USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 842 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 46 ASN : amide:sc= -0.363 X(o=-0.36,f=-0.17) USER MOD Set 1.2: A 47 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 29 LYS NZ :NH3+ 151:sc= -0.101 (180deg=-0.56) USER MOD Set 2.2: A 74 CYS SG : rot -25:sc= -0.509 USER MOD Single : A 1 SER N :NH3+ -132:sc= 0.152 (180deg=-0.192) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0215 USER MOD Single : A 6 LYS NZ :NH3+ 149:sc= 1.28 (180deg=0.759) USER MOD Single : A 7 CYS SG : rot 170:sc= -3.02! USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 MET CE :methyl -142:sc= -1.61 (180deg=-4.86!) USER MOD Single : A 11 SER OG : rot 91:sc= 1.21 USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ -159:sc= 0.0752 (180deg=0.0154) USER MOD Single : A 17 GLN : amide:sc= 0.27 K(o=0.27,f=-0.71) USER MOD Single : A 19 SER OG : rot -1:sc= 0.915 USER MOD Single : A 23 ASN : amide:sc= -4.74! C(o=-4.7!,f=-11!) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 HIS : no HD1:sc=-0.000352 X(o=-0.00035,f=0) USER MOD Single : A 38 GLN : amide:sc= -0.917 K(o=-0.92,f=-1.8!) USER MOD Single : A 39 SER OG : rot -23:sc= 1.14 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ -157:sc= -0.105 (180deg=-0.553) USER MOD Single : A 48 ASN : amide:sc= -0.361 K(o=-0.36,f=-1.3) USER MOD Single : A 58 THR OG1 : rot -39:sc= 0.418 USER MOD Single : A 60 LYS NZ :NH3+ -179:sc= -1.21! (180deg=-1.25!) USER MOD Single : A 62 SER OG : rot 180:sc= -0.673 USER MOD Single : A 63 THR OG1 : rot 159:sc= 0.442 USER MOD Single : A 70 TYR OH : rot -19:sc= 1.19 USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.13 USER MOD Single : A 73 SER OG : rot -82:sc= 1.24 USER MOD Single : A 77 LYS NZ :NH3+ -133:sc= -0.685 (180deg=-2.6!) USER MOD Single : A 78 LYS NZ :NH3+ -172:sc=-0.00181 (180deg=-0.056) USER MOD Single : A 80 LYS NZ :NH3+ -134:sc=-0.00804 (180deg=-0.189) USER MOD Single : A 82 GLN : amide:sc= -0.391 X(o=-0.39,f=-0.069) USER MOD Single : B 201 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0166) USER MOD Single : B 203 THR OG1 : rot 55:sc= 0.61 USER MOD Single : B 208 LYS NZ :NH3+ -159:sc= -0.317 (180deg=-1.51!) USER MOD Single : B 210 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0418) USER MOD Single : B 211 TYR OH : rot 102:sc= 0.116 USER MOD Single : B 213 ASN : amide:sc= 0 X(o=0,f=-0.42) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -17.719 6.160 8.984 1.00 0.00 N ATOM 2 CA SER A 1 -18.629 7.104 8.304 1.00 0.00 C ATOM 3 C SER A 1 -19.170 6.474 7.026 1.00 0.00 C ATOM 4 O SER A 1 -18.864 5.316 6.725 1.00 0.00 O ATOM 5 CB SER A 1 -17.867 8.412 7.969 1.00 0.00 C ATOM 6 OG SER A 1 -16.677 8.122 7.253 1.00 0.00 O ATOM 0 H1 SER A 1 -17.967 6.105 9.993 1.00 0.00 H new ATOM 0 H2 SER A 1 -17.810 5.218 8.553 1.00 0.00 H new ATOM 0 H3 SER A 1 -16.738 6.492 8.886 1.00 0.00 H new ATOM 0 HA SER A 1 -19.465 7.336 8.964 1.00 0.00 H new ATOM 0 HB2 SER A 1 -18.504 9.070 7.377 1.00 0.00 H new ATOM 0 HB3 SER A 1 -17.625 8.945 8.888 1.00 0.00 H new ATOM 0 HG SER A 1 -16.207 8.957 7.047 1.00 0.00 H new ATOM 14 N GLU A 2 -19.964 7.225 6.271 1.00 0.00 N ATOM 15 CA GLU A 2 -20.484 6.742 4.997 1.00 0.00 C ATOM 16 C GLU A 2 -19.336 6.481 4.023 1.00 0.00 C ATOM 17 O GLU A 2 -19.423 5.586 3.193 1.00 0.00 O ATOM 18 CB GLU A 2 -21.482 7.762 4.389 1.00 0.00 C ATOM 19 CG GLU A 2 -20.841 9.089 4.002 1.00 0.00 C ATOM 20 CD GLU A 2 -21.808 10.022 3.299 1.00 0.00 C ATOM 21 OE1 GLU A 2 -22.808 10.432 3.924 1.00 0.00 O ATOM 22 OE2 GLU A 2 -21.575 10.364 2.120 1.00 0.00 O ATOM 0 H GLU A 2 -20.261 8.169 6.518 1.00 0.00 H new ATOM 0 HA GLU A 2 -21.015 5.807 5.175 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -21.946 7.321 3.506 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -22.279 7.950 5.108 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -20.457 9.577 4.898 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -19.987 8.900 3.351 1.00 0.00 H new ATOM 29 N GLU A 3 -18.247 7.237 4.165 1.00 0.00 N ATOM 30 CA GLU A 3 -17.097 7.118 3.268 1.00 0.00 C ATOM 31 C GLU A 3 -16.608 5.675 3.189 1.00 0.00 C ATOM 32 O GLU A 3 -16.185 5.217 2.136 1.00 0.00 O ATOM 33 CB GLU A 3 -15.949 8.013 3.748 1.00 0.00 C ATOM 34 CG GLU A 3 -14.818 8.146 2.741 1.00 0.00 C ATOM 35 CD GLU A 3 -15.240 8.889 1.491 1.00 0.00 C ATOM 36 OE1 GLU A 3 -15.629 8.236 0.502 1.00 0.00 O ATOM 37 OE2 GLU A 3 -15.191 10.138 1.498 1.00 0.00 O ATOM 0 H GLU A 3 -18.137 7.941 4.895 1.00 0.00 H new ATOM 0 HA GLU A 3 -17.419 7.436 2.276 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -16.342 9.004 3.973 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -15.550 7.610 4.679 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -13.982 8.668 3.206 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -14.461 7.153 2.467 1.00 0.00 H new ATOM 44 N GLU A 4 -16.693 4.956 4.300 1.00 0.00 N ATOM 45 CA GLU A 4 -16.213 3.580 4.358 1.00 0.00 C ATOM 46 C GLU A 4 -16.902 2.703 3.311 1.00 0.00 C ATOM 47 O GLU A 4 -16.255 1.909 2.625 1.00 0.00 O ATOM 48 CB GLU A 4 -16.441 3.002 5.755 1.00 0.00 C ATOM 49 CG GLU A 4 -15.749 3.784 6.860 1.00 0.00 C ATOM 50 CD GLU A 4 -14.244 3.842 6.685 1.00 0.00 C ATOM 51 OE1 GLU A 4 -13.562 2.861 7.047 1.00 0.00 O ATOM 52 OE2 GLU A 4 -13.735 4.868 6.184 1.00 0.00 O ATOM 0 H GLU A 4 -17.090 5.302 5.174 1.00 0.00 H new ATOM 0 HA GLU A 4 -15.145 3.589 4.140 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -17.512 2.975 5.957 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -16.087 1.971 5.775 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -16.147 4.799 6.885 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -15.981 3.327 7.822 1.00 0.00 H new ATOM 59 N ASP A 5 -18.212 2.861 3.178 1.00 0.00 N ATOM 60 CA ASP A 5 -18.984 2.040 2.251 1.00 0.00 C ATOM 61 C ASP A 5 -19.228 2.768 0.933 1.00 0.00 C ATOM 62 O ASP A 5 -19.661 2.167 -0.049 1.00 0.00 O ATOM 63 CB ASP A 5 -20.328 1.650 2.880 1.00 0.00 C ATOM 64 CG ASP A 5 -21.382 2.738 2.787 1.00 0.00 C ATOM 65 OD1 ASP A 5 -22.126 2.772 1.783 1.00 0.00 O ATOM 66 OD2 ASP A 5 -21.495 3.544 3.734 1.00 0.00 O ATOM 0 H ASP A 5 -18.761 3.546 3.697 1.00 0.00 H new ATOM 0 HA ASP A 5 -18.404 1.141 2.044 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -20.702 0.751 2.390 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -20.169 1.398 3.929 1.00 0.00 H new ATOM 71 N LYS A 6 -18.933 4.058 0.914 1.00 0.00 N ATOM 72 CA LYS A 6 -19.283 4.912 -0.212 1.00 0.00 C ATOM 73 C LYS A 6 -18.033 5.358 -0.973 1.00 0.00 C ATOM 74 O LYS A 6 -18.117 6.099 -1.954 1.00 0.00 O ATOM 75 CB LYS A 6 -20.058 6.119 0.327 1.00 0.00 C ATOM 76 CG LYS A 6 -20.673 7.028 -0.721 1.00 0.00 C ATOM 77 CD LYS A 6 -21.475 8.124 -0.046 1.00 0.00 C ATOM 78 CE LYS A 6 -21.990 9.155 -1.033 1.00 0.00 C ATOM 79 NZ LYS A 6 -22.780 10.210 -0.346 1.00 0.00 N ATOM 0 H LYS A 6 -18.448 4.540 1.671 1.00 0.00 H new ATOM 0 HA LYS A 6 -19.903 4.358 -0.917 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -20.853 5.756 0.978 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -19.385 6.712 0.946 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -19.890 7.467 -1.339 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -21.317 6.450 -1.384 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -22.317 7.680 0.484 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -20.853 8.618 0.700 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -21.150 9.610 -1.559 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -22.609 8.665 -1.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -22.677 11.110 -0.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -23.783 9.936 -0.