USER MOD reduce.3.24.130724 H: found=0, std=0, add=1696, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1692 hydrogens (26 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 85 LYS NZ :NH3+ 168:sc= 0.332 (180deg=0.219) USER MOD Set 1.2: B 74 ASN : amide:sc= -0.117 K(o=0.21,f=-0.39!) USER MOD Single : A 1 MET CE :methyl 158:sc= 0 (180deg=-0.755) USER MOD Single : A 1 MET N :NH3+ 170:sc= -0.0664 (180deg=-0.0669) USER MOD Single : A 7 THR OG1 : rot 92:sc= 0.878 USER MOD Single : A 12 SER OG : rot 61:sc= 0.865 USER MOD Single : A 15 THR OG1 : rot 71:sc= 0.997 USER MOD Single : A 18 THR OG1 : rot -132:sc= 0.376 USER MOD Single : A 19 THR OG1 : rot 79:sc= 1.25 USER MOD Single : A 22 THR OG1 : rot 90:sc= 0.419 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 150:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= -0.0114 USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 93:sc= 1.25 USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot -57:sc= 0.14 USER MOD Single : A 59 LYS NZ :NH3+ 155:sc= 0.0265 (180deg=0) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 GLN : amide:sc= -0.0101 X(o=-0.01,f=0) USER MOD Single : A 69 SER OG : rot -48:sc= 0.458 USER MOD Single : A 72 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0818) USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0.05) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 169:sc= 0.762 (180deg=0.69) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000492) USER MOD Single : A 98 LYS NZ :NH3+ 174:sc=-0.000767 (180deg=-0.0637) USER MOD Single : A 99 ANW OAV : rot 179:sc= 0.459! USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -179:sc= 0.475 (180deg=0.469) USER MOD Single : B 7 THR OG1 : rot 104:sc= 0.994 USER MOD Single : B 12 SER OG : rot 68:sc= 0.337 USER MOD Single : B 15 THR OG1 : rot 87:sc= 1.26 USER MOD Single : B 18 THR OG1 : rot 180:sc= -0.323 USER MOD Single : B 19 THR OG1 : rot 88:sc= 1.21 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0 USER MOD Single : B 26 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : B 30 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00184) USER MOD Single : B 32 SER OG : rot -130:sc= -0.0317 USER MOD Single : B 34 SER OG : rot 180:sc= 0 USER MOD Single : B 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 THR OG1 : rot 73:sc= 0.851 USER MOD Single : B 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 45 GLN : amide:sc= 0 K(o=0,f=-3.5!) USER MOD Single : B 48 HIS : no HD1:sc=-0.00326 X(o=-0.0033,f=-0.28) USER MOD Single : B 51 LYS NZ :NH3+ -173:sc= 0.236 (180deg=0.219) USER MOD Single : B 55 SER OG : rot 180:sc= 0 USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD Single : B 66 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 69 SER OG : rot -44:sc= 0.484 USER MOD Single : B 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 76 TYR OH : rot 180:sc= 0 USER MOD Single : B 85 LYS NZ :NH3+ -158:sc= 0.0509 (180deg=0.00405) USER MOD Single : B 89 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0136) USER MOD Single : B 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 97 LYS NZ :NH3+ 172:sc= -0.0022 (180deg=-0.0551) USER MOD Single : B 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 99 ANW OAV : rot 61:sc= 1.84 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 6.669 16.679 7.669 1.00 1.04 N ATOM 2 CA MET A 1 7.480 15.551 7.103 1.00 0.91 C ATOM 3 C MET A 1 7.584 14.335 8.061 1.00 0.73 C ATOM 4 O MET A 1 8.224 13.333 7.711 1.00 0.96 O ATOM 5 CB MET A 1 8.890 16.053 6.700 1.00 1.31 C ATOM 6 CG MET A 1 9.730 16.601 7.860 1.00 1.57 C ATOM 7 SD MET A 1 11.381 17.134 7.364 1.00 2.18 S ATOM 8 CE MET A 1 12.054 17.608 8.956 1.00 2.71 C ATOM 0 H1 MET A 1 6.774 17.519 7.065 1.00 1.04 H new ATOM 0 H2 MET A 1 5.667 16.402 7.705 1.00 1.04 H new ATOM 0 H3 MET A 1 7.002 16.899 8.629 1.00 1.04 H new ATOM 0 HA MET A 1 6.954 15.198 6.216 1.00 0.91 H new ATOM 0 HB2 MET A 1 9.433 15.232 6.232 1.00 1.31 H new ATOM 0 HB3 MET A 1 8.782 16.834 5.947 1.00 1.31 H new ATOM 0 HG2 MET A 1 9.206 17.443 8.312 1.00 1.57 H new ATOM 0 HG3 MET A 1 9.820 15.832 8.628 1.00 1.57 H new ATOM 0 HE1 MET A 1 13.143 17.586 8.912 1.00 2.71 H new ATOM 0 HE2 MET A 1 11.721 18.615 9.207 1.00 2.71 H new ATOM 0 HE3 MET A 1 11.708 16.911 9.719 1.00 2.71 H new ATOM 20 N ALA A 2 6.955 14.418 9.261 1.00 0.77 N ATOM 21 CA ALA A 2 6.975 13.328 10.252 1.00 0.71 C ATOM 22 C ALA A 2 5.588 12.680 10.364 1.00 0.59 C ATOM 23 O ALA A 2 4.574 13.387 10.406 1.00 0.68 O ATOM 24 CB ALA A 2 7.425 13.856 11.613 1.00 1.02 C ATOM 0 H ALA A 2 6.426 15.237 9.561 1.00 0.77 H new ATOM 0 HA ALA A 2 7.685 12.571 9.920 1.00 0.71 H new ATOM 0 HB1 ALA A 2 7.435 13.039 12.335 1.00 1.02 H new ATOM 0 HB2 ALA A 2 8.427 14.276 11.527 1.00 1.02 H new ATOM 0 HB3 ALA A 2 6.735 14.629 11.950 1.00 1.02 H new ATOM 30 N ALA A 3 5.543 11.334 10.424 1.00 0.56 N ATOM 31 CA ALA A 3 4.268 10.599 10.520 1.00 0.54 C ATOM 32 C ALA A 3 3.769 10.526 11.974 1.00 0.55 C ATOM 33 O ALA A 3 4.424 9.926 12.833 1.00 0.70 O ATOM 34 CB ALA A 3 4.407 9.201 9.919 1.00 0.66 C ATOM 0 H ALA A 3 6.370 10.738 10.408 1.00 0.56 H new ATOM 0 HA ALA A 3 3.522 11.147 9.945 1.00 0.54 H new ATOM 0 HB1 ALA A 3 3.456 8.674 9.999 1.00 0.66 H new ATOM 0 HB2 ALA A 3 4.689 9.283 8.869 1.00 0.66 H new ATOM 0 HB3 ALA A 3 5.175 8.647 10.459 1.00 0.66 H new ATOM 40 N GLU A 4 2.599 11.145 12.235 1.00 0.52 N ATOM 41 CA GLU A 4 1.988 11.171 13.578 1.00 0.55 C ATOM 42 C GLU A 4 0.799 10.182 13.658 1.00 0.52 C ATOM 43 O GLU A 4 0.043 10.068 12.689 1.00 0.50 O ATOM 44 CB GLU A 4 1.511 12.603 13.900 1.00 0.61 C ATOM 45 CG GLU A 4 1.093 12.820 15.355 1.00 0.74 C ATOM 46 CD GLU A 4 0.743 14.269 15.658 1.00 0.86 C ATOM 47 OE1 GLU A 4 -0.416 14.665 15.410 1.00 0.94 O ATOM 48 OE2 GLU A 4 1.629 15.008 16.138 1.00 1.02 O ATOM 0 H GLU A 4 2.056 11.637 11.526 1.00 0.52 H new ATOM 0 HA GLU A 4 2.735 10.865 14.310 1.00 0.55 H new ATOM 0 HB2 GLU A 4 2.311 13.302 13.657 1.00 0.61 H new ATOM 0 HB3 GLU A 4 0.668 12.846 13.253 1.00 0.61 H new ATOM 0 HG2 GLU A 4 0.233 12.189 15.579 1.00 0.74 H new ATOM 0 HG3 GLU A 4 1.902 12.501 16.012 1.00 0.74 H new ATOM 55 N PRO A 5 0.611 9.442 14.806 1.00 0.57 N ATOM 56 CA PRO A 5 -0.514 8.484 14.964 1.00 0.59 C ATOM 57 C PRO A 5 -1.898 9.163 14.912 1.00 0.53 C ATOM 58 O PRO A 5 -2.083 10.239 15.489 1.00 0.59 O ATOM 59 CB PRO A 5 -0.279 7.865 16.357 1.00 0.74 C ATOM 60 CG PRO A 5 1.154 8.131 16.663 1.00 0.73 C ATOM 61 CD PRO A 5 1.473 9.446 16.014 1.00 0.67 C ATOM 0 HA PRO A 5 -0.527 7.757 14.152 1.00 0.59 H new ATOM 0 HB2 PRO A 5 -0.932 8.316 17.104 1.00 0.74 H new ATOM 0 HB3 PRO A 5 -0.490 6.796 16.354 1.00 0.74 H new ATOM 0 HG2 PRO A 5 1.323 8.175 17.739 1.00 0.73 H new ATOM 0 HG3 PRO A 5 1.791 7.337 16.273 1.00 0.73 H new ATOM 0 HD2 PRO A 5 1.244 10.286 16.670 1.00 0.67 H new ATOM 0 HD3 PRO A 5 2.529 9.522 15.756 1.00 0.67 H new ATOM 69 N LEU A 6 -2.864 8.525 14.210 1.00 0.58 N ATOM 70 CA LEU A 6 -4.241 9.054 14.074 1.00 0.67 C ATOM 71 C LEU A 6 -5.284 7.900 14.259 1.00 0.71 C ATOM 72 O LEU A 6 -5.260 7.238 15.301 1.00 1.19 O ATOM 73 CB LEU A 6 -4.391 9.795 12.713 1.00 0.84 C ATOM 74 CG LEU A 6 -3.406 10.958 12.435 1.00 0.91 C ATOM 75 CD1 LEU A 6 -3.401 11.311 10.946 1.00 1.14 C ATOM 76 CD2 LEU A 6 -3.741 12.198 13.276 1.00 1.03 C ATOM 0 H LEU A 6 -2.713 7.639 13.727 1.00 0.58 H new ATOM 0 HA LEU A 6 -4.439 9.784 14.859 1.00 0.67 H new ATOM 0 HB2 LEU A 6 -4.284 9.061 11.914 1.00 0.84 H new ATOM 0 HB3 LEU A 6 -5.406 10.188 12.651 1.00 0.84 H new ATOM 0 HG LEU A 6 -2.410 10.621 12.723 1.00 0.91 H new ATOM 0 HD11 LEU A 6 -2.704 12.130 10.769 1.00 1.14 H new ATOM 0 HD12 LEU A 6 -3.093 10.440 10.367 1.00 1.14 H new ATOM 0 HD13 LEU A 6 -4.402 11.615 10.641 1.00 1.14 H new ATOM 0 HD21 LEU A 6 -3.028 12.992 13.053 1.00 1.03 H new ATOM 0 HD22 LEU A 6 -4.749 12.538 13.038 1.00 1.03 H new ATOM 0 HD23 LEU A 6 -3.684 11.946 14.335 1.00 1.03 H new ATOM 88 N THR A 7 -6.186 7.644 13.264 1.00 0.52 N ATOM 89 CA THR A 7 -7.209 6.561 13.352 1.00 0.52 C ATOM 90 C THR A 7 -6.545 5.170 13.210 1.00 0.49 C ATOM 91 O THR A 7 -5.408 5.089 12.757 1.00 0.56 O ATOM 92 CB THR A 7 -8.305 6.752 12.249 1.00 0.58 C ATOM 93 OG1 THR A 7 -8.707 8.129 12.199 1.00 0.98 O ATOM 94 CG2 THR A 7 -9.544 5.887 12.490 1.00 0.94 C ATOM 0 H THR A 7 -6.223 8.174 12.393 1.00 0.52 H new ATOM 0 HA THR A 7 -7.684 6.619 14.331 1.00 0.52 H new ATOM 0 HB THR A 7 -7.859 6.441 11.304 1.00 0.58 H new ATOM 0 HG1 THR A 7 -8.164 8.604 11.536 1.00 0.98 H new ATOM 0 HG21 THR A 7 -10.269 6.061 11.695 1.00 0.94 H new ATOM 0 HG22 THR A 7 -9.258 4.835 12.497 1.00 0.94 H new ATOM 0 HG23 THR A 7 -9.989 6.148 13.450 1.00 0.94 H new ATOM 102 N GLU A 8 -7.255 4.078 13.599 1.00 0.51 N ATOM 103 CA GLU A 8 -6.714 2.693 13.505 1.00 0.50 C ATOM 104 C GLU A 8 -6.116 2.371 12.111 1.00 0.46 C ATOM 105 O GLU A 8 -5.072 1.715 12.035 1.00 0.48 O ATOM 106 CB GLU A 8 -7.789 1.642 13.873 1.00 0.55 C ATOM 107 CG GLU A 8 -7.216 0.272 14.262 1.00 0.91 C ATOM 108 CD GLU A 8 -8.290 -0.764 14.555 1.00 0.95 C ATOM 109 OE1 GLU A 8 -8.730 -0.849 15.723 1.00 1.42 O ATOM 110 OE2 GLU A 8 -8.686 -1.494 13.620 1.00 1.14 O ATOM 0 H GLU A 8 -8.200 4.128 13.979 1.00 0.51 H new ATOM 0 HA GLU A 8 -5.901 2.641 14.229 1.00 0.50 H new ATOM 0 HB2 GLU A 8 -8.386 2.023 14.701 1.00 0.55 H new ATOM 0 HB3 GLU A 8 -8.463 1.515 13.026 1.00 0.55 H new ATOM 0 HG2 GLU A 8 -6.580 -0.091 13.455 1.00 0.91 H new ATOM 0 HG3 GLU A 8 -6.581 0.387 15.141 1.00 0.91 H new ATOM 117 N LEU A 9 -6.777 2.826 11.020 1.00 0.45 N ATOM 118 CA LEU A 9 -6.272 2.589 9.648 1.00 0.44 C ATOM 119 C LEU A 9 -5.099 3.531 9.322 1.00 0.42 C ATOM 120 O LEU A 9 -4.108 3.094 8.732 1.00 0.43 O ATOM 121 CB LEU A 9 -7.389 2.737 8.588 1.00 0.48 C ATOM 122 CG LEU A 9 -8.567 1.736 8.671 1.00 0.56 C ATOM 123 CD1 LEU A 9 -9.552 1.965 7.522 1.00 0.65 C ATOM 124 CD2 LEU A 9 -8.081 0.281 8.675 1.00 0.65 C ATOM 0 H LEU A 9 -7.650 3.352 11.062 1.00 0.45 H new ATOM 0 HA LEU A 9 -5.915 1.560 9.613 1.00 0.44 H new ATOM 0 HB2 LEU A 9 -7.795 3.746 8.661 1.00 0.48 H new ATOM 0 HB3 LEU A 9 -6.935 2.646 7.601 1.00 0.48 H new ATOM 0 HG LEU A 9 -9.079 1.916 9.616 1.00 0.56 H new ATOM 0 HD11 LEU A 9 -10.372 1.251 7.598 1.00 0.65 H new ATOM 0 HD12 LEU A 9 -9.947 2.979 7.578 1.00 0.65 H new ATOM 0 HD13 LEU A 9 -9.039 1.827 6.570 1.00 0.65 H new ATOM 0 HD21 LEU A 9 -8.939 -0.389 8.734 1.00 0.65 H new ATOM 0 HD22 LEU A 9 -7.526 0.080 7.758 1.00 0.65 H new ATOM 0 HD23 LEU A 9 -7.432 0.117 9.535 1.00 0.65 H new ATOM 136 N GLU A 10 -5.211 4.822 9.716 1.00 0.42 N ATOM 137 CA GLU A 10 -4.132 5.813 9.487 1.00 0.44 C ATOM 138 C GLU A 10 -2.884 5.471 10.336 1.00 0.44 C ATOM 139 O GLU A 10 -1.756 5.747 9.919 1.00 0.48 O ATOM 140 CB GLU A 10 -4.602 7.248 9.817 1.00 0.49 C ATOM 141 CG GLU A 10 -5.786 7.738 8.984 1.00 0.54 C ATOM 142 CD GLU A 10 -6.191 9.164 9.327 1.00 0.63 C ATOM 143 OE1 GLU A 10 -5.624 10.103 8.733 1.00 1.03 O ATOM 144 OE2 GLU A 10 -7.071 9.338 10.196 1.00 0.96 O ATOM 0 H GLU A 10 -6.031 5.200 10.190 1.00 0.42 H new ATOM 0 HA GLU A 10 -3.872 5.768 8.429 1.00 0.44 H new ATOM 0 HB2 GLU A 10 -4.873 7.294 10.872 1.00 0.49 H new ATOM 0 HB3 GLU A 10 -3.766 7.932 9.673 1.00 0.49 H new ATOM 0 HG2 GLU A 10 -5.530 7.681 7.926 1.00 0.54 H new ATOM 0 HG3 GLU A 10 -6.636 7.075 9.142 1.00 0.54 H new ATOM 151 N GLU A 11 -3.109 4.871 11.530 1.00 0.44 N ATOM 152 CA GLU A 11 -2.026 4.459 12.445 1.00 0.46 C ATOM 153 C GLU A 11 -1.286 3.211 11.915 1.00 0.45 C ATOM 154 O GLU A 11 -0.102 3.032 12.212 1.00 0.47 O ATOM 155 CB GLU A 11 -2.579 4.171 13.865 1.00 0.52 C ATOM 156 CG GLU A 11 -1.505 4.084 14.957 1.00 0.61 C ATOM 157 CD GLU A 11 -2.068 3.764 16.335 1.00 0.69 C ATOM 158 OE1 GLU A 11 -2.783 4.620 16.901 1.00 0.79 O ATOM 159 OE2 GLU A 11 -1.787 2.659 16.852 1.00 0.81 O ATOM 0 H GLU A 11 -4.043 4.661 11.881 1.00 0.44 H new ATOM 0 HA GLU A 11 -1.319 5.286 12.500 1.00 0.46 H new ATOM 0 HB2 GLU A 11 -3.288 4.955 14.131 1.00 0.52 H new ATOM 0 HB3 GLU A 11 -3.134 3.233 13.842 1.00 0.52 H new ATOM 0 HG2 GLU A 11 -0.779 3.318 14.682 1.00 0.61 H new ATOM 0 HG3 GLU A 11 -0.967 5.031 15.003 1.00 0.61 H new ATOM 166 N SER A 12 -1.994 2.348 11.142 1.00 0.45 N ATOM 167 CA SER A 12 -1.394 1.125 10.570 1.00 0.47 C ATOM 168 C SER A 12 -0.178 1.470 9.693 1.00 0.44 C ATOM 169 O SER A 12 0.939 1.045 9.995 1.00 0.49 O ATOM 170 CB SER A 12 -2.433 0.323 9.762 1.00 0.52 C ATOM 171 OG SER A 12 -3.478 -0.146 10.598 1.00 0.63 O ATOM 0 H SER A 12 -2.977 2.480 10.904 1.00 0.45 H new ATOM 0 HA SER A 12 -1.055 0.503 11.398 1.00 0.47 H new ATOM 0 HB2 SER A 12 -2.848 0.950 8.973 1.00 0.52 H new ATOM 0 HB3 SER A 12 -1.946 -0.522 9.275 1.00 0.52 H new ATOM 0 HG SER A 12 -3.937 0.617 11.007 1.00 0.63 H new ATOM 177 N ILE A 13 -0.399 2.265 8.624 1.00 0.42 N ATOM 178 CA ILE A 13 0.696 2.691 7.723 1.00 0.43 C ATOM 179 C ILE A 13 1.696 3.631 8.442 1.00 0.41 C ATOM 180 O ILE A 13 2.871 3.666 8.079 1.00 0.46 O ATOM 181 CB ILE A 13 0.182 3.356 6.390 1.00 0.47 C ATOM 182 CG1 ILE A 13 -0.794 4.549 6.635 1.00 0.46 C ATOM 183 CG2 ILE A 13 -0.478 2.304 5.492 1.00 0.56 C ATOM 184 CD1 ILE A 13 -0.122 5.875 6.965 1.00 0.44 C ATOM 0 H ILE A 13 -1.318 2.623 8.364 1.00 0.42 H new ATOM 0 HA ILE A 13 1.216 1.775 7.443 1.00 0.43 H new ATOM 0 HB ILE A 13 1.058 3.769 5.890 1.00 0.47 H new ATOM 0 HG12 ILE A 13 -1.410 4.683 5.746 1.00 0.46 H new ATOM 0 HG13 ILE A 13 -1.466 4.287 7.452 1.00 0.46 H new ATOM 0 HG21 ILE A 13 -0.829 2.777 4.575 1.00 0.56 H new ATOM 0 HG22 ILE A 13 0.248 1.529 5.246 1.00 0.56 H new ATOM 0 HG23 ILE A 13 -1.323 1.857 6.016 1.00 0.56 H new ATOM 0 HD11 ILE A 13 -0.883 6.640 7.118 1.00 0.44 H new ATOM 0 HD12 ILE A 13 0.471 5.766 7.873 1.00 0.44 H new ATOM 0 HD13 ILE A 13 0.528 6.169 6.141 1.00 0.44 H new ATOM 196 N GLU A 14 1.220 4.382 9.465 1.00 0.39 N ATOM 197 CA GLU A 14 2.069 5.306 10.254 1.00 0.40 C ATOM 198 C GLU A 14 3.170 4.553 11.031 1.00 0.41 C ATOM 199 O GLU A 14 4.307 5.030 11.113 1.00 0.44 O ATOM 200 CB GLU A 14 1.190 6.127 11.229 1.00 0.43 C ATOM 201 CG GLU A 14 1.947 7.078 12.166 1.00 0.52 C ATOM 202 CD GLU A 14 2.354 6.428 13.485 1.00 0.61 C ATOM 203 OE1 GLU A 14 1.457 5.977 14.230 1.00 0.93 O ATOM 204 OE2 GLU A 14 3.570 6.362 13.765 1.00 1.00 O ATOM 0 H GLU A 14 0.245 4.365 9.764 1.00 0.39 H new ATOM 0 HA GLU A 14 2.565 5.981 9.556 1.00 0.40 H new ATOM 0 HB2 GLU A 14 0.479 6.711 10.644 1.00 0.43 H new ATOM 0 HB3 GLU A 14 0.609 5.434 11.837 1.00 0.43 H new ATOM 0 HG2 GLU A 14 2.840 7.443 11.658 1.00 0.52 H new ATOM 0 HG3 GLU A 14 1.321 7.946 12.374 1.00 0.52 H new ATOM 211 N THR A 15 2.816 3.388 11.614 1.00 0.42 N ATOM 212 CA THR A 15 3.769 2.564 12.386 1.00 0.45 C ATOM 213 C THR A 15 4.903 2.028 11.481 1.00 0.43 C ATOM 214 O THR A 15 6.039 1.887 11.934 1.00 0.45 O ATOM 215 CB THR A 15 3.043 1.385 13.106 1.00 0.50 C ATOM 216 OG1 THR A 15 1.880 1.883 13.786 1.00 0.65 O ATOM 217 CG2 THR A 15 3.948 0.683 14.126 1.00 0.77 C ATOM 0 H THR A 15 1.875 2.997 11.564 1.00 0.42 H new ATOM 0 HA THR A 15 4.213 3.205 13.147 1.00 0.45 H new ATOM 0 HB THR A 15 2.766 0.658 12.342 1.00 0.50 H new ATOM 0 HG1 THR A 15 1.198 2.131 13.128 1.00 0.65 H new ATOM 0 HG21 THR A 15 3.399 -0.130 14.601 1.00 0.77 H new ATOM 0 HG22 THR A 15 4.825 0.281 13.618 1.00 0.77 H new ATOM 0 HG23 THR A 15 4.265 1.399 14.885 1.00 0.77 H new ATOM 225 N VAL A 16 4.587 1.748 10.200 1.00 0.41 N ATOM 226 CA VAL A 16 5.582 1.255 9.219 1.00 0.42 C ATOM 227 C VAL A 16 6.592 2.372 8.842 1.00 0.42 C ATOM 228 O VAL A 16 7.761 2.085 8.567 1.00 0.46 O ATOM 229 CB VAL A 16 4.896 0.714 7.912 1.00 0.44 C ATOM 230 CG1 VAL A 16 5.907 0.057 6.960 1.00 0.50 C ATOM 231 CG2 VAL A 16 3.765 -0.268 8.240 1.00 0.49 C ATOM 0 H VAL A 16 3.648 1.855 9.817 1.00 0.41 H new ATOM 0 HA VAL A 16 6.113 0.432 9.698 1.00 0.42 H new ATOM 0 HB VAL A 16 4.470 1.579 7.404 1.00 0.44 H new ATOM 0 HG11 VAL A 16 5.389 -0.302 6.071 1.00 0.50 H new ATOM 0 HG12 VAL A 16 6.662 0.788 6.670 1.00 0.50 H new ATOM 0 HG13 VAL A 16 6.389 -0.782 7.463 1.00 0.50 H new ATOM 0 HG21 VAL A 16 3.312 -0.623 7.315 1.00 0.49 H new ATOM 0 HG22 VAL A 16 4.168 -1.115 8.795 1.00 0.49 H new ATOM 0 HG23 VAL A 16 3.010 0.235 8.844 1.00 0.49 H new ATOM 241 N VAL A 17 6.126 3.642 8.836 1.00 0.42 N ATOM 242 CA VAL A 17 6.965 4.808 8.479 1.00 0.47 C ATOM 243 C VAL A 17 7.918 5.206 9.631 1.00 0.55 C ATOM 244 O VAL A 17 9.131 5.222 9.443 1.00 0.95 O ATOM 245 CB VAL A 17 6.080 6.043 8.063 1.00 0.51 C ATOM 246 CG1 VAL A 17 6.926 7.270 7.682 1.00 0.60 C ATOM 247 CG2 VAL A 17 5.139 5.680 6.909 1.00 0.52 C ATOM 0 H VAL A 17 5.165 3.886 9.077 1.00 0.42 H new ATOM 0 HA VAL A 17 7.572 4.508 7.625 1.00 0.47 H new ATOM 0 HB VAL A 17 5.488 6.308 8.939 1.00 0.51 H new ATOM 0 HG11 VAL A 17 6.268 8.093 7.403 1.00 0.60 H new ATOM 0 HG12 VAL A 17 7.539 7.567 8.533 1.00 0.60 H new ATOM 0 HG13 VAL A 17 7.571 7.020 6.840 1.00 0.60 H new ATOM 0 HG21 VAL A 17 4.539 6.550 6.641 1.00 0.52 H new ATOM 0 HG22 VAL A 17 5.726 5.364 6.046 1.00 0.52 H new ATOM 0 HG23 VAL A 17 4.482 4.867 7.218 1.00 0.52 H new ATOM 257 N THR A 18 7.361 5.501 10.822 1.00 0.47 N ATOM 258 CA THR A 18 8.155 5.943 11.995 1.00 0.51 C ATOM 259 C THR A 18 9.175 4.901 12.505 1.00 0.51 C ATOM 260 O THR A 18 10.219 5.282 13.044 1.00 0.60 O ATOM 261 CB THR A 18 7.237 6.353 13.183 1.00 0.56 C ATOM 262 OG1 THR A 18 6.398 5.250 13.560 1.00 0.57 O ATOM 263 CG2 THR A 18 6.355 7.542 12.827 1.00 0.62 C ATOM 0 H THR A 18 6.359 5.442 11.002 1.00 0.47 H new ATOM 0 HA THR A 18 8.718 6.801 11.628 1.00 0.51 H new ATOM 0 HB THR A 18 7.885 6.636 14.013 1.00 0.56 H new ATOM 0 HG1 THR A 18 5.471 5.557 13.641 1.00 0.57 H new ATOM 0 HG21 THR A 18 5.728 7.799 13.681 1.00 0.62 H new ATOM 0 HG22 THR A 18 6.982 8.395 12.567 1.00 0.62 H new ATOM 0 HG23 THR A 18 5.723 7.284 11.977 1.00 0.62 H new ATOM 271 N THR A 19 8.885 3.597 12.332 1.00 0.49 N ATOM 272 CA THR A 19 9.777 2.523 12.816 1.00 0.53 C ATOM 273 C THR A 19 11.044 2.325 11.943 1.00 0.53 C ATOM 274 O THR A 19 12.100 1.991 12.490 1.00 0.62 O ATOM 275 CB THR A 19 8.998 1.175 12.953 1.00 0.55 C ATOM 276 OG1 THR A 19 7.869 1.366 13.817 1.00 0.56 O ATOM 277 CG2 THR A 19 9.863 0.049 13.526 1.00 0.66 C ATOM 0 H THR A 19 8.044 3.262 11.863 1.00 0.49 H new ATOM 0 HA THR A 19 10.126 2.845 13.797 1.00 0.53 H new ATOM 0 HB THR A 19 8.686 0.882 11.951 1.00 0.55 H new ATOM 0 HG1 THR A 19 7.146 1.803 13.319 1.00 0.56 H new ATOM 0 HG21 THR A 19 9.271 -0.863 13.599 1.00 0.66 H new ATOM 0 HG22 THR A 19 10.716 -0.124 12.870 1.00 0.66 H new ATOM 0 HG23 THR A 19 10.218 0.331 14.517 1.00 0.66 H new ATOM 285 N PHE A 20 10.953 2.536 10.610 1.00 0.53 N ATOM 286 CA PHE A 20 12.113 2.332 9.711 1.00 0.57 C ATOM 287 C PHE A 20 12.735 3.638 9.169 1.00 0.57 C ATOM 288 O PHE A 20 13.930 3.649 8.860 1.00 0.89 O ATOM 289 CB PHE A 20 11.735 1.400 8.541 1.00 0.64 C ATOM 290 CG PHE A 20 12.937 0.848 7.792 1.00 0.71 C ATOM 291 CD1 PHE A 20 13.792 -0.066 8.399 1.00 0.83 C ATOM 292 CD2 PHE A 20 13.216 1.248 6.492 1.00 0.76 C ATOM 293 CE1 PHE A 20 14.889 -0.565 7.728 1.00 0.95 C ATOM 294 CE2 PHE A 20 14.317 0.748 5.818 1.00 0.86 C ATOM 295 CZ PHE A 20 15.153 -0.160 6.437 1.00 0.93 C ATOM 0 H PHE A 20 10.102 2.843 10.138 1.00 0.53 H new ATOM 0 HA PHE A 20 12.881 1.866 10.328 1.00 0.57 H new ATOM 0 HB2 PHE A 20 11.144 0.569 8.925 1.00 0.64 H new ATOM 0 HB3 PHE A 20 11.101 1.946 7.842 1.00 0.64 H new ATOM 0 HD1 PHE A 20 13.594 -0.390 9.410 1.00 0.83 H new ATOM 0 HD2 PHE A 20 12.567 1.957 6.001 1.00 0.76 H new ATOM 0 HE1 PHE A 20 15.542 -1.274 8.215 1.00 0.95 H new ATOM 0 HE2 PHE A 20 14.522 1.068 4.807 1.00 0.86 H new ATOM 0 HZ PHE A 20 16.011 -0.552 5.911 1.00 0.93 H new ATOM 305 N PHE A 21 11.948 4.731 9.042 1.00 0.71 N ATOM 306 CA PHE A 21 12.476 6.019 8.525 1.00 0.73 C ATOM 307 C PHE A 21 13.526 6.650 9.474 1.00 0.66 C ATOM 308 O PHE A 21 14.321 7.486 9.036 1.00 0.67 O ATOM 309 CB PHE A 21 11.326 7.018 8.229 1.00 1.04 C ATOM 310 CG PHE A 21 10.625 6.788 6.892 1.00 1.67 C ATOM 311 CD1 PHE A 21 10.085 5.543 6.561 1.00 1.97 C ATOM 312 CD2 PHE A 21 10.514 7.817 5.957 1.00 2.34 C ATOM 313 CE1 PHE A 21 9.459 5.337 5.348 1.00 2.74 C ATOM 314 CE2 PHE A 21 9.887 7.609 4.741 1.00 3.02 C ATOM 315 CZ PHE A 21 9.361 6.368 4.438 1.00 3.17 C ATOM 0 H PHE A 21 10.958 4.750 9.286 1.00 0.71 H new ATOM 0 HA PHE A 21 12.986 5.796 7.588 1.00 0.73 H new ATOM 0 HB2 PHE A 21 10.588 6.953 9.029 1.00 1.04 H new ATOM 0 HB3 PHE A 21 11.727 8.031 8.247 1.00 1.04 H new ATOM 0 HD1 PHE A 21 10.158 4.728 7.266 1.00 1.97 H new ATOM 0 HD2 PHE A 21 10.923 8.790 6.185 1.00 2.34 H new ATOM 0 HE1 PHE A 21 9.046 4.368 5.112 1.00 2.74 H new ATOM 0 HE2 PHE A 21 9.809 8.417 4.029 1.00 3.02 H new ATOM 0 HZ PHE A 21 8.873 6.206 3.488 1.00 3.17 H new ATOM 325 N THR A 22 13.534 6.242 10.769 1.00 0.75 N ATOM 326 CA THR A 22 14.512 6.752 11.755 1.00 0.89 C ATOM 327 C THR A 22 15.937 6.216 11.465 1.00 0.82 C ATOM 328 O THR A 22 16.924 6.904 11.749 1.00 0.97 O ATOM 329 CB THR A 22 14.092 6.378 13.212 1.00 1.11 C ATOM 330 OG1 THR A 22 12.715 6.733 13.434 1.00 1.25 O ATOM 331 CG2 THR A 22 14.966 7.069 14.261 1.00 1.37 C ATOM 0 H THR A 22 12.875 5.563 11.150 1.00 0.75 H new ATOM 0 HA THR A 22 14.524 7.838 11.662 1.00 0.89 H new ATOM 0 HB THR A 22 14.226 5.302 13.319 1.00 1.11 H new ATOM 0 HG1 THR A 22 12.140 5.975 13.199 1.00 1.25 H new ATOM 0 HG21 THR A 22 14.636 6.778 15.258 1.00 1.37 H new ATOM 0 HG22 THR A 22 16.005 6.772 14.122 1.00 1.37 H new ATOM 0 HG23 THR A 22 14.880 8.150 14.151 1.00 1.37 H new ATOM 339 N PHE A 23 16.035 4.988 10.905 1.00 0.69 N ATOM 340 CA PHE A 23 17.336 4.362 10.568 1.00 0.76 C ATOM 341 C PHE A 23 17.685 4.519 9.073 1.00 0.69 C ATOM 342 O PHE A 23 18.866 4.567 8.718 1.00 0.82 O ATOM 343 CB PHE A 23 17.326 2.864 10.945 1.00 0.87 C ATOM 344 CG PHE A 23 17.210 2.611 12.436 1.00 1.04 C ATOM 345 CD1 PHE A 23 15.964 2.513 13.052 1.00 1.01 C ATOM 346 CD2 PHE A 23 18.348 2.483 13.226 1.00 1.34 C ATOM 347 CE1 PHE A 23 15.860 2.293 14.413 1.00 1.24 C ATOM 348 CE2 PHE A 23 18.245 2.264 14.587 1.00 1.55 C ATOM 349 CZ PHE A 23 17.001 2.168 15.179 1.00 1.49 C ATOM 0 H PHE A 23 15.227 4.409 10.676 1.00 0.69 H new ATOM 0 HA PHE A 23 18.101 4.880 11.146 1.00 0.76 H new ATOM 0 HB2 PHE A 23 16.494 2.376 10.437 1.00 0.87 H new ATOM 0 HB3 PHE A 23 18.241 2.400 10.577 1.00 0.87 H new ATOM 0 HD1 PHE A 23 15.067 2.610 12.458 1.00 1.01 H new ATOM 0 HD2 PHE A 23 19.324 2.556 12.770 1.00 1.34 H new ATOM 0 HE1 PHE A 23 14.887 2.219 14.876 1.00 1.24 H new ATOM 0 HE2 PHE A 23 19.138 2.168 15.187 1.00 1.55 H new ATOM 0 HZ PHE A 23 16.921 1.995 16.242 1.00 1.49 H new ATOM 359 N ALA A 24 16.656 4.608 8.204 1.00 0.59 N ATOM 360 CA ALA A 24 16.850 4.738 6.744 1.00 0.67 C ATOM 361 C ALA A 24 17.245 6.164 6.296 1.00 0.62 C ATOM 362 O ALA A 24 17.841 6.331 5.226 1.00 0.83 O ATOM 363 CB ALA A 24 15.582 4.296 6.018 1.00 0.82 C ATOM 0 H ALA A 24 15.677 4.592 8.490 1.00 0.59 H new ATOM 0 HA ALA A 24 17.687 4.092 6.481 1.00 0.67 H new ATOM 0 HB1 ALA A 24 15.726 4.392 4.942 1.00 0.82 H new ATOM 0 HB2 ALA A 24 15.366 3.256 6.263 1.00 0.82 H new ATOM 0 HB3 ALA A 24 14.747 4.923 6.330 1.00 0.82 H new ATOM 369 N ARG A 25 16.908 7.183 7.114 1.00 0.61 N ATOM 370 CA ARG A 25 17.204 8.606 6.806 1.00 0.65 C ATOM 371 C ARG A 25 18.719 8.938 6.740 1.00 0.69 C ATOM 372 O ARG A 25 19.103 9.906 6.078 1.00 0.88 O ATOM 373 CB ARG A 25 16.514 9.525 7.843 1.00 0.75 C ATOM 374 CG ARG A 25 16.994 9.323 9.291 1.00 0.78 C ATOM 375 CD ARG A 25 16.345 10.295 10.276 1.00 0.97 C ATOM 376 NE ARG A 25 16.889 10.136 11.638 1.00 1.09 N ATOM 377 CZ ARG A 25 16.811 11.055 12.623 1.00 1.32 C ATOM 378 NH1 ARG A 25 16.192 12.231 12.448 1.00 1.55 N ATOM 379 NH2 ARG A 25 17.365 10.786 13.807 1.00 1.47 N ATOM 0 H ARG A 25 16.426 7.048 8.003 1.00 0.61 H new ATOM 0 HA