1.00 0.81 C ATOM 432 C ASN A 46 -17.334 8.109 6.883 1.00 0.84 C ATOM 433 O ASN A 46 -18.150 7.816 7.733 1.00 0.94 O ATOM 434 CB ASN A 46 -15.551 9.855 7.067 1.00 0.84 C ATOM 435 CG ASN A 46 -14.111 10.116 7.508 1.00 2.25 C ATOM 436 OD1 ASN A 46 -13.402 9.202 7.880 1.00 3.40 O ATOM 437 ND2 ASN A 46 -13.645 11.334 7.487 1.00 2.69 N ATOM 0 H ASN A 46 -14.576 8.086 5.569 1.00 0.64 H new ATOM 0 HA ASN A 46 -15.669 8.095 8.271 1.00 0.81 H new ATOM 0 HB2 ASN A 46 -15.684 10.151 6.026 1.00 0.84 H new ATOM 0 HB3 ASN A 46 -16.239 10.457 7.660 1.00 0.84 H new ATOM 0 HD21 ASN A 46 -12.686 11.518 7.783 1.00 2.69 H new ATOM 0 HD22 ASN A 46 -14.239 12.102 7.175 1.00 2.69 H new ATOM 444 N LYS A 47 -17.662 8.181 5.617 1.00 0.77 N ATOM 445 CA LYS A 47 -19.058 7.903 5.194 1.00 0.82 C ATOM 446 C LYS A 47 -19.185 6.422 4.836 1.00 0.85 C ATOM 447 O LYS A 47 -20.270 5.877 4.771 1.00 1.36 O ATOM 448 CB LYS A 47 -19.412 8.761 3.978 1.00 0.75 C ATOM 449 CG LYS A 47 -20.924 8.988 3.938 1.00 0.66 C ATOM 450 CD LYS A 47 -21.221 10.481 4.088 1.00 1.11 C ATOM 451 CE LYS A 47 -21.610 11.062 2.729 1.00 0.81 C ATOM 452 NZ LYS A 47 -22.437 12.286 2.930 1.00 1.45 N ATOM 0 H LYS A 47 -17.019 8.421 4.862 1.00 0.77 H new ATOM 0 HA LYS A 47 -19.742 8.144 6.008 1.00 0.82 H new ATOM 0 HB2 LYS A 47 -18.891 9.717 4.030 1.00 0.75 H new ATOM 0 HB3 LYS A 47 -19.083 8.268 3.063 1.00 0.75 H new ATOM 0 HG2 LYS A 47 -21.333 8.618 2.998 1.00 0.66 H new ATOM 0 HG3 LYS A 47 -21.408 8.428 4.738 1.00 0.66 H new ATOM 0 HD2 LYS A 47 -22.028 10.632 4.805 1.00 1.11 H new ATOM 0 HD3 LYS A 47 -20.346 10.999 4.480 1.00 1.11 H new ATOM 0 HE2 LYS A 47 -20.715 11.305 2.156 1.00 0.81 H new ATOM 0 HE3 LYS A 47 -22.168 10.324 2.152 1.00 0.81 H new ATOM 0 HZ1 LYS A 47 -22.702 12.682 2.005 1.00 1.45 H new ATOM 0 HZ2 LYS A 47 -23.297 12.041 3.461 1.00 1.45 H new ATOM 0 HZ3 LYS A 47 -21.890 12.991 3.464 1.00 1.45 H new ATOM 466 N SER A 48 -18.081 5.768 4.599 1.00 0.57 N ATOM 467 CA SER A 48 -18.126 4.324 4.241 1.00 0.51 C ATOM 468 C SER A 48 -18.547 3.509 5.462 1.00 0.85 C ATOM 469 O SER A 48 -17.767 3.255 6.355 1.00 2.07 O ATOM 470 CB SER A 48 -16.742 3.870 3.779 1.00 0.56 C ATOM 471 OG SER A 48 -16.811 2.517 3.348 1.00 0.91 O ATOM 0 H SER A 48 -17.146 6.174 4.638 1.00 0.57 H new ATOM 0 HA SER A 48 -18.846 4.172 3.437 1.00 0.51 H new ATOM 0 HB2 SER A 48 -16.391 4.505 2.966 1.00 0.56 H new ATOM 0 HB3 SER A 48 -16.024 3.968 4.593 1.00 0.56 H new ATOM 0 HG SER A 48 -17.705 2.332 2.993 1.00 0.91 H new ATOM 477 N ASN A 49 -19.778 3.086 5.499 1.00 0.26 N ATOM 478 CA ASN A 49 -20.272 2.282 6.651 1.00 0.22 C ATOM 479 C ASN A 49 -19.298 1.143 6.995 1.00 0.30 C ATOM 480 O ASN A 49 -19.354 0.586 8.072 1.00 0.89 O ATOM 481 CB ASN A 49 -21.634 1.686 6.297 1.00 0.46 C ATOM 482 CG ASN A 49 -22.742 2.595 6.829 1.00 0.67 C ATOM 483 OD1 ASN A 49 -23.791 2.126 7.223 1.00 1.60 O ATOM 484 ND2 ASN A 49 -22.552 3.886 6.858 1.00 1.40 N ATOM 0 H ASN A 49 -20.471 3.265 4.772 1.00 0.26 H new ATOM 0 HA ASN A 49 -20.354 2.937 7.518 1.00 0.22 H new ATOM 0 HB2 ASN A 49 -21.726 1.577 5.216 1.00 0.46 H new ATOM 0 HB3 ASN A 49 -21.729 0.689 6.727 1.00 0.46 H new ATOM 0 HD21 ASN A 49 -23.284 4.501 7.212 1.00 1.40 H new ATOM 0 HD22 ASN A 49 -21.671 4.279 6.527 1.00 1.40 H new ATOM 491 N MET A 50 -18.415 0.780 6.101 1.00 0.41 N ATOM 492 CA MET A 50 -17.468 -0.329 6.410 1.00 0.36 C ATOM 493 C MET A 50 -16.153 0.249 6.925 1.00 0.37 C ATOM 494 O MET A 50 -15.083 -0.161 6.517 1.00 0.56 O ATOM 495 CB MET A 50 -17.203 -1.136 5.139 1.00 0.49 C ATOM 496 CG MET A 50 -17.252 -2.631 5.461 1.00 1.06 C ATOM 497 SD MET A 50 -18.900 -3.277 5.081 1.00 0.85 S ATOM 498 CE MET A 50 -18.827 -3.042 3.289 1.00 0.55 C ATOM 0 H MET A 50 -18.310 1.201 5.178 1.00 0.41 H new ATOM 0 HA MET A 50 -17.903 -0.976 7.172 1.00 0.36 H new ATOM 0 HB2 MET A 50 -17.946 -0.893 4.380 1.00 0.49 H new ATOM 0 HB3 MET A 50 -16.229 -0.874 4.726 1.00 0.49 H new ATOM 0 HG2 MET A 50 -16.498 -3.164 4.881 1.00 1.06 H new ATOM 0 HG3 MET A 50 -17.019 -2.795 6.513 1.00 1.06 H new ATOM 0 HE1 MET A 50 -19.531 -3.719 2.804 1.00 0.55 H new ATOM 0 HE2 MET A 50 -19.088 -2.012 3.046 1.00 0.55 H new ATOM 0 HE3 MET A 50 -17.818 -3.254 2.935 1.00 0.55 H new ATOM 508 N CYS A 51 -16.216 1.202 7.812 1.00 0.58 N ATOM 509 CA CYS A 51 -14.959 1.801 8.336 1.00 0.78 C ATOM 510 C CYS A 51 -15.225 2.437 9.703 1.00 1.39 C ATOM 511 O CYS A 51 -14.729 1.982 10.715 1.00 2.27 O ATOM 512 CB CYS A 51 -14.477 2.861 7.347 1.00 0.54 C ATOM 513 SG CYS A 51 -12.998 3.692 7.980 1.00 0.95 S ATOM 0 H CYS A 51 -17.078 1.590 8.195 1.00 0.58 H new ATOM 0 HA CYS A 51 -14.195 1.033 8.452 1.00 0.78 H new ATOM 0 HB2 CYS A 51 -14.257 2.397 6.386 1.00 0.54 H new ATOM 0 HB3 CYS A 51 -15.267 3.592 7.175 1.00 0.54 H new ATOM 518 N GLU A 52 -16.000 3.484 9.741 1.00 1.23 N ATOM 519 CA GLU A 52 -16.291 4.143 11.046 1.00 1.79 C ATOM 520 C GLU A 52 -17.752 4.586 11.079 1.00 1.71 C ATOM 521 O GLU A 52 -18.078 5.644 11.582 1.00 2.01 O ATOM 522 CB GLU A 52 -15.383 5.361 11.219 1.00 2.20 C ATOM 523 CG GLU A 52 -13.970 4.897 11.573 1.00 2.77 C ATOM 524 CD GLU A 52 -13.512 5.587 12.861 1.00 3.56 C ATOM 525 OE1 GLU A 52 -14.296 5.638 13.794 1.00 3.70 O ATOM 526 OE2 GLU A 52 -12.383 6.051 12.892 1.00 4.29 O ATOM 0 H GLU A 52 -16.444 3.912 8.928 1.00 1.23 H new ATOM 0 HA GLU A 52 -16.108 3.438 11.857 1.00 1.79 H new ATOM 0 HB2 GLU A 52 -15.365 5.948 10.301 1.00 2.20 H new ATOM 0 HB3 GLU A 52 -15.772 6.009 12.004 1.00 2.20 H new ATOM 0 HG2 GLU A 52 -13.953 3.815 11.702 1.00 2.77 H new ATOM 0 HG3 GLU A 52 -13.284 5.132 10.759 1.00 2.77 H new ATOM 533 N SER A 53 -18.639 3.785 10.553 1.00 1.54 N ATOM 534 CA SER A 53 -20.082 4.159 10.564 1.00 1.75 C ATOM 535 C SER A 53 -20.505 4.463 12.004 1.00 2.10 C ATOM 536 O SER A 53 -20.963 5.544 12.319 1.00 2.15 O ATOM 537 CB SER A 53 -20.914 2.997 10.023 1.00 2.06 C ATOM 538 OG SER A 53 -22.022 3.509 9.296 1.00 1.75 O ATOM 0 H SER A 53 -18.427 2.888 10.116 1.00 1.54 H new ATOM 0 HA SER A 53 -20.241 5.037 9.938 1.00 1.75 H new ATOM 0 HB2 SER A 53 -20.302 2.366 9.378 1.00 2.06 H new ATOM 0 HB3 SER A 53 -21.262 2.371 10.845 1.00 2.06 H new ATOM 0 HG SER A 53 -22.816 2.967 9.486 1.00 1.75 H new ATOM 544 N SER A 54 -20.343 3.510 12.878 1.00 2.52 N ATOM 545 CA SER A 54 -20.712 3.712 14.305 1.00 2.89 C ATOM 546 C SER A 54 -20.095 2.574 15.112 1.00 3.22 C ATOM 547 O SER A 54 -20.308 1.415 14.815 1.00 3.44 O ATOM 548 CB SER A 54 -22.234 3.689 14.455 1.00 3.22 C ATOM 549 OG SER A 54 -22.834 3.864 13.180 1.00 2.59 O ATOM 0 H SER A 54 -19.966 2.588 12.660 1.00 2.52 H new ATOM 0 HA SER A 54 -20.344 4.674 14.661 1.00 2.89 H new ATOM 0 HB2 SER A 54 -22.553 2.744 14.893 1.00 3.22 H new ATOM 0 HB3 SER A 54 -22.556 4.480 15.133 1.00 3.22 H new ATOM 0 HG SER A 54 -23.809 3.848 13.273 1.00 2.59 H new ATOM 555 N LYS A 55 -19.304 2.883 16.104 1.00 3.82 N ATOM 556 CA LYS A 55 -18.654 1.800 16.891 1.00 4.18 C ATOM 557 C LYS A 55 -17.787 0.988 15.925 1.00 3.33 C ATOM 558 O LYS A 55 -17.935 -0.209 15.778 1.00 2.82 O ATOM 559 CB LYS A 55 -19.728 0.912 17.539 1.00 4.82 C ATOM 560 CG LYS A 55 -19.078 -0.321 18.170 1.00 6.32 C ATOM 561 CD LYS A 55 -19.574 -1.581 17.456 1.00 7.05 C ATOM 562 CE LYS A 55 -20.099 -2.581 18.490 1.00 8.45 C ATOM 563 NZ LYS A 55 -21.014 -3.556 17.828 1.00 8.80 N ATOM 0 H LYS A 55 -19.082 3.833 16.401 1.00 3.82 H new ATOM 0 HA LYS A 55 -18.038 2.212 17.690 1.00 4.18 H new ATOM 0 HB2 LYS A 55 -20.269 1.477 18.298 1.00 4.82 H new ATOM 0 HB3 LYS A 55 -20.458 0.605 16.790 1.00 4.82 H new ATOM 0 HG2 LYS A 55 -17.993 -0.251 18.096 1.00 6.32 H new ATOM 0 HG3 LYS A 55 -19.322 -0.371 19.231 1.00 6.32 H new ATOM 0 HD2 LYS A 55 -20.363 -1.324 16.749 1.00 7.05 H new ATOM 0 HD3 LYS A 55 -18.764 -2.028 16.880 1.00 7.05 H new ATOM 0 HE2 LYS A 55 -19.266 -3.108 18.956 1.00 8.45 H new ATOM 0 HE3 LYS A 55 -20.627 -2.054 19.284 1.00 8.45 H new ATOM 0 HZ1 LYS A 55 -21.368 -4.233 18.533 1.00 8.80 H new ATOM 0 HZ2 LYS A 55 -21.815 -3.047 17.403 1.00 8.80 H new ATOM 0 HZ3 LYS A 55 -20.497 -4.068 17.085 1.00 8.80 H new ATOM 577 N GLU A 56 -16.890 1.655 15.251 1.00 3.55 N ATOM 578 CA GLU A 56 -16.008 0.969 14.274 1.00 3.13 C ATOM 579 C GLU A 56 -16.844 0.313 13.184 1.00 1.95 C ATOM 580 O GLU A 56 -18.009 0.607 13.005 1.00 1.42 O ATOM 581 CB GLU A 56 -15.162 -0.096 14.975 1.00 3.99 C ATOM 582 CG GLU A 56 -13.696 0.305 14.863 1.00 5.95 C ATOM 583 CD GLU A 56 -12.815 -0.758 15.521 1.00 6.93 C ATOM 584 OE1 GLU A 56 -12.955 -0.959 16.716 1.00 6.91 O ATOM 585 OE2 GLU A 56 -12.015 -1.354 14.818 1.00 7.90 O ATOM 0 H GLU A 56 -16.732 2.659 15.340 1.00 3.55 H new ATOM 0 HA GLU A 56 -15.348 1.712 13.827 1.00 3.13 H new ATOM 0 HB2 GLU A 56 -15.453 -0.183 16.022 1.00 3.99 H new ATOM 0 HB3 GLU A 56 -15.325 -1.072 14.517 1.00 3.99 H new ATOM 0 HG2 GLU A 56 -13.420 0.421 13.815 1.00 5.95 H new ATOM 0 HG3 GLU A 56 -13.536 1.271 15.343 1.00 5.95 H new ATOM 592 N ALA A 57 -16.244 -0.578 12.458 1.00 2.07 N ATOM 593 CA ALA A 57 -16.956 -1.279 11.375 1.00 0.98 C ATOM 594 C ALA A 57 -16.405 -2.694 11.337 1.00 0.72 C ATOM 595 O ALA A 57 -15.236 -2.901 11.091 1.00 1.11 O ATOM 596 CB ALA A 57 -16.682 -0.569 10.051 1.00 1.10 C ATOM 0 H ALA A 57 -15.269 -0.853 12.575 1.00 2.07 H new ATOM 0 HA ALA A 57 -18.033 -1.289 11.540 1.00 0.98 H new ATOM 0 HB1 ALA A 57 -17.207 -1.084 9.246 1.00 1.10 H new ATOM 0 HB2 ALA A 57 -17.032 0.461 10.111 1.00 1.10 H new ATOM 0 HB3 ALA A 57 -15.611 -0.577 9.849 1.00 1.10 H new ATOM 602 N LEU A 58 -17.219 -3.665 11.614 1.00 0.76 N ATOM 603 CA LEU A 58 -16.715 -5.060 11.632 1.00 1.05 C ATOM 604 C LEU A 58 -16.104 -5.401 10.275 1.00 0.94 C ATOM 605 O LEU A 58 -16.779 -5.838 9.363 1.00 1.67 O ATOM 606 CB LEU A 58 -17.871 -6.001 11.937 1.00 1.42 C ATOM 607 CG LEU A 58 -18.997 -5.774 10.926 1.00 2.13 C ATOM 608 CD1 LEU A 58 -19.236 -7.056 10.127 1.00 2.80 C ATOM 609 CD2 LEU A 58 -20.277 -5.389 11.670 1.00 3.08 C ATOM 0 H LEU A 58 -18.210 -3.555 11.829 1.00 0.76 H new ATOM 0 HA LEU A 58 -15.949 -5.168 12.400 1.00 1.05 H new ATOM 0 HB2 LEU A 58 -17.532 -7.036 11.893 1.00 1.42 H new ATOM 0 HB3 LEU A 58 -18.237 -5.828 12.949 1.00 1.42 H new ATOM 0 HG LEU A 58 -18.716 -4.971 10.244 1.00 2.13 H new ATOM 0 HD11 LEU A 58 -20.038 -6.892 9.408 1.00 2.80 H new ATOM 0 HD12 LEU A 58 -18.324 -7.330 9.597 1.00 2.80 H new ATOM 0 HD13 LEU A 58 -19.517 -7.861 10.806 1.00 2.80 H new ATOM 0 HD21 LEU A 58 -21.081 -5.227 10.952 1.00 3.08 H new ATOM 0 HD22 LEU A 58 -20.557 -6.192 12.352 1.00 3.08 H new ATOM 0 HD23 LEU A 58 -20.107 -4.474 12.237 1.00 3.08 H new ATOM 621 N ALA A 59 -14.822 -5.199 10.142 1.00 0.22 N ATOM 622 CA ALA A 59 -14.143 -5.503 8.850 1.00 0.41 C ATOM 623 C ALA A 59 -13.046 -6.541 9.089 1.00 0.53 C ATOM 624 O ALA A 59 -11.985 -6.230 9.593 1.00 0.80 O ATOM 625 CB ALA A 59 -13.519 -4.222 8.291 1.00 0.97 C ATOM 0 H ALA A 59 -14.213 -4.835 10.875 1.00 0.22 H new ATOM 0 HA ALA A 59 -14.869 -5.895 8.137 1.00 0.41 H new ATOM 0 HB1 ALA A 59 -13.022 -4.442 7.346 1.00 0.97 H new ATOM 0 HB2 ALA A 59 -14.299 -3.479 8.126 1.00 0.97 H new ATOM 0 HB3 ALA A 59 -12.791 -3.832 9.002 1.00 0.97 H new ATOM 631 N GLU A 60 -13.294 -7.774 8.742 1.00 0.77 N ATOM 632 CA GLU A 60 -12.267 -8.825 8.963 1.00 1.19 C ATOM 633 C GLU A 60 -12.135 -9.691 7.707 1.00 1.07 C ATOM 634 O GLU A 60 -11.821 -10.863 7.782 1.00 1.28 O ATOM 635 CB GLU A 60 -12.705 -9.695 10.139 1.00 1.56 C ATOM 636 CG GLU A 60 -11.473 -10.253 10.852 1.00 2.24 C ATOM 637 CD GLU A 60 -11.559 -11.779 10.902 1.00 2.54 C ATOM 638 OE1 GLU A 60 -11.587 -12.387 9.845 1.00 2.88 O ATOM 639 OE2 GLU A 60 -11.596 -12.316 11.999 1.00 2.70 O ATOM 0 H GLU A 60 -14.163 -8.097 8.316 1.00 0.77 H new ATOM 0 HA GLU A 60 -11.304 -8.363 9.178 1.00 1.19 H new ATOM 0 HB2 GLU A 60 -13.305 -9.108 10.834 1.00 1.56 H new ATOM 0 HB3 GLU A 60 -13.334 -10.512 9.785 1.00 1.56 H new ATOM 0 HG2 GLU A 60 -10.567 -9.946 10.329 1.00 2.24 H new ATOM 0 HG3 GLU A 60 -11.410 -9.849 11.862 1.00 2.24 H new ATOM 646 N ASN A 61 -12.371 -9.126 6.553 1.00 0.86 N ATOM 647 CA ASN A 61 -12.258 -9.922 5.297 1.00 0.97 C ATOM 648 C ASN A 61 -10.804 -10.361 5.102 1.00 1.20 C ATOM 649 O ASN A 61 -10.527 -11.501 4.786 1.00 1.87 O ATOM 650 CB ASN A 61 -12.700 -9.068 4.108 1.00 0.99 C ATOM 651 CG ASN A 61 -12.561 -9.878 2.818 1.00 2.02 C ATOM 652 OD1 ASN A 61 -11.920 -9.445 1.882 1.00 3.12 O ATOM 653 ND2 ASN A 61 -13.139 -11.045 2.729 1.00 2.13 N ATOM 0 H ASN A 61 -12.637 -8.149 6.426 1.00 0.86 H new ATOM 0 HA ASN A 61 -12.897 -10.802 5.365 1.00 0.97 H new ATOM 0 HB2 ASN A 61 -13.734 -8.749 4.240 1.00 0.99 H new ATOM 0 HB3 ASN A 61 -12.093 -8.165 4.050 1.00 0.99 H new ATOM 0 HD21 ASN A 61 -13.052 -11.593 1.873 1.00 2.13 H new ATOM 0 HD22 ASN A 61 -13.677 -11.409 3.515 1.00 2.13 H new ATOM 660 N ASN A 62 -9.874 -9.461 5.292 1.00 0.78 N ATOM 661 CA ASN A 62 -8.429 -9.812 5.129 1.00 1.12 C ATOM 662 C ASN A 62 -8.090 -9.972 3.644 1.00 0.95 C ATOM 663 O ASN A 62 -8.010 -11.069 3.130 1.00 1.38 O ATOM 664 CB ASN A 62 -8.113 -11.122 5.862 1.00 1.66 C ATOM 665 CG ASN A 62 -8.832 -11.146 7.214 1.00 2.03 C ATOM 666 OD1 ASN A 62 -9.578 -12.060 7.502 1.00 3.31 O ATOM 667 ND2 ASN A 62 -8.638 -10.172 8.060 1.00 1.05 N ATOM 0 H ASN A 62 -10.053 -8.492 5.555 1.00 0.78 H new ATOM 0 HA ASN A 62 -7.830 -9.007 5.555 1.00 1.12 H new ATOM 0 HB2 ASN A 62 -8.427 -11.973 5.257 1.00 1.66 H new ATOM 0 HB3 ASN A 62 -7.037 -11.216 6.010 1.00 1.66 H new ATOM 0 HD21 ASN A 62 -9.113 -10.178 8.963 1.00 1.05 H new ATOM 0 HD22 ASN A 62 -8.012 -9.404 7.819 1.00 1.05 H new ATOM 674 N LEU A 63 -7.875 -8.883 2.957 1.00 0.55 N ATOM 675 CA LEU A 63 -7.524 -8.963 1.509 1.00 0.64 C ATOM 676 C LEU A 63 -6.207 -9.734 1.359 1.00 0.93 C ATOM 677 O LEU A 63 -5.792 -10.442 2.255 1.00 1.05 O ATOM 678 CB LEU A 63 -7.368 -7.542 0.966 1.00 0.54 C ATOM 679 CG LEU A 63 -8.741 -6.870 0.911 1.00 0.58 C ATOM 680 CD1 LEU A 63 -8.566 -5.379 0.617 1.00 0.89 C ATOM 681 CD2 LEU A 63 -9.578 -7.515 -0.197 1.00 0.84 C ATOM 0 H LEU A 63 -7.927 -7.938 3.337 1.00 0.55 H new ATOM 0 HA LEU A 63 -8.305 -9.480 0.952 1.00 0.64 H new ATOM 0 HB2 LEU A 63 -6.695 -6.969 1.603 1.00 0.54 H new ATOM 0 HB3 LEU A 63 -6.922 -7.567 -0.028 1.00 0.54 H new ATOM 0 HG LEU A 63 -9.247 -6.994 1.868 1.00 0.58 H new ATOM 0 HD11 LEU A 63 -9.544 -4.899 0.577 1.00 0.89 H new ATOM 0 HD12 LEU A 63 -7.968 -4.921 1.405 1.00 0.89 H new ATOM 0 HD13 LEU A 63 -8.061 -5.254 -0.341 1.00 0.89 H new ATOM 0 HD21 LEU A 63 -10.557 -7.038 -0.238 1.00 0.84 H new ATOM 0 HD22 LEU A 63 -9.073 -7.389 -1.155 1.00 0.84 H new ATOM 0 HD23 LEU A 63 -9.701 -8.578 0.012 1.00 0.84 H new ATOM 693 N ASN A 64 -5.543 -9.614 0.239 1.00 1.08 N ATOM 694 CA ASN A 64 -4.262 -10.351 0.058 1.00 1.36 C ATOM 695 C ASN A 64 -3.148 -9.362 -0.281 1.00 1.35 C ATOM 696 O ASN A 64 -2.164 -9.706 -0.906 1.00 1.45 O ATOM 697 CB ASN A 64 -4.412 -11.362 -1.082 1.00 1.69 C ATOM 698 CG ASN A 64 -3.140 -12.203 -1.189 1.00 2.26 C ATOM 699 OD1 ASN A 64 -2.608 -12.653 -0.192 1.00 2.24 O ATOM 700 ND2 ASN A 64 -2.624 -12.438 -2.364 1.00 3.16 N ATOM 0 H ASN A 64 -5.832 -9.040 -0.553 1.00 1.08 H new ATOM 0 HA ASN A 64 -4.012 -10.877 0.980 1.00 1.36 H new ATOM 0 HB2 ASN A 64 -5.272 -12.006 -0.900 1.00 1.69 H new ATOM 0 HB3 ASN A 64 -4.597 -10.842 -2.022 1.00 1.69 H new ATOM 0 HD21 ASN A 64 -1.776 -12.998 -2.446 1.00 3.16 H new ATOM 0 HD22 ASN A 64 -3.069 -12.061 -3.201 1.00 3.16 H new ATOM 707 N LEU A 65 -3.298 -8.132 0.123 1.00 1.32 N ATOM 708 CA LEU A 65 -2.252 -7.120 -0.176 1.00 1.41 C ATOM 709 C LEU A 65 -1.218 -6.938 0.973 1.00 1.44 C ATOM 710 O LEU A 65 -0.189 -6.341 0.727 1.00 2.03 O ATOM 711 CB LEU A 65 -2.921 -5.775 -0.483 1.00 1.37 C ATOM 712 CG LEU A 65 -3.545 -5.192 0.783 1.00 1.14 C ATOM 713 CD1 LEU A 65 -2.784 -3.932 1.188 1.00 0.87 C ATOM 714 CD2 LEU A 65 -5.006 -4.836 0.510 1.00 1.41 C ATOM 0 H LEU A 65 -4.101 -7.785 0.648 1.00 1.32 H new ATOM 0 HA LEU A 65 -1.696 -7.486 -1.039 1.00 