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -22.434 10.324 0.628 1.00 0.00 H new ATOM 93 N CYS A 7 -16.876 4.903 -0.515 1.00 0.00 N ATOM 94 CA CYS A 7 -15.608 5.301 -1.112 1.00 0.00 C ATOM 95 C CYS A 7 -15.487 4.764 -2.533 1.00 0.00 C ATOM 96 O CYS A 7 -15.755 3.587 -2.797 1.00 0.00 O ATOM 97 CB CYS A 7 -14.430 4.811 -0.257 1.00 0.00 C ATOM 98 SG CYS A 7 -12.909 5.757 -0.491 1.00 0.00 S ATOM 0 H CYS A 7 -16.788 4.257 0.269 1.00 0.00 H new ATOM 0 HA CYS A 7 -15.580 6.390 -1.151 1.00 0.00 H new ATOM 0 HB2 CYS A 7 -14.715 4.854 0.794 1.00 0.00 H new ATOM 0 HB3 CYS A 7 -14.235 3.765 -0.491 1.00 0.00 H new ATOM 0 HG CYS A 7 -12.042 5.415 0.415 1.00 0.00 H new ATOM 104 N LYS A 8 -15.107 5.651 -3.440 1.00 0.00 N ATOM 105 CA LYS A 8 -14.946 5.317 -4.844 1.00 0.00 C ATOM 106 C LYS A 8 -13.719 4.426 -5.067 1.00 0.00 C ATOM 107 O LYS A 8 -12.759 4.461 -4.295 1.00 0.00 O ATOM 108 CB LYS A 8 -14.841 6.604 -5.654 1.00 0.00 C ATOM 109 CG LYS A 8 -13.669 7.481 -5.288 1.00 0.00 C ATOM 110 CD LYS A 8 -13.508 8.571 -6.318 1.00 0.00 C ATOM 111 CE LYS A 8 -12.322 9.472 -6.014 1.00 0.00 C ATOM 112 NZ LYS A 8 -12.107 10.486 -7.081 1.00 0.00 N ATOM 0 H LYS A 8 -14.901 6.626 -3.221 1.00 0.00 H new ATOM 0 HA LYS A 8 -15.816 4.751 -5.177 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -14.771 6.348 -6.711 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -15.760 7.175 -5.525 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -13.824 7.919 -4.302 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -12.759 6.884 -5.232 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -13.379 8.123 -7.303 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -14.418 9.170 -6.357 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -12.484 9.976 -5.061 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -11.424 8.865 -5.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -11.289 11.080 -6.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -11.927 10.005 -7.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -12.954 11.083 -7.169 1.00 0.00 H new ATOM 126 N PRO A 9 -13.741 3.617 -6.139 1.00 0.00 N ATOM 127 CA PRO A 9 -12.679 2.651 -6.431 1.00 0.00 C ATOM 128 C PRO A 9 -11.410 3.328 -6.918 1.00 0.00 C ATOM 129 O PRO A 9 -11.457 4.342 -7.616 1.00 0.00 O ATOM 130 CB PRO A 9 -13.291 1.781 -7.529 1.00 0.00 C ATOM 131 CG PRO A 9 -14.248 2.681 -8.226 1.00 0.00 C ATOM 132 CD PRO A 9 -14.798 3.599 -7.170 1.00 0.00 C ATOM 0 HA PRO A 9 -12.375 2.088 -5.549 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -12.528 1.408 -8.212 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -13.797 0.911 -7.110 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -13.749 3.246 -9.013 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -15.046 2.110 -8.700 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -14.989 4.597 -7.566 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -15.742 3.229 -6.770 1.00 0.00 H new ATOM 140 N MET A 10 -10.277 2.778 -6.517 1.00 0.00 N ATOM 141 CA MET A 10 -8.990 3.335 -6.875 1.00 0.00 C ATOM 142 C MET A 10 -8.635 2.991 -8.316 1.00 0.00 C ATOM 143 O MET A 10 -8.535 1.817 -8.672 1.00 0.00 O ATOM 144 CB MET A 10 -7.909 2.831 -5.926 1.00 0.00 C ATOM 145 CG MET A 10 -6.628 3.627 -6.045 1.00 0.00 C ATOM 146 SD MET A 10 -6.793 5.295 -5.387 1.00 0.00 S ATOM 147 CE MET A 10 -5.757 5.190 -3.937 1.00 0.00 C ATOM 0 H MET A 10 -10.226 1.939 -5.939 1.00 0.00 H new ATOM 0 HA MET A 10 -9.051 4.420 -6.788 1.00 0.00 H new ATOM 0 HB2 MET A 10 -8.274 2.885 -4.900 1.00 0.00 H new ATOM 0 HB3 MET A 10 -7.704 1.781 -6.137 1.00 0.00 H new ATOM 0 HG2 MET A 10 -5.830 3.107 -5.515 1.00 0.00 H new ATOM 0 HG3 MET A 10 -6.332 3.680 -7.093 1.00 0.00 H new ATOM 0 HE1 MET A 10 -6.211 5.757 -3.124 1.00 0.00 H new ATOM 0 HE2 MET A 10 -5.654 4.147 -3.638 1.00 0.00 H new ATOM 0 HE3 MET A 10 -4.773 5.602 -4.162 1.00 0.00 H new ATOM 157 N SER A 11 -8.445 4.021 -9.134 1.00 0.00 N ATOM 158 CA SER A 11 -8.195 3.841 -10.561 1.00 0.00 C ATOM 159 C SER A 11 -6.801 3.261 -10.804 1.00 0.00 C ATOM 160 O SER A 11 -5.968 3.262 -9.899 1.00 0.00 O ATOM 161 CB SER A 11 -8.330 5.186 -11.277 1.00 0.00 C ATOM 162 OG SER A 11 -9.426 5.931 -10.764 1.00 0.00 O ATOM 0 H SER A 11 -8.459 4.995 -8.831 1.00 0.00 H new ATOM 0 HA SER A 11 -8.929 3.139 -10.956 1.00 0.00 H new ATOM 0 HB2 SER A 11 -7.410 5.758 -11.159 1.00 0.00 H new ATOM 0 HB3 SER A 11 -8.467 5.020 -12.346 1.00 0.00 H new ATOM 0 HG SER A 11 -9.117 6.508 -10.035 1.00 0.00 H new ATOM 168 N TYR A 12 -6.546 2.780 -12.020 1.00 0.00 N ATOM 169 CA TYR A 12 -5.256 2.165 -12.355 1.00 0.00 C ATOM 170 C TYR A 12 -4.089 3.092 -12.035 1.00 0.00 C ATOM 171 O TYR A 12 -3.194 2.733 -11.264 1.00 0.00 O ATOM 172 CB TYR A 12 -5.212 1.761 -13.838 1.00 0.00 C ATOM 173 CG TYR A 12 -3.806 1.552 -14.380 1.00 0.00 C ATOM 174 CD1 TYR A 12 -2.867 0.805 -13.677 1.00 0.00 C ATOM 175 CD2 TYR A 12 -3.416 2.118 -15.587 1.00 0.00 C ATOM 176 CE1 TYR A 12 -1.587 0.626 -14.155 1.00 0.00 C ATOM 177 CE2 TYR A 12 -2.136 1.943 -16.076 1.00 0.00 C ATOM 178 CZ TYR A 12 -1.225 1.198 -15.357 1.00 0.00 C ATOM 179 OH TYR A 12 0.051 1.025 -15.843 1.00 0.00 O ATOM 0 H TYR A 12 -7.213 2.803 -12.791 1.00 0.00 H new ATOM 0 HA TYR A 12 -5.157 1.271 -11.739 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -5.782 0.841 -13.971 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -5.708 2.531 -14.429 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -3.147 0.355 -12.736 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -4.125 2.704 -16.152 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -0.873 0.042 -13.593 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -1.850 2.388 -17.018 1.00 0.00 H new ATOM 0 HH TYR A 12 0.141 1.492 -16.700 1.00 0.00 H new ATOM 189 N GLU A 13 -4.104 4.275 -12.627 1.00 0.00 N ATOM 190 CA GLU A 13 -3.021 5.235 -12.460 1.00 0.00 C ATOM 191 C GLU A 13 -2.824 5.587 -10.992 1.00 0.00 C ATOM 192 O GLU A 13 -1.720 5.936 -10.568 1.00 0.00 O ATOM 193 CB GLU A 13 -3.308 6.489 -13.283 1.00 0.00 C ATOM 194 CG GLU A 13 -3.433 6.202 -14.769 1.00 0.00 C ATOM 195 CD GLU A 13 -3.973 7.382 -15.548 1.00 0.00 C ATOM 196 OE1 GLU A 13 -3.168 8.124 -16.148 1.00 0.00 O ATOM 197 OE2 GLU A 13 -5.207 7.573 -15.567 1.00 0.00 O ATOM 0 H GLU A 13 -4.859 4.597 -13.232 1.00 0.00 H new ATOM 0 HA GLU A 13 -2.097 4.782 -12.818 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -4.230 6.948 -12.927 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -2.509 7.213 -13.123 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -2.456 5.927 -15.165 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -4.089 5.344 -14.915 1.00 0.00 H new ATOM 204 N GLU A 14 -3.885 5.444 -10.212 1.00 0.00 N ATOM 205 CA GLU A 14 -3.825 5.733 -8.797 1.00 0.00 C ATOM 206 C GLU A 14 -3.254 4.541 -8.056 1.00 0.00 C ATOM 207 O GLU A 14 -2.401 4.697 -7.199 1.00 0.00 O ATOM 208 CB GLU A 14 -5.216 6.061 -8.266 1.00 0.00 C ATOM 209 CG GLU A 14 -5.811 7.338 -8.829 1.00 0.00 C ATOM 210 CD GLU A 14 -7.194 7.620 -8.285 1.00 0.00 C ATOM 211 OE1 GLU A 14 -7.341 8.575 -7.495 1.00 0.00 O ATOM 212 OE2 GLU A 14 -8.143 6.888 -8.643 1.00 0.00 O ATOM 0 H GLU A 14 -4.797 5.129 -10.541 1.00 0.00 H new ATOM 0 HA GLU A 14 -3.179 6.597 -8.638 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -5.885 5.231 -8.493 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -5.168 6.144 -7.180 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -5.154 8.176 -8.595 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -5.859 7.265 -9.915 1.00 0.00 H new ATOM 219 N LYS A 15 -3.745 3.355 -8.395 1.00 0.00 N ATOM 220 CA LYS A 15 -3.231 2.111 -7.866 1.00 0.00 C ATOM 221 C LYS A 15 -1.728 1.987 -8.045 1.00 0.00 C ATOM 222 O LYS A 15 -1.005 1.695 -7.092 1.00 0.00 O ATOM 223 CB LYS A 15 -3.914 0.935 -8.549 1.00 0.00 C ATOM 224 CG LYS A 15 -5.305 0.652 -8.019 1.00 0.00 C ATOM 225 CD LYS A 15 -5.738 -0.760 -8.368 1.00 0.00 C ATOM 226 CE LYS A 15 -6.971 -1.192 -7.589 1.00 0.00 C ATOM 227 NZ LYS A 15 -7.588 -2.410 -8.177 1.00 0.00 N ATOM 0 H LYS A 15 -4.517 3.236 -9.051 1.00 0.00 H new ATOM 0 HA LYS A 15 -3.444 2.104 -6.797 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -3.975 1.132 -9.619 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -3.298 0.045 -8.424 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -5.321 0.785 -6.937 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -6.012 1.368 -8.439 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -5.945 -0.821 -9.436 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -4.920 -1.450 -8.162 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -6.698 -1.386 -6.552 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -7.700 -0.382 -7.