ARG A 25 16.808 8.786 5.807 1.00 0.65 H new ATOM 0 HB2 ARG A 25 16.683 10.564 7.559 1.00 0.75 H new ATOM 0 HB3 ARG A 25 15.438 9.354 7.803 1.00 0.75 H new ATOM 0 HG2 ARG A 25 16.776 8.301 9.601 1.00 0.78 H new ATOM 0 HG3 ARG A 25 18.077 9.444 9.329 1.00 0.78 H new ATOM 0 HD2 ARG A 25 16.506 11.318 9.937 1.00 0.97 H new ATOM 0 HD3 ARG A 25 15.268 10.131 10.293 1.00 0.97 H new ATOM 0 HE ARG A 25 17.363 9.259 11.853 1.00 1.09 H new ATOM 0 HH11 ARG A 25 15.762 12.453 11.550 1.00 1.55 H new ATOM 0 HH12 ARG A 25 16.151 12.904 13.213 1.00 1.55 H new ATOM 0 HH21 ARG A 25 17.839 9.896 13.958 1.00 1.47 H new ATOM 0 HH22 ARG A 25 17.314 11.471 14.561 1.00 1.47 H new ATOM 393 N GLN A 26 19.565 8.140 7.421 1.00 0.73 N ATOM 394 CA GLN A 26 21.026 8.375 7.464 1.00 0.84 C ATOM 395 C GLN A 26 21.742 8.040 6.131 1.00 0.78 C ATOM 396 O GLN A 26 22.806 8.603 5.852 1.00 0.89 O ATOM 397 CB GLN A 26 21.644 7.566 8.625 1.00 1.01 C ATOM 398 CG GLN A 26 23.082 7.947 8.974 1.00 1.22 C ATOM 399 CD GLN A 26 23.559 7.322 10.277 1.00 1.49 C ATOM 400 OE1 GLN A 26 24.120 6.224 10.280 1.00 1.63 O ATOM 401 NE2 GLN A 26 23.339 8.017 11.398 1.00 1.80 N ATOM 0 H GLN A 26 19.262 7.323 7.952 1.00 0.73 H new ATOM 0 HA GLN A 26 21.174 9.443 7.627 1.00 0.84 H new ATOM 0 HB2 GLN A 26 21.023 7.696 9.511 1.00 1.01 H new ATOM 0 HB3 GLN A 26 21.615 6.507 8.368 1.00 1.01 H new ATOM 0 HG2 GLN A 26 23.742 7.636 8.164 1.00 1.22 H new ATOM 0 HG3 GLN A 26 23.158 9.032 9.048 1.00 1.22 H new ATOM 0 HE21 GLN A 26 22.871 8.922 11.353 1.00 1.80 H new ATOM 0 HE22 GLN A 26 23.639 7.642 12.298 1.00 1.80 H new ATOM 410 N GLU A 27 21.161 7.139 5.310 1.00 0.70 N ATOM 411 CA GLU A 27 21.770 6.723 4.023 1.00 0.76 C ATOM 412 C GLU A 27 21.593 7.772 2.902 1.00 0.93 C ATOM 413 O GLU A 27 22.531 8.008 2.134 1.00 1.59 O ATOM 414 CB GLU A 27 21.197 5.362 3.563 1.00 0.92 C ATOM 415 CG GLU A 27 21.383 4.214 4.566 1.00 1.09 C ATOM 416 CD GLU A 27 22.841 3.895 4.865 1.00 1.27 C ATOM 417 OE1 GLU A 27 23.535 3.375 3.963 1.00 1.52 O ATOM 418 OE2 GLU A 27 23.290 4.165 6.000 1.00 1.46 O ATOM 0 H GLU A 27 20.271 6.684 5.513 1.00 0.70 H new ATOM 0 HA GLU A 27 22.840 6.628 4.208 1.00 0.76 H new ATOM 0 HB2 GLU A 27 20.132 5.481 3.362 1.00 0.92 H new ATOM 0 HB3 GLU A 27 21.670 5.084 2.621 1.00 0.92 H new ATOM 0 HG2 GLU A 27 20.878 4.471 5.497 1.00 1.09 H new ATOM 0 HG3 GLU A 27 20.897 3.320 4.176 1.00 1.09 H new ATOM 425 N GLY A 28 20.396 8.385 2.800 1.00 0.79 N ATOM 426 CA GLY A 28 20.150 9.388 1.758 1.00 0.92 C ATOM 427 C GLY A 28 18.699 9.861 1.708 1.00 0.73 C ATOM 428 O GLY A 28 17.794 9.045 1.523 1.00 0.72 O ATOM 0 H GLY A 28 19.603 8.205 3.415 1.00 0.79 H new ATOM 0 HA2 GLY A 28 20.799 10.247 1.929 1.00 0.92 H new ATOM 0 HA3 GLY A 28 20.423 8.970 0.789 1.00 0.92 H new ATOM 432 N ARG A 29 18.484 11.196 1.855 1.00 0.72 N ATOM 433 CA ARG A 29 17.137 11.821 1.852 1.00 0.71 C ATOM 434 C ARG A 29 16.285 11.313 3.039 1.00 0.68 C ATOM 435 O ARG A 29 16.339 10.132 3.395 1.00 0.76 O ATOM 436 CB ARG A 29 16.412 11.624 0.489 1.00 0.73 C ATOM 437 CG ARG A 29 16.685 12.729 -0.549 1.00 0.92 C ATOM 438 CD ARG A 29 18.177 12.920 -0.854 1.00 1.31 C ATOM 439 NE ARG A 29 18.425 13.924 -1.906 1.00 1.46 N ATOM 440 CZ ARG A 29 19.649 14.321 -2.320 1.00 1.91 C ATOM 441 NH1 ARG A 29 20.767 13.806 -1.789 1.00 2.60 N ATOM 442 NH2 ARG A 29 19.753 15.242 -3.281 1.00 2.05 N ATOM 0 H ARG A 29 19.242 11.868 1.979 1.00 0.72 H new ATOM 0 HA ARG A 29 17.271 12.895 1.982 1.00 0.71 H new ATOM 0 HB2 ARG A 29 16.714 10.665 0.067 1.00 0.73 H new ATOM 0 HB3 ARG A 29 15.338 11.570 0.668 1.00 0.73 H new ATOM 0 HG2 ARG A 29 16.160 12.487 -1.473 1.00 0.92 H new ATOM 0 HG3 ARG A 29 16.272 13.670 -0.185 1.00 0.92 H new ATOM 0 HD2 ARG A 29 18.693 13.221 0.058 1.00 1.31 H new ATOM 0 HD3 ARG A 29 18.605 11.966 -1.162 1.00 1.31 H new ATOM 0 HE ARG A 29 17.613 14.350 -2.354 1.00 1.46 H new ATOM 0 HH11 ARG A 29 20.705 13.099 -1.056 1.00 2.60 H new ATOM 0 HH12 ARG A 29 21.680 14.121 -2.118 1.00 2.60 H new ATOM 0 HH21 ARG A 29 18.912 15.641 -3.698 1.00 2.05 H new ATOM 0 HH22 ARG A 29 20.673 15.546 -3.598 1.00 2.05 H new ATOM 456 N LYS A 30 15.491 12.214 3.646 1.00 0.67 N ATOM 457 CA LYS A 30 14.666 11.866 4.828 1.00 0.67 C ATOM 458 C LYS A 30 13.414 11.043 4.468 1.00 0.66 C ATOM 459 O LYS A 30 13.066 10.118 5.208 1.00 0.72 O ATOM 460 CB LYS A 30 14.279 13.136 5.623 1.00 0.76 C ATOM 461 CG LYS A 30 15.470 14.006 6.061 1.00 0.82 C ATOM 462 CD LYS A 30 16.483 13.234 6.923 1.00 0.89 C ATOM 463 CE LYS A 30 17.623 14.117 7.435 1.00 1.00 C ATOM 464 NZ LYS A 30 18.503 14.634 6.341 1.00 1.22 N ATOM 0 H LYS A 30 15.400 13.184 3.343 1.00 0.67 H new ATOM 0 HA LYS A 30 15.285 11.229 5.460 1.00 0.67 H new ATOM 0 HB2 LYS A 30 13.609 13.741 5.012 1.00 0.76 H new ATOM 0 HB3 LYS A 30 13.719 12.837 6.509 1.00 0.76 H new ATOM 0 HG2 LYS A 30 15.974 14.396 5.177 1.00 0.82 H new ATOM 0 HG3 LYS A 30 15.101 14.864 6.622 1.00 0.82 H new ATOM 0 HD2 LYS A 30 15.965 12.789 7.773 1.00 0.89 H new ATOM 0 HD3 LYS A 30 16.900 12.414 6.338 1.00 0.89 H new ATOM 0 HE2 LYS A 30 17.203 14.960 7.984 1.00 1.00 H new ATOM 0 HE3 LYS A 30 18.228 13.547 8.140 1.00 1.00 H new ATOM 0 HZ1 LYS A 30 19.255 15.224 6.750 1.00 1.22 H new ATOM 0 HZ2 LYS A 30 18.930 13.834 5.831 1.00 1.22 H new ATOM 0 HZ3 LYS A 30 17.937 15.203 5.680 1.00 1.22 H new ATOM 478 N ASP A 31 12.749 11.365 3.338 1.00 0.66 N ATOM 479 CA ASP A 31 11.540 10.629 2.903 1.00 0.71 C ATOM 480 C ASP A 31 11.869 9.528 1.855 1.00 0.64 C ATOM 481 O ASP A 31 11.010 9.168 1.039 1.00 0.89 O ATOM 482 CB ASP A 31 10.485 11.614 2.355 1.00 0.87 C ATOM 483 CG ASP A 31 9.885 12.499 3.437 1.00 1.03 C ATOM 484 OD1 ASP A 31 9.017 12.009 4.190 1.00 1.38 O ATOM 485 OD2 ASP A 31 10.279 13.681 3.526 1.00 1.43 O ATOM 0 H ASP A 31 13.025 12.123 2.714 1.00 0.66 H new ATOM 0 HA ASP A 31 11.130 10.121 3.776 1.00 0.71 H new ATOM 0 HB2 ASP A 31 10.944 12.242 1.591 1.00 0.87 H new ATOM 0 HB3 ASP A 31 9.688 11.052 1.869 1.00 0.87 H new ATOM 490 N SER A 32 13.108 8.980 1.897 1.00 0.65 N ATOM 491 CA SER A 32 13.546 7.917 0.972 1.00 0.58 C ATOM 492 C SER A 32 14.286 6.804 1.731 1.00 0.56 C ATOM 493 O SER A 32 14.998 7.078 2.705 1.00 0.63 O ATOM 494 CB SER A 32 14.452 8.495 -0.130 1.00 0.58 C ATOM 495 OG SER A 32 14.842 7.488 -1.060 1.00 1.09 O ATOM 0 H SER A 32 13.823 9.262 2.568 1.00 0.65 H new ATOM 0 HA SER A 32 12.658 7.490 0.507 1.00 0.58 H new ATOM 0 HB2 SER A 32 13.927 9.293 -0.654 1.00 0.58 H new ATOM 0 HB3 SER A 32 15.339 8.940 0.321 1.00 0.58 H new ATOM 0 HG SER A 32 14.978 7.892 -1.942 1.00 1.09 H new ATOM 501 N LEU A 33 14.117 5.552 1.264 1.00 0.54 N ATOM 502 CA LEU A 33 14.750 4.374 1.881 1.00 0.54 C ATOM 503 C LEU A 33 16.014 3.969 1.105 1.00 0.52 C ATOM 504 O LEU A 33 16.196 4.372 -0.048 1.00 0.66 O ATOM 505 CB LEU A 33 13.760 3.182 1.941 1.00 0.55 C ATOM 506 CG LEU A 33 12.492 3.380 2.813 1.00 0.67 C ATOM 507 CD1 LEU A 33 11.446 4.255 2.109 1.00 0.76 C ATOM 508 CD2 LEU A 33 11.883 2.029 3.198 1.00 0.75 C ATOM 0 H LEU A 33 13.540 5.331 0.452 1.00 0.54 H new ATOM 0 HA LEU A 33 15.033 4.641 2.899 1.00 0.54 H new ATOM 0 HB2 LEU A 33 13.442 2.950 0.924 1.00 0.55 H new ATOM 0 HB3 LEU A 33 14.298 2.310 2.313 1.00 0.55 H new ATOM 0 HG LEU A 33 12.801 3.899 3.720 1.00 0.67 H new ATOM 0 HD11 LEU A 33 10.574 4.369 2.753 1.00 0.76 H new ATOM 0 HD12 LEU A 33 11.873 5.236 1.900 1.00 0.76 H new ATOM 0 HD13 LEU A 33 11.147 3.783 1.173 1.00 0.76 H new ATOM 0 HD21 LEU A 33 10.995 2.191 3.809 1.00 0.75 H new ATOM 0 HD22 LEU A 33 11.608 1.484 2.295 1.00 0.75 H new ATOM 0 HD23 LEU A 33 12.612 1.449 3.764 1.00 0.75 H new ATOM 520 N SER A 34 16.878 3.160 1.749 1.00 0.50 N ATOM 521 CA SER A 34 18.140 2.695 1.141 1.00 0.52 C ATOM 522 C SER A 34 17.935 1.406 0.325 1.00 0.47 C ATOM 523 O SER A 34 16.897 0.749 0.442 1.00 0.47 O ATOM 524 CB SER A 34 19.197 2.467 2.235 1.00 0.62 C ATOM 525 OG SER A 34 20.481 2.222 1.679 1.00 0.68 O ATOM 0 H SER A 34 16.723 2.813 2.696 1.00 0.50 H new ATOM 0 HA SER A 34 18.487 3.469 0.457 1.00 0.52 H new ATOM 0 HB2 SER A 34 19.242 3.340 2.886 1.00 0.62 H new ATOM 0 HB3 SER A 34 18.902 1.622 2.856 1.00 0.62 H new ATOM 0 HG SER A 34 21.129 2.083 2.401 1.00 0.68 H new ATOM 531 N VAL A 35 18.941 1.060 -0.504 1.00 0.50 N ATOM 532 CA VAL A 35 18.902 -0.152 -1.353 1.00 0.49 C ATOM 533 C VAL A 35 19.485 -1.390 -0.625 1.00 0.45 C ATOM 534 O VAL A 35 19.121 -2.523 -0.955 1.00 0.46 O ATOM 535 CB VAL A 35 19.637 0.090 -2.719 1.00 0.59 C ATOM 536 CG1 VAL A 35 21.157 0.244 -2.548 1.00 0.63 C ATOM 537 CG2 VAL A 35 19.301 -1.007 -3.743 1.00 0.64 C ATOM 0 H VAL A 35 19.797 1.606 -0.605 1.00 0.50 H new ATOM 0 HA VAL A 35 17.853 -0.362 -1.562 1.00 0.49 H new ATOM 0 HB VAL A 35 19.264 1.037 -3.108 1.00 0.59 H new ATOM 0 HG11 VAL A 35 21.618 0.409 -3.522 1.00 0.63 H new ATOM 0 HG12 VAL A 35 21.366 1.094 -1.899 1.00 0.63 H new ATOM 0 HG13 VAL A 35 21.567 -0.662 -2.102 1.00 0.63 H new ATOM 0 HG21 VAL A 35 19.827 -0.807 -4.676 1.00 0.64 H new ATOM 0 HG22 VAL A 35 19.611 -1.976 -3.352 1.00 0.64 H new ATOM 0 HG23 VAL A 35 18.227 -1.016 -3.927 1.00 0.64 H new ATOM 547 N ASN A 36 20.386 -1.167 0.356 1.00 0.45 N ATOM 548 CA ASN A 36 21.009 -2.267 1.117 1.00 0.46 C ATOM 549 C ASN A 36 20.297 -2.508 2.466 1.00 0.44 C ATOM 550 O ASN A 36 20.135 -3.663 2.872 1.00 0.55 O ATOM 551 CB ASN A 36 22.507 -1.979 1.354 1.00 0.55 C ATOM 552 CG ASN A 36 23.305 -3.226 1.753 1.00 0.64 C ATOM 553 OD1 ASN A 36 23.183 -4.275 1.118 1.00 0.82 O ATOM 554 ND2 ASN A 36 24.121 -3.124 2.805 1.00 0.77 N ATOM 0 H ASN A 36 20.696 -0.237 0.638 1.00 0.45 H new ATOM 0 HA ASN A 36 20.907 -3.173 0.520 1.00 0.46 H new ATOM 0 HB2 ASN A 36 22.937 -1.555 0.447 1.00 0.55 H new ATOM 0 HB3 ASN A 36 22.607 -1.226 2.136 1.00 0.55 H new ATOM 0 HD21 ASN A 36 24.668 -3.930 3.106 1.00 0.77 H new ATOM 0 HD22 ASN A 36 24.197 -2.240 3.307 1.00 0.77 H new ATOM 561 N GLU A 37 19.874 -1.421 3.150 1.00 0.44 N ATOM 562 CA GLU A 37 19.201 -1.531 4.464 1.00 0.46 C ATOM 563 C GLU A 37 17.785 -2.133 4.352 1.00 0.41 C ATOM 564 O GLU A 37 17.367 -2.872 5.249 1.00 0.43 O ATOM 565 CB GLU A 37 19.148 -0.163 5.178 1.00 0.55 C ATOM 566 CG GLU A 37 18.962 -0.264 6.697 1.00 0.70 C ATOM 567 CD GLU A 37 18.933 1.089 7.388 1.00 0.83 C ATOM 568 OE1 GLU A 37 20.019 1.654 7.631 1.00 1.25 O ATOM 569 OE2 GLU A 37 17.824 1.576 7.693 1.00 1.54 O ATOM 0 H GLU A 37 19.986 -0.464 2.817 1.00 0.44 H new ATOM 0 HA GLU A 37 19.800 -2.217 5.063 1.00 0.46 H new ATOM 0 HB2 GLU A 37 20.069 0.381 4.970 1.00 0.55 H new ATOM 0 HB3 GLU A 37 18.330 0.423 4.759 1.00 0.55 H new ATOM 0 HG2 GLU A 37 18.032 -0.793 6.908 1.00 0.70 H new ATOM 0 HG3 GLU A 37 19.771 -0.862 7.117 1.00 0.70 H new ATOM 576 N PHE A 38 17.047 -1.823 3.259 1.00 0.40 N ATOM 577 CA PHE A 38 15.682 -2.367 3.062 1.00 0.39 C ATOM 578 C PHE A 38 15.719 -3.898 2.834 1.00 0.37 C ATOM 579 O PHE A 38 14.749 -4.590 3.151 1.00 0.40 O ATOM 580 CB PHE A 38 14.928 -1.617 1.923 1.00 0.43 C ATOM 581 CG PHE A 38 14.926 -2.289 0.554 1.00 0.41 C ATOM 582 CD1 PHE A 38 16.012 -2.169 -0.301 1.00 0.49 C ATOM 583 CD2 PHE A 38 13.824 -3.028 0.124 1.00 0.50 C ATOM 584 CE1 PHE A 38 16.002 -2.767 -1.550 1.00 0.61 C ATOM 585 CE2 PHE A 38 13.813 -3.628 -1.121 1.00 0.61 C ATOM 586 CZ PHE A 38 14.902 -3.496 -1.958 1.00 0.65 C ATOM 0 H PHE A 38 17.368 -1.209 2.511 1.00 0.40 H new ATOM 0 HA PHE A 38 15.116 -2.194 3.977 1.00 0.39 H new ATOM 0 HB2 PHE A 38 13.893 -1.474 2.235 1.00 0.43 H new ATOM 0 HB3 PHE A 38 15.369 -0.626 1.816 1.00 0.43 H new ATOM 0 HD1 PHE A 38 16.876 -1.602 0.012 1.00 0.49 H new ATOM 0 HD2 PHE A 38 12.967 -3.133 0.773 1.00 0.50 H new ATOM 0 HE1 PHE A 38 16.854 -2.663 -2.205 1.00 0.61 H new ATOM 0 HE2 PHE A 38 12.953 -4.199 -1.438 1.00 0.61 H new ATOM 0 HZ PHE A 38 14.894 -3.963 -2.932 1.00 0.65 H new ATOM 596 N LYS A 39 16.844 -4.412 2.277 1.00 0.37 N ATOM 597 CA LYS A 39 17.029 -5.858 2.047 1.00 0.40 C ATOM 598 C LYS A 39 17.154 -6.598 3.396 1.00 0.38 C ATOM 599 O LYS A 39 16.655 -7.716 3.541 1.00 0.42 O ATOM 600 CB LYS A 39 18.274 -6.113 1.163 1.00 0.46 C ATOM 601 CG LYS A 39 18.371 -7.532 0.589 1.00 0.55 C ATOM 602 CD LYS A 39 19.576 -7.701 -0.346 1.00 0.64 C ATOM 603 CE LYS A 39 19.685 -9.125 -0.903 1.00 0.76 C ATOM 604 NZ LYS A 39 18.596 -9.451 -1.875 1.00 0.87 N ATOM 0 H LYS A 39 17.635 -3.841 1.980 1.00 0.37 H new ATOM 0 HA LYS A 39 16.156 -6.244 1.520 1.00 0.40 H new ATOM 0 HB2 LYS A 39 18.269 -5.401 0.338 1.00 0.46 H new ATOM 0 HB3 LYS A 39 19.169 -5.912 1.752 1.00 0.46 H new ATOM 0 HG2 LYS A 39 18.446 -8.248 1.407 1.00 0.55 H new ATOM 0 HG3 LYS A 39 17.456 -7.765 0.044 1.00 0.55 H new ATOM 0 HD2 LYS A 39 19.493 -6.995 -1.173 1.00 0.64 H new ATOM 0 HD3 LYS A 39 20.490 -7.454 0.194 1.00 0.64 H new ATOM 0 HE2 LYS A 39 20.651 -9.246 -1.393 1.00 0.76 H new ATOM 0 HE3 LYS A 39 19.655 -9.837 -0.078 1.00 0.76 H new ATOM 0 HZ1 LYS A 39 18.718 -10.425 -2.220 1.00 0.87 H new ATOM 0 HZ2 LYS A 39 17.673 -9.364 -1.404 1.00 0.87 H new ATOM 0 HZ3 LYS A 39 18.639 -8.792 -2.678 1.00 0.87 H new ATOM 618 N GLU A 40 17.824 -5.954 4.382 1.00 0.38 N ATOM 619 CA GLU A 40 17.984 -6.515 5.739 1.00 0.40 C ATOM 620 C GLU A 40 16.632 -6.513 6.487 1.00 0.40 C ATOM 621 O GLU A 40 16.365 -7.415 7.286 1.00 0.44 O ATOM 622 CB GLU A 40 19.040 -5.724 6.545 1.00 0.45 C ATOM 623 CG GLU A 40 20.455 -5.820 5.980 1.00 0.49 C ATOM 624 CD GLU A 40 21.496 -5.141 6.857 1.00 0.59 C ATOM 625 OE1 GLU A 40 21.957 -5.772 7.833 1.00 0.73 O ATOM 626 OE2 GLU A 40 21.856 -3.982 6.564 1.00 0.64 O ATOM 0 H GLU A 40 18.263 -5.042 4.258 1.00 0.38 H new ATOM 0 HA GLU A 40 18.330 -7.544 5.639 1.00 0.40 H new ATOM 0 HB2 GLU A 40 18.744 -4.675 6.580 1.00 0.45 H new ATOM 0 HB3 GLU A 40 19.045 -6.088 7.572 1.00 0.45 H new ATOM 0 HG2 GLU A 40 20.721 -6.870 5.858 1.00 0.49 H new ATOM 0 HG3 GLU A 40 20.475 -5.369 4.988 1.00 0.49 H new ATOM 633 N LEU A 41 15.787 -5.487 6.209 1.00 0.39 N ATOM 634 CA LEU A 41 14.443 -5.353 6.819 1.00 0.41 C ATOM 635 C LEU A 41 13.540 -6.554 6.463 1.00 0.40 C ATOM 636 O LEU A 41 12.762 -7.015 7.304 1.00 0.44 O ATOM 637 CB LEU A 41 13.779 -4.033 6.354 1.00 0.44 C ATOM 638 CG LEU A 41 12.432 -3.654 7.014 1.00 0.55 C ATOM 639 CD1 LEU A 41 12.600 -3.396 8.515 1.00 0.65 C ATOM 640 CD2 LEU A 41 11.819 -2.436 6.313 1.00 0.58 C ATOM 0 H LEU A 41 16.018 -4.735 5.560 1.00 0.39 H new ATOM 0 HA LEU A 41 14.565 -5.335 7.902 1.00 0.41 H new ATOM 0 HB2 LEU A 41 14.483 -3.220 6.529 1.00 0.44 H new ATOM 0 HB3 LEU A 41 13.623 -4.093 5.277 1.00 0.44 H new ATOM 0 HG LEU A 41 11.750 -4.497 6.901 1.00 0.55 H new ATOM 0 HD11 LEU A 41 11.636 -3.132 8.949 1.00 0.65 H new ATOM 0 HD12 LEU A 41 12.981 -4.295 8.998 1.00 0.65 H new ATOM 0 HD13 LEU A 41 13.303 -2.577 8.667 1.00 0.65 H new ATOM 0 HD21 LEU A 41 10.872 -2.181 6.788 1.00 0.58 H new ATOM 0 HD22 LEU A 41 12.502 -1.590 6.389 1.00 0.58 H new ATOM 0 HD23 LEU A 41 11.646 -2.669 5.262 1.00 0.58 H new ATOM 652 N VAL A 42 13.650 -7.042 5.209 1.00 0.36 N ATOM 653 CA VAL A 42 12.860 -8.194 4.729 1.00 0.37 C ATOM 654 C VAL A 42 13.495 -9.538 5.169 1.00 0.38 C ATOM 655 O VAL A 42 12.791 -10.548 5.280 1.00 0.41 O ATOM 656 CB VAL A 42 12.676 -8.161 3.169 1.00 0.40 C ATOM 657 CG1 VAL A 42 11.806 -9.325 2.667 1.00 0.45 C ATOM 658 CG2 VAL A 42 12.078 -6.820 2.716 1.00 0.41 C ATOM 0 H VAL A 42 14.281 -6.653 4.509 1.00 0.36 H new ATOM 0 HA VAL A 42 11.874 -8.115 5.187 1.00 0.37 H new ATOM 0 HB VAL A 42 13.667 -8.273 2.729 1.00 0.40 H new ATOM 0 HG11 VAL A 42 11.705 -9.263 1.583 1.00 0.45 H new ATOM 0 HG12 VAL A 42 12.276 -10.272 2.934 1.00 0.45 H new ATOM 0 HG13 VAL A 42 10.820 -9.267 3.127 1.00 0.45 H new ATOM 0 HG21 VAL A 42 11.960 -6.822 1.632 1.00 0.41 H new ATOM 0 HG22 VAL A 42 11.105 -6.678 3.187 1.00 0.41 H new ATOM 0 HG23 VAL A 42 12.744 -6.008 3.007 1.00 0.41 H new ATOM 668 N THR A 43 14.818 -9.540 5.433 1.00 0.39 N ATOM 669 CA THR A 43 15.542 -10.751 5.857 1.00 0.42 C ATOM 670 C THR A 43 15.582 -10.915 7.405 1.00 0.49 C ATOM 671 O THR A 43 16.079 -11.937 7.895 1.00 0.80 O ATOM 672 CB THR A 43 16.998 -10.734 5.281 1.00 0.45 C ATOM 673 OG1 THR A 43 16.978 -10.366 3.888 1.00 0.46 O ATOM 674 CG2 THR A 43 17.706 -12.087 5.426 1.00 0.50 C ATOM 0 H THR A 43 15.407 -8.711 5.359 1.00 0.39 H new ATOM 0 HA THR A 43 14.996 -11.607 5.459 1.00 0.42 H new ATOM 0 HB THR A 43 17.554 -9.999 5.863 1.00 0.45 H new ATOM 0 HG1 THR A 43 17.098 -9.397 3.804 1.00 0.46 H new ATOM 0 HG21 THR A 43 18.711 -12.018 5.010 1.00 0.50 H new ATOM 0 HG22 THR A 43 17.767 -12.355 6.481 1.00 0.50 H new ATOM 0 HG23 THR A 43 17.143 -12.851 4.890 1.00 0.50 H new ATOM 682 N GLN A 44 15.036 -9.936 8.175 1.00 0.41 N ATOM 683 CA GLN A 44 15.058 -10.004 9.652 1.00 0.44 C ATOM 684 C GLN A 44 13.678 -9.713 10.286 1.00 0.44 C ATOM 685 O GLN A 44 13.168 -10.552 11.038 1.00 0.50 O ATOM 686 CB GLN A 44 16.127 -9.034 10.213 1.00 0.48 C ATOM 687 CG GLN A 44 16.635 -9.401 11.612 1.00 0.65 C ATOM 688 CD GLN A 44 17.844 -8.577 12.051 1.00 0.77 C ATOM 689 OE1 GLN A 44 18.986 -8.952 11.781 1.00 1.02 O ATOM 690 NE2 GLN A 44 17.610 -7.456 12.741 1.00 1.10 N ATOM 0 H GLN A 44 14.582 -9.103 7.799 1.00 0.41 H new ATOM 0 HA GLN A 44 15.316 -11.028 9.922 1.00 0.44 H new ATOM 0 HB2 GLN A 44 16.973 -9.007 9.527 1.00 0.48 H new ATOM 0 HB3 GLN A 44 15.709 -8.028 10.243 1.00 0.48 H new ATOM 0 HG2 GLN A 44 15.828 -9.262 12.332 1.00 0.65 H new ATOM 0 HG3 GLN A 44 16.899 -10.458 11.629 1.00 0.65 H new ATOM 0 HE21 GLN A 44 16.651 -7.175 12.947 1.00 1.10 H new ATOM 0 HE22 GLN A 44 18.390 -6.882 13.061 1.00 1.10 H new ATOM 699 N GLN A 45 13.079 -8.542 9.978 1.00 0.41 N ATOM 700 CA GLN A 45 11.773 -8.144 10.562 1.00 0.43 C ATOM 701 C GLN A 45 10.571 -8.391 9.616 1.00 0.41 C ATOM 702 O GLN A 45 9.436 -8.058 9.976 1.00 0.45 O ATOM 703 CB GLN A 45 11.822 -6.663 11.000 1.00 0.47 C ATOM 704 CG GLN A 45 12.712 -6.415 12.221 1.00 0.59 C ATOM 705 CD GLN A 45 12.896 -4.936 12.550 1.00 0.64 C ATOM 706 OE1 GLN A 45 12.108 -4.360 13.297 1.00 0.65 O ATOM 707 NE2 GLN A 45 13.940 -4.308 12.000 1.00 0.84 N ATOM 0 H GLN A 45 13.474 -7.858 9.333 1.00 0.41 H new ATOM 0 HA GLN A 45 11.610 -8.783 11.430 1.00 0.43 H new ATOM 0 HB2 GLN A 45 12.184 -6.058 10.168 1.00 0.47 H new ATOM 0 HB3 GLN A 45 10.810 -6.325 11.224 1.00 0.47 H new ATOM 0 HG2 GLN A 45 12.279 -6.920 13.085 1.00 0.59 H new ATOM 0 HG3 GLN A 45 13.689 -6.864 12.046 1.00 0.59 H new ATOM 0 HE21 GLN A 45 14.575 -4.817 11.384 1.00 0.84 H new ATOM 0 HE22 GLN A 45 14.102 -3.320 12.196 1.00 0.84 H new ATOM 716 N LEU A 46 10.808 -8.972 8.418 1.00 0.40 N ATOM 717 CA LEU A 46 9.718 -9.272 7.463 1.00 0.40 C ATOM 718 C LEU A 46 10.018 -10.571 6.648 1.00 0.40 C ATOM 719 O LEU A 46 9.839 -10.581 5.426 1.00 0.42 O ATOM 720 CB LEU A 46 9.500 -8.040 6.532 1.00 0.41 C ATOM 721 CG LEU A 46 8.043 -7.731 6.121 1.00 0.40 C ATOM 722 CD1 LEU A 46 7.245 -7.178 7.303 1.00 0.59 C ATOM 723 CD2 LEU A 46 8.009 -6.746 4.946 1.00 0.67 C ATOM 0 H LEU A 46 11.736 -9.240 8.092 1.00 0.40 H new ATOM 0 HA LEU A 46 8.797 -9.460 8.015 1.00 0.40 H new ATOM 0 HB2 LEU A 46 9.907 -7.160 7.031 1.00 0.41 H new ATOM 0 HB3 LEU A 46 10.085 -8.191 5.625 1.00 0.41 H new ATOM 0 HG LEU A 46 7.579 -8.665 5.804 1.00 0.40 H new ATOM 0 HD11 LEU A 46 6.223 -6.969 6.986 1.00 0.59 H new ATOM 0 HD12 LEU A 46 7.232 -7.912 8.109 1.00 0.59 H new ATOM 0 HD13 LEU A 46 7.710 -6.258 7.658 1.00 0.59 H new ATOM 0 HD21 LEU A 46 6.974 -6.542 4.672 1.00 0.67 H new ATOM 0 HD22 LEU A 46 8.498 -5.816 5.237 1.00 0.67 H new ATOM 0 HD23 LEU A 46 8.531 -7.179 4.093 1.00 0.67 H new ATOM 735 N PRO A 47 10.441 -11.709 7.309 1.00 0.42 N ATOM 736 CA PRO A 47 10.762 -12.962 6.597 1.00 0.45 C ATOM 737 C PRO A 47 9.532 -13.838 6.263 1.00 0.47 C ATOM 738 O PRO A 47 9.442 -14.363 5.151 1.00 0.52 O ATOM 739 CB PRO A 47 11.707 -13.675 7.573 1.00 0.49 C ATOM 740 CG PRO A 47 11.262 -13.245 8.933 1.00 0.49 C ATOM 741 CD PRO A 47 10.639 -11.874 8.781 1.00 0.46 C ATOM 0 HA PRO A 47 11.193 -12.764 5.616 1.00 0.45 H new ATOM 0 HB2 PRO A 47 11.644 -14.758 7.462 1.00 0.49 H new ATOM 0 HB3 PRO A 47 12.745 -13.396 7.391 1.00 0.49 H new ATOM 0 HG2 PRO A 47 10.542 -13.952 9.345 1.00 0.49 H new ATOM 0 HG3 PRO A 47 12.106 -13.211 9.622 1.00 0.49 H new ATOM 0 HD2 PRO A 47 9.693 -11.807 9.318 1.00 0.46 H new ATOM 0 HD3 PRO A 47 11.289 -11.097 9.183 1.00 0.46 H new ATOM 749 N HIS A 48 8.588 -13.991 7.220 1.00 0.47 N ATOM 750 CA HIS A 48 7.373 -14.814 7.014 1.00 0.52 C ATOM 751 C HIS A 48 6.482 -14.252 5.893 1.00 0.50 C ATOM 752 O HIS A 48 5.851 -15.024 5.165 1.00 0.57 O ATOM 753 CB HIS A 48 6.569 -14.948 8.322 1.00 0.57 C ATOM 754 CG HIS A 48 7.253 -15.787 9.361 1.00 0.65 C ATOM 755 ND1 HIS A 48 7.972 -15.257 10.415 1.00 0.69 N ATOM 756 CD2 HIS A 48 7.333 -17.131 9.494 1.00 0.79 C ATOM 757 CE1 HIS A 48 8.462 -16.241 11.147 1.00 0.80 C ATOM 758 NE2 HIS A 48 8.086 -17.387 10.610 1.00 0.85 N ATOM 0 H HIS A 48 8.644 -13.556 8.141 1.00 0.47 H new ATOM 0 HA HIS A 48 7.707 -15.805 6.706 1.00 0.52 H new ATOM 0 HB2 HIS A 48 6.387 -13.954 8.731 1.00 0.57 H new ATOM 0 HB3 HIS A 48 5.595 -15.384 8.098 1.00 0.57 H new ATOM 0 HD2 HIS A 48 6.886 -17.866 8.841 1.00 0.79 H new ATOM 0 HE1 HIS A 48 9.067 -16.128 12.034 1.00 0.80 H new ATOM 0 HE2 HIS A 48 8.318 -18.313 10.968 1.00 0.85 H new ATOM 767 N LEU A 49 6.437 -12.908 5.758 1.00 0.46 N ATOM 768 CA LEU A 49 5.640 -12.241 4.711 1.00 0.46 C ATOM 769 C LEU A 49 6.226 -12.541 3.313 1.00 0.45 C ATOM 770 O LEU A 49 5.516 -13.043 2.436 1.00 0.53 O ATOM 771 CB LEU A 49 5.593 -10.718 4.977 1.00 0.47 C ATOM 772 CG LEU A 49 4.490 -9.918 4.254 1.00 0.50 C ATOM 773 CD1 LEU A 49 3.102 -10.260 4.801 1.00 0.87 C ATOM 774 CD2 LEU A 49 4.763 -8.420 4.376 1.00 0.53 C ATOM 0 H LEU A 49 6.946 -12.265 6.364 1.00 0.46 H new ATOM 0 HA LEU A 49 4.622 -12.629 4.737 1.00 0.46 H new ATOM 0 HB2 LEU A 49 5.476 -10.564 6.050 1.00 0.47 H new ATOM 0 HB3 LEU A 49 6.558 -10.295 4.698 1.00 0.47 H new ATOM 0 HG LEU A 49 4.505 -10.196 3.200 1.00 0.50 H new ATOM 0 HD11 LEU A 49 2.348 -9.679 4.270 1.00 0.87 H new ATOM 0 HD12 LEU A 49 2.907 -11.323 4.659 1.00 0.87 H new ATOM 0 HD13 LEU A 49 3.061 -10.022 5.864 1.00 0.87 H new ATOM 0 HD21 LEU A 49 3.979 -7.864 3.862 1.00 0.53 H new ATOM 0 HD22 LEU A 49 4.778 -8.137 5.429 1.00 0.53 H new ATOM 0 HD23 LEU A 49 5.727 -8.188 3.924 1.00 0.53 H new ATOM 786 N LEU A 50 7.526 -12.233 3.129 1.00 0.43 N ATOM 787 CA LEU A 50 8.243 -12.487 1.870 1.00 0.45 C ATOM 788 C LEU A 50 9.322 -13.561 2.123 1.00 0.48 C ATOM 789 O LEU A 50 10.497 -13.240 2.352 1.00 0.54 O ATOM 790 CB LEU A 50 8.863 -11.175 1.327 1.00 0.48 C ATOM 791 CG LEU A 50 7.868 -10.040 0.968 1.00 0.57 C ATOM 792 CD1 LEU A 50 8.618 -8.748 0.634 1.00 0.66 C ATOM 793 CD2 LEU A 50 6.957 -10.445 -0.198 1.00 0.73 C ATOM 0 H LEU A 50 8.105 -11.802 3.850 1.00 0.43 H new ATOM 0 HA LEU A 50 7.550 -12.853 1.112 1.00 0.45 H new ATOM 0 HB2 LEU A 50 9.562 -10.794 2.071 1.00 0.48 H new ATOM 0 HB3 LEU A 50 9.444 -11.414 0.437 1.00 0.48 H new ATOM 0 HG LEU A 50 7.240 -9.863 1.841 1.00 0.57 H new ATOM 0 HD11 LEU A 50 7.901 -7.965 0.385 1.00 0.66 H new ATOM 0 HD12 LEU A 50 9.210 -8.438 1.495 1.00 0.66 H new ATOM 0 HD13 LEU A 50 9.278 -8.920 -0.217 1.00 0.66 H new ATOM 0 HD21 LEU A 50 6.272 -9.628 -0.425 1.00 0.73 H new ATOM 0 HD22 LEU A 50 7.565 -10.663 -1.076 1.00 0.73 H new ATOM 0 HD23 LEU A 50 6.386 -11.332 0.077 1.00 0.73 H new ATOM 805 N LYS A 51 8.892 -14.842 2.107 1.00 0.55 N ATOM 806 CA LYS A 51 9.783 -16.005 2.364 1.00 0.66 C ATOM 807 C LYS A 51 10.989 -16.089 1.406 1.00 0.63 C ATOM 808 O LYS A 51 12.064 -16.543 1.816 1.00 0.76 O ATOM 809 CB LYS A 51 8.985 -17.330 2.326 1.00 0.78 C ATOM 810 CG LYS A 51 8.278 -17.620 0.995 1.00 0.78 C ATOM 811 CD LYS A 51 7.633 -19.007 0.978 1.00 1.18 C ATOM 812 CE LYS A 51 6.968 -19.314 -0.362 1.00 1.16 C ATOM 813 NZ LYS A 51 7.961 -19.586 -1.448 1.00 1.32 N ATOM 