1.41 H new ATOM 0 HB2 LEU A 65 -2.186 -5.079 -0.888 1.00 1.37 H new ATOM 0 HB3 LEU A 65 -3.688 -5.908 -1.246 1.00 1.37 H new ATOM 0 HG LEU A 65 -3.492 -5.925 1.588 1.00 1.14 H new ATOM 0 HD11 LEU A 65 -3.227 -3.514 2.092 1.00 0.87 H new ATOM 0 HD12 LEU A 65 -1.740 -4.183 1.378 1.00 0.87 H new ATOM 0 HD13 LEU A 65 -2.840 -3.199 0.383 1.00 0.87 H new ATOM 0 HD21 LEU A 65 -5.454 -4.420 1.412 1.00 1.41 H new ATOM 0 HD22 LEU A 65 -5.057 -4.101 -0.293 1.00 1.41 H new ATOM 0 HD23 LEU A 65 -5.550 -5.733 0.216 1.00 1.41 H new ATOM 726 N PRO A 66 -1.465 -7.424 2.189 1.00 1.20 N ATOM 727 CA PRO A 66 -0.486 -7.249 3.279 1.00 1.27 C ATOM 728 C PRO A 66 0.671 -8.240 3.122 1.00 0.65 C ATOM 729 O PRO A 66 0.577 -9.212 2.400 1.00 1.11 O ATOM 730 CB PRO A 66 -1.285 -7.541 4.551 1.00 1.96 C ATOM 731 CG PRO A 66 -2.488 -8.405 4.117 1.00 2.24 C ATOM 732 CD PRO A 66 -2.679 -8.170 2.608 1.00 1.60 C ATOM 0 HA PRO A 66 -0.039 -6.255 3.289 1.00 1.27 H new ATOM 0 HB2 PRO A 66 -0.672 -8.067 5.283 1.00 1.96 H new ATOM 0 HB3 PRO A 66 -1.620 -6.616 5.021 1.00 1.96 H new ATOM 0 HG2 PRO A 66 -2.302 -9.459 4.324 1.00 2.24 H new ATOM 0 HG3 PRO A 66 -3.385 -8.125 4.669 1.00 2.24 H new ATOM 0 HD2 PRO A 66 -2.771 -9.113 2.068 1.00 1.60 H new ATOM 0 HD3 PRO A 66 -3.585 -7.598 2.407 1.00 1.60 H new ATOM 740 N LYS A 67 1.760 -7.999 3.797 1.00 0.61 N ATOM 741 CA LYS A 67 2.925 -8.922 3.692 1.00 1.25 C ATOM 742 C LYS A 67 4.078 -8.370 4.532 1.00 1.25 C ATOM 743 O LYS A 67 5.176 -8.171 4.052 1.00 1.42 O ATOM 744 CB LYS A 67 3.357 -9.032 2.228 1.00 2.16 C ATOM 745 CG LYS A 67 3.465 -10.508 1.833 1.00 2.68 C ATOM 746 CD LYS A 67 2.660 -10.761 0.555 1.00 3.19 C ATOM 747 CE LYS A 67 3.594 -11.269 -0.545 1.00 4.35 C ATOM 748 NZ LYS A 67 3.376 -12.729 -0.749 1.00 4.84 N ATOM 0 H LYS A 67 1.894 -7.201 4.418 1.00 0.61 H new ATOM 0 HA LYS A 67 2.648 -9.910 4.059 1.00 1.25 H new ATOM 0 HB2 LYS A 67 2.636 -8.525 1.587 1.00 2.16 H new ATOM 0 HB3 LYS A 67 4.316 -8.535 2.083 1.00 2.16 H new ATOM 0 HG2 LYS A 67 4.510 -10.777 1.675 1.00 2.68 H new ATOM 0 HG3 LYS A 67 3.092 -11.139 2.640 1.00 2.68 H new ATOM 0 HD2 LYS A 67 1.875 -11.492 0.746 1.00 3.19 H new ATOM 0 HD3 LYS A 67 2.169 -9.842 0.234 1.00 3.19 H new ATOM 0 HE2 LYS A 67 3.407 -10.730 -1.473 1.00 4.35 H new ATOM 0 HE3 LYS A 67 4.632 -11.081 -0.271 1.00 4.35 H new ATOM 0 HZ1 LYS A 67 4.011 -13.074 -1.497 1.00 4.84 H new ATOM 0 HZ2 LYS A 67 3.576 -13.237 0.136 1.00 4.84 H new ATOM 0 HZ3 LYS A 67 2.389 -12.897 -1.029 1.00 4.84 H new ATOM 762 N MET A 68 3.830 -8.117 5.787 1.00 1.12 N ATOM 763 CA MET A 68 4.903 -7.572 6.667 1.00 1.11 C ATOM 764 C MET A 68 4.478 -7.705 8.132 1.00 0.79 C ATOM 765 O MET A 68 3.307 -7.669 8.452 1.00 0.72 O ATOM 766 CB MET A 68 5.127 -6.095 6.335 1.00 1.52 C ATOM 767 CG MET A 68 6.398 -5.604 7.028 1.00 1.11 C ATOM 768 SD MET A 68 7.420 -4.693 5.844 1.00 2.27 S ATOM 769 CE MET A 68 7.195 -3.048 6.564 1.00 0.78 C ATOM 0 H MET A 68 2.929 -8.264 6.242 1.00 1.12 H new ATOM 0 HA MET A 68 5.826 -8.128 6.505 1.00 1.11 H new ATOM 0 HB2 MET A 68 5.214 -5.963 5.257 1.00 1.52 H new ATOM 0 HB3 MET A 68 4.271 -5.504 6.661 1.00 1.52 H new ATOM 0 HG2 MET A 68 6.140 -4.963 7.871 1.00 1.11 H new ATOM 0 HG3 MET A 68 6.955 -6.450 7.430 1.00 1.11 H new ATOM 0 HE1 MET A 68 7.897 -2.351 6.106 1.00 0.78 H new ATOM 0 HE2 MET A 68 6.176 -2.708 6.382 1.00 0.78 H new ATOM 0 HE3 MET A 68 7.377 -3.093 7.638 1.00 0.78 H new ATOM 779 N ALA A 69 5.420 -7.854 9.023 1.00 0.79 N ATOM 780 CA ALA A 69 5.068 -7.985 10.465 1.00 0.65 C ATOM 781 C ALA A 69 6.325 -7.798 11.318 1.00 0.77 C ATOM 782 O ALA A 69 7.357 -7.374 10.834 1.00 1.27 O ATOM 783 CB ALA A 69 4.478 -9.373 10.723 1.00 0.29 C ATOM 0 H ALA A 69 6.418 -7.891 8.815 1.00 0.79 H new ATOM 0 HA ALA A 69 4.334 -7.224 10.729 1.00 0.65 H new ATOM 0 HB1 ALA A 69 4.221 -9.469 11.778 1.00 0.29 H new ATOM 0 HB2 ALA A 69 3.582 -9.506 10.117 1.00 0.29 H new ATOM 0 HB3 ALA A 69 5.211 -10.135 10.458 1.00 0.29 H new ATOM 789 N GLU A 70 6.251 -8.109 12.585 1.00 0.52 N ATOM 790 CA GLU A 70 7.444 -7.944 13.463 1.00 0.61 C ATOM 791 C GLU A 70 8.368 -9.153 13.303 1.00 0.13 C ATOM 792 O GLU A 70 9.568 -9.054 13.469 1.00 0.11 O ATOM 793 CB GLU A 70 6.996 -7.832 14.923 1.00 1.12 C ATOM 794 CG GLU A 70 6.226 -9.095 15.322 1.00 0.32 C ATOM 795 CD GLU A 70 6.112 -9.174 16.848 1.00 0.48 C ATOM 796 OE1 GLU A 70 6.694 -8.333 17.515 1.00 1.34 O ATOM 797 OE2 GLU A 70 5.443 -10.077 17.325 1.00 1.58 O ATOM 0 H GLU A 70 5.417 -8.470 13.048 1.00 0.52 H new ATOM 0 HA GLU A 70 7.979 -7.038 13.179 1.00 0.61 H new ATOM 0 HB2 GLU A 70 7.863 -7.702 15.571 1.00 1.12 H new ATOM 0 HB3 GLU A 70 6.365 -6.953 15.054 1.00 1.12 H new ATOM 0 HG2 GLU A 70 5.232 -9.083 14.874 1.00 0.32 H new ATOM 0 HG3 GLU A 70 6.737 -9.979 14.940 1.00 0.32 H new ATOM 804 N LYS A 71 7.822 -10.293 12.981 1.00 0.42 N ATOM 805 CA LYS A 71 8.675 -11.502 12.810 1.00 0.85 C ATOM 806 C LYS A 71 9.745 -11.220 11.758 1.00 0.90 C ATOM 807 O LYS A 71 10.823 -11.781 11.785 1.00 1.27 O ATOM 808 CB LYS A 71 7.809 -12.676 12.354 1.00 0.98 C ATOM 809 CG LYS A 71 7.501 -13.574 13.553 1.00 2.05 C ATOM 810 CD LYS A 71 7.180 -14.986 13.062 1.00 1.87 C ATOM 811 CE LYS A 71 5.842 -15.436 13.648 1.00 2.74 C ATOM 812 NZ LYS A 71 5.952 -15.518 15.133 1.00 3.82 N ATOM 0 H LYS A 71 6.824 -10.439 12.829 1.00 0.42 H new ATOM 0 HA LYS A 71 9.152 -11.750 13.758 1.00 0.85 H new ATOM 0 HB2 LYS A 71 6.882 -12.309 11.913 1.00 0.98 H new ATOM 0 HB3 LYS A 71 8.326 -13.246 11.582 1.00 0.98 H new ATOM 0 HG2 LYS A 71 8.354 -13.598 14.231 1.00 2.05 H new ATOM 0 HG3 LYS A 71 6.658 -13.172 14.115 1.00 2.05 H new ATOM 0 HD2 LYS A 71 7.137 -15.003 11.973 1.00 1.87 H new ATOM 0 HD3 LYS A 71 7.970 -15.675 13.360 1.00 1.87 H new ATOM 0 HE2 LYS A 71 5.056 -14.734 13.369 1.00 2.74 H new ATOM 0 HE3 LYS A 71 5.562 -16.407 13.239 1.00 2.74 H new ATOM 0 HZ1 LYS A 71 5.227 -16.167 15.500 1.00 3.82 H new ATOM 0 HZ2 LYS A 71 6.895 -15.871 15.392 1.00 3.82 H new ATOM 0 HZ3 LYS A 71 5.811 -14.573 15.544 1.00 3.82 H new ATOM 826 N ASP A 72 9.456 -10.351 10.831 1.00 0.72 N ATOM 827 CA ASP A 72 10.456 -10.026 9.778 1.00 1.08 C ATOM 828 C ASP A 72 11.563 -9.163 10.383 1.00 1.32 C ATOM 829 O ASP A 72 12.726 -9.318 10.068 1.00 1.84 O ATOM 830 CB ASP A 72 9.773 -9.262 8.642 1.00 0.89 C ATOM 831 CG ASP A 72 8.860 -10.212 7.866 1.00 1.34 C ATOM 832 OD1 ASP A 72 9.373 -10.969 7.060 1.00 1.73 O ATOM 833 OD2 ASP A 72 7.661 -10.167 8.093 1.00 2.02 O ATOM 0 H ASP A 72 8.570 -9.852 10.757 1.00 0.72 H new ATOM 0 HA ASP A 72 10.886 -10.947 9.385 1.00 1.08 H new ATOM 0 HB2 ASP A 72 9.193 -8.431 9.045 1.00 0.89 H new ATOM 0 HB3 ASP A 72 10.522 -8.834 7.975 1.00 0.89 H new ATOM 838 N GLY A 73 11.211 -8.256 11.252 1.00 1.01 N ATOM 839 CA GLY A 73 12.243 -7.384 11.880 1.00 1.32 C ATOM 840 C GLY A 73 12.022 -5.936 11.438 1.00 0.91 C ATOM 841 O GLY A 73 12.931 -5.131 11.439 1.00 1.00 O ATOM 0 H GLY A 73 10.253 -8.081 11.554 1.00 1.01 H new ATOM 0 HA2 GLY A 73 12.185 -7.457 12.966 1.00 1.32 H new ATOM 0 HA3 GLY A 73 13.240 -7.716 11.591 1.00 1.32 H new ATOM 845 N CYS A 74 10.819 -5.598 11.057 1.00 0.65 N ATOM 846 CA CYS A 74 10.540 -4.203 10.608 1.00 0.65 C ATOM 847 C CYS A 74 10.220 -3.307 11.811 1.00 0.44 C ATOM 848 O CYS A 74 9.738 -2.203 11.654 1.00 0.64 O ATOM 849 CB CYS A 74 9.343 -4.207 9.659 1.00 1.07 C ATOM 850 SG CYS A 74 9.902 -4.584 7.979 1.00 1.55 S ATOM 0 H CYS A 74 10.017 -6.228 11.037 1.00 0.65 H new ATOM 0 HA CYS A 74 11.423 -3.815 10.099 1.00 0.65 H new ATOM 0 HB2 CYS A 74 8.611 -4.946 9.984 1.00 1.07 H new ATOM 0 HB3 CYS A 74 8.847 -3.237 9.679 1.00 1.07 H new ATOM 855 N PHE A 75 10.477 -3.763 13.008 1.00 0.26 N ATOM 856 CA PHE A 75 10.176 -2.917 14.197 1.00 0.42 C ATOM 857 C PHE A 75 11.289 -3.076 15.237 1.00 0.34 C ATOM 858 O PHE A 75 12.267 -3.763 15.015 1.00 0.28 O ATOM 859 CB PHE A 75 8.837 -3.344 14.803 1.00 0.65 C ATOM 860 CG PHE A 75 7.712 -2.784 13.967 1.00 0.91 C ATOM 861 CD1 PHE A 75 7.406 -1.419 14.032 1.00 1.54 C ATOM 862 CD2 PHE A 75 6.978 -3.626 13.123 1.00 0.92 C ATOM 863 CE1 PHE A 75 6.367 -0.895 13.253 1.00 1.81 C ATOM 864 CE2 PHE A 75 5.937 -3.102 12.344 1.00 1.06 C ATOM 865 CZ PHE A 75 5.632 -1.737 12.410 1.00 1.42 C ATOM 0 H PHE A 75 10.879 -4.678 13.212 1.00 0.26 H new ATOM 0 HA PHE A 75 10.117 -1.872 13.893 1.00 0.42 H new ATOM 0 HB2 PHE A 75 8.772 -4.431 14.840 1.00 0.65 H new ATOM 0 HB3 PHE A 75 8.757 -2.984 15.829 1.00 0.65 H new ATOM 0 HD1 PHE A 75 7.972 -0.770 14.684 1.00 1.54 H new ATOM 0 HD2 PHE A 75 7.214 -4.679 13.072 1.00 0.92 H new ATOM 0 HE1 PHE A 75 6.133 0.158 13.303 1.00 1.81 H new ATOM 0 HE2 PHE A 75 5.370 -3.751 11.693 1.00 1.06 H new ATOM 0 HZ PHE A 75 4.829 -1.334 11.810 1.00 1.42 H new ATOM 875 N GLN A 76 11.148 -2.438 16.367 1.00 0.74 N ATOM 876 CA GLN A 76 12.196 -2.541 17.423 1.00 0.84 C ATOM 877 C GLN A 76 12.491 -4.014 17.722 1.00 0.73 C ATOM 878 O GLN A 76 13.629 -4.405 17.891 1.00 0.70 O ATOM 879 CB GLN A 76 11.698 -1.850 18.695 1.00 1.05 C ATOM 880 CG GLN A 76 12.890 -1.493 19.585 1.00 1.09 C ATOM 881 CD GLN A 76 13.515 -0.183 19.102 1.00 1.61 C ATOM 882 OE1 GLN A 76 14.701 -0.119 18.854 1.00 2.35 O ATOM 883 NE2 GLN A 76 12.760 0.873 18.960 1.00 2.52 N ATOM 0 H GLN A 76 10.350 -1.848 16.605 1.00 0.74 H new ATOM 0 HA GLN A 76 13.109 -2.059 17.075 1.00 0.84 H new ATOM 0 HB2 GLN A 76 11.141 -0.949 18.437 1.00 1.05 H new ATOM 0 HB3 GLN A 76 11.013 -2.506 19.233 1.00 1.05 H new ATOM 0 HG2 GLN A 76 12.567 -1.393 20.621 1.00 1.09 H new ATOM 0 HG3 GLN A 76 13.630 -2.293 19.558 1.00 1.09 H new ATOM 0 HE21 GLN A 76 11.763 0.819 19.169 1.00 2.52 H new ATOM 0 HE22 GLN A 76 13.167 1.752 18.641 1.00 2.52 H new ATOM 892 N SER A 77 11.478 -4.834 17.790 1.00 0.72 N ATOM 893 CA SER A 77 11.710 -6.278 18.079 1.00 0.67 C ATOM 894 C SER A 77 12.683 -6.851 17.047 1.00 0.52 C ATOM 895 O SER A 77 12.301 -7.205 15.949 1.00 0.84 O ATOM 896 CB SER A 77 10.385 -7.036 18.006 1.00 0.78 C ATOM 897 OG SER A 77 10.646 -8.419 17.799 1.00 1.55 O ATOM 0 H SER A 77 10.502 -4.568 17.658 1.00 0.72 H new ATOM 0 HA SER A 77 12.132 -6.385 19.078 1.00 0.67 H new ATOM 0 HB2 SER A 77 9.821 -6.895 18.928 1.00 0.78 H new ATOM 0 HB3 SER A 77 9.773 -6.644 17.194 1.00 0.78 H new ATOM 0 HG SER A 77 9.798 -8.909 17.753 1.00 1.55 H new ATOM 903 N GLY A 78 13.939 -6.945 17.389 1.00 0.80 N ATOM 904 CA GLY A 78 14.935 -7.493 16.425 1.00 0.90 C ATOM 905 C GLY A 78 14.899 -6.672 15.134 1.00 0.79 C ATOM 906 O GLY A 78 14.669 -7.194 14.061 1.00 0.79 O ATOM 0 H GLY A 78 14.318 -6.666 18.294 1.00 0.80 H new ATOM 0 HA2 GLY A 78 15.934 -7.462 16.861 1.00 0.90 H new ATOM 0 HA3 GLY A 78 14.713 -8.538 16.210 1.00 0.90 H new ATOM 910 N PHE A 79 15.121 -5.390 15.230 1.00 0.72 N ATOM 911 CA PHE A 79 15.096 -4.533 14.011 1.00 0.62 C ATOM 912 C PHE A 79 16.046 -5.101 12.953 1.00 0.52 C ATOM 913 O PHE A 79 16.904 -5.911 13.241 1.00 0.93 O ATOM 914 CB PHE A 79 15.537 -3.114 14.378 1.00 0.54 C ATOM 915 CG PHE A 79 15.382 -2.212 13.176 1.00 0.41 C ATOM 916 CD1 PHE A 79 14.124 -2.040 12.584 1.00 0.54 C ATOM 917 CD2 PHE A 79 16.497 -1.546 12.654 1.00 0.43 C ATOM 918 CE1 PHE A 79 13.983 -1.203 11.471 1.00 0.51 C ATOM 919 CE2 PHE A 79 16.356 -0.709 11.541 1.00 0.33 C ATOM 920 CZ PHE A 79 15.098 -0.538 10.949 1.00 0.23 C ATOM 0 H PHE A 79 15.319 -4.898 16.101 1.00 0.72 H new ATOM 0 HA PHE A 79 14.083 -4.512 13.609 1.00 0.62 H new ATOM 0 HB2 PHE A 79 14.938 -2.739 15.208 1.00 0.54 H new ATOM 0 HB3 PHE A 79 16.575 -3.119 14.711 1.00 0.54 H new ATOM 0 HD1 PHE A 79 13.263 -2.553 12.986 1.00 0.54 H new ATOM 0 HD2 PHE A 79 17.467 -1.678 13.110 1.00 0.43 H new ATOM 0 HE1 PHE A 79 13.013 -1.070 11.015 1.00 0.51 H new ATOM 0 HE2 PHE A 79 17.217 -0.195 11.139 1.00 0.33 H new ATOM 0 HZ PHE A 79 14.989 0.107 10.090 1.00 0.23 H new ATOM 930 N ASN A 80 15.898 -4.673 11.729 1.00 0.75 N ATOM 931 CA ASN A 80 16.784 -5.172 10.640 1.00 0.62 C ATOM 932 C ASN A 80 16.950 -4.060 9.600 1.00 0.61 C ATOM 933 O ASN A 80 16.701 -2.905 9.882 1.00 1.26 O ATOM 934 CB ASN A 80 16.147 -6.404 9.996 1.00 0.70 C ATOM 935 CG ASN A 80 14.726 -6.063 9.556 1.00 3.04 C ATOM 936 OD1 ASN A 80 14.358 -4.907 9.503 1.00 4.46 O ATOM 937 ND2 ASN A 80 13.909 -7.025 9.236 1.00 3.76 N ATOM 0 H ASN A 80 15.196 -3.994 11.435 1.00 0.75 H new ATOM 0 HA ASN A 80 17.760 -5.448 11.039 1.00 0.62 H new ATOM 0 HB2 ASN A 80 16.738 -6.728 9.139 1.00 0.70 H new ATOM 0 HB3 ASN A 80 16.132 -7.233 10.704 1.00 0.70 H new ATOM 0 HD21 ASN A 80 12.957 -6.808 8.940 1.00 3.76 H new ATOM 0 HD22 ASN A 80 14.221 -7.995 9.281 1.00 3.76 H new ATOM 944 N GLU A 81 17.372 -4.382 8.406 1.00 0.18 N ATOM 945 CA GLU A 81 17.552 -3.313 7.384 1.00 0.20 C ATOM 946 C GLU A 81 17.281 -3.858 5.977 1.00 0.20 C ATOM 947 O GLU A 81 16.416 -3.379 5.272 1.00 0.26 O ATOM 948 CB GLU A 81 18.989 -2.794 7.456 1.00 0.22 C ATOM 949 CG GLU A 81 19.299 -2.346 8.885 1.00 0.32 C ATOM 950 CD GLU A 81 20.619 -1.574 8.905 1.00 0.31 C ATOM 951 OE1 GLU A 81 20.945 -0.972 7.895 1.00 0.88 O ATOM 952 OE2 GLU A 81 21.281 -1.597 9.929 1.00 0.58 O ATOM 0 H GLU A 81 17.597 -5.328 8.098 1.00 0.18 H new ATOM 0 HA GLU A 81 16.847 -2.507 7.587 1.00 0.20 H new ATOM 0 HB2 GLU A 81 19.685 -3.575 7.150 1.00 0.22 H new ATOM 0 HB3 GLU A 81 19.121 -1.961 6.766 1.00 0.22 H new ATOM 0 HG2 GLU A 81 18.493 -1.718 9.263 1.00 0.32 H new ATOM 0 HG3 GLU A 81 19.363 -3.213 9.543 1.00 0.32 H new ATOM 959 N GLU A 82 18.030 -4.838 5.552 1.00 0.19 N ATOM 960 CA GLU A 82 17.833 -5.391 4.179 1.00 0.21 C ATOM 961 C GLU A 82 16.572 -6.258 4.114 1.00 0.21 C ATOM 962 O GLU A 82 16.022 -6.480 3.053 1.00 0.25 O ATOM 963 CB GLU A 82 19.047 -6.241 3.799 1.00 0.22 C ATOM 964 CG GLU A 82 18.988 -6.578 2.308 1.00 0.47 C ATOM 965 CD GLU A 82 19.027 -8.095 2.125 1.00 0.85 C ATOM 966 OE1 GLU A 82 18.336 -8.781 2.861 1.00 1.26 O ATOM 967 OE2 GLU A 82 19.750 -8.548 1.252 1.00 1.01 O ATOM 0 H GLU A 82 18.771 -5.281 6.095 1.00 0.19 H new ATOM 0 HA GLU A 82 17.720 -4.560 3.483 1.00 0.21 H new ATOM 0 HB2 GLU A 82 19.967 -5.701 4.025 1.00 0.22 H new ATOM 0 HB3 GLU A 82 19.062 -7.157 4.389 1.00 0.22 H new ATOM 0 HG2 GLU A 82 18.077 -6.172 1.868 1.00 0.47 H new ATOM 0 HG3 GLU A 82 19.827 -6.117 1.787 1.00 0.47 H new ATOM 974 N THR A 83 16.105 -6.755 5.227 1.00 0.18 N ATOM 975 CA THR A 83 14.885 -7.608 5.192 1.00 0.19 C ATOM 976 C THR A 83 13.644 -6.722 5.198 1.00 0.18 C ATOM 977 O THR A 83 12.664 -7.011 4.542 1.00 0.20 O ATOM 978 CB THR A 83 14.857 -8.531 6.408 1.00 0.23 C ATOM 979 OG1 THR A 83 16.130 -9.143 6.570 1.00 0.12 O ATOM 980 CG2 THR A 83 13.791 -9.607 6.197 1.00 0.43 C ATOM 0 H THR A 83 16.512 -6.609 6.151 1.00 0.18 H new ATOM 0 HA THR A 83 14.899 -8.213 4.285 1.00 0.19 H new ATOM 0 HB THR A 83 14.621 -7.954 7.302 1.00 0.23 H new ATOM 0 HG1 THR A 83 16.112 -9.734 7.352 1.00 0.12 H new ATOM 0 HG21 THR A 83 13.766 -10.269 7.062 1.00 0.43 H new ATOM 0 HG22 THR A 83 12.816 -9.135 6.074 1.00 0.43 H new ATOM 0 HG23 THR A 83 14.029 -10.185 5.304 1.00 0.43 H new ATOM 988 N CYS A 84 13.673 -5.643 5.928 1.00 0.17 N ATOM 989 CA CYS A 84 12.490 -4.747 5.960 1.00 0.17 C ATOM 990 C CYS A 84 12.382 -4.030 4.618 1.00 0.13 C ATOM 991 O CYS A 84 11.317 -3.907 4.044 1.00 0.06 O ATOM 992 CB CYS A 84 12.650 -3.715 7.077 1.00 0.19 C ATOM 993 SG CYS A 84 11.037 -2.994 7.467 1.00 0.66 S ATOM 0 H CYS A 84 14.463 -5.345 6.501 1.00 0.17 H new ATOM 0 HA CYS A 84 11.590 -5.333 6.145 1.00 0.17 H new ATOM 0 HB2 CYS A 84 13.074 -4.186 7.964 1.00 0.19 H new ATOM 0 HB3 CYS A 84 13.345 -2.934 6.768 1.00 0.19 H new ATOM 998 N LEU A 85 13.486 -3.562 4.112 1.00 0.19 N ATOM 999 CA LEU A 85 13.467 -2.857 2.805 1.00 0.17 C ATOM 1000 C LEU A 85 12.984 -3.822 1.721 1.00 0.15 C ATOM 1001 O LEU A 85 12.182 -3.471 0.879 1.00 0.10 O ATOM 1002 CB LEU A 85 14.879 -2.373 2.476 1.00 0.19 C ATOM 1003 CG LEU A 85 14.806 -1.235 1.460 1.00 0.13 C ATOM 1004 CD1 LEU A 85 14.336 0.041 2.162 1.00 0.46 C ATOM 1005 CD2 LEU A 85 