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -8.581 -2.477 -7.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -7.545 -2.354 -9.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -7.070 -3.252 -7.854 1.00 0.00 H new ATOM 241 N ARG A 16 -1.260 2.194 -9.265 1.00 0.00 N ATOM 242 CA ARG A 16 0.158 2.066 -9.546 1.00 0.00 C ATOM 243 C ARG A 16 0.947 3.126 -8.806 1.00 0.00 C ATOM 244 O ARG A 16 2.005 2.832 -8.247 1.00 0.00 O ATOM 245 CB ARG A 16 0.431 2.121 -11.060 1.00 0.00 C ATOM 246 CG ARG A 16 1.888 2.337 -11.447 1.00 0.00 C ATOM 247 CD ARG A 16 2.112 1.968 -12.903 1.00 0.00 C ATOM 248 NE ARG A 16 1.757 0.573 -13.175 1.00 0.00 N ATOM 249 CZ ARG A 16 2.405 -0.207 -14.042 1.00 0.00 C ATOM 250 NH1 ARG A 16 3.433 0.268 -14.739 1.00 0.00 N ATOM 251 NH2 ARG A 16 2.019 -1.466 -14.214 1.00 0.00 N ATOM 0 H ARG A 16 -1.835 2.449 -10.068 1.00 0.00 H new ATOM 0 HA ARG A 16 0.488 1.090 -9.189 1.00 0.00 H new ATOM 0 HB2 ARG A 16 0.086 1.190 -11.510 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -0.166 2.924 -11.492 1.00 0.00 H new ATOM 0 HG2 ARG A 16 2.163 3.379 -11.283 1.00 0.00 H new ATOM 0 HG3 ARG A 16 2.533 1.733 -10.809 1.00 0.00 H new ATOM 0 HD2 ARG A 16 1.518 2.624 -13.539 1.00 0.00 H new ATOM 0 HD3 ARG A 16 3.158 2.134 -13.163 1.00 0.00 H new ATOM 0 HE ARG A 16 0.966 0.173 -12.670 1.00 0.00 H new ATOM 0 HH11 ARG A 16 3.731 1.235 -14.613 1.00 0.00 H new ATOM 0 HH12 ARG A 16 3.923 -0.335 -15.400 1.00 0.00 H new ATOM 0 HH21 ARG A 16 1.229 -1.834 -13.684 1.00 0.00 H new ATOM 0 HH22 ARG A 16 2.512 -2.065 -14.876 1.00 0.00 H new ATOM 265 N GLN A 17 0.432 4.347 -8.750 1.00 0.00 N ATOM 266 CA GLN A 17 1.130 5.368 -8.008 1.00 0.00 C ATOM 267 C GLN A 17 1.075 5.032 -6.522 1.00 0.00 C ATOM 268 O GLN A 17 2.047 5.212 -5.815 1.00 0.00 O ATOM 269 CB GLN A 17 0.581 6.774 -8.299 1.00 0.00 C ATOM 270 CG GLN A 17 1.398 7.869 -7.641 1.00 0.00 C ATOM 271 CD GLN A 17 2.840 7.883 -8.110 1.00 0.00 C ATOM 272 OE1 GLN A 17 3.138 7.580 -9.268 1.00 0.00 O ATOM 273 NE2 GLN A 17 3.749 8.191 -7.204 1.00 0.00 N ATOM 0 H GLN A 17 -0.437 4.641 -9.195 1.00 0.00 H new ATOM 0 HA GLN A 17 2.171 5.384 -8.330 1.00 0.00 H new ATOM 0 HB2 GLN A 17 0.564 6.937 -9.377 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -0.450 6.836 -7.951 1.00 0.00 H new ATOM 0 HG2 GLN A 17 0.941 8.836 -7.854 1.00 0.00 H new ATOM 0 HG3 GLN A 17 1.373 7.736 -6.559 1.00 0.00 H new ATOM 0 HE21 GLN A 17 3.462 8.436 -6.256 1.00 0.00 H new ATOM 0 HE22 GLN A 17 4.739 8.184 -7.451 1.00 0.00 H new ATOM 282 N LEU A 18 -0.040 4.459 -6.094 1.00 0.00 N ATOM 283 CA LEU A 18 -0.265 4.084 -4.711 1.00 0.00 C ATOM 284 C LEU A 18 0.745 3.047 -4.258 1.00 0.00 C ATOM 285 O LEU A 18 1.331 3.174 -3.186 1.00 0.00 O ATOM 286 CB LEU A 18 -1.689 3.554 -4.539 1.00 0.00 C ATOM 287 CG LEU A 18 -2.434 4.062 -3.303 1.00 0.00 C ATOM 288 CD1 LEU A 18 -2.247 3.116 -2.135 1.00 0.00 C ATOM 289 CD2 LEU A 18 -1.925 5.410 -2.882 1.00 0.00 C ATOM 0 H LEU A 18 -0.824 4.239 -6.709 1.00 0.00 H new ATOM 0 HA LEU A 18 -0.138 4.970 -4.089 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -2.266 3.819 -5.425 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -1.651 2.465 -4.497 1.00 0.00 H new ATOM 0 HG LEU A 18 -3.488 4.127 -3.574 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -2.786 3.498 -1.268 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -2.634 2.132 -2.398 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -1.186 3.037 -1.897 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -2.472 5.747 -2.001 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -0.863 5.340 -2.645 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -2.069 6.123 -3.694 1.00 0.00 H new ATOM 301 N SER A 19 0.959 2.030 -5.083 1.00 0.00 N ATOM 302 CA SER A 19 1.949 1.015 -4.778 1.00 0.00 C ATOM 303 C SER A 19 3.338 1.643 -4.711 1.00 0.00 C ATOM 304 O SER A 19 4.231 1.148 -4.023 1.00 0.00 O ATOM 305 CB SER A 19 1.907 -0.106 -5.813 1.00 0.00 C ATOM 306 OG SER A 19 1.994 0.389 -7.140 1.00 0.00 O ATOM 0 H SER A 19 0.462 1.890 -5.962 1.00 0.00 H new ATOM 0 HA SER A 19 1.718 0.581 -3.805 1.00 0.00 H new ATOM 0 HB2 SER A 19 2.729 -0.798 -5.630 1.00 0.00 H new ATOM 0 HB3 SER A 19 0.982 -0.671 -5.697 1.00 0.00 H new ATOM 0 HG SER A 19 2.043 1.368 -7.122 1.00 0.00 H new ATOM 312 N LEU A 20 3.498 2.745 -5.431 1.00 0.00 N ATOM 313 CA LEU A 20 4.739 3.510 -5.402 1.00 0.00 C ATOM 314 C LEU A 20 4.827 4.409 -4.156 1.00 0.00 C ATOM 315 O LEU A 20 5.843 4.402 -3.468 1.00 0.00 O ATOM 316 CB LEU A 20 4.869 4.343 -6.677 1.00 0.00 C ATOM 317 CG LEU A 20 4.984 3.535 -7.968 1.00 0.00 C ATOM 318 CD1 LEU A 20 4.963 4.449 -9.184 1.00 0.00 C ATOM 319 CD2 LEU A 20 6.248 2.701 -7.954 1.00 0.00 C ATOM 0 H LEU A 20 2.781 3.131 -6.045 1.00 0.00 H new ATOM 0 HA LEU A 20 5.567 2.804 -5.350 1.00 0.00 H new ATOM 0 HB2 LEU A 20 4.003 5.000 -6.753 1.00 0.00 H new ATOM 0 HB3 LEU A 20 5.747 4.983 -6.587 1.00 0.00 H new ATOM 0 HG LEU A 20 4.125 2.868 -8.032 1.00 0.00 H new ATOM 0 HD11 LEU A 20 5.046 3.850 -10.091 1.00 0.00 H new ATOM 0 HD12 LEU A 20 4.027 5.008 -9.203 1.00 0.00 H new ATOM 0 HD13 LEU A 20 5.800 5.145 -9.131 1.00 0.00 H new ATOM 0 HD21 LEU A 20 6.317 2.130 -8.880 1.00 0.00 H new ATOM 0 HD22 LEU A 20 7.115 3.356 -7.865 1.00 0.00 H new ATOM 0 HD23 LEU A 20 6.223 2.016 -7.106 1.00 0.00 H new ATOM 331 N ASP A 21 3.778 5.190 -3.868 1.00 0.00 N ATOM 332 CA ASP A 21 3.734 6.013 -2.670 1.00 0.00 C ATOM 333 C ASP A 21 3.987 5.166 -1.434 1.00 0.00 C ATOM 334 O ASP A 21 4.704 5.568 -0.515 1.00 0.00 O ATOM 335 CB ASP A 21 2.405 6.727 -2.530 1.00 0.00 C ATOM 336 CG ASP A 21 1.779 7.174 -3.831 1.00 0.00 C ATOM 337 OD1 ASP A 21 0.573 6.934 -4.028 1.00 0.00 O ATOM 338 OD2 ASP A 21 2.482 7.826 -4.636 1.00 0.00 O ATOM 0 H ASP A 21 2.948 5.264 -4.457 1.00 0.00 H new ATOM 0 HA ASP A 21 4.518 6.764 -2.764 1.00 0.00 H new ATOM 0 HB2 ASP A 21 1.707 6.066 -2.017 1.00 0.00 H new ATOM 0 HB3 ASP A 21 2.544 7.600 -1.893 1.00 0.00 H new ATOM 343 N ILE A 22 3.413 3.977 -1.441 1.00 0.00 N ATOM 344 CA ILE A 22 3.587 3.026 -0.352 1.00 0.00 C ATOM 345 C ILE A 22 5.032 2.533 -0.276 1.00 0.00 C ATOM 346 O ILE A 22 5.589 2.383 0.808 1.00 0.00 O ATOM 347 CB ILE A 22 2.619 1.829 -0.492 1.00 0.00 C ATOM 348 CG1 ILE A 22 1.179 2.264 -0.217 1.00 0.00 C ATOM 349 CG2 ILE A 22 3.002 0.712 0.456 1.00 0.00 C ATOM 350 CD1 ILE A 22 0.161 1.219 -0.602 1.00 0.00 C ATOM 0 H ILE A 22 2.815 3.642 -2.197 1.00 0.00 H new ATOM 0 HA ILE A 22 3.352 3.548 0.576 1.00 0.00 H new ATOM 0 HB ILE A 22 2.690 1.462 -1.516 1.00 0.00 H new ATOM 0 HG12 ILE A 22 1.071 2.494 0.843 1.00 0.00 H new ATOM 0 HG13 ILE A 22 0.972 3.183 -0.765 1.00 0.00 H new ATOM 0 HG21 ILE A 22 2.306 -0.119 0.339 1.00 0.00 H new ATOM 0 HG22 ILE A 22 4.013 0.373 0.230 1.00 0.00 H new ATOM 0 HG23 ILE A 22 2.963 1.076 1.483 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -0.841 1.588 -0.382 1.00 0.00 H new ATOM 0 HD12 ILE A 22 0.243 1.006 -1.668 1.00 0.00 H new ATOM 0 HD13 ILE A 22 0.344 0.306 -0.035 1.00 0.00 H new ATOM 362 N ASN A 23 5.649 2.306 -1.425 1.00 0.00 N ATOM 363 CA ASN A 23 7.018 1.808 -1.455 1.00 0.00 C ATOM 364 C ASN A 23 8.027 2.927 -1.177 1.00 0.00 C ATOM 365 O ASN A 23 9.198 2.656 -0.898 1.00 0.00 O ATOM 366 CB ASN A 23 7.315 1.090 -2.786 1.00 0.00 C ATOM 367 CG ASN A 23 8.081 1.923 -3.806 1.00 0.00 C ATOM 368 OD1 ASN A 23 7.501 2.601 -4.649 1.00 0.00 O ATOM 369 ND2 ASN A 23 9.396 1.846 -3.755 