0 H LYS A 51 7.924 -15.102 1.917 1.00 0.55 H new ATOM 0 HA LYS A 51 10.189 -15.848 3.363 1.00 0.66 H new ATOM 0 HB2 LYS A 51 9.665 -18.153 2.547 1.00 0.78 H new ATOM 0 HB3 LYS A 51 8.239 -17.311 3.120 1.00 0.78 H new ATOM 0 HG2 LYS A 51 7.514 -16.863 0.818 1.00 0.78 H new ATOM 0 HG3 LYS A 51 8.997 -17.545 0.179 1.00 0.78 H new ATOM 0 HD2 LYS A 51 8.391 -19.762 1.187 1.00 1.18 H new ATOM 0 HD3 LYS A 51 6.891 -19.071 1.774 1.00 1.18 H new ATOM 0 HE2 LYS A 51 6.313 -20.178 -0.249 1.00 1.16 H new ATOM 0 HE3 LYS A 51 6.339 -18.473 -0.652 1.00 1.16 H new ATOM 0 HZ1 LYS A 51 7.458 -19.788 -2.336 1.00 1.32 H new ATOM 0 HZ2 LYS A 51 8.571 -18.753 -1.578 1.00 1.32 H new ATOM 0 HZ3 LYS A 51 8.545 -20.406 -1.187 1.00 1.32 H new ATOM 827 N ASP A 52 10.812 -15.662 0.141 1.00 0.64 N ATOM 828 CA ASP A 52 11.899 -15.696 -0.847 1.00 0.71 C ATOM 829 C ASP A 52 12.839 -14.484 -0.645 1.00 0.59 C ATOM 830 O ASP A 52 12.752 -13.481 -1.366 1.00 0.73 O ATOM 831 CB ASP A 52 11.326 -15.745 -2.288 1.00 0.99 C ATOM 832 CG ASP A 52 12.213 -16.511 -3.264 1.00 1.46 C ATOM 833 OD1 ASP A 52 13.456 -16.383 -3.175 1.00 2.08 O ATOM 834 OD2 ASP A 52 11.665 -17.243 -4.114 1.00 2.02 O ATOM 0 H ASP A 52 9.931 -15.292 -0.216 1.00 0.64 H new ATOM 0 HA ASP A 52 12.486 -16.603 -0.700 1.00 0.71 H new ATOM 0 HB2 ASP A 52 10.340 -16.208 -2.264 1.00 0.99 H new ATOM 0 HB3 ASP A 52 11.191 -14.727 -2.653 1.00 0.99 H new ATOM 839 N VAL A 53 13.723 -14.586 0.371 1.00 0.51 N ATOM 840 CA VAL A 53 14.685 -13.512 0.709 1.00 0.52 C ATOM 841 C VAL A 53 15.818 -13.392 -0.332 1.00 0.56 C ATOM 842 O VAL A 53 16.317 -12.287 -0.572 1.00 0.71 O ATOM 843 CB VAL A 53 15.291 -13.676 2.149 1.00 0.59 C ATOM 844 CG1 VAL A 53 14.204 -13.531 3.216 1.00 0.65 C ATOM 845 CG2 VAL A 53 16.042 -15.006 2.329 1.00 0.64 C ATOM 0 H VAL A 53 13.791 -15.405 0.975 1.00 0.51 H new ATOM 0 HA VAL A 53 14.107 -12.588 0.692 1.00 0.52 H new ATOM 0 HB VAL A 53 16.021 -12.876 2.272 1.00 0.59 H new ATOM 0 HG11 VAL A 53 14.647 -13.648 4.205 1.00 0.65 H new ATOM 0 HG12 VAL A 53 13.747 -12.545 3.138 1.00 0.65 H new ATOM 0 HG13 VAL A 53 13.443 -14.297 3.066 1.00 0.65 H new ATOM 0 HG21 VAL A 53 16.439 -15.065 3.342 1.00 0.64 H new ATOM 0 HG22 VAL A 53 15.357 -15.837 2.159 1.00 0.64 H new ATOM 0 HG23 VAL A 53 16.863 -15.060 1.614 1.00 0.64 H new ATOM 855 N GLY A 54 16.217 -14.531 -0.942 1.00 0.53 N ATOM 856 CA GLY A 54 17.273 -14.541 -1.957 1.00 0.64 C ATOM 857 C GLY A 54 16.843 -13.929 -3.291 1.00 0.61 C ATOM 858 O GLY A 54 17.636 -13.223 -3.925 1.00 0.83 O ATOM 0 H GLY A 54 15.819 -15.449 -0.743 1.00 0.53 H new ATOM 0 HA2 GLY A 54 18.136 -13.995 -1.577 1.00 0.64 H new ATOM 0 HA3 GLY A 54 17.595 -15.569 -2.125 1.00 0.64 H new ATOM 862 N SER A 55 15.584 -14.186 -3.713 1.00 0.57 N ATOM 863 CA SER A 55 15.052 -13.655 -4.984 1.00 0.58 C ATOM 864 C SER A 55 14.358 -12.288 -4.775 1.00 0.51 C ATOM 865 O SER A 55 13.200 -12.097 -5.172 1.00 0.62 O ATOM 866 CB SER A 55 14.085 -14.668 -5.630 1.00 0.74 C ATOM 867 OG SER A 55 13.736 -14.276 -6.950 1.00 0.85 O ATOM 0 H SER A 55 14.920 -14.758 -3.191 1.00 0.57 H new ATOM 0 HA SER A 55 15.892 -13.499 -5.661 1.00 0.58 H new ATOM 0 HB2 SER A 55 14.549 -15.654 -5.651 1.00 0.74 H new ATOM 0 HB3 SER A 55 13.184 -14.752 -5.023 1.00 0.74 H new ATOM 0 HG SER A 55 13.336 -13.382 -6.931 1.00 0.85 H new ATOM 873 N LEU A 56 15.082 -11.333 -4.149 1.00 0.49 N ATOM 874 CA LEU A 56 14.557 -9.975 -3.908 1.00 0.53 C ATOM 875 C LEU A 56 14.822 -9.068 -5.132 1.00 0.58 C ATOM 876 O LEU A 56 14.184 -8.023 -5.267 1.00 1.03 O ATOM 877 CB LEU A 56 15.163 -9.366 -2.610 1.00 0.67 C ATOM 878 CG LEU A 56 14.198 -8.580 -1.673 1.00 0.83 C ATOM 879 CD1 LEU A 56 13.660 -7.315 -2.342 1.00 1.22 C ATOM 880 CD2 LEU A 56 13.043 -9.460 -1.173 1.00 1.21 C ATOM 0 H LEU A 56 16.030 -11.480 -3.803 1.00 0.49 H new ATOM 0 HA LEU A 56 13.478 -10.043 -3.766 1.00 0.53 H new ATOM 0 HB2 LEU A 56 15.608 -10.176 -2.033 1.00 0.67 H new ATOM 0 HB3 LEU A 56 15.974 -8.697 -2.898 1.00 0.67 H new ATOM 0 HG LEU A 56 14.786 -8.276 -0.807 1.00 0.83 H new ATOM 0 HD11 LEU A 56 12.991 -6.796 -1.655 1.00 1.22 H new ATOM 0 HD12 LEU A 56 14.491 -6.660 -2.603 1.00 1.22 H new ATOM 0 HD13 LEU A 56 13.114 -7.586 -3.245 1.00 1.22 H new ATOM 0 HD21 LEU A 56 12.394 -8.873 -0.523 1.00 1.21 H new ATOM 0 HD22 LEU A 56 12.469 -9.826 -2.025 1.00 1.21 H new ATOM 0 HD23 LEU A 56 13.445 -10.306 -0.616 1.00 1.21 H new ATOM 892 N ASP A 57 15.766 -9.480 -6.026 1.00 0.49 N ATOM 893 CA ASP A 57 16.086 -8.719 -7.260 1.00 0.53 C ATOM 894 C ASP A 57 14.844 -8.588 -8.173 1.00 0.47 C ATOM 895 O ASP A 57 14.705 -7.591 -8.888 1.00 0.50 O ATOM 896 CB ASP A 57 17.269 -9.361 -8.033 1.00 0.67 C ATOM 897 CG ASP A 57 17.013 -10.798 -8.475 1.00 0.70 C ATOM 898 OD1 ASP A 57 16.450 -10.992 -9.573 1.00 0.77 O ATOM 899 OD2 ASP A 57 17.378 -11.726 -7.721 1.00 0.77 O ATOM 0 H ASP A 57 16.314 -10.332 -5.912 1.00 0.49 H new ATOM 0 HA ASP A 57 16.391 -7.718 -6.954 1.00 0.53 H new ATOM 0 HB2 ASP A 57 17.487 -8.755 -8.912 1.00 0.67 H new ATOM 0 HB3 ASP A 57 18.157 -9.338 -7.402 1.00 0.67 H new ATOM 904 N GLU A 58 13.949 -9.611 -8.142 1.00 0.46 N ATOM 905 CA GLU A 58 12.691 -9.602 -8.924 1.00 0.51 C ATOM 906 C GLU A 58 11.824 -8.379 -8.547 1.00 0.47 C ATOM 907 O GLU A 58 11.172 -7.785 -9.411 1.00 0.56 O ATOM 908 CB GLU A 58 11.908 -10.920 -8.691 1.00 0.60 C ATOM 909 CG GLU A 58 10.627 -11.069 -9.516 1.00 0.79 C ATOM 910 CD GLU A 58 9.995 -12.449 -9.385 1.00 0.92 C ATOM 911 OE1 GLU A 58 9.255 -12.675 -8.404 1.00 1.02 O ATOM 912 OE2 GLU A 58 10.249 -13.302 -10.262 1.00 1.09 O ATOM 0 H GLU A 58 14.080 -10.453 -7.581 1.00 0.46 H new ATOM 0 HA GLU A 58 12.940 -9.528 -9.983 1.00 0.51 H new ATOM 0 HB2 GLU A 58 12.566 -11.760 -8.915 1.00 0.60 H new ATOM 0 HB3 GLU A 58 11.651 -10.990 -7.634 1.00 0.60 H new ATOM 0 HG2 GLU A 58 9.907 -10.314 -9.200 1.00 0.79 H new ATOM 0 HG3 GLU A 58 10.852 -10.876 -10.565 1.00 0.79 H new ATOM 919 N LYS A 59 11.838 -8.014 -7.246 1.00 0.42 N ATOM 920 CA LYS A 59 11.085 -6.860 -6.732 1.00 0.47 C ATOM 921 C LYS A 59 11.937 -5.579 -6.816 1.00 0.53 C ATOM 922 O LYS A 59 11.415 -4.518 -7.159 1.00 0.91 O ATOM 923 CB LYS A 59 10.634 -7.103 -5.273 1.00 0.52 C ATOM 924 CG LYS A 59 9.559 -8.187 -5.100 1.00 0.60 C ATOM 925 CD LYS A 59 10.124 -9.610 -5.172 1.00 0.81 C ATOM 926 CE LYS A 59 9.051 -10.665 -4.913 1.00 1.17 C ATOM 927 NZ LYS A 59 9.560 -12.053 -5.126 1.00 1.55 N ATOM 0 H LYS A 59 12.369 -8.511 -6.531 1.00 0.42 H new ATOM 0 HA LYS A 59 10.197 -6.733 -7.351 1.00 0.47 H new ATOM 0 HB2 LYS A 59 11.506 -7.379 -4.680 1.00 0.52 H new ATOM 0 HB3 LYS A 59 10.254 -6.167 -4.865 1.00 0.52 H new ATOM 0 HG2 LYS A 59 9.062 -8.048 -4.140 1.00 0.60 H new ATOM 0 HG3 LYS A 59 8.800 -8.064 -5.872 1.00 0.60 H new ATOM 0 HD2 LYS A 59 10.565 -9.776 -6.155 1.00 0.81 H new ATOM 0 HD3 LYS A 59 10.924 -9.720 -4.440 1.00 0.81 H new ATOM 0 HE2 LYS A 59 8.687 -10.567 -3.890 1.00 1.17 H new ATOM 0 HE3 LYS A 59 8.202 -10.486 -5.572 1.00 1.17 H new ATOM 0 HZ1 LYS A 59 8.995 -12.720 -4.563 1.00 1.55 H new ATOM 0 HZ2 LYS A 59 9.485 -12.300 -6.134 1.00 1.55 H new ATOM 0 HZ3 LYS A 59 10.555 -12.107 -4.830 1.00 1.55 H new ATOM 941 N MET A 60 13.254 -5.698 -6.515 1.00 0.39 N ATOM 942 CA MET A 60 14.203 -4.557 -6.556 1.00 0.41 C ATOM 943 C MET A 60 14.239 -3.879 -7.945 1.00 0.42 C ATOM 944 O MET A 60 14.420 -2.663 -8.027 1.00 0.46 O ATOM 945 CB MET A 60 15.620 -5.023 -6.148 1.00 0.45 C ATOM 946 CG MET A 60 16.562 -3.887 -5.736 1.00 0.53 C ATOM 947 SD MET A 60 18.162 -4.463 -5.117 1.00 0.66 S ATOM 948 CE MET A 60 18.975 -4.980 -6.629 1.00 0.84 C ATOM 0 H MET A 60 13.686 -6.580 -6.239 1.00 0.39 H new ATOM 0 HA MET A 60 13.849 -3.814 -5.841 1.00 0.41 H new ATOM 0 HB2 MET A 60 15.534 -5.727 -5.320 1.00 0.45 H new ATOM 0 HB3 MET A 60 16.066 -5.565 -6.982 1.00 0.45 H new ATOM 0 HG2 MET A 60 16.727 -3.234 -6.593 1.00 0.53 H new ATOM 0 HG3 MET A 60 16.078 -3.286 -4.966 1.00 0.53 H new ATOM 0 HE1 MET A 60 19.971 -5.357 -6.396 1.00 0.84 H new ATOM 0 HE2 MET A 60 18.391 -5.767 -7.105 1.00 0.84 H new ATOM 0 HE3 MET A 60 19.058 -4.130 -7.306 1.00 0.84 H new ATOM 958 N LYS A 61 14.067 -4.671 -9.030 1.00 0.44 N ATOM 959 CA LYS A 61 14.039 -4.131 -10.409 1.00 0.49 C ATOM 960 C LYS A 61 12.806 -3.229 -10.613 1.00 0.46 C ATOM 961 O LYS A 61 12.890 -2.206 -11.302 1.00 0.49 O ATOM 962 CB LYS A 61 14.041 -5.277 -11.446 1.00 0.59 C ATOM 963 CG LYS A 61 15.414 -5.934 -11.675 1.00 0.70 C ATOM 964 CD LYS A 61 16.403 -5.028 -12.425 1.00 1.11 C ATOM 965 CE LYS A 61 15.994 -4.789 -13.882 1.00 1.90 C ATOM 966 NZ LYS A 61 17.059 -4.098 -14.665 1.00 2.56 N ATOM 0 H LYS A 61 13.946 -5.682 -8.977 1.00 0.44 H new ATOM 0 HA LYS A 61 14.937 -3.531 -10.556 1.00 0.49 H new ATOM 0 HB2 LYS A 61 13.336 -6.043 -11.122 1.00 0.59 H new ATOM 0 HB3 LYS A 61 13.676 -4.889 -12.397 1.00 0.59 H new ATOM 0 HG2 LYS A 61 15.843 -6.209 -10.711 1.00 0.70 H new ATOM 0 HG3 LYS A 61 15.278 -6.857 -12.239 1.00 0.70 H new ATOM 0 HD2 LYS A 61 16.475 -4.070 -11.910 1.00 1.11 H new ATOM 0 HD3 LYS A 61 17.395 -5.479 -12.399 1.00 1.11 H new ATOM 0 HE2 LYS A 61 15.762 -5.744 -14.353 1.00 1.90 H new ATOM 0 HE3 LYS A 61 15.083 -4.192 -13.907 1.00 1.90 H new ATOM 0 HZ1 LYS A 61 16.735 -3.959 -15.644 1.00 2.56 H new ATOM 0 HZ2 LYS A 61 17.263 -3.174 -14.233 1.00 2.56 H new ATOM 0 HZ3 LYS A 61 17.922 -4.679 -14.665 1.00 2.56 H new ATOM 980 N SER A 62 11.668 -3.619 -10.003 1.00 0.44 N ATOM 981 CA SER A 62 10.419 -2.843 -10.071 1.00 0.46 C ATOM 982 C SER A 62 10.492 -1.596 -9.167 1.00 0.43 C ATOM 983 O SER A 62 9.874 -0.573 -9.473 1.00 0.47 O ATOM 984 CB SER A 62 9.226 -3.724 -9.672 1.00 0.53 C ATOM 985 OG SER A 62 9.084 -4.819 -10.563 1.00 0.61 O ATOM 0 H SER A 62 11.592 -4.475 -9.454 1.00 0.44 H new ATOM 0 HA SER A 62 10.282 -2.507 -11.099 1.00 0.46 H new ATOM 0 HB2 SER A 62 9.365 -4.093 -8.656 1.00 0.53 H new ATOM 0 HB3 SER A 62 8.313 -3.129 -9.673 1.00 0.53 H new ATOM 0 HG SER A 62 8.319 -5.367 -10.289 1.00 0.61 H new ATOM 991 N LEU A 63 11.249 -1.691 -8.044 1.00 0.40 N ATOM 992 CA LEU A 63 11.421 -0.564 -7.112 1.00 0.43 C ATOM 993 C LEU A 63 12.404 0.472 -7.690 1.00 0.45 C ATOM 994 O LEU A 63 12.028 1.628 -7.900 1.00 0.53 O ATOM 995 CB LEU A 63 11.904 -1.052 -5.718 1.00 0.45 C ATOM 996 CG LEU A 63 11.023 -2.120 -5.016 1.00 0.42 C ATOM 997 CD1 LEU A 63 11.702 -2.643 -3.747 1.00 0.48 C ATOM 998 CD2 LEU A 63 9.626 -1.582 -4.697 1.00 0.68 C ATOM 0 H LEU A 63 11.746 -2.538 -7.769 1.00 0.40 H new ATOM 0 HA LEU A 63 10.449 -0.088 -6.982 1.00 0.43 H new ATOM 0 HB2 LEU A 63 12.910 -1.458 -5.828 1.00 0.45 H new ATOM 0 HB3 LEU A 63 11.980 -0.186 -5.060 1.00 0.45 H new ATOM 0 HG LEU A 63 10.906 -2.951 -5.712 1.00 0.42 H new ATOM 0 HD11 LEU A 63 11.064 -3.390 -3.274 1.00 0.48 H new ATOM 0 HD12 LEU A 63 12.659 -3.095 -4.007 1.00 0.48 H new ATOM 0 HD13 LEU A 63 11.867 -1.817 -3.056 1.00 0.48 H new ATOM 0 HD21 LEU A 63 9.040 -2.359 -4.206 1.00 0.68 H new ATOM 0 HD22 LEU A 63 9.710 -0.719 -4.036 1.00 0.68 H new ATOM 0 HD23 LEU A 63 9.131 -1.284 -5.621 1.00 0.68 H new ATOM 1010 N ASP A 64 13.658 0.048 -7.970 1.00 0.45 N ATOM 1011 CA ASP A 64 14.685 0.949 -8.531 1.00 0.51 C ATOM 1012 C ASP A 64 14.493 1.096 -10.062 1.00 0.50 C ATOM 1013 O ASP A 64 15.261 0.542 -10.858 1.00 0.54 O ATOM 1014 CB ASP A 64 16.102 0.432 -8.176 1.00 0.60 C ATOM 1015 CG ASP A 64 17.212 1.417 -8.532 1.00 0.83 C ATOM 1016 OD1 ASP A 64 17.289 2.485 -7.891 1.00 1.39 O ATOM 1017 OD2 ASP A 64 18.005 1.111 -9.448 1.00 1.28 O ATOM 0 H ASP A 64 13.980 -0.908 -7.817 1.00 0.45 H new ATOM 0 HA ASP A 64 14.574 1.939 -8.089 1.00 0.51 H new ATOM 0 HB2 ASP A 64 16.146 0.217 -7.108 1.00 0.60 H new ATOM 0 HB3 ASP A 64 16.279 -0.508 -8.698 1.00 0.60 H new ATOM 1022 N VAL A 65 13.443 1.850 -10.455 1.00 0.51 N ATOM 1023 CA VAL A 65 13.114 2.092 -11.875 1.00 0.55 C ATOM 1024 C VAL A 65 13.687 3.444 -12.369 1.00 0.55 C ATOM 1025 O VAL A 65 14.083 3.555 -13.533 1.00 0.60 O ATOM 1026 CB VAL A 65 11.566 1.990 -12.127 1.00 0.64 C ATOM 1027 CG1 VAL A 65 10.773 3.110 -11.438 1.00 0.67 C ATOM 1028 CG2 VAL A 65 11.245 1.940 -13.626 1.00 0.73 C ATOM 0 H VAL A 65 12.805 2.304 -9.802 1.00 0.51 H new ATOM 0 HA VAL A 65 13.592 1.308 -12.462 1.00 0.55 H new ATOM 0 HB VAL A 65 11.247 1.052 -11.673 1.00 0.64 H new ATOM 0 HG11 VAL A 65 9.711 2.986 -11.649 1.00 0.67 H new ATOM 0 HG12 VAL A 65 10.937 3.063 -10.362 1.00 0.67 H new ATOM 0 HG13 VAL A 65 11.107 4.077 -11.814 1.00 0.67 H new ATOM 0 HG21 VAL A 65 10.166 1.870 -13.765 1.00 0.73 H new ATOM 0 HG22 VAL A 65 11.615 2.845 -14.108 1.00 0.73 H new ATOM 0 HG23 VAL A 65 11.726 1.069 -14.072 1.00 0.73 H new ATOM 1038 N ASN A 66 13.731 4.459 -11.477 1.00 0.56 N ATOM 1039 CA ASN A 66 14.278 5.792 -11.814 1.00 0.60 C ATOM 1040 C ASN A 66 15.826 5.752 -11.913 1.00 0.59 C ATOM 1041 O ASN A 66 16.418 6.557 -12.638 1.00 0.66 O ATOM 1042 CB ASN A 66 13.836 6.832 -10.758 1.00 0.67 C ATOM 1043 CG ASN A 66 13.911 8.273 -11.260 1.00 0.94 C ATOM 1044 OD1 ASN A 66 12.938 8.797 -11.802 1.00 1.29 O ATOM 1045 ND2 ASN A 66 15.061 8.926 -11.086 1.00 1.44 N ATOM 0 H ASN A 66 13.394 4.380 -10.518 1.00 0.56 H new ATOM 0 HA ASN A 66 13.885 6.084 -12.788 1.00 0.60 H new ATOM 0 HB2 ASN A 66 12.813 6.615 -10.450 1.00 0.67 H new ATOM 0 HB3 ASN A 66 14.464 6.730 -9.873 1.00 0.67 H new ATOM 0 HD21 ASN A 66 15.154 9.890 -11.406 1.00 1.44 H new ATOM 0 HD22 ASN A 66 15.848 8.461 -10.633 1.00 1.44 H new ATOM 1052 N GLN A 67 16.466 4.810 -11.161 1.00 0.55 N ATOM 1053 CA GLN A 67 17.935 4.616 -11.142 1.00 0.60 C ATOM 1054 C GLN A 67 18.663 5.813 -10.500 1.00 0.63 C ATOM 1055 O GLN A 67 19.192 6.686 -11.200 1.00 0.78 O ATOM 1056 CB GLN A 67 18.497 4.318 -12.555 1.00 0.70 C ATOM 1057 CG GLN A 67 17.945 3.042 -13.199 1.00 0.88 C ATOM 1058 CD GLN A 67 18.339 2.891 -14.668 1.00 1.20 C ATOM 1059 OE1 GLN A 67 18.990 1.918 -15.046 1.00 1.96 O ATOM 1060 NE2 GLN A 67 17.948 3.853 -15.512 1.00 1.86 N ATOM 0 H GLN A 67 15.968 4.163 -10.549 1.00 0.55 H new ATOM 0 HA GLN A 67 18.126 3.741 -10.521 1.00 0.60 H new ATOM 0 HB2 GLN A 67 18.277 5.164 -13.206 1.00 0.70 H new ATOM 0 HB3 GLN A 67 19.582 4.239 -12.492 1.00 0.70 H new ATOM 0 HG2 GLN A 67 18.305 2.177 -12.642 1.00 0.88 H new ATOM 0 HG3 GLN A 67 16.858 3.043 -13.119 1.00 0.88 H new ATOM 0 HE21 GLN A 67 17.409 4.647 -15.166 1.00 1.86 H new ATOM 0 HE22 GLN A 67 18.189 3.792 -16.501 1.00 1.86 H new ATOM 1069 N ASP A 68 18.645 5.859 -9.157 1.00 0.62 N ATOM 1070 CA ASP A 68 19.318 6.927 -8.388 1.00 0.71 C ATOM 1071 C ASP A 68 19.949 6.393 -7.072 1.00 0.77 C ATOM 1072 O ASP A 68 20.424 7.188 -6.256 1.00 1.32 O ATOM 1073 CB ASP A 68 18.300 8.051 -8.074 1.00 0.78 C ATOM 1074 CG ASP A 68 18.956 9.358 -7.640 1.00 1.08 C ATOM 1075 OD1 ASP A 68 19.414 10.117 -8.520 1.00 1.41 O ATOM 1076 OD2 ASP A 68 19.011 9.617 -6.419 1.00 1.37 O ATOM 0 H ASP A 68 18.170 5.167 -8.577 1.00 0.62 H new ATOM 0 HA ASP A 68 20.132 7.319 -8.998 1.00 0.71 H new ATOM 0 HB2 ASP A 68 17.689 8.235 -8.958 1.00 0.78 H new ATOM 0 HB3 ASP A 68 17.627 7.712 -7.287 1.00 0.78 H new ATOM 1081 N SER A 69 19.972 5.045 -6.873 1.00 0.62 N ATOM 1082 CA SER A 69 20.517 4.412 -5.647 1.00 0.67 C ATOM 1083 C SER A 69 19.753 4.845 -4.363 1.00 0.68 C ATOM 1084 O SER A 69 20.261 4.672 -3.249 1.00 1.24 O ATOM 1085 CB SER A 69 22.030 4.699 -5.509 1.00 0.82 C ATOM 1086 OG SER A 69 22.625 3.871 -4.520 1.00 1.31 O ATOM 0 H SER A 69 19.615 4.375 -7.555 1.00 0.62 H new ATOM 0 HA SER A 69 20.372 3.337 -5.754 1.00 0.67 H new ATOM 0 HB2 SER A 69 22.522 4.535 -6.468 1.00 0.82 H new ATOM 0 HB3 SER A 69 22.181 5.746 -5.248 1.00 0.82 H new ATOM 0 HG SER A 69 22.079 3.890 -3.706 1.00 1.31 H new ATOM 1092 N GLU A 70 18.522 5.387 -4.525 1.00 0.66 N ATOM 1093 CA GLU A 70 17.687 5.840 -3.401 1.00 0.77 C ATOM 1094 C GLU A 70 16.228 5.440 -3.659 1.00 0.64 C ATOM 1095 O GLU A 70 15.597 5.958 -4.589 1.00 0.75 O ATOM 1096 CB GLU A 70 17.796 7.370 -3.217 1.00 1.13 C ATOM 1097 CG GLU A 70 19.200 7.865 -2.861 1.00 1.41 C ATOM 1098 CD GLU A 70 19.250 9.357 -2.590 1.00 1.90 C ATOM 1099 OE1 GLU A 70 19.150 10.141 -3.557 1.00 2.41 O ATOM 1100 OE2 GLU A 70 19.392 9.740 -1.410 1.00 2.42 O ATOM 0 H GLU A 70 18.087 5.519 -5.438 1.00 0.66 H new ATOM 0 HA GLU A 70 18.039 5.365 -2.485 1.00 0.77 H new ATOM 0 HB2 GLU A 70 17.474 7.858 -4.137 1.00 1.13 H new ATOM 0 HB3 GLU A 70 17.105 7.680 -2.433 1.00 1.13 H new ATOM 0 HG2 GLU A 70 19.556 7.329 -1.981 1.00 1.41 H new ATOM 0 HG3 GLU A 70 19.882 7.626 -3.677 1.00 1.41 H new ATOM 1107 N LEU A 71 15.698 4.514 -2.837 1.00 0.57 N ATOM 1108 CA LEU A 71 14.316 4.025 -2.991 1.00 0.51 C ATOM 1109 C LEU A 71 13.297 4.989 -2.349 1.00 0.51 C ATOM 1110 O LEU A 71 12.888 4.794 -1.197 1.00 0.53 O ATOM 1111 CB LEU A 71 14.150 2.599 -2.393 1.00 0.53 C ATOM 1112 CG LEU A 71 14.745 1.425 -3.218 1.00 0.66 C ATOM 1113 CD1 LEU A 71 16.275 1.414 -3.152 1.00 0.95 C ATOM 1114 CD2 LEU A 71 14.175 0.084 -2.740 1.00 0.74 C ATOM 0 H LEU A 71 16.206 4.090 -2.061 1.00 0.57 H new ATOM 0 HA LEU A 71 14.115 3.978 -4.061 1.00 0.51 H new ATOM 0 HB2 LEU A 71 14.610 2.588 -1.405 1.00 0.53 H new ATOM 0 HB3 LEU A 71 13.086 2.411 -2.251 1.00 0.53 H new ATOM 0 HG LEU A 71 14.458 1.573 -4.259 1.00 0.66 H new ATOM 0 HD11 LEU A 71 16.659 0.580 -3.740 1.00 0.95 H new ATOM 0 HD12 LEU A 71 16.663 2.350 -3.554 1.00 0.95 H new ATOM 0 HD13 LEU A 71 16.594 1.304 -2.115 1.00 0.95 H new ATOM 0 HD21 LEU A 71 14.604 -0.725 -3.331 1.00 0.74 H new ATOM 0 HD22 LEU A 71 14.423 -0.063 -1.689 1.00 0.74 H new ATOM 0 HD23 LEU A 71 13.092 0.086 -2.860 1.00 0.74 H new ATOM 1126 N LYS A 72 12.898 6.046 -3.099 1.00 0.53 N ATOM 1127 CA LYS A 72 11.877 7.019 -2.626 1.00 0.56 C ATOM 1128 C LYS A 72 10.550 6.275 -2.377 1.00 0.50 C ATOM 1129 O LYS A 72 10.400 5.146 -2.847 1.00 0.48 O ATOM 1130 CB LYS A 72 11.670 8.152 -3.672 1.00 0.63 C ATOM 1131 CG LYS A 72 12.029 9.548 -3.168 1.00 0.86 C ATOM 1132 CD LYS A 72 11.557 10.638 -4.130 1.00 1.00 C ATOM 1133 CE LYS A 72 11.825 12.044 -3.591 1.00 1.43 C ATOM 1134 NZ LYS A 72 11.040 12.350 -2.354 1.00 1.89 N ATOM 0 H LYS A 72 13.264 6.247 -4.029 1.00 0.53 H new ATOM 0 HA LYS A 72 12.221 7.476 -1.698 1.00 0.56 H new ATOM 0 HB2 LYS A 72 12.272 7.931 -4.553 1.00 0.63 H new ATOM 0 HB3 LYS A 72 10.627 8.151 -3.990 1.00 0.63 H new ATOM 0 HG2 LYS A 72 11.578 9.708 -2.188 1.00 0.86 H new ATOM 0 HG3 LYS A 72 13.109 9.621 -3.038 1.00 0.86 H new ATOM 0 HD2 LYS A 72 12.061 10.517 -5.089 1.00 1.00 H new ATOM 0 HD3 LYS A 72 10.489 10.519 -4.314 1.00 1.00 H new ATOM 0 HE2 LYS A 72 12.888 12.149 -3.376 1.00 1.43 H new ATOM 0 HE3 LYS A 72 11.581 12.776 -4.361 1.00 1.43 H new ATOM 0 HZ1 LYS A 72 11.141 13.358 -2.119 1.00 1.89 H new ATOM 0 HZ2 LYS A 72 10.036 12.131 -2.517 1.00 1.89 H new ATOM 0 HZ3 LYS A 72 11.397 11.774 -1.565 1.00 1.89 H new ATOM 1148 N PHE A 73 9.578 6.884 -1.658 1.00 0.53 N ATOM 1149 CA PHE A 73 8.291 6.191 -1.396 1.00 0.50 C ATOM 1150 C PHE A 73 7.501 5.909 -2.697 1.00 0.47 C ATOM 1151 O PHE A 73 6.684 4.990 -2.725 1.00 0.47 O ATOM 1152 CB PHE A 73 7.410 6.924 -0.363 1.00 0.56 C ATOM 1153 CG PHE A 73 6.424 5.986 0.315 1.00 0.69 C ATOM 1154 CD1 PHE A 73 6.828 5.174 1.371 1.00 0.87 C ATOM 1155 CD2 PHE A 73 5.111 5.880 -0.133 1.00 0.89 C ATOM 1156 CE1 PHE A 73 5.948 4.291 1.965 1.00 1.11 C ATOM 1157 CE2 PHE A 73 4.232 4.991 0.458 1.00 1.12 C ATOM 1158 CZ PHE A 73 4.650 4.197 1.505 1.00 1.20 C ATOM 0 H PHE A 73 9.652 7.820 -1.261 1.00 0.53 H new ATOM 0 HA PHE A 73 8.562 5.231 -0.957 1.00 0.50 H new ATOM 0 HB2 PHE A 73 8.046 7.388 0.391 1.00 0.56 H new ATOM 0 HB3 PHE A 73 6.864 7.727 -0.858 1.00 0.56 H new ATOM 0 HD1 PHE A 73 7.844 5.235 1.731 1.00 0.87 H new ATOM 0 HD2 PHE A 73 4.775 6.499 -0.952 1.00 0.89 H new ATOM 0 HE1 PHE A 73 6.275 3.674 2.789 1.00 1.11 H new ATOM 0 HE2 PHE A 73 3.216 4.918 0.099 1.00 1.12 H new ATOM 0 HZ PHE A 73 3.963 3.502 1.965 1.00 1.20 H new ATOM 1168 N ASN A 74 7.743 6.707 -3.764 1.00 0.49 N ATOM 1169 CA ASN A 74 7.102 6.483 -5.077 1.00 0.51 C ATOM 1170 C ASN A 74 7.726 5.233 -5.751 1.00 0.49 C ATOM 1171 O ASN A 74 7.067 4.554 -6.541 1.00 0.53 O ATOM 1172 CB ASN A 74 7.250 7.734 -5.970 1.00 0.57 C ATOM 1173 CG ASN A 74 6.464 7.644 -7.279 1.00 0.65 C ATOM 1174 OD1 ASN A 74 7.037 7.360 -8.331 1.00 0.98 O ATOM 1175 ND2 ASN A 74 5.146 7.863 -7.221 1.00 0.91 N ATOM 0 H ASN A 74 8.375 7.507 -3.739 1.00 0.49 H new ATOM 0 HA ASN A 74 6.036 6.305 -4.935 1.00 0.51 H new ATOM 0 HB2 ASN A 74 6.915 8.610 -5.414 1.00 0.57 H new ATOM 0 HB3 ASN A 74 8.305 7.885 -6.198 1.00 0.57 H new ATOM 0 HD21 ASN A 74 4.580 7.797 -8.067 1.00 0.91 H new ATOM 0 HD22 ASN A 74 4.706 8.096 -6.331 1.00 0.91 H new ATOM 1182 N GLU A 75 9.011 4.955 -5.436 1.00 0.46 N ATOM 1183 CA GLU A 75 9.716 3.766 -5.948 1.00 0.47 C ATOM 1184 C GLU A 75 9.425 2.558 -5.031 1.00 0.43 C ATOM 1185 O GLU A 75 9.196 1.450 -5.518 1.00 0.44 O ATOM 1186 CB GLU A 75 11.239 4.023 -6.047 1.00 0.53 C ATOM 1187 CG GLU A 75 11.682 4.726 -7.335 1.00 0.61 C ATOM 1188 CD GLU A 75 11.288 6.196 -7.399 1.00 0.78 C ATOM 1189 OE1 GLU A 75 10.148 6.488 -7.818 1.00 1.03 O ATOM 1190 OE2 GLU A 75 12.122 7.050 -7.035 1.00 0.98 O ATOM 0 H GLU A 75 9.580 5.543 -4.827 1.00 0.46 H new ATOM 0 HA GLU A 75 9.353 3.548 -6.952 1.00 0.47 H new ATOM 0 HB2 GLU A 75 11.549 4.626 -5.194 1.00 0.53 H new ATOM 0 HB3 GLU A 75 11.761 3.069 -5.970 1.00 0.53 H new ATOM 0 HG2 GLU A 75 12.765 4.645 -7.428 1.00 0.61 H new ATOM 0 HG3 GLU A 75 11.249 4.206 -8.189 1.00 0.61 H new ATOM 1197 N TYR A 76 9.412 2.797 -3.695 1.00 0.42 N ATOM 1198 CA TYR A 76 9.115 1.755 -2.684 1.00 0.41 C ATOM 1199 C TYR A 76 7.612 1.366 -2.701 1.00 0.39 C ATOM 1200 O TYR A 76 7.233 0.328 -2.153 1.00 0.52 O ATOM 1201 CB TYR A 76 9.529 2.253 -1.275 1.00 0.44 C ATOM 1202 CG TYR A 76 9.649 1.163 -0.205 1.00 0.45 C ATOM 1203 CD1 TYR A 76 10.514 0.080 -0.371 1.00 0.52 C ATOM 1204 CD2 TYR A 76 8.906 1.226 0.972 1.00 0.51 C ATOM 1205 CE1 TYR A 76 10.627 -0.899 0.597 1.00 0.59 C ATOM 1206 CE2 TYR A 76 9.019 0.249 1.943 1.00 0.57 C ATOM 1207 CZ TYR A 76 9.879 -0.813 1.750 1.00 0.59 C ATOM 1208 OH TYR A 76 10.002 -1.790 2.718 1.00 0.69 O ATOM 0 H TYR A 76 9.606 3.714 -3.292 1.00 0.42 H new ATOM 0 HA TYR A 76 9.692 0.864 -2.932 1.00 0.41 H new ATOM 0 HB2 TYR A 76 10.487 2.767 -1.356 1.00 0.44 H new ATOM 0 HB3 TYR A 76 8.800 2.990 -0.939 1.00 0.44 H new ATOM 0 HD1 TYR A 76 11.105 0.006 -1.272 1.00 0.52 H new ATOM 0 HD2 TYR A 76 8.230 2.053 1.128 1.00 0.51 H new ATOM 0 HE1 TYR A 76 11.301 -1.730 0.450 1.00 0.59 H new ATOM 0 HE2 TYR A 76 8.436 0.316 2.850 1.00 0.57 H new ATOM 0 HH TYR A 76 9.408 -1.583 3.469 1.00 0.69 H new ATOM 1218 N TRP A 77 6.775 2.223 -3.335 1.00 0.40 N ATOM 1219 CA TRP A 77 5.312 2.017 -3.481 1.00 0.42 C ATOM 1220 C TRP A 77 4.960 0.635 -4.107 1.00 0.37 C ATOM 1221 O TRP A 77 3.928 0.049 -3.760 1.00 0.39 O ATOM 1222 CB TRP A 77 4.758 3.222 -4.303 1.00 0.58 C ATOM 1223 CG TRP A 77 3.431 3.078 -5.015 1.00 0.49 C ATOM 1224 CD1 TRP A 77 2.308 2.431 -4.586 1.00 0.53 C ATOM 1225 CD2 TRP A 77 3.094 3.653 -6.288 1.00 0.78 C ATOM 1226 NE1 TRP A 77 1.305 2.563 -5.516 1.00 0.77 N ATOM 1227 CE2 TRP A 77 1.767 3.304 -6.569 1.00 0.97 C ATOM 1228 CE3 TRP A 77 3.795 4.427 -7.217 1.00 1.04 C ATOM 1229 CZ2 TRP A 77 1.125 3.700 -7.738 1.00 1.40 C ATOM 1230 CZ3 TRP A 77 3.159 4.819 -8.375 1.00 1.45 C ATOM 1231 CH2 TRP A 77 1.835 4.456 -8.628 1.00 1.62 C ATOM 0 H TRP A 77 7.101 3.088 -3.765 1.00 0.40 H new ATOM 0 HA TRP A 77 4.835 1.989 -2.501 1.00 0.42 H new ATOM 0 HB2 TRP A 77 4.677 4.072 -3.626 1.00 0.58 H new ATOM 0 HB3 TRP A 77 5.506 3.481 -5.052 1.00 0.58 H new ATOM 0 HD1 TRP A 77 2.221 1.894 -3.653 1.00 0.53 H new ATOM 0 HE1 TRP A 77 0.367 2.171 -5.434 1.00 0.77 H new ATOM 0 HE3 TRP A 77 4.819 4.713 -7.030 1.00 1.04 H new ATOM 0 HZ2 TRP A 77 0.101 3.420 -7.935 1.00 1.40 H new ATOM 0 HZ3 TRP A 77 3.694 