16.192 -1.002 0.856 1.00 0.16 C ATOM 0 H LEU A 85 14.404 -3.638 4.550 1.00 0.19 H new ATOM 0 HA LEU A 85 12.794 -2.001 2.853 1.00 0.17 H new ATOM 0 HB2 LEU A 85 15.378 -2.033 3.383 1.00 0.19 H new ATOM 0 HB3 LEU A 85 15.472 -3.195 2.075 1.00 0.19 H new ATOM 0 HG LEU A 85 14.104 -1.497 0.668 1.00 0.13 H new ATOM 0 HD11 LEU A 85 14.283 0.855 1.439 1.00 0.46 H new ATOM 0 HD12 LEU A 85 13.350 -0.124 2.595 1.00 0.46 H new ATOM 0 HD13 LEU A 85 15.040 0.302 2.952 1.00 0.46 H new ATOM 0 HD21 LEU A 85 16.141 -0.190 0.131 1.00 0.16 H new ATOM 0 HD22 LEU A 85 16.894 -0.738 1.647 1.00 0.16 H new ATOM 0 HD23 LEU A 85 16.530 -1.911 0.359 1.00 0.16 H new ATOM 1017 N VAL A 86 13.457 -5.040 1.735 1.00 0.19 N ATOM 1018 CA VAL A 86 13.007 -6.016 0.704 1.00 0.18 C ATOM 1019 C VAL A 86 11.486 -6.163 0.799 1.00 0.14 C ATOM 1020 O VAL A 86 10.793 -6.074 -0.184 1.00 0.11 O ATOM 1021 CB VAL A 86 13.720 -7.372 0.935 1.00 0.24 C ATOM 1022 CG1 VAL A 86 12.828 -8.561 0.543 1.00 0.35 C ATOM 1023 CG2 VAL A 86 14.982 -7.417 0.075 1.00 0.74 C ATOM 0 H VAL A 86 14.131 -5.398 2.412 1.00 0.19 H new ATOM 0 HA VAL A 86 13.263 -5.666 -0.296 1.00 0.18 H new ATOM 0 HB VAL A 86 13.955 -7.451 1.996 1.00 0.24 H new ATOM 0 HG11 VAL A 86 13.365 -9.493 0.720 1.00 0.35 H new ATOM 0 HG12 VAL A 86 11.918 -8.547 1.143 1.00 0.35 H new ATOM 0 HG13 VAL A 86 12.567 -8.488 -0.513 1.00 0.35 H new ATOM 0 HG21 VAL A 86 15.493 -8.367 0.229 1.00 0.74 H new ATOM 0 HG22 VAL A 86 14.710 -7.317 -0.976 1.00 0.74 H new ATOM 0 HG23 VAL A 86 15.644 -6.599 0.358 1.00 0.74 H new ATOM 1033 N LYS A 87 10.969 -6.399 1.971 1.00 0.17 N ATOM 1034 CA LYS A 87 9.496 -6.563 2.113 1.00 0.15 C ATOM 1035 C LYS A 87 8.781 -5.297 1.632 1.00 0.11 C ATOM 1036 O LYS A 87 7.622 -5.331 1.269 1.00 0.09 O ATOM 1037 CB LYS A 87 9.152 -6.824 3.581 1.00 0.19 C ATOM 1038 CG LYS A 87 9.787 -8.145 4.024 1.00 1.15 C ATOM 1039 CD LYS A 87 8.692 -9.119 4.469 1.00 1.02 C ATOM 1040 CE LYS A 87 8.926 -10.487 3.820 1.00 1.04 C ATOM 1041 NZ LYS A 87 8.413 -10.473 2.418 1.00 1.65 N ATOM 0 H LYS A 87 11.502 -6.485 2.836 1.00 0.17 H new ATOM 0 HA LYS A 87 9.168 -7.408 1.507 1.00 0.15 H new ATOM 0 HB2 LYS A 87 9.516 -6.006 4.202 1.00 0.19 H new ATOM 0 HB3 LYS A 87 8.071 -6.866 3.711 1.00 0.19 H new ATOM 0 HG2 LYS A 87 10.361 -8.577 3.204 1.00 1.15 H new ATOM 0 HG3 LYS A 87 10.485 -7.968 4.843 1.00 1.15 H new ATOM 0 HD2 LYS A 87 8.696 -9.215 5.555 1.00 1.02 H new ATOM 0 HD3 LYS A 87 7.712 -8.734 4.187 1.00 1.02 H new ATOM 0 HE2 LYS A 87 9.989 -10.726 3.826 1.00 1.04 H new ATOM 0 HE3 LYS A 87 8.421 -11.264 4.394 1.00 1.04 H new ATOM 0 HZ1 LYS A 87 8.573 -11.403 1.980 1.00 1.65 H new ATOM 0 HZ2 LYS A 87 7.394 -10.264 2.423 1.00 1.65 H new ATOM 0 HZ3 LYS A 87 8.914 -9.743 1.872 1.00 1.65 H new ATOM 1055 N ILE A 88 9.455 -4.178 1.627 1.00 0.15 N ATOM 1056 CA ILE A 88 8.798 -2.918 1.170 1.00 0.09 C ATOM 1057 C ILE A 88 8.720 -2.911 -0.367 1.00 0.09 C ATOM 1058 O ILE A 88 7.764 -2.437 -0.948 1.00 0.12 O ATOM 1059 CB ILE A 88 9.590 -1.705 1.724 1.00 0.08 C ATOM 1060 CG1 ILE A 88 8.601 -0.634 2.178 1.00 1.50 C ATOM 1061 CG2 ILE A 88 10.548 -1.101 0.682 1.00 1.64 C ATOM 1062 CD1 ILE A 88 8.312 -0.820 3.668 1.00 0.26 C ATOM 0 H ILE A 88 10.428 -4.081 1.918 1.00 0.15 H new ATOM 0 HA ILE A 88 7.778 -2.853 1.550 1.00 0.09 H new ATOM 0 HB ILE A 88 10.197 -2.058 2.558 1.00 0.08 H new ATOM 0 HG12 ILE A 88 9.012 0.359 1.996 1.00 1.50 H new ATOM 0 HG13 ILE A 88 7.677 -0.707 1.604 1.00 1.50 H new ATOM 0 HG21 ILE A 88 11.077 -0.255 1.121 1.00 1.64 H new ATOM 0 HG22 ILE A 88 11.268 -1.857 0.369 1.00 1.64 H new ATOM 0 HG23 ILE A 88 9.978 -0.762 -0.183 1.00 1.64 H new ATOM 0 HD11 ILE A 88 7.606 -0.058 4.000 1.00 0.26 H new ATOM 0 HD12 ILE A 88 7.884 -1.809 3.835 1.00 0.26 H new ATOM 0 HD13 ILE A 88 9.239 -0.726 4.233 1.00 0.26 H new ATOM 1074 N ILE A 89 9.708 -3.453 -1.021 1.00 0.13 N ATOM 1075 CA ILE A 89 9.683 -3.503 -2.510 1.00 0.17 C ATOM 1076 C ILE A 89 8.637 -4.527 -2.919 1.00 0.12 C ATOM 1077 O ILE A 89 7.915 -4.374 -3.886 1.00 0.44 O ATOM 1078 CB ILE A 89 11.043 -3.975 -3.014 1.00 0.24 C ATOM 1079 CG1 ILE A 89 12.153 -3.139 -2.370 1.00 0.09 C ATOM 1080 CG2 ILE A 89 11.107 -3.821 -4.534 1.00 0.41 C ATOM 1081 CD1 ILE A 89 13.516 -3.643 -2.850 1.00 0.77 C ATOM 0 H ILE A 89 10.535 -3.865 -0.588 1.00 0.13 H new ATOM 0 HA ILE A 89 9.455 -2.521 -2.924 1.00 0.17 H new ATOM 0 HB ILE A 89 11.180 -5.023 -2.747 1.00 0.24 H new ATOM 0 HG12 ILE A 89 12.029 -2.088 -2.631 1.00 0.09 H new ATOM 0 HG13 ILE A 89 12.090 -3.207 -1.284 1.00 0.09 H new ATOM 0 HG21 ILE A 89 12.079 -4.158 -4.893 1.00 0.41 H new ATOM 0 HG22 ILE A 89 10.322 -4.421 -4.994 1.00 0.41 H new ATOM 0 HG23 ILE A 89 10.966 -2.773 -4.800 1.00 0.41 H new ATOM 0 HD11 ILE A 89 14.306 -3.048 -2.392 1.00 0.77 H new ATOM 0 HD12 ILE A 89 13.638 -4.688 -2.566 1.00 0.77 H new ATOM 0 HD13 ILE A 89 13.576 -3.552 -3.935 1.00 0.77 H new ATOM 1093 N THR A 90 8.566 -5.572 -2.159 1.00 0.33 N ATOM 1094 CA THR A 90 7.598 -6.657 -2.420 1.00 0.39 C ATOM 1095 C THR A 90 6.202 -6.187 -1.998 1.00 0.31 C ATOM 1096 O THR A 90 5.199 -6.712 -2.439 1.00 0.34 O ATOM 1097 CB THR A 90 8.007 -7.879 -1.589 1.00 0.63 C ATOM 1098 OG1 THR A 90 9.359 -7.749 -1.171 1.00 1.66 O ATOM 1099 CG2 THR A 90 7.864 -9.148 -2.422 1.00 0.92 C ATOM 0 H THR A 90 9.158 -5.723 -1.342 1.00 0.33 H new ATOM 0 HA THR A 90 7.586 -6.917 -3.478 1.00 0.39 H new ATOM 0 HB THR A 90 7.357 -7.941 -0.716 1.00 0.63 H new ATOM 0 HG1 THR A 90 9.416 -7.089 -0.448 1.00 1.66 H new ATOM 0 HG21 THR A 90 8.157 -10.011 -1.824 1.00 0.92 H new ATOM 0 HG22 THR A 90 6.827 -9.261 -2.738 1.00 0.92 H new ATOM 0 HG23 THR A 90 8.506 -9.081 -3.300 1.00 0.92 H new ATOM 1107 N GLY A 91 6.136 -5.195 -1.148 1.00 0.35 N ATOM 1108 CA GLY A 91 4.815 -4.682 -0.694 1.00 0.41 C ATOM 1109 C GLY A 91 4.385 -3.508 -1.579 1.00 0.37 C ATOM 1110 O GLY A 91 3.234 -3.120 -1.591 1.00 0.57 O ATOM 0 H GLY A 91 6.945 -4.718 -0.749 1.00 0.35 H new ATOM 0 HA2 GLY A 91 4.070 -5.477 -0.740 1.00 0.41 H new ATOM 0 HA3 GLY A 91 4.876 -4.362 0.346 1.00 0.41 H new ATOM 1114 N LEU A 92 5.300 -2.932 -2.314 1.00 0.24 N ATOM 1115 CA LEU A 92 4.936 -1.779 -3.185 1.00 0.32 C ATOM 1116 C LEU A 92 4.424 -2.285 -4.540 1.00 0.33 C ATOM 1117 O LEU A 92 3.459 -1.773 -5.068 1.00 0.22 O ATOM 1118 CB LEU A 92 6.164 -0.892 -3.395 1.00 0.33 C ATOM 1119 CG LEU A 92 6.234 0.157 -2.284 1.00 0.41 C ATOM 1120 CD1 LEU A 92 7.563 0.911 -2.373 1.00 0.50 C ATOM 1121 CD2 LEU A 92 5.077 1.146 -2.444 1.00 0.45 C ATOM 0 H LEU A 92 6.281 -3.210 -2.348 1.00 0.24 H new ATOM 0 HA LEU A 92 4.148 -1.201 -2.703 1.00 0.32 H new ATOM 0 HB2 LEU A 92 7.069 -1.500 -3.393 1.00 0.33 H new ATOM 0 HB3 LEU A 92 6.110 -0.403 -4.368 1.00 0.33 H new ATOM 0 HG LEU A 92 6.161 -0.337 -1.315 1.00 0.41 H new ATOM 0 HD11 LEU A 92 7.611 1.658 -1.581 1.00 0.50 H new ATOM 0 HD12 LEU A 92 8.388 0.208 -2.260 1.00 0.50 H new ATOM 0 HD13 LEU A 92 7.637 1.405 -3.342 1.00 0.50 H new ATOM 0 HD21 LEU A 92 5.126 1.894 -1.653 1.00 0.45 H new ATOM 0 HD22 LEU A 92 5.151 1.638 -3.414 1.00 0.45 H new ATOM 0 HD23 LEU A 92 4.130 0.611 -2.380 1.00 0.45 H new ATOM 1133 N LEU A 93 5.051 -3.287 -5.110 1.00 0.49 N ATOM 1134 CA LEU A 93 4.564 -3.804 -6.427 1.00 0.51 C ATOM 1135 C LEU A 93 3.156 -4.371 -6.231 1.00 0.46 C ATOM 1136 O LEU A 93 2.236 -4.079 -6.980 1.00 0.42 O ATOM 1137 CB LEU A 93 5.501 -4.902 -6.947 1.00 0.63 C ATOM 1138 CG LEU A 93 6.939 -4.378 -6.980 1.00 0.51 C ATOM 1139 CD1 LEU A 93 7.902 -5.549 -7.177 1.00 0.84 C ATOM 1140 CD2 LEU A 93 7.097 -3.391 -8.140 1.00 1.04 C ATOM 0 H LEU A 93 5.867 -3.763 -4.726 1.00 0.49 H new ATOM 0 HA LEU A 93 4.546 -2.995 -7.158 1.00 0.51 H new ATOM 0 HB2 LEU A 93 5.438 -5.781 -6.306 1.00 0.63 H new ATOM 0 HB3 LEU A 93 5.194 -5.213 -7.945 1.00 0.63 H new ATOM 0 HG LEU A 93 7.163 -3.874 -6.040 1.00 0.51 H new ATOM 0 HD11 LEU A 93 8.926 -5.178 -7.201 1.00 0.84 H new ATOM 0 HD12 LEU A 93 7.791 -6.254 -6.353 1.00 0.84 H new ATOM 0 HD13 LEU A 93 7.676 -6.051 -8.118 1.00 0.84 H new ATOM 0 HD21 LEU A 93 8.121 -3.018 -8.163 1.00 1.04 H new ATOM 0 HD22 LEU A 93 6.873 -3.895 -9.080 1.00 1.04 H new ATOM 0 HD23 LEU A 93 6.410 -2.556 -8.004 1.00 1.04 H new ATOM 1152 N GLU A 94 2.968 -5.155 -5.205 1.00 0.48 N ATOM 1153 CA GLU A 94 1.612 -5.699 -4.942 1.00 0.44 C ATOM 1154 C GLU A 94 0.709 -4.509 -4.639 1.00 0.43 C ATOM 1155 O GLU A 94 -0.394 -4.404 -5.125 1.00 0.44 O ATOM 1156 CB GLU A 94 1.654 -6.645 -3.739 1.00 0.46 C ATOM 1157 CG GLU A 94 1.065 -8.000 -4.136 1.00 0.67 C ATOM 1158 CD GLU A 94 1.370 -9.029 -3.047 1.00 0.54 C ATOM 1159 OE1 GLU A 94 0.869 -8.864 -1.947 1.00 1.14 O ATOM 1160 OE2 GLU A 94 2.100 -9.965 -3.331 1.00 1.35 O ATOM 0 H GLU A 94 3.691 -5.439 -4.544 1.00 0.48 H new ATOM 0 HA GLU A 94 1.242 -6.261 -5.799 1.00 0.44 H new ATOM 0 HB2 GLU A 94 2.681 -6.769 -3.396 1.00 0.46 H new ATOM 0 HB3 GLU A 94 1.090 -6.220 -2.909 1.00 0.46 H new ATOM 0 HG2 GLU A 94 -0.012 -7.913 -4.277 1.00 0.67 H new ATOM 0 HG3 GLU A 94 1.485 -8.326 -5.087 1.00 0.67 H new ATOM 1167 N PHE A 95 1.199 -3.586 -3.858 1.00 0.42 N ATOM 1168 CA PHE A 95 0.402 -2.370 -3.540 1.00 0.41 C ATOM 1169 C PHE A 95 -0.045 -1.719 -4.849 1.00 0.36 C ATOM 1170 O PHE A 95 -1.059 -1.060 -4.913 1.00 0.35 O ATOM 1171 CB PHE A 95 1.291 -1.384 -2.776 1.00 0.49 C ATOM 1172 CG PHE A 95 1.033 -1.460 -1.286 1.00 0.61 C ATOM 1173 CD1 PHE A 95 0.533 -2.634 -0.703 1.00 0.42 C ATOM 1174 CD2 PHE A 95 1.310 -0.348 -0.485 1.00 1.06 C ATOM 1175 CE1 PHE A 95 0.309 -2.689 0.675 1.00 0.50 C ATOM 1176 CE2 PHE A 95 1.090 -0.404 0.893 1.00 1.21 C ATOM 1177 CZ PHE A 95 0.588 -1.574 1.475 1.00 0.88 C ATOM 0 H PHE A 95 2.122 -3.623 -3.425 1.00 0.42 H new ATOM 0 HA PHE A 95 -0.467 -2.636 -2.938 1.00 0.41 H new ATOM 0 HB2 PHE A 95 2.339 -1.603 -2.978 1.00 0.49 H new ATOM 0 HB3 PHE A 95 1.103 -0.370 -3.130 1.00 0.49 H new ATOM 0 HD1 PHE A 95 0.321 -3.495 -1.319 1.00 0.42 H new ATOM 0 HD2 PHE A 95 1.695 0.556 -0.933 1.00 1.06 H new ATOM 0 HE1 PHE A 95 -0.079 -3.592 1.123 1.00 0.50 H new ATOM 0 HE2 PHE A 95 1.307 0.456 1.510 1.00 1.21 H new ATOM 0 HZ PHE A 95 0.416 -1.617 2.540 1.00 0.88 H new ATOM 1187 N GLU A 96 0.723 -1.902 -5.888 1.00 0.35 N ATOM 1188 CA GLU A 96 0.379 -1.302 -7.206 1.00 0.34 C ATOM 1189 C GLU A 96 -0.851 -1.993 -7.788 1.00 0.26 C ATOM 1190 O GLU A 96 -1.751 -1.349 -8.283 1.00 0.26 O ATOM 1191 CB GLU A 96 1.554 -1.473 -8.159 1.00 0.40 C ATOM 1192 CG GLU A 96 1.996 -0.110 -8.681 1.00 0.84 C ATOM 1193 CD GLU A 96 0.829 0.563 -9.409 1.00 1.52 C ATOM 1194 OE1 GLU A 96 0.471 0.091 -10.476 1.00 1.59 O ATOM 1195 OE2 GLU A 96 0.315 1.538 -8.887 1.00 2.31 O ATOM 0 H GLU A 96 1.584 -2.448 -5.878 1.00 0.35 H new ATOM 0 HA GLU A 96 0.163 -0.242 -7.073 1.00 0.34 H new ATOM 0 HB2 GLU A 96 2.382 -1.963 -7.646 1.00 0.40 H new ATOM 0 HB3 GLU A 96 1.269 -2.117 -8.991 1.00 0.40 H new ATOM 0 HG2 GLU A 96 2.332 0.516 -7.854 1.00 0.84 H new ATOM 0 HG3 GLU A 96 2.842 -0.225 -9.358 1.00 0.84 H new ATOM 1202 N VAL A 97 -0.906 -3.297 -7.747 1.00 0.27 N ATOM 1203 CA VAL A 97 -2.113 -3.976 -8.308 1.00 0.26 C ATOM 1204 C VAL A 97 -3.340 -3.513 -7.509 1.00 0.26 C ATOM 1205 O VAL A 97 -4.400 -3.270 -8.058 1.00 0.28 O ATOM 1206 CB VAL A 97 -1.964 -5.508 -8.248 1.00 0.31 C ATOM 1207 CG1 VAL A 97 -1.639 -5.977 -6.835 1.00 0.72 C ATOM 1208 CG2 VAL A 97 -3.268 -6.162 -8.683 1.00 0.20 C ATOM 0 H VAL A 97 -0.188 -3.910 -7.360 1.00 0.27 H new ATOM 0 HA VAL A 97 -2.232 -3.708 -9.358 1.00 0.26 H new ATOM 0 HB VAL A 97 -1.148 -5.792 -8.912 1.00 0.31 H new ATOM 0 HG11 VAL A 97 -1.540 -7.062 -6.826 1.00 0.72 H new ATOM 0 HG12 VAL A 97 -0.703 -5.524 -6.508 1.00 0.72 H new ATOM 0 HG13 VAL A 97 -2.441 -5.680 -6.159 1.00 0.72 H new ATOM 0 HG21 VAL A 97 -3.163 -7.246 -8.641 1.00 0.20 H new ATOM 0 HG22 VAL A 97 -4.072 -5.849 -8.017 1.00 0.20 H new ATOM 0 HG23 VAL A 97 -3.504 -5.860 -9.703 1.00 0.20 H new ATOM 1218 N TYR A 98 -3.193 -3.340 -6.221 1.00 0.25 N ATOM 1219 CA TYR A 98 -4.338 -2.848 -5.406 1.00 0.27 C ATOM 1220 C TYR A 98 -4.528 -1.361 -5.718 1.00 0.23 C ATOM 1221 O TYR A 98 -5.606 -0.812 -5.582 1.00 0.24 O ATOM 1222 CB TYR A 98 -4.036 -3.048 -3.919 1.00 0.29 C ATOM 1223 CG TYR A 98 -3.721 -4.505 -3.679 1.00 0.50 C ATOM 1224 CD1 TYR A 98 -4.744 -5.460 -3.725 1.00 0.77 C ATOM 1225 CD2 TYR A 98 -2.405 -4.902 -3.425 1.00 0.58 C ATOM 1226 CE1 TYR A 98 -4.449 -6.813 -3.515 1.00 1.01 C ATOM 1227 CE2 TYR A 98 -2.109 -6.255 -3.215 1.00 0.86 C ATOM 1228 CZ TYR A 98 -3.130 -7.210 -3.261 1.00 1.05 C ATOM 1229 OH TYR A 98 -2.837 -8.544 -3.055 1.00 1.34 O ATOM 0 H TYR A 98 -2.333 -3.518 -5.702 1.00 0.25 H new ATOM 0 HA TYR A 98 -5.248 -3.399 -5.644 1.00 0.27 H new ATOM 0 HB2 TYR A 98 -3.194 -2.425 -3.618 1.00 0.29 H new ATOM 0 HB3 TYR A 98 -4.891 -2.742 -3.316 1.00 0.29 H new ATOM 0 HD1 TYR A 98 -5.761 -5.153 -3.922 1.00 0.77 H new ATOM 0 HD2 TYR A 98 -1.616 -4.165 -3.391 1.00 0.58 H new ATOM 0 HE1 TYR A 98 -5.238 -7.550 -3.549 1.00 1.01 H new ATOM 0 HE2 TYR A 98 -1.092 -6.561 -3.018 1.00 0.86 H new ATOM 0 HH TYR A 98 -2.087 -8.621 -2.429 1.00 1.34 H new ATOM 1239 N LEU A 99 -3.488 -0.719 -6.194 1.00 0.19 N ATOM 1240 CA LEU A 99 -3.602 0.709 -6.579 1.00 0.16 C ATOM 1241 C LEU A 99 -4.458 0.750 -7.837 1.00 0.14 C ATOM 1242 O LEU A 99 -5.163 1.702 -8.099 1.00 0.11 O ATOM 1243 CB LEU A 99 -2.215 1.291 -6.874 1.00 0.22 C ATOM 1244 CG LEU A 99 -1.589 1.810 -5.583 1.00 0.35 C ATOM 1245 CD1 LEU A 99 -0.154 2.263 -5.852 1.00 0.56 C ATOM 1246 CD2 LEU A 99 -2.404 2.992 -5.076 1.00 0.56 C ATOM 0 H LEU A 99 -2.565 -1.131 -6.330 1.00 0.19 H new ATOM 0 HA LEU A 99 -4.046 1.297 -5.776 1.00 0.16 H new ATOM 0 HB2 LEU A 99 -1.576 0.527 -7.317 1.00 0.22 H new ATOM 0 HB3 LEU A 99 -2.296 2.099 -7.601 1.00 0.22 H new ATOM 0 HG LEU A 99 -1.582 1.016 -4.836 1.00 0.35 H new ATOM 0 HD11 LEU A 99 0.290 2.633 -4.928 1.00 0.56 H new ATOM 0 HD12 LEU A 99 0.430 1.421 -6.223 1.00 0.56 H new ATOM 0 HD13 LEU A 99 -0.157 3.059 -6.597 1.00 0.56 H new ATOM 0 HD21 LEU A 99 -1.963 3.369 -4.153 1.00 0.56 H new ATOM 0 HD22 LEU A 99 -2.405 3.782 -5.827 1.00 0.56 H new ATOM 0 HD23 LEU A 99 -3.428 2.672 -4.884 1.00 0.56 H new ATOM 1258 N GLU A 100 -4.429 -0.318 -8.594 1.00 0.17 N ATOM 1259 CA GLU A 100 -5.262 -0.407 -9.806 1.00 0.18 C ATOM 1260 C GLU A 100 -6.700 -0.474 -9.322 1.00 0.21 C ATOM 1261 O GLU A 100 -7.606 0.095 -9.899 1.00 0.22 O ATOM 1262 CB GLU A 100 -4.911 -1.696 -10.550 1.00 0.19 C ATOM 1263 CG GLU A 100 -4.899 -1.447 -12.057 1.00 0.22 C ATOM 1264 CD GLU A 100 -6.333 -1.278 -12.561 1.00 0.78 C ATOM 1265 OE1 GLU A 100 -6.982 -2.285 -12.792 1.00 1.55 O ATOM 1266 OE2 GLU A 100 -6.760 -0.144 -12.707 1.00 0.99 O ATOM 0 H GLU A 100 -3.851 -1.138 -8.411 1.00 0.17 H new ATOM 0 HA GLU A 100 -5.107 0.439 -10.476 1.00 0.18 H new ATOM 0 HB2 GLU A 100 -3.935 -2.058 -10.226 1.00 0.19 H new ATOM 0 HB3 GLU A 100 -5.636 -2.473 -10.308 1.00 0.19 H new ATOM 0 HG2 GLU A 100 -4.316 -0.554 -12.284 1.00 0.22 H new ATOM 0 HG3 GLU A 100 -4.419 -2.280 -12.570 1.00 0.22 H new ATOM 1273 N TYR A 101 -6.895 -1.169 -8.236 1.00 0.28 N ATOM 1274 CA TYR A 101 -8.249 -1.296 -7.648 1.00 0.38 C ATOM 1275 C TYR A 101 -8.820 0.083 -7.371 1.00 0.46 C ATOM 1276 O TYR A 101 -9.978 0.350 -7.615 1.00 0.62 O ATOM 1277 CB TYR A 101 -8.155 -2.070 -6.332 1.00 0.44 C ATOM 1278 CG TYR A 101 -9.437 -2.825 -6.110 1.00 0.27 C ATOM 1279 CD1 TYR A 101 -9.858 -3.767 -7.051 1.00 0.43 C ATOM 1280 CD2 TYR A 101 -10.209 -2.576 -4.971 1.00 0.10 C ATOM 1281 CE1 TYR A 101 -11.055 -4.465 -6.856 1.00 0.51 C ATOM 1282 CE2 TYR A 101 -11.405 -3.274 -4.774 1.00 0.30 C ATOM 1283 CZ TYR A 101 -11.829 -4.219 -5.717 1.00 0.48 C ATOM 1284 OH TYR A 101 -13.010 -4.906 -5.523 1.00 0.69 O ATOM 0 H TYR A 101 -6.160 -1.660 -7.727 1.00 0.28 H new ATOM 0 HA TYR A 101 -8.897 -1.824 -8.347 1.00 0.38 H new ATOM 0 HB2 TYR A 101 -7.313 -2.761 -6.362 1.00 0.44 H new ATOM 0 HB3 TYR A 101 -7.975 -1.384 -5.505 1.00 0.44 H new ATOM 0 HD1 TYR A 101 -9.259 -3.957 -7.930 1.00 0.43 H new ATOM 0 HD2 TYR A 101 -9.882 -1.846 -4.245 1.00 0.10 H new ATOM 0 HE1 TYR A 101 -11.381 -5.193 -7.584 1.00 0.51 H new ATOM 0 HE2 TYR A 101 -12.002 -3.084 -3.894 1.00 0.30 H new ATOM 0 HH TYR A 101 -13.423 -4.616 -4.683 1.00 0.69 H new ATOM 1294 N LEU A 102 -8.024 0.950 -6.838 1.00 0.40 N ATOM 1295 CA LEU A 102 -8.524 2.310 -6.509 1.00 0.50 C ATOM 1296 C LEU A 102 -8.309 3.260 -7.689 1.00 0.70 C ATOM 1297 O LEU A 102 -8.791 4.374 -7.690 1.00 1.16 O ATOM 1298 CB LEU A 102 -7.773 2.822 -5.284 1.00 0.39 C ATOM 1299 CG LEU A 102 -7.738 1.723 -4.217 1.00 0.32 C ATOM 1300 CD1 LEU A 102 -6.346 1.654 -3.600 1.00 0.32 C ATOM 1301 CD2 LEU A 102 -8.771 2.036 -3.142 1.00 0.40 C ATOM 0 H LEU A 102 -7.044 0.780 -6.613 1.00 0.40 H new ATOM 0 HA LEU A 102 -9.593 2.265 -6.300 1.00 0.50 H new ATOM 0 HB2 LEU A 102 -6.758 3.110 -5.559 1.00 0.39 H new ATOM 0 HB3 LEU A 102 -8.262 3.713 -4.889 1.00 0.39 H new ATOM 0 HG LEU A 102 -7.971 0.760 -4.671 1.00 0.32 H new ATOM 0 HD11 LEU A 102 -6.323 0.872 -2.841 1.00 0.32 H new ATOM 0 HD12 LEU A 102 -5.615 1.428 -4.376 1.00 0.32 H new ATOM 0 HD13 LEU A 102 -6.104 2.612 -3.141 1.00 0.32 H new ATOM 0 HD21 LEU A 102 -8.751 1.257 -2.380 1.00 0.40 H new ATOM 0 HD22 LEU A 102 -8.540 2.998 -2.684 1.00 0.40 H new ATOM 0 HD23 LEU A 102 -9.763 2.078 -3.592 1.00 0.40 H new ATOM 1313 N GLN A 103 -7.598 2.833 -8.695 1.00 0.43 N ATOM 1314 CA GLN A 103 -7.367 3.721 -9.865 1.00 0.67 C ATOM 1315 C GLN A 103 -8.649 3.815 -10.695 1.00 0.89 C ATOM 1316 O GLN A 103 -8.808 4.702 -11.510 1.00 1.08 O ATOM 1317 CB GLN A 103 -6.251 3.140 -10.732 1.00 0.63 C ATOM 1318 CG GLN A 103 -5.475 4.277 -11.400 1.00 0.53 C ATOM 1319 CD GLN A 103 -4.749 3.743 -12.635 1.00 0.39 C ATOM 1320 OE1 GLN A 103 -4.157 2.684 -12.595 1.00 0.57 O ATOM 1321 NE2 GLN A 103 -4.770 4.437 -13.741 1.00 1.25 N ATOM 0 H GLN A 103 -7.168 1.910 -8.757 1.00 0.43 H new ATOM 0 HA GLN A 103 -7.082 4.713 -9.515 1.00 0.67 H new ATOM 0 HB2 GLN A 103 -5.579 2.537 -10.121 1.00 0.63 H new ATOM 0 HB3 GLN A 103 -6.672 2.479 -11.490 1.00 0.63 H new ATOM 0 HG2 GLN A 103 -6.157 5.079 -11.684 1.00 0.53 H new ATOM 0 HG3 GLN A 103 -4.757 4.703 -10.699 1.00 0.53 H new ATOM 0 HE21 GLN A 103 -5.267 5.327 -13.775 1.00 1.25 H new ATOM 0 HE22 GLN A 103 -4.289 4.089 -14.571 1.00 1.25 H new ATOM 1330 N ASN A 104 -9.561 2.897 -10.509 1.00 0.97 N ATOM 1331 CA ASN A 104 -10.818 2.928 -11.305 1.00 1.25 C ATOM 1332 C ASN A 104 -12.040 2.977 -10.379 1.00 1.18 C ATOM 1333 O ASN A 104 -13.127 3.320 -10.797 1.00 1.49 O ATOM 1334 CB ASN A 104 -10.883 1.669 -12.171 1.00 1.48 C ATOM 1335 CG ASN A 104 -10.568 0.441 -11.316 1.00 3.91 C ATOM 1336 OD1 ASN A 104 -10.821 0.432 -10.128 1.00 5.35 O ATOM 1337 ND2 ASN A 104 -10.022 -0.604 -11.874 1.00 4.79 N ATOM 0 H ASN A 104 -9.488 2.130 -9.841 1.00 0.97 H new ATOM 0 HA ASN A 104 -10.824 3.819 -11.933 1.00 1.25 H new ATOM 0 HB2 ASN A 104 -11.874 1.571 -12.614 1.00 1.48 H new ATOM 0 HB3 ASN A 104 -10.172 1.744 -12.993 1.00 1.48 H new ATOM 0 HD21 ASN A 104 -9.808 -1.428 -11.313 1.00 4.79 H new ATOM 0 HD22 ASN A 104 -9.809 -0.597 -12.872 1.00 4.79 H new ATOM 1344 N ARG A 105 -11.881 2.632 -9.129 1.00 0.88 N ATOM 1345 CA ARG A 105 -13.047 2.660 -8.198 1.00 0.89 C ATOM 1346 C ARG A 105 -13.382 4.107 -7.827 1.00 0.75 C ATOM 1347 O ARG A 105 -14.479 4.409 -7.402 1.00 0.89 O ATOM 1348 CB ARG A 105 -12.712 1.877 -6.928 1.00 0.87 C ATOM 1349 CG ARG A 105 -13.682 0.705 -6.775 1.00 1.04 C ATOM 1350 CD ARG A 105 -12.947 -0.610 -7.042 1.00 1.89 C ATOM 1351 NE ARG A 105 -13.802 -1.495 -7.883 1.00 2.46 N ATOM 1352 CZ ARG A 105 -13.772 -1.386 -9.183 1.00 3.45 C ATOM 1353 NH1 ARG A 105 -12.728 -1.796 -9.850 1.00 5.07 N ATOM 1354 NH2 ARG A 105 -14.789 -0.868 -9.817 1.00 3.31 N ATOM 0 H ARG A 105 -10.999 2.333 -8.714 1.00 0.88 H new ATOM 0 HA ARG A 105 -13.906 2.205 -8.691 1.00 0.89 H new ATOM 0 HB2 ARG A 105 -11.687 1.510 -6.975 1.00 0.87 H new ATOM 0 HB3 ARG A 105 -12.776 2.531 -6.058 1.00 0.87 H new ATOM 0 HG2 ARG A 105 -14.105 0.699 -5.770 1.00 1.04 H new ATOM 0 HG3 ARG A 105 -14.514 0.816 -7.470 1.00 1.04 H new ATOM 0 HD2 ARG A 105 -12.001 -0.414 -7.547 1.00 1.89 H new ATOM 0 HD3 ARG A 105 -12.710 -1.104 -6.100 1.00 1.89 H new ATOM 0 HE ARG A 105 -14.410 -2.185 -7.443 1.00 2.46 H new ATOM 0 HH11 ARG A 105 -11.934 -2.202 -9.355 1.00 5.07 H new ATOM 0 HH12 ARG A 105 -12.706 -1.710 -10.866 1.00 5.07 H new ATOM 0 HH21 ARG A 105 -15.606 -0.549 -9.296 1.00 3.31 H new ATOM 0 HH22 ARG A 105 -14.767 -0.782 -10.833 1.00 3.31 H new ATOM 1368 N PHE A 106 -12.446 5.003 -7.979 1.00 0.53 N ATOM 1369 CA PHE A 106 -12.717 6.426 -7.628 1.00 0.43 C ATOM 1370 C PHE A 106 -13.315 7.150 -8.836 1.00 0.66 C ATOM 1371 O PHE A 106 -12.721 8.056 -9.385 1.00 0.73 O ATOM 1372 CB PHE A 106 -11.411 7.108 -7.218 1.00 0.34 C ATOM 1373 CG PHE A 106 -11.307 7.130 -5.712 1.00 0.21 C ATOM 1374 CD1 PHE A 106 -12.092 8.019 -4.968 1.00 0.88 C ATOM 1375 CD2 PHE A 106 -10.424 6.261 -5.059 1.00 0.42 C ATOM 1376 CE1 PHE A 106 -11.994 8.039 -3.571 1.00 1.08 C ATOM 1377 CE2 PHE A 106 -10.328 6.282 -3.662 1.00 0.37 C ATOM 1378 CZ PHE A 106 -11.112 7.170 -2.919 1.00 0.63 C ATOM 0 H PHE A 106 -11.508 4.812 -8.330 1.00 0.53 H new ATOM 0 HA PHE A 106 -13.423 6.465 -6.799 1.00 0.43 H new ATOM 0 HB2 PHE A 106 -10.561 6.576 -7.644 1.00 0.34 H new ATOM 0 HB3 PHE A 106 -11.380 8.124 -7.610 1.00 0.34 H new ATOM 0 HD1 PHE A 106 -12.773 8.689 -5.471 1.00 0.88 H new ATOM 0 HD2 PHE A 106 -9.818 5.575 -5.632 1.00 0.42 H new ATOM 0 HE1 PHE A 106 -12.599 8.725 -2.997 1.00 1.08 H new ATOM 0 HE2 PHE A 106 -9.648 5.612 -3.158 1.00 0.37 H new ATOM 0 HZ PHE A 106 -11.037 7.185 -1.842 1.00 0.63 H new ATOM 1388 N GLU A 107 -14.487 6.760 -9.251 1.00 0.93 N ATOM 1389 CA GLU A 107 -15.125 7.431 -10.420 1.00 1.17 C ATOM 1390 C GLU A 107 -15.481 8.873 -10.050 1.00 1.16 C ATOM 1391 O GLU A 107 -15.641 9.723 -10.905 1.00 1.30 O ATOM 1392 CB GLU A 107 -16.398 6.677 -10.806 1.00 1.31 C ATOM 1393 CG GLU A 107 -17.376 6.680 -9.627 1.00 1.80 C ATOM 1394 CD GLU A 107 -18.533 5.726 -9.924 1.00 2.59 C ATOM 1395 OE1 GLU A 107 -18.998 5.722 -11.053 1.00 2.23 O ATOM 1396 OE2 GLU A 107 -18.937 5.015 -9.018 1.00 3.71 O ATOM 0 H GLU A 107 -15.032 6.006 -8.832 1.00 0.93 H new ATOM 0 HA GLU A 107 -14.432 7.432 -11.261 1.00 1.17 H new ATOM 0 HB2 GLU A 107 -16.860 7.145 -11.676 1.00 1.31 H new ATOM 0 HB3 GLU A 107 -16.155 5.652 -11.087 1.00 1.31 H new ATOM 0 HG2 GLU A 107 -16.864 6.375 -8.715 1.00 1.80 H new ATOM 0 HG3 GLU A 107 -17.755 7.688 -9.458 1.00 1.80 H new ATOM 1403 N SER A 108 -15.601 9.158 -8.782 1.00 1.00 N ATOM 1404 CA SER A 108 -15.940 10.544 -8.355 1.00 1.00 C ATOM 1405 C SER A 108 -14.643 11.317 -8.131 1.00 0.99 C ATOM 1406 O SER A 108 -14.480 12.434 -8.581 1.00 1.13 O ATOM 1407 CB SER A 108 -16.739 10.497 -7.053 1.00 0.85 C ATOM 1408 OG SER A 108 -15.848 10.316 -5.960 1.00 1.61 O ATOM 0 H SER A 108 -15.478 8.489 -8.022 1.00 1.00 H new ATOM 0 HA SER A 108 -16.538 11.035 -9.123 1.00 1.00 H new ATOM 0 HB2 SER A 108 -17.305 11.420 -6.927 1.00 0.85 H new ATOM 0 HB3 SER A 108 -17.462 9.682 -7.086 1.00 0.85 H new ATOM 0 HG SER A 108 -16.358 10.287 -5.124 1.00 1.61 H new ATOM 1414 N SER A 109 -13.714 10.715 -7.446 1.00 0.85 N ATOM 1415 CA SER A 109 -12.412 11.385 -7.192 1.00 0.88 C ATOM 1416 C SER A 109 -11.328 10.629 -7.956 1.00 0.90 C ATOM 1417 O SER A 109 -10.280 10.313 -7.431 1.00 0.90 O ATOM 1418 CB SER A 109 -12.107 11.360 -5.695 1.00 0.73 C ATOM 1419 OG SER A 109 -11.920 12.690 -5.232 1.00 1.17 O ATOM 0 H SER A 109 -13.802 9.780 -7.048 1.00 0.85 H new ATOM 0 HA SER A 109 -12.448 12.422 -7.524 1.00 0.88 H new ATOM 0 HB2 SER A 109 -12.925 10.886 -5.153 1.00 0.73 H new ATOM 0 HB3 SER A 109 -11.213 10.767 -5.504 1.00 0.73 H new ATOM 0 HG SER A 109 -12.447 12.830 -4.417 1.00 1.17 H new ATOM 1425 N GLU A 110 -11.591 10.320 -9.196 1.00 0.91 N ATOM 1426 CA GLU A 110 -10.610 9.565 -10.014 1.00 0.93 C ATOM 1427 C GLU A 110 -9.210 10.180 -9.881 1.00 0.94 C ATOM 1428 O GLU A 110 -8.245 9.495 -9.613 1.00 0.91 O ATOM 1429 CB GLU A 110 -11.043 9.612 -11.478 1.00 0.95 C ATOM 1430 CG GLU A 110 -10.576 8.341 -12.186 1.00 1.29 C ATOM 1431 CD GLU A 110 -11.791 7.562 -12.693 1.00 2.27 C ATOM 1432 OE1 GLU A 110 -12.791 8.192 -12.995 1.00 2.60 O ATOM 1433 OE2 GLU A 110 -11.701 6.348 -12.769 1.00 2.87 O ATOM 0 H GLU A 110 -12.455 10.563 -9.680 1.00 0.91 H new ATOM 0 HA GLU A 110 -10.574 8.534 -9.663 1.00 0.93 H new ATOM 0 HB2 GLU A 110 -12.127 9.702 -11.545 1.00 0.95 H new ATOM 0 HB3 GLU A 110 -10.620 10.490 -11.966 1.00 0.95 H new ATOM 0 HG2 GLU A 110 -9.921 8.596 -13.019 1.00 1.29 H new ATOM 0 HG3 GLU A 110 -9.995 7.723 -11.501 1.00 1.29 H new ATOM 1440 N GLU A 111 -9.096 11.465 -10.083 1.00 1.00 N ATOM 1441 CA GLU A 111 -7.763 12.129 -9.986 1.00 1.01 C ATOM 1442 C GLU A 111 -7.101 11.807 -8.642 1.00 0.94 C ATOM 1443 O GLU A 111 -5.904 11.610 -8.564 1.00 0.85 O ATOM 1444 CB GLU A 111 -7.944 13.644 -10.109 1.00 1.08 C ATOM 1445 CG GLU A 111 -6.722 14.253 -10.800 1.00 1.07 C ATOM 1446 CD GLU A 111 -7.058 15.667 -11.274 1.00 1.23 C ATOM 1447 OE1 GLU A 111 -7.874 15.791 -12.173 1.00 2.35 O ATOM 1448 OE2 GLU A 111 -6.496 16.604 -10.731 1.00 0.84 O ATOM 0 H GLU A 111 -9.872 12.086 -10.312 1.00 1.00 H new ATOM 0 HA GLU A 111 -7.126 11.761 -10.790 1.00 1.01 H new ATOM 0 HB2 GLU A 111 -8.846 13.867 -10.679 1.00 1.08 H new ATOM 0 HB3 GLU A 111 -8.074 14.086 -9.121 1.00 1.08 H new ATOM 0 HG2 GLU A 111 -5.877 14.280 -10.112 1.00 1.07 H new ATOM 0 HG3 GLU A 111 -6.424 13.635 -11.647 1.00 1.07 H new ATOM 1455 N GLN A 112 -7.863 11.758 -7.584 1.00 0.99 N ATOM 1456 CA GLN A 112 -7.263 11.459 -6.251 1.00 0.93 C ATOM 1457 C GLN A 112 -6.615 10.075 -6.280 1.00 0.78 C ATOM 1458 O GLN A 112 -5.512 9.883 -5.810 1.00 0.69 O ATOM 1459 CB GLN A 112 -8.356 11.487 -5.181 1.00 1.06 C ATOM 1460 CG GLN A 112 -8.942 12.897 -5.083 1.00 1.21 C ATOM 1461 CD GLN A 112 -9.717 13.038 -3.770 1.00 2.39 C ATOM 1462 OE1 GLN A 112 -9.719 14.091 -3.163 1.00 2.37 O ATOM 1463 NE2 GLN A 112 -10.377 12.014 -3.301 1.00 4.00 N ATOM 0 H GLN A 112 -8.871 11.911 -7.583 1.00 0.99 H new ATOM 0 HA GLN A 112 -6.507 12.209 -6.019 1.00 0.93 H new ATOM 0 HB2 GLN A 112 -9.141 10.773 -5.430 1.00 1.06 H new ATOM 0 HB3 GLN A 112 -7.944 11.186 -4.218 1.00 1.06 H new ATOM 0 HG2 GLN A 112 -8.144 13.638 -5.128 1.00 1.21 H new ATOM 0 HG3 GLN A 112 -9.602 13.088 -5.929 1.00 1.21 H new ATOM 0 HE21 GLN A 112 -10.376 11.130 -3.810 1.00 4.00 H new ATOM 0 HE22 GLN A 112 -10.894 12.098 -2.426 1.00 4.00 H new ATOM 1472 N ALA A 113 -7.293 9.109 -6.831 1.00 0.76 N ATOM 1473 CA ALA A 113 -6.717 7.735 -6.892 1.00 0.63 C ATOM 1474 C ALA A 113 -5.404 7.766 -7.679 1.00 0.53 C ATOM 1475 O ALA A 113 -4.399 7.227 -7.256 1.00 0.22 O ATOM 1476 CB ALA A 113 -7.707 6.803 -7.593 1.00 0.71 C ATOM 0 H ALA A 113 -8.221 9.210 -7.242 1.00 0.76 H new ATOM 0 HA ALA A 113 -6.526 7.374 -5.881 1.00 0.63 H new ATOM 0 HB1 ALA A 113 -7.289 5.797 -7.640 1.00 0.71 H new ATOM 0 HB2 ALA A 113 -8.644 6.782 -7.036 1.00 0.71 H new ATOM 0 HB3 ALA A 113 -7.894 7.165 -8.604 1.00 0.71 H new ATOM 1482 N ARG A 114 -5.407 8.392 -8.822 1.00 0.81 N ATOM 1483 CA ARG A 114 -4.169 8.464 -9.648 1.00 0.74 C ATOM 1484 C ARG A 114 -3.095 9.270 -8.911 1.00 0.71 C ATOM 1485 O ARG A 114 -1.924 9.184 -9.222 1.00 0.70 O ATOM 1486 CB ARG A 114 -4.494 9.150 -10.977 1.00 0.91 C ATOM 1487 CG ARG A 114 -3.362 8.905 -11.976 1.00 0.52 C ATOM 1488 CD ARG A 114 -3.666 9.646 -13.280 1.00 0.64 C ATOM 1489 NE ARG A 114 -2.629 9.311 -14.298 1.00 0.87 N ATOM 1490 CZ ARG A 114 -2.870 9.512 -15.565 1.00 1.07 C ATOM 1491 NH1 ARG A 114 -3.676 10.469 -15.933 1.00 1.17 N ATOM 1492 NH2 ARG A 114 -2.305 8.753 -16.464 1.00 1.49 N ATOM 0 H ARG A 114 -6.220 8.860 -9.223 1.00 0.81 H new ATOM 0 HA ARG A 114 -3.797 7.456 -9.830 1.00 0.74 H new ATOM 0 HB2 ARG A 114 -5.433 8.765 -11.375 1.00 0.91 H new ATOM 0 HB3 ARG A 114 -4.629 10.220 -10.821 1.00 0.91 H new ATOM 0 HG2 ARG A 114 -2.415 9.250 -11.561 1.00 0.52 H new ATOM 0 HG3 ARG A 114 -3.256 7.837 -12.168 1.00 0.52 H new ATOM 0 HD2 ARG A 114 -4.654 9.367 -13.647 1.00 0.64 H new ATOM 0 HD3 ARG A 114 -3.683 10.722 -13.104 1.00 0.64 H new ATOM 0 HE ARG A 114 -1.732 8.925 -14.004 1.00 0.87 H new ATOM 0 HH11 ARG A 114 -4.119 11.061 -15.230 1.00 1.17 H new ATOM 0 HH12 ARG A 114 -3.864 10.625 -16.923 1.00 1.17 H new ATOM 0 HH21 ARG A 114 -1.676 8.004 -16.176 1.00 1.49 H new ATOM 0 HH22 ARG A 114 -2.493 8.909 -17.454 1.00 1.49 H new ATOM 1506 N ALA A 115 -3.482 10.058 -7.947 1.00 0.78 N ATOM 1507 CA ALA A 115 -2.478 10.871 -7.206 1.00 0.82 C ATOM 1508 C ALA A 115 -1.674 9.974 -6.261 1.00 0.68 C ATOM 1509 O ALA A 115 -0.464 10.064 -6.189 1.00 0.84 O ATOM 1510 CB ALA A 115 -3.197 11.951 -6.398 1.00 0.96 C ATOM 0 H ALA A 115 -4.448 10.174 -7.641 1.00 0.78 H new ATOM 0 HA ALA A 115 -1.798 11.338 -7.918 1.00 0.82 H new ATOM 0 HB1 ALA A 115 -2.464 12.547 -5.855 1.00 0.96 H new ATOM 0 HB2 ALA A 115 -3.761 12.595 -7.073 1.00 0.96 H new ATOM 0 HB3 ALA A 115 -3.880 11.482 -5.690 1.00 0.96 H new ATOM 1516 N VAL A 116 -2.330 9.113 -5.532 1.00 0.42 N ATOM 1517 CA VAL A 116 -1.586 8.222 -4.595 1.00 0.34 C ATOM 1518 C VAL A 116 -0.793 7.184 -5.394 1.00 0.36 C ATOM 1519 O VAL A 116 0.240 6.713 -4.964 1.00 0.38 O ATOM 1520 CB VAL A 116 -2.572 7.520 -3.650 1.00 0.19 C ATOM 1521 CG1 VAL A 116 -3.437 6.519 -4.426 1.00 0.56 C ATOM 1522 CG2 VAL A 116 -1.788 6.776 -2.566 1.00 0.62 C ATOM 0 H VAL A 116 -3.342 8.988 -5.544 1.00 0.42 H new ATOM 0 HA VAL A 116 -0.894 8.819 -4.001 1.00 0.34 H new ATOM 0 HB VAL A 116 -3.221 8.269 -3.196 1.00 0.19 H new ATOM 0 HG11 VAL A 116 -4.130 6.030 -3.742 1.00 0.56 H new ATOM 0 HG12 VAL A 116 -3.999 7.045 -5.197 1.00 0.56 H new ATOM 0 HG13 VAL A 116 -2.797 5.769 -4.891 1.00 0.56 H new ATOM 0 HG21 VAL A 116 -2.484 6.276 -1.892 1.00 0.62 H new ATOM 0 HG22 VAL A 116 -1.137 6.035 -3.031 1.00 0.62 H new ATOM 0 HG23 VAL A 116 -1.184 7.486 -2.002 1.00 0.62 H new ATOM 1532 N GLN A 117 -1.275 6.820 -6.551 1.00 0.40 N ATOM 1533 CA GLN A 117 -0.559 5.809 -7.376 1.00 0.47 C ATOM 1534 C GLN A 117 0.744 6.402 -7.921 1.00 0.49 C ATOM 1535 O GLN A 117 1.797 5.806 -7.821 1.00 0.52 O ATOM 1536 CB GLN A 117 -1.451 5.390 -8.544 1.00 0.55 C ATOM 1537 CG GLN A 117 -0.870 4.141 -9.202 1.00 0.54 C ATOM 1538 CD GLN A 117 -1.619 3.855 -10.504 1.00 0.54 C ATOM 1539 OE1 GLN A 117 -2.726 3.357 -10.484 1.00 1.59 O ATOM 1540 NE2 GLN A 117 -1.058 4.151 -11.644 1.00 0.77 N ATOM 0 H GLN A 117 -2.137 7.181 -6.961 1.00 0.40 H new ATOM 0 HA GLN A 117 -0.325 4.943 -6.757 1.00 0.47 H new ATOM 0 HB2 GLN A 117 -2.463 5.191 -8.190 1.00 0.55 H new ATOM 0 HB3 GLN A 117 -1.521 6.199 -9.271 1.00 0.55 H new ATOM 0 HG2 GLN A 117 0.191 4.284 -9.405 1.00 0.54 H new ATOM 0 HG3 GLN A 117 -0.954 3.289 -8.527 1.00 0.54 H new ATOM 0 HE21 GLN A 117 -0.128 4.569 -11.661 1.00 0.77 H new ATOM 0 HE22 GLN A 117 -1.549 3.964 -12.518 1.00 0.77 H new ATOM 1549 N MET A 118 0.679 7.570 -8.504 1.00 0.50 N ATOM 1550 CA MET A 118 1.914 8.197 -9.065 1.00 0.58 C ATOM 1551 C MET A 118 3.020 8.210 -8.006 1.00 0.50 C ATOM 1552 O MET A 118 4.146 7.834 -8.265 1.00 0.50 O ATOM 1553 CB MET A 118 1.607 9.633 -9.495 1.00 0.62 C ATOM 1554 CG MET A 118 0.426 9.637 -10.468 1.00 0.73 C ATOM 1555 SD MET A 118 1.034 9.870 -12.158 1.00 0.60 S ATOM 1556 CE MET A 118 0.973 11.679 -12.181 1.00 1.65 C ATOM 0 H MET A 118 -0.174 8.117 -8.616 1.00 0.50 H new ATOM 0 HA MET A 118 2.248 7.619 -9.927 1.00 0.58 H new ATOM 0 HB2 MET A 118 1.374 10.243 -8.622 1.00 0.62 H new ATOM 0 HB3 MET A 118 2.483 10.076 -9.969 1.00 0.62 H new ATOM 0 HG2 MET A 118 -0.123 8.698 -10.394 1.00 0.73 H new ATOM 0 HG3 MET A 118 -0.270 10.434 -10.208 1.00 0.73 H new ATOM 0 HE1 MET A 118 1.313 12.042 -13.151 1.00 1.65 H new ATOM 0 HE2 MET A 118 -0.051 12.011 -12.008 1.00 1.65 H new ATOM 0 HE3 MET A 118 1.620 12.075 -11.398 1.00 1.65 H new ATOM 