1.00 0.00 N ATOM 0 H ASN A 23 5.229 2.457 -2.342 1.00 0.00 H new ATOM 0 HA ASN A 23 7.125 1.075 -0.655 1.00 0.00 H new ATOM 0 HB2 ASN A 23 7.886 0.186 -2.575 1.00 0.00 H new ATOM 0 HB3 ASN A 23 6.371 0.775 -3.231 1.00 0.00 H new ATOM 0 HD21 ASN A 23 9.963 2.359 -4.429 1.00 0.00 H new ATOM 0 HD22 ASN A 23 9.846 1.273 -3.041 1.00 0.00 H new ATOM 376 N LYS A 24 7.574 4.181 -1.247 1.00 0.00 N ATOM 377 CA LYS A 24 8.407 5.321 -0.865 1.00 0.00 C ATOM 378 C LYS A 24 8.659 5.323 0.633 1.00 0.00 C ATOM 379 O LYS A 24 9.695 5.800 1.099 1.00 0.00 O ATOM 380 CB LYS A 24 7.745 6.639 -1.245 1.00 0.00 C ATOM 381 CG LYS A 24 7.621 6.856 -2.736 1.00 0.00 C ATOM 382 CD LYS A 24 6.839 8.120 -3.040 1.00 0.00 C ATOM 383 CE LYS A 24 6.297 8.120 -4.454 1.00 0.00 C ATOM 384 NZ LYS A 24 7.378 8.190 -5.471 1.00 0.00 N ATOM 0 H LYS A 24 6.637 4.431 -1.564 1.00 0.00 H new ATOM 0 HA LYS A 24 9.351 5.223 -1.401 1.00 0.00 H new ATOM 0 HB2 LYS A 24 6.751 6.677 -0.799 1.00 0.00 H new ATOM 0 HB3 LYS A 24 8.319 7.460 -0.815 1.00 0.00 H new ATOM 0 HG2 LYS A 24 8.614 6.923 -3.181 1.00 0.00 H new ATOM 0 HG3 LYS A 24 7.125 5.999 -3.191 1.00 0.00 H new ATOM 0 HD2 LYS A 24 6.014 8.215 -2.334 1.00 0.00 H new ATOM 0 HD3 LYS A 24 7.482 8.988 -2.897 1.00 0.00 H new ATOM 0 HE2 LYS A 24 5.707 7.217 -4.615 1.00 0.00 H new ATOM 0 HE3 LYS A 24 5.624 8.968 -4.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 6.960 8.187 -6.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 7.926 9.064 -5.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 8.006 7.368 -5.367 1.00 0.00 H new ATOM 398 N LEU A 25 7.689 4.813 1.383 1.00 0.00 N ATOM 399 CA LEU A 25 7.792 4.747 2.825 1.00 0.00 C ATOM 400 C LEU A 25 9.027 3.965 3.246 1.00 0.00 C ATOM 401 O LEU A 25 9.460 3.040 2.558 1.00 0.00 O ATOM 402 CB LEU A 25 6.567 4.058 3.418 1.00 0.00 C ATOM 403 CG LEU A 25 5.212 4.549 2.935 1.00 0.00 C ATOM 404 CD1 LEU A 25 4.138 3.629 3.476 1.00 0.00 C ATOM 405 CD2 LEU A 25 4.957 5.975 3.395 1.00 0.00 C ATOM 0 H LEU A 25 6.818 4.438 1.007 1.00 0.00 H new ATOM 0 HA LEU A 25 7.861 5.771 3.193 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.639 2.991 3.205 1.00 0.00 H new ATOM 0 HB3 LEU A 25 6.604 4.170 4.502 1.00 0.00 H new ATOM 0 HG LEU A 25 5.196 4.541 1.845 1.00 0.00 H new ATOM 0 HD11 LEU A 25 3.161 3.971 3.136 1.00 0.00 H new ATOM 0 HD12 LEU A 25 4.313 2.615 3.116 1.00 0.00 H new ATOM 0 HD13 LEU A 25 4.167 3.638 4.566 1.00 0.00 H new ATOM 0 HD21 LEU A 25 3.981 6.304 3.037 1.00 0.00 H new ATOM 0 HD22 LEU A 25 4.976 6.015 4.484 1.00 0.00 H new ATOM 0 HD23 LEU A 25 5.730 6.630 2.994 1.00 0.00 H new ATOM 417 N PRO A 26 9.630 4.360 4.365 1.00 0.00 N ATOM 418 CA PRO A 26 10.657 3.555 5.017 1.00 0.00 C ATOM 419 C PRO A 26 10.101 2.187 5.411 1.00 0.00 C ATOM 420 O PRO A 26 8.887 2.049 5.600 1.00 0.00 O ATOM 421 CB PRO A 26 11.042 4.354 6.263 1.00 0.00 C ATOM 422 CG PRO A 26 10.447 5.718 6.097 1.00 0.00 C ATOM 423 CD PRO A 26 9.373 5.635 5.046 1.00 0.00 C ATOM 0 HA PRO A 26 11.509 3.368 4.364 1.00 0.00 H new ATOM 0 HB2 PRO A 26 10.663 3.873 7.164 1.00 0.00 H new ATOM 0 HB3 PRO A 26 12.126 4.414 6.366 1.00 0.00 H new ATOM 0 HG2 PRO A 26 10.030 6.069 7.041 1.00 0.00 H new ATOM 0 HG3 PRO A 26 11.214 6.434 5.802 1.00 0.00 H new ATOM 0 HD2 PRO A 26 8.378 5.655 5.491 1.00 0.00 H new ATOM 0 HD3 PRO A 26 9.429 6.474 4.353 1.00 0.00 H new ATOM 431 N GLY A 27 10.977 1.190 5.527 1.00 0.00 N ATOM 432 CA GLY A 27 10.547 -0.187 5.767 1.00 0.00 C ATOM 433 C GLY A 27 9.502 -0.315 6.861 1.00 0.00 C ATOM 434 O GLY A 27 8.482 -0.985 6.677 1.00 0.00 O ATOM 0 H GLY A 27 11.988 1.310 5.459 1.00 0.00 H new ATOM 0 HA2 GLY A 27 10.145 -0.600 4.842 1.00 0.00 H new ATOM 0 HA3 GLY A 27 11.416 -0.789 6.034 1.00 0.00 H new ATOM 438 N GLU A 28 9.746 0.355 7.983 1.00 0.00 N ATOM 439 CA GLU A 28 8.833 0.336 9.124 1.00 0.00 C ATOM 440 C GLU A 28 7.416 0.744 8.713 1.00 0.00 C ATOM 441 O GLU A 28 6.424 0.169 9.168 1.00 0.00 O ATOM 442 CB GLU A 28 9.343 1.294 10.204 1.00 0.00 C ATOM 443 CG GLU A 28 8.536 1.261 11.489 1.00 0.00 C ATOM 444 CD GLU A 28 8.717 -0.035 12.253 1.00 0.00 C ATOM 445 OE1 GLU A 28 9.645 -0.113 13.087 1.00 0.00 O ATOM 446 OE2 GLU A 28 7.932 -0.981 12.027 1.00 0.00 O ATOM 0 H GLU A 28 10.579 0.925 8.128 1.00 0.00 H new ATOM 0 HA GLU A 28 8.797 -0.682 9.511 1.00 0.00 H new ATOM 0 HB2 GLU A 28 10.380 1.049 10.432 1.00 0.00 H new ATOM 0 HB3 GLU A 28 9.335 2.309 9.808 1.00 0.00 H new ATOM 0 HG2 GLU A 28 8.832 2.097 12.122 1.00 0.00 H new ATOM 0 HG3 GLU A 28 7.480 1.397 11.255 1.00 0.00 H new ATOM 453 N LYS A 29 7.329 1.718 7.825 1.00 0.00 N ATOM 454 CA LYS A 29 6.050 2.291 7.460 1.00 0.00 C ATOM 455 C LYS A 29 5.266 1.381 6.523 1.00 0.00 C ATOM 456 O LYS A 29 4.038 1.418 6.506 1.00 0.00 O ATOM 457 CB LYS A 29 6.231 3.677 6.846 1.00 0.00 C ATOM 458 CG LYS A 29 6.478 4.809 7.859 1.00 0.00 C ATOM 459 CD LYS A 29 5.869 4.566 9.234 1.00 0.00 C ATOM 460 CE LYS A 29 6.230 5.699 10.176 1.00 0.00 C ATOM 461 NZ LYS A 29 6.075 7.033 9.536 1.00 0.00 N ATOM 0 H LYS A 29 8.130 2.127 7.344 1.00 0.00 H new ATOM 0 HA LYS A 29 5.467 2.393 8.376 1.00 0.00 H new ATOM 0 HB2 LYS A 29 7.069 3.643 6.150 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.342 3.919 6.263 1.00 0.00 H new ATOM 0 HG2 LYS A 29 7.553 4.952 7.971 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.074 5.737 7.455 1.00 0.00 H new ATOM 0 HD2 LYS A 29 4.785 4.485 9.150 1.00 0.00 H new ATOM 0 HD3 LYS A 29 6.230 3.620 9.637 1.00 0.00 H new ATOM 0 HE2 LYS A 29 5.598 5.648 11.062 1.00 0.00 H new ATOM 0 HE3 LYS A 29 7.260 5.576 10.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 5.845 7.742 10.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 6.963 7.297 9.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 5.308 6.994 8.834 1.00 0.00 H new ATOM 475 N LEU A 30 5.943 0.539 5.760 1.00 0.00 N ATOM 476 CA LEU A 30 5.217 -0.440 4.959 1.00 0.00 C ATOM 477 C LEU A 30 4.643 -1.528 5.863 1.00 0.00 C ATOM 478 O LEU A 30 3.783 -2.303 5.451 1.00 0.00 O ATOM 479 CB LEU A 30 6.071 -1.072 3.859 1.00 0.00 C ATOM 480 CG LEU A 30 6.473 -0.162 2.708 1.00 0.00 C ATOM 481 CD1 LEU A 30 7.865 0.378 2.918 1.00 0.00 C ATOM 482 CD2 LEU A 30 6.396 -0.910 1.386 1.00 0.00 C ATOM 0 H LEU A 30 6.959 0.509 5.676 1.00 0.00 H new ATOM 0 HA LEU A 30 4.412 0.098 4.459 1.00 0.00 H new ATOM 0 HB2 LEU A 30 6.979 -1.467 4.316 1.00 0.00 H new ATOM 0 HB3 LEU A 30 5.525 -1.922 3.448 1.00 0.00 H new ATOM 0 HG LEU A 30 5.776 0.676 2.678 1.00 0.00 H new ATOM 0 HD11 LEU A 30 8.133 1.026 2.084 1.00 0.00 H new ATOM 0 HD12 LEU A 30 7.898 0.948 3.846 1.00 0.00 H new ATOM 0 HD13 LEU A 30 8.572 -0.450 2.976 1.00 0.00 H new ATOM 0 HD21 LEU A 30 6.687 -0.244 0.574 1.00 0.00 H new ATOM 0 HD22 LEU A 30 7.070 -1.766 1.412 1.00 0.00 H new ATOM 0 HD23 LEU A 30 5.376 -1.257 1.223 1.00 0.00 H new ATOM 494 N GLY A 31 5.108 -1.566 7.107 1.00 0.00 N ATOM 495 CA GLY A 31 4.555 -2.490 8.081 1.00 0.00 C ATOM 496 C GLY A 31 3.112 -2.164 8.406 1.00 0.00 C ATOM 497 O GLY A 31 2.369 -3.000 8.916 1.00 0.00 O ATOM 0 H GLY A 31 5.859 -0.973 7.459 1.00 0.00 H new ATOM 0 HA2 GLY A 31 4.620 -3.507 7.695 1.00 0.00 H new ATOM 0 HA3 GLY A 31 5.150 -2.456 8.994 1.00 0.00 H new ATOM 501 N ARG A 32 2.724 -0.940 8.098 1.00 0.00 N ATOM 502 CA ARG A 32 1.351 -0.492 8.284 1.00 0.00 C ATOM 503 C ARG A 32 0.445 -0.959 7.139 1.00 0.00 C ATOM 504 O ARG A 32 -0.607 -1.540 7.381 1.00 0.00 O ATOM 505 CB ARG A 32 1.308 1.028 8.392 1.00 0.00 C ATOM 506 CG ARG A 32 -0.078 1.608 8.152 1.00 0.00 C ATOM 507 CD ARG A 32 -0.806 1.903 9.443 1.00 0.00 C ATOM 508 NE ARG A 32 -0.101 2.874 10.273 1.00 0.00 N ATOM 509 CZ ARG A 32 -0.615 3.411 11.374 1.00 0.00 C ATOM 510 NH1 ARG A 32 -1.833 3.064 11.774 1.00 0.00 N ATOM 511 NH2 ARG A 32 0.087 4.292 12.073 1.00 0.00 N ATOM 0 H ARG A 32 3.346 -0.229 7.713 1.00 0.00 H new ATOM 0 HA ARG A 32 0.979 -0.934 9.208 1.00 0.00 H new ATOM 0 HB2 ARG A 32 1.652 1.325 9.383 1.00 0.00 H new ATOM 0 HB3 ARG A 32 2.004 