5.417 -9.098 1.00 1.45 H new ATOM 0 HH2 TRP A 77 1.363 4.779 -9.544 1.00 1.62 H new ATOM 1242 N ARG A 78 5.827 0.114 -5.007 1.00 0.39 N ATOM 1243 CA ARG A 78 5.602 -1.202 -5.661 1.00 0.42 C ATOM 1244 C ARG A 78 5.737 -2.385 -4.676 1.00 0.40 C ATOM 1245 O ARG A 78 5.136 -3.440 -4.908 1.00 0.45 O ATOM 1246 CB ARG A 78 6.566 -1.412 -6.856 1.00 0.49 C ATOM 1247 CG ARG A 78 6.493 -0.335 -7.947 1.00 0.64 C ATOM 1248 CD ARG A 78 5.164 -0.339 -8.711 1.00 0.82 C ATOM 1249 NE ARG A 78 4.913 -1.609 -9.423 1.00 1.11 N ATOM 1250 CZ ARG A 78 5.307 -1.897 -10.690 1.00 1.57 C ATOM 1251 NH1 ARG A 78 6.053 -1.041 -11.408 1.00 1.96 N ATOM 1252 NH2 ARG A 78 4.963 -3.069 -11.235 1.00 1.93 N ATOM 0 H ARG A 78 6.686 0.581 -5.298 1.00 0.39 H new ATOM 0 HA ARG A 78 4.575 -1.183 -6.026 1.00 0.42 H new ATOM 0 HB2 ARG A 78 7.587 -1.454 -6.476 1.00 0.49 H new ATOM 0 HB3 ARG A 78 6.354 -2.381 -7.308 1.00 0.49 H new ATOM 0 HG2 ARG A 78 6.640 0.645 -7.492 1.00 0.64 H new ATOM 0 HG3 ARG A 78 7.311 -0.485 -8.652 1.00 0.64 H new ATOM 0 HD2 ARG A 78 4.349 -0.153 -8.012 1.00 0.82 H new ATOM 0 HD3 ARG A 78 5.161 0.481 -9.429 1.00 0.82 H new ATOM 0 HE ARG A 78 4.399 -2.332 -8.919 1.00 1.11 H new ATOM 0 HH11 ARG A 78 6.337 -0.149 -11.003 1.00 1.96 H new ATOM 0 HH12 ARG A 78 6.335 -1.283 -12.358 1.00 1.96 H new ATOM 0 HH21 ARG A 78 4.409 -3.738 -10.699 1.00 1.93 H new ATOM 0 HH22 ARG A 78 5.254 -3.294 -12.186 1.00 1.93 H new ATOM 1266 N LEU A 79 6.520 -2.219 -3.582 1.00 0.37 N ATOM 1267 CA LEU A 79 6.699 -3.294 -2.586 1.00 0.37 C ATOM 1268 C LEU A 79 5.558 -3.295 -1.550 1.00 0.36 C ATOM 1269 O LEU A 79 5.181 -4.362 -1.067 1.00 0.39 O ATOM 1270 CB LEU A 79 8.070 -3.192 -1.873 1.00 0.40 C ATOM 1271 CG LEU A 79 8.561 -4.487 -1.178 1.00 0.44 C ATOM 1272 CD1 LEU A 79 9.008 -5.536 -2.202 1.00 0.49 C ATOM 1273 CD2 LEU A 79 9.685 -4.186 -0.185 1.00 0.53 C ATOM 0 H LEU A 79 7.030 -1.361 -3.372 1.00 0.37 H new ATOM 0 HA LEU A 79 6.671 -4.238 -3.131 1.00 0.37 H new ATOM 0 HB2 LEU A 79 8.818 -2.888 -2.605 1.00 0.40 H new ATOM 0 HB3 LEU A 79 8.013 -2.400 -1.127 1.00 0.40 H new ATOM 0 HG LEU A 79 7.719 -4.900 -0.623 1.00 0.44 H new ATOM 0 HD11 LEU A 79 9.346 -6.432 -1.681 1.00 0.49 H new ATOM 0 HD12 LEU A 79 8.171 -5.789 -2.853 1.00 0.49 H new ATOM 0 HD13 LEU A 79 9.825 -5.134 -2.801 1.00 0.49 H new ATOM 0 HD21 LEU A 79 10.010 -5.113 0.288 1.00 0.53 H new ATOM 0 HD22 LEU A 79 10.525 -3.733 -0.712 1.00 0.53 H new ATOM 0 HD23 LEU A 79 9.322 -3.497 0.578 1.00 0.53 H new ATOM 1285 N ILE A 80 5.002 -2.097 -1.216 1.00 0.38 N ATOM 1286 CA ILE A 80 3.887 -1.986 -0.237 1.00 0.41 C ATOM 1287 C ILE A 80 2.659 -2.792 -0.724 1.00 0.40 C ATOM 1288 O ILE A 80 1.938 -3.378 0.092 1.00 0.43 O ATOM 1289 CB ILE A 80 3.469 -0.492 0.053 1.00 0.49 C ATOM 1290 CG1 ILE A 80 4.697 0.414 0.359 1.00 0.53 C ATOM 1291 CG2 ILE A 80 2.451 -0.407 1.204 1.00 0.59 C ATOM 1292 CD1 ILE A 80 5.545 -0.006 1.555 1.00 0.61 C ATOM 0 H ILE A 80 5.305 -1.205 -1.606 1.00 0.38 H new ATOM 0 HA ILE A 80 4.254 -2.403 0.701 1.00 0.41 H new ATOM 0 HB ILE A 80 2.999 -0.122 -0.858 1.00 0.49 H new ATOM 0 HG12 ILE A 80 5.335 0.441 -0.524 1.00 0.53 H new ATOM 0 HG13 ILE A 80 4.343 1.431 0.527 1.00 0.53 H new ATOM 0 HG21 ILE A 80 2.184 0.636 1.378 1.00 0.59 H new ATOM 0 HG22 ILE A 80 1.556 -0.971 0.941 1.00 0.59 H new ATOM 0 HG23 ILE A 80 2.890 -0.825 2.110 1.00 0.59 H new ATOM 0 HD11 ILE A 80 6.372 0.693 1.678 1.00 0.61 H new ATOM 0 HD12 ILE A 80 4.931 -0.003 2.455 1.00 0.61 H new ATOM 0 HD13 ILE A 80 5.939 -1.009 1.388 1.00 0.61 H new ATOM 1304 N GLY A 81 2.430 -2.811 -2.060 1.00 0.40 N ATOM 1305 CA GLY A 81 1.334 -3.589 -2.640 1.00 0.44 C ATOM 1306 C GLY A 81 1.574 -5.092 -2.492 1.00 0.41 C ATOM 1307 O GLY A 81 0.632 -5.851 -2.249 1.00 0.47 O ATOM 0 H GLY A 81 2.990 -2.298 -2.741 1.00 0.40 H new ATOM 0 HA2 GLY A 81 0.397 -3.319 -2.152 1.00 0.44 H new ATOM 0 HA3 GLY A 81 1.228 -3.339 -3.696 1.00 0.44 H new ATOM 1311 N GLU A 82 2.851 -5.513 -2.649 1.00 0.38 N ATOM 1312 CA GLU A 82 3.255 -6.926 -2.489 1.00 0.38 C ATOM 1313 C GLU A 82 3.202 -7.342 -1.002 1.00 0.36 C ATOM 1314 O GLU A 82 2.891 -8.495 -0.694 1.00 0.42 O ATOM 1315 CB GLU A 82 4.677 -7.162 -3.061 1.00 0.43 C ATOM 1316 CG GLU A 82 4.814 -6.865 -4.558 1.00 0.51 C ATOM 1317 CD GLU A 82 4.139 -7.904 -5.439 1.00 0.62 C ATOM 1318 OE1 GLU A 82 2.931 -7.754 -5.715 1.00 0.86 O ATOM 1319 OE2 GLU A 82 4.820 -8.866 -5.848 1.00 0.83 O ATOM 0 H GLU A 82 3.621 -4.889 -2.888 1.00 0.38 H new ATOM 0 HA GLU A 82 2.552 -7.543 -3.049 1.00 0.38 H new ATOM 0 HB2 GLU A 82 5.384 -6.539 -2.513 1.00 0.43 H new ATOM 0 HB3 GLU A 82 4.960 -8.199 -2.881 1.00 0.43 H new ATOM 0 HG2 GLU A 82 4.384 -5.886 -4.768 1.00 0.51 H new ATOM 0 HG3 GLU A 82 5.872 -6.811 -4.816 1.00 0.51 H new ATOM 1326 N LEU A 83 3.498 -6.384 -0.086 1.00 0.36 N ATOM 1327 CA LEU A 83 3.463 -6.626 1.377 1.00 0.39 C ATOM 1328 C LEU A 83 2.063 -7.095 1.837 1.00 0.40 C ATOM 1329 O LEU A 83 1.940 -8.116 2.515 1.00 0.49 O ATOM 1330 CB LEU A 83 3.862 -5.337 2.158 1.00 0.44 C ATOM 1331 CG LEU A 83 5.312 -5.272 2.702 1.00 0.49 C ATOM 1332 CD1 LEU A 83 6.342 -5.176 1.580 1.00 0.67 C ATOM 1333 CD2 LEU A 83 5.474 -4.095 3.669 1.00 0.61 C ATOM 0 H LEU A 83 3.765 -5.432 -0.339 1.00 0.36 H new ATOM 0 HA LEU A 83 4.183 -7.416 1.593 1.00 0.39 H new ATOM 0 HB2 LEU A 83 3.706 -4.480 1.502 1.00 0.44 H new ATOM 0 HB3 LEU A 83 3.178 -5.224 2.999 1.00 0.44 H new ATOM 0 HG LEU A 83 5.495 -6.203 3.239 1.00 0.49 H new ATOM 0 HD11 LEU A 83 7.343 -5.133 2.008 1.00 0.67 H new ATOM 0 HD12 LEU A 83 6.260 -6.051 0.935 1.00 0.67 H new ATOM 0 HD13 LEU A 83 6.159 -4.275 0.994 1.00 0.67 H new ATOM 0 HD21 LEU A 83 6.499 -4.067 4.040 1.00 0.61 H new ATOM 0 HD22 LEU A 83 5.251 -3.163 3.149 1.00 0.61 H new ATOM 0 HD23 LEU A 83 4.788 -4.216 4.507 1.00 0.61 H new ATOM 1345 N ALA A 84 1.018 -6.345 1.437 1.00 0.39 N ATOM 1346 CA ALA A 84 -0.375 -6.655 1.812 1.00 0.45 C ATOM 1347 C ALA A 84 -1.025 -7.729 0.909 1.00 0.45 C ATOM 1348 O ALA A 84 -2.064 -8.288 1.281 1.00 0.55 O ATOM 1349 CB ALA A 84 -1.206 -5.376 1.816 1.00 0.54 C ATOM 0 H ALA A 84 1.114 -5.516 0.851 1.00 0.39 H new ATOM 0 HA ALA A 84 -0.350 -7.080 2.815 1.00 0.45 H new ATOM 0 HB1 ALA A 84 -2.234 -5.611 2.094 1.00 0.54 H new ATOM 0 HB2 ALA A 84 -0.787 -4.672 2.536 1.00 0.54 H new ATOM 0 HB3 ALA A 84 -1.192 -4.930 0.822 1.00 0.54 H new ATOM 1355 N LYS A 85 -0.437 -8.007 -0.279 1.00 0.42 N ATOM 1356 CA LYS A 85 -0.975 -9.039 -1.195 1.00 0.46 C ATOM 1357 C LYS A 85 -0.501 -10.447 -0.776 1.00 0.47 C ATOM 1358 O LYS A 85 -1.253 -11.416 -0.913 1.00 0.55 O ATOM 1359 CB LYS A 85 -0.564 -8.761 -2.663 1.00 0.49 C ATOM 1360 CG LYS A 85 -1.299 -9.629 -3.708 1.00 0.59 C ATOM 1361 CD LYS A 85 -0.587 -9.664 -5.066 1.00 0.64 C ATOM 1362 CE LYS A 85 -0.706 -8.348 -5.842 1.00 0.69 C ATOM 1363 NZ LYS A 85 0.184 -8.324 -7.040 1.00 0.96 N ATOM 0 H LYS A 85 0.401 -7.537 -0.622 1.00 0.42 H new ATOM 0 HA LYS A 85 -2.062 -8.997 -1.128 1.00 0.46 H new ATOM 0 HB2 LYS A 85 -0.750 -7.710 -2.886 1.00 0.49 H new ATOM 0 HB3 LYS A 85 0.509 -8.924 -2.764 1.00 0.49 H new ATOM 0 HG2 LYS A 85 -1.392 -10.646 -3.327 1.00 0.59 H new ATOM 0 HG3 LYS A 85 -2.310 -9.246 -3.844 1.00 0.59 H new ATOM 0 HD2 LYS A 85 0.467 -9.893 -4.911 1.00 0.64 H new ATOM 0 HD3 LYS A 85 -1.004 -10.472 -5.667 1.00 0.64 H new ATOM 0 HE2 LYS A 85 -1.740 -8.204 -6.155 1.00 0.69 H new ATOM 0 HE3 LYS A 85 -0.453 -7.516 -5.185 1.00 0.69 H new ATOM 0 HZ1 LYS A 85 -0.070 -7.517 -7.645 1.00 0.96 H new ATOM 0 HZ2 LYS A 85 1.174 -8.231 -6.735 1.00 0.96 H new ATOM 0 HZ3 LYS A 85 0.069 -9.208 -7.576 1.00 0.96 H new ATOM 1377 N GLU A 86 0.751 -10.554 -0.272 1.00 0.42 N ATOM 1378 CA GLU A 86 1.327 -11.848 0.153 1.00 0.46 C ATOM 1379 C GLU A 86 0.850 -12.277 1.562 1.00 0.52 C ATOM 1380 O GLU A 86 0.896 -13.468 1.877 1.00 0.92 O ATOM 1381 CB GLU A 86 2.875 -11.798 0.106 1.00 0.49 C ATOM 1382 CG GLU A 86 3.467 -11.582 -1.296 1.00 0.55 C ATOM 1383 CD GLU A 86 3.331 -12.795 -2.204 1.00 1.03 C ATOM 1384 OE1 GLU A 86 4.103 -13.761 -2.026 1.00 1.52 O ATOM 1385 OE2 GLU A 86 2.453 -12.778 -3.093 1.00 1.65 O ATOM 0 H GLU A 86 1.379 -9.760 -0.151 1.00 0.42 H new ATOM 0 HA GLU A 86 0.968 -12.598 -0.552 1.00 0.46 H new ATOM 0 HB2 GLU A 86 3.219 -10.996 0.759 1.00 0.49 H new ATOM 0 HB3 GLU A 86 3.268 -12.730 0.512 1.00 0.49 H new ATOM 0 HG2 GLU A 86 2.973 -10.730 -1.764 1.00 0.55 H new ATOM 0 HG3 GLU A 86 4.522 -11.325 -1.201 1.00 0.55 H new ATOM 1392 N ILE A 87 0.388 -11.317 2.407 1.00 0.44 N ATOM 1393 CA ILE A 87 -0.094 -11.635 3.777 1.00 0.47 C ATOM 1394 C ILE A 87 -1.338 -12.564 3.741 1.00 0.51 C ATOM 1395 O ILE A 87 -1.428 -13.509 4.529 1.00 0.61 O ATOM 1396 CB ILE A 87 -0.373 -10.324 4.621 1.00 0.51 C ATOM 1397 CG1 ILE A 87 -0.153 -10.559 6.147 1.00 0.59 C ATOM 1398 CG2 ILE A 87 -1.750 -9.700 4.345 1.00 0.55 C ATOM 1399 CD1 ILE A 87 -1.115 -11.528 6.824 1.00 0.66 C ATOM 0 H ILE A 87 0.340 -10.327 2.166 1.00 0.44 H new ATOM 0 HA ILE A 87 0.705 -12.178 4.281 1.00 0.47 H new ATOM 0 HB ILE A 87 0.364 -9.596 4.282 1.00 0.51 H new ATOM 0 HG12 ILE A 87 0.863 -10.926 6.294 1.00 0.59 H new ATOM 0 HG13 ILE A 87 -0.221 -9.597 6.655 1.00 0.59 H new ATOM 0 HG21 ILE A 87 -1.874 -8.806 4.957 1.00 0.55 H new ATOM 0 HG22 ILE A 87 -1.823 -9.431 3.291 1.00 0.55 H new ATOM 0 HG23 ILE A 87 -2.531 -10.419 4.591 1.00 0.55 H new ATOM 0 HD11 ILE A 87 -0.864 -11.611 7.882 1.00 0.66 H new ATOM 0 HD12 ILE A 87 -2.136 -11.159 6.721 1.00 0.66 H new ATOM 0 HD13 ILE A 87 -1.034 -12.508 6.354 1.00 0.66 H new ATOM 1411 N ARG A 88 -2.274 -12.300 2.801 1.00 0.54 N ATOM 1412 CA ARG A 88 -3.501 -13.110 2.662 1.00 0.68 C ATOM 1413 C ARG A 88 -3.242 -14.385 1.835 1.00 0.68 C ATOM 1414 O ARG A 88 -3.640 -15.474 2.251 1.00 0.87 O ATOM 1415 CB ARG A 88 -4.679 -12.281 2.068 1.00 0.83 C ATOM 1416 CG ARG A 88 -4.394 -11.553 0.737 1.00 0.91 C ATOM 1417 CD ARG A 88 -4.774 -10.069 0.780 1.00 1.05 C ATOM 1418 NE ARG A 88 -6.232 -9.846 0.805 1.00 1.18 N ATOM 1419 CZ ARG A 88 -6.827 -8.644 0.973 1.00 1.39 C ATOM 1420 NH1 ARG A 88 -6.116 -7.536 1.221 1.00 1.74 N ATOM 1421 NH2 ARG A 88 -8.155 -8.553 0.908 1.00 1.73 N ATOM 0 H ARG A 88 -2.202 -11.535 2.131 1.00 0.54 H new ATOM 0 HA ARG A 88 -3.797 -13.419 3.665 1.00 0.68 H new ATOM 0 HB2 ARG A 88 -5.527 -12.949 1.919 1.00 0.83 H new ATOM 0 HB3 ARG A 88 -4.983 -11.539 2.806 1.00 0.83 H new ATOM 0 HG2 ARG A 88 -3.335 -11.646 0.497 1.00 0.91 H new ATOM 0 HG3 ARG A 88 -4.947 -12.042 -0.065 1.00 0.91 H new ATOM 0 HD2 ARG A 88 -4.327 -9.611 1.662 1.00 1.05 H new ATOM 0 HD3 ARG A 88 -4.350 -9.566 -0.089 1.00 1.05 H new ATOM 0 HE ARG A 88 -6.836 -10.659 0.687 1.00 1.18 H new ATOM 0 HH11 ARG A 88 -5.099 -7.587 1.287 1.00 1.74 H new ATOM 0 HH12 ARG A 88 -6.591 -6.642 1.344 1.00 1.74 H new ATOM 0 HH21 ARG A 88 -8.715 -9.387 0.732 1.00 1.73 H new ATOM 0 HH22 ARG A 88 -8.611 -7.649 1.034 1.00 1.73 H new ATOM 1435 N LYS A 89 -2.559 -14.249 0.678 1.00 0.58 N ATOM 1436 CA LYS A 89 -2.253 -15.404 -0.188 1.00 0.64 C ATOM 1437 C LYS A 89 -0.915 -15.223 -0.933 1.00 0.58 C ATOM 1438 O LYS A 89 -0.831 -14.478 -1.915 1.00 0.69 O ATOM 1439 CB LYS A 89 -3.413 -15.690 -1.181 1.00 0.76 C ATOM 1440 CG LYS A 89 -3.890 -14.486 -2.006 1.00 0.77 C ATOM 1441 CD LYS A 89 -4.974 -14.872 -3.017 1.00 1.00 C ATOM 1442 CE LYS A 89 -5.395 -13.686 -3.881 1.00 1.22 C ATOM 1443 NZ LYS A 89 -6.400 -14.067 -4.921 1.00 1.52 N ATOM 0 H LYS A 89 -2.212 -13.357 0.325 1.00 0.58 H new ATOM 0 HA LYS A 89 -2.148 -16.273 0.462 1.00 0.64 H new ATOM 0 HB2 LYS A 89 -3.095 -16.475 -1.867 1.00 0.76 H new ATOM 0 HB3 LYS A 89 -4.261 -16.082 -0.619 1.00 0.76 H new ATOM 0 HG2 LYS A 89 -4.277 -13.719 -1.336 1.00 0.77 H new ATOM 0 HG3 LYS A 89 -3.042 -14.050 -2.534 1.00 0.77 H new ATOM 0 HD2 LYS A 89 -4.605 -15.674 -3.656 1.00 1.00 H new ATOM 0 HD3 LYS A 89 -5.843 -15.261 -2.487 1.00 1.00 H new ATOM 0 HE2 LYS A 89 -5.813 -12.906 -3.244 1.00 1.22 H new ATOM 0 HE3 LYS A 89 -4.516 -13.264 -4.367 1.00 1.22 H new ATOM 0 HZ1 LYS A 89 -6.654 -13.229 -5.482 1.00 1.52 H new ATOM 0 HZ2 LYS A 89 -5.994 -14.792 -5.547 1.00 1.52 H new ATOM 0 HZ3 LYS A 89 -7.251 -14.446 -4.459 1.00 1.52 H new ATOM 1457 N LYS A 90 0.138 -15.903 -0.433 1.00 0.56 N ATOM 1458 CA LYS A 90 1.476 -15.866 -1.060 1.00 0.55 C ATOM 1459 C LYS A 90 1.602 -17.010 -2.084 1.00 0.55 C ATOM 1460 O LYS A 90 2.199 -16.829 -3.149 1.00 0.60 O ATOM 1461 CB LYS A 90 2.620 -15.924 -0.013 1.00 0.61 C ATOM 1462 CG LYS A 90 2.528 -17.049 1.040 1.00 0.71 C ATOM 1463 CD LYS A 90 1.913 -16.580 2.368 1.00 0.97 C ATOM 1464 CE LYS A 90 2.925 -15.855 3.264 1.00 1.39 C ATOM 1465 NZ LYS A 90 3.794 -16.802 4.027 1.00 1.87 N ATOM 0 H LYS A 90 0.087 -16.485 0.403 1.00 0.56 H new ATOM 0 HA LYS A 90 1.578 -14.911 -1.575 1.00 0.55 H new ATOM 0 HB2 LYS A 90 3.565 -16.030 -0.545 1.00 0.61 H new ATOM 0 HB3 LYS A 90 2.654 -14.968 0.510 1.00 0.61 H new ATOM 0 HG2 LYS A 90 1.930 -17.867 0.638 1.00 0.71 H new ATOM 0 HG3 LYS A 90 3.526 -17.446 1.228 1.00 0.71 H new ATOM 0 HD2 LYS A 90 1.075 -15.915 2.161 1.00 0.97 H new ATOM 0 HD3 LYS A 90 1.512 -17.441 2.902 1.00 0.97 H new ATOM 0 HE2 LYS A 90 3.551 -15.207 2.650 1.00 1.39 H new ATOM 0 HE3 LYS A 90 2.391 -15.212 3.964 1.00 1.39 H new ATOM 0 HZ1 LYS A 90 4.575 -16.277 4.469 1.00 1.87 H new ATOM 0 HZ2 LYS A 90 3.231 -17.272 4.765 1.00 1.87 H new ATOM 0 HZ3 LYS A 90 4.181 -17.517 3.379 1.00 1.87 H new ATOM 1479 N LYS A 91 1.031 -18.184 -1.742 1.00 0.57 N ATOM 1480 CA LYS A 91 1.013 -19.363 -2.612 1.00 0.64 C ATOM 1481 C LYS A 91 -0.454 -19.693 -2.939 1.00 0.69 C ATOM 1482 O LYS A 91 -1.062 -20.555 -2.294 1.00 0.71 O ATOM 1483 CB LYS A 91 1.709 -20.562 -1.921 1.00 0.72 C ATOM 1484 CG LYS A 91 3.241 -20.550 -1.996 1.00 0.85 C ATOM 1485 CD LYS A 91 3.870 -21.585 -1.045 1.00 0.97 C ATOM 1486 CE LYS A 91 5.173 -22.187 -1.584 1.00 1.29 C ATOM 1487 NZ LYS A 91 4.932 -23.303 -2.549 1.00 1.53 N ATOM 0 H LYS A 91 0.568 -18.334 -0.846 1.00 0.57 H new ATOM 0 HA LYS A 91 1.560 -19.158 -3.532 1.00 0.64 H new ATOM 0 HB2 LYS A 91 1.411 -20.581 -0.873 1.00 0.72 H new ATOM 0 HB3 LYS A 91 1.345 -21.485 -2.373 1.00 0.72 H new ATOM 0 HG2 LYS A 91 3.556 -20.758 -3.019 1.00 0.85 H new ATOM 0 HG3 LYS A 91 3.609 -19.555 -1.745 1.00 0.85 H new ATOM 0 HD2 LYS A 91 4.067 -21.112 -0.083 1.00 0.97 H new ATOM 0 HD3 LYS A 91 3.154 -22.387 -0.866 1.00 0.97 H new ATOM 0 HE2 LYS A 91 5.755 -21.406 -2.074 1.00 1.29 H new ATOM 0 HE3 LYS A 91 5.772 -22.555 -0.751 1.00 1.29 H new ATOM 0 HZ1 LYS A 91 5.844 -23.675 -2.884 1.00 1.53 H new ATOM 0 HZ2 LYS A 91 4.400 -24.062 -2.076 1.00 1.53 H new ATOM 0 HZ3 LYS A 91 4.384 -22.949 -3.359 1.00 1.53 H new ATOM 1501 N ASP A 92 -1.032 -18.976 -3.930 1.00 0.78 N ATOM 1502 CA ASP A 92 -2.451 -19.167 -4.327 1.00 0.87 C ATOM 1503 C ASP A 92 -2.662 -20.463 -5.153 1.00 1.03 C ATOM 1504 O ASP A 92 -3.072 -20.416 -6.319 1.00 1.81 O ATOM 1505 CB ASP A 92 -2.999 -17.913 -5.068 1.00 0.89 C ATOM 1506 CG ASP A 92 -2.215 -17.526 -6.321 1.00 0.98 C ATOM 1507 OD1 ASP A 92 -1.073 -17.042 -6.182 1.00 1.01 O ATOM 1508 OD2 ASP A 92 -2.754 -17.699 -7.436 1.00 1.18 O ATOM 0 H ASP A 92 -0.542 -18.262 -4.469 1.00 0.78 H new ATOM 0 HA ASP A 92 -3.028 -19.289 -3.410 1.00 0.87 H new ATOM 0 HB2 ASP A 92 -4.037 -18.095 -5.346 1.00 0.89 H new ATOM 0 HB3 ASP A 92 -2.997 -17.069 -4.378 1.00 0.89 H new ATOM 1513 N LEU A 93 -2.390 -21.624 -4.511 1.00 0.67 N ATOM 1514 CA LEU A 93 -2.532 -22.962 -5.133 1.00 0.70 C ATOM 1515 C LEU A 93 -2.229 -24.079 -4.108 1.00 0.70 C ATOM 1516 O LEU A 93 -3.008 -25.027 -3.971 1.00 0.79 O ATOM 1517 CB LEU A 93 -1.598 -23.118 -6.365 1.00 0.77 C ATOM 1518 CG LEU A 93 -1.818 -24.381 -7.237 1.00 0.97 C ATOM 1519 CD1 LEU A 93 -3.100 -24.267 -8.072 1.00 1.24 C ATOM 1520 CD2 LEU A 93 -0.602 -24.629 -8.137 1.00 1.15 C ATOM 0 H LEU A 93 -2.065 -21.659 -3.545 1.00 0.67 H new ATOM 0 HA LEU A 93 -3.565 -23.054 -5.468 1.00 0.70 H new ATOM 0 HB2 LEU A 93 -1.718 -22.239 -6.999 1.00 0.77 H new ATOM 0 HB3 LEU A 93 -0.566 -23.120 -6.014 1.00 0.77 H new ATOM 0 HG LEU A 93 -1.935 -25.235 -6.569 1.00 0.97 H new ATOM 0 HD11 LEU A 93 -3.225 -25.168 -8.672 1.00 1.24 H new ATOM 0 HD12 LEU A 93 -3.957 -24.151 -7.409 1.00 1.24 H new ATOM 0 HD13 LEU A 93 -3.030 -23.400 -8.730 1.00 1.24 H new ATOM 0 HD21 LEU A 93 -0.773 -25.519 -8.742 1.00 1.15 H new ATOM 0 HD22 LEU A 93 -0.451 -23.769 -8.790 1.00 1.15 H new ATOM 0 HD23 LEU A 93 0.284 -24.775 -7.519 1.00 1.15 H new ATOM 1532 N LYS A 94 -1.089 -23.947 -3.394 1.00 0.70 N ATOM 1533 CA LYS A 94 -0.648 -24.936 -2.390 1.00 0.77 C ATOM 1534 C LYS A 94 -1.365 -24.737 -1.039 1.00 0.71 C ATOM 1535 O LYS A 94 -1.968 -25.677 -0.515 1.00 0.77 O ATOM 1536 CB LYS A 94 0.888 -24.839 -2.203 1.00 0.92 C ATOM 1537 CG LYS A 94 1.529 -25.975 -1.394 1.00 1.09 C ATOM 1538 CD LYS A 94 1.562 -27.295 -2.168 1.00 1.23 C ATOM 1539 CE LYS A 94 2.390 -28.367 -1.456 1.00 1.57 C ATOM 1540 NZ LYS A 94 1.732 -28.878 -0.212 1.00 1.73 N ATOM 0 H LYS A 94 -0.453 -23.156 -3.498 1.00 0.70 H new ATOM 0 HA LYS A 94 -0.910 -25.929 -2.755 1.00 0.77 H new ATOM 0 HB2 LYS A 94 1.355 -24.809 -3.187 1.00 0.92 H new ATOM 0 HB3 LYS A 94 1.118 -23.893 -1.713 1.00 0.92 H new ATOM 0 HG2 LYS A 94 2.545 -25.693 -1.119 1.00 1.09 H new ATOM 0 HG3 LYS A 94 0.974 -26.115 -0.466 1.00 1.09 H new ATOM 0 HD2 LYS A 94 0.544 -27.658 -2.306 1.00 1.23 H new ATOM 0 HD3 LYS A 94 1.975 -27.121 -3.161 1.00 1.23 H new ATOM 0 HE2 LYS A 94 2.562 -29.199 -2.138 1.00 1.57 H new ATOM 0 HE3 LYS A 94 3.367 -27.956 -1.202 1.00 1.57 H new ATOM 0 HZ1 LYS A 94 2.336 -29.601 0.229 1.00 1.73 H new ATOM 0 HZ2 LYS A 94 1.591 -28.092 0.454 1.00 1.73 H new ATOM 0 HZ3 LYS A 94 0.811 -29.297 -0.453 1.00 1.73 H new ATOM 1554 N ILE A 95 -1.286 -23.508 -0.486 1.00 0.68 N ATOM 1555 CA ILE A 95 -1.904 -23.177 0.815 1.00 0.67 C ATOM 1556 C ILE A 95 -2.769 -21.908 0.704 1.00 0.67 C ATOM 1557 O ILE A 95 -2.295 -20.877 0.215 1.00 0.77 O ATOM 1558 CB ILE A 95 -0.828 -22.986 1.941 1.00 0.75 C ATOM 1559 CG1 ILE A 95 0.315 -22.032 1.486 1.00 0.87 C ATOM 1560 CG2 ILE A 95 -0.271 -24.348 2.379 1.00 0.85 C ATOM 1561 CD1 ILE A 95 1.272 -21.612 2.591 1.00 1.06 C ATOM 0 H ILE A 95 -0.798 -22.726 -0.923 1.00 0.68 H new ATOM 0 HA ILE A 95 -2.537 -24.021 1.089 1.00 0.67 H new ATOM 0 HB ILE A 95 -1.314 -22.518 2.797 1.00 0.75 H new ATOM 0 HG12 ILE A 95 0.886 -22.522 0.697 1.00 0.87 H new ATOM 0 HG13 ILE A 95 -0.129 -21.137 1.050 1.00 0.87 H new ATOM 0 HG21 ILE A 95 0.475 -24.202 3.161 1.00 0.85 H new ATOM 0 HG22 ILE A 95 -1.082 -24.967 2.763 1.00 0.85 H new ATOM 0 HG23 ILE A 95 0.191 -24.844 1.525 1.00 0.85 H new ATOM 0 HD11 ILE A 95 2.034 -20.949 2.180 1.00 1.06 H new ATOM 0 HD12 ILE A 95 0.719 -21.090 3.372 1.00 1.06 H new ATOM 0 HD13 ILE A 95 1.750 -22.496 3.014 1.00 1.06 H new ATOM 1573 N ARG A 96 -4.039 -21.988 1.149 1.00 0.71 N ATOM 1574 CA ARG A 96 -4.963 -20.837 1.101 1.00 0.77 C ATOM 1575 C ARG A 96 -5.807 -20.725 2.390 1.00 0.77 C ATOM 1576 O ARG A 96 -7.035 -20.604 2.330 1.00 0.93 O ATOM 1577 CB ARG A 96 -5.868 -20.917 -0.149 1.00 0.93 C ATOM 1578 CG ARG A 96 -6.707 -22.198 -0.250 1.00 1.05 C ATOM 1579 CD ARG A 96 -7.897 -22.046 -1.199 1.00 1.26 C ATOM 1580 NE ARG A 96 -9.029 -22.898 -0.804 1.00 1.40 N ATOM 1581 CZ ARG A 96 -9.129 -24.232 -1.015 1.00 1.83 C ATOM 1582 NH1 ARG A 96 -8.166 -24.915 -1.652 1.00 2.26 N ATOM 1583 NH2 ARG A 96 -10.210 -24.882 -0.583 1.00 2.18 N ATOM 0 H ARG A 96 -4.447 -22.835 1.545 1.00 0.71 H new ATOM 0 HA ARG A 96 -4.359 -19.932 1.032 1.00 0.77 H new ATOM 0 HB2 ARG A 96 -6.539 -20.058 -0.151 1.00 0.93 H new ATOM 0 HB3 ARG A 96 -5.244 -20.836 -1.039 1.00 0.93 H new ATOM 0 HG2 ARG A 96 -6.075 -23.016 -0.594 1.00 1.05 H new ATOM 0 HG3 ARG A 96 -7.069 -22.470 0.741 1.00 1.05 H new ATOM 0 HD2 ARG A 96 -8.216 -21.004 -1.216 1.00 1.26 H new ATOM 0 HD3 ARG A 96 -7.587 -22.301 -2.212 1.00 1.26 H new ATOM 0 HE ARG A 96 -9.809 -22.443 -0.329 1.00 1.40 H new ATOM 0 HH11 ARG A 96 -7.335 -24.430 -1.990 1.00 2.26 H new ATOM 0 HH12 ARG A 96 -8.265 -25.920 -1.799 1.00 2.26 H new ATOM 0 HH21 ARG A 96 -10.951 -24.375 -0.099 1.00 2.18 H new ATOM 0 HH22 ARG A 96 -10.296 -25.887 -0.736 1.00 2.18 H new ATOM 1597 N LYS A 97 -5.140 -20.775 3.554 1.00 0.72 N ATOM 1598 CA LYS A 97 -5.813 -20.645 4.862 1.00 0.75 C ATOM 1599 C LYS A 97 -4.778 -20.508 5.990 1.00 0.74 C ATOM 1600 O LYS A 97 -4.176 -21.499 6.416 1.00 0.95 O ATOM 1601 CB LYS A 97 -6.796 -21.812 5.146 1.00 0.87 C ATOM 1602 CG LYS A 97 -6.231 -23.224 4.936 1.00 0.94 C ATOM 1603 CD LYS A 97 -7.179 -24.293 5.487 1.00 1.10 C ATOM 1604 CE LYS A 97 -6.678 -25.714 5.226 1.00 1.36 C ATOM 1605 NZ LYS A 97 -5.391 -26.020 5.928 1.00 1.74 N ATOM 0 H LYS A 97 -4.130 -20.905 3.619 1.00 0.72 H new ATOM 0 HA LYS A 97 -6.413 -19.736 4.824 1.00 0.75 H new ATOM 0 HB2 LYS A 97 -7.142 -21.729 6.176 1.00 0.87 H new ATOM 0 HB3 LYS A 97 -7.670 -21.691 4.505 1.00 0.87 H new ATOM 0 HG2 LYS A 97 -6.064 -23.396 3.873 1.00 0.94 H new ATOM 0 HG3 LYS A 97 -5.262 -23.307 5.428 1.00 0.94 H new ATOM 0 HD2 LYS A 97 -7.302 -24.146 6.560 1.00 1.10 H new ATOM 0 HD3 LYS A 97 -8.163 -24.170 5.034 1.00 1.10 H new ATOM 0 HE2 LYS A 97 -7.438 -26.426 5.547 1.00 1.36 H new ATOM 0 HE3 LYS A 97 -6.543 -25.854 4.154 1.00 1.36 H new ATOM 0 HZ1 LYS A 97 -5.111 -27.001 5.727 1.00 1.74 H new ATOM 0 HZ2 LYS A 97 -4.650 -25.372 5.592 1.00 1.74 H new ATOM 0 HZ3 LYS A 97 -5.517 -25.899 6.953 1.00 1.74 H new ATOM 1619 N LYS A 98 -4.572 -19.265 6.461 1.00 0.69 N ATOM 1620 CA LYS A 98 -3.606 -18.975 7.526 1.00 0.72 C ATOM 1621 C LYS A 98 -4.283 -18.236 8.686 1.00 0.76 C ATOM 1622 O LYS A 98 -5.370 -18.612 9.131 1.00 0.98 O ATOM 1623 CB LYS A 98 -2.437 -18.151 6.949 1.00 0.88 C ATOM 1624 CG LYS A 98 -1.240 -18.010 7.888 1.00 1.04 C ATOM 1625 CD LYS A 98 -0.064 -17.302 7.214 1.00 1.35 C ATOM 1626 CE LYS A 98 1.136 -17.160 8.149 1.00 1.61 C ATOM 1627 NZ LYS A 98 1.715 -18.478 8.548 1.00 1.71 N ATOM 0 H LYS A 98 -5.067 -18.443 6.115 1.00 0.69 H new ATOM 0 HA LYS A 98 -3.214 -19.913 7.920 1.00 0.72 H new ATOM 0 HB2 LYS A 98 -2.103 -18.617 6.022 1.00 0.88 H new ATOM 0 HB3 LYS A 98 -2.801 -17.156 6.693 1.00 0.88 H new ATOM 0 HG2 LYS A 98 -1.539 -17.452 8.775 1.00 1.04 H new ATOM 0 HG3 LYS A 98 -0.924 -18.998 8.224 1.00 1.04 H new ATOM 0 HD2 LYS A 98 0.233 -17.860 6.326 1.00 1.35 H new ATOM 0 HD3 LYS A 98 -0.380 -16.314 6.879 1.00 1.35 H new ATOM 0 HE2 LYS A 98 1.905 -16.563 7.658 1.00 1.61 H new ATOM 0 HE3 LYS A 98 0.832 -16.616 9.043 1.00 1.61 H new ATOM 0 HZ1 LYS A 98 2.584 -18.323 9.098 1.00 1.71 H new ATOM 0 HZ2 LYS A 98 1.026 -18.998 9.128 1.00 1.71 H new ATOM 0 HZ3 LYS A 98 1.938 -19.031 7.696 1.00 1.71 H new TER 1641 LYS A 98 ATOM 1642 N MET B 1 -5.566 -17.527 2.573 1.00 0.85 N ATOM 1643 CA MET B 1 -6.600 -16.584 2.153 1.00 0.86 C ATOM 1644 C MET B 1 -6.913 -15.572 3.273 1.00 0.76 C ATOM 1645 O MET B 1 -7.240 -14.416 2.991 1.00 0.93 O ATOM 1646 CB MET B 1 -7.874 -17.337 1.707 1.00 1.04 C ATOM 1647 CG MET B 1 -8.603 -18.085 2.829 1.00 1.09 C ATOM 1648 SD MET B 1 -9.934 -19.146 2.228 1.00 1.44 S ATOM 1649 CE MET B 1 -10.465 -19.905 3.761 1.00 1.75 C ATOM 0 H1 MET B 1 -5.361 -18.187 1.796 1.00 0.85 H new ATOM 0 H2 MET B 1 -4.701 -17.006 2.821 1.00 0.85 H new ATOM 0 H3 MET B 1 -5.899 -18.061 3.401 1.00 0.85 H new ATOM 0 HA MET B 1 -6.223 -16.023 1.298 1.00 0.86 H new ATOM 0 HB2 MET B 1 -8.563 -16.622 1.258 1.00 1.04 H new ATOM 0 HB3 MET B 1 -7.604 -18.051 0.929 1.00 1.04 H new ATOM 0 HG2 MET B 1 -7.884 -18.692 3.379 1.00 1.09 H new ATOM 0 HG3 MET B 1 -9.014 -17.361 3.533 1.00 1.09 H new ATOM 0 HE1 MET B 1 -11.287 -20.593 3.561 1.00 1.75 H new ATOM 0 HE2 MET B 1 -9.633 -20.453 4.203 1.00 1.75 H new ATOM 0 HE3 MET B 1 -10.799 -19.132 4.453 1.00 1.75 H new ATOM 1659 N ALA B 2 -6.815 -16.021 4.546 1.00 0.73 N ATOM 1660 CA ALA B 2 -7.076 -15.161 5.712 1.00 0.67 C ATOM 1661 C ALA B 2 -5.794 -14.440 6.159 1.00 0.60 C ATOM 1662 O ALA B 2 -4.696 -14.998 6.046 1.00 0.68 O ATOM 1663 CB ALA B 2 -7.656 -15.989 6.857 1.00 0.78 C ATOM 0 H ALA B 2 -6.556 -16.978 4.787 1.00 0.73 H new ATOM 0 HA ALA B 2 -7.805 -14.403 5.425 1.00 0.67 H new ATOM 0 HB1 ALA B 2 -7.845 -15.343 7.714 1.00 0.78 H new ATOM 0 HB2 ALA B 2 -8.591 -16.449 6.536 1.00 0.78 H new ATOM 0 HB3 ALA B 2 -6.947 -16.767 7.139 1.00 0.78 H new ATOM 1669 N ALA B 3 -5.942 -13.200 6.667 1.00 0.57 N ATOM 1670 CA ALA B 3 -4.800 -12.391 7.123 1.00 0.57 C ATOM 1671 C ALA B 3 -4.576 -12.550 8.634 1.00 0.58 C ATOM 1672 O ALA B 3 -5.402 -12.102 9.439 1.00 0.69 O ATOM 1673 CB ALA B 3 -5.018 -10.926 6.754 1.00 0.64 C ATOM 0 H ALA B 3 -6.845 -12.738 6.771 1.00 0.57 H new ATOM 0 HA ALA B 3 -3.901 -12.748 6.620 1.00 0.57 H new ATOM 0 HB1 ALA B 3 -4.168 -10.335 7.095 1.00 0.64 H new ATOM 0 HB2 ALA B 3 -5.113 -10.834 5.672 1.00 0.64 H new ATOM 0 HB3 ALA B 3 -5.928 -10.562 7.231 1.00 0.64 H new ATOM 1679 N GLU B 4 -3.452 -13.196 9.007 1.00 0.56 N ATOM 1680 CA GLU B 4 -3.093 -13.432 10.419 1.00 0.59 C ATOM 1681 C GLU B 4 -1.858 -12.591 10.816 1.00 0.56 C ATOM 1682 O GLU B 4 -0.891 -12.533 10.045 1.00 0.54 O ATOM 1683 CB GLU B 4 -2.814 -14.935 10.643 1.00 0.66 C ATOM 1684 CG GLU B 4 -2.842 -15.365 12.110 1.00 0.79 C ATOM 1685 CD GLU B 4 -2.764 -16.872 12.284 1.00 0.91 C ATOM 1686 OE1 GLU B 4 -3.826 -17.531 12.243 1.00 1.10 O ATOM 1687 OE2 GLU B 4 -1.644 -17.395 12.459 1.00 1.00 O ATOM 0 H GLU B 4 -2.773 -13.566 8.342 1.00 0.56 H new ATOM 0 HA GLU B 4 -3.929 -13.127 11.049 1.00 0.59 H new ATOM 0 HB2 GLU B 4 -3.553 -15.516 10.091 1.00 0.66 H new ATOM 0 HB3 GLU B 4 -1.838 -15.179 10.223 1.00 0.66 H new ATOM 0 HG2 GLU B 4 -2.008 -14.900 12.636 1.00 0.79 H new ATOM 0 HG3 GLU B 4 -3.757 -14.997 12.574 1.00 0.79 H new ATOM 1694 N PRO B 5 -1.848 -11.941 12.029 1.00 0.62 N ATOM 1695 CA PRO B 5 -0.715 -11.104 12.469 1.00 0.65 C ATOM 1696 C PRO B 5 0.423 -11.917 13.126 1.00 0.59 C ATOM 1697 O PRO B 5 0.161 -12.916 13.803 1.00 0.68 O ATOM 1698 CB PRO B 5 -1.382 -10.159 13.477 1.00 0.83 C ATOM 1699 CG PRO B 5 -2.477 -10.966 14.100 1.00 0.80 C ATOM 1700 CD PRO B 5 -2.919 -11.976 13.066 1.00 0.73 C ATOM 0 HA PRO B 5 -0.222 -10.599 11.639 1.00 0.65 H new ATOM 0 HB2 PRO B 5 -0.669 -9.816 14.227 1.00 0.83 H new ATOM 0 HB3 PRO B 5 -1.778 -9.271 12.983 1.00 0.83 H new ATOM 0 HG2 PRO B 5 -2.123 -11.466 15.002 1.00 0.80 H new ATOM 0 HG3 PRO B 5 -3.309 -10.326 14.395 1.00 0.80 H new ATOM 0 HD2 PRO B 5 -3.019 -12.971 13.500 1.00 0.73 H new ATOM 0 HD3 PRO B 5 -3.889 -11.714 12.644 1.00 0.73 H new ATOM 1708 N LEU B 6 1.683 -11.478 12.914 1.00 0.61 N ATOM 1709 CA LEU B 6 2.870 -12.152 13.486 1.00 0.70 C ATOM 1710 C LEU B 6 3.900 -11.123 13.998 1.00 0.73 C ATOM 1711 O LEU B 6 4.157 -11.055 15.203 1.00 1.24 O ATOM 1712 CB LEU B 6 3.522 -13.094 12.440 1.00 0.87 C ATOM 1713 CG LEU B 6 2.690 -14.332 12.024 1.00 0.95 C ATOM 1714 CD1 LEU B 6 3.331 -15.047 10.830 1.00 1.18 C ATOM 1715 CD2 LEU B 6 2.513 -15.299 13.200 1.00 1.08 C ATOM 0 H LEU B 6 1.905 -10.658 12.350 1.00 0.61 H new ATOM 0 HA LEU B 6 2.538 -12.751 14.334 1.00 0.70 H new ATOM 0 HB2 LEU B 6 3.742 -12.512 11.545 1.00 0.87 H new ATOM 0 HB3 LEU B 6 4.476 -13.440 12.838 1.00 0.87 H new ATOM 0 HG LEU B 6 1.703 -13.982 11.722 1.00 0.95 H new ATOM 0 HD11 LEU B 6 2.727 -15.913 10.558 1.00 1.18 H new ATOM 0 HD12 LEU B 6 3.387 -14.363 9.983 1.00 1.18 H new ATOM 0 HD13 LEU B 6 4.335 -15.375 11.099 1.00 1.18 H new ATOM 0 HD21 LEU B 6 1.925 -16.159 12.879 1.00 1.08 H new ATOM 0 HD22 LEU B 6 3.491 -15.636 13.544 1.00 1.08 H new ATOM 0 HD23 LEU B 6 1.997 -14.791 14.015 1.00 1.08 H new ATOM 1727 N THR B 7 4.480 -10.331 13.073 1.00 0.52 N ATOM 1728 CA THR B 7 5.482 -9.300 13.408 1.00 0.50 C ATOM 1729 C THR B 7 4.820 -7.905 13.427 1.00 0.48 C ATOM 1730 O THR B 7 3.739 -7.733 12.864 1.00 0.53 O ATOM 1731 CB THR B 7 6.659 -9.328 12.381 1.00 0.53 C ATOM 1732 OG1 THR B 7 7.094 -10.679 12.180 1.00 0.92 O ATOM 1733 CG2 THR B 7 7.858 -8.496 12.839 1.00 1.06 C ATOM 0 H THR B 7 4.268 -10.388 12.077 1.00 0.52 H new ATOM 0 HA THR B 7 5.884 -9.512 14.399 1.00 0.50 H new ATOM 0 HB THR B 7 6.280 -8.896 11.455 1.00 0.53 H new ATOM 0 HG1 THR B 7 6.757 -11.007 11.320 1.00 0.92 H new ATOM 0 HG21 THR B 7 8.647 -8.550 12.089 1.00 1.06 H new ATOM 0 HG22 THR B 7 7.552 -7.458 12.969 1.00 1.06 H new ATOM 0 HG23 THR B 7 8.231 -8.886 13.786 1.00 1.06 H new ATOM 1741 N GLU B 8 5.468 -6.917 14.086 1.00 0.49 N ATOM 1742 CA GLU B 8 4.939 -5.531 14.168 1.00 0.49 C ATOM 1743 C GLU B 8 4.671 -4.920 12.769 1.00 0.44 C ATOM 1744 O GLU B 8 3.659 -4.235 12.577 1.00 0.47 O ATOM 1745 CB GLU B 8 5.906 -4.625 14.965 1.00 0.54 C ATOM 1746 CG GLU B 8 5.294 -3.295 15.412 1.00 0.95 C ATOM 1747 CD GLU B 8 6.244 -2.448 16.242 1.00 1.01 C ATOM 1748 OE1 GLU B 8 6.341 -2.688 17.466 1.00 1.51 O ATOM 1749 OE2 GLU B 8 6.889 -1.541 15.671 1.00 1.29 O ATOM 0 H GLU B 8 6.357 -7.051 14.569 1.00 0.49 H new ATOM 0 HA GLU B 8 3.984 -5.587 14.691 1.00 0.49 H new ATOM 0 HB2 GLU B 8 6.252 -5.167 15.845 1.00 0.54 H new ATOM 0 HB3 GLU B 8 6.783 -4.421 14.351 1.00 0.54 H new ATOM 0 HG2 GLU B 8 4.988 -2.729 14.532 1.00 0.95 H new ATOM 0 HG3 GLU B 8 4.393 -3.494 15.993 1.00 0.95 H new ATOM 1756 N LEU B 9 5.578 -5.183 11.802 1.00 0.42 N ATOM 1757 CA LEU B 9 5.445 -4.669 10.420 1.00 0.39 C ATOM 1758 C LEU B 9 4.382 -5.452 9.627 1.00 0.38 C ATOM 1759 O LEU B 9 3.633 -4.854 8.846 1.00 0.39 O ATOM 1760 CB LEU B 9 6.801 -4.720 9.686 1.00 0.41 C ATOM 1761 CG LEU B 9 7.913 -3.804 10.253 1.00 0.50 C ATOM 1762 CD1 LEU B 9 9.275 -4.192 9.676 1.00 0.63 C ATOM 1763 CD2 LEU B 9 7.610 -2.326 9.974 1.00 0.65 C ATOM 0 H LEU B 9 6.412 -5.750 11.954 1.00 0.42 H new ATOM 0 HA LEU B 9 5.120 -3.631 10.487 1.00 0.39 H new ATOM 0 HB2 LEU B 9 7.162 -5.748 9.701 1.00 0.41 H new ATOM 0 HB3 LEU B 9 6.637 -4.455 8.641 1.00 0.41 H new ATOM 0 HG LEU B 9 7.942 -3.942 11.334 1.00 0.50 H new ATOM 0 HD11 LEU B 9 10.044 -3.537 10.086 1.00 0.63 H new ATOM 0 HD12 LEU B 9 9.501 -5.225 9.939 1.00 0.63 H new ATOM 0 HD13 LEU B 9 9.253 -4.090 8.591 1.00 0.63 H new ATOM 0 HD21 LEU B 9 8.408 -1.707 10.384 1.00 0.65 H new ATOM 0 HD22 LEU B 9 7.542 -2.165 8.898 1.00 0.65 H new ATOM 0 HD23 LEU B 9 6.664 -2.054 10.442 1.00 0.65 H new ATOM 1775 N GLU B 10 4.324 -6.792 9.824 1.00 0.39 N ATOM 1776 CA GLU B 10 3.320 -7.645 9.150 1.00 0.41 C ATOM 1777 C GLU B 10 1.913 -7.336 9.692 1.00 0.42 C ATOM 1778 O GLU B 10 0.938 -7.356 8.937 1.00 0.47 O ATOM 1779 CB GLU B 10 3.634 -9.145 9.338 1.00 0.46 C ATOM 1780 CG GLU B 10 4.958 -9.594 8.722 1.00 0.50 C ATOM 1781 CD GLU B 10 5.193 -11.091 8.851 1.00 0.56 C ATOM 1782 OE1 GLU B 10 4.547 -11.863 8.110 1.00 0.95 O ATOM 1783 OE2 GLU B 10 6.018 -11.493 9.700 1.00 0.95 O ATOM 0 H GLU B 10 4.957 -7.301 10.441 1.00 0.39 H new ATOM 0 HA GLU B 10 3.357 -7.422 8.084 1.00 0.41 H new ATOM 0 HB2 GLU B 10 3.649 -9.370 10.404 1.00 0.46 H new ATOM 0 HB3 GLU B 10 2.826 -9.731 8.900 1.00 0.46 H new ATOM 0 HG2 GLU B 10 4.974 -9.318 7.668 1.00 0.50 H new ATOM 0 HG3 GLU B 10 5.777 -9.060 9.204 1.00 0.50 H new ATOM 1790 N GLU B 11 1.828 -7.041 11.012 1.00 0.42 N ATOM 1791 CA GLU B 11 0.561 -6.693 11.680 1.00 0.45 C ATOM 1792 C GLU B 11 -0.017 -5.382 11.117 1.00 0.43 C ATOM 1793 O GLU B 11 -1.233 -5.258 10.980 1.00 0.45 O ATOM 1794 CB GLU B 11 0.772 -6.571 13.208 1.00 0.51 C ATOM 1795 CG GLU B 11 -0.518 -6.486 14.027 1.00 0.62 C ATOM 1796 CD GLU B 11 -0.268 -6.176 15.495 1.00 0.70 C ATOM 1797 OE1 GLU B 11 0.195 -7.080 16.224 1.00 0.82 O ATOM 1798 OE2 GLU B 11 -0.534 -5.029 15.915 1.00 0.85 O ATOM 0 H GLU B 11 2.635 -7.039 11.636 1.00 0.42 H new ATOM 0 HA GLU B 11 -0.154 -7.493 11.486 1.00 0.45 H new ATOM 0 HB2 GLU B 11 1.348 -7.430 13.551 1.00 0.51 H new ATOM 0 HB3 GLU B 11 1.373 -5.684 13.408 1.00 0.51 H new ATOM 0 HG2 GLU B 11 -1.162 -5.715 13.603 1.00 0.62 H new ATOM 0 HG3 GLU B 11 -1.056 -7.430 13.947 1.00 0.62 H new ATOM 1805 N SER B 12 0.867 -4.410 10.789 1.00 0.43 N ATOM 1806 CA SER B 12 0.442 -3.112 10.229 1.00 0.44 C ATOM 1807 C SER B 12 -0.290 -3.297 8.889 1.00 0.42 C ATOM 1808 O SER B 12 -1.416 -2.824 8.728 1.00 0.47 O ATOM 1809 CB SER B 12 1.647 -2.177 10.042 1.00 0.48 C ATOM 1810 OG SER B 12 2.243 -1.847 11.289 1.00 0.56 O ATOM 0 H SER B 12 1.876 -4.503 10.904 1.00 0.43 H new ATOM 0 HA SER B 12 -0.249 -2.659 10.940 1.00 0.44 H new ATOM 0 HB2 SER B 12 2.385 -2.656 9.399 1.00 0.48 H new ATOM 0 HB3 SER B 12 1.328 -1.266 9.537 1.00 0.48 H new ATOM 0 HG SER B 12 2.667 -2.644 11.670 1.00 0.56 H new ATOM 1816 N ILE B 13 0.356 -4.001 7.935 1.00 0.40 N ATOM 1817 CA ILE B 13 -0.242 -4.269 6.605 1.00 0.41 C ATOM 1818 C ILE B 13 -1.395 -5.304 6.679 1.00 0.41 C ATOM 1819 O ILE B 13 -2.213 -5.383 5.756 1.00 0.48 O ATOM 1820 CB ILE B 13 0.824 -4.717 5.533 1.00 0.46 C ATOM 1821 CG1 ILE B 13 1.700 -5.924 5.992 1.00 0.45 C ATOM 1822 CG2 ILE B 13 1.713 -3.531 5.148 1.00 0.53 C ATOM 1823 CD1 ILE B 13 1.103 -7.284 5.691 1.00 0.45 C ATOM 0 H ILE B 13 1.289 -4.394 8.058 1.00 0.40 H new ATOM 0 HA ILE B 13 -0.658 -3.316 6.277 1.00 0.41 H new ATOM 0 HB ILE B 13 0.263 -5.060 4.663 1.00 0.46 H new ATOM 0 HG12 ILE B 13 2.674 -5.854 5.509 1.00 0.45 H new ATOM 0 HG13 ILE B 13 1.870 -5.846 7.066 1.00 0.45 H new ATOM 0 HG21 ILE B 13 2.446 -3.851 4.407 1.00 0.53 H new ATOM 0 HG22 ILE B 13 1.097 -2.735 4.729 1.00 0.53 H new ATOM 0 HG23 ILE B 13 2.230 -3.161 6.034 1.00 0.53 H new ATOM 0 HD11 ILE B 13 1.778 -8.064 6.044 1.00 0.45 H new ATOM 0 HD12 ILE B 13 0.142 -7.380 6.197 1.00 0.45 H new ATOM 0 HD13 ILE B 13 0.959 -7.388 4.616 1.00 0.45 H new ATOM 1835 N GLU B 14 -1.449 -6.087 7.783 1.00 0.40 N ATOM 1836 CA GLU B 14 -2.499 -7.102 8.007 1.00 0.43 C ATOM 1837 C GLU B 14 -3.771 -6.466 8.612 1.00 0.45 C ATOM 1838 O GLU B 14 -4.883 -6.861 8.252 1.00 0.48 O ATOM 1839 CB GLU B 14 -1.950 -8.234 8.919 1.00 0.46 C ATOM 1840 CG GLU B 14 -2.987 -9.247 9.447 1.00 0.57 C ATOM 1841 CD GLU B 14 -3.554 -8.914 10.831 1.00 0.64 C ATOM 1842 OE1 GLU B 14 -3.223 -7.842 11.387 1.00 0.92 O ATOM 1843 OE2 GLU B 14 -4.334 -9.735 11.357 1.00 1.00 O ATOM 0 H GLU B 14 -0.767 -6.031 8.539 1.00 0.40 H new ATOM 0 HA GLU B 14 -2.779 -7.532 7.046 1.00 0.43 H new ATOM 0 HB2 GLU B 14 -1.188 -8.782 8.364 1.00 0.46 H new ATOM 0 HB3 GLU B 14 -1.454 -7.775 9.774 1.00 0.46 H new ATOM 0 HG2 GLU B 14 -3.811 -9.308 8.736 1.00 0.57 H new ATOM 0 HG3 GLU B 14 -2.525 -10.234 9.485 1.00 0.57 H new ATOM 1850 N THR B 15 -3.598 -5.490 9.534 1.00 0.45 N ATOM 1851 CA THR B 15 -4.735 -4.800 10.188 1.00 0.49 C ATOM 1852 C THR B 15 -5.604 -4.036 9.164 1.00 0.47 C ATOM 1853 O THR B 15 -6.818 -3.918 9.354 1.00 0.50 O ATOM 1854 CB THR B 15 -4.252 -3.842 11.321 1.00 0.54 C ATOM 1855 OG1 THR B 15 -3.429 -4.569 12.245 1.00 0.75 O ATOM 1856 CG2 THR B 15 -5.418 -3.223 12.095 1.00 0.88 C ATOM 0 H THR B 15 -2.682 -5.163 9.842 1.00 0.45 H new ATOM 0 HA THR B 15 -5.354 -5.574 10.643 1.00 0.49 H new ATOM 0 HB THR B 15 -3.692 -3.037 10.845 1.00 0.54 H new ATOM 0 HG1 THR B 15 -2.501 -4.565 11.929 1.00 0.75 H new ATOM 0 HG21 THR B 15 -5.030 -2.565 12.872 1.00 0.88 H new ATOM 0 HG22 THR B 15 -6.044 -2.649 11.412 1.00 0.88 H new ATOM 0 HG23 THR B 15 -6.012 -4.014 12.553 1.00 0.88 H new ATOM 1864 N VAL B 16 -4.980 -3.525 8.081 1.00 0.45 N ATOM 1865 CA VAL B 16 -5.713 -2.808 7.012 1.00 0.47 C ATOM 1866 C VAL B 16 -6.686 -3.773 6.284 1.00 0.47 C ATOM 1867 O VAL B 16 -7.755 -3.350 5.830 1.00 0.52 O ATOM 1868 CB VAL B 16 -4.737 -2.147 5.976 1.00 0.49 C ATOM 1869 CG1 VAL B 16 -5.490 -1.339 4.913 1.00 0.56 C ATOM 1870 CG2 VAL B 16 -3.708 -1.253 6.680 1.00 0.53 C ATOM 0 H VAL B 16 -3.975 -3.594 7.923 1.00 0.45 H new ATOM 0 HA VAL B 16 -6.284 -2.010 7.487 1.00 0.47 H new ATOM 0 HB VAL B 16 -4.214 -2.961 5.473 1.00 0.49 H new ATOM 0 HG11 VAL B 16 -4.776 -0.899 4.217 1.00 0.56 H new ATOM 0 HG12 VAL B 16 -6.169 -1.996 4.370 1.00 0.56 H new ATOM 0 HG13 VAL B 16 -6.062 -0.546 5.396 1.00 0.56 H new ATOM 0 HG21 VAL B 16 -3.045 -0.808 5.938 1.00 0.53 H new ATOM 0 HG22 VAL B 16 -4.225 -0.463 7.225 1.00 0.53 H new ATOM 0 HG23 VAL B 16 -3.122 -1.852 7.377 1.00 0.53 H new ATOM 1880 N VAL B 17 -6.303 -5.067 6.189 1.00 0.46 N ATOM 1881 CA VAL B 17 -7.128 -6.104 5.540 1.00 0.50 C ATOM 1882 C VAL B 17 -8.216 -6.622 6.501 1.00 0.57 C ATOM 1883 O VAL B 17 -9.392 -6.623 6.149 1.00 0.97 O ATOM 1884 CB VAL B 17 -6.255 -7.310 5.041 1.00 0.53 C ATOM 1885 CG1 VAL B 17 -7.099 -8.376 4.315 1.00 0.63 C ATOM 1886 CG2 VAL B 17 -5.109 -6.818 4.149 1.00 0.55 C ATOM 0 H VAL B 17 -5.419 -5.417 6.558 1.00 0.46 H new ATOM 0 HA VAL B 17 -7.602 -5.639 4.676 1.00 0.50 H new ATOM 0 HB VAL B 17 -5.828 -7.787 5.923 1.00 0.53 H new ATOM 0 HG11 VAL B 17 -6.453 -9.191 3.988 1.00 0.63 H new ATOM 0 HG12 VAL B 17 -7.857 -8.765 4.995 1.00 0.63 H new ATOM 0 HG13 VAL B 17 -7.584 -7.927 3.448 1.00 0.63 H new ATOM 0 HG21 VAL B 17 -4.517 -7.670 3.814 1.00 0.55 H new ATOM 0 HG22 VAL B 17 -5.519 -6.299 3.283 1.00 0.55 H new ATOM 0 HG23 VAL B 17 -4.475 -6.135 4.715 1.00 0.55 H new ATOM 1896 N THR B 18 -7.814 -7.027 7.726 1.00 0.50 N ATOM 1897 CA THR B 18 -8.751 -7.592 8.727 1.00 0.52 C ATOM 1898 C THR B 18 -9.887 -6.632 9.150 1.00 0.54 C ATOM 1899 O THR B 18 -10.933 -7.100 9.607 1.00 0.67 O ATOM 1900 CB THR B 18 -8.010 -8.091 10.006 1.00 0.56 C ATOM 1901 OG1 THR B 18 -7.242 -7.029 10.588 1.00 0.58 O ATOM 1902 CG2 THR B 18 -7.087 -9.273 9.700 1.00 0.62 C ATOM 0 H THR B 18 -6.847 -6.974 8.047 1.00 0.50 H new ATOM 0 HA THR B 18 -9.211 -8.434 8.210 1.00 0.52 H new ATOM 0 HB THR B 18 -8.772 -8.422 10.711 1.00 0.56 H new ATOM 0 HG1 THR B 18 -6.784 -7.358 11.390 1.00 0.58 H new ATOM 0 HG21 THR B 18 -6.589 -9.592 10.615 1.00 0.62 H new ATOM 0 HG22 THR B 18 -7.674 -10.099 9.300 1.00 0.62 H new ATOM 0 HG23 THR B 18 -6.339 -8.971 8.967 1.00 0.62 H new ATOM 1910 N THR B 19 -9.699 -5.303 9.003 1.00 0.53 N ATOM 1911 CA THR B 19 -10.739 -4.328 9.389 1.00 0.57 C ATOM 1912 C THR B 19 -11.775 -4.104 8.262 1.00 0.57 C ATOM 1913 O THR B 19 -12.981 -4.093 8.539 1.00 0.66 O ATOM 1914 CB THR B 19 -10.119 -2.966 9.825 1.00 0.60 C ATOM 1915 OG1 THR B 19 -9.064 -3.196 10.772 1.00 0.61 O ATOM 1916 CG2 THR B 19 -11.159 -2.034 10.461 1.00 0.69 C ATOM 0 H THR B 19 -8.848 -4.886 8.625 1.00 0.53 H new ATOM 0 HA THR B 19 -11.260 -4.760 10.244 1.00 0.57 H new ATOM 0 HB THR B 19 -9.733 -2.484 8.927 1.00 0.60 H new ATOM 0 HG1 THR B 19 -8.219 -3.332 10.294 1.00 0.61 H new ATOM 0 HG21 THR B 19 -10.681 -1.098 10.749 1.00 0.69 H new ATOM 0 HG22 THR B 19 -11.953 -1.830 9.742 1.00 0.69 H new ATOM 0 HG23 THR B 19 -11.583 -2.511 11.344 1.00 0.69 H new ATOM 1924 N PHE B 20 -11.312 -3.944 7.001 1.00 0.56 N ATOM 1925 CA PHE B 20 -12.226 -3.688 5.863 1.00 0.60 C ATOM 1926 C PHE B 20 -12.577 -4.945 5.027 1.00 0.60 C ATOM 1927 O PHE B 20 -13.292 -4.816 4.029 1.00 0.94 O ATOM 1928 CB PHE B 20 -11.650 -2.580 4.949 1.00 0.68 C ATOM 1929 CG PHE B 20 -12.702 -1.853 4.126 1.00 0.75 C ATOM 1930 CD1 PHE B 20 -13.658 -1.053 4.744 1.00 0.91 C ATOM 1931 CD2 PHE B 20 -12.740 -1.976 2.742 1.00 0.80 C ATOM 1932 CE1 PHE B 20 -14.619 -0.396 4.004 1.00 1.02 C ATOM 1933 CE2 PHE B 20 -13.705 -1.317 2.002 1.00 0.90 C ATOM 1934 CZ PHE B 20 -14.644 -0.527 2.633 1.00 0.97 C ATOM 0 H PHE B 20 -10.325 -3.987 6.747 1.00 0.56 H new ATOM 0 HA PHE B 20 -13.165 -3.358 6.309 1.00 0.60 H new ATOM 0 HB2 PHE B 20 -11.119 -1.854 5.565 1.00 0.68 H new ATOM 0 HB3 PHE B 20 -10.917 -3.023 4.275 1.00 0.68 H new ATOM 0 HD1 PHE B 20 -13.648 -0.945 5.819 1.00 0.91 H new ATOM 0 HD2 PHE B 20 -12.009 -2.592 2.240 1.00 0.80 H new ATOM 0 HE1 PHE B 20 -15.353 0.222 4.500 1.00 1.02 H new ATOM 0 HE2 PHE B 20 -13.724 -1.421 0.927 1.00 0.90 H new ATOM 0 HZ PHE B 20 -15.396 -0.013 2.054 1.00 0.97 H new ATOM 1944 N PHE B 21 -12.103 -6.155 5.409 1.00 0.71 N ATOM 1945 CA PHE B 21 -12.440 -7.384 4.646 1.00 0.72 C ATOM 1946 C PHE B 21 -13.944 -7.720 4.790 1.00 0.68 C ATOM 1947 O PHE B 21 -14.553 -8.242 3.853 1.00 0.71 O ATOM 1948 CB PHE B 21 -11.579 -8.591 5.089 1.00 1.01 C ATOM 1949 CG PHE B 21 -11.576 -9.745 4.102 1.00 1.63 C ATOM 1950 CD1 PHE B 21 -12.608 -10.679 4.091 1.00 2.26 C ATOM 1951 CD2 PHE B 21 -10.546 -9.887 3.179 1.00 1.93 C ATOM 1952 CE1 PHE B 21 -12.609 -11.719 3.184 1.00 2.92 C ATOM 1953 CE2 PHE B 21 -10.548 -10.930 2.274 1.00 2.67 C ATOM 1954 CZ PHE B 21 -11.579 -11.845 2.275 1.00 3.08 C ATOM 0 H PHE B 21 -11.502 -6.307 6.219 1.00 0.71 H new ATOM 0 HA PHE B 21 -12.219 -7.185 3.597 1.00 0.72 H new ATOM 0 HB2 PHE B 21 -10.553 -8.255 5.242 1.00 1.01 H new ATOM 0 HB3 PHE B 21 -11.944 -8.951 6.051 1.00 1.01 H new ATOM 0 HD1 PHE B 21 -13.417 -10.589 4.800 1.00 2.26 H new ATOM 0 HD2 PHE B 21 -9.735 -9.174 3.170 1.00 1.93 H new ATOM 0 HE1 PHE B 21 -13.417 -12.435 3.186 1.00 2.92 H new ATOM 0 HE2 PHE B 21 -9.740 -11.029 1.564 1.00 2.67 H new ATOM 0 HZ PHE B 21 -11.580 -12.659 1.565 1.00 3.08 H new ATOM 1964 N THR B 22 -14.526 -7.410 5.971 1.00 0.76 N ATOM 1965 CA THR B 22 -15.958 -7.651 6.247 1.00 0.91 C ATOM 1966 C THR B 22 -16.860 -6.833 5.286 1.00 0.84 C ATOM 1967 O THR B 22 -17.902 -7.328 4.846 1.00 1.01 O ATOM 1968 CB THR B 22 -16.304 -7.309 7.732 1.00 1.10 C ATOM 1969 OG1 THR B 22 -15.301 -7.842 8.624 1.00 1.23 O ATOM 1970 CG2 THR B 22 -17.671 -7.854 8.143 1.00 1.37 C ATOM 0 H THR B 22 -14.021 -6.990 6.751 1.00 0.76 H new ATOM 0 HA THR B 22 -16.151 -8.711 6.079 1.00 0.91 H new ATOM 0 HB THR B 22 -16.328 -6.222 7.805 1.00 1.10 H new ATOM 0 HG1 THR B 22 -15.533 -7.617 9.549 1.00 1.23 H new ATOM 0 HG21 THR B 22 -17.869 -7.593 9.182 1.00 1.37 H new ATOM 0 HG22 THR B 22 -18.442 -7.420 7.506 1.00 1.37 H new ATOM 0 HG23 THR B 22 -17.678 -8.939 8.034 1.00 1.37 H new ATOM 1978 N PHE B 23 -16.451 -5.582 4.976 1.00 0.69 N ATOM 1979 CA PHE B 23 -17.198 -4.700 4.053 1.00 0.75 C ATOM 1980 C PHE B 23 -16.803 -4.950 2.578 1.00 0.70 C ATOM 1981 O PHE B 23 -17.643 -4.815 1.684 1.00 0.83 O ATOM 1982 CB PHE B 23 -16.961 -3.213 4.415 1.00 0.84 C ATOM 1983 CG PHE B 23 -17.666 -2.753 5.677 1.00 1.00 C ATOM 1984 CD1 PHE B 23 -17.117 -2.996 6.934 1.00 1.03 C ATOM 1985 CD2 PHE B 23 -18.882 -2.075 5.608 1.00 1.32 C ATOM 1986 CE1 PHE B 23 -17.765 -2.575 8.081 1.00 1.27 C ATOM 1987 CE2 PHE B 23 -19.528 -1.655 6.754 1.00 1.54 C ATOM 1988 CZ PHE B 23 -18.968 -1.905 7.991 1.00 1.48 C ATOM 0 H PHE B 23 -15.603 -5.160 5.354 1.00 0.69 H new ATOM 0 HA PHE B 23 -18.257 -4.935 4.164 1.00 0.75 H new ATOM 0 HB2 PHE B 23 -15.890 -3.047 4.531 1.00 0.84 H new ATOM 0 HB3 PHE B 23 -17.292 -2.592 3.582 1.00 0.84 H new ATOM 0 HD1 PHE B 23 -16.175 -3.519 7.014 1.00 1.03 H new ATOM 0 HD2 PHE B 23 -19.326 -1.875 4.644 1.00 1.32 H new ATOM 0 HE1 PHE B 23 -17.329 -2.771 9.049 1.00 1.27 H new ATOM 0 HE2 PHE B 23 -20.470 -1.132 6.683 1.00 1.54 H new ATOM 0 HZ PHE B 23 -19.471 -1.576 8.888 1.00 1.48 H new ATOM 1998 N ALA B 24 -15.524 -5.317 2.329 1.00 0.61 N ATOM 1999 CA ALA B 24 -15.008 -5.566 0.960 1.00 0.67 C ATOM 2000 C ALA B 24 -15.557 -6.862 0.317 1.00 0.65 C ATOM 2001 O ALA B 24 -15.630 -6.949 -0.913 1.00 0.85 O ATOM 2002 CB ALA B 24 -13.479 -5.595 0.974 1.00 0.77 C ATOM 0 H ALA B 24 -14.827 -5.448 3.062 1.00 0.61 H new ATOM 0 HA ALA B 24 -15.364 -4.742 0.342 1.00 0.67 H new ATOM 0 HB1 ALA B 24 -13.109 -5.778 -0.035 1.00 0.77 H new ATOM 0 HB2 ALA B 24 -13.100 -4.637 1.331 1.00 0.77 H new ATOM 0 HB3 ALA B 24 -13.136 -6.390 1.636 1.00 0.77 H new ATOM 2008 N ARG B 25 -15.937 -7.863 1.142 1.00 0.62 N ATOM 2009 CA ARG B 25 -16.471 -9.155 0.636 1.00 0.68 C ATOM 2010 C ARG B 25 -17.959 -9.091 0.198 1.00 0.70 C ATOM 2011 O ARG B 25 -18.496 -10.098 -0.276 1.00 0.87 O ATOM 2012 CB ARG B 25 -16.274 -10.269 1.693 1.00 0.77 C ATOM 2013 CG ARG B 25 -17.104 -10.108 2.976 1.00 0.80 C ATOM 2014 CD ARG B 25 -16.757 -11.169 4.020 1.00 1.01 C ATOM 2015 NE ARG B 25 -17.635 -11.103 5.203 1.00 1.10 N ATOM 2016 CZ ARG B 25 -17.312 -11.544 6.440 1.00 1.38 C ATOM 2017 NH1 ARG B 25 -16.118 -12.103 6.694 1.00 1.73 N ATOM 2018 NH2 ARG B 25 -18.200 -11.428 7.427 1.00 1.48 N ATOM 0 H ARG B 25 -15.885 -7.805 2.159 1.00 0.62 H new ATOM 0 HA ARG B 25 -15.899 -9.386 -0.262 1.00 0.68 H new ATOM 0 HB2 ARG B 25 -16.521 -11.228 1.237 1.00 0.77 H new ATOM 0 HB3 ARG B 25 -15.219 -10.308 1.964 1.00 0.77 H new ATOM 0 HG2 ARG B 25 -16.933 -9.117 3.396 1.00 0.80 H new ATOM 0 HG3 ARG B 25 -18.164 -10.173 2.732 1.00 0.80 H new ATOM 0 HD2 ARG B 25 -16.834 -12.158 3.568 1.00 1.01 H new ATOM 0 HD3 ARG B 25 -15.721 -11.042 4.333 1.00 1.01 H new ATOM 0 HE ARG B 25 -18.560 -10.692 5.078 1.00 1.10 H new ATOM 0 HH11 ARG B 25 -15.432 -12.202 5.946 1.00 1.73 H new ATOM 0 HH12 ARG B 25 -15.897 -12.428 7.635 1.00 1.73 H new ATOM 0 HH21 ARG B 25 -19.113 -11.010 7.245 1.00 1.48 H new ATOM 0 HH22 ARG B 25 -17.967 -11.757 8.364 1.00 1.48 H new ATOM 2032 N GLN B 26 -18.622 -7.922 0.349 1.00 0.71 N ATOM 2033 CA GLN B 26 -20.041 -7.761 -0.027 1.00 0.79 C ATOM 2034 C GLN B 26 -20.253 -7.835 -1.560 1.00 0.73 C ATOM 2035 O GLN B 26 -21.263 -8.381 -2.013 1.00 0.84 O ATOM 2036 CB GLN B 26 -20.591 -6.438 0.551 1.00 0.90 C ATOM 2037 CG GLN B 26 -22.117 -6.370 0.632 1.00 1.09 C ATOM 2038 CD GLN B 26 -22.625 -5.161 1.417 1.00 1.31 C ATOM 2039 OE1 GLN B 26 -22.008 -4.094 1.405 1.00 1.46 O ATOM 2040 NE2 GLN B 26 -23.750 -5.321 2.118 1.00 1.68 N ATOM 0 H GLN B 26 -18.195 -7.077 0.729 1.00 0.71 H new ATOM 0 HA GLN B 26 -20.598 -8.594 0.402 1.00 0.79 H new ATOM 0 HB2 GLN B 26 -20.179 -6.293 1.550 1.00 0.90 H new ATOM 0 HB3 GLN B 26 -20.235 -5.611 -0.064 1.00 0.90 H new ATOM 0 HG2 GLN B 26 -22.527 -6.338 -0.377 1.00 1.09 H new ATOM 0 HG3 GLN B 26 -22.491 -7.281 1.099 1.00 1.09 H new ATOM 0 HE21 GLN B 26 -24.235 -6.218 2.106 1.00 1.68 H new ATOM 0 HE22 GLN B 26 -24.124 -4.546 2.666 1.00 1.68 H new ATOM 2049 N GLU B 27 -19.297 -7.294 -2.346 1.00 0.66 N ATOM 2050 CA GLU B 27 -19.374 -7.311 -3.824 1.00 0.71 C ATOM 2051 C GLU B 27 -18.439 -8.397 -4.409 1.00 0.88 C ATOM 2052 O GLU B 27 -17.829 -9.159 -3.648 1.00 1.45 O ATOM 2053 CB GLU B 27 -19.040 -5.907 -4.387 1.00 0.83 C ATOM 2054 CG GLU B 27 -20.086 -4.836 -4.066 1.00 0.93 C ATOM 2055 CD GLU B 27 -21.404 -5.045 -4.801 1.00 1.04 C ATOM 2056 OE1 GLU B 27 -21.512 -4.610 -5.968 1.00 1.23 O ATOM 2057 OE2 GLU B 27 -22.328 -5.645 -4.211 1.00 1.16 O ATOM 0 H GLU B 27 -18.461 -6.839 -1.981 1.00 0.66 H new ATOM 0 HA GLU B 27 -20.391 -7.563 -4.124 1.00 0.71 H new ATOM 0 HB2 GLU B 27 -18.076 -5.588 -3.989 1.00 0.83 H new ATOM 0 HB3 GLU B 27 -18.930 -5.979 -5.469 1.00 0.83 H new ATOM 0 HG2 GLU B 27 -20.273 -4.830 -2.992 1.00 0.93 H new ATOM 0 HG3 GLU B 27 -19.685 -3.856 -4.325 1.00 0.93 H new ATOM 2064 N GLY B 28 -18.344 -8.469 -5.761 1.00 0.73 N ATOM 2065 CA GLY B 28 -17.504 -9.467 -6.451 1.00 0.86 C ATOM 2066 C GLY B 28 -16.061 -9.565 -5.936 1.00 0.69 C ATOM 2067 O GLY B 28 -15.472 -8.550 -5.555 1.00 0.66 O ATOM 0 H GLY B 28 -18.843 -7.842 -6.392 1.00 0.73 H new ATOM 0 HA2 GLY B 28 -17.975 -10.445 -6.356 1.00 0.86 H new ATOM 0 HA3 GLY B 28 -17.479 -9.227 -7.514 1.00 0.86 H new ATOM 2071 N ARG B 29 -15.495 -10.801 -5.956 1.00 0.68 N ATOM 2072 CA ARG B 29 -14.120 -11.104 -5.475 1.00 0.65 C ATOM 2073 C ARG B 29 -13.978 -10.833 -3.961 1.00 0.62 C ATOM 2074 O ARG B 29 -14.307 -9.743 -3.484 1.00 0.69 O ATOM 2075 CB ARG B 29 -13.020 -10.341 -6.268 1.00 0.66 C ATOM 2076 CG ARG B 29 -12.602 -10.999 -7.594 1.00 0.84 C ATOM 2077 CD ARG B 29 -13.622 -10.783 -8.708 1.00 1.28 C ATOM 2078 NE ARG B 29 -13.123 -11.234 -10.023 1.00 1.44 N ATOM 2079 CZ ARG B 29 -13.494 -12.364 -10.675 1.00 1.93 C ATOM 2080 NH1 ARG B 29 -14.330 -13.258 -10.127 1.00 2.62 N ATOM 2081 NH2 ARG B 29 -13.003 -12.603 -11.892 1.00 2.09 N ATOM 0 H ARG B 29 -15.985 -11.623 -6.310 1.00 0.68 H new ATOM 0 HA ARG B 29 -13.967 -12.168 -5.655 1.00 0.65 H new ATOM 0 HB2 ARG B 29 -13.377 -9.332 -6.477 1.00 0.66 H new ATOM 0 HB3 ARG B 29 -12.138 -10.243 -5.635 1.00 0.66 