1566 N SER A 119 2.707 8.639 -6.814 1.00 0.43 N ATOM 1567 CA SER A 119 3.741 8.673 -5.741 1.00 0.36 C ATOM 1568 C SER A 119 4.236 7.252 -5.468 1.00 0.34 C ATOM 1569 O SER A 119 5.420 6.993 -5.426 1.00 0.36 O ATOM 1570 CB SER A 119 3.131 9.256 -4.467 1.00 0.25 C ATOM 1571 OG SER A 119 2.195 10.267 -4.816 1.00 1.49 O ATOM 0 H SER A 119 1.782 8.967 -6.537 1.00 0.43 H new ATOM 0 HA SER A 119 4.578 9.294 -6.059 1.00 0.36 H new ATOM 0 HB2 SER A 119 2.639 8.471 -3.893 1.00 0.25 H new ATOM 0 HB3 SER A 119 3.914 9.672 -3.832 1.00 0.25 H new ATOM 0 HG SER A 119 2.223 10.983 -4.148 1.00 1.49 H new ATOM 1577 N THR A 120 3.336 6.327 -5.282 1.00 0.33 N ATOM 1578 CA THR A 120 3.755 4.923 -5.010 1.00 0.39 C ATOM 1579 C THR A 120 4.659 4.417 -6.140 1.00 0.53 C ATOM 1580 O THR A 120 5.393 3.462 -5.974 1.00 0.55 O ATOM 1581 CB THR A 120 2.514 4.033 -4.904 1.00 0.53 C ATOM 1582 OG1 THR A 120 1.822 4.043 -6.144 1.00 1.42 O ATOM 1583 CG2 THR A 120 1.598 4.564 -3.800 1.00 0.81 C ATOM 0 H THR A 120 2.328 6.482 -5.307 1.00 0.33 H new ATOM 0 HA THR A 120 4.309 4.889 -4.072 1.00 0.39 H new ATOM 0 HB THR A 120 2.814 3.013 -4.663 1.00 0.53 H new ATOM 0 HG1 THR A 120 2.187 4.749 -6.717 1.00 1.42 H new ATOM 0 HG21 THR A 120 0.714 3.930 -3.724 1.00 0.81 H new ATOM 0 HG22 THR A 120 2.132 4.557 -2.850 1.00 0.81 H new ATOM 0 HG23 THR A 120 1.294 5.583 -4.038 1.00 0.81 H new ATOM 1591 N LYS A 121 4.632 5.056 -7.280 1.00 0.67 N ATOM 1592 CA LYS A 121 5.510 4.614 -8.399 1.00 0.84 C ATOM 1593 C LYS A 121 6.892 5.218 -8.172 1.00 0.77 C ATOM 1594 O LYS A 121 7.908 4.608 -8.434 1.00 0.79 O ATOM 1595 CB LYS A 121 4.942 5.115 -9.729 1.00 1.07 C ATOM 1596 CG LYS A 121 3.574 4.477 -9.976 1.00 1.10 C ATOM 1597 CD LYS A 121 3.728 3.287 -10.924 1.00 0.69 C ATOM 1598 CE LYS A 121 3.203 3.665 -12.311 1.00 1.54 C ATOM 1599 NZ LYS A 121 4.115 3.118 -13.357 1.00 1.18 N ATOM 0 H LYS A 121 4.041 5.862 -7.483 1.00 0.67 H new ATOM 0 HA LYS A 121 5.568 3.526 -8.432 1.00 0.84 H new ATOM 0 HB2 LYS A 121 4.850 6.201 -9.711 1.00 1.07 H new ATOM 0 HB3 LYS A 121 5.623 4.867 -10.543 1.00 1.07 H new ATOM 0 HG2 LYS A 121 3.138 4.149 -9.032 1.00 1.10 H new ATOM 0 HG3 LYS A 121 2.891 5.211 -10.405 1.00 1.10 H new ATOM 0 HD2 LYS A 121 4.776 2.993 -10.988 1.00 0.69 H new ATOM 0 HD3 LYS A 121 3.179 2.428 -10.538 1.00 0.69 H new ATOM 0 HE2 LYS A 121 2.196 3.271 -12.450 1.00 1.54 H new ATOM 0 HE3 LYS A 121 3.136 4.749 -12.403 1.00 1.54 H new ATOM 0 HZ1 LYS A 121 3.757 3.376 -14.299 1.00 1.18 H new ATOM 0 HZ2 LYS A 121 5.068 3.514 -13.228 1.00 1.18 H new ATOM 0 HZ3 LYS A 121 4.157 2.082 -13.274 1.00 1.18 H new ATOM 1613 N VAL A 122 6.923 6.418 -7.669 1.00 0.74 N ATOM 1614 CA VAL A 122 8.218 7.092 -7.396 1.00 0.75 C ATOM 1615 C VAL A 122 8.998 6.297 -6.344 1.00 0.59 C ATOM 1616 O VAL A 122 10.211 6.323 -6.310 1.00 0.63 O ATOM 1617 CB VAL A 122 7.937 8.499 -6.869 1.00 0.78 C ATOM 1618 CG1 VAL A 122 9.254 9.194 -6.536 1.00 0.87 C ATOM 1619 CG2 VAL A 122 7.194 9.302 -7.939 1.00 0.94 C ATOM 0 H VAL A 122 6.096 6.966 -7.433 1.00 0.74 H new ATOM 0 HA VAL A 122 8.808 7.148 -8.311 1.00 0.75 H new ATOM 0 HB VAL A 122 7.325 8.434 -5.969 1.00 0.78 H new ATOM 0 HG11 VAL A 122 9.051 10.197 -6.160 1.00 0.87 H new ATOM 0 HG12 VAL A 122 9.785 8.622 -5.775 1.00 0.87 H new ATOM 0 HG13 VAL A 122 9.868 9.260 -7.434 1.00 0.87 H new ATOM 0 HG21 VAL A 122 6.992 10.306 -7.566 1.00 0.94 H new ATOM 0 HG22 VAL A 122 7.807 9.365 -8.838 1.00 0.94 H new ATOM 0 HG23 VAL A 122 6.252 8.807 -8.177 1.00 0.94 H new ATOM 1629 N LEU A 123 8.312 5.594 -5.481 1.00 0.43 N ATOM 1630 CA LEU A 123 9.024 4.801 -4.433 1.00 0.28 C ATOM 1631 C LEU A 123 9.460 3.456 -5.021 1.00 0.29 C ATOM 1632 O LEU A 123 10.444 2.873 -4.611 1.00 0.21 O ATOM 1633 CB LEU A 123 8.083 4.550 -3.250 1.00 0.16 C ATOM 1634 CG LEU A 123 8.027 5.790 -2.358 1.00 0.21 C ATOM 1635 CD1 LEU A 123 9.423 6.108 -1.832 1.00 0.45 C ATOM 1636 CD2 LEU A 123 7.515 6.974 -3.169 1.00 0.50 C ATOM 0 H LEU A 123 7.294 5.534 -5.456 1.00 0.43 H new ATOM 0 HA LEU A 123 9.898 5.356 -4.093 1.00 0.28 H new ATOM 0 HB2 LEU A 123 7.084 4.307 -3.613 1.00 0.16 H new ATOM 0 HB3 LEU A 123 8.430 3.692 -2.674 1.00 0.16 H new ATOM 0 HG LEU A 123 7.357 5.600 -1.519 1.00 0.21 H new ATOM 0 HD11 LEU A 123 9.380 6.993 -1.196 1.00 0.45 H new ATOM 0 HD12 LEU A 123 9.795 5.263 -1.253 1.00 0.45 H new ATOM 0 HD13 LEU A 123 10.094 6.296 -2.670 1.00 0.45 H new ATOM 0 HD21 LEU A 123 7.474 7.859 -2.534 1.00 0.50 H new ATOM 0 HD22 LEU A 123 8.187 7.159 -4.007 1.00 0.50 H new ATOM 0 HD23 LEU A 123 6.517 6.752 -3.546 1.00 0.50 H new ATOM 1648 N ILE A 124 8.728 2.963 -5.977 1.00 0.44 N ATOM 1649 CA ILE A 124 9.076 1.655 -6.602 1.00 0.52 C ATOM 1650 C ILE A 124 10.320 1.820 -7.474 1.00 0.55 C ATOM 1651 O ILE A 124 11.134 0.924 -7.588 1.00 0.52 O ATOM 1652 CB ILE A 124 7.898 1.178 -7.460 1.00 0.65 C ATOM 1653 CG1 ILE A 124 6.701 0.894 -6.553 1.00 0.67 C ATOM 1654 CG2 ILE A 124 8.279 -0.104 -8.204 1.00 0.54 C ATOM 1655 CD1 ILE A 124 5.416 0.894 -7.383 1.00 0.90 C ATOM 0 H ILE A 124 7.895 3.413 -6.357 1.00 0.44 H new ATOM 0 HA ILE A 124 9.281 0.918 -5.825 1.00 0.52 H new ATOM 0 HB ILE A 124 7.644 1.952 -8.184 1.00 0.65 H new ATOM 0 HG12 ILE A 124 6.827 -0.070 -6.059 1.00 0.67 H new ATOM 0 HG13 ILE A 124 6.639 1.648 -5.769 1.00 0.67 H new ATOM 0 HG21 ILE A 124 7.437 -0.436 -8.811 1.00 0.54 H new ATOM 0 HG22 ILE A 124 9.136 0.090 -8.848 1.00 0.54 H new ATOM 0 HG23 ILE A 124 8.535 -0.880 -7.483 1.00 0.54 H new ATOM 0 HD11 ILE A 124 4.564 0.691 -6.734 1.00 0.90 H new ATOM 0 HD12 ILE A 124 5.288 1.868 -7.856 1.00 0.90 H new ATOM 0 HD13 ILE A 124 5.479 0.123 -8.151 1.00 0.90 H new ATOM 1667 N GLN A 125 10.479 2.957 -8.086 1.00 0.71 N ATOM 1668 CA GLN A 125 11.667 3.176 -8.940 1.00 0.79 C ATOM 1669 C GLN A 125 12.825 3.651 -8.066 1.00 0.70 C ATOM 1670 O GLN A 125 13.914 3.117 -8.117 1.00 0.64 O ATOM 1671 CB GLN A 125 11.330 4.232 -9.986 1.00 0.98 C ATOM 1672 CG GLN A 125 10.954 3.541 -11.296 1.00 1.13 C ATOM 1673 CD GLN A 125 11.277 4.461 -12.474 1.00 1.34 C ATOM 1674 OE1 GLN A 125 10.516 5.354 -12.789 1.00 1.33 O ATOM 1675 NE2 GLN A 125 12.383 4.279 -13.142 1.00 1.95 N ATOM 0 H GLN A 125 9.833 3.745 -8.029 1.00 0.71 H new ATOM 0 HA GLN A 125 11.954 2.251 -9.441 1.00 0.79 H new ATOM 0 HB2 GLN A 125 10.505 4.854 -9.639 1.00 0.98 H new ATOM 0 HB3 GLN A 125 12.183 4.892 -10.141 1.00 0.98 H new ATOM 0 HG2 GLN A 125 11.501 2.603 -11.394 1.00 1.13 H new ATOM 0 HG3 GLN A 125 9.893 3.293 -11.296 1.00 1.13 H new ATOM 0 HE21 GLN A 125 13.021 3.529 -12.877 1.00 1.95 H new ATOM 0 HE22 GLN A 125 12.609 4.887 -13.929 1.00 1.95 H new ATOM 1684 N PHE A 126 12.594 4.641 -7.250 1.00 0.73 N ATOM 1685 CA PHE A 126 13.678 5.138 -6.359 1.00 0.67 C ATOM 1686 C PHE A 126 14.188 3.977 -5.501 1.00 0.51 C ATOM 1687 O PHE A 126 15.310 3.980 -5.043 1.00 0.67 O ATOM 1688 CB PHE A 126 13.133 6.238 -5.443 1.00 0.68 C ATOM 1689 CG PHE A 126 13.205 7.569 -6.150 1.00 0.82 C ATOM 1690 CD1 PHE A 126 12.537 7.751 -7.366 1.00 0.89 C ATOM 1691 CD2 PHE A 126 13.939 8.621 -5.589 1.00 0.95 C ATOM 1692 CE1 PHE A 126 12.602 8.986 -8.021 1.00 1.00 C ATOM 1693 CE2 PHE A 126 14.004 9.856 -6.244 1.00 1.10 C ATOM 1694 CZ PHE A 126 13.336 10.038 -7.460 1.00 1.09 C ATOM 0 H PHE A 126 11.702 5.127 -7.162 1.00 0.73 H new ATOM 0 HA PHE A 126 14.490 5.542 -6.964 1.00 0.67 H new ATOM 0 HB2 PHE A 126 12.102 6.017 -5.167 1.00 0.68 H new ATOM 0 HB3 PHE A 126 13.710 6.274 -4.519 1.00 0.68 H new ATOM 0 HD1 PHE A 126 11.972 6.939 -7.799 1.00 0.89 H new ATOM 0 HD2 PHE A 126 14.455 8.479 -4.651 1.00 0.95 H new ATOM 0 HE1 PHE A 126 12.086 9.128 -8.959 1.00 1.00 H new ATOM 0 HE2 PHE A 126 14.569 10.668 -5.811 1.00 1.10 H new ATOM 0 HZ PHE A 126 13.387 10.991 -7.966 1.00 1.09 H new ATOM 1704 N LEU A 127 13.365 2.987 -5.281 1.00 0.27 N ATOM 1705 CA LEU A 127 13.792 1.825 -4.449 1.00 0.17 C ATOM 1706 C LEU A 127 14.620 0.856 -5.297 1.00 0.21 C ATOM 1707 O LEU A 127 15.696 0.443 -4.914 1.00 0.25 O ATOM 1708 CB LEU A 127 12.552 1.093 -3.928 1.00 0.39 C ATOM 1709 CG LEU A 127 12.030 1.787 -2.671 1.00 0.82 C ATOM 1710 CD1 LEU A 127 10.615 1.292 -2.368 1.00 1.67 C ATOM 1711 CD2 LEU A 127 12.948 1.461 -1.491 1.00 0.63 C ATOM 0 H LEU A 127 12.413 2.933 -5.643 1.00 0.27 H new ATOM 0 HA LEU A 127 14.393 2.184 -3.614 1.00 0.17 H new ATOM 0 HB2 LEU A 127 11.778 1.080 -4.695 1.00 0.39 H new ATOM 0 HB3 LEU A 127 12.798 0.055 -3.705 1.00 0.39 H new ATOM 0 HG LEU A 127 12.012 2.865 -2.830 1.00 0.82 H new ATOM 0 HD11 LEU A 127 10.241 1.786 -1.471 1.00 1.67 H new ATOM 0 HD12 LEU A 127 9.961 1.522 -3.209 1.00 1.67 H new ATOM 0 HD13 LEU A 127 10.633 0.214 -2.207 1.00 1.67 H new ATOM 0 HD21 LEU A 127 12.577 1.956 -0.594 1.00 0.63 H new ATOM 0 HD22 LEU A 127 12.965 0.383 -1.330 1.00 0.63 H new ATOM 0 HD23 LEU A 127 13.957 1.812 -1.707 1.00 0.63 H new ATOM 1723 N GLN A 128 14.117 0.481 -6.441 1.00 0.28 N ATOM 1724 CA GLN A 128 14.861 -0.473 -7.317 1.00 0.39 C ATOM 1725 C GLN A 128 16.313 -0.012 -7.493 1.00 0.49 C ATOM 1726 O GLN A 128 17.238 -0.782 -7.332 1.00 0.61 O ATOM 1727 CB GLN A 128 14.179 -0.542 -8.686 1.00 0.74 C ATOM 1728 CG GLN A 128 13.390 -1.849 -8.803 1.00 0.57 C ATOM 1729 CD GLN A 128 11.906 -1.533 -8.995 1.00 1.13 C ATOM 1730 OE1 GLN A 128 11.077 -1.953 -8.212 1.00 2.13 O ATOM 1731 NE2 GLN A 128 11.532 -0.804 -10.012 1.00 2.13 N ATOM 0 H GLN A 128 13.219 0.795 -6.810 1.00 0.28 H new ATOM 0 HA GLN A 128 14.857 -1.459 -6.851 1.00 0.39 H new ATOM 0 HB2 GLN A 128 13.511 0.310 -8.814 1.00 0.74 H new ATOM 0 HB3 GLN A 128 14.925 -0.484 -9.478 1.00 0.74 H new ATOM 0 HG2 GLN A 128 13.760 -2.435 -9.644 1.00 0.57 H new ATOM 0 HG3 GLN A 128 13.531 -2.453 -7.907 1.00 0.57 H new ATOM 0 HE21 GLN A 128 12.227 -0.451 -10.670 1.00 2.13 H new ATOM 0 HE22 GLN A 128 10.545 -0.588 -10.149 1.00 2.13 H new ATOM 1740 N LYS A 129 16.522 1.233 -7.831 1.00 0.60 N ATOM 1741 CA LYS A 129 17.917 1.725 -8.026 1.00 0.85 C ATOM 1742 C LYS A 129 18.573 2.006 -6.671 1.00 0.86 C ATOM 1743 O LYS A 129 19.770 1.865 -6.514 1.00 1.04 O ATOM 1744 CB LYS A 129 17.898 3.007 -8.860 1.00 1.06 C ATOM 1745 CG LYS A 129 16.924 4.010 -8.240 1.00 2.58 C ATOM 1746 CD LYS A 129 17.342 5.428 -8.631 1.00 3.33 C ATOM 1747 CE LYS A 129 17.871 6.167 -7.399 1.00 5.28 C ATOM 1748 NZ LYS A 129 18.807 5.283 -6.647 1.00 6.36 N ATOM 0 H LYS A 129 15.790 1.928 -7.980 1.00 0.60 H new ATOM 0 HA LYS A 129 18.492 0.959 -8.547 1.00 0.85 H new ATOM 0 HB2 LYS A 129 18.898 3.437 -8.906 1.00 1.06 H new ATOM 0 HB3 LYS A 129 17.601 2.782 -9.884 1.00 1.06 H new ATOM 0 HG2 LYS A 129 15.909 3.810 -8.584 1.00 2.58 H new ATOM 0 HG3 LYS A 129 16.919 3.906 -7.155 1.00 2.58 H new ATOM 0 HD2 LYS A 129 18.111 5.391 -9.403 1.00 3.33 H new ATOM 0 HD3 LYS A 129 16.492 5.965 -9.052 1.00 3.33 H new ATOM 0 HE2 LYS A 129 18.383 7.080 -7.703 1.00 5.28 H new ATOM 0 HE3 LYS A 129 17.042 6.465 -6.757 1.00 5.28 H new ATOM 0 HZ1 LYS A 129 19.501 5.866 -6.136 1.00 6.36 H new ATOM 0 HZ2 LYS A 129 18.270 4.708 -5.967 1.00 6.36 H new ATOM 0 HZ3 LYS A 129 19.304 4.657 -7.313 1.00 6.36 H new ATOM 1762 N LYS A 130 17.807 2.399 -5.691 1.00 0.81 N ATOM 1763 CA LYS A 130 18.403 2.681 -4.352 1.00 1.04 C ATOM 1764 C LYS A 130 18.560 1.379 -3.567 1.00 0.90 C ATOM 1765 O LYS A 130 18.955 1.385 -2.419 1.00 1.08 O ATOM 1766 CB LYS A 130 17.495 3.634 -3.574 1.00 1.35 C ATOM 1767 CG LYS A 130 18.114 3.936 -2.208 1.00 1.73 C ATOM 1768 CD LYS A 130 17.292 3.251 -1.113 1.00 2.01 C ATOM 1769 CE LYS A 130 15.862 3.790 -1.134 1.00 2.12 C ATOM 1770 NZ LYS A 130 15.232 3.577 0.200 1.00 3.11 N ATOM 0 H LYS A 130 16.799 2.537 -5.757 1.00 0.81 H new ATOM 0 HA LYS A 130 19.382 3.140 -4.490 1.00 1.04 H new ATOM 0 HB2 LYS A 130 17.357 4.559 -4.134 1.00 1.35 H new ATOM 0 HB3 LYS A 130 16.508 3.189 -3.446 1.00 1.35 H new ATOM 0 HG2 LYS A 130 19.145 3.584 -2.178 1.00 1.73 H new ATOM 0 HG3 LYS A 130 18.140 5.012 -2.039 1.00 1.73 H new ATOM 0 HD2 LYS A 130 17.287 2.172 -1.269 1.00 2.01 H new ATOM 0 HD3 LYS A 130 17.745 3.430 -0.138 1.00 2.01 H new ATOM 0 HE2 LYS A 130 15.866 4.852 -1.381 1.00 2.12 H new ATOM 0 HE3 LYS A 130 15.283 3.285 -1.907 1.00 2.12 H new ATOM 0 HZ1 LYS A 130 14.635 4.395 0.436 1.00 3.11 H new ATOM 0 HZ2 LYS A 130 14.647 2.717 0.175 1.00 3.11 H new ATOM 0 HZ3 LYS A 130 15.974 3.470 0.921 1.00 3.11 H new ATOM 1784 N ALA A 131 18.269 0.257 -4.170 1.00 0.63 N ATOM 1785 CA ALA A 131 18.418 -1.028 -3.441 1.00 0.64 C ATOM 1786 C ALA A 131 19.847 -1.547 -3.620 1.00 0.64 C ATOM 1787 O ALA A 131 20.063 -2.715 -3.882 1.00 0.80 O ATOM 1788 CB ALA A 131 17.423 -2.049 -3.998 1.00 0.50 C ATOM 0 H ALA A 131 17.936 0.178 -5.131 1.00 0.63 H new ATOM 0 HA ALA A 131 18.218 -0.874 -2.381 1.00 0.64 H new ATOM 0 HB1 ALA A 131 17.532 -2.992 -3.463 1.00 0.50 H new ATOM 0 HB2 ALA A 131 16.407 -1.675 -3.870 1.00 0.50 H new ATOM 0 HB3 ALA A 131 17.620 -2.208 -5.058 1.00 0.50 H new ATOM 1794 N LYS A 132 20.833 -0.694 -3.477 1.00 0.65 N ATOM 1795 CA LYS A 132 22.244 -1.155 -3.634 1.00 0.64 C ATOM 1796 C LYS A 132 22.475 -2.373 -2.736 1.00 0.79 C ATOM 1797 O LYS A 132 22.004 -2.427 -1.617 1.00 0.91 O ATOM 1798 CB LYS A 132 23.202 -0.031 -3.229 1.00 0.76 C ATOM 1799 CG LYS A 132 22.741 0.583 -1.907 1.00 0.92 C ATOM 1800 CD LYS A 132 23.944 0.757 -0.978 1.00 1.51 C ATOM 1801 CE LYS A 132 23.472 0.724 0.475 1.00 1.73 C ATOM 1802 NZ LYS A 132 24.071 1.869 1.219 1.00 1.75 N ATOM 0 H LYS A 132 20.720 0.296 -3.259 1.00 0.65 H new ATOM 0 HA LYS A 132 22.428 -1.424 -4.674 1.00 0.64 H new ATOM 0 HB2 LYS A 132 24.215 -0.421 -3.127 1.00 0.76 H new ATOM 0 HB3 LYS A 132 23.232 0.733 -4.006 1.00 0.76 H new ATOM 0 HG2 LYS A 132 22.265 1.547 -2.088 1.00 0.92 H new ATOM 0 HG3 LYS A 132 21.995 -0.058 -1.437 1.00 0.92 H new ATOM 0 HD2 LYS A 132 24.671 -0.036 -1.154 1.00 1.51 H new ATOM 0 HD3 LYS A 132 24.446 1.702 -1.188 1.00 1.51 H new ATOM 0 HE2 LYS A 132 22.384 0.779 0.516 1.00 1.73 H new ATOM 0 HE3 LYS A 132 23.762 -0.218 0.941 1.00 1.73 H new ATOM 0 HZ1 LYS A 132 23.750 1.847 2.208 1.00 1.75 H new ATOM 0 HZ2 LYS A 132 25.108 1.797 1.190 1.00 1.75 H new ATOM 0 HZ3 LYS A 132 23.773 2.763 0.779 1.00 1.75 H new ATOM 1816 N ASN A 133 23.173 -3.361 -3.223 1.00 0.83 N ATOM 1817 CA ASN A 133 23.404 -4.581 -2.398 1.00 1.04 C ATOM 1818 C ASN A 133 22.049 -5.160 -1.997 1.00 0.99 C ATOM 1819 O ASN A 133 21.832 -5.556 -0.869 1.00 1.05 O ATOM 1820 CB ASN A 133 24.204 -4.225 -1.144 1.00 1.24 C ATOM 1821 CG ASN A 133 24.652 -5.509 -0.446 1.00 1.98 C ATOM 1822 OD1 ASN A 133 24.979 -6.484 -1.093 1.00 2.69 O ATOM 1823 ND2 ASN A 133 24.681 -5.554 0.858 1.00 2.31 N ATOM 0 H ASN A 133 23.592 -3.377 -4.153 1.00 0.83 H new ATOM 0 HA ASN A 133 23.970 -5.313 -2.974 1.00 1.04 H new ATOM 0 HB2 ASN A 133 25.072 -3.622 -1.412 1.00 1.24 H new ATOM 0 HB3 ASN A 133 23.595 -3.625 -0.469 1.00 1.24 H new ATOM 0 HD21 ASN A 133 24.978 -6.407 1.332 1.00 2.31 H new ATOM 0 HD22 ASN A 133 24.407 -4.736 1.403 1.00 2.31 H new ATOM 1830 N LEU A 134 21.137 -5.203 -2.925 1.00 0.89 N ATOM 1831 CA LEU A 134 19.783 -5.744 -2.634 1.00 0.84 C ATOM 1832 C LEU A 134 19.271 -6.488 -3.865 1.00 1.04 C ATOM 1833 O LEU A 134 20.029 -6.854 -4.740 1.00 1.22 O ATOM 1834 CB LEU A 134 18.836 -4.593 -2.290 1.00 0.72 C ATOM 1835 CG LEU A 134 17.991 -4.970 -1.071 1.00 0.86 C ATOM 1836 CD1 LEU A 134 18.210 -3.941 0.041 1.00 0.58 C ATOM 1837 CD2 LEU A 134 16.511 -4.986 -1.464 1.00 1.42 C ATOM 0 H LEU A 134 21.274 -4.883 -3.884 1.00 0.89 H new ATOM 0 HA LEU A 134 19.831 -6.429 -1.788 1.00 0.84 H new ATOM 0 HB2 LEU A 134 19.407 -3.688 -2.083 1.00 0.72 H new ATOM 0 HB3 LEU A 134 18.189 -4.374 -3.140 1.00 0.72 H new ATOM 0 HG LEU A 134 18.286 -5.957 -0.716 1.00 0.86 H new ATOM 0 HD11 LEU A 134 17.608 -4.210 0.909 1.00 0.58 H new ATOM 0 HD12 LEU A 134 19.263 -3.926 0.320 1.00 0.58 H new ATOM 0 HD13 LEU A 134 17.915 -2.954 -0.314 1.00 0.58 H new ATOM 0 HD21 LEU A 134 15.907 -5.254 -0.597 1.00 1.42 H new ATOM 0 HD22 