1.457 7.671 1.00 0.00 H new ATOM 0 HG2 ARG A 32 0.010 2.525 7.569 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -0.665 0.908 7.558 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -1.803 2.280 9.216 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -0.935 0.977 10.003 1.00 0.00 H new ATOM 0 HE ARG A 32 0.838 3.156 9.992 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -2.373 2.386 11.236 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -2.229 3.476 12.619 1.00 0.00 H new ATOM 0 HH21 ARG A 32 1.022 4.558 11.766 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -0.308 4.704 12.918 1.00 0.00 H new ATOM 525 N VAL A 33 0.846 -0.687 5.896 1.00 0.00 N ATOM 526 CA VAL A 33 0.054 -1.088 4.725 1.00 0.00 C ATOM 527 C VAL A 33 -0.140 -2.590 4.673 1.00 0.00 C ATOM 528 O VAL A 33 -1.233 -3.052 4.362 1.00 0.00 O ATOM 529 CB VAL A 33 0.678 -0.602 3.405 1.00 0.00 C ATOM 530 CG1 VAL A 33 0.358 0.865 3.181 1.00 0.00 C ATOM 531 CG2 VAL A 33 2.175 -0.814 3.404 1.00 0.00 C ATOM 0 H VAL A 33 1.710 -0.193 5.671 1.00 0.00 H new ATOM 0 HA VAL A 33 -0.918 -0.609 4.838 1.00 0.00 H new ATOM 0 HB VAL A 33 0.249 -1.187 2.591 1.00 0.00 H new ATOM 0 HG11 VAL A 33 0.805 1.196 2.244 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -0.723 0.999 3.134 1.00 0.00 H new ATOM 0 HG13 VAL A 33 0.761 1.455 4.004 1.00 0.00 H new ATOM 0 HG21 VAL A 33 2.592 -0.462 2.460 1.00 0.00 H new ATOM 0 HG22 VAL A 33 2.622 -0.257 4.228 1.00 0.00 H new ATOM 0 HG23 VAL A 33 2.392 -1.875 3.523 1.00 0.00 H new ATOM 541 N VAL A 34 0.901 -3.356 4.992 1.00 0.00 N ATOM 542 CA VAL A 34 0.755 -4.797 5.054 1.00 0.00 C ATOM 543 C VAL A 34 -0.280 -5.154 6.114 1.00 0.00 C ATOM 544 O VAL A 34 -1.140 -5.992 5.889 1.00 0.00 O ATOM 545 CB VAL A 34 2.096 -5.524 5.329 1.00 0.00 C ATOM 546 CG1 VAL A 34 3.154 -5.095 4.333 1.00 0.00 C ATOM 547 CG2 VAL A 34 2.584 -5.290 6.745 1.00 0.00 C ATOM 0 H VAL A 34 1.835 -3.006 5.207 1.00 0.00 H new ATOM 0 HA VAL A 34 0.417 -5.139 4.076 1.00 0.00 H new ATOM 0 HB VAL A 34 1.913 -6.592 5.212 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.087 -5.618 4.545 1.00 0.00 H new ATOM 0 HG12 VAL A 34 2.823 -5.338 3.323 1.00 0.00 H new ATOM 0 HG13 VAL A 34 3.314 -4.020 4.413 1.00 0.00 H new ATOM 0 HG21 VAL A 34 3.526 -5.817 6.897 1.00 0.00 H new ATOM 0 HG22 VAL A 34 2.735 -4.223 6.906 1.00 0.00 H new ATOM 0 HG23 VAL A 34 1.842 -5.662 7.452 1.00 0.00 H new ATOM 557 N HIS A 35 -0.228 -4.452 7.241 1.00 0.00 N ATOM 558 CA HIS A 35 -1.177 -4.652 8.324 1.00 0.00 C ATOM 559 C HIS A 35 -2.593 -4.302 7.868 1.00 0.00 C ATOM 560 O HIS A 35 -3.536 -5.044 8.139 1.00 0.00 O ATOM 561 CB HIS A 35 -0.756 -3.810 9.533 1.00 0.00 C ATOM 562 CG HIS A 35 -1.727 -3.823 10.674 1.00 0.00 C ATOM 563 ND1 HIS A 35 -1.693 -4.762 11.677 1.00 0.00 N ATOM 564 CD2 HIS A 35 -2.751 -2.990 10.974 1.00 0.00 C ATOM 565 CE1 HIS A 35 -2.652 -4.510 12.545 1.00 0.00 C ATOM 566 NE2 HIS A 35 -3.309 -3.440 12.144 1.00 0.00 N ATOM 0 H HIS A 35 0.471 -3.732 7.427 1.00 0.00 H new ATOM 0 HA HIS A 35 -1.178 -5.702 8.616 1.00 0.00 H new ATOM 0 HB2 HIS A 35 0.209 -4.170 9.891 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -0.612 -2.780 9.208 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -3.069 -2.132 10.400 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -2.864 -5.084 13.435 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -4.102 -3.016 12.625 1.00 0.00 H new ATOM 575 N ILE A 36 -2.738 -3.174 7.172 1.00 0.00 N ATOM 576 CA ILE A 36 -4.032 -2.785 6.623 1.00 0.00 C ATOM 577 C ILE A 36 -4.517 -3.832 5.631 1.00 0.00 C ATOM 578 O ILE A 36 -5.533 -4.483 5.862 1.00 0.00 O ATOM 579 CB ILE A 36 -4.004 -1.411 5.911 1.00 0.00 C ATOM 580 CG1 ILE A 36 -3.703 -0.285 6.892 1.00 0.00 C ATOM 581 CG2 ILE A 36 -5.354 -1.166 5.253 1.00 0.00 C ATOM 582 CD1 ILE A 36 -3.370 1.024 6.214 1.00 0.00 C ATOM 0 H ILE A 36 -1.980 -2.520 6.977 1.00 0.00 H new ATOM 0 HA ILE A 36 -4.710 -2.708 7.473 1.00 0.00 H new ATOM 0 HB ILE A 36 -3.213 -1.425 5.161 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -4.565 -0.140 7.544 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -2.868 -0.580 7.528 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -5.343 -0.200 4.749 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -5.552 -1.953 4.525 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -6.135 -1.170 6.013 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -3.166 1.783 6.969 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -2.490 0.894 5.584 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -4.213 1.340 5.600 1.00 0.00 H new ATOM 594 N ILE A 37 -3.778 -3.995 4.540 1.00 0.00 N ATOM 595 CA ILE A 37 -4.136 -4.950 3.502 1.00 0.00 C ATOM 596 C ILE A 37 -4.454 -6.333 4.082 1.00 0.00 C ATOM 597 O ILE A 37 -5.513 -6.870 3.821 1.00 0.00 O ATOM 598 CB ILE A 37 -3.032 -5.075 2.444 1.00 0.00 C ATOM 599 CG1 ILE A 37 -3.068 -3.883 1.501 1.00 0.00 C ATOM 600 CG2 ILE A 37 -3.195 -6.361 1.666 1.00 0.00 C ATOM 601 CD1 ILE A 37 -1.743 -3.190 1.357 1.00 0.00 C ATOM 0 H ILE A 37 -2.922 -3.474 4.352 1.00 0.00 H new ATOM 0 HA ILE A 37 -5.036 -4.562 3.025 1.00 0.00 H new ATOM 0 HB ILE A 37 -2.066 -5.092 2.949 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -3.402 -4.217 0.519 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -3.806 -3.167 1.862 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -2.405 -6.437 0.919 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -3.132 -7.209 2.348 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -4.165 -6.366 1.170 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -1.844 -2.350 0.670 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -1.416 -2.825 2.330 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -1.006 -3.892 0.966 1.00 0.00 H new ATOM 613 N GLN A 38 -3.552 -6.891 4.888 1.00 0.00 N ATOM 614 CA GLN A 38 -3.746 -8.237 5.442 1.00 0.00 C ATOM 615 C GLN A 38 -5.044 -8.340 6.249 1.00 0.00 C ATOM 616 O GLN A 38 -5.762 -9.335 6.154 1.00 0.00 O ATOM 617 CB GLN A 38 -2.566 -8.625 6.335 1.00 0.00 C ATOM 618 CG GLN A 38 -1.299 -8.972 5.573 1.00 0.00 C ATOM 619 CD GLN A 38 -0.068 -8.977 6.461 1.00 0.00 C ATOM 620 OE1 GLN A 38 0.007 -8.256 7.454 1.00 0.00 O ATOM 621 NE2 GLN A 38 0.911 -9.790 6.108 1.00 0.00 N ATOM 0 H GLN A 38 -2.684 -6.438 5.173 1.00 0.00 H new ATOM 0 HA GLN A 38 -3.811 -8.923 4.598 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -2.353 -7.801 7.016 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -2.854 -9.479 6.948 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -1.414 -9.953 5.112 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -1.157 -8.254 4.765 1.00 0.00 H new ATOM 0 HE21 GLN A 38 0.814 -10.374 5.278 1.00 0.00 H new ATOM 0 HE22 GLN A 38 1.764 -9.834 6.666 1.00 0.00 H new ATOM 630 N SER A 39 -5.336 -7.320 7.051 1.00 0.00 N ATOM 631 CA SER A 39 -6.532 -7.318 7.876 1.00 0.00 C ATOM 632 C SER A 39 -7.794 -7.160 7.030 1.00 0.00 C ATOM 633 O SER A 39 -8.833 -7.761 7.314 1.00 0.00 O ATOM 634 CB SER A 39 -6.453 -6.196 8.912 1.00 0.00 C ATOM 635 OG SER A 39 -6.382 -4.915 8.303 1.00 0.00 O ATOM 0 H SER A 39 -4.758 -6.485 7.145 1.00 0.00 H new ATOM 0 HA SER A 39 -6.588 -8.279 8.387 1.00 0.00 H new ATOM 0 HB2 SER A 39 -7.327 -6.241 9.562 1.00 0.00 H new ATOM 0 HB3 SER A 39 -5.577 -6.346 9.544 1.00 0.00 H new ATOM 0 HG SER A 39 -6.034 -5.005 7.391 1.00 0.00 H new ATOM 641 N ARG A 40 -7.689 -6.345 5.994 1.00 0.00 N ATOM 642 CA ARG A 40 -8.817 -6.052 5.122 1.00 0.00 C ATOM 643 C ARG A 40 -8.996 -7.156 4.082 1.00 0.00 C ATOM 644 O ARG A 40 -10.107 -7.420 3.623 1.00 0.00 O ATOM 645 CB ARG A 40 -8.605 -4.691 4.446 1.00 0.00 C ATOM 646 CG ARG A 40 -8.374 -3.556 5.436 1.00 0.00 C ATOM 647 CD ARG A 40 -9.238 -2.353 5.123 1.00 0.00 C ATOM 648 NE ARG A 40 -10.660 -2.698 5.077 1.00 0.00 N ATOM 649 CZ ARG A 40 -11.648 -1.825 5.252 1.00 0.00 C ATOM 650 NH1 ARG A 40 -11.374 -0.553 5.517 1.00 0.00 N ATOM 651 NH2 ARG A 40 -12.911 -2.231 