H new ATOM 0 HG2 ARG B 29 -11.639 -10.596 -7.906 1.00 0.84 H new ATOM 0 HG3 ARG B 29 -12.464 -12.069 -7.436 1.00 0.84 H new ATOM 0 HD2 ARG B 29 -14.539 -11.320 -8.467 1.00 1.28 H new ATOM 0 HD3 ARG B 29 -13.878 -9.725 -8.763 1.00 1.28 H new ATOM 0 HE ARG B 29 -12.434 -10.640 -10.484 1.00 1.44 H new ATOM 0 HH11 ARG B 29 -14.707 -13.098 -9.193 1.00 2.62 H new ATOM 0 HH12 ARG B 29 -14.589 -14.098 -10.644 1.00 2.62 H new ATOM 0 HH21 ARG B 29 -12.357 -11.940 -12.321 1.00 2.09 H new ATOM 0 HH22 ARG B 29 -13.273 -13.449 -12.394 1.00 2.09 H new ATOM 2095 N LYS B 30 -13.468 -11.835 -3.213 1.00 0.64 N ATOM 2096 CA LYS B 30 -13.287 -11.717 -1.747 1.00 0.65 C ATOM 2097 C LYS B 30 -12.136 -10.757 -1.382 1.00 0.63 C ATOM 2098 O LYS B 30 -12.207 -10.070 -0.357 1.00 0.67 O ATOM 2099 CB LYS B 30 -13.044 -13.099 -1.099 1.00 0.73 C ATOM 2100 CG LYS B 30 -14.099 -14.168 -1.413 1.00 0.79 C ATOM 2101 CD LYS B 30 -15.517 -13.758 -0.993 1.00 0.87 C ATOM 2102 CE LYS B 30 -16.520 -14.890 -1.202 1.00 1.01 C ATOM 2103 NZ LYS B 30 -16.753 -15.184 -2.648 1.00 1.11 N ATOM 0 H LYS B 30 -13.175 -12.733 -3.597 1.00 0.64 H new ATOM 0 HA LYS B 30 -14.213 -11.300 -1.352 1.00 0.65 H new ATOM 0 HB2 LYS B 30 -12.071 -13.467 -1.423 1.00 0.73 H new ATOM 0 HB3 LYS B 30 -12.992 -12.970 -0.018 1.00 0.73 H new ATOM 0 HG2 LYS B 30 -14.089 -14.376 -2.483 1.00 0.79 H new ATOM 0 HG3 LYS B 30 -13.830 -15.095 -0.906 1.00 0.79 H new ATOM 0 HD2 LYS B 30 -15.514 -13.464 0.057 1.00 0.87 H new ATOM 0 HD3 LYS B 30 -15.828 -12.886 -1.568 1.00 0.87 H new ATOM 0 HE2 LYS B 30 -16.157 -15.790 -0.705 1.00 1.01 H new ATOM 0 HE3 LYS B 30 -17.466 -14.625 -0.731 1.00 1.01 H new ATOM 0 HZ1 LYS B 30 -17.453 -15.947 -2.739 1.00 1.11 H new ATOM 0 HZ2 LYS B 30 -17.108 -14.330 -3.123 1.00 1.11 H new ATOM 0 HZ3 LYS B 30 -15.860 -15.480 -3.090 1.00 1.11 H new ATOM 2117 N ASP B 31 -11.080 -10.709 -2.226 1.00 0.65 N ATOM 2118 CA ASP B 31 -9.918 -9.825 -1.997 1.00 0.69 C ATOM 2119 C ASP B 31 -10.027 -8.525 -2.829 1.00 0.64 C ATOM 2120 O ASP B 31 -9.006 -7.969 -3.258 1.00 0.88 O ATOM 2121 CB ASP B 31 -8.607 -10.564 -2.349 1.00 0.83 C ATOM 2122 CG ASP B 31 -8.440 -11.892 -1.624 1.00 0.94 C ATOM 2123 OD1 ASP B 31 -8.412 -11.894 -0.373 1.00 1.36 O ATOM 2124 OD2 ASP B 31 -8.334 -12.931 -2.309 1.00 1.24 O ATOM 0 H ASP B 31 -11.010 -11.274 -3.073 1.00 0.65 H new ATOM 0 HA ASP B 31 -9.908 -9.554 -0.941 1.00 0.69 H new ATOM 0 HB2 ASP B 31 -8.577 -10.741 -3.424 1.00 0.83 H new ATOM 0 HB3 ASP B 31 -7.761 -9.920 -2.108 1.00 0.83 H new ATOM 2129 N SER B 32 -11.269 -8.024 -3.035 1.00 0.65 N ATOM 2130 CA SER B 32 -11.509 -6.807 -3.826 1.00 0.59 C ATOM 2131 C SER B 32 -12.492 -5.864 -3.120 1.00 0.57 C ATOM 2132 O SER B 32 -13.418 -6.317 -2.442 1.00 0.64 O ATOM 2133 CB SER B 32 -12.053 -7.181 -5.213 1.00 0.59 C ATOM 2134 OG SER B 32 -12.251 -6.029 -6.020 1.00 1.13 O ATOM 0 H SER B 32 -12.117 -8.450 -2.661 1.00 0.65 H new ATOM 0 HA SER B 32 -10.558 -6.286 -3.934 1.00 0.59 H new ATOM 0 HB2 SER B 32 -11.357 -7.858 -5.708 1.00 0.59 H new ATOM 0 HB3 SER B 32 -12.996 -7.717 -5.103 1.00 0.59 H new ATOM 0 HG SER B 32 -13.151 -6.051 -6.407 1.00 1.13 H new ATOM 2140 N LEU B 33 -12.280 -4.548 -3.299 1.00 0.55 N ATOM 2141 CA LEU B 33 -13.132 -3.514 -2.697 1.00 0.56 C ATOM 2142 C LEU B 33 -14.120 -2.966 -3.735 1.00 0.55 C ATOM 2143 O LEU B 33 -13.831 -2.975 -4.937 1.00 0.72 O ATOM 2144 CB LEU B 33 -12.271 -2.353 -2.144 1.00 0.59 C ATOM 2145 CG LEU B 33 -11.409 -2.670 -0.897 1.00 0.69 C ATOM 2146 CD1 LEU B 33 -10.222 -3.583 -1.239 1.00 0.79 C ATOM 2147 CD2 LEU B 33 -10.925 -1.374 -0.241 1.00 0.75 C ATOM 0 H LEU B 33 -11.516 -4.175 -3.863 1.00 0.55 H new ATOM 0 HA LEU B 33 -13.687 -3.968 -1.876 1.00 0.56 H new ATOM 0 HB2 LEU B 33 -11.609 -2.010 -2.939 1.00 0.59 H new ATOM 0 HB3 LEU B 33 -12.933 -1.522 -1.900 1.00 0.59 H new ATOM 0 HG LEU B 33 -12.038 -3.210 -0.189 1.00 0.69 H new ATOM 0 HD11 LEU B 33 -9.643 -3.781 -0.337 1.00 0.79 H new ATOM 0 HD12 LEU B 33 -10.592 -4.524 -1.646 1.00 0.79 H new ATOM 0 HD13 LEU B 33 -9.587 -3.093 -1.977 1.00 0.79 H new ATOM 0 HD21 LEU B 33 -10.321 -1.613 0.634 1.00 0.75 H new ATOM 0 HD22 LEU B 33 -10.325 -0.808 -0.953 1.00 0.75 H new ATOM 0 HD23 LEU B 33 -11.785 -0.777 0.064 1.00 0.75 H new ATOM 2159 N SER B 34 -15.288 -2.492 -3.269 1.00 0.52 N ATOM 2160 CA SER B 34 -16.305 -1.916 -4.163 1.00 0.53 C ATOM 2161 C SER B 34 -15.932 -0.465 -4.504 1.00 0.50 C ATOM 2162 O SER B 34 -15.315 0.224 -3.683 1.00 0.52 O ATOM 2163 CB SER B 34 -17.697 -1.969 -3.513 1.00 0.62 C ATOM 2164 OG SER B 34 -18.700 -1.477 -4.389 1.00 0.69 O ATOM 0 H SER B 34 -15.550 -2.496 -2.283 1.00 0.52 H new ATOM 0 HA SER B 34 -16.337 -2.504 -5.080 1.00 0.53 H new ATOM 0 HB2 SER B 34 -17.930 -2.996 -3.232 1.00 0.62 H new ATOM 0 HB3 SER B 34 -17.694 -1.381 -2.595 1.00 0.62 H new ATOM 0 HG SER B 34 -19.573 -1.526 -3.947 1.00 0.69 H new ATOM 2170 N VAL B 35 -16.308 -0.002 -5.716 1.00 0.52 N ATOM 2171 CA VAL B 35 -16.003 1.378 -6.161 1.00 0.53 C ATOM 2172 C VAL B 35 -16.795 2.453 -5.353 1.00 0.48 C ATOM 2173 O VAL B 35 -16.447 3.635 -5.404 1.00 0.52 O ATOM 2174 CB VAL B 35 -16.219 1.543 -7.712 1.00 0.64 C ATOM 2175 CG1 VAL B 35 -17.701 1.549 -8.109 1.00 0.67 C ATOM 2176 CG2 VAL B 35 -15.504 2.791 -8.250 1.00 0.71 C ATOM 0 H VAL B 35 -16.820 -0.558 -6.401 1.00 0.52 H new ATOM 0 HA VAL B 35 -14.947 1.549 -5.954 1.00 0.53 H new ATOM 0 HB VAL B 35 -15.771 0.664 -8.176 1.00 0.64 H new ATOM 0 HG11 VAL B 35 -17.788 1.666 -9.189 1.00 0.67 H new ATOM 0 HG12 VAL B 35 -18.162 0.609 -7.807 1.00 0.67 H new ATOM 0 HG13 VAL B 35 -18.207 2.377 -7.613 1.00 0.67 H new ATOM 0 HG21 VAL B 35 -15.674 2.874 -9.323 1.00 0.71 H new ATOM 0 HG22 VAL B 35 -15.895 3.678 -7.751 1.00 0.71 H new ATOM 0 HG23 VAL B 35 -14.434 2.709 -8.058 1.00 0.71 H new ATOM 2186 N ASN B 36 -17.845 2.031 -4.609 1.00 0.47 N ATOM 2187 CA ASN B 36 -18.661 2.947 -3.785 1.00 0.48 C ATOM 2188 C ASN B 36 -18.291 2.844 -2.284 1.00 0.46 C ATOM 2189 O ASN B 36 -18.317 3.854 -1.577 1.00 0.66 O ATOM 2190 CB ASN B 36 -20.160 2.640 -3.980 1.00 0.55 C ATOM 2191 CG ASN B 36 -21.074 3.772 -3.510 1.00 0.64 C ATOM 2192 OD1 ASN B 36 -21.430 4.651 -4.295 1.00 0.83 O ATOM 2193 ND2 ASN B 36 -21.457 3.765 -2.231 1.00 0.79 N ATOM 0 H ASN B 36 -18.146 1.057 -4.565 1.00 0.47 H new ATOM 0 HA ASN B 36 -18.453 3.966 -4.113 1.00 0.48 H new ATOM 0 HB2 ASN B 36 -20.349 2.443 -5.035 1.00 0.55 H new ATOM 0 HB3 ASN B 36 -20.411 1.729 -3.436 1.00 0.55 H new ATOM 0 HD21 ASN B 36 -22.064 4.504 -1.876 1.00 0.79 H new ATOM 0 HD22 ASN B 36 -21.143 3.021 -1.609 1.00 0.79 H new ATOM 2200 N GLU B 37 -17.945 1.623 -1.809 1.00 0.46 N ATOM 2201 CA GLU B 37 -17.593 1.390 -0.386 1.00 0.50 C ATOM 2202 C GLU B 37 -16.226 1.987 -0.001 1.00 0.45 C ATOM 2203 O GLU B 37 -16.065 2.455 1.132 1.00 0.46 O ATOM 2204 CB GLU B 37 -17.614 -0.114 -0.054 1.00 0.62 C ATOM 2205 CG GLU B 37 -19.001 -0.748 -0.150 1.00 0.69 C ATOM 2206 CD GLU B 37 -19.012 -2.212 0.260 1.00 0.88 C ATOM 2207 OE1 GLU B 37 -18.748 -3.074 -0.604 1.00 1.61 O ATOM 2208 OE2 GLU B 37 -19.285 -2.492 1.445 1.00 1.28 O ATOM 0 H GLU B 37 -17.902 0.785 -2.389 1.00 0.46 H new ATOM 0 HA GLU B 37 -18.352 1.905 0.202 1.00 0.50 H new ATOM 0 HB2 GLU B 37 -16.939 -0.636 -0.732 1.00 0.62 H new ATOM 0 HB3 GLU B 37 -17.228 -0.259 0.955 1.00 0.62 H new ATOM 0 HG2 GLU B 37 -19.693 -0.193 0.484 1.00 0.69 H new ATOM 0 HG3 GLU B 37 -19.365 -0.660 -1.174 1.00 0.69 H new ATOM 2215 N PHE B 38 -15.238 1.962 -0.929 1.00 0.43 N ATOM 2216 CA PHE B 38 -13.897 2.526 -0.653 1.00 0.43 C ATOM 2217 C PHE B 38 -13.983 4.055 -0.464 1.00 0.39 C ATOM 2218 O PHE B 38 -13.254 4.622 0.349 1.00 0.42 O ATOM 2219 CB PHE B 38 -12.876 2.126 -1.758 1.00 0.48 C ATOM 2220 CG PHE B 38 -12.682 3.130 -2.888 1.00 0.46 C ATOM 2221 CD1 PHE B 38 -13.557 3.172 -3.966 1.00 0.52 C ATOM 2222 CD2 PHE B 38 -11.614 4.027 -2.866 1.00 0.55 C ATOM 2223 CE1 PHE B 38 -13.375 4.084 -4.989 1.00 0.61 C ATOM 2224 CE2 PHE B 38 -11.435 4.938 -3.886 1.00 0.65 C ATOM 2225 CZ PHE B 38 -12.313 4.965 -4.949 1.00 0.66 C ATOM 0 H PHE B 38 -15.343 1.563 -1.862 1.00 0.43 H new ATOM 0 HA PHE B 38 -13.528 2.100 0.280 1.00 0.43 H new ATOM 0 HB2 PHE B 38 -11.910 1.951 -1.285 1.00 0.48 H new ATOM 0 HB3 PHE B 38 -13.194 1.178 -2.192 1.00 0.48 H new ATOM 0 HD1 PHE B 38 -14.389 2.484 -4.005 1.00 0.52 H new ATOM 0 HD2 PHE B 38 -10.919 4.008 -2.040 1.00 0.55 H new ATOM 0 HE1 PHE B 38 -14.064 4.107 -5.820 1.00 0.61 H new ATOM 0 HE2 PHE B 38 -10.607 5.630 -3.852 1.00 0.65 H new ATOM 0 HZ PHE B 38 -12.170 5.675 -5.750 1.00 0.66 H new ATOM 2235 N LYS B 39 -14.893 4.706 -1.226 1.00 0.37 N ATOM 2236 CA LYS B 39 -15.115 6.160 -1.136 1.00 0.38 C ATOM 2237 C LYS B 39 -15.741 6.530 0.226 1.00 0.36 C ATOM 2238 O LYS B 39 -15.418 7.578 0.794 1.00 0.39 O ATOM 2239 CB LYS B 39 -16.024 6.629 -2.290 1.00 0.43 C ATOM 2240 CG LYS B 39 -16.029 8.139 -2.516 1.00 0.50 C ATOM 2241 CD LYS B 39 -16.978 8.549 -3.643 1.00 0.60 C ATOM 2242 CE LYS B 39 -16.932 10.054 -3.910 1.00 0.70 C ATOM 2243 NZ LYS B 39 -15.682 10.470 -4.617 1.00 0.81 N ATOM 0 H LYS B 39 -15.486 4.240 -1.912 1.00 0.37 H new ATOM 0 HA LYS B 39 -14.153 6.665 -1.219 1.00 0.38 H new ATOM 0 HB2 LYS B 39 -15.706 6.137 -3.209 1.00 0.43 H new ATOM 0 HB3 LYS B 39 -17.044 6.301 -2.089 1.00 0.43 H new ATOM 0 HG2 LYS B 39 -16.322 8.642 -1.595 1.00 0.50 H new ATOM 0 HG3 LYS B 39 -15.019 8.473 -2.754 1.00 0.50 H new ATOM 0 HD2 LYS B 39 -16.714 8.011 -4.553 1.00 0.60 H new ATOM 0 HD3 LYS B 39 -17.996 8.257 -3.384 1.00 0.60 H new ATOM 0 HE2 LYS B 39 -17.797 10.341 -4.508 1.00 0.70 H new ATOM 0 HE3 LYS B 39 -17.007 10.590 -2.964 1.00 0.70 H new ATOM 0 HZ1 LYS B 39 -15.698 11.498 -4.775 1.00 0.81 H new ATOM 0 HZ2 LYS B 39 -14.856 10.222 -4.036 1.00 0.81 H new ATOM 0 HZ3 LYS B 39 -15.621 9.980 -5.532 1.00 0.81 H new ATOM 2257 N GLU B 40 -16.650 5.663 0.731 1.00 0.35 N ATOM 2258 CA GLU B 40 -17.309 5.871 2.037 1.00 0.38 C ATOM 2259 C GLU B 40 -16.303 5.716 3.191 1.00 0.38 C ATOM 2260 O GLU B 40 -16.390 6.440 4.184 1.00 0.41 O ATOM 2261 CB GLU B 40 -18.492 4.898 2.223 1.00 0.43 C ATOM 2262 CG GLU B 40 -19.677 5.184 1.303 1.00 0.47 C ATOM 2263 CD GLU B 40 -20.881 4.302 1.592 1.00 0.56 C ATOM 2264 OE1 GLU B 40 -21.694 4.676 2.461 1.00 0.69 O ATOM 2265 OE2 GLU B 40 -21.010 3.239 0.946 1.00 0.63 O ATOM 0 H GLU B 40 -16.942 4.812 0.251 1.00 0.35 H new ATOM 0 HA GLU B 40 -17.698 6.889 2.053 1.00 0.38 H new ATOM 0 HB2 GLU B 40 -18.144 3.880 2.046 1.00 0.43 H new ATOM 0 HB3 GLU B 40 -18.829 4.944 3.259 1.00 0.43 H new ATOM 0 HG2 GLU B 40 -19.966 6.230 1.407 1.00 0.47 H new ATOM 0 HG3 GLU B 40 -19.369 5.040 0.267 1.00 0.47 H new ATOM 2272 N LEU B 41 -15.344 4.773 3.048 1.00 0.37 N ATOM 2273 CA LEU B 41 -14.298 4.541 4.069 1.00 0.40 C ATOM 2274 C LEU B 41 -13.361 5.762 4.171 1.00 0.38 C ATOM 2275 O LEU B 41 -12.887 6.092 5.261 1.00 0.40 O ATOM 2276 CB LEU B 41 -13.490 3.268 3.727 1.00 0.44 C ATOM 2277 CG LEU B 41 -12.417 2.832 4.755 1.00 0.55 C ATOM 2278 CD1 LEU B 41 -13.056 2.322 6.051 1.00 0.68 C ATOM 2279 CD2 LEU B 41 -11.493 1.771 4.148 1.00 0.64 C ATOM 0 H LEU B 41 -15.273 4.161 2.235 1.00 0.37 H new ATOM 0 HA LEU B 41 -14.782 4.398 5.035 1.00 0.40 H new ATOM 0 HB2 LEU B 41 -14.191 2.444 3.596 1.00 0.44 H new ATOM 0 HB3 LEU B 41 -12.999 3.424 2.767 1.00 0.44 H new ATOM 0 HG LEU B 41 -11.820 3.708 5.007 1.00 0.55 H new ATOM 0 HD11 LEU B 41 -12.274 2.025 6.750 1.00 0.68 H new ATOM 0 HD12 LEU B 41 -13.658 3.114 6.496 1.00 0.68 H new ATOM 0 HD13 LEU B 41 -13.691 1.464 5.830 1.00 0.68 H new ATOM 0 HD21 LEU B 41 -10.745 1.476 4.884 1.00 0.64 H new ATOM 0 HD22 LEU B 41 -12.080 0.900 3.858 1.00 0.64 H new ATOM 0 HD23 LEU B 41 -10.995 2.182 3.269 1.00 0.64 H new ATOM 2291 N VAL B 42 -13.102 6.416 3.019 1.00 0.37 N ATOM 2292 CA VAL B 42 -12.251 7.617 2.949 1.00 0.38 C ATOM 2293 C VAL B 42 -12.970 8.846 3.559 1.00 0.39 C ATOM 2294 O VAL B 42 -12.306 9.740 4.084 1.00 0.43 O ATOM 2295 CB VAL B 42 -11.808 7.897 1.468 1.00 0.43 C ATOM 2296 CG1 VAL B 42 -11.126 9.262 1.302 1.00 0.48 C ATOM 2297 CG2 VAL B 42 -10.878 6.785 0.969 1.00 0.47 C ATOM 0 H VAL B 42 -13.477 6.126 2.116 1.00 0.37 H new ATOM 0 HA VAL B 42 -11.354 7.432 3.541 1.00 0.38 H new ATOM 0 HB VAL B 42 -12.717 7.914 0.866 1.00 0.43 H new ATOM 0 HG11 VAL B 42 -10.841 9.402 0.259 1.00 0.48 H new ATOM 0 HG12 VAL B 42 -11.816 10.052 1.599 1.00 0.48 H new ATOM 0 HG13 VAL B 42 -10.236 9.303 1.930 1.00 0.48 H new ATOM 0 HG21 VAL B 42 -10.580 6.994 -0.059 1.00 0.47 H new ATOM 0 HG22 VAL B 42 -9.992 6.741 1.602 1.00 0.47 H new ATOM 0 HG23 VAL B 42 -11.400 5.829 1.008 1.00 0.47 H new ATOM 2307 N THR B 43 -14.319 8.879 3.494 1.00 0.38 N ATOM 2308 CA THR B 43 -15.108 10.001 4.047 1.00 0.42 C ATOM 2309 C THR B 43 -15.741 9.651 5.428 1.00 0.48 C ATOM 2310 O THR B 43 -16.612 10.387 5.908 1.00 0.83 O ATOM 2311 CB THR B 43 -16.231 10.434 3.045 1.00 0.44 C ATOM 2312 OG1 THR B 43 -15.781 10.272 1.685 1.00 0.46 O ATOM 2313 CG2 THR B 43 -16.664 11.890 3.255 1.00 0.49 C ATOM 0 H THR B 43 -14.882 8.144 3.066 1.00 0.38 H new ATOM 0 HA THR B 43 -14.416 10.830 4.197 1.00 0.42 H new ATOM 0 HB THR B 43 -17.089 9.790 3.236 1.00 0.44 H new ATOM 0 HG1 THR B 43 -15.749 9.318 1.462 1.00 0.46 H new ATOM 0 HG21 THR B 43 -17.444 12.145 2.538 1.00 0.49 H new ATOM 0 HG22 THR B 43 -17.048 12.013 4.268 1.00 0.49 H new ATOM 0 HG23 THR B 43 -15.808 12.549 3.109 1.00 0.49 H new ATOM 2321 N GLN B 44 -15.292 8.545 6.074 1.00 0.42 N ATOM 2322 CA GLN B 44 -15.833 8.127 7.387 1.00 0.44 C ATOM 2323 C GLN B 44 -14.718 7.709 8.372 1.00 0.44 C ATOM 2324 O GLN B 44 -14.746 8.123 9.534 1.00 0.50 O ATOM 2325 CB GLN B 44 -16.854 6.978 7.202 1.00 0.47 C ATOM 2326 CG GLN B 44 -17.887 6.869 8.325 1.00 0.58 C ATOM 2327 CD GLN B 44 -18.890 5.743 8.101 1.00 0.67 C ATOM 2328 OE1 GLN B 44 -19.913 5.940 7.448 1.00 0.91 O ATOM 2329 NE2 GLN B 44 -18.603 4.555 8.639 1.00 0.98 N ATOM 0 H GLN B 44 -14.563 7.933 5.708 1.00 0.42 H new ATOM 0 HA GLN B 44 -16.338 8.989 7.823 1.00 0.44 H new ATOM 0 HB2 GLN B 44 -17.376 7.120 6.256 1.00 0.47 H new ATOM 0 HB3 GLN B 44 -16.313 6.035 7.129 1.00 0.47 H new ATOM 0 HG2 GLN B 44 -17.371 6.707 9.272 1.00 0.58 H new ATOM 0 HG3 GLN B 44 -18.423 7.814 8.412 1.00 0.58 H new ATOM 0 HE21 GLN B 44 -17.744 4.432 9.174 1.00 0.98 H new ATOM 0 HE22 GLN B 44 -19.243 3.771 8.515 1.00 0.98 H new ATOM 2338 N GLN B 45 -13.747 6.887 7.913 1.00 0.42 N ATOM 2339 CA GLN B 45 -12.639 6.406 8.774 1.00 0.43 C ATOM 2340 C GLN B 45 -11.239 6.878 8.299 1.00 0.41 C ATOM 2341 O GLN B 45 -10.275 6.781 9.068 1.00 0.46 O ATOM 2342 CB GLN B 45 -12.683 4.866 8.856 1.00 0.47 C ATOM 2343 CG GLN B 45 -11.944 4.276 10.062 1.00 0.57 C ATOM 2344 CD GLN B 45 -12.317 2.822 10.333 1.00 0.62 C ATOM 2345 OE1 GLN B 45 -11.671 1.903 9.829 1.00 0.70 O ATOM 2346 NE2 GLN B 45 -13.365 2.601 11.133 1.00 0.73 N ATOM 0 H GLN B 45 -13.707 6.543 6.954 1.00 0.42 H new ATOM 0 HA GLN B 45 -12.789 6.844 9.761 1.00 0.43 H new ATOM 0 HB2 GLN B 45 -13.724 4.546 8.891 1.00 0.47 H new ATOM 0 HB3 GLN B 45 -12.253 4.453 7.944 1.00 0.47 H new ATOM 0 HG2 GLN B 45 -10.869 4.345 9.893 1.00 0.57 H new ATOM 0 HG3 GLN B 45 -12.166 4.874 10.946 1.00 0.57 H new ATOM 0 HE21 GLN B 45 -13.876 3.388 11.533 1.00 0.73 H new ATOM 0 HE22 GLN B 45 -13.653 1.646 11.344 1.00 0.73 H new ATOM 2355 N LEU B 46 -11.118 7.391 7.049 1.00 0.39 N ATOM 2356 CA LEU B 46 -9.819 7.858 6.507 1.00 0.38 C ATOM 2357 C LEU B 46 -9.899 9.298 5.896 1.00 0.38 C ATOM 2358 O LEU B 46 -9.241 9.561 4.880 1.00 0.41 O ATOM 2359 CB LEU B 46 -9.334 6.835 5.435 1.00 0.40 C ATOM 2360 CG LEU B 46 -7.818 6.519 5.421 1.00 0.41 C ATOM 2361 CD1 LEU B 46 -7.445 5.527 6.527 1.00 0.58 C ATOM 2362 CD2 LEU B 46 -7.389 5.982 4.049 1.00 0.62 C ATOM 0 H LEU B 46 -11.900 7.491 6.401 1.00 0.39 H new ATOM 0 HA LEU B 46 -9.107 7.918 7.330 1.00 0.38 H new ATOM 0 HB2 LEU B 46 -9.876 5.901 5.584 1.00 0.40 H new ATOM 0 HB3 LEU B 46 -9.613 7.213 4.451 1.00 0.40 H new ATOM 0 HG LEU B 46 -7.283 7.449 5.612 1.00 0.41 H new ATOM 0 HD11 LEU B 46 -6.374 5.326 6.490 1.00 0.58 H new ATOM 0 HD12 LEU B 46 -7.701 5.951 7.498 1.00 0.58 H new ATOM 0 HD13 LEU B 46 -7.994 4.597 6.381 1.00 0.58 H new ATOM 0 HD21 LEU B 46 -6.321 5.766 4.061 1.00 0.62 H new ATOM 0 HD22 LEU B 46 -7.941 5.069 3.827 1.00 0.62 H new ATOM 0 HD23 LEU B 46 -7.600 6.729 3.284 1.00 0.62 H new ATOM 2374 N PRO B 47 -10.663 10.278 6.505 1.00 0.40 N ATOM 2375 CA PRO B 47 -10.783 11.650 5.946 1.00 0.42 C ATOM 2376 C PRO B 47 -9.542 12.546 6.172 1.00 0.42 C ATOM 2377 O PRO B 47 -9.193 13.343 5.293 1.00 0.46 O ATOM 2378 CB PRO B 47 -12.010 12.210 6.679 1.00 0.48 C ATOM 2379 CG PRO B 47 -12.000 11.530 8.002 1.00 0.48 C ATOM 2380 CD PRO B 47 -11.464 10.144 7.754 1.00 0.44 C ATOM 0 HA PRO B 47 -10.874 11.627 4.860 1.00 0.42 H new ATOM 0 HB2 PRO B 47 -11.946 13.293 6.789 1.00 0.48 H new ATOM 0 HB3 PRO B 47 -12.929 11.999 6.132 1.00 0.48 H new ATOM 0 HG2 PRO B 47 -11.373 12.069 8.713 1.00 0.48 H new ATOM 0 HG3 PRO B 47 -13.003 11.490 8.427 1.00 0.48 H new ATOM 0 HD2 PRO B 47 -10.849 9.800 8.586 1.00 0.44 H new ATOM 0 HD3 PRO B 47 -12.271 9.421 7.634 1.00 0.44 H new ATOM 2388 N HIS B 48 -8.886 12.416 7.345 1.00 0.42 N ATOM 2389 CA HIS B 48 -7.690 13.227 7.685 1.00 0.44 C ATOM 2390 C HIS B 48 -6.449 12.824 6.857 1.00 0.43 C ATOM 2391 O HIS B 48 -5.539 13.644 6.678 1.00 0.49 O ATOM 2392 CB HIS B 48 -7.364 13.118 9.190 1.00 0.49 C ATOM 2393 CG HIS B 48 -8.454 13.618 10.095 1.00 0.56 C ATOM 2394 ND1 HIS B 48 -9.507 12.832 10.513 1.00 0.67 N ATOM 2395 CD2 HIS B 48 -8.646 14.832 10.665 1.00 0.70 C ATOM 2396 CE1 HIS B 48 -10.298 13.539 11.299 1.00 0.79 C ATOM 2397 NE2 HIS B 48 -9.797 14.753 11.408 1.00 0.81 N ATOM 0 H HIS B 48 -9.162 11.758 8.074 1.00 0.42 H new ATOM 0 HA HIS B 48 -7.935 14.260 7.438 1.00 0.44 H new ATOM 0 HB2 HIS B 48 -7.157 12.075 9.431 1.00 0.49 H new ATOM 0 HB3 HIS B 48 -6.452 13.679 9.394 1.00 0.49 H new ATOM 0 HD2 HIS B 48 -8.012 15.699 10.555 1.00 0.70 H new ATOM 0 HE1 HIS B 48 -11.201 13.183 11.772 1.00 0.79 H new ATOM 0 HE2 HIS B 48 -10.200 15.512 11.957 1.00 0.81 H new ATOM 2406 N LEU B 49 -6.412 11.567 6.357 1.00 0.41 N ATOM 2407 CA LEU B 49 -5.280 11.068 5.551 1.00 0.42 C ATOM 2408 C LEU B 49 -5.235 11.763 4.179 1.00 0.40 C ATOM 2409 O LEU B 49 -4.253 12.431 3.850 1.00 0.48 O ATOM 2410 CB LEU B 49 -5.375 9.532 5.379 1.00 0.43 C ATOM 2411 CG LEU B 49 -4.057 8.806 5.028 1.00 0.52 C ATOM 2412 CD1 LEU B 49 -3.076 8.850 6.203 1.00 0.88 C ATOM 2413 CD2 LEU B 49 -4.332 7.362 4.609 1.00 0.62 C ATOM 0 H LEU B 49 -7.154 10.882 6.499 1.00 0.41 H new ATOM 0 HA LEU B 49 -4.356 11.302 6.080 1.00 0.42 H new ATOM 0 HB2 LEU B 49 -5.766 9.107 6.303 1.00 0.43 H new ATOM 0 HB3 LEU B 49 -6.103 9.318 4.597 1.00 0.43 H new ATOM 0 HG LEU B 49 -3.599 9.327 4.187 1.00 0.52 H new ATOM 0 HD11 LEU B 49 -2.157 8.332 5.929 1.00 0.88 H new ATOM 0 HD12 LEU B 49 -2.848 9.887 6.448 1.00 0.88 H new ATOM 0 HD13 LEU B 49 -3.523 8.362 7.069 1.00 0.88 H new ATOM 0 HD21 LEU B 49 -3.391 6.868 4.366 1.00 0.62 H new ATOM 0 HD22 LEU B 49 -4.819 6.832 5.428 1.00 0.62 H new ATOM 0 HD23 LEU B 49 -4.982 7.355 3.734 1.00 0.62 H new ATOM 2425 N LEU B 50 -6.314 11.608 3.392 1.00 0.38 N ATOM 2426 CA LEU B 50 -6.416 12.222 2.066 1.00 0.41 C ATOM 2427 C LEU B 50 -7.103 13.586 2.194 1.00 0.45 C ATOM 2428 O LEU B 50 -8.308 13.652 2.463 1.00 0.52 O ATOM 2429 CB LEU B 50 -7.190 11.296 1.100 1.00 0.44 C ATOM 2430 CG LEU B 50 -6.603 9.873 0.911 1.00 0.51 C ATOM 2431 CD1 LEU B 50 -7.552 8.995 0.093 1.00 0.57 C ATOM 2432 CD2 LEU B 50 -5.218 9.927 0.255 1.00 0.70 C ATOM 0 H LEU B 50 -7.131 11.058 3.658 1.00 0.38 H new ATOM 0 HA LEU B 50 -5.418 12.368 1.653 1.00 0.41 H new ATOM 0 HB2 LEU B 50 -8.214 11.201 1.461 1.00 0.44 H new ATOM 0 HB3 LEU B 50 -7.240 11.780 0.125 1.00 0.44 H new ATOM 0 HG LEU B 50 -6.491 9.428 1.899 1.00 0.51 H new ATOM 0 HD11 LEU B 50 -7.118 8.002 -0.026 1.00 0.57 H new ATOM 0 HD12 LEU B 50 -8.508 8.913 0.610 1.00 0.57 H new ATOM 0 HD13 LEU B 50 -7.707 9.443 -0.889 1.00 0.57 H new ATOM 0 HD21 LEU B 50 -4.832 8.915 0.136 1.00 0.70 H new ATOM 0 HD22 LEU B 50 -5.297 10.403 -0.722 1.00 0.70 H new ATOM 0 HD23 LEU B 50 -4.539 10.502 0.885 1.00 0.70 H new ATOM 2444 N LYS B 51 -6.317 14.675 2.017 1.00 0.50 N ATOM 2445 CA LYS B 51 -6.826 16.065 2.129 1.00 0.58 C ATOM 2446 C LYS B 51 -8.073 16.315 1.254 1.00 0.53 C ATOM 2447 O LYS B 51 -8.984 17.032 1.678 1.00 0.61 O ATOM 2448 CB LYS B 51 -5.712 17.099 1.812 1.00 0.68 C ATOM 2449 CG LYS B 51 -5.062 16.969 0.422 1.00 0.72 C ATOM 2450 CD LYS B 51 -3.894 17.948 0.242 1.00 1.06 C ATOM 2451 CE LYS B 51 -3.168 17.769 -1.096 1.00 1.03 C ATOM 2452 NZ LYS B 51 -3.895 18.394 -2.242 1.00 1.23 N ATOM 0 H LYS B 51 -5.323 14.618 1.795 1.00 0.50 H new ATOM 0 HA LYS B 51 -7.135 16.198 3.166 1.00 0.58 H new ATOM 0 HB2 LYS B 51 -6.133 18.100 1.905 1.00 0.68 H new ATOM 0 HB3 LYS B 51 -4.932 17.010 2.568 1.00 0.68 H new ATOM 0 HG2 LYS B 51 -4.705 15.949 0.282 1.00 0.72 H new ATOM 0 HG3 LYS B 51 -5.812 17.153 -0.348 1.00 0.72 H new ATOM 0 HD2 LYS B 51 -4.268 18.969 0.313 1.00 1.06 H new ATOM 0 HD3 LYS B 51 -3.183 17.812 1.057 1.00 1.06 H new ATOM 0 HE2 LYS B 51 -2.172 18.205 -1.024 1.00 1.03 H new ATOM 0 HE3 LYS B 51 -3.037 16.705 -1.293 1.00 1.03 H new ATOM 0 HZ1 LYS B 51 -3.422 18.141 -3.133 1.00 1.23 H new ATOM 0 HZ2 LYS B 51 -4.876 18.049 -2.261 1.00 1.23 H new ATOM 0 HZ3 LYS B 51 -3.894 19.428 -2.131 1.00 1.23 H new ATOM 2466 N ASP B 52 -8.112 15.710 0.051 1.00 0.48 N ATOM 2467 CA ASP B 52 -9.249 15.865 -0.873 1.00 0.54 C ATOM 2468 C ASP B 52 -10.212 14.656 -0.791 1.00 0.48 C ATOM 2469 O ASP B 52 -10.123 13.728 -1.604 1.00 0.60 O ATOM 2470 CB ASP B 52 -8.743 16.059 -2.322 1.00 0.69 C ATOM 2471 CG ASP B 52 -8.173 17.445 -2.576 1.00 1.20 C ATOM 2472 OD1 ASP B 52 -8.968 18.395 -2.730 1.00 1.78 O ATOM 2473 OD2 ASP B 52 -6.931 17.578 -2.621 1.00 1.94 O ATOM 0 H ASP B 52 -7.368 15.109 -0.303 1.00 0.48 H new ATOM 0 HA ASP B 52 -9.805 16.753 -0.574 1.00 0.54 H new ATOM 0 HB2 ASP B 52 -7.977 15.313 -2.536 1.00 0.69 H new ATOM 0 HB3 ASP B 52 -9.565 15.879 -3.014 1.00 0.69 H new ATOM 2478 N VAL B 53 -11.123 14.666 0.212 1.00 0.44 N ATOM 2479 CA VAL B 53 -12.134 13.583 0.381 1.00 0.45 C ATOM 2480 C VAL B 53 -13.206 13.618 -0.735 1.00 0.46 C ATOM 2481 O VAL B 53 -13.730 12.567 -1.118 1.00 0.57 O ATOM 2482 CB VAL B 53 -12.853 13.603 1.780 1.00 0.53 C ATOM 2483 CG1 VAL B 53 -11.896 13.172 2.889 1.00 0.60 C ATOM 2484 CG2 VAL B 53 -13.473 14.971 2.104 1.00 0.58 C ATOM 0 H VAL B 53 -11.182 15.404 0.914 1.00 0.44 H new ATOM 0 HA VAL B 53 -11.561 12.658 0.314 1.00 0.45 H new ATOM 0 HB VAL B 53 -13.672 12.886 1.722 1.00 0.53 H new ATOM 0 HG11 VAL B 53 -12.416 13.194 3.847 1.00 0.60 H new ATOM 0 HG12 VAL B 53 -11.542 12.160 2.691 1.00 0.60 H new ATOM 0 HG13 VAL B 53 -11.046 13.854 2.922 1.00 0.60 H new ATOM 0 HG21 VAL B 53 -13.956 14.929 3.080 1.00 0.58 H new ATOM 0 HG22 VAL B 53 -12.691 15.731 2.118 1.00 0.58 H new ATOM 0 HG23 VAL B 53 -14.212 15.225 1.344 1.00 0.58 H new ATOM 2494 N GLY B 54 -13.533 14.829 -1.235 1.00 0.44 N ATOM 2495 CA GLY B 54 -14.524 14.982 -2.301 1.00 0.51 C ATOM 2496 C GLY B 54 -13.932 14.734 -3.687 1.00 0.51 C ATOM 2497 O GLY B 54 -14.559 14.060 -4.511 1.00 0.67 O ATOM 0 H GLY B 54 -13.123 15.706 -0.914 1.00 0.44 H new ATOM 0 HA2 GLY B 54 -15.347 14.287 -2.131 1.00 0.51 H new ATOM 0 HA3 GLY B 54 -14.943 15.988 -2.262 1.00 0.51 H new ATOM 2501 N SER B 55 -12.723 15.279 -3.943 1.00 0.51 N ATOM 2502 CA SER B 55 -12.036 15.097 -5.232 1.00 0.57 C ATOM 2503 C SER B 55 -11.204 13.804 -5.207 1.00 0.52 C ATOM 2504 O SER B 55 -9.980 13.834 -5.016 1.00 0.63 O ATOM 2505 CB SER B 55 -11.162 16.325 -5.560 1.00 0.74 C ATOM 2506 OG SER B 55 -10.505 16.174 -6.809 1.00 0.92 O ATOM 0 H SER B 55 -12.206 15.847 -3.272 1.00 0.51 H new ATOM 0 HA SER B 55 -12.781 15.005 -6.022 1.00 0.57 H new ATOM 0 HB2 SER B 55 -11.783 17.221 -5.580 1.00 0.74 H new ATOM 0 HB3 SER B 55 -10.422 16.468 -4.773 1.00 0.74 H new ATOM 0 HG SER B 55 -9.960 16.968 -6.990 1.00 0.92 H new ATOM 2512 N LEU B 56 -11.904 12.668 -5.377 1.00 0.47 N ATOM 2513 CA LEU B 56 -11.289 11.330 -5.390 1.00 0.47 C ATOM 2514 C LEU B 56 -11.384 10.700 -6.808 1.00 0.48 C ATOM 2515 O LEU B 56 -11.055 9.525 -6.980 1.00 0.81 O ATOM 2516 CB LEU B 56 -11.989 10.420 -4.331 1.00 0.58 C ATOM 2517 CG LEU B 56 -11.085 9.715 -3.278 1.00 0.75 C ATOM 2518 CD1 LEU B 56 -10.051 8.797 -3.935 1.00 1.09 C ATOM 2519 CD2 LEU B 56 -10.409 10.728 -2.345 1.00 1.24 C ATOM 0 H LEU B 56 -12.915 12.653 -5.510 1.00 0.47 H new ATOM 0 HA LEU B 56 -10.233 11.420 -5.133 1.00 0.47 H new ATOM 0 HB2 LEU B 56 -12.718 11.028 -3.795 1.00 0.58 H new ATOM 0 HB3 LEU B 56 -12.546 9.650 -4.865 1.00 0.58 H new ATOM 0 HG LEU B 56 -11.738 9.088 -2.671 1.00 0.75 H new ATOM 0 HD11 LEU B 56 -9.441 8.325 -3.164 1.00 1.09 H new ATOM 0 HD12 LEU B 56 -10.563 8.028 -4.514 1.00 1.09 H new ATOM 0 HD13 LEU B 56 -9.412 9.383 -4.595 1.00 1.09 H new ATOM 0 HD21 LEU B 56 -9.786 10.199 -1.624 1.00 1.24 H new ATOM 0 HD22 LEU B 56 -9.789 11.406 -2.932 1.00 1.24 H new ATOM 0 HD23 LEU B 56 -11.171 11.300 -1.816 1.00 1.24 H new ATOM 2531 N ASP B 57 -11.812 11.499 -7.824 1.00 0.48 N ATOM 2532 CA ASP B 57 -11.956 11.010 -9.216 1.00 0.49 C ATOM 2533 C ASP B 57 -10.592 10.819 -9.903 1.00 0.44 C ATOM 2534 O ASP B 57 -10.435 9.890 -10.702 1.00 0.46 O ATOM 2535 CB ASP B 57 -12.855 11.952 -10.053 1.00 0.60 C ATOM 2536 CG ASP B 57 -12.319 13.376 -10.179 1.00 0.64 C ATOM 2537 OD1 ASP B 57 -12.503 14.170 -9.231 1.00 0.73 O ATOM 2538 OD2 ASP B 57 -11.716 13.692 -11.227 1.00 0.69 O ATOM 0 H ASP B 57 -12.061 12.480 -7.701 1.00 0.48 H new ATOM 0 HA ASP B 57 -12.438 10.034 -9.158 1.00 0.49 H new ATOM 0 HB2 ASP B 57 -12.974 11.531 -11.051 1.00 0.60 H new ATOM 0 HB3 ASP B 57 -13.846 11.987 -9.601 1.00 0.60 H new ATOM 2543 N GLU B 58 -9.605 11.692 -9.587 1.00 0.45 N ATOM 2544 CA GLU B 58 -8.248 11.596 -10.172 1.00 0.50 C ATOM 2545 C GLU B 58 -7.577 10.250 -9.799 1.00 0.47 C ATOM 2546 O GLU B 58 -6.842 9.673 -10.608 1.00 0.57 O ATOM 2547 CB GLU B 58 -7.373 12.786 -9.714 1.00 0.59 C ATOM 2548 CG GLU B 58 -6.100 12.989 -10.541 1.00 0.73 C ATOM 2549 CD GLU B 58 -5.264 14.163 -10.067 1.00 0.92 C ATOM 2550 OE1 GLU B 58 -4.404 13.965 -9.182 1.00 1.06 O ATOM 2551 OE2 GLU B 58 -5.466 15.284 -10.581 1.00 1.10 O ATOM 0 H GLU B 58 -9.723 12.466 -8.934 1.00 0.45 H new ATOM 0 HA GLU B 58 -8.344 11.636 -11.257 1.00 0.50 H new ATOM 0 HB2 GLU B 58 -7.969 13.698 -9.757 1.00 0.59 H new ATOM 0 HB3 GLU B 58 -7.094 12.636 -8.671 1.00 0.59 H new ATOM 0 HG2 GLU B 58 -5.498 12.081 -10.499 1.00 0.73 H new ATOM 0 HG3 GLU B 58 -6.373 13.143 -11.585 1.00 0.73 H new ATOM 2558 N LYS B 59 -7.851 9.766 -8.569 1.00 0.43 N ATOM 2559 CA LYS B 59 -7.314 8.488 -8.069 1.00 0.48 C ATOM 2560 C LYS B 59 -8.248 7.303 -8.421 1.00 0.54 C ATOM 2561 O LYS B 59 -7.767 6.184 -8.593 1.00 0.91 O ATOM 2562 CB LYS B 59 -7.108 8.548 -6.534 1.00 0.52 C ATOM 2563 CG LYS B 59 -5.810 9.229 -6.066 1.00 0.59 C ATOM 2564 CD LYS B 59 -5.818 10.761 -6.209 1.00 0.79 C ATOM 2565 CE LYS B 59 -6.785 11.443 -5.233 1.00 1.19 C ATOM 2566 NZ LYS B 59 -6.566 12.920 -5.150 1.00 1.47 N ATOM 0 H LYS B 59 -8.449 10.250 -7.899 1.00 0.43 H new ATOM 0 HA LYS B 59 -6.353 8.325 -8.557 1.00 0.48 H new ATOM 0 HB2 LYS B 59 -7.954 9.074 -6.092 1.00 0.52 H new ATOM 0 HB3 LYS B 59 -7.126 7.531 -6.143 1.00 0.52 H new ATOM 0 HG2 LYS B 59 -5.634 8.973 -5.021 1.00 0.59 H new ATOM 0 HG3 LYS B 59 -4.974 8.826 -6.638 1.00 0.59 H new ATOM 0 HD2 LYS B 59 -4.811 11.142 -6.042 1.00 0.79 H new ATOM 0 HD3 LYS B 59 -6.093 11.025 -7.230 1.00 0.79 H new ATOM 0 HE2 LYS B 59 -7.811 11.248 -5.546 1.00 1.19 H new ATOM 0 HE3 LYS B 59 -6.666 11.005 -4.242 1.00 1.19 H new ATOM 0 HZ1 LYS B 59 -7.243 13.334 -4.478 1.00 1.47 H new ATOM 0 HZ2 LYS B 59 -5.596 13.109 -4.825 1.00 1.47 H new ATOM 0 HZ3 LYS B 59 -6.706 13.345 -6.089 1.00 1.47 H new ATOM 2580 N MET B 60 -9.581 7.555 -8.529 1.00 0.40 N ATOM 2581 CA MET B 60 -10.575 6.492 -8.842 1.00 0.43 C ATOM 2582 C MET B 60 -10.377 5.889 -10.251 1.00 0.45 C ATOM 2583 O MET B 60 -10.488 4.668 -10.411 1.00 0.49 O ATOM 2584 CB MET B 60 -12.021 7.022 -8.679 1.00 0.47 C ATOM 2585 CG MET B 60 -13.115 5.950 -8.791 1.00 0.55 C ATOM 2586 SD MET B 60 -14.732 6.511 -8.201 1.00 0.67 S ATOM 2587 CE MET B 60 -15.340 7.426 -9.618 1.00 0.81 C ATOM 0 H MET B 60 -9.990 8.481 -8.404 1.00 0.40 H new ATOM 0 HA MET B 60 -10.409 5.689 -8.124 1.00 0.43 H new ATOM 0 HB2 MET B 60 -12.107 7.509 -7.708 1.00 0.47 H new ATOM 0 HB3 MET B 60 -12.201 7.785 -9.436 1.00 0.47 H new ATOM 0 HG2 MET B 60 -13.204 5.639 -9.832 1.00 0.55 H new ATOM 0 HG3 MET B 60 -12.813 5.072 -8.221 1.00 0.55 H new ATOM 0 HE1 MET B 60 -16.328 7.828 -9.395 1.00 0.81 H new ATOM 0 HE2 MET B 60 -14.657 8.245 -9.842 1.00 0.81 H new ATOM 0 HE3 MET B 60 -15.405 6.762 -10.480 1.00 0.81 H new ATOM 2597 N LYS B 61 -10.089 6.732 -11.267 1.00 0.47 N ATOM 2598 CA LYS B 61 -9.876 6.239 -12.647 1.00 0.53 C ATOM 2599 C LYS B 61 -8.570 5.429 -12.733 1.00 0.48 C ATOM 2600 O LYS B 61 -8.539 4.373 -13.375 1.00 0.52 O ATOM 2601 CB LYS B 61 -9.894 7.399 -13.667 1.00 0.63 C ATOM 2602 CG LYS B 61 -11.298 7.978 -13.894 1.00 0.78 C ATOM 2603 CD LYS B 61 -11.306 9.240 -14.767 1.00 1.13 C ATOM 2604 CE LYS B 61 -10.759 10.468 -14.031 1.00 1.87 C ATOM 2605 NZ LYS B 61 -10.957 11.730 -14.804 1.00 2.39 N ATOM 0 H LYS B 61 -9.999 7.743 -11.161 1.00 0.47 H new ATOM 0 HA LYS B 61 -10.701 5.575 -12.904 1.00 0.53 H new ATOM 0 HB2 LYS B 61 -9.232 8.192 -13.319 1.00 0.63 H new ATOM 0 HB3 LYS B 61 -9.495 7.046 -14.618 1.00 0.63 H new ATOM 0 HG2 LYS B 61 -11.924 7.218 -14.362 1.00 0.78 H new ATOM 0 HG3 LYS B 61 -11.747 8.211 -12.928 1.00 0.78 H new ATOM 0 HD2 LYS B 61 -10.710 9.062 -15.662 1.00 1.13 H new ATOM 0 HD3 LYS B 61 -12.325 9.443 -15.097 1.00 1.13 H new ATOM 0 HE2 LYS B 61 -11.252 10.557 -13.063 1.00 1.87 H new ATOM 0 HE3 LYS B 61 -9.696 10.328 -13.836 1.00 1.87 H new ATOM 0 HZ1 LYS B 61 -10.571 12.531 -14.265 1.00 2.39 H new ATOM 0 HZ2 LYS B 61 -10.465 11.658 -15.718 1.00 2.39 H new ATOM 0 HZ3 LYS B 61 -11.973 11.881 -14.968 1.00 2.39 H new ATOM 2619 N SER B 62 -7.496 5.924 -12.075 1.00 0.46 N ATOM 2620 CA SER B 62 -6.202 5.213 -12.021 1.00 0.47 C ATOM 2621 C SER B 62 -6.342 3.900 -11.219 1.00 0.44 C ATOM 2622 O SER B 62 -5.751 2.878 -11.584 1.00 0.50 O ATOM 2623 CB SER B 62 -5.118 6.104 -11.391 1.00 0.54 C ATOM 2624 OG SER B 62 -4.939 7.296 -12.140 1.00 0.63 O ATOM 0 H SER B 62 -7.502 6.813 -11.575 1.00 0.46 H new ATOM 0 HA SER B 62 -5.903 4.972 -13.041 1.00 0.47 H new ATOM 0 HB2 SER B 62 -5.397 6.352 -10.367 1.00 0.54 H new ATOM 0 HB3 SER B 62 -4.177 5.557 -11.341 1.00 0.54 H new ATOM 0 HG SER B 62 -4.246 7.846 -11.719 1.00 0.63 H new ATOM 2630 N LEU B 63 -7.142 3.952 -10.123 1.00 0.41 N ATOM 2631 CA LEU B 63 -7.424 2.780 -9.261 1.00 0.44 C ATOM 2632 C LEU B 63 -8.112 1.664 -10.066 1.00 0.47 C ATOM 2633 O LEU B 63 -7.784 0.489 -9.898 1.00 0.57 O ATOM 2634 CB LEU B 63 -8.324 3.191 -8.062 1.00 0.45 C ATOM 2635 CG LEU B 63 -7.589 3.675 -6.789 1.00 0.42 C ATOM 2636 CD1 LEU B 63 -8.527 4.488 -5.889 1.00 0.47 C ATOM 2637 CD2 LEU B 63 -7.008 2.484 -6.024 1.00 0.69 C ATOM 0 H LEU B 63 -7.607 4.806 -9.815 1.00 0.41 H new ATOM 0 HA LEU B 63 -6.473 2.405 -8.882 1.00 0.44 H new ATOM 0 HB2 LEU B 63 -8.994 3.984 -8.393 1.00 0.45 H new ATOM 0 HB3 LEU B 63 -8.948 2.338 -7.794 1.00 0.45 H new ATOM 0 HG LEU B 63 -6.770 4.325 -7.095 1.00 0.42 H new ATOM 0 HD11 LEU B 63 -7.986 4.816 -5.002 1.00 0.47 H new ATOM 0 HD12 LEU B 63 -8.891 5.359 -6.435 1.00 0.47 H new ATOM 0 HD13 LEU B 63 -9.372 3.868 -5.590 1.00 0.47 H new ATOM 0 HD21 LEU B 63 -6.494 2.841 -5.131 1.00 0.69 H new ATOM 0 HD22 LEU B 63 -7.814 1.810 -5.734 1.00 0.69 H new ATOM 0 HD23 LEU B 63 -6.301 1.952 -6.661 1.00 0.69 H new ATOM 2649 N ASP B 64 -9.071 2.054 -10.934 1.00 0.47 N ATOM 2650 CA ASP B 64 -9.819 1.114 -11.778 1.00 0.55 C ATOM 2651 C ASP B 64 -9.352 1.221 -13.245 1.00 0.53 C ATOM 2652 O ASP B 64 -10.119 1.627 -14.129 1.00 0.60 O ATOM 2653 CB ASP B 64 -11.337 1.389 -11.635 1.00 0.66 C ATOM 2654 CG ASP B 64 -12.220 0.331 -12.288 1.00 0.85 C ATOM 2655 OD1 ASP B 64 -12.027 -0.869 -11.999 1.00 1.27 O ATOM 2656 OD2 ASP B 64 -13.113 0.707 -13.079 1.00 1.32 O ATOM 0 H ASP B 64 -9.343 3.028 -11.064 1.00 0.47 H new ATOM 0 HA ASP B 64 -9.626 0.092 -11.452 1.00 0.55 H new ATOM 0 HB2 ASP B 64 -11.587 1.453 -10.576 1.00 0.66 H new ATOM 0 HB3 ASP B 64 -11.564 2.360 -12.076 1.00 0.66 H new ATOM 2661 N VAL B 65 -8.073 0.865 -13.492 1.00 0.53 N ATOM 2662 CA VAL B 65 -7.491 0.900 -14.852 1.00 0.56 C ATOM 2663 C VAL B 65 -7.922 -0.341 -15.676 1.00 0.56 C ATOM 2664 O VAL B 65 -7.973 -0.279 -16.908 1.00 0.61 O ATOM 2665 CB VAL B 65 -5.925 1.044 -14.817 1.00 0.64 C ATOM 2666 CG1 VAL B 65 -5.223 -0.213 -14.278 1.00 0.68 C ATOM 2667 CG2 VAL B 65 -5.367 1.440 -16.196 1.00 0.72 C ATOM 0 H VAL B 65 -7.425 0.551 -12.770 1.00 0.53 H new ATOM 0 HA VAL B 65 -7.884 1.787 -15.349 1.00 0.56 H new ATOM 0 HB VAL B 65 -5.707 1.850 -14.116 1.00 0.64 H new ATOM 0 HG11 VAL B 65 -4.144 -0.055 -14.277 1.00 0.68 H new ATOM 0 HG12 VAL B 65 -5.562 -0.411 -13.261 1.00 0.68 H new ATOM 0 HG13 VAL B 65 -5.464 -1.065 -14.913 1.00 0.68 H new ATOM 0 HG21 VAL B 65 -4.282 1.531 -16.137 1.00 0.72 H new ATOM 0 HG22 VAL B 65 -5.628 0.675 -16.927 1.00 0.72 H new ATOM 0 HG23 VAL B 65 -5.795 2.395 -16.501 1.00 0.72 H new ATOM 2677 N ASN B 66 -8.237 -1.455 -14.976 1.00 0.56 N ATOM 2678 CA ASN B 66 -8.680 -2.710 -15.616 1.00 0.60 C ATOM 2679 C ASN B 66 -10.095 -2.564 -16.237 1.00 0.61 C ATOM 2680 O ASN B 66 -10.414 -3.255 -17.208 1.00 0.68 O ATOM 2681 CB ASN B 66 -8.648 -3.860 -14.584 1.00 0.65 C ATOM 2682 CG ASN B 66 -8.536 -5.242 -15.223 1.00 0.90 C ATOM 2683 OD1 ASN B 66 -7.433 -5.716 -15.500 1.00 1.38 O ATOM 2684 ND2 ASN B 66 -9.672 -5.898 -15.458 1.00 1.32 N ATOM 0 H ASN B 66 -8.191 -1.507 -13.958 1.00 0.56 H new ATOM 0 HA ASN B 66 -7.994 -2.942 -16.430 1.00 0.60 H new ATOM 0 HB2 ASN B 66 -7.805 -3.710 -13.909 1.00 0.65 H new ATOM 0 HB3 ASN B 66 -9.553 -3.820 -13.978 1.00 0.65 H new ATOM 0 HD21 ASN B 66 -9.647 -6.826 -15.881 1.00 1.32 H new ATOM 0 HD22 ASN B 66 -10.566 -5.472 -15.215 1.00 1.32 H new ATOM 2691 N GLN B 67 -10.934 -1.665 -15.655 1.00 0.59 N ATOM 2692 CA GLN B 67 -12.313 -1.379 -16.125 1.00 0.64 C ATOM 2693 C GLN B 67 -13.250 -2.600 -15.991 1.00 0.64 C ATOM 2694 O GLN B 67 -13.584 -3.258 -16.986 1.00 0.77 O ATOM 2695 CB GLN B 67 -12.327 -0.818 -17.575 1.00 0.75 C ATOM 2696 CG GLN B 67 -11.674 0.565 -17.731 1.00 0.96 C ATOM 2697 CD GLN B 67 -12.587 1.601 -18.383 1.00 1.28 C ATOM 2698 OE1 GLN B 67 -13.316 2.319 -17.694 1.00 2.02 O ATOM 2699 NE2 GLN B 67 -12.559 1.684 -19.715 1.00 1.87 N ATOM 0 H GLN B 67 -10.667 -1.115 -14.839 1.00 0.59 H new ATOM 0 HA GLN B 67 -12.703 -0.604 -15.466 1.00 0.64 H new ATOM 0 HB2 GLN B 67 -11.814 -1.523 -18.229 1.00 0.75 H new ATOM 0 HB3 GLN B 67 -13.360 -0.759 -17.918 1.00 0.75 H new ATOM 0 HG2 GLN B 67 -11.370 0.927 -16.749 1.00 0.96 H new ATOM 0 HG3 GLN B 67 -10.768 0.465 -18.328 1.00 0.96 H new ATOM 0 HE21 GLN B 67 -11.943 1.073 -20.251 1.00 1.87 H new ATOM 0 HE22 GLN B 67 -13.154 2.358 -20.197 1.00 1.87 H new ATOM 2708 N ASP B 68 -13.647 -2.913 -14.738 1.00 0.65 N ATOM 2709 CA ASP B 68 -14.575 -4.028 -14.447 1.00 0.72 C ATOM 2710 C ASP B 68 -15.400 -3.785 -13.146 1.00 0.79 C ATOM 2711 O ASP B 68 -16.012 -4.723 -12.624 1.00 1.30 O ATOM 2712 CB ASP B 68 -13.782 -5.356 -14.354 1.00 0.76 C ATOM 2713 CG ASP B 68 -14.633 -6.580 -14.661 1.00 0.97 C ATOM 2714 OD1 ASP B 68 -14.762 -6.927 -15.855 1.00 1.16 O ATOM 2715 OD2 ASP B 68 -15.170 -7.188 -13.710 1.00 1.25 O ATOM 0 H ASP B 68 -13.337 -2.406 -13.909 1.00 0.65 H new ATOM 0 HA ASP B 68 -15.291 -4.090 -15.266 1.00 0.72 H new ATOM 0 HB2 ASP B 68 -12.942 -5.321 -15.048 1.00 0.76 H new ATOM 0 HB3 ASP B 68 -13.363 -5.453 -13.352 1.00 0.76 H new ATOM 2720 N SER B 69 -15.436 -2.517 -12.641 1.00 0.66 N ATOM 2721 CA SER B 69 -16.169 -2.141 -11.403 1.00 0.71 C ATOM 2722 C SER B 69 -15.715 -2.954 -10.163 1.00 0.71 C ATOM 2723 O SER B 69 -16.499 -3.158 -9.229 1.00 1.26 O ATOM 2724 CB SER B 69 -17.694 -2.263 -11.614 1.00 0.86 C ATOM 2725 OG SER B 69 -18.412 -1.649 -10.550 1.00 1.35 O ATOM 0 H SER B 69 -14.958 -1.732 -13.083 1.00 0.66 H new ATOM 0 HA SER B 69 -15.923 -1.099 -11.197 1.00 0.71 H new ATOM 0 HB2 SER B 69 -17.971 -1.797 -12.560 1.00 0.86 H new ATOM 0 HB3 SER B 69 -17.971 -3.315 -11.684 1.00 0.86 H new ATOM 0 HG SER B 69 -18.002 -1.894 -9.694 1.00 1.35 H new ATOM 2731 N GLU B 70 -14.436 -3.391 -10.147 1.00 0.69 N ATOM 2732 CA GLU B 70 -13.877 -4.172 -9.029 1.00 0.75 C ATOM 2733 C GLU B 70 -12.461 -3.683 -8.701 1.00 0.62 C ATOM 2734 O GLU B 70 -11.589 -3.676 -9.579 1.00 0.78 O ATOM 2735 CB GLU B 70 -13.858 -5.676 -9.368 1.00 1.11 C ATOM 2736 CG GLU B 70 -15.247 -6.290 -9.551 1.00 1.39 C ATOM 2737 CD GLU B 70 -15.211 -7.746 -9.987 1.00 1.87 C ATOM 2738 OE1 GLU B 70 -14.540 -8.053 -10.997 1.00 2.37 O ATOM 2739 OE2 GLU B 70 -15.863 -8.577 -9.322 1.00 2.40 O ATOM 0 H GLU B 70 -13.772 -3.213 -10.901 1.00 0.69 H new ATOM 0 HA GLU B 70 -14.513 -4.027 -8.155 1.00 0.75 H new ATOM 0 HB2 GLU B 70 -13.283 -5.825 -10.282 1.00 1.11 H new ATOM 0 HB3 GLU B 70 -13.337 -6.211 -8.573 1.00 1.11 H new ATOM 0 HG2 GLU B 70 -15.797 -6.213 -8.613 1.00 1.39 H new ATOM 0 HG3 GLU B 70 -15.798 -5.710 -10.292 1.00 1.39 H new ATOM 2746 N LEU B 71 -12.236 -3.274 -7.435 1.00 0.54 N ATOM 2747 CA LEU B 71 -10.930 -2.761 -6.989 1.00 0.51 C ATOM 2748 C LEU B 71 -10.144 -3.840 -6.228 1.00 0.50 C ATOM 2749 O LEU B 71 -10.072 -3.817 -4.992 1.00 0.52 O ATOM 2750 CB LEU B 71 -11.108 -1.493 -6.107 1.00 0.58 C ATOM 2751 CG LEU B 71 -11.491 -0.179 -6.837 1.00 0.78 C ATOM 2752 CD1 LEU B 71 -12.804 -0.315 -7.617 1.00 1.13 C ATOM 2753 CD2 LEU B 71 -11.592 0.979 -5.840 1.00 0.92 C ATOM 0 H LEU B 71 -12.947 -3.291 -6.704 1.00 0.54 H new ATOM 0 HA LEU B 71 -10.358 -2.487 -7.875 1.00 0.51 H new ATOM 0 HB2 LEU B 71 -11.875 -1.703 -5.362 1.00 0.58 H new ATOM 0 HB3 LEU B 71 -10.177 -1.322 -5.567 1.00 0.58 H new ATOM 0 HG LEU B 71 -10.699 0.032 -7.556 1.00 0.78 H new ATOM 0 HD11 LEU B 71 -13.033 0.629 -8.112 1.00 1.13 H new ATOM 0 HD12 LEU B 71 -12.703 -1.102 -8.365 1.00 1.13 H new ATOM 0 HD13 LEU B 71 -13.611 -0.569 -6.930 1.00 1.13 H new ATOM 0 HD21 LEU B 71 -11.861 1.893 -6.370 1.00 0.92 H new ATOM 0 HD22 LEU B 71 -12.355 0.753 -5.096 1.00 0.92 H new ATOM 0 HD23 LEU B 71 -10.631 1.117 -5.344 1.00 0.92 H new ATOM 2765 N LYS B 72 -9.561 -4.807 -6.974 1.00 0.52 N ATOM 2766 CA LYS B 72 -8.738 -5.878 -6.368 1.00 0.54 C ATOM 2767 C LYS B 72 -7.483 -5.238 -5.758 1.00 0.48 C ATOM 2768 O LYS B 72 -7.082 -4.169 -6.212 1.00 0.46 O ATOM 2769 CB LYS B 72 -8.345 -6.944 -7.421 1.00 0.60 C ATOM 2770 CG LYS B 72 -7.816 -8.254 -6.825 1.00 0.78 C ATOM 2771 CD LYS B 72 -7.145 -9.152 -7.867 1.00 0.91 C ATOM 2772 CE LYS B 72 -6.617 -10.453 -7.251 1.00 1.29 C ATOM 2773 NZ LYS B 72 -5.405 -10.245 -6.393 1.00 1.81 N ATOM 0 H LYS B 72 -9.645 -4.867 -7.989 1.00 0.52 H new ATOM 0 HA LYS B 72 -9.315 -6.384 -5.594 1.00 0.54 H new ATOM 0 HB2 LYS B 72 -9.215 -7.165 -8.039 1.00 0.60 H new ATOM 0 HB3 LYS B 72 -7.584 -6.524 -8.079 1.00 0.60 H new ATOM 0 HG2 LYS B 72 -7.101 -8.025 -6.035 1.00 0.78 H new ATOM 0 HG3 LYS B 72 -8.640 -8.796 -6.362 1.00 0.78 H new ATOM 0 HD2 LYS B 72 -7.859 -9.388 -8.656 1.00 0.91 H new ATOM 0 HD3 LYS B 72 -6.321 -8.612 -8.334 1.00 0.91 H new ATOM 0 HE2 LYS B 72 -7.405 -10.911 -6.653 1.00 1.29 H new ATOM 0 HE3 LYS B 72 -6.374 -11.154 -8.049 1.00 1.29 H new ATOM 0 HZ1 LYS B 72 -5.094 -11.158 -6.004 1.00 1.81 H new ATOM 0 HZ2 LYS B 72 -4.641 -9.834 -6.966 1.00 1.81 H new ATOM 0 HZ3 LYS B 72 -5.639 -9.598 -5.613 1.00 1.81 H new ATOM 2787 N PHE B 73 -6.859 -5.869 -4.741 1.00 0.51 N ATOM 2788 CA PHE B 73 -5.655 -5.287 -4.095 1.00 0.49 C ATOM 2789 C PHE B 73 -4.523 -4.966 -5.104 1.00 0.46 C ATOM 2790 O PHE B 73 -3.716 -4.067 -4.848 1.00 0.46 O ATOM 2791 CB PHE B 73 -5.128 -6.161 -2.935 1.00 0.55 C ATOM 2792 CG PHE B 73 -4.655 -5.322 -1.765 1.00 0.69 C ATOM 2793 CD1 PHE B 73 -3.391 -4.750 -1.765 1.00 0.89 C ATOM 2794 CD2 PHE B 73 -5.496 -5.070 -0.690 1.00 0.90 C ATOM 2795 CE1 PHE B 73 -2.979 -3.950 -0.721 1.00 1.14 C ATOM 2796 CE2 PHE B 73 -5.085 -4.278 0.360 1.00 1.15 C ATOM 2797 CZ PHE B 73 -3.826 -3.714 0.344 1.00 1.23 C ATOM 0 H PHE B 73 -7.158 -6.764 -4.353 1.00 0.51 H new ATOM 0 HA PHE B 73 -5.985 -4.338 -3.671 1.00 0.49 H new ATOM 0 HB2 PHE B 73 -5.916 -6.836 -2.602 1.00 0.55 H new ATOM 0 HB3 PHE B 73 -4.306 -6.782 -3.292 1.00 0.55 H new ATOM 0 HD1 PHE B 73 -2.722 -4.934 -2.593 1.00 0.89 H new ATOM 0 HD2 PHE B 73 -6.486 -5.501 -0.676 1.00 0.90 H new ATOM 0 HE1 PHE B 73 -1.994 -3.508 -0.736 1.00 1.14 H new ATOM 0 HE2 PHE B 73 -5.747 -4.099 1.194 1.00 1.15 H new ATOM 0 HZ PHE B 73 -3.503 -3.089 1.163 1.00 1.23 H new ATOM 2807 N ASN B 74 -4.464 -5.702 -6.238 1.00 0.47 N ATOM 2808 CA ASN B 74 -3.461 -5.440 -7.296 1.00 0.50 C ATOM 2809 C ASN B 74 -3.759 -4.084 -7.988 1.00 0.48 C ATOM 2810 O ASN B 74 -2.834 -3.334 -8.304 1.00 0.54 O ATOM 2811 CB ASN B 74 -3.448 -6.596 -8.326 1.00 0.55 C ATOM 2812 CG ASN B 74 -2.226 -6.587 -9.252 1.00 0.63 C ATOM 2813 OD1 ASN B 74 -1.749 -5.529 -9.665 1.00 0.99 O ATOM 2814 ND2 ASN B 74 -1.702 -7.772 -9.579 1.00 0.93 N ATOM 0 H ASN B 74 -5.095 -6.477 -6.443 1.00 0.47 H new ATOM 0 HA ASN B 74 -2.473 -5.383 -6.840 1.00 0.50 H new ATOM 0 HB2 ASN B 74 -3.481 -7.546 -7.792 1.00 0.55 H new ATOM 0 HB3 ASN B 74 -4.352 -6.540 -8.932 1.00 0.55 H new ATOM 0 HD21 ASN B 74 -0.884 -7.818 -10.187 1.00 0.93 H new ATOM 0 HD22 ASN B 74 -2.120 -8.631 -9.221 1.00 0.93 H new ATOM 2821 N GLU B 75 -5.061 -3.788 -8.208 1.00 0.44 N ATOM 2822 CA GLU B 75 -5.514 -2.523 -8.826 1.00 0.47 C ATOM 2823 C GLU B 75 -5.744 -1.426 -7.760 1.00 0.41 C ATOM 2824 O GLU B 75 -5.699 -0.237 -8.081 1.00 0.42 O ATOM 2825 CB GLU B 75 -6.814 -2.745 -9.631 1.00 0.54 C ATOM 2826 CG GLU B 75 -6.611 -3.427 -10.984 1.00 0.64 C ATOM 2827 CD GLU B 75 -6.331 -4.918 -10.873 1.00 0.76 C ATOM 2828 OE1 GLU B 75 -7.295 -5.693 -10.701 1.00 0.91 O ATOM 2829 OE2 GLU B 75 -5.148 -5.308 -10.963 1.00 0.93 O ATOM 0 H GLU B 75 -5.824 -4.419 -7.962 1.00 0.44 H new ATOM 0 HA GLU B 75 -4.726 -2.189 -9.501 1.00 0.47 H new ATOM 0 HB2 GLU B 75 -7.498 -3.347 -9.033 1.00 0.54 H new ATOM 0 HB3 GLU B 75 -7.296 -1.781 -9.793 1.00 0.54 H new ATOM 0 HG2 GLU B 75 -7.501 -3.276 -11.596 1.00 0.64 H new ATOM 0 HG3 GLU B 75 -5.782 -2.947 -11.504 1.00 0.64 H new ATOM 2836 N TYR B 76 -6.000 -1.839 -6.494 1.00 0.41 N ATOM 2837 CA TYR B 76 -6.220 -0.906 -5.373 1.00 0.39 C ATOM 2838 C TYR B 76 -4.871 -0.377 -4.812 1.00 0.36 C ATOM 2839 O TYR B 76 -4.858 0.518 -3.961 1.00 0.43 O ATOM 2840 CB TYR B 76 -7.055 -1.595 -4.264 1.00 0.43 C ATOM 2841 CG TYR B 76 -7.447 -0.691 -3.093 1.00 0.44 C ATOM 2842 CD1 TYR B 76 -8.352 0.357 -3.256 1.00 0.50 C ATOM 2843 CD2 TYR B 76 -6.899 -0.885 -1.826 1.00 0.52 C ATOM 2844 CE1 TYR B 76 -8.697 1.177 -2.195 1.00 0.58 C ATOM 2845 CE2 TYR B 76 -7.241 -0.069 -0.764 1.00 0.59 C ATOM 2846 CZ TYR B 76 -8.137 0.960 -0.952 1.00 0.59 C ATOM 2847 OH TYR B 76 -8.476 1.777 0.111 1.00 0.71 O ATOM 0 H TYR B 76 -6.058 -2.822 -6.228 1.00 0.41 H new ATOM 0 HA TYR B 76 -6.779 -0.046 -5.743 1.00 0.39 H new ATOM 0 HB2 TYR B 76 -7.963 -1.998 -4.712 1.00 0.43 H new ATOM 0 HB3 TYR B 76 -6.488 -2.441 -3.876 1.00 0.43 H new ATOM 0 HD1 TYR B 76 -8.792 0.532 -4.227 1.00 0.50 H new ATOM 0 HD2 TYR B 76 -6.194 -1.688 -1.671 1.00 0.52 H new ATOM 0 HE1 TYR B 76 -9.401 1.983 -2.339 1.00 0.58 H new ATOM 0 HE2 TYR B 76 -6.807 -0.238 0.210 1.00 0.59 H new ATOM 0 HH TYR B 76 -7.994 1.487 0.913 1.00 0.71 H new ATOM 2857 N TRP B 77 -3.736 -0.925 -5.321 1.00 0.39 N ATOM 2858 CA TRP B 77 -2.379 -0.519 -4.906 1.00 0.40 C ATOM 2859 C TRP B 77 -2.075 0.973 -5.234 1.00 0.35 C ATOM 2860 O TRP B 77 -1.161 1.543 -4.639 1.00 0.37 O ATOM 2861 CB TRP B 77 -1.331 -1.511 -5.512 1.00 0.58 C ATOM 2862 CG TRP B 77 -0.149 -0.916 -6.243 1.00 0.48 C ATOM 2863 CD1 TRP B 77 1.073 -0.610 -5.713 1.00 0.56 C ATOM 2864 CD2 TRP B 77 -0.077 -0.585 -7.639 1.00 0.74 C ATOM 2865 NE1 TRP B 77 1.895 -0.101 -6.688 1.00 0.79 N ATOM 2866 CE2 TRP B 77 1.214 -0.074 -7.879 1.00 0.94 C ATOM 2867 CE3 TRP B 77 -0.977 -0.665 -8.709 1.00 0.98 C ATOM 2868 CZ2 TRP B 77 1.624 0.348 -9.142 1.00 1.34 C ATOM 2869 CZ3 TRP B 77 -0.568 -0.246 -9.960 1.00 1.37 C ATOM 2870 CH2 TRP B 77 0.722 0.254 -10.168 1.00 1.54 C ATOM 0 H TRP B 77 -3.743 -1.659 -6.029 1.00 0.39 H new ATOM 0 HA TRP B 77 -2.311 -0.580 -3.820 1.00 0.40 H new ATOM 0 HB2 TRP B 77 -0.948 -2.132 -4.702 1.00 0.58 H new ATOM 0 HB3 TRP B 77 -1.854 -2.174 -6.201 1.00 0.58 H new ATOM 0 HD1 TRP B 77 1.351 -0.748 -4.679 1.00 0.56 H new ATOM 0 HE1 TRP B 77 2.857 0.207 -6.549 1.00 0.79 H new ATOM 0 HE3 TRP B 77 -1.975 -1.048 -8.558 1.00 0.98 H new ATOM 0 HZ2 TRP B 77 2.619 0.736 -9.306 1.00 1.34 H new ATOM 0 HZ3 TRP B 77 -1.255 -0.305 -10.791 1.00 1.37 H new ATOM 0 HH2 TRP B 77 1.012 0.572 -11.158 1.00 1.54 H new ATOM 2881 N ARG B 78 -2.840 1.597 -6.171 1.00 0.37 N ATOM 2882 CA ARG B 78 -2.641 3.025 -6.536 1.00 0.41 C ATOM 2883 C ARG B 78 -2.847 3.953 -5.321 1.00 0.38 C ATOM 2884 O ARG B 78 -2.063 4.885 -5.112 1.00 0.45 O ATOM 2885 CB ARG B 78 -3.594 3.462 -7.679 1.00 0.49 C ATOM 2886 CG ARG B 78 -3.491 2.638 -8.971 1.00 0.68 C ATOM 2887 CD ARG B 78 -2.169 2.838 -9.719 1.00 0.88 C ATOM 2888 NE ARG B 78 -2.006 4.202 -10.260 1.00 1.17 N ATOM 2889 CZ ARG B 78 -1.030 4.586 -11.116 1.00 1.72 C ATOM 2890 NH1 ARG B 78 -0.089 3.725 -11.534 1.00 2.14 N ATOM 2891 NH2 ARG B 78 -0.991 5.848 -11.550 1.00 2.15 N ATOM 0 H ARG B 78 -3.593 1.137 -6.683 1.00 0.37 H new ATOM 0 HA ARG B 78 -1.611 3.115 -6.882 1.00 0.41 H new ATOM 0 HB2 ARG B 78 -4.620 3.409 -7.315 1.00 0.49 H new ATOM 0 HB3 ARG B 78 -3.394 4.507 -7.917 1.00 0.49 H new ATOM 0 HG2 ARG B 78 -3.606 1.581 -8.729 1.00 0.68 H new ATOM 0 HG3 ARG B 78 -4.317 2.906 -9.630 1.00 0.68 H new ATOM 0 HD2 ARG B 78 -1.341 2.621 -9.044 1.00 0.88 H new ATOM 0 HD3 ARG B 78 -2.110 2.120 -10.537 1.00 0.88 H new ATOM 0 HE ARG B 78 -2.680 4.909 -9.966 1.00 1.17 H new ATOM 0 HH11 ARG B 78 -0.100 2.759 -11.206 1.00 2.14 H new ATOM 0 HH12 ARG B 78 0.637 4.037 -12.179 1.00 2.14 H new ATOM 0 HH21 ARG B 78 -1.694 6.517 -11.237 1.00 2.15 H new ATOM 0 HH22 ARG B 78 -0.258 6.143 -12.195 1.00 2.15 H new ATOM 2905 N LEU B 79 -3.904 3.686 -4.520 1.00 0.33 N ATOM 2906 CA LEU B 79 -4.206 4.486 -3.315 1.00 0.34 C ATOM 2907 C LEU B 79 -3.312 4.065 -2.133 1.00 0.32 C ATOM 2908 O LEU B 79 -3.113 4.852 -1.206 1.00 0.36 O ATOM 2909 CB LEU B 79 -5.701 4.379 -2.935 1.00 0.36 C ATOM 2910 CG LEU B 79 -6.254 5.508 -2.031 1.00 0.41 C ATOM 2911 CD1 LEU B 79 -6.350 6.829 -2.804 1.00 0.49 C ATOM 2912 CD2 LEU B 79 -7.619 5.124 -1.451 1.00 0.48 C ATOM 0 H LEU B 79 -4.560 2.923 -4.688 1.00 0.33 H new ATOM 0 HA LEU B 79 -3.991 5.529 -3.548 1.00 0.34 H new ATOM 0 HB2 LEU B 79 -6.288 4.355 -3.853 1.00 0.36 H new ATOM 0 HB3 LEU B 79 -5.860 3.426 -2.430 1.00 0.36 H new ATOM 0 HG LEU B 79 -5.558 5.646 -1.203 1.00 0.41 H new ATOM 0 HD11 LEU B 79 -6.741 7.607 -2.148 1.00 0.49 H new ATOM 0 HD12 LEU B 79 -5.360 7.116 -3.158 1.00 0.49 H new ATOM 0 HD13 LEU B 79 -7.018 6.704 -3.657 1.00 0.49 H new ATOM 0 HD21 LEU B 79 -7.987 5.933 -0.820 1.00 0.48 H new ATOM 0 HD22 LEU B 79 -8.324 4.949 -2.264 1.00 0.48 H new ATOM 0 HD23 LEU B 79 -7.519 4.216 -0.856 1.00 0.48 H new ATOM 2924 N ILE B 80 -2.785 2.813 -2.164 1.00 0.34 N ATOM 2925 CA ILE B 80 -1.879 2.298 -1.111 1.00 0.37 C ATOM 2926 C ILE B 80 -0.585 3.149 -1.047 1.00 0.36 C ATOM 2927 O ILE