LEU A 134 16.218 -3.998 -1.818 1.00 1.42 H new ATOM 0 HD23 LEU A 134 16.353 -5.717 -2.257 1.00 1.42 H new ATOM 1849 N ASP A 135 17.995 -6.722 -3.937 1.00 1.01 N ATOM 1850 CA ASP A 135 17.445 -7.455 -5.114 1.00 1.20 C ATOM 1851 C ASP A 135 16.342 -6.633 -5.783 1.00 0.75 C ATOM 1852 O ASP A 135 16.160 -5.465 -5.500 1.00 1.62 O ATOM 1853 CB ASP A 135 16.869 -8.796 -4.654 1.00 2.14 C ATOM 1854 CG ASP A 135 17.890 -9.520 -3.776 1.00 2.51 C ATOM 1855 OD1 ASP A 135 17.962 -9.204 -2.600 1.00 3.37 O ATOM 1856 OD2 ASP A 135 18.584 -10.379 -4.295 1.00 2.63 O ATOM 0 H ASP A 135 17.308 -6.441 -3.237 1.00 1.01 H new ATOM 0 HA ASP A 135 18.247 -7.623 -5.832 1.00 1.20 H new ATOM 0 HB2 ASP A 135 15.946 -8.635 -4.098 1.00 2.14 H new ATOM 0 HB3 ASP A 135 16.617 -9.411 -5.518 1.00 2.14 H new ATOM 1861 N ALA A 136 15.593 -7.248 -6.657 1.00 1.31 N ATOM 1862 CA ALA A 136 14.491 -6.538 -7.338 1.00 1.27 C ATOM 1863 C ALA A 136 13.166 -7.114 -6.860 1.00 1.38 C ATOM 1864 O ALA A 136 12.114 -6.547 -7.080 1.00 1.89 O ATOM 1865 CB ALA A 136 14.614 -6.700 -8.855 1.00 2.10 C ATOM 0 H ALA A 136 15.705 -8.225 -6.927 1.00 1.31 H new ATOM 0 HA ALA A 136 14.540 -5.475 -7.100 1.00 1.27 H new ATOM 0 HB1 ALA A 136 13.796 -6.172 -9.345 1.00 2.10 H new ATOM 0 HB2 ALA A 136 15.565 -6.285 -9.189 1.00 2.10 H new ATOM 0 HB3 ALA A 136 14.569 -7.758 -9.113 1.00 2.10 H new ATOM 1871 N ILE A 137 13.215 -8.225 -6.182 1.00 1.18 N ATOM 1872 CA ILE A 137 11.984 -8.830 -5.652 1.00 1.32 C ATOM 1873 C ILE A 137 11.007 -9.151 -6.794 1.00 1.37 C ATOM 1874 O ILE A 137 9.841 -9.412 -6.577 1.00 1.47 O ATOM 1875 CB ILE A 137 11.383 -7.845 -4.648 1.00 1.23 C ATOM 1876 CG1 ILE A 137 12.292 -7.769 -3.415 1.00 1.40 C ATOM 1877 CG2 ILE A 137 9.998 -8.304 -4.218 1.00 1.36 C ATOM 1878 CD1 ILE A 137 13.565 -6.986 -3.754 1.00 1.17 C ATOM 0 H ILE A 137 14.071 -8.739 -5.975 1.00 1.18 H new ATOM 0 HA ILE A 137 12.198 -9.775 -5.153 1.00 1.32 H new ATOM 0 HB ILE A 137 11.301 -6.865 -5.118 1.00 1.23 H new ATOM 0 HG12 ILE A 137 11.765 -7.285 -2.593 1.00 1.40 H new ATOM 0 HG13 ILE A 137 12.551 -8.774 -3.080 1.00 1.40 H new ATOM 0 HG21 ILE A 137 9.584 -7.592 -3.504 1.00 1.36 H new ATOM 0 HG22 ILE A 137 9.347 -8.363 -5.090 1.00 1.36 H new ATOM 0 HG23 ILE A 137 10.069 -9.287 -3.752 1.00 1.36 H new ATOM 0 HD11 ILE A 137 14.206 -6.936 -2.874 1.00 1.17 H new ATOM 0 HD12 ILE A 137 14.097 -7.488 -4.562 1.00 1.17 H new ATOM 0 HD13 ILE A 137 13.299 -5.976 -4.067 1.00 1.17 H new ATOM 1890 N THR A 138 11.479 -9.166 -8.010 1.00 1.58 N ATOM 1891 CA THR A 138 10.581 -9.496 -9.153 1.00 1.84 C ATOM 1892 C THR A 138 9.290 -8.670 -9.071 1.00 1.71 C ATOM 1893 O THR A 138 9.248 -7.620 -8.462 1.00 1.58 O ATOM 1894 CB THR A 138 10.233 -10.987 -9.105 1.00 2.22 C ATOM 1895 OG1 THR A 138 11.134 -11.656 -8.233 1.00 2.32 O ATOM 1896 CG2 THR A 138 10.341 -11.585 -10.508 1.00 2.63 C ATOM 0 H THR A 138 12.447 -8.964 -8.262 1.00 1.58 H new ATOM 0 HA THR A 138 11.092 -9.262 -10.087 1.00 1.84 H new ATOM 0 HB THR A 138 9.214 -11.109 -8.738 1.00 2.22 H new ATOM 0 HG1 THR A 138 10.911 -12.610 -8.201 1.00 2.32 H new ATOM 0 HG21 THR A 138 10.093 -12.646 -10.471 1.00 2.63 H new ATOM 0 HG22 THR A 138 9.648 -11.073 -11.176 1.00 2.63 H new ATOM 0 HG23 THR A 138 11.359 -11.463 -10.878 1.00 2.63 H new ATOM 1904 N THR A 139 8.239 -9.144 -9.683 1.00 1.80 N ATOM 1905 CA THR A 139 6.948 -8.403 -9.651 1.00 1.78 C ATOM 1906 C THR A 139 5.851 -9.312 -10.244 1.00 2.10 C ATOM 1907 O THR A 139 6.145 -10.150 -11.074 1.00 2.06 O ATOM 1908 CB THR A 139 7.109 -7.111 -10.467 1.00 1.82 C ATOM 1909 OG1 THR A 139 6.027 -6.233 -10.200 1.00 1.88 O ATOM 1910 CG2 THR A 139 7.155 -7.424 -11.964 1.00 2.08 C ATOM 0 H THR A 139 8.220 -10.019 -10.207 1.00 1.80 H new ATOM 0 HA THR A 139 6.664 -8.136 -8.633 1.00 1.78 H new ATOM 0 HB THR A 139 8.045 -6.634 -10.177 1.00 1.82 H new ATOM 0 HG1 THR A 139 5.300 -6.408 -10.833 1.00 1.88 H new ATOM 0 HG21 THR A 139 7.269 -6.497 -12.526 1.00 2.08 H new ATOM 0 HG22 THR A 139 7.999 -8.081 -12.173 1.00 2.08 H new ATOM 0 HG23 THR A 139 6.229 -7.917 -12.261 1.00 2.08 H new ATOM 1918 N PRO A 140 4.623 -9.147 -9.796 1.00 2.41 N ATOM 1919 CA PRO A 140 3.503 -9.979 -10.275 1.00 2.73 C ATOM 1920 C PRO A 140 3.079 -9.596 -11.693 1.00 3.04 C ATOM 1921 O PRO A 140 2.315 -10.291 -12.328 1.00 3.16 O ATOM 1922 CB PRO A 140 2.388 -9.711 -9.258 1.00 3.03 C ATOM 1923 CG PRO A 140 2.721 -8.357 -8.591 1.00 2.99 C ATOM 1924 CD PRO A 140 4.231 -8.130 -8.789 1.00 2.52 C ATOM 0 HA PRO A 140 3.765 -11.035 -10.340 1.00 2.73 H new ATOM 0 HB2 PRO A 140 1.416 -9.673 -9.749 1.00 3.03 H new ATOM 0 HB3 PRO A 140 2.340 -10.508 -8.516 1.00 3.03 H new ATOM 0 HG2 PRO A 140 2.145 -7.550 -9.044 1.00 2.99 H new ATOM 0 HG3 PRO A 140 2.467 -8.374 -7.531 1.00 2.99 H new ATOM 0 HD2 PRO A 140 4.439 -7.120 -9.141 1.00 2.52 H new ATOM 0 HD3 PRO A 140 4.779 -8.261 -7.856 1.00 2.52 H new ATOM 1932 N ASP A 141 3.577 -8.513 -12.210 1.00 3.96 N ATOM 1933 CA ASP A 141 3.200 -8.117 -13.597 1.00 4.40 C ATOM 1934 C ASP A 141 1.703 -7.773 -13.626 1.00 3.88 C ATOM 1935 O ASP A 141 1.015 -7.982 -12.646 1.00 3.41 O ATOM 1936 CB ASP A 141 3.483 -9.294 -14.536 1.00 4.78 C ATOM 1937 CG ASP A 141 4.426 -8.850 -15.658 1.00 5.49 C ATOM 1938 OD1 ASP A 141 5.421 -8.215 -15.351 1.00 5.46 O ATOM 1939 OD2 ASP A 141 4.135 -9.152 -16.803 1.00 6.13 O ATOM 0 H ASP A 141 4.227 -7.884 -11.737 1.00 3.96 H new ATOM 0 HA ASP A 141 3.776 -7.249 -13.917 1.00 4.40 H new ATOM 0 HB2 ASP A 141 3.930 -10.117 -13.978 1.00 4.78 H new ATOM 0 HB3 ASP A 141 2.550 -9.666 -14.959 1.00 4.78 H new ATOM 1944 N PRO A 142 1.228 -7.260 -14.743 1.00 4.04 N ATOM 1945 CA PRO A 142 -0.188 -6.898 -14.887 1.00 3.72 C ATOM 1946 C PRO A 142 -1.015 -8.157 -15.151 1.00 3.22 C ATOM 1947 O PRO A 142 -2.198 -8.205 -14.878 1.00 2.83 O ATOM 1948 CB PRO A 142 -0.206 -5.955 -16.091 1.00 4.27 C ATOM 1949 CG PRO A 142 1.073 -6.262 -16.905 1.00 4.74 C ATOM 1950 CD PRO A 142 2.038 -6.998 -15.954 1.00 4.62 C ATOM 0 HA PRO A 142 -0.612 -6.431 -13.998 1.00 3.72 H new ATOM 0 HB2 PRO A 142 -1.099 -6.114 -16.696 1.00 4.27 H new ATOM 0 HB3 PRO A 142 -0.221 -4.914 -15.769 1.00 4.27 H new ATOM 0 HG2 PRO A 142 0.840 -6.878 -17.773 1.00 4.74 H new ATOM 0 HG3 PRO A 142 1.524 -5.343 -17.278 1.00 4.74 H new ATOM 0 HD2 PRO A 142 2.403 -7.925 -16.397 1.00 4.62 H new ATOM 0 HD3 PRO A 142 2.912 -6.389 -15.724 1.00 4.62 H new ATOM 1958 N THR A 143 -0.394 -9.186 -15.665 1.00 3.24 N ATOM 1959 CA THR A 143 -1.138 -10.446 -15.927 1.00 2.78 C ATOM 1960 C THR A 143 -1.534 -11.066 -14.594 1.00 2.57 C ATOM 1961 O THR A 143 -2.613 -11.607 -14.452 1.00 2.17 O ATOM 1962 CB THR A 143 -0.253 -11.421 -16.710 1.00 2.82 C ATOM 1963 OG1 THR A 143 1.037 -11.470 -16.116 1.00 3.18 O ATOM 1964 CG2 THR A 143 -0.132 -10.951 -18.159 1.00 3.44 C ATOM 0 H THR A 143 0.595 -9.205 -15.913 1.00 3.24 H new ATOM 0 HA THR A 143 -2.030 -10.232 -16.516 1.00 2.78 H new ATOM 0 HB THR A 143 -0.700 -12.415 -16.689 1.00 2.82 H new ATOM 0 HG1 THR A 143 1.603 -12.095 -16.615 1.00 3.18 H new ATOM 0 HG21 THR A 143 0.498 -11.645 -18.715 1.00 3.44 H new ATOM 0 HG22 THR A 143 -1.122 -10.915 -18.614 1.00 3.44 H new ATOM 0 HG23 THR A 143 0.315 -9.957 -18.183 1.00 3.44 H new ATOM 1972 N THR A 144 -0.687 -10.977 -13.603 1.00 2.86 N ATOM 1973 CA THR A 144 -1.061 -11.550 -12.285 1.00 2.73 C ATOM 1974 C THR A 144 -2.128 -10.652 -11.666 1.00 2.55 C ATOM 1975 O THR A 144 -2.953 -11.091 -10.893 1.00 2.19 O ATOM 1976 CB THR A 144 0.162 -11.614 -11.372 1.00 3.16 C ATOM 1977 OG1 THR A 144 1.179 -12.383 -12.001 1.00 3.17 O ATOM 1978 CG2 THR A 144 -0.226 -12.268 -10.048 1.00 3.21 C ATOM 0 H THR A 144 0.233 -10.539 -13.650 1.00 2.86 H new ATOM 0 HA THR A 144 -1.444 -12.563 -12.411 1.00 2.73 H new ATOM 0 HB THR A 144 0.531 -10.606 -11.184 1.00 3.16 H new ATOM 0 HG1 THR A 144 1.905 -11.792 -12.289 1.00 3.17 H new ATOM 0 HG21 THR A 144 0.646 -12.314 -9.396 1.00 3.21 H new ATOM 0 HG22 THR A 144 -1.008 -11.680 -9.567 1.00 3.21 H new ATOM 0 HG23 THR A 144 -0.593 -13.277 -10.235 1.00 3.21 H new ATOM 1986 N ASN A 145 -2.126 -9.394 -12.021 1.00 2.86 N ATOM 1987 CA ASN A 145 -3.151 -8.464 -11.478 1.00 2.82 C ATOM 1988 C ASN A 145 -4.515 -8.878 -12.036 1.00 2.32 C ATOM 1989 O ASN A 145 -5.530 -8.717 -11.401 1.00 2.06 O ATOM 1990 CB ASN A 145 -2.800 -7.025 -11.899 1.00 3.40 C ATOM 1991 CG ASN A 145 -4.014 -6.091 -11.753 1.00 5.24 C ATOM 1992 OD1 ASN A 145 -4.140 -5.128 -12.482 1.00 6.88 O ATOM 1993 ND2 ASN A 145 -4.915 -6.337 -10.840 1.00 5.10 N ATOM 0 H ASN A 145 -1.456 -8.973 -12.665 1.00 2.86 H new ATOM 0 HA ASN A 145 -3.180 -8.506 -10.389 1.00 2.82 H new ATOM 0 HB2 ASN A 145 -1.977 -6.655 -11.287 1.00 3.40 H new ATOM 0 HB3 ASN A 145 -2.456 -7.020 -12.933 1.00 3.40 H new ATOM 0 HD21 ASN A 145 -5.722 -5.721 -10.741 1.00 5.10 H new ATOM 0 HD22 ASN A 145 -4.812 -7.145 -10.226 1.00 5.10 H new ATOM 2000 N ALA A 146 -4.553 -9.421 -13.215 1.00 2.29 N ATOM 2001 CA ALA A 146 -5.864 -9.841 -13.773 1.00 1.92 C ATOM 2002 C ALA A 146 -6.464 -10.910 -12.864 1.00 1.34 C ATOM 2003 O ALA A 146 -7.665 -11.041 -12.752 1.00 1.20 O ATOM 2004 CB ALA A 146 -5.669 -10.407 -15.181 1.00 1.90 C ATOM 0 H ALA A 146 -3.744 -9.591 -13.812 1.00 2.29 H new ATOM 0 HA ALA A 146 -6.535 -8.984 -13.828 1.00 1.92 H new ATOM 0 HB1 ALA A 146 -6.633 -10.714 -15.587 1.00 1.90 H new ATOM 0 HB2 ALA A 146 -5.232 -9.642 -15.823 1.00 1.90 H new ATOM 0 HB3 ALA A 146 -5.003 -11.269 -15.138 1.00 1.90 H new ATOM 2010 N SER A 147 -5.634 -11.671 -12.206 1.00 1.23 N ATOM 2011 CA SER A 147 -6.162 -12.728 -11.295 1.00 0.88 C ATOM 2012 C SER A 147 -6.559 -12.098 -9.954 1.00 0.88 C ATOM 2013 O SER A 147 -7.682 -12.227 -9.506 1.00 0.79 O ATOM 2014 CB SER A 147 -5.087 -13.792 -11.063 1.00 1.26 C ATOM 2015 OG SER A 147 -5.583 -15.057 -11.482 1.00 1.41 O ATOM 0 H SER A 147 -4.617 -11.608 -12.258 1.00 1.23 H new ATOM 0 HA SER A 147 -7.037 -13.193 -11.750 1.00 0.88 H new ATOM 0 HB2 SER A 147 -4.183 -13.540 -11.618 1.00 1.26 H new ATOM 0 HB3 SER A 147 -4.814 -13.826 -10.008 1.00 1.26 H new ATOM 0 HG SER A 147 -4.897 -15.742 -11.337 1.00 1.41 H new ATOM 2021 N LEU A 148 -5.652 -11.408 -9.311 1.00 0.98 N ATOM 2022 CA LEU A 148 -5.983 -10.760 -8.001 1.00 0.97 C ATOM 2023 C LEU A 148 -7.298 -10.002 -8.137 1.00 0.68 C ATOM 2024 O LEU A 148 -8.236 -10.223 -7.404 1.00 0.56 O ATOM 2025 CB LEU A 148 -4.878 -9.767 -7.634 1.00 1.52 C ATOM 2026 CG LEU A 148 -4.704 -9.718 -6.110 1.00 0.72 C ATOM 2027 CD1 LEU A 148 -6.000 -9.242 -5.443 1.00 1.45 C ATOM 2028 CD2 LEU A 148 -4.359 -11.115 -5.596 1.00 1.75 C ATOM 0 H LEU A 148 -4.696 -11.264 -9.635 1.00 0.98 H new ATOM 0 HA LEU A 148 -6.069 -11.523 -7.227 1.00 0.97 H new ATOM 0 HB2 LEU A 148 -3.941 -10.062 -8.106 1.00 1.52 H new ATOM 0 HB3 LEU A 148 -5.128 -8.776 -8.012 1.00 1.52 H new ATOM 0 HG LEU A 148 -3.901 -9.022 -5.867 1.00 0.72 H new ATOM 0 HD11 LEU A 148 -5.863 -9.212 -4.362 1.00 1.45 H new ATOM 0 HD12 LEU A 148 -6.251 -8.245 -5.805 1.00 1.45 H new ATOM 0 HD13 LEU A 148 -6.809 -9.931 -5.687 1.00 1.45 H new ATOM 0 HD21 LEU A 148 -4.235 -11.084 -4.514 1.00 1.75 H new ATOM 0 HD22 LEU A 148 -5.164 -11.805 -5.849 1.00 1.75 H new ATOM 0 HD23 LEU A 148 -3.432 -11.454 -6.058 1.00 1.75 H new ATOM 2040 N LEU A 149 -7.352 -9.114 -9.084 1.00 0.90 N ATOM 2041 CA LEU A 149 -8.578 -8.309 -9.326 1.00 1.08 C ATOM 2042 C LEU A 149 -9.767 -9.226 -9.632 1.00 0.95 C ATOM 2043 O LEU A 149 -10.862 -8.989 -9.173 1.00 1.13 O ATOM 2044 CB LEU A 149 -8.330 -7.383 -10.527 1.00 1.51 C ATOM 2045 CG LEU A 149 -8.472 -5.905 -10.127 1.00 0.83 C ATOM 2046 CD1 LEU A 149 -7.721 -5.626 -8.820 1.00 0.35 C ATOM 2047 CD2 LEU A 149 -7.882 -5.033 -11.238 1.00 0.96 C ATOM 0 H LEU A 149 -6.579 -8.907 -9.716 1.00 0.90 H new ATOM 0 HA LEU A 149 -8.807 -7.724 -8.435 1.00 1.08 H new ATOM 0 HB2 LEU A 149 -7.331 -7.560 -10.926 1.00 1.51 H new ATOM 0 HB3 LEU A 149 -9.038 -7.617 -11.322 1.00 1.51 H new ATOM 0 HG LEU A 149 -9.528 -5.676 -9.981 1.00 0.83 H new ATOM 0 HD11 LEU A 149 -7.833 -4.575 -8.553 1.00 0.35 H new ATOM 0 HD12 LEU A 149 -8.131 -6.248 -8.025 1.00 0.35 H new ATOM 0 HD13 LEU A 149 -6.664 -5.856 -8.952 1.00 0.35 H new ATOM 0 HD21 LEU A 149 -7.977 -3.982 -10.965 1.00 0.96 H new ATOM 0 HD22 LEU A 149 -6.829 -5.279 -11.373 1.00 0.96 H new ATOM 0 HD23 LEU A 149 -8.419 -5.216 -12.168 1.00 0.96 H new ATOM 2059 N THR A 150 -9.584 -10.268 -10.405 1.00 0.81 N ATOM 2060 CA THR A 150 -10.746 -11.161 -10.705 1.00 0.87 C ATOM 2061 C THR A 150 -11.385 -11.596 -9.376 1.00 0.69 C ATOM 2062 O THR A 150 -12.559 -11.903 -9.301 1.00 0.81 O ATOM 2063 CB THR A 150 -10.282 -12.376 -11.546 1.00 0.88 C ATOM 2064 OG1 THR A 150 -11.391 -12.885 -12.272 1.00 1.64 O ATOM 2065 CG2 THR A 150 -9.702 -13.498 -10.671 1.00 0.94 C ATOM 0 H THR A 150 -8.698 -10.536 -10.834 1.00 0.81 H new ATOM 0 HA THR A 150 -11.493 -10.629 -11.295 1.00 0.87 H new ATOM 0 HB THR A 150 -9.495 -12.035 -12.219 1.00 0.88 H new ATOM 0 HG1 THR A 150 -11.106 -13.654 -12.809 1.00 1.64 H new ATOM 0 HG21 THR A 150 -9.390 -14.329 -11.304 1.00 0.94 H new ATOM 0 HG22 THR A 150 -8.842 -13.120 -10.118 1.00 0.94 H new ATOM 0 HG23 THR A 150 -10.462 -13.842 -9.969 1.00 0.94 H new ATOM 2073 N LYS A 151 -10.603 -11.611 -8.328 1.00 0.43 N ATOM 2074 CA LYS A 151 -11.133 -12.010 -6.993 1.00 0.25 C ATOM 2075 C LYS A 151 -11.537 -10.771 -6.172 1.00 0.12 C ATOM 2076 O LYS A 151 -12.384 -10.858 -5.304 1.00 0.42 O ATOM 2077 CB LYS A 151 -10.060 -12.789 -6.232 1.00 0.19 C ATOM 2078 CG LYS A 151 -10.626 -13.254 -4.889 1.00 0.25 C ATOM 2079 CD LYS A 151 -9.849 -12.591 -3.750 1.00 0.79 C ATOM 2080 CE LYS A 151 -8.629 -13.445 -3.402 1.00 1.34 C ATOM 2081 NZ LYS A 151 -8.577 -13.659 -1.929 1.00 1.59 N ATOM 0 H LYS A 151 -9.614 -11.362 -8.341 1.00 0.43 H new ATOM 0 HA LYS A 151 -12.014 -12.634 -7.143 1.00 0.25 H new ATOM 0 HB2 LYS A 151 -9.734 -13.648 -6.819 1.00 0.19 H new ATOM 0 HB3 LYS A 151 -9.184 -12.161 -6.072 1.00 0.19 H new ATOM 0 HG2 LYS A 151 -11.683 -12.998 -4.820 1.00 0.25 H new ATOM 0 HG3 LYS A 151 -10.555 -14.339 -4.809 1.00 0.25 H new ATOM 0 HD2 LYS A 151 -9.534 -11.590 -4.045 1.00 0.79 H new ATOM 0 HD3 LYS A 151 -10.490 -12.479 -2.875 1.00 0.79 H new ATOM 0 HE2 LYS A 151 -8.684 -14.404 -3.918 1.00 1.34 H new ATOM 0 HE3 LYS A 151 -7.718 -12.952 -3.741 1.00 1.34 H new ATOM 0 HZ1 LYS A 151 -7.748 -14.240 -1.692 1.00 1.59 H new ATOM 0 HZ2 LYS A 151 -8.506 -12.740 -1.447 1.00 1.59 H new ATOM 0 HZ3 LYS A 151 -9.441 -14.147 -1.618 1.00 1.59 H new ATOM 2095 N LEU A 152 -10.965 -9.614 -6.432 1.00 0.30 N ATOM 2096 CA LEU A 152 -11.370 -8.409 -5.648 1.00 0.28 C ATOM 2097 C LEU A 152 -12.724 -7.961 -6.171 1.00 0.20 C ATOM 2098 O LEU A 152 -13.705 -7.917 -5.457 1.00 0.41 O ATOM 2099 CB LEU A 152 -10.370 -7.255 -5.842 1.00 0.57 C ATOM 2100 CG LEU A 152 -8.924 -7.746 -5.741 1.00 0.54 C ATOM 2101 CD1 LEU A 152 -7.980 -6.541 -5.727 1.00 0.36 C ATOM 2102 CD2 LEU A 152 -8.727 -8.546 -4.454 1.00 0.57 C ATOM 0 H LEU A 152 -10.248 -9.458 -7.141 1.00 0.30 H new ATOM 0 HA LEU A 152 -11.401 -8.662 -4.588 1.00 0.28 H new ATOM 0 HB2 LEU A 152 -10.531 -6.792 -6.815 1.00 0.57 H new ATOM 0 HB3 LEU A 152 -10.548 -6.487 -5.090 1.00 0.57 H new ATOM 0 HG LEU A 152 -8.707 -8.384 -6.598 1.00 0.54 H new ATOM 0 HD11 LEU A 152 -6.949 -6.887 -5.655 1.00 0.36 H new ATOM 0 HD12 LEU A 152 -8.107 -5.968 -6.646 1.00 0.36 H new ATOM 0 HD13 LEU A 152 -8.211 -5.908 -4.870 1.00 0.36 H new ATOM 0 HD21 LEU A 152 -7.694 -8.890 -4.394 1.00 0.57 H new ATOM 0 HD22 LEU A 152 -8.950 -7.913 -3.595 1.00 0.57 H new ATOM 0 HD23 LEU A 152 -9.396 -9.406 -4.454 1.00 0.57 H new ATOM 2114 N GLN A 153 -12.772 -7.626 -7.425 1.00 0.36 N ATOM 2115 CA GLN A 153 -14.044 -7.176 -8.036 1.00 0.43 C ATOM 2116 C GLN A 153 -15.126 -8.250 -7.861 1.00 0.57 C ATOM 2117 O GLN A 153 -16.284 -7.947 -7.652 1.00 0.94 O ATOM 2118 CB GLN A 153 -13.820 -6.922 -9.527 1.00 0.61 C ATOM 2119 CG GLN A 153 -13.080 -5.598 -9.713 1.00 0.48 C ATOM 