5.179 1.00 0.00 N ATOM 0 H ARG A 40 -6.825 -5.869 5.733 1.00 0.00 H new ATOM 0 HA ARG A 40 -9.728 -6.009 5.720 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -7.750 -4.757 3.773 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -9.476 -4.458 3.833 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -8.589 -3.905 6.446 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -7.324 -3.264 5.416 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -9.076 -1.583 5.878 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -8.936 -1.929 4.165 1.00 0.00 H new ATOM 0 HE ARG A 40 -10.909 -3.671 4.899 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -10.404 -0.244 5.587 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -12.133 0.115 5.651 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -13.122 -3.211 4.989 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -13.670 -1.563 5.313 1.00 0.00 H new ATOM 665 N GLU A 41 -7.896 -7.806 3.735 1.00 0.00 N ATOM 666 CA GLU A 41 -7.888 -8.874 2.746 1.00 0.00 C ATOM 667 C GLU A 41 -7.447 -10.187 3.397 1.00 0.00 C ATOM 668 O GLU A 41 -6.269 -10.548 3.338 1.00 0.00 O ATOM 669 CB GLU A 41 -6.926 -8.527 1.610 1.00 0.00 C ATOM 670 CG GLU A 41 -7.095 -7.114 1.070 1.00 0.00 C ATOM 671 CD GLU A 41 -8.399 -6.922 0.322 1.00 0.00 C ATOM 672 OE1 GLU A 41 -9.046 -5.868 0.503 1.00 0.00 O ATOM 673 OE2 GLU A 41 -8.791 -7.821 -0.449 1.00 0.00 O ATOM 0 H GLU A 41 -6.978 -7.607 4.133 1.00 0.00 H new ATOM 0 HA GLU A 41 -8.896 -8.988 2.346 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -5.902 -8.651 1.963 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -7.070 -9.237 0.795 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -7.049 -6.406 1.897 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -6.263 -6.882 0.405 1.00 0.00 H new ATOM 680 N PRO A 42 -8.383 -10.924 4.026 1.00 0.00 N ATOM 681 CA PRO A 42 -8.076 -12.174 4.748 1.00 0.00 C ATOM 682 C PRO A 42 -7.461 -13.272 3.871 1.00 0.00 C ATOM 683 O PRO A 42 -7.118 -14.347 4.362 1.00 0.00 O ATOM 684 CB PRO A 42 -9.440 -12.640 5.268 1.00 0.00 C ATOM 685 CG PRO A 42 -10.301 -11.426 5.258 1.00 0.00 C ATOM 686 CD PRO A 42 -9.815 -10.582 4.113 1.00 0.00 C ATOM 0 HA PRO A 42 -7.330 -11.989 5.520 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -9.856 -13.422 4.633 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -9.357 -13.055 6.273 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -11.350 -11.693 5.128 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -10.224 -10.885 6.201 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -10.342 -10.816 3.188 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -9.964 -9.519 4.304 1.00 0.00 H new ATOM 694 N SER A 43 -7.310 -12.999 2.584 1.00 0.00 N ATOM 695 CA SER A 43 -6.830 -13.995 1.642 1.00 0.00 C ATOM 696 C SER A 43 -5.304 -14.030 1.610 1.00 0.00 C ATOM 697 O SER A 43 -4.710 -15.019 1.179 1.00 0.00 O ATOM 698 CB SER A 43 -7.379 -13.690 0.238 1.00 0.00 C ATOM 699 OG SER A 43 -7.070 -14.730 -0.676 1.00 0.00 O ATOM 0 H SER A 43 -7.515 -12.091 2.168 1.00 0.00 H new ATOM 0 HA SER A 43 -7.185 -14.973 1.966 1.00 0.00 H new ATOM 0 HB2 SER A 43 -8.460 -13.558 0.289 1.00 0.00 H new ATOM 0 HB3 SER A 43 -6.960 -12.751 -0.122 1.00 0.00 H new ATOM 0 HG SER A 43 -7.433 -14.508 -1.559 1.00 0.00 H new ATOM 705 N LEU A 44 -4.669 -12.965 2.082 1.00 0.00 N ATOM 706 CA LEU A 44 -3.222 -12.841 1.956 1.00 0.00 C ATOM 707 C LEU A 44 -2.521 -12.776 3.309 1.00 0.00 C ATOM 708 O LEU A 44 -1.418 -12.241 3.423 1.00 0.00 O ATOM 709 CB LEU A 44 -2.877 -11.626 1.090 1.00 0.00 C ATOM 710 CG LEU A 44 -3.496 -10.301 1.514 1.00 0.00 C ATOM 711 CD1 LEU A 44 -2.583 -9.580 2.480 1.00 0.00 C ATOM 712 CD2 LEU A 44 -3.782 -9.445 0.291 1.00 0.00 C ATOM 0 H LEU A 44 -5.126 -12.183 2.550 1.00 0.00 H new ATOM 0 HA LEU A 44 -2.853 -13.742 1.466 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -1.793 -11.510 1.079 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -3.186 -11.836 0.066 1.00 0.00 H new ATOM 0 HG LEU A 44 -4.439 -10.496 2.024 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -3.039 -8.635 2.774 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -2.427 -10.198 3.364 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -1.624 -9.387 1.999 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -4.225 -8.499 0.604 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -2.852 -9.251 -0.243 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -4.475 -9.970 -0.366 1.00 0.00 H new ATOM 724 N LYS A 45 -3.135 -13.359 4.330 1.00 0.00 N ATOM 725 CA LYS A 45 -2.526 -13.370 5.658 1.00 0.00 C ATOM 726 C LYS A 45 -1.452 -14.451 5.747 1.00 0.00 C ATOM 727 O LYS A 45 -0.768 -14.579 6.763 1.00 0.00 O ATOM 728 CB LYS A 45 -3.581 -13.552 6.755 1.00 0.00 C ATOM 729 CG LYS A 45 -4.412 -14.815 6.618 1.00 0.00 C ATOM 730 CD LYS A 45 -5.726 -14.726 7.380 1.00 0.00 C ATOM 731 CE LYS A 45 -5.547 -15.013 8.862 1.00 0.00 C ATOM 732 NZ LYS A 45 -5.076 -16.402 9.107 1.00 0.00 N ATOM 0 H LYS A 45 -4.041 -13.824 4.269 1.00 0.00 H new ATOM 0 HA LYS A 45 -2.052 -12.402 5.817 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -3.083 -13.562 7.724 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -4.248 -12.690 6.749 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -4.618 -15.000 5.564 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -3.839 -15.666 6.985 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -6.152 -13.731 7.253 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -6.439 -15.434 6.957 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -4.831 -14.308 9.284 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -6.493 -14.855 9.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -5.330 -16.689 10.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -5.525 -17.046 8.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -4.043 -16.443 8.994 1.00 0.00 H new ATOM 746 N ASN A 46 -1.305 -15.220 4.669 1.00 0.00 N ATOM 747 CA ASN A 46 -0.236 -16.213 4.568 1.00 0.00 C ATOM 748 C ASN A 46 1.105 -15.512 4.381 1.00 0.00 C ATOM 749 O ASN A 46 2.152 -16.024 4.786 1.00 0.00 O ATOM 750 CB ASN A 46 -0.486 -17.187 3.385 1.00 0.00 C ATOM 751 CG ASN A 46 -0.811 -16.460 2.091 1.00 0.00 C ATOM 752 OD1 ASN A 46 0.082 -16.049 1.351 1.00 0.00 O ATOM 753 ND2 ASN A 46 -2.093 -16.316 1.797 1.00 0.00 N ATOM 0 H ASN A 46 -1.914 -15.174 3.852 1.00 0.00 H new ATOM 0 HA ASN A 46 -0.222 -16.792 5.491 1.00 0.00 H new ATOM 0 HB2 ASN A 46 0.398 -17.808 3.237 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -1.308 -17.857 3.638 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -2.369 -15.851 0.932 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -2.806 -16.670 2.435 1.00 0.00 H new ATOM 760 N SER A 47 1.060 -14.337 3.765 1.00 0.00 N ATOM 761 CA SER A 47 2.250 -13.538 3.546 1.00 0.00 C ATOM 762 C SER A 47 2.711 -12.919 4.858 1.00 0.00 C ATOM 763 O SER A 47 1.956 -12.201 5.512 1.00 0.00 O ATOM 764 CB SER A 47 1.961 -12.445 2.515 1.00 0.00 C ATOM 765 OG SER A 47 1.431 -12.998 1.320 1.00 0.00 O ATOM 0 H SER A 47 0.202 -13.917 3.407 1.00 0.00 H new ATOM 0 HA SER A 47 3.045 -14.179 3.165 1.00 0.00 H new ATOM 0 HB2 SER A 47 1.255 -11.726 2.931 1.00 0.00 H new ATOM 0 HB3 SER A 47 2.878 -11.900 2.292 1.00 0.00 H new ATOM 0 HG SER A 47 1.253 -12.279 0.678 1.00 0.00 H new ATOM 771 N ASN A 48 3.935 -13.219 5.251 1.00 0.00 N ATOM 772 CA ASN A 48 4.514 -12.638 6.458 1.00 0.00 C ATOM 773 C ASN A 48 4.860 -11.187 6.164 1.00 0.00 C ATOM 774 O ASN A 48 5.318 -10.884 5.074 1.00 0.00 O ATOM 775 CB ASN A 48 5.790 -13.386 6.856 1.00 0.00 C ATOM 776 CG ASN A 48 5.857 -13.698 8.334 1.00 0.00 C ATOM 777 OD1 ASN A 48 6.220 -12.851 9.148 1.00 0.00 O ATOM 778 ND2 ASN A 48 5.556 -14.937 8.675 1.00 0.00 N ATOM 0 H ASN A 48 4.552 -13.862 4.754 1.00 0.00 H new ATOM 0 HA ASN A 48 3.799 -12.711 7.277 1.00 0.00 H new ATOM 0 HB2 ASN A 48 5.850 -14.316 6.291 1.00 0.00 H new ATOM 