B 80 -0.031 3.350 0.040 1.00 0.39 O ATOM 2928 CB ILE B 80 -1.541 0.777 -1.334 1.00 0.44 C ATOM 2929 CG1 ILE B 80 -2.818 -0.100 -1.188 1.00 0.47 C ATOM 2930 CG2 ILE B 80 -0.422 0.278 -0.402 1.00 0.54 C ATOM 2931 CD1 ILE B 80 -3.363 -0.239 0.229 1.00 0.56 C ATOM 0 H ILE B 80 -2.974 2.143 -2.909 1.00 0.34 H new ATOM 0 HA ILE B 80 -2.395 2.380 -0.155 1.00 0.37 H new ATOM 0 HB ILE B 80 -1.167 0.682 -2.353 1.00 0.44 H new ATOM 0 HG12 ILE B 80 -3.600 0.321 -1.819 1.00 0.47 H new ATOM 0 HG13 ILE B 80 -2.599 -1.096 -1.573 1.00 0.47 H new ATOM 0 HG21 ILE B 80 -0.229 -0.777 -0.598 1.00 0.54 H new ATOM 0 HG22 ILE B 80 0.486 0.853 -0.583 1.00 0.54 H new ATOM 0 HG23 ILE B 80 -0.730 0.404 0.636 1.00 0.54 H new ATOM 0 HD11 ILE B 80 -4.252 -0.869 0.217 1.00 0.56 H new ATOM 0 HD12 ILE B 80 -2.605 -0.693 0.867 1.00 0.56 H new ATOM 0 HD13 ILE B 80 -3.622 0.746 0.617 1.00 0.56 H new ATOM 2943 N GLY B 81 -0.109 3.636 -2.218 1.00 0.36 N ATOM 2944 CA GLY B 81 1.071 4.501 -2.266 1.00 0.39 C ATOM 2945 C GLY B 81 0.781 5.888 -1.699 1.00 0.37 C ATOM 2946 O GLY B 81 1.632 6.478 -1.033 1.00 0.42 O ATOM 0 H GLY B 81 -0.526 3.441 -3.128 1.00 0.36 H new ATOM 0 HA2 GLY B 81 1.882 4.040 -1.702 1.00 0.39 H new ATOM 0 HA3 GLY B 81 1.412 4.594 -3.297 1.00 0.39 H new ATOM 2950 N GLU B 82 -0.441 6.404 -1.964 1.00 0.34 N ATOM 2951 CA GLU B 82 -0.886 7.718 -1.455 1.00 0.36 C ATOM 2952 C GLU B 82 -1.312 7.631 0.033 1.00 0.33 C ATOM 2953 O GLU B 82 -1.441 8.662 0.699 1.00 0.40 O ATOM 2954 CB GLU B 82 -2.062 8.253 -2.308 1.00 0.41 C ATOM 2955 CG GLU B 82 -1.700 8.592 -3.758 1.00 0.49 C ATOM 2956 CD GLU B 82 -0.955 9.911 -3.901 1.00 0.61 C ATOM 2957 OE1 GLU B 82 -1.620 10.958 -4.059 1.00 0.91 O ATOM 2958 OE2 GLU B 82 0.294 9.898 -3.854 1.00 0.79 O ATOM 0 H GLU B 82 -1.140 5.925 -2.532 1.00 0.34 H new ATOM 0 HA GLU B 82 -0.044 8.406 -1.529 1.00 0.36 H new ATOM 0 HB2 GLU B 82 -2.858 7.509 -2.311 1.00 0.41 H new ATOM 0 HB3 GLU B 82 -2.463 9.147 -1.830 1.00 0.41 H new ATOM 0 HG2 GLU B 82 -1.087 7.790 -4.169 1.00 0.49 H new ATOM 0 HG3 GLU B 82 -2.612 8.632 -4.353 1.00 0.49 H new ATOM 2965 N LEU B 83 -1.522 6.389 0.547 1.00 0.33 N ATOM 2966 CA LEU B 83 -1.931 6.145 1.952 1.00 0.35 C ATOM 2967 C LEU B 83 -0.863 6.652 2.942 1.00 0.37 C ATOM 2968 O LEU B 83 -1.162 7.486 3.801 1.00 0.45 O ATOM 2969 CB LEU B 83 -2.217 4.626 2.184 1.00 0.42 C ATOM 2970 CG LEU B 83 -3.631 4.268 2.705 1.00 0.51 C ATOM 2971 CD1 LEU B 83 -4.703 4.537 1.643 1.00 0.69 C ATOM 2972 CD2 LEU B 83 -3.683 2.809 3.164 1.00 0.63 C ATOM 0 H LEU B 83 -1.412 5.535 0.000 1.00 0.33 H new ATOM 0 HA LEU B 83 -2.849 6.704 2.135 1.00 0.35 H new ATOM 0 HB2 LEU B 83 -2.055 4.099 1.244 1.00 0.42 H new ATOM 0 HB3 LEU B 83 -1.483 4.244 2.894 1.00 0.42 H new ATOM 0 HG LEU B 83 -3.842 4.909 3.561 1.00 0.51 H new ATOM 0 HD11 LEU B 83 -5.683 4.275 2.041 1.00 0.69 H new ATOM 0 HD12 LEU B 83 -4.691 5.593 1.373 1.00 0.69 H new ATOM 0 HD13 LEU B 83 -4.498 3.934 0.758 1.00 0.69 H new ATOM 0 HD21 LEU B 83 -4.684 2.577 3.526 1.00 0.63 H new ATOM 0 HD22 LEU B 83 -3.440 2.155 2.326 1.00 0.63 H new ATOM 0 HD23 LEU B 83 -2.962 2.654 3.967 1.00 0.63 H new ATOM 2984 N ALA B 84 0.384 6.152 2.809 1.00 0.38 N ATOM 2985 CA ALA B 84 1.493 6.564 3.693 1.00 0.44 C ATOM 2986 C ALA B 84 2.259 7.797 3.154 1.00 0.45 C ATOM 2987 O ALA B 84 3.149 8.312 3.838 1.00 0.55 O ATOM 2988 CB ALA B 84 2.453 5.397 3.935 1.00 0.55 C ATOM 0 H ALA B 84 0.646 5.466 2.101 1.00 0.38 H new ATOM 0 HA ALA B 84 1.046 6.859 4.642 1.00 0.44 H new ATOM 0 HB1 ALA B 84 3.263 5.721 4.589 1.00 0.55 H new ATOM 0 HB2 ALA B 84 1.914 4.574 4.405 1.00 0.55 H new ATOM 0 HB3 ALA B 84 2.867 5.063 2.984 1.00 0.55 H new ATOM 2994 N LYS B 85 1.928 8.261 1.926 1.00 0.41 N ATOM 2995 CA LYS B 85 2.574 9.444 1.326 1.00 0.45 C ATOM 2996 C LYS B 85 1.819 10.733 1.703 1.00 0.47 C ATOM 2997 O LYS B 85 2.444 11.786 1.857 1.00 0.57 O ATOM 2998 CB LYS B 85 2.669 9.301 -0.210 1.00 0.49 C ATOM 2999 CG LYS B 85 3.615 10.302 -0.875 1.00 0.57 C ATOM 3000 CD LYS B 85 3.640 10.180 -2.405 1.00 0.66 C ATOM 3001 CE LYS B 85 4.456 8.975 -2.904 1.00 0.79 C ATOM 3002 NZ LYS B 85 3.601 7.784 -3.197 1.00 1.10 N ATOM 0 H LYS B 85 1.217 7.831 1.334 1.00 0.41 H new ATOM 0 HA LYS B 85 3.586 9.511 1.726 1.00 0.45 H new ATOM 0 HB2 LYS B 85 3.000 8.291 -0.450 1.00 0.49 H new ATOM 0 HB3 LYS B 85 1.673 9.420 -0.637 1.00 0.49 H new ATOM 0 HG2 LYS B 85 3.315 11.314 -0.602 1.00 0.57 H new ATOM 0 HG3 LYS B 85 4.623 10.153 -0.488 1.00 0.57 H new ATOM 0 HD2 LYS B 85 2.617 10.095 -2.773 1.00 0.66 H new ATOM 0 HD3 LYS B 85 4.057 11.094 -2.829 1.00 0.66 H new ATOM 0 HE2 LYS B 85 5.000 9.257 -3.805 1.00 0.79 H new ATOM 0 HE3 LYS B 85 5.199 8.708 -2.153 1.00 0.79 H new ATOM 0 HZ1 LYS B 85 4.183 6.923 -3.164 1.00 1.10 H new ATOM 0 HZ2 LYS B 85 2.843 7.718 -2.488 1.00 1.10 H new ATOM 0 HZ3 LYS B 85 3.181 7.882 -4.144 1.00 1.10 H new ATOM 3016 N GLU B 86 0.477 10.643 1.860 1.00 0.42 N ATOM 3017 CA GLU B 86 -0.354 11.807 2.227 1.00 0.46 C ATOM 3018 C GLU B 86 -0.635 11.850 3.754 1.00 0.50 C ATOM 3019 O GLU B 86 -1.654 12.396 4.185 1.00 0.81 O ATOM 3020 CB GLU B 86 -1.675 11.798 1.414 1.00 0.52 C ATOM 3021 CG GLU B 86 -1.496 11.940 -0.104 1.00 0.59 C ATOM 3022 CD GLU B 86 -0.979 13.308 -0.530 1.00 1.01 C ATOM 3023 OE1 GLU B 86 -1.791 14.255 -0.605 1.00 1.48 O ATOM 3024 OE2 GLU B 86 0.240 13.431 -0.783 1.00 1.68 O ATOM 0 H GLU B 86 -0.049 9.778 1.738 1.00 0.42 H new ATOM 0 HA GLU B 86 0.201 12.712 1.979 1.00 0.46 H new ATOM 0 HB2 GLU B 86 -2.205 10.867 1.618 1.00 0.52 H new ATOM 0 HB3 GLU B 86 -2.309 12.610 1.769 1.00 0.52 H new ATOM 0 HG2 GLU B 86 -0.804 11.174 -0.453 1.00 0.59 H new ATOM 0 HG3 GLU B 86 -2.452 11.753 -0.594 1.00 0.59 H new ATOM 3031 N ILE B 87 0.285 11.283 4.571 1.00 0.48 N ATOM 3032 CA ILE B 87 0.156 11.280 6.042 1.00 0.51 C ATOM 3033 C ILE B 87 1.184 12.250 6.669 1.00 0.53 C ATOM 3034 O ILE B 87 0.837 13.014 7.575 1.00 0.58 O ATOM 3035 CB ILE B 87 0.282 9.823 6.631 1.00 0.56 C ATOM 3036 CG1 ILE B 87 -0.313 9.713 8.071 1.00 0.61 C ATOM 3037 CG2 ILE B 87 1.714 9.266 6.564 1.00 0.62 C ATOM 3038 CD1 ILE B 87 0.502 10.342 9.201 1.00 0.63 C ATOM 0 H ILE B 87 1.128 10.820 4.230 1.00 0.48 H new ATOM 0 HA ILE B 87 -0.842 11.633 6.302 1.00 0.51 H new ATOM 0 HB ILE B 87 -0.323 9.190 5.981 1.00 0.56 H new ATOM 0 HG12 ILE B 87 -1.301 10.174 8.067 1.00 0.61 H new ATOM 0 HG13 ILE B 87 -0.455 8.657 8.301 1.00 0.61 H new ATOM 0 HG21 ILE B 87 1.733 8.261 6.985 1.00 0.62 H new ATOM 0 HG22 ILE B 87 2.043 9.231 5.525 1.00 0.62 H new ATOM 0 HG23 ILE B 87 2.382 9.911 7.134 1.00 0.62 H new ATOM 0 HD11 ILE B 87 -0.018 10.198 10.148 1.00 0.63 H new ATOM 0 HD12 ILE B 87 1.483 9.869 9.250 1.00 0.63 H new ATOM 0 HD13 ILE B 87 0.623 11.409 9.012 1.00 0.63 H new ATOM 3050 N ARG B 88 2.440 12.234 6.162 1.00 0.57 N ATOM 3051 CA ARG B 88 3.510 13.110 6.666 1.00 0.67 C ATOM 3052 C ARG B 88 3.769 14.305 5.719 1.00 0.67 C ATOM 3053 O ARG B 88 4.139 15.387 6.186 1.00 0.84 O ATOM 3054 CB ARG B 88 4.810 12.302 6.934 1.00 0.75 C ATOM 3055 CG ARG B 88 5.631 11.866 5.704 1.00 0.82 C ATOM 3056 CD ARG B 88 5.266 10.471 5.198 1.00 1.05 C ATOM 3057 NE ARG B 88 6.116 10.072 4.060 1.00 1.17 N ATOM 3058 CZ ARG B 88 6.445 8.803 3.735 1.00 1.26 C ATOM 3059 NH1 ARG B 88 5.924 7.753 4.383 1.00 1.64 N ATOM 3060 NH2 ARG B 88 7.296 8.587 2.725 1.00 1.55 N ATOM 0 H ARG B 88 2.732 11.620 5.402 1.00 0.57 H new ATOM 0 HA ARG B 88 3.174 13.526 7.616 1.00 0.67 H new ATOM 0 HB2 ARG B 88 5.455 12.902 7.576 1.00 0.75 H new ATOM 0 HB3 ARG B 88 4.543 11.408 7.497 1.00 0.75 H new ATOM 0 HG2 ARG B 88 5.480 12.587 4.901 1.00 0.82 H new ATOM 0 HG3 ARG B 88 6.691 11.887 5.957 1.00 0.82 H new ATOM 0 HD2 ARG B 88 5.376 9.749 6.007 1.00 1.05 H new ATOM 0 HD3 ARG B 88 4.219 10.454 4.896 1.00 1.05 H new ATOM 0 HE ARG B 88 6.486 10.817 3.469 1.00 1.17 H new ATOM 0 HH11 ARG B 88 5.261 7.901 5.143 1.00 1.64 H new ATOM 0 HH12 ARG B 88 6.191 6.805 4.116 1.00 1.64 H new ATOM 0 HH21 ARG B 88 7.688 9.376 2.211 1.00 1.55 H new ATOM 0 HH22 ARG B 88 7.553 7.633 2.469 1.00 1.55 H new ATOM 3074 N LYS B 89 3.575 14.100 4.392 1.00 0.60 N ATOM 3075 CA LYS B 89 3.785 15.156 3.385 1.00 0.67 C ATOM 3076 C LYS B 89 2.568 15.286 2.445 1.00 0.63 C ATOM 3077 O LYS B 89 2.684 15.169 1.216 1.00 0.76 O ATOM 3078 CB LYS B 89 5.098 14.898 2.605 1.00 0.76 C ATOM 3079 CG LYS B 89 5.155 13.592 1.795 1.00 0.78 C ATOM 3080 CD LYS B 89 6.552 13.350 1.213 1.00 1.06 C ATOM 3081 CE LYS B 89 6.532 12.402 0.015 1.00 1.32 C ATOM 3082 NZ LYS B 89 7.903 12.131 -0.511 1.00 1.65 N ATOM 0 H LYS B 89 3.273 13.208 4.000 1.00 0.60 H new ATOM 0 HA LYS B 89 3.885 16.112 3.899 1.00 0.67 H new ATOM 0 HB2 LYS B 89 5.262 15.733 1.923 1.00 0.76 H new ATOM 0 HB3 LYS B 89 5.925 14.898 3.315 1.00 0.76 H new ATOM 0 HG2 LYS B 89 4.876 12.754 2.434 1.00 0.78 H new ATOM 0 HG3 LYS B 89 4.425 13.632 0.986 1.00 0.78 H new ATOM 0 HD2 LYS B 89 6.986 14.303 0.910 1.00 1.06 H new ATOM 0 HD3 LYS B 89 7.198 12.937 1.988 1.00 1.06 H new ATOM 0 HE2 LYS B 89 6.063 11.462 0.305 1.00 1.32 H new ATOM 0 HE3 LYS B 89 5.919 12.832 -0.777 1.00 1.32 H new ATOM 0 HZ1 LYS B 89 7.834 11.596 -1.400 1.00 1.65 H new ATOM 0 HZ2 LYS B 89 8.392 13.032 -0.686 1.00 1.65 H new ATOM 0 HZ3 LYS B 89 8.439 11.576 0.186 1.00 1.65 H new ATOM 3096 N LYS B 90 1.391 15.546 3.043 1.00 0.58 N ATOM 3097 CA LYS B 90 0.132 15.707 2.285 1.00 0.56 C ATOM 3098 C LYS B 90 0.118 17.038 1.503 1.00 0.54 C ATOM 3099 O LYS B 90 -0.360 17.086 0.367 1.00 0.58 O ATOM 3100 CB LYS B 90 -1.097 15.591 3.224 1.00 0.59 C ATOM 3101 CG LYS B 90 -1.134 16.580 4.411 1.00 0.66 C ATOM 3102 CD LYS B 90 -1.238 15.878 5.773 1.00 0.96 C ATOM 3103 CE LYS B 90 -2.658 15.399 6.089 1.00 1.48 C ATOM 3104 NZ LYS B 90 -3.536 16.506 6.573 1.00 2.03 N ATOM 0 H LYS B 90 1.283 15.650 4.052 1.00 0.58 H new ATOM 0 HA LYS B 90 0.072 14.899 1.556 1.00 0.56 H new ATOM 0 HB2 LYS B 90 -1.999 15.733 2.629 1.00 0.59 H new ATOM 0 HB3 LYS B 90 -1.133 14.576 3.620 1.00 0.59 H new ATOM 0 HG2 LYS B 90 -0.234 17.195 4.393 1.00 0.66 H new ATOM 0 HG3 LYS B 90 -1.982 17.253 4.290 1.00 0.66 H new ATOM 0 HD2 LYS B 90 -0.560 15.025 5.789 1.00 0.96 H new ATOM 0 HD3 LYS B 90 -0.908 16.562 6.555 1.00 0.96 H new ATOM 0 HE2 LYS B 90 -3.096 14.955 5.195 1.00 1.48 H new ATOM 0 HE3 LYS B 90 -2.615 14.616 6.846 1.00 1.48 H new ATOM 0 HZ1 LYS B 90 -4.486 16.133 6.774 1.00 2.03 H new ATOM 0 HZ2 LYS B 90 -3.134 16.914 7.441 1.00 2.03 H new ATOM 0 HZ3 LYS B 90 -3.601 17.243 5.842 1.00 2.03 H new ATOM 3118 N LYS B 91 0.649 18.104 2.131 1.00 0.55 N ATOM 3119 CA LYS B 91 0.748 19.434 1.521 1.00 0.59 C ATOM 3120 C LYS B 91 2.213 19.902 1.635 1.00 0.62 C ATOM 3121 O LYS B 91 2.545 20.747 2.477 1.00 0.69 O ATOM 3122 CB LYS B 91 -0.218 20.419 2.221 1.00 0.64 C ATOM 3123 CG LYS B 91 -1.703 20.075 2.066 1.00 0.74 C ATOM 3124 CD LYS B 91 -2.588 20.967 2.943 1.00 0.84 C ATOM 3125 CE LYS B 91 -4.077 20.629 2.809 1.00 1.14 C ATOM 3126 NZ LYS B 91 -4.744 21.400 1.718 1.00 1.36 N ATOM 0 H LYS B 91 1.022 18.062 3.080 1.00 0.55 H new ATOM 0 HA LYS B 91 0.460 19.397 0.470 1.00 0.59 H new ATOM 0 HB2 LYS B 91 0.025 20.452 3.283 1.00 0.64 H new ATOM 0 HB3 LYS B 91 -0.047 21.419 1.823 1.00 0.64 H new ATOM 0 HG2 LYS B 91 -1.995 20.187 1.022 1.00 0.74 H new ATOM 0 HG3 LYS B 91 -1.864 19.030 2.331 1.00 0.74 H new ATOM 0 HD2 LYS B 91 -2.287 20.860 3.985 1.00 0.84 H new ATOM 0 HD3 LYS B 91 -2.430 22.011 2.671 1.00 0.84 H new ATOM 0 HE2 LYS B 91 -4.188 19.562 2.615 1.00 1.14 H new ATOM 0 HE3 LYS B 91 -4.579 20.835 3.754 1.00 1.14 H new ATOM 0 HZ1 LYS B 91 -5.748 21.135 1.669 1.00 1.36 H new ATOM 0 HZ2 LYS B 91 -4.664 22.418 1.914 1.00 1.36 H new ATOM 0 HZ3 LYS B 91 -4.285 21.185 0.810 1.00 1.36 H new ATOM 3140 N ASP B 92 3.097 19.311 0.796 1.00 0.66 N ATOM 3141 CA ASP B 92 4.546 19.628 0.813 1.00 0.74 C ATOM 3142 C ASP B 92 4.871 20.984 0.149 1.00 0.92 C ATOM 3143 O ASP B 92 5.398 21.037 -0.969 1.00 1.72 O ATOM 3144 CB ASP B 92 5.396 18.477 0.200 1.00 0.75 C ATOM 3145 CG ASP B 92 4.920 17.980 -1.164 1.00 0.88 C ATOM 3146 OD1 ASP B 92 5.151 18.682 -2.173 1.00 1.15 O ATOM 3147 OD2 ASP B 92 4.332 16.878 -1.221 1.00 0.93 O ATOM 0 H ASP B 92 2.833 18.613 0.100 1.00 0.66 H new ATOM 0 HA ASP B 92 4.823 19.722 1.863 1.00 0.74 H new ATOM 0 HB2 ASP B 92 6.427 18.817 0.107 1.00 0.75 H new ATOM 0 HB3 ASP B 92 5.399 17.638 0.895 1.00 0.75 H new ATOM 3152 N LEU B 93 4.544 22.084 0.860 1.00 0.63 N ATOM 3153 CA LEU B 93 4.812 23.462 0.388 1.00 0.66 C ATOM 3154 C LEU B 93 4.465 24.499 1.478 1.00 0.69 C ATOM 3155 O LEU B 93 5.293 25.357 1.802 1.00 0.82 O ATOM 3156 CB LEU B 93 4.044 23.788 -0.925 1.00 0.71 C ATOM 3157 CG LEU B 93 4.826 24.638 -1.953 1.00 0.97 C ATOM 3158 CD1 LEU B 93 5.945 23.822 -2.617 1.00 1.27 C ATOM 3159 CD2 LEU B 93 3.885 25.219 -3.007 1.00 1.18 C ATOM 0 H LEU B 93 4.089 22.044 1.772 1.00 0.63 H new ATOM 0 HA LEU B 93 5.879 23.520 0.174 1.00 0.66 H new ATOM 0 HB2 LEU B 93 3.753 22.850 -1.399 1.00 0.71 H new ATOM 0 HB3 LEU B 93 3.124 24.314 -0.668 1.00 0.71 H new ATOM 0 HG LEU B 93 5.289 25.464 -1.414 1.00 0.97 H new ATOM 0 HD11 LEU B 93 6.476 24.448 -3.334 1.00 1.27 H new ATOM 0 HD12 LEU B 93 6.642 23.473 -1.855 1.00 1.27 H new ATOM 0 HD13 LEU B 93 5.513 22.965 -3.134 1.00 1.27 H new ATOM 0 HD21 LEU B 93 4.458 25.813 -3.719 1.00 1.18 H new ATOM 0 HD22 LEU B 93 3.383 24.407 -3.533 1.00 1.18 H new ATOM 0 HD23 LEU B 93 3.142 25.852 -2.522 1.00 1.18 H new ATOM 3171 N LYS B 94 3.237 24.409 2.040 1.00 0.66 N ATOM 3172 CA LYS B 94 2.775 25.337 3.094 1.00 0.74 C ATOM 3173 C LYS B 94 3.092 24.790 4.501 1.00 0.70 C ATOM 3174 O LYS B 94 3.439 25.566 5.398 1.00 0.79 O ATOM 3175 CB LYS B 94 1.256 25.600 2.952 1.00 0.84 C ATOM 3176 CG LYS B 94 0.737 26.813 3.735 1.00 1.00 C ATOM 3177 CD LYS B 94 1.022 28.135 3.013 1.00 1.15 C ATOM 3178 CE LYS B 94 0.595 29.353 3.834 1.00 1.45 C ATOM 3179 NZ LYS B 94 1.509 29.621 4.986 1.00 1.61 N ATOM 0 H LYS B 94 2.549 23.702 1.780 1.00 0.66 H new ATOM 0 HA LYS B 94 3.311 26.278 2.970 1.00 0.74 H new ATOM 0 HB2 LYS B 94 1.023 25.740 1.896 1.00 0.84 H new ATOM 0 HB3 LYS B 94 0.715 24.713 3.283 1.00 0.84 H new ATOM 0 HG2 LYS B 94 -0.337 26.710 3.890 1.00 1.00 H new ATOM 0 HG3 LYS B 94 1.201 26.832 4.721 1.00 1.00 H new ATOM 0 HD2 LYS B 94 2.088 28.204 2.794 1.00 1.15 H new ATOM 0 HD3 LYS B 94 0.499 28.143 2.057 1.00 1.15 H new ATOM 0 HE2 LYS B 94 0.566 30.230 3.187 1.00 1.45 H new ATOM 0 HE3 LYS B 94 -0.417 29.198 4.207 1.00 1.45 H new ATOM 0 HZ1 LYS B 94 1.174 30.456 5.508 1.00 1.61 H new ATOM 0 HZ2 LYS B 94 1.519 28.797 5.620 1.00 1.61 H new ATOM 0 HZ3 LYS B 94 2.471 29.797 4.632 1.00 1.61 H new ATOM 3193 N ILE B 95 2.959 23.456 4.689 1.00 0.65 N ATOM 3194 CA ILE B 95 3.236 22.798 5.982 1.00 0.66 C ATOM 3195 C ILE B 95 4.314 21.712 5.819 1.00 0.68 C ATOM 3196 O ILE B 95 4.342 21.011 4.803 1.00 0.78 O ATOM 3197 CB ILE B 95 1.946 22.172 6.613 1.00 0.74 C ATOM 3198 CG1 ILE B 95 1.222 21.224 5.613 1.00 0.83 C ATOM 3199 CG2 ILE B 95 1.004 23.279 7.103 1.00 0.84 C ATOM 3200 CD1 ILE B 95 0.156 20.331 6.235 1.00 1.04 C ATOM 0 H ILE B 95 2.660 22.814 3.955 1.00 0.65 H new ATOM 0 HA ILE B 95 3.600 23.571 6.659 1.00 0.66 H new ATOM 0 HB ILE B 95 2.248 21.568 7.469 1.00 0.74 H new ATOM 0 HG12 ILE B 95 0.759 21.828 4.832 1.00 0.83 H new ATOM 0 HG13 ILE B 95 1.967 20.593 5.129 1.00 0.83 H new ATOM 0 HG21 ILE B 95 0.111 22.831 7.539 1.00 0.84 H new ATOM 0 HG22 ILE B 95 1.512 23.882 7.856 1.00 0.84 H new ATOM 0 HG23 ILE B 95 0.718 23.912 6.263 1.00 0.84 H new ATOM 0 HD11 ILE B 95 -0.292 19.707 5.462 1.00 1.04 H new ATOM 0 HD12 ILE B 95 0.611 19.696 6.995 1.00 1.04 H new ATOM 0 HD13 ILE B 95 -0.615 20.950 6.694 1.00 1.04 H new ATOM 3212 N ARG B 96 5.210 21.584 6.820 1.00 0.70 N ATOM 3213 CA ARG B 96 6.287 20.573 6.783 1.00 0.79 C ATOM 3214 C ARG B 96 6.695 20.072 8.195 1.00 0.79 C ATOM 3215 O ARG B 96 7.786 19.517 8.359 1.00 1.02 O ATOM 3216 CB ARG B 96 7.510 21.133 6.013 1.00 0.99 C ATOM 3217 CG ARG B 96 8.264 22.272 6.721 1.00 1.12 C ATOM 3218 CD ARG B 96 9.058 23.151 5.747 1.00 1.41 C ATOM 3219 NE ARG B 96 10.074 22.394 4.988 1.00 1.59 N ATOM 3220 CZ ARG B 96 10.548 22.723 3.764 1.00 2.01 C ATOM 3221 NH1 ARG B 96 10.128 23.820 3.109 1.00 2.42 N ATOM 3222 NH2 ARG B 96 11.461 21.939 3.187 1.00 2.37 N ATOM 0 H ARG B 96 5.209 22.164 7.659 1.00 0.70 H new ATOM 0 HA ARG B 96 5.898 19.702 6.256 1.00 0.79 H new ATOM 0 HB2 ARG B 96 8.208 20.316 5.828 1.00 0.99 H new ATOM 0 HB3 ARG B 96 7.174 21.491 5.040 1.00 0.99 H new ATOM 0 HG2 ARG B 96 7.551 22.892 7.264 1.00 1.12 H new ATOM 0 HG3 ARG B 96 8.945 21.848 7.459 1.00 1.12 H new ATOM 0 HD2 ARG B 96 8.368 23.625 5.049 1.00 1.41 H new ATOM 0 HD3 ARG B 96 9.548 23.950 6.303 1.00 1.41 H new ATOM 0 HE ARG B 96 10.450 21.552 5.423 1.00 1.59 H new ATOM 0 HH11 ARG B 96 9.432 24.432 3.534 1.00 2.42 H new ATOM 0 HH12 ARG B 96 10.506 24.039 2.187 1.00 2.42 H new ATOM 0 HH21 ARG B 96 11.793 21.103 3.668 1.00 2.37 H new ATOM 0 HH22 ARG B 96 11.827 22.175 2.265 1.00 2.37 H new ATOM 3236 N LYS B 97 5.815 20.253 9.209 1.00 0.72 N ATOM 3237 CA LYS B 97 6.095 19.800 10.586 1.00 0.76 C ATOM 3238 C LYS B 97 4.782 19.547 11.348 1.00 0.76 C ATOM 3239 O LYS B 97 4.114 20.489 11.783 1.00 1.04 O ATOM 3240 CB LYS B 97 7.005 20.801 11.347 1.00 0.89 C ATOM 3241 CG LYS B 97 6.567 22.273 11.306 1.00 0.94 C ATOM 3242 CD LYS B 97 7.466 23.151 12.182 1.00 1.16 C ATOM 3243 CE LYS B 97 7.008 24.611 12.224 1.00 1.49 C ATOM 3244 NZ LYS B 97 5.655 24.784 12.844 1.00 1.86 N ATOM 0 H LYS B 97 4.909 20.708 9.096 1.00 0.72 H new ATOM 0 HA LYS B 97 6.641 18.859 10.523 1.00 0.76 H new ATOM 0 HB2 LYS B 97 7.063 20.489 12.390 1.00 0.89 H new ATOM 0 HB3 LYS B 97 8.012 20.730 10.936 1.00 0.89 H new ATOM 0 HG2 LYS B 97 6.595 22.634 10.278 1.00 0.94 H new ATOM 0 HG3 LYS B 97 5.534 22.356 11.645 1.00 0.94 H new ATOM 0 HD2 LYS B 97 7.481 22.750 13.196 1.00 1.16 H new ATOM 0 HD3 LYS B 97 8.488 23.106 11.806 1.00 1.16 H new ATOM 0 HE2 LYS B 97 7.736 25.198 12.784 1.00 1.49 H new ATOM 0 HE3 LYS B 97 6.990 25.009 11.210 1.00 1.49 H new ATOM 0 HZ1 LYS B 97 5.457 25.797 12.968 1.00 1.86 H new ATOM 0 HZ2 LYS B 97 4.933 24.364 12.225 1.00 1.86 H new ATOM 0 HZ3 LYS B 97 5.635 24.311 13.770 1.00 1.86 H new ATOM 3258 N LYS B 98 4.405 18.259 11.480 1.00 0.71 N ATOM 3259 CA LYS B 98 3.169 17.869 12.181 1.00 0.74 C ATOM 3260 C LYS B 98 3.270 16.422 12.692 1.00 0.90 C ATOM 3261 O LYS B 98 3.279 16.231 13.929 1.00 1.07 O ATOM 3262 CB LYS B 98 1.944 18.042 11.249 1.00 0.96 C ATOM 3263 CG LYS B 98 0.595 17.909 11.963 1.00 1.08 C ATOM 3264 CD LYS B 98 -0.592 18.138 11.023 1.00 1.52 C ATOM 3265 CE LYS B 98 -1.934 17.935 11.736 1.00 1.69 C ATOM 3266 NZ LYS B 98 -2.237 19.025 12.712 1.00 1.85 N ATOM 3267 OXT LYS B 98 3.347 15.499 11.854 1.00 1.15 O ATOM 0 H LYS B 98 4.940 17.473 11.110 1.00 0.71 H new ATOM 0 HA LYS B 98 3.037 18.522 13.043 1.00 0.74 H new ATOM 0 HB2 LYS B 98 1.997 19.022 10.774 1.00 0.96 H new ATOM 0 HB3 LYS B 98 1.998 17.299 10.454 1.00 0.96 H new ATOM 0 HG2 LYS B 98 0.518 16.915 12.405 1.00 1.08 H new ATOM 0 HG3 LYS B 98 0.549 18.626 12.782 1.00 1.08 H new ATOM 0 HD2 LYS B 98 -0.545 19.149 10.619 1.00 1.52 H new ATOM 0 HD3 LYS B 98 -0.523 17.453 10.178 1.00 1.52 H new ATOM 0 HE2 LYS B 98 -2.731 17.885 10.994 1.00 1.69 H new ATOM 0 HE3 LYS B 98 -1.923 16.978 12.258 1.00 1.69 H new ATOM 0 HZ1 LYS B 98 -3.154 18.840 13.166 1.00 1.85 H new ATOM 0 HZ2 LYS B 98 -1.492 19.058 13.437 1.00 1.85 H new ATOM 0 HZ3 LYS B 98 -2.276 19.937 12.213 1.00 1.85 H new TER 3281 LYS B 98 HETATM 3282 NAA ANW A 99 14.775 16.666 10.961 1.00 4.56 N HETATM 3283 NAB ANW A 99 15.774 18.584 11.823 1.00 6.22 N HETATM 3284 CAC ANW A 99 10.843 9.210 11.042 1.00 5.26 C HETATM 3285 CAD ANW A 99 10.249 10.535 10.558 1.00 4.51 C HETATM 3286 CAE ANW A 99 9.658 10.354 9.158 1.00 5.16 C HETATM 3287 CAF ANW A 99 11.235 11.515 10.533 1.00 3.64 C HETATM 3288 CAG ANW A 99 11.079 12.666 11.299 1.00 3.13 C HETATM 3289 CAH ANW A 99 12.068 13.645 11.303 1.00 2.76 C HETATM 3290 CAI ANW A 99 13.214 13.474 10.536 1.00 3.04 C HETATM 3291 CAJ ANW A 99 13.377 12.322 9.776 1.00 3.59 C HETATM 3292 CAK ANW A 99 12.386 11.345 9.770 1.00 3.84 C HETATM 3293 CAL ANW A 99 13.896 15.662 11.094 1.00 3.63 C HETATM 3294 CAM ANW A 99 14.774 17.707 11.807 1.00 5.17 C HETATM 3295 CAN ANW A 99 13.857 17.788 12.848 1.00 5.05 C HETATM 3296 CAO ANW A 99 12.947 16.749 13.016 1.00 4.25 C HETATM 3297 CAP ANW A 99 12.968 15.682 12.128 1.00 3.42 C HETATM 3298 CAQ ANW A 99 11.956 14.731 12.160 1.00 3.01 C HETATM 3299 CAR ANW A 99 13.698 18.971 13.563 1.00 6.05 C HETATM 3300 OAS ANW A 99 14.120 14.489 10.439 1.00 3.49 O HETATM 3301 OAT ANW A 99 11.013 14.830 12.940 1.00 3.52 O HETATM 3302 OAU ANW A 99 12.921 19.006 14.544 1.00 6.33 O HETATM 3303 OAV ANW A 99 14.308 20.004 13.214 1.00 6.88 O HETATM 0 HOAV ANW A 99 14.065 20.744 13.808 1.00 6.88 H new HETATM 0 HNAB ANW A 99 16.561 18.472 11.184 1.00 6.22 H new HETATM 0 HNAA ANW A 99 15.754 19.369 12.474 1.00 6.22 H new HETATM 0 HAEB ANW A 99 10.442 10.037 8.470 1.00 5.16 H new HETATM 0 HAEA ANW A 99 8.875 9.597 9.189 1.00 5.16 H new HETATM 0 HACB ANW A 99 10.061 8.451 11.075 1.00 5.26 H new HETATM 0 HACA ANW A 99 11.629 8.892 10.357 1.00 5.26 H new HETATM 0 HAO ANW A 99 12.227 16.772 13.834 1.00 4.25 H new HETATM 0 HAK ANW A 99 12.512 10.446 9.167 1.00 3.84 H new HETATM 0 HAJ ANW A 99 14.282 12.184 9.184 1.00 3.59 H new HETATM 0 HAG ANW A 99 10.179 12.801 11.898 1.00 3.13 H new HETATM 0 HAE ANW A 99 9.236 11.299 8.816 1.00 5.16 H new HETATM 0 HAD ANW A 99 9.459 10.845 11.243 1.00 4.51 H new HETATM 0 HAC ANW A 99 11.263 9.342 12.039 1.00 5.26 H new HETATM 3317 NAA ANW B 99 -10.363 -14.847 2.919 1.00 4.81 N HETATM 3318 NAB ANW B 99 -10.958 -15.838 0.905 1.00 6.57 N HETATM 3319 CAC ANW B 99 -12.035 -10.034 9.616 1.00 5.53 C HETATM 3320 CAD ANW B 99 -11.529 -11.477 9.673 1.00 4.77 C HETATM 3321 CAE ANW B 99 -10.308 -11.555 10.594 1.00 5.55 C HETATM 3322 CAF ANW B 99 -11.185 -11.912 8.397 1.00 3.85 C HETATM 3323 CAG ANW B 99 -11.839 -13.009 7.847 1.00 3.21 C HETATM 3324 CAH ANW B 99 -11.508 -13.452 6.571 1.00 2.83 C HETATM 3325 CAI ANW B 99 -10.522 -12.794 5.843 1.00 3.21 C HETATM 3326 CAJ ANW B 99 -9.868 -11.696 6.390 1.00 3.83 C HETATM 3327 CAK ANW B 99 -10.192 -11.263 7.671 1.00 4.12 C HETATM 3328 CAL ANW B 99 -10.749 -14.386 4.117 1.00 3.82 C HETATM 3329 CAM ANW B 99 -11.134 -15.689 2.217 1.00 5.45 C HETATM 3330 CAN ANW B 99 -12.345 -16.145 2.723 1.00 5.26 C HETATM 3331 CAO ANW B 99 -12.764 -15.688 3.970 1.00 4.33 C HETATM 3332 CAP ANW B 99 -11.958 -14.794 4.667 1.00 3.50 C HETATM 3333 CAQ ANW B 99 -12.268 -14.446 5.973 1.00 3.00 C HETATM 3334 CAR ANW B 99 -13.064 -17.137 2.068 1.00 6.31 C HETATM 3335 OAS ANW B 99 -10.153 -13.266 4.618 1.00 3.68 O HETATM 3336 OAT ANW B 99 -13.160 -15.026 6.594 1.00 3.40 O HETATM 3337 OAU ANW B 99 -14.196 -17.466 2.485 1.00 6.52 O HETATM 3338 OAV ANW B 99 -12.573 -17.717 1.073 1.00 7.25 O HETATM 0 HOAV ANW B 99 -11.744 -18.170 1.334 1.00 7.25 H new HETATM 0 HNAB ANW B 99 -10.231 -15.308 0.425 1.00 6.57 H new HETATM 0 HNAA ANW B 99 -11.551 -16.482 0.381 1.00 6.57 H new HETATM 0 HAEB ANW B 99 -9.519 -10.909 10.208 1.00 5.55 H new HETATM 0 HAEA ANW B 99 -10.587 -11.229 11.596 1.00 5.55 H new HETATM 0 HACB ANW B 99 -12.315 -9.707 10.617 1.00 5.53 H new HETATM 0 HACA ANW B 99 -11.247 -9.387 9.230 1.00 5.53 H new HETATM 0 HAO ANW B 99 -13.710 -16.026 4.394 1.00 4.33 H new HETATM 0 HAK ANW B 99 -9.667 -10.413 8.107 1.00 4.12 H new HETATM 0 HAJ ANW B 99 -9.102 -11.175 5.815 1.00 3.83 H new HETATM 0 HAG ANW B 99 -12.613 -13.523 8.417 1.00 3.21 H new HETATM 0 HAE ANW B 99 -9.948 -12.583 10.634 1.00 5.55 H new HETATM 0 HAD ANW B 99 -12.319 -12.118 10.064 1.00 4.77 H new HETATM 0 HAC ANW B 99 -12.904 -9.979 8.960 1.00 5.53 H new