2120 CD GLN A 153 -13.231 -5.126 -11.160 1.00 0.67 C ATOM 2121 OE1 GLN A 153 -13.850 -4.114 -11.420 1.00 0.81 O ATOM 2122 NE2 GLN A 153 -12.687 -5.823 -12.120 1.00 1.86 N ATOM 0 H GLN A 153 -11.974 -7.645 -8.059 1.00 0.36 H new ATOM 0 HA GLN A 153 -14.372 -6.260 -7.545 1.00 0.43 H new ATOM 0 HB2 GLN A 153 -13.243 -7.738 -9.963 1.00 0.61 H new ATOM 0 HB3 GLN A 153 -14.776 -6.893 -10.049 1.00 0.61 H new ATOM 0 HG2 GLN A 153 -13.480 -4.847 -9.031 1.00 0.48 H new ATOM 0 HG3 GLN A 153 -12.025 -5.722 -9.468 1.00 0.48 H new ATOM 0 HE21 GLN A 153 -12.167 -6.673 -11.902 1.00 1.86 H new ATOM 0 HE22 GLN A 153 -12.782 -5.518 -13.089 1.00 1.86 H new ATOM 2131 N ALA A 154 -14.761 -9.501 -7.957 1.00 0.42 N ATOM 2132 CA ALA A 154 -15.770 -10.593 -7.811 1.00 0.54 C ATOM 2133 C ALA A 154 -16.564 -10.406 -6.516 1.00 0.74 C ATOM 2134 O ALA A 154 -17.731 -10.735 -6.440 1.00 1.43 O ATOM 2135 CB ALA A 154 -15.056 -11.946 -7.779 1.00 0.81 C ATOM 0 H ALA A 154 -13.806 -9.815 -8.131 1.00 0.42 H new ATOM 0 HA ALA A 154 -16.456 -10.559 -8.658 1.00 0.54 H new ATOM 0 HB1 ALA A 154 -15.792 -12.743 -7.672 1.00 0.81 H new ATOM 0 HB2 ALA A 154 -14.501 -12.086 -8.706 1.00 0.81 H new ATOM 0 HB3 ALA A 154 -14.366 -11.974 -6.935 1.00 0.81 H new ATOM 2141 N GLN A 155 -15.938 -9.888 -5.496 1.00 0.55 N ATOM 2142 CA GLN A 155 -16.647 -9.681 -4.197 1.00 0.72 C ATOM 2143 C GLN A 155 -17.998 -8.998 -4.430 1.00 0.63 C ATOM 2144 O GLN A 155 -18.169 -8.234 -5.360 1.00 0.67 O ATOM 2145 CB GLN A 155 -15.789 -8.798 -3.290 1.00 0.81 C ATOM 2146 CG GLN A 155 -14.541 -9.565 -2.852 1.00 0.94 C ATOM 2147 CD GLN A 155 -14.947 -10.727 -1.944 1.00 0.94 C ATOM 2148 OE1 GLN A 155 -16.082 -10.817 -1.523 1.00 1.80 O ATOM 2149 NE2 GLN A 155 -14.059 -11.627 -1.625 1.00 0.92 N ATOM 0 H GLN A 155 -14.960 -9.597 -5.504 1.00 0.55 H new ATOM 0 HA GLN A 155 -16.815 -10.650 -3.728 1.00 0.72 H new ATOM 0 HB2 GLN A 155 -15.502 -7.889 -3.818 1.00 0.81 H new ATOM 0 HB3 GLN A 155 -16.364 -8.491 -2.416 1.00 0.81 H new ATOM 0 HG2 GLN A 155 -14.008 -9.941 -3.725 1.00 0.94 H new ATOM 0 HG3 GLN A 155 -13.859 -8.899 -2.324 1.00 0.94 H new ATOM 0 HE21 GLN A 155 -13.106 -11.551 -1.979 1.00 0.92 H new ATOM 0 HE22 GLN A 155 -14.318 -12.407 -1.021 1.00 0.92 H new ATOM 2158 N ASN A 156 -18.958 -9.263 -3.584 1.00 0.53 N ATOM 2159 CA ASN A 156 -20.295 -8.626 -3.745 1.00 0.48 C ATOM 2160 C ASN A 156 -20.167 -7.125 -3.481 1.00 0.51 C ATOM 2161 O ASN A 156 -19.088 -6.618 -3.264 1.00 0.61 O ATOM 2162 CB ASN A 156 -21.274 -9.238 -2.741 1.00 0.44 C ATOM 2163 CG ASN A 156 -22.018 -10.405 -3.395 1.00 0.70 C ATOM 2164 OD1 ASN A 156 -22.194 -10.431 -4.597 1.00 1.11 O ATOM 2165 ND2 ASN A 156 -22.466 -11.377 -2.648 1.00 0.94 N ATOM 0 H ASN A 156 -18.872 -9.894 -2.788 1.00 0.53 H new ATOM 0 HA ASN A 156 -20.664 -8.792 -4.757 1.00 0.48 H new ATOM 0 HB2 ASN A 156 -20.736 -9.585 -1.859 1.00 0.44 H new ATOM 0 HB3 ASN A 156 -21.985 -8.483 -2.405 1.00 0.44 H new ATOM 0 HD21 ASN A 156 -22.964 -12.159 -3.073 1.00 0.94 H new ATOM 0 HD22 ASN A 156 -22.318 -11.355 -1.639 1.00 0.94 H new ATOM 2172 N GLN A 157 -21.257 -6.412 -3.487 1.00 0.62 N ATOM 2173 CA GLN A 157 -21.183 -4.950 -3.219 1.00 0.68 C ATOM 2174 C GLN A 157 -20.711 -4.747 -1.781 1.00 0.65 C ATOM 2175 O GLN A 157 -20.074 -3.766 -1.450 1.00 0.75 O ATOM 2176 CB GLN A 157 -22.568 -4.329 -3.395 1.00 0.72 C ATOM 2177 CG GLN A 157 -22.482 -2.818 -3.173 1.00 1.04 C ATOM 2178 CD GLN A 157 -22.540 -2.101 -4.523 1.00 0.91 C ATOM 2179 OE1 GLN A 157 -21.532 -1.654 -5.031 1.00 1.98 O ATOM 2180 NE2 GLN A 157 -23.688 -1.974 -5.132 1.00 1.01 N ATOM 0 H GLN A 157 -22.193 -6.776 -3.665 1.00 0.62 H new ATOM 0 HA GLN A 157 -20.489 -4.475 -3.912 1.00 0.68 H new ATOM 0 HB2 GLN A 157 -22.948 -4.539 -4.395 1.00 0.72 H new ATOM 0 HB3 GLN A 157 -23.269 -4.772 -2.688 1.00 0.72 H new ATOM 0 HG2 GLN A 157 -23.302 -2.486 -2.537 1.00 1.04 H new ATOM 0 HG3 GLN A 157 -21.556 -2.568 -2.656 1.00 1.04 H new ATOM 0 HE21 GLN A 157 -24.535 -2.349 -4.706 1.00 1.01 H new ATOM 0 HE22 GLN A 157 -23.737 -1.500 -6.034 1.00 1.01 H new ATOM 2189 N TRP A 158 -21.025 -5.680 -0.927 1.00 0.51 N ATOM 2190 CA TRP A 158 -20.609 -5.581 0.498 1.00 0.49 C ATOM 2191 C TRP A 158 -19.097 -5.801 0.607 1.00 0.45 C ATOM 2192 O TRP A 158 -18.348 -4.917 0.987 1.00 0.44 O ATOM 2193 CB TRP A 158 -21.334 -6.666 1.292 1.00 0.43 C ATOM 2194 CG TRP A 158 -21.173 -6.416 2.756 1.00 0.57 C ATOM 2195 CD1 TRP A 158 -20.009 -6.513 3.436 1.00 0.57 C ATOM 2196 CD2 TRP A 158 -22.187 -6.032 3.729 1.00 0.84 C ATOM 2197 NE1 TRP A 158 -20.243 -6.214 4.767 1.00 0.72 N ATOM 2198 CE2 TRP A 158 -21.571 -5.913 4.997 1.00 0.90 C ATOM 2199 CE3 TRP A 158 -23.568 -5.782 3.636 1.00 1.08 C ATOM 2200 CZ2 TRP A 158 -22.299 -5.553 6.131 1.00 1.16 C ATOM 2201 CZ3 TRP A 158 -24.304 -5.421 4.776 1.00 1.37 C ATOM 2202 CH2 TRP A 158 -23.670 -5.308 6.022 1.00 1.40 C ATOM 0 H TRP A 158 -21.559 -6.517 -1.160 1.00 0.51 H new ATOM 0 HA TRP A 158 -20.858 -4.595 0.891 1.00 0.49 H new ATOM 0 HB2 TRP A 158 -22.392 -6.676 1.030 1.00 0.43 H new ATOM 0 HB3 TRP A 158 -20.933 -7.646 1.035 1.00 0.43 H new ATOM 0 HD1 TRP A 158 -19.053 -6.780 3.011 1.00 0.57 H new ATOM 0 HE1 TRP A 158 -19.523 -6.216 5.489 1.00 0.72 H new ATOM 0 HE3 TRP A 158 -24.066 -5.868 2.681 1.00 1.08 H new ATOM 0 HZ2 TRP A 158 -21.806 -5.464 7.088 1.00 1.16 H new ATOM 0 HZ3 TRP A 158 -25.364 -5.229 4.693 1.00 1.37 H new ATOM 0 HH2 TRP A 158 -24.241 -5.032 6.896 1.00 1.40 H new ATOM 2213 N LEU A 159 -18.642 -6.980 0.274 1.00 0.44 N ATOM 2214 CA LEU A 159 -17.183 -7.269 0.355 1.00 0.41 C ATOM 2215 C LEU A 159 -16.416 -6.369 -0.618 1.00 0.39 C ATOM 2216 O LEU A 159 -15.208 -6.266 -0.551 1.00 0.29 O ATOM 2217 CB LEU A 159 -16.931 -8.736 0.003 1.00 0.43 C ATOM 2218 CG LEU A 159 -17.401 -9.625 1.155 1.00 0.61 C ATOM 2219 CD1 LEU A 159 -18.566 -10.498 0.686 1.00 1.43 C ATOM 2220 CD2 LEU A 159 -16.248 -10.520 1.615 1.00 0.65 C ATOM 0 H LEU A 159 -19.220 -7.755 -0.051 1.00 0.44 H new ATOM 0 HA LEU A 159 -16.837 -7.073 1.370 1.00 0.41 H new ATOM 0 HB2 LEU A 159 -17.462 -8.998 -0.912 1.00 0.43 H new ATOM 0 HB3 LEU A 159 -15.870 -8.899 -0.186 1.00 0.43 H new ATOM 0 HG LEU A 159 -17.728 -8.998 1.984 1.00 0.61 H new ATOM 0 HD11 LEU A 159 -18.900 -11.131 1.508 1.00 1.43 H new ATOM 0 HD12 LEU A 159 -19.389 -9.862 0.360 1.00 1.43 H new ATOM 0 HD13 LEU A 159 -18.240 -11.124 -0.145 1.00 1.43 H new ATOM 0 HD21 LEU A 159 -16.584 -11.153 2.436 1.00 0.65 H new ATOM 0 HD22 LEU A 159 -15.920 -11.146 0.785 1.00 0.65 H new ATOM 0 HD23 LEU A 159 -15.418 -9.899 1.952 1.00 0.65 H new ATOM 2232 N GLN A 160 -17.097 -5.710 -1.519 1.00 0.54 N ATOM 2233 CA GLN A 160 -16.386 -4.818 -2.472 1.00 0.52 C ATOM 2234 C GLN A 160 -15.962 -3.556 -1.725 1.00 0.47 C ATOM 2235 O GLN A 160 -14.823 -3.137 -1.788 1.00 0.50 O ATOM 2236 CB GLN A 160 -17.318 -4.448 -3.627 1.00 0.69 C ATOM 2237 CG GLN A 160 -17.044 -5.376 -4.812 1.00 0.70 C ATOM 2238 CD GLN A 160 -17.893 -4.945 -6.008 1.00 1.15 C ATOM 2239 OE1 GLN A 160 -18.924 -5.529 -6.276 1.00 2.33 O ATOM 2240 NE2 GLN A 160 -17.501 -3.941 -6.742 1.00 0.50 N ATOM 0 H GLN A 160 -18.110 -5.753 -1.633 1.00 0.54 H new ATOM 0 HA GLN A 160 -15.510 -5.325 -2.878 1.00 0.52 H new ATOM 0 HB2 GLN A 160 -18.358 -4.537 -3.313 1.00 0.69 H new ATOM 0 HB3 GLN A 160 -17.160 -3.410 -3.919 1.00 0.69 H new ATOM 0 HG2 GLN A 160 -15.986 -5.345 -5.074 1.00 0.70 H new ATOM 0 HG3 GLN A 160 -17.275 -6.406 -4.541 1.00 0.70 H new ATOM 0 HE21 GLN A 160 -16.635 -3.451 -6.516 1.00 0.50 H new ATOM 0 HE22 GLN A 160 -18.060 -3.645 -7.542 1.00 0.50 H new ATOM 2249 N ASP A 161 -16.868 -2.962 -0.997 1.00 0.49 N ATOM 2250 CA ASP A 161 -16.511 -1.743 -0.222 1.00 0.51 C ATOM 2251 C ASP A 161 -15.421 -2.118 0.778 1.00 0.39 C ATOM 2252 O ASP A 161 -14.548 -1.332 1.092 1.00 0.45 O ATOM 2253 CB ASP A 161 -17.744 -1.234 0.527 1.00 0.70 C ATOM 2254 CG ASP A 161 -17.376 0.010 1.339 1.00 1.05 C ATOM 2255 OD1 ASP A 161 -16.323 0.572 1.086 1.00 1.11 O ATOM 2256 OD2 ASP A 161 -18.155 0.381 2.202 1.00 1.43 O ATOM 0 H ASP A 161 -17.837 -3.268 -0.906 1.00 0.49 H new ATOM 0 HA ASP A 161 -16.156 -0.959 -0.890 1.00 0.51 H new ATOM 0 HB2 ASP A 161 -18.539 -0.997 -0.180 1.00 0.70 H new ATOM 0 HB3 ASP A 161 -18.127 -2.012 1.188 1.00 0.70 H new ATOM 2261 N MET A 162 -15.463 -3.325 1.276 1.00 0.29 N ATOM 2262 CA MET A 162 -14.429 -3.770 2.250 1.00 0.34 C ATOM 2263 C MET A 162 -13.060 -3.787 1.552 1.00 0.26 C ATOM 2264 O MET A 162 -12.079 -3.324 2.090 1.00 0.24 O ATOM 2265 CB MET A 162 -14.822 -5.173 2.779 1.00 0.38 C ATOM 2266 CG MET A 162 -13.591 -6.055 3.066 1.00 0.47 C ATOM 2267 SD MET A 162 -12.473 -5.210 4.214 1.00 0.96 S ATOM 2268 CE MET A 162 -10.949 -5.441 3.261 1.00 0.43 C ATOM 0 H MET A 162 -16.172 -4.023 1.048 1.00 0.29 H new ATOM 0 HA MET A 162 -14.366 -3.088 3.098 1.00 0.34 H new ATOM 0 HB2 MET A 162 -15.409 -5.064 3.691 1.00 0.38 H new ATOM 0 HB3 MET A 162 -15.459 -5.669 2.047 1.00 0.38 H new ATOM 0 HG2 MET A 162 -13.908 -7.008 3.490 1.00 0.47 H new ATOM 0 HG3 MET A 162 -13.069 -6.278 2.136 1.00 0.47 H new ATOM 0 HE1 MET A 162 -10.224 -5.991 3.861 1.00 0.43 H new ATOM 0 HE2 MET A 162 -11.169 -6.002 2.353 1.00 0.43 H new ATOM 0 HE3 MET A 162 -10.535 -4.468 2.995 1.00 0.43 H new ATOM 2278 N THR A 163 -12.985 -4.330 0.369 1.00 0.25 N ATOM 2279 CA THR A 163 -11.675 -4.390 -0.349 1.00 0.22 C ATOM 2280 C THR A 163 -10.970 -3.028 -0.307 1.00 0.21 C ATOM 2281 O THR A 163 -9.964 -2.862 0.354 1.00 0.30 O ATOM 2282 CB THR A 163 -11.915 -4.796 -1.803 1.00 0.20 C ATOM 2283 OG1 THR A 163 -12.593 -6.045 -1.839 1.00 0.22 O ATOM 2284 CG2 THR A 163 -10.575 -4.921 -2.529 1.00 0.23 C ATOM 0 H THR A 163 -13.774 -4.736 -0.135 1.00 0.25 H new ATOM 0 HA THR A 163 -11.038 -5.125 0.143 1.00 0.22 H new ATOM 0 HB THR A 163 -12.523 -4.037 -2.296 1.00 0.20 H new ATOM 0 HG1 THR A 163 -13.510 -5.929 -1.513 1.00 0.22 H new ATOM 0 HG21 THR A 163 -10.748 -5.211 -3.565 1.00 0.23 H new ATOM 0 HG22 THR A 163 -10.056 -3.963 -2.502 1.00 0.23 H new ATOM 0 HG23 THR A 163 -9.964 -5.679 -2.038 1.00 0.23 H new ATOM 2292 N THR A 164 -11.481 -2.056 -1.012 1.00 0.40 N ATOM 2293 CA THR A 164 -10.830 -0.710 -1.020 1.00 0.42 C ATOM 2294 C THR A 164 -10.542 -0.239 0.411 1.00 0.36 C ATOM 2295 O THR A 164 -9.584 0.468 0.659 1.00 0.32 O ATOM 2296 CB THR A 164 -11.758 0.298 -1.705 1.00 0.53 C ATOM 2297 OG1 THR A 164 -11.189 1.597 -1.617 1.00 1.42 O ATOM 2298 CG2 THR A 164 -13.124 0.289 -1.015 1.00 1.52 C ATOM 0 H THR A 164 -12.322 -2.133 -1.584 1.00 0.40 H new ATOM 0 HA THR A 164 -9.887 -0.782 -1.563 1.00 0.42 H new ATOM 0 HB THR A 164 -11.882 0.025 -2.753 1.00 0.53 H new ATOM 0 HG1 THR A 164 -11.780 2.244 -2.056 1.00 1.42 H new ATOM 0 HG21 THR A 164 -13.783 1.007 -1.503 1.00 1.52 H new ATOM 0 HG22 THR A 164 -13.559 -0.708 -1.083 1.00 1.52 H new ATOM 0 HG23 THR A 164 -13.004 0.562 0.033 1.00 1.52 H new ATOM 2306 N HIS A 165 -11.365 -0.610 1.352 1.00 0.37 N ATOM 2307 CA HIS A 165 -11.139 -0.164 2.758 1.00 0.34 C ATOM 2308 C HIS A 165 -9.781 -0.675 3.263 1.00 0.27 C ATOM 2309 O HIS A 165 -8.868 0.095 3.491 1.00 0.38 O ATOM 2310 CB HIS A 165 -12.268 -0.696 3.653 1.00 0.33 C ATOM 2311 CG HIS A 165 -11.975 -0.384 5.097 1.00 0.23 C ATOM 2312 ND1 HIS A 165 -11.445 -1.330 5.959 1.00 0.49 N ATOM 2313 CD2 HIS A 165 -12.127 0.759 5.842 1.00 0.40 C ATOM 2314 CE1 HIS A 165 -11.296 -0.745 7.161 1.00 0.55 C ATOM 2315 NE2 HIS A 165 -11.698 0.528 7.146 1.00 0.43 N ATOM 0 H HIS A 165 -12.184 -1.202 1.210 1.00 0.37 H new ATOM 0 HA HIS A 165 -11.136 0.925 2.792 1.00 0.34 H new ATOM 0 HB2 HIS A 165 -13.217 -0.246 3.361 1.00 0.33 H new ATOM 0 HB3 HIS A 165 -12.372 -1.773 3.519 1.00 0.33 H new ATOM 0 HD2 HIS A 165 -12.520 1.695 5.473 1.00 0.40 H new ATOM 0 HE1 HIS A 165 -10.899 -1.244 8.033 1.00 0.55 H new ATOM 0 HE2 HIS A 165 -11.692 1.189 7.923 1.00 0.43 H new ATOM 2323 N LEU A 166 -9.647 -1.957 3.465 1.00 0.11 N ATOM 2324 CA LEU A 166 -8.354 -2.495 3.982 1.00 0.17 C ATOM 2325 C LEU A 166 -7.187 -2.012 3.121 1.00 0.16 C ATOM 2326 O LEU A 166 -6.073 -1.916 3.594 1.00 0.20 O ATOM 2327 CB LEU A 166 -8.384 -4.022 3.988 1.00 0.26 C ATOM 2328 CG LEU A 166 -7.103 -4.555 4.632 1.00 0.86 C ATOM 2329 CD1 LEU A 166 -7.429 -5.802 5.456 1.00 0.96 C ATOM 2330 CD2 LEU A 166 -6.095 -4.919 3.540 1.00 2.62 C ATOM 0 H LEU A 166 -10.373 -2.654 3.296 1.00 0.11 H new ATOM 0 HA LEU A 166 -8.216 -2.131 5.000 1.00 0.17 H new ATOM 0 HB2 LEU A 166 -9.255 -4.377 4.538 1.00 0.26 H new ATOM 0 HB3 LEU A 166 -8.475 -4.399 2.969 1.00 0.26 H new ATOM 0 HG LEU A 166 -6.677 -3.789 5.280 1.00 0.86 H new ATOM 0 HD11 LEU A 166 -6.517 -6.183 5.916 1.00 0.96 H new ATOM 0 HD12 LEU A 166 -8.148 -5.546 6.234 1.00 0.96 H new ATOM 0 HD13 LEU A 166 -7.855 -6.567 4.806 1.00 0.96 H new ATOM 0 HD21 LEU A 166 -5.182 -5.299 3.999 1.00 2.62 H new ATOM 0 HD22 LEU A 166 -6.521 -5.685 2.892 1.00 2.62 H new ATOM 0 HD23 LEU A 166 -5.862 -4.033 2.949 1.00 2.62 H new ATOM 2342 N ILE A 167 -7.413 -1.701 1.870 1.00 0.20 N ATOM 2343 CA ILE A 167 -6.276 -1.221 1.035 1.00 0.22 C ATOM 2344 C ILE A 167 -5.754 0.077 1.643 1.00 0.22 C ATOM 2345 O ILE A 167 -4.568 0.252 1.836 1.00 0.31 O ATOM 2346 CB ILE A 167 -6.724 -0.974 -0.409 1.00 0.23 C ATOM 2347 CG1 ILE A 167 -7.140 -2.306 -1.042 1.00 0.23 C ATOM 2348 CG2 ILE A 167 -5.558 -0.370 -1.207 1.00 0.28 C ATOM 2349 CD1 ILE A 167 -7.595 -2.070 -2.484 1.00 0.23 C ATOM 0 H ILE A 167 -8.317 -1.757 1.400 1.00 0.20 H new ATOM 0 HA ILE A 167 -5.493 -1.979 1.017 1.00 0.22 H new ATOM 0 HB ILE A 167 -7.568 -0.284 -0.420 1.00 0.23 H new ATOM 0 HG12 ILE A 167 -6.304 -3.005 -1.024 1.00 0.23 H new ATOM 0 HG13 ILE A 167 -7.947 -2.758 -0.465 1.00 0.23 H new ATOM 0 HG21 ILE A 167 -5.874 -0.193 -2.235 1.00 0.28 H new ATOM 0 HG22 ILE A 167 -5.256 0.574 -0.753 1.00 0.28 H new ATOM 0 HG23 ILE A 167 -4.716 -1.062 -1.200 1.00 0.28 H new ATOM 0 HD11 ILE A 167 -7.890 -3.019 -2.932 1.00 0.23 H new ATOM 0 HD12 ILE A 167 -8.444 -1.386 -2.490 1.00 0.23 H new ATOM 0 HD13 ILE A 167 -6.776 -1.637 -3.058 1.00 0.23 H new ATOM 2361 N LEU A 168 -6.634 0.983 1.965 1.00 0.14 N ATOM 2362 CA LEU A 168 -6.189 2.260 2.582 1.00 0.12 C ATOM 2363 C LEU A 168 -5.731 1.988 4.021 1.00 0.08 C ATOM 2364 O LEU A 168 -5.104 2.818 4.649 1.00 0.14 O ATOM 2365 CB LEU A 168 -7.349 3.261 2.591 1.00 0.15 C ATOM 2366 CG LEU A 168 -7.978 3.332 1.195 1.00 0.12 C ATOM 2367 CD1 LEU A 168 -9.499 3.216 1.314 1.00 0.56 C ATOM 2368 CD2 LEU A 168 -7.622 4.669 0.541 1.00 0.39 C ATOM 0 H LEU A 168 -7.641 0.893 1.827 1.00 0.14 H new ATOM 0 HA LEU A 168 -5.363 2.677 2.006 1.00 0.12 H new ATOM 0 HB2 LEU A 168 -8.098 2.959 3.323 1.00 0.15 H new ATOM 0 HB3 LEU A 168 -6.990 4.246 2.890 1.00 0.15 H new ATOM 0 HG LEU A 168 -7.596 2.514 0.584 1.00 0.12 H new ATOM 0 HD11 LEU A 168 -9.947 3.266 0.321 1.00 0.56 H new ATOM 0 HD12 LEU A 168 -9.756 2.265 1.780 1.00 0.56 H new ATOM 0 HD13 LEU A 168 -9.880 4.034 1.926 1.00 0.56 H new ATOM 0 HD21 LEU A 168 -8.069 4.719 -0.452 1.00 0.39 H new ATOM 0 HD22 LEU A 168 -8.004 5.486 1.153 1.00 0.39 H new ATOM 0 HD23 LEU A 168 -6.539 4.755 0.455 1.00 0.39 H new ATOM 2380 N ARG A 169 -6.038 0.827 4.552 1.00 0.09 N ATOM 2381 CA ARG A 169 -5.619 0.507 5.947 1.00 0.09 C ATOM 2382 C ARG A 169 -4.150 0.077 5.957 1.00 0.10 C ATOM 2383 O ARG A 169 -3.412 0.387 6.873 1.00 0.10 O ATOM 2384 CB ARG A 169 -6.485 -0.633 6.491 1.00 0.14 C ATOM 2385 CG ARG A 169 -6.276 -0.761 8.003 1.00 0.55 C ATOM 2386 CD ARG A 169 -7.482 -1.464 8.630 1.00 0.77 C ATOM 2387 NE ARG A 169 -7.308 -1.540 10.108 1.00 0.65 N ATOM 2388 CZ ARG A 169 -7.319 -2.699 10.708 1.00 1.29 C ATOM 2389 NH1 ARG A 169 -8.454 -3.240 11.061 1.00 2.16 N ATOM 2390 NH2 ARG A 169 -6.198 -3.318 10.957 1.00 1.99 N ATOM 0 H ARG A 169 -6.560 0.091 4.077 1.00 0.09 H new ATOM 0 HA ARG A 169 -5.743 1.391 6.573 1.00 0.09 H new ATOM 0 HB2 ARG A 169 -7.536 -0.440 6.274 1.00 0.14 H new ATOM 0 HB3 ARG A 169 -6.224 -1.569 5.997 1.00 0.14 H new ATOM 0 HG2 ARG A 