0 HB3 ASN A 48 6.657 -12.787 6.577 1.00 0.00 H new ATOM 0 HD21 ASN A 48 5.620 -15.227 9.651 1.00 0.00 H new ATOM 0 HD22 ASN A 48 5.259 -15.604 7.963 1.00 0.00 H new ATOM 785 N PRO A 49 4.638 -10.263 7.114 1.00 0.00 N ATOM 786 CA PRO A 49 4.905 -8.829 6.898 1.00 0.00 C ATOM 787 C PRO A 49 6.362 -8.527 6.536 1.00 0.00 C ATOM 788 O PRO A 49 6.654 -7.476 5.978 1.00 0.00 O ATOM 789 CB PRO A 49 4.546 -8.187 8.241 1.00 0.00 C ATOM 790 CG PRO A 49 3.623 -9.158 8.896 1.00 0.00 C ATOM 791 CD PRO A 49 4.091 -10.520 8.463 1.00 0.00 C ATOM 0 HA PRO A 49 4.330 -8.447 6.054 1.00 0.00 H new ATOM 0 HB2 PRO A 49 5.435 -8.016 8.848 1.00 0.00 H new ATOM 0 HB3 PRO A 49 4.066 -7.219 8.100 1.00 0.00 H new ATOM 0 HG2 PRO A 49 3.656 -9.059 9.981 1.00 0.00 H new ATOM 0 HG3 PRO A 49 2.591 -8.984 8.592 1.00 0.00 H new ATOM 0 HD2 PRO A 49 4.848 -10.921 9.137 1.00 0.00 H new ATOM 0 HD3 PRO A 49 3.273 -11.240 8.438 1.00 0.00 H new ATOM 799 N ASP A 50 7.268 -9.452 6.840 1.00 0.00 N ATOM 800 CA ASP A 50 8.691 -9.257 6.564 1.00 0.00 C ATOM 801 C ASP A 50 9.084 -9.860 5.214 1.00 0.00 C ATOM 802 O ASP A 50 10.208 -9.681 4.742 1.00 0.00 O ATOM 803 CB ASP A 50 9.536 -9.874 7.681 1.00 0.00 C ATOM 804 CG ASP A 50 9.463 -9.083 8.972 1.00 0.00 C ATOM 805 OD1 ASP A 50 8.555 -9.343 9.787 1.00 0.00 O ATOM 806 OD2 ASP A 50 10.321 -8.195 9.177 1.00 0.00 O ATOM 0 H ASP A 50 7.043 -10.345 7.278 1.00 0.00 H new ATOM 0 HA ASP A 50 8.880 -8.184 6.522 1.00 0.00 H new ATOM 0 HB2 ASP A 50 9.199 -10.894 7.865 1.00 0.00 H new ATOM 0 HB3 ASP A 50 10.574 -9.935 7.355 1.00 0.00 H new ATOM 811 N GLU A 51 8.141 -10.563 4.611 1.00 0.00 N ATOM 812 CA GLU A 51 8.318 -11.215 3.315 1.00 0.00 C ATOM 813 C GLU A 51 7.043 -11.037 2.501 1.00 0.00 C ATOM 814 O GLU A 51 6.657 -11.889 1.697 1.00 0.00 O ATOM 815 CB GLU A 51 8.653 -12.700 3.492 1.00 0.00 C ATOM 816 CG GLU A 51 10.144 -12.991 3.560 1.00 0.00 C ATOM 817 CD GLU A 51 10.859 -12.742 2.248 1.00 0.00 C ATOM 818 OE1 GLU A 51 11.391 -11.631 2.046 1.00 0.00 O ATOM 819 OE2 GLU A 51 10.909 -13.669 1.410 1.00 0.00 O ATOM 0 H GLU A 51 7.213 -10.702 5.011 1.00 0.00 H new ATOM 0 HA GLU A 51 9.154 -10.756 2.786 1.00 0.00 H new ATOM 0 HB2 GLU A 51 8.180 -13.063 4.404 1.00 0.00 H new ATOM 0 HB3 GLU A 51 8.221 -13.261 2.664 1.00 0.00 H new ATOM 0 HG2 GLU A 51 10.594 -12.371 4.335 1.00 0.00 H new ATOM 0 HG3 GLU A 51 10.292 -14.029 3.856 1.00 0.00 H new ATOM 826 N ILE A 52 6.383 -9.920 2.768 1.00 0.00 N ATOM 827 CA ILE A 52 5.056 -9.627 2.248 1.00 0.00 C ATOM 828 C ILE A 52 5.026 -9.547 0.718 1.00 0.00 C ATOM 829 O ILE A 52 6.003 -9.158 0.074 1.00 0.00 O ATOM 830 CB ILE A 52 4.548 -8.290 2.833 1.00 0.00 C ATOM 831 CG1 ILE A 52 3.088 -8.044 2.475 1.00 0.00 C ATOM 832 CG2 ILE A 52 5.384 -7.155 2.299 1.00 0.00 C ATOM 833 CD1 ILE A 52 2.133 -9.106 2.962 1.00 0.00 C ATOM 0 H ILE A 52 6.760 -9.181 3.361 1.00 0.00 H new ATOM 0 HA ILE A 52 4.408 -10.450 2.550 1.00 0.00 H new ATOM 0 HB ILE A 52 4.632 -8.345 3.918 1.00 0.00 H new ATOM 0 HG12 ILE A 52 2.783 -7.083 2.889 1.00 0.00 H new ATOM 0 HG13 ILE A 52 3.002 -7.966 1.391 1.00 0.00 H new ATOM 0 HG21 ILE A 52 5.025 -6.213 2.712 1.00 0.00 H new ATOM 0 HG22 ILE A 52 6.425 -7.304 2.586 1.00 0.00 H new ATOM 0 HG23 ILE A 52 5.308 -7.127 1.212 1.00 0.00 H new ATOM 0 HD11 ILE A 52 1.118 -8.848 2.662 1.00 0.00 H new ATOM 0 HD12 ILE A 52 2.406 -10.068 2.528 1.00 0.00 H new ATOM 0 HD13 ILE A 52 2.184 -9.171 4.049 1.00 0.00 H new ATOM 845 N GLU A 53 3.891 -9.925 0.153 1.00 0.00 N ATOM 846 CA GLU A 53 3.636 -9.742 -1.261 1.00 0.00 C ATOM 847 C GLU A 53 2.193 -9.263 -1.438 1.00 0.00 C ATOM 848 O GLU A 53 1.258 -10.063 -1.426 1.00 0.00 O ATOM 849 CB GLU A 53 3.857 -11.064 -2.003 1.00 0.00 C ATOM 850 CG GLU A 53 4.063 -10.914 -3.501 1.00 0.00 C ATOM 851 CD GLU A 53 3.939 -12.234 -4.226 1.00 0.00 C ATOM 852 OE1 GLU A 53 2.793 -12.666 -4.483 1.00 0.00 O ATOM 853 OE2 GLU A 53 4.979 -12.847 -4.542 1.00 0.00 O ATOM 0 H GLU A 53 3.125 -10.366 0.662 1.00 0.00 H new ATOM 0 HA GLU A 53 4.319 -9.000 -1.674 1.00 0.00 H new ATOM 0 HB2 GLU A 53 4.726 -11.565 -1.577 1.00 0.00 H new ATOM 0 HB3 GLU A 53 2.998 -11.712 -1.829 1.00 0.00 H new ATOM 0 HG2 GLU A 53 3.330 -10.212 -3.899 1.00 0.00 H new ATOM 0 HG3 GLU A 53 5.048 -10.488 -3.690 1.00 0.00 H new ATOM 860 N ILE A 54 2.015 -7.955 -1.584 1.00 0.00 N ATOM 861 CA ILE A 54 0.683 -7.372 -1.702 1.00 0.00 C ATOM 862 C ILE A 54 0.297 -7.243 -3.169 1.00 0.00 C ATOM 863 O ILE A 54 1.113 -6.841 -3.995 1.00 0.00 O ATOM 864 CB ILE A 54 0.595 -5.973 -1.041 1.00 0.00 C ATOM 865 CG1 ILE A 54 0.988 -6.027 0.441 1.00 0.00 C ATOM 866 CG2 ILE A 54 -0.820 -5.423 -1.181 1.00 0.00 C ATOM 867 CD1 ILE A 54 1.249 -4.666 1.050 1.00 0.00 C ATOM 0 H ILE A 54 2.777 -7.278 -1.624 1.00 0.00 H new ATOM 0 HA ILE A 54 -0.003 -8.041 -1.183 1.00 0.00 H new ATOM 0 HB ILE A 54 1.297 -5.314 -1.552 1.00 0.00 H new ATOM 0 HG12 ILE A 54 0.193 -6.520 1.001 1.00 0.00 H new ATOM 0 HG13 ILE A 54 1.882 -6.641 0.549 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -0.876 -4.439 -0.715 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -1.075 -5.339 -2.237 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -1.523 -6.097 -0.691 1.00 0.00 H new ATOM 0 HD11 ILE A 54 1.521 -4.783 2.099 1.00 0.00 H new ATOM 0 HD12 ILE A 54 2.064 -4.178 0.515 1.00 0.00 H new ATOM 0 HD13 ILE A 54 0.349 -4.055 0.975 1.00 0.00 H new ATOM 879 N ASP A 55 -0.945 -7.579 -3.482 1.00 0.00 N ATOM 880 CA ASP A 55 -1.442 -7.486 -4.848 1.00 0.00 C ATOM 881 C ASP A 55 -2.511 -6.406 -4.943 1.00 0.00 C ATOM 882 O ASP A 55 -3.620 -6.561 -4.417 1.00 0.00 O ATOM 883 CB ASP A 55 -2.017 -8.829 -5.300 1.00 0.00 C ATOM 884 CG ASP A 55 -2.376 -8.836 -6.768 1.00 0.00 C ATOM 885 OD1 ASP A 55 -1.677 -9.510 -7.554 1.00 0.00 O ATOM 886 OD2 ASP A 55 -3.358 -8.174 -7.140 1.00 0.00 O ATOM 0 H ASP A 55 -1.630 -7.920 -2.807 1.00 0.00 H new ATOM 0 HA ASP A 55 -0.611 -7.223 -5.502 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -1.291 -9.617 -5.102 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -2.905 -9.058 -4.710 1.00 0.00 H new ATOM 891 N PHE A 56 -2.188 -5.322 -5.635 1.00 0.00 N ATOM 892 CA PHE A 56 -3.075 -4.169 -5.710 1.00 0.00 C ATOM 893 C PHE A 56 -4.304 -4.456 -6.561 1.00 0.00 C ATOM 894 O PHE A 56 -5.246 -3.664 -6.606 1.00 0.00 O ATOM 895 CB PHE A 56 -2.335 -2.952 -6.263 1.00 0.00 C ATOM 896 CG PHE A 56 -2.544 -1.752 -5.404 1.00 0.00 C ATOM 897 CD1 PHE A 56 -2.009 -1.722 -4.146 1.00 0.00 C ATOM 898 CD2 PHE A 56 -3.302 -0.683 -5.824 1.00 0.00 C ATOM 899 CE1 PHE A 56 -2.218 -0.660 -3.317 1.00 0.00 C ATOM 900 CE2 PHE A 56 -3.511 0.400 -4.992 1.00 0.00 C ATOM 901 CZ PHE A 56 -2.964 0.395 -3.737 1.00 0.00 C ATOM 0 H PHE A 56 -1.316 -5.217 -6.154 1.00 0.00 H new ATOM 0 HA PHE A 56 -3.409 -3.955 -4.695 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -1.270 -3.172 -6.331 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -2.682 -2.742 -7.275 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -1.411 -2.553 -3.803 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -3.737 -0.691 -6.812 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -1.790 -0.657 -2.325 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -4.099 1.241 -5.328 1.00 0.00 H new ATOM 0 HZ PHE A 56 -3.126 1.234 -3.077 1.00 0.00 H new ATOM 911 N GLU A 57 -4.300 -5.599 -7.215 1.00 0.00 N ATOM 912 CA GLU A 57 -5.387 -5.977 -8.087 1.00 0.00 C ATOM 913 C GLU A 57 -6.374 -6.875 -7.354 1.00 0.00 C ATOM 914 O GLU A 57 -7.424 -7.236 -7.890 1.00 0.00 O ATOM 915 CB GLU A 57 -4.835 -6.677 -9.328 1.00 0.00 C ATOM 916 CG GLU A 57 -3.961 -5.781 -10.187 1.00 0.00 C ATOM 917 CD GLU A 57 -4.761 -4.780 -10.998 1.00 0.00 C ATOM 918 OE1 GLU A 57 -5.325 -3.834 -10.409 1.00 0.00 O ATOM 919 OE2 GLU A 57 -4.824 -4.933 -12.239 1.00 0.00 O ATOM 0 H GLU A 57 -3.548 -6.286 -7.157 1.00 0.00 H new ATOM 0 HA GLU A 57 -5.919 -5.079 -8.399 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -4.256 -7.547 -9.018 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -5.667 -7.045 -9.929 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -3.259 -5.245 -9.548 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -3.369 -6.399 -10.863 1.00 0.00 H new ATOM 926 N THR A 58 -6.036 -7.235 -6.125 1.00 0.00 N ATOM 927 CA THR A 58 -6.893 -8.087 -5.328 1.00 0.00 C ATOM 928 C THR A 58 -7.533 -7.311 -4.187 1.00 0.00 C ATOM 929 O THR A 58 -8.586 -7.697 -3.684 1.00 0.00 O ATOM 930 CB THR A 58 -6.110 -9.282 -4.757 1.00 0.00 C ATOM 931 OG1 THR A 58 -5.063 -8.824 -3.890 1.00 0.00 O ATOM 932 CG2 THR A 58 -5.510 -10.104 -5.881 1.00 0.00 C ATOM 0 H THR A 58 -5.174 -6.948 -5.662 1.00 0.00 H new ATOM 0 HA THR A 58 -7.678 -8.459 -5.987 1.00 0.00 H new ATOM 0 HB THR A 58 -6.801 -9.903 -4.187 1.00 0.00 H new ATOM 0 HG1 THR A 58 -4.651 -8.021 -4.271 1.00 0.00 H new ATOM 0 HG21 THR A 58 -4.959 -10.946 -5.462 1.00 0.00 H new ATOM 0 HG22 THR A 58 -6.307 -10.476 -6.525 1.00 0.00 H new ATOM 0 HG23 THR A 58 -4.832 -9.482 -6.465 1.00 0.00 H new ATOM 940 N LEU A 59 -6.898 -6.209 -3.795 1.00 0.00 N ATOM 941 CA LEU A 59 -7.376 -5.411 -2.669 1.00 0.00 C ATOM 942 C LEU A 59 -8.721 -4.783 -2.984 1.00 0.00 C ATOM 943 O LEU A 59 -8.957 -4.330 -4.105 1.00 0.00 O ATOM 944 CB LEU A 59 -6.379 -4.306 -2.333 1.00 0.00 C ATOM 945 CG LEU A 59 -4.917 -4.740 -2.298 1.00 0.00 C ATOM 946 CD1 LEU A 59 -4.015 -3.555 -2.015 1.00 0.00 C ATOM 947 CD2 LEU A 59 -4.717 -5.808 -1.249 1.00 0.00 C ATOM 0 H LEU A 59 -6.053 -5.849 -4.239 1.00 0.00 H new ATOM 0 HA LEU A 59 -7.482 -6.078 -1.814 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -6.487 -3.506 -3.066 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -6.640 -3.886 -1.362 1.00 0.00 H new ATOM 0 HG LEU A 59 -4.654 -5.148 -3.274 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -2.976 -3.885 -1.994 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.142 -2.806 -2.797 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.277 -3.120 -1.050 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -3.670 -6.110 -1.233 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -4.996 -5.415 -0.272 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -5.340 -6.671 -1.485 1.00 0.00 H new ATOM 959 N LYS A 60 -9.600 -4.764 -1.998 1.00 0.00 N ATOM 960 CA LYS A 60 -10.896 -4.136 -2.150 1.00 0.00 C ATOM 961 C LYS A 60 -10.742 -2.611 -2.050 1.00 0.00 C ATOM 962 O LYS A 60 -9.877 -2.133 -1.309 1.00 0.00 O ATOM 963 CB LYS A 60 -11.864 -4.689 -1.093 1.00 0.00 C ATOM 964 CG LYS A 60 -11.681 -4.129 0.306 1.00 0.00 C ATOM 965 CD LYS A 60 -12.687 -4.739 1.277 1.00 0.00 C ATOM 966 CE LYS A 60 -12.199 -6.051 1.890 1.00 0.00 C ATOM 967 NZ LYS A 60 -11.568 -6.962 0.896 1.00 0.00 N ATOM 0 H LYS A 60 -9.437 -5.179 -1.081 1.00 0.00 H new ATOM 0 HA LYS A 60 -11.313 -4.364 -3.131 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -12.885 -4.487 -1.417 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -11.751 -5.772 -1.051 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -10.668 -4.331 0.653 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -11.801 -3.046 0.286 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -12.894 -4.025 2.075 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -13.628 -4.915 0.755 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -11.480 -5.831 2.679 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -13.041 -6.561 2.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -11.273 -7.840 1.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -12.253 -7.185 0.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -10.736 -6.498 0.478 1.00 0.00 H new ATOM 981 N PRO A 61 -11.535 -1.841 -2.838 1.00 0.00 N ATOM 982 CA PRO A 61 -11.489 -0.371 -2.878 1.00 0.00 C ATOM 983 C PRO A 61 -11.138 0.294 -1.548 1.00 0.00 C ATOM 984 O PRO A 61 -10.244 1.140 -1.493 1.00 0.00 O ATOM 985 CB PRO A 61 -12.913 -0.011 -3.277 1.00 0.00 C ATOM 986 CG PRO A 61 -13.367 -1.130 -4.147 1.00 0.00 C ATOM 987 CD PRO A 61 -12.531 -2.345 -3.806 1.00 0.00 C ATOM 0 HA PRO A 61 -10.707 -0.024 -3.553 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -13.554 0.092 -2.401 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -12.945 0.940 -3.809 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -14.425 -1.336 -3.985 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -13.251 -0.868 -5.199 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -13.140 -3.139 -3.373 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -12.050 -2.759 -4.692 1.00 0.00 H new ATOM 995 N SER A 62 -11.832 -0.096 -0.484 1.00 0.00 N ATOM 996 CA SER A 62 -11.637 0.518 0.824 1.00 0.00 C ATOM 997 C SER A 62 -10.192 0.392 1.302 1.00 0.00 C ATOM 998 O SER A 62 -9.614 1.365 1.775 1.00 0.00 O ATOM 999 CB SER A 62 -12.604 -0.083 1.848 1.00 0.00 C ATOM 1000 OG SER A 62 -12.655 -1.495 1.738 1.00 0.00 O ATOM 0 H SER A 62 -12.535 -0.835 -0.502 1.00 0.00 H new ATOM 0 HA SER A 62 -11.852 1.582 0.724 1.00 0.00 H new ATOM 0 HB2 SER A 62 -12.291 0.195 2.854 1.00 0.00 H new ATOM 0 HB3 SER A 62 -13.601 0.332 1.698 1.00 0.00 H new ATOM 0 HG SER A 62 -13.278 -1.853 2.404 1.00 0.00 H new ATOM 1006 N THR A 63 -9.601 -0.788 1.140 1.00 0.00 N ATOM 1007 CA THR A 63 -8.220 -1.012 1.560 1.00 0.00 C ATOM 1008 C THR A 63 -7.306 -0.058 0.814 1.00 0.00 C ATOM 1009 O THR A 63 -6.552 0.684 1.426 1.00 0.00 O ATOM 1010 CB THR A 63 -7.766 -2.465 1.299 1.00 0.00 C ATOM 1011 OG1 THR A 63 -8.831 -3.370 1.625 1.00 0.00 O ATOM 1012 CG2 THR A 63 -6.540 -2.812 2.127 1.00 0.00 C ATOM 0 H THR A 63 -10.054 -1.601 0.723 1.00 0.00 H new ATOM 0 HA THR A 63 -8.164 -0.832 2.634 1.00 0.00 H new ATOM 0 HB THR A 63 -7.509 -2.557 0.244 1.00 0.00 H new ATOM 0 HG1 THR A 63 -8.687 -4.223 1.165 1.00 0.00 H new ATOM 0 HG21 THR A 63 -6.243 -3.841 1.923 1.00 0.00 H new ATOM 0 HG22 THR A 63 -5.723 -2.139 1.866 1.00 0.00 H new ATOM 0 HG23 THR A 63 -6.774 -2.705 3.186 1.00 0.00 H new ATOM 1020 N LEU A 64 -7.445 -0.041 -0.507 1.00 0.00 N ATOM 1021 CA LEU A 64 -6.611 0.787 -1.378 1.00 0.00 C ATOM 1022 C LEU A 64 -6.707 2.260 -0.998 1.00 0.00 C ATOM 1023 O LEU A 64 -5.722 2.997 -1.063 1.00 0.00 O ATOM 1024 CB LEU A 64 -7.050 0.589 -2.831 1.00 0.00 C ATOM 1025 CG LEU A 64 -7.148 -0.863 -3.264 1.00 0.00 C ATOM 1026 CD1 LEU A 64 -8.354 -1.038 -4.135 1.00 0.00 C ATOM 1027 CD2 LEU A 64 -5.914 -1.281 -4.022 1.00 0.00 C ATOM 0 H LEU A 64 -8.137 -0.599 -1.006 1.00 0.00 H new ATOM 0 HA LEU A 64 -5.572 0.481 -1.260 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -8.021 1.064 -2.972 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -6.345 1.104 -3.484 1.00 0.00 H new ATOM 0 HG LEU A 64 -7.235 -1.488 -2.375 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -8.428 -2.079 -4.448 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -9.249 -0.762 -3.577 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -8.264 -0.400 -5.014 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -6.007 -2.325 -4.322 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -5.803 -0.657 -4.909 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -5.038 -1.164 -3.384 1.00 0.00 H new ATOM 1039 N ARG A 65 -7.891 2.679 -0.590 1.00 0.00 N ATOM 1040 CA ARG A 65 -8.108 4.062 -0.200 1.00 0.00 C ATOM 1041 C ARG A 65 -7.584 4.326 1.210 1.00 0.00 C ATOM 1042 O ARG A 65 -7.218 5.457 1.539 1.00 0.00 O ATOM 1043 CB ARG A 65 -9.589 4.421 -0.296 1.00 0.00 C ATOM 1044 CG ARG A 65 -10.156 4.299 -1.706 1.00 0.00 C ATOM 1045 CD ARG A 65 -9.337 5.097 -2.711 1.00 0.00 C ATOM 1046 NE ARG A 65 -10.044 5.273 -3.980 1.00 0.00 N ATOM 1047 CZ ARG A 65 -9.881 6.326 -4.783 1.00 0.00 C ATOM 1048 NH1 ARG A 65 -9.153 7.365 -4.386 1.00 0.00 N ATOM 1049 NH2 ARG A 65 -10.479 6.360 -5.967 1.00 0.00 N ATOM 0 H ARG A 65 -8.716 2.084 -0.520 1.00 0.00 H new ATOM 0 HA ARG A 65 -7.551 4.696 -0.890 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -10.156 3.772 0.372 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -9.730 