169 -5.366 -1.325 8.208 1.00 0.55 H new ATOM 0 HG3 ARG A 169 -6.146 0.226 8.447 1.00 0.55 H new ATOM 0 HD2 ARG A 169 -8.396 -0.922 8.389 1.00 0.77 H new ATOM 0 HD3 ARG A 169 -7.587 -2.466 8.215 1.00 0.77 H new ATOM 0 HE ARG A 169 -7.180 -0.686 10.651 1.00 0.65 H new ATOM 0 HH11 ARG A 169 -9.331 -2.757 10.868 1.00 2.16 H new ATOM 0 HH12 ARG A 169 -8.463 -4.146 11.530 1.00 2.16 H new ATOM 0 HH21 ARG A 169 -5.311 -2.896 10.683 1.00 1.99 H new ATOM 0 HH22 ARG A 169 -6.209 -4.224 11.426 1.00 1.99 H new ATOM 2404 N SER A 170 -3.709 -0.622 4.943 1.00 0.11 N ATOM 2405 CA SER A 170 -2.292 -1.048 4.905 1.00 0.12 C ATOM 2406 C SER A 170 -1.463 0.133 4.426 1.00 0.16 C ATOM 2407 O SER A 170 -0.435 0.445 4.974 1.00 0.24 O ATOM 2408 CB SER A 170 -2.137 -2.223 3.938 1.00 0.09 C ATOM 2409 OG SER A 170 -1.936 -3.419 4.681 1.00 0.38 O ATOM 0 H SER A 170 -4.273 -0.912 4.144 1.00 0.11 H new ATOM 0 HA SER A 170 -1.959 -1.366 5.893 1.00 0.12 H new ATOM 0 HB2 SER A 170 -3.025 -2.314 3.313 1.00 0.09 H new ATOM 0 HB3 SER A 170 -1.293 -2.050 3.270 1.00 0.09 H new ATOM 0 HG SER A 170 -1.838 -4.175 4.065 1.00 0.38 H new ATOM 2415 N PHE A 171 -1.912 0.817 3.418 1.00 0.14 N ATOM 2416 CA PHE A 171 -1.142 1.990 2.936 1.00 0.20 C ATOM 2417 C PHE A 171 -0.878 2.931 4.110 1.00 0.24 C ATOM 2418 O PHE A 171 0.230 3.351 4.333 1.00 0.25 O ATOM 2419 CB PHE A 171 -1.931 2.707 1.845 1.00 0.22 C ATOM 2420 CG PHE A 171 -1.578 2.082 0.524 1.00 0.20 C ATOM 2421 CD1 PHE A 171 -1.921 0.750 0.269 1.00 0.49 C ATOM 2422 CD2 PHE A 171 -0.891 2.827 -0.439 1.00 0.42 C ATOM 2423 CE1 PHE A 171 -1.581 0.162 -0.953 1.00 0.48 C ATOM 2424 CE2 PHE A 171 -0.548 2.238 -1.660 1.00 0.43 C ATOM 2425 CZ PHE A 171 -0.892 0.906 -1.920 1.00 0.19 C ATOM 0 H PHE A 171 -2.773 0.617 2.909 1.00 0.14 H new ATOM 0 HA PHE A 171 -0.189 1.664 2.519 1.00 0.20 H new ATOM 0 HB2 PHE A 171 -3.002 2.622 2.032 1.00 0.22 H new ATOM 0 HB3 PHE A 171 -1.692 3.770 1.839 1.00 0.22 H new ATOM 0 HD1 PHE A 171 -2.449 0.176 1.016 1.00 0.49 H new ATOM 0 HD2 PHE A 171 -0.626 3.855 -0.240 1.00 0.42 H new ATOM 0 HE1 PHE A 171 -1.849 -0.865 -1.152 1.00 0.48 H new ATOM 0 HE2 PHE A 171 -0.016 2.812 -2.404 1.00 0.43 H new ATOM 0 HZ PHE A 171 -0.627 0.453 -2.864 1.00 0.19 H new ATOM 2435 N LYS A 172 -1.880 3.244 4.881 1.00 0.26 N ATOM 2436 CA LYS A 172 -1.658 4.141 6.048 1.00 0.30 C ATOM 2437 C LYS A 172 -0.609 3.517 6.979 1.00 0.29 C ATOM 2438 O LYS A 172 0.462 4.057 7.178 1.00 0.28 O ATOM 2439 CB LYS A 172 -2.973 4.324 6.809 1.00 0.34 C ATOM 2440 CG LYS A 172 -3.039 5.742 7.384 1.00 0.64 C ATOM 2441 CD LYS A 172 -3.275 6.746 6.253 1.00 0.79 C ATOM 2442 CE LYS A 172 -3.134 8.170 6.797 1.00 1.58 C ATOM 2443 NZ LYS A 172 -4.421 8.600 7.415 1.00 0.53 N ATOM 0 H LYS A 172 -2.839 2.920 4.755 1.00 0.26 H new ATOM 0 HA LYS A 172 -1.303 5.111 5.699 1.00 0.30 H new ATOM 0 HB2 LYS A 172 -3.818 4.151 6.143 1.00 0.34 H new ATOM 0 HB3 LYS A 172 -3.045 3.591 7.612 1.00 0.34 H new ATOM 0 HG2 LYS A 172 -3.842 5.810 8.118 1.00 0.64 H new ATOM 0 HG3 LYS A 172 -2.111 5.977 7.905 1.00 0.64 H new ATOM 0 HD2 LYS A 172 -2.558 6.580 5.449 1.00 0.79 H new ATOM 0 HD3 LYS A 172 -4.269 6.604 5.828 1.00 0.79 H new ATOM 0 HE2 LYS A 172 -2.333 8.210 7.535 1.00 1.58 H new ATOM 0 HE3 LYS A 172 -2.860 8.852 5.992 1.00 1.58 H new ATOM 0 HZ1 LYS A 172 -4.323 9.567 7.784 1.00 0.53 H new ATOM 0 HZ2 LYS A 172 -5.175 8.577 6.699 1.00 0.53 H new ATOM 0 HZ3 LYS A 172 -4.664 7.956 8.194 1.00 0.53 H new ATOM 2457 N GLU A 173 -0.914 2.384 7.559 1.00 0.28 N ATOM 2458 CA GLU A 173 0.056 1.730 8.487 1.00 0.25 C ATOM 2459 C GLU A 173 1.273 1.211 7.711 1.00 0.22 C ATOM 2460 O GLU A 173 2.357 1.734 7.840 1.00 0.24 O ATOM 2461 CB GLU A 173 -0.638 0.564 9.198 1.00 0.27 C ATOM 2462 CG GLU A 173 0.251 0.053 10.333 1.00 1.09 C ATOM 2463 CD GLU A 173 -0.549 0.029 11.638 1.00 0.30 C ATOM 2464 OE1 GLU A 173 -0.795 1.094 12.178 1.00 1.69 O ATOM 2465 OE2 GLU A 173 -0.900 -1.054 12.075 1.00 1.22 O ATOM 0 H GLU A 173 -1.793 1.884 7.430 1.00 0.28 H new ATOM 0 HA GLU A 173 0.398 2.461 9.220 1.00 0.25 H new ATOM 0 HB2 GLU A 173 -1.601 0.887 9.594 1.00 0.27 H new ATOM 0 HB3 GLU A 173 -0.839 -0.240 8.490 1.00 0.27 H new ATOM 0 HG2 GLU A 173 0.617 -0.947 10.100 1.00 1.09 H new ATOM 0 HG3 GLU A 173 1.125 0.695 10.442 1.00 1.09 H new ATOM 2472 N PHE A 174 1.093 0.176 6.923 1.00 0.17 N ATOM 2473 CA PHE A 174 2.218 -0.428 6.125 1.00 0.14 C ATOM 2474 C PHE A 174 3.215 0.638 5.631 1.00 0.17 C ATOM 2475 O PHE A 174 4.390 0.585 5.943 1.00 0.18 O ATOM 2476 CB PHE A 174 1.628 -1.162 4.917 1.00 0.12 C ATOM 2477 CG PHE A 174 2.582 -2.228 4.448 1.00 0.13 C ATOM 2478 CD1 PHE A 174 3.779 -1.865 3.827 1.00 0.85 C ATOM 2479 CD2 PHE A 174 2.269 -3.578 4.639 1.00 0.66 C ATOM 2480 CE1 PHE A 174 4.670 -2.855 3.392 1.00 0.86 C ATOM 2481 CE2 PHE A 174 3.159 -4.569 4.206 1.00 0.66 C ATOM 2482 CZ PHE A 174 4.361 -4.207 3.583 1.00 0.20 C ATOM 0 H PHE A 174 0.194 -0.288 6.795 1.00 0.17 H new ATOM 0 HA PHE A 174 2.761 -1.115 6.774 1.00 0.14 H new ATOM 0 HB2 PHE A 174 0.671 -1.610 5.185 1.00 0.12 H new ATOM 0 HB3 PHE A 174 1.434 -0.455 4.110 1.00 0.12 H new ATOM 0 HD1 PHE A 174 4.018 -0.822 3.682 1.00 0.85 H new ATOM 0 HD2 PHE A 174 1.343 -3.856 5.120 1.00 0.66 H new ATOM 0 HE1 PHE A 174 5.595 -2.575 2.910 1.00 0.86 H new ATOM 0 HE2 PHE A 174 2.919 -5.612 4.352 1.00 0.66 H new ATOM 0 HZ PHE A 174 5.049 -4.971 3.250 1.00 0.20 H new ATOM 2492 N LEU A 175 2.771 1.600 4.863 1.00 0.17 N ATOM 2493 CA LEU A 175 3.725 2.641 4.373 1.00 0.20 C ATOM 2494 C LEU A 175 4.381 3.327 5.573 1.00 0.22 C ATOM 2495 O LEU A 175 5.576 3.548 5.596 1.00 0.24 O ATOM 2496 CB LEU A 175 2.980 3.689 3.541 1.00 0.17 C ATOM 2497 CG LEU A 175 2.530 3.084 2.207 1.00 0.18 C ATOM 2498 CD1 LEU A 175 1.361 3.894 1.644 1.00 0.16 C ATOM 2499 CD2 LEU A 175 3.688 3.128 1.207 1.00 0.20 C ATOM 0 H LEU A 175 1.804 1.710 4.557 1.00 0.17 H new ATOM 0 HA LEU A 175 4.484 2.165 3.752 1.00 0.20 H new ATOM 0 HB2 LEU A 175 2.114 4.054 4.093 1.00 0.17 H new ATOM 0 HB3 LEU A 175 3.627 4.547 3.360 1.00 0.17 H new ATOM 0 HG LEU A 175 2.220 2.052 2.370 1.00 0.18 H new ATOM 0 HD11 LEU A 175 1.043 3.462 0.695 1.00 0.16 H new ATOM 0 HD12 LEU A 175 0.530 3.873 2.349 1.00 0.16 H new ATOM 0 HD13 LEU A 175 1.676 4.925 1.486 1.00 0.16 H new ATOM 0 HD21 LEU A 175 3.366 2.697 0.259 1.00 0.20 H new ATOM 0 HD22 LEU A 175 3.994 4.162 1.050 1.00 0.20 H new ATOM 0 HD23 LEU A 175 4.529 2.556 1.599 1.00 0.20 H new ATOM 2511 N GLN A 176 3.610 3.670 6.572 1.00 0.25 N ATOM 2512 CA GLN A 176 4.199 4.342 7.766 1.00 0.27 C ATOM 2513 C GLN A 176 5.334 3.484 8.333 1.00 0.19 C ATOM 2514 O GLN A 176 6.287 3.988 8.892 1.00 0.14 O ATOM 2515 CB GLN A 176 3.119 4.532 8.828 1.00 0.36 C ATOM 2516 CG GLN A 176 2.731 6.009 8.884 1.00 0.52 C ATOM 2517 CD GLN A 176 3.403 6.672 10.087 1.00 1.55 C ATOM 2518 OE1 GLN A 176 4.506 7.172 9.982 1.00 3.03 O ATOM 2519 NE2 GLN A 176 2.783 6.698 11.234 1.00 0.95 N ATOM 0 H GLN A 176 2.603 3.514 6.612 1.00 0.25 H new ATOM 0 HA GLN A 176 4.596 5.315 7.475 1.00 0.27 H new ATOM 0 HB2 GLN A 176 2.247 3.922 8.591 1.00 0.36 H new ATOM 0 HB3 GLN A 176 3.485 4.202 9.800 1.00 0.36 H new ATOM 0 HG2 GLN A 176 3.034 6.510 7.964 1.00 0.52 H new ATOM 0 HG3 GLN A 176 1.648 6.108 8.960 1.00 0.52 H new ATOM 0 HE21 GLN A 176 1.857 6.279 11.323 1.00 0.95 H new ATOM 0 HE22 GLN A 176 3.224 7.138 12.042 1.00 0.95 H new ATOM 2528 N SER A 177 5.240 2.190 8.189 1.00 0.41 N ATOM 2529 CA SER A 177 6.312 1.300 8.712 1.00 0.42 C ATOM 2530 C SER A 177 7.566 1.487 7.863 1.00 0.26 C ATOM 2531 O SER A 177 8.670 1.481 8.363 1.00 0.15 O ATOM 2532 CB SER A 177 5.853 -0.157 8.632 1.00 0.62 C ATOM 2533 OG SER A 177 4.576 -0.284 9.246 1.00 0.99 O ATOM 0 H SER A 177 4.465 1.711 7.731 1.00 0.41 H new ATOM 0 HA SER A 177 6.527 1.551 9.751 1.00 0.42 H new ATOM 0 HB2 SER A 177 5.802 -0.477 7.591 1.00 0.62 H new ATOM 0 HB3 SER A 177 6.574 -0.805 9.130 1.00 0.62 H new ATOM 0 HG SER A 177 4.279 -1.217 9.194 1.00 0.99 H new ATOM 2539 N SER A 178 7.400 1.657 6.580 1.00 0.30 N ATOM 2540 CA SER A 178 8.584 1.854 5.695 1.00 0.29 C ATOM 2541 C SER A 178 9.348 3.101 6.145 1.00 0.27 C ATOM 2542 O SER A 178 10.561 3.117 6.195 1.00 0.43 O ATOM 2543 CB SER A 178 8.114 2.038 4.250 1.00 0.47 C ATOM 2544 OG SER A 178 7.761 3.399 4.036 1.00 1.53 O ATOM 0 H SER A 178 6.497 1.668 6.106 1.00 0.30 H new ATOM 0 HA SER A 178 9.237 0.983 5.756 1.00 0.29 H new ATOM 0 HB2 SER A 178 8.904 1.743 3.559 1.00 0.47 H new ATOM 0 HB3 SER A 178 7.258 1.393 4.050 1.00 0.47 H new ATOM 0 HG SER A 178 6.883 3.576 4.434 1.00 1.53 H new ATOM 2550 N LEU A 179 8.640 4.150 6.467 1.00 0.21 N ATOM 2551 CA LEU A 179 9.310 5.405 6.909 1.00 0.24 C ATOM 2552 C LEU A 179 10.107 5.150 8.194 1.00 0.29 C ATOM 2553 O LEU A 179 11.243 5.562 8.323 1.00 0.36 O ATOM 2554 CB LEU A 179 8.248 6.470 7.183 1.00 0.27 C ATOM 2555 CG LEU A 179 7.803 7.103 5.864 1.00 0.29 C ATOM 2556 CD1 LEU A 179 6.485 6.470 5.410 1.00 0.59 C ATOM 2557 CD2 LEU A 179 7.604 8.606 6.065 1.00 0.28 C ATOM 0 H LEU A 179 7.621 4.191 6.442 1.00 0.21 H new ATOM 0 HA LEU A 179 9.989 5.744 6.126 1.00 0.24 H new ATOM 0 HB2 LEU A 179 7.393 6.023 7.690 1.00 0.27 H new ATOM 0 HB3 LEU A 179 8.649 7.235 7.848 1.00 0.27 H new ATOM 0 HG LEU A 179 8.566 6.934 5.104 1.00 0.29 H new ATOM 0 HD11 LEU A 179 6.169 6.922 4.470 1.00 0.59 H new ATOM 0 HD12 LEU A 179 6.626 5.398 5.268 1.00 0.59 H new ATOM 0 HD13 LEU A 179 5.720 6.638 6.168 1.00 0.59 H new ATOM 0 HD21 LEU A 179 7.287 9.060 5.126 1.00 0.28 H new ATOM 0 HD22 LEU A 179 6.841 8.774 6.825 1.00 0.28 H new ATOM 0 HD23 LEU A 179 8.542 9.057 6.387 1.00 0.28 H new ATOM 2569 N ARG A 180 9.513 4.488 9.150 1.00 0.31 N ATOM 2570 CA ARG A 180 10.226 4.220 10.434 1.00 0.43 C ATOM 2571 C ARG A 180 11.360 3.211 10.214 1.00 0.45 C ATOM 2572 O ARG A 180 12.291 3.132 10.993 1.00 0.58 O ATOM 2573 CB ARG A 180 9.231 3.652 11.450 1.00 0.48 C ATOM 2574 CG ARG A 180 8.752 4.769 12.379 1.00 0.40 C ATOM 2575 CD ARG A 180 7.521 4.298 13.158 1.00 1.11 C ATOM 2576 NE ARG A 180 6.384 5.229 12.907 1.00 2.11 N ATOM 2577 CZ ARG A 180 5.180 4.758 12.731 1.00 3.21 C ATOM 2578 NH1 ARG A 180 4.981 3.767 11.906 1.00 4.15 N ATOM 2579 NH2 ARG A 180 4.172 5.281 13.376 1.00 3.79 N ATOM 0 H ARG A 180 8.563 4.120 9.098 1.00 0.31 H new ATOM 0 HA ARG A 180 10.652 5.152 10.807 1.00 0.43 H new ATOM 0 HB2 ARG A 180 8.382 3.207 10.932 1.00 0.48 H new ATOM 0 HB3 ARG A 180 9.702 2.859 12.031 1.00 0.48 H new ATOM 0 HG2 ARG A 180 9.548 5.047 13.070 1.00 0.40 H new ATOM 0 HG3 ARG A 180 8.509 5.659 11.799 1.00 0.40 H new ATOM 0 HD2 ARG A 180 7.250 3.287 12.854 1.00 1.11 H new ATOM 0 HD3 ARG A 180 7.745 4.261 14.224 1.00 1.11 H new ATOM 0 HE ARG A 180 6.547 6.235 12.873 1.00 2.11 H new ATOM 0 HH11 ARG A 180 5.767 3.360 11.398 1.00 4.15 H new ATOM 0 HH12 ARG A 180 4.040 3.399 11.769 1.00 4.15 H new ATOM 0 HH21 ARG A 180 4.326 6.059 14.018 1.00 3.79 H new ATOM 0 HH22 ARG A 180 3.231 4.912 13.238 1.00 3.79 H new ATOM 2593 N ALA A 181 11.296 2.440 9.164 1.00 0.34 N ATOM 2594 CA ALA A 181 12.370 1.442 8.908 1.00 0.36 C ATOM 2595 C ALA A 181 13.544 2.134 8.222 1.00 0.38 C ATOM 2596 O ALA A 181 14.681 1.725 8.345 1.00 0.50 O ATOM 2597 CB ALA A 181 11.834 0.331 8.004 1.00 0.31 C ATOM 0 H ALA A 181 10.546 2.458 8.473 1.00 0.34 H new ATOM 0 HA ALA A 181 12.699 1.009 9.853 1.00 0.36 H new ATOM 0 HB1 ALA A 181 12.622 -0.399 7.818 1.00 0.31 H new ATOM 0 HB2 ALA A 181 10.992 -0.161 8.492 1.00 0.31 H new ATOM 0 HB3 ALA A 181 11.505 0.759 7.057 1.00 0.31 H new ATOM 2603 N LEU A 182 13.276 3.185 7.502 1.00 0.40 N ATOM 2604 CA LEU A 182 14.372 3.910 6.810 1.00 0.55 C ATOM 2605 C LEU A 182 15.069 4.835 7.807 1.00 0.66 C ATOM 2606 O LEU A 182 16.262 5.052 7.742 1.00 0.80 O ATOM 2607 CB LEU A 182 13.793 4.735 5.662 1.00 0.60 C ATOM 2608 CG LEU A 182 14.118 4.052 4.335 1.00 0.65 C ATOM 2609 CD1 LEU A 182 13.500 2.652 4.313 1.00 1.20 C ATOM 2610 CD2 LEU A 182 13.546 4.879 3.183 1.00 0.44 C ATOM 0 H LEU A 182 12.343 3.573 7.363 1.00 0.40 H new ATOM 0 HA LEU A 182 15.091 3.195 6.411 1.00 0.55 H new ATOM 0 HB2 LEU A 182 12.714 4.834 5.778 1.00 0.60 H new ATOM 0 HB3 LEU A 182 14.209 5.742 5.677 1.00 0.60 H new ATOM 0 HG LEU A 182 15.199 3.972 4.225 1.00 0.65 H new ATOM 0 HD11 LEU A 182 13.733 2.166 3.365 1.00 1.20 H new ATOM 0 HD12 LEU A 182 13.908 2.061 5.133 1.00 1.20 H new ATOM 0 HD13 LEU A 182 12.419 2.730 4.425 1.00 1.20 H new ATOM 0 HD21 LEU A 182 13.778 4.392 2.236 1.00 0.44 H new ATOM 0 HD22 LEU A 182 12.465 4.960 3.295 1.00 0.44 H new ATOM 0 HD23 LEU A 182 13.987 5.876 3.196 1.00 0.44 H new ATOM 2622 N ARG A 183 14.328 5.381 8.731 1.00 0.60 N ATOM 2623 CA ARG A 183 14.939 6.293 9.738 1.00 0.73 C ATOM 2624 C ARG A 183 15.727 5.471 10.758 1.00 0.74 C ATOM 2625 O ARG A 183 16.733 5.910 11.280 1.00 0.80 O ATOM 2626 CB ARG A 183 13.836 7.076 10.455 1.00 0.78 C ATOM 2627 CG ARG A 183 13.886 8.541 10.017 1.00 0.35 C ATOM 2628 CD ARG A 183 12.524 9.195 10.257 1.00 1.27 C ATOM 2629 NE ARG A 183 12.138 9.986 9.054 1.00 2.10 N ATOM 2630 CZ ARG A 183 12.018 11.283 9.136 1.00 2.40 C ATOM 2631 NH1 ARG A 183 10.949 11.806 9.671 1.00 3.08 N ATOM 2632 NH2 ARG A 183 12.965 12.056 8.681 1.00 2.60 N ATOM 0 H ARG A 183 13.324 5.235 8.832 1.00 0.60 H new ATOM 0 HA ARG A 183 15.610 6.990 9.236 1.00 0.73 H new ATOM 0 HB2 ARG A 183 12.861 6.648 10.222 1.00 0.78 H new ATOM 0 HB3 ARG A 183 13.966 7.003 11.535 1.00 0.78 H new ATOM 0 HG2 ARG A 183 14.659 9.071 10.574 1.00 0.35 H new ATOM 0 HG3 ARG A 183 14.151 8.607 8.962 1.00 0.35 H new ATOM 0 HD2 ARG A 183 11.773 8.432 10.461 1.00 1.27 H new ATOM 0 HD3 ARG A 183 12.568 9.842 11.133 1.00 1.27 H new ATOM 0 HE ARG A 183 11.968 9.513 8.166 1.00 2.10 H new ATOM 0 HH11 ARG A 183 10.208 11.201 10.025 1.00 3.08 H new ATOM 0 HH12 ARG A 183 10.855 12.820 9.735 1.00 3.08 H new ATOM 0 HH21 ARG A 183 13.800 11.647 8.261 1.00 2.60 H new ATOM 0 HH22 ARG A 183 12.871 13.070 8.745 1.00 2.60 H new ATOM 2646 N GLN A 184 15.280 4.276 11.047 1.00 0.69 N ATOM 2647 CA GLN A 184 16.010 3.430 12.031 1.00 0.71 C ATOM 2648 C GLN A 184 17.189 2.746 11.336 1.00 0.70 C ATOM 2649 O GLN A 184 18.180 2.413 11.955 1.00 0.69 O ATOM 2650 CB GLN A 184 15.062 2.365 12.590 1.00 0.69 C ATOM 2651 CG GLN A 184 13.928 3.043 13.360 1.00 0.79 C ATOM 2652 CD GLN A 184 14.450 3.531 14.712 1.00 0.80 C ATOM 2653 OE1 GLN A 184 15.107 4.552 14.791 1.00 1.28 O ATOM 2654 NE2 GLN A 184 14.185 2.841 15.787 1.00 1.23 N ATOM 0 H GLN A 184 14.444 3.853 10.644 1.00 0.69 H new ATOM 0 HA GLN A 184 16.378 4.054 12.846 1.00 0.71 H new ATOM 0 HB2 GLN A 184 14.655 1.763 11.777 1.00 0.69 H new ATOM 0 HB3 GLN A 184 15.607 1.687 13.247 1.00 0.69 H new ATOM 0 HG2 GLN A 184 13.535 3.882 12.786 1.00 0.79 H new ATOM 0 HG3 GLN A 184 13.105 2.344 13.507 1.00 0.79 H new ATOM 0 HE21 GLN A 184 13.634 1.985 15.721 1.00 1.23 H new ATOM 0 HE22 GLN A 184 14.529 3.157 16.694 1.00 1.23 H new ATOM 2663 N MET A 185 17.089 2.533 10.052 1.00 0.71 N ATOM 2664 CA MET A 185 18.201 1.870 9.318 1.00 0.70 C ATOM 2665 C MET A 185 19.486 2.684 9.490 1.00 1.01 C ATOM 2666 O MET A 185 20.393 2.191 10.141 1.00 2.26 O ATOM 2667 CB MET A 185 17.849 1.781 7.831 1.00 0.27 C ATOM 2668 CG MET A 185 17.252 0.406 7.527 1.00 0.59 C ATOM 2669 SD MET A 185 16.712 0.349 5.800 1.00 0.37 S ATOM 2670 CE MET A 185 15.107 -0.437 6.084 1.00 0.30 C ATOM 2671 OXT MET A 185 19.541 3.785 8.967 1.00 0.68 O ATOM 0 H MET A 185 16.284 2.790 9.480 1.00 0.71 H new ATOM 0 HA MET A 185 18.351 0.867 9.717 1.00 0.70 H new ATOM 0 HB2 MET A 185 17.138 2.564 7.568 1.00 0.27 H new ATOM 0 HB3 MET A 185 18.741 1.944 7.225 1.00 0.27 H new ATOM 0 HG2 MET A 185 17.992 -0.372 7.713 1.00 0.59 H new ATOM 0 HG3 MET A 185 16.409 0.210 8.189 1.00 0.59 H new ATOM 0 HE1 MET A 185 14.811 -0.993 5.194 1.00 0.30 H new ATOM 0 HE2 MET A 185 15.181 -1.120 6.930 1.00 0.30 H new ATOM 0 HE3 MET A 185 14.360 0.328 6.299 1.00 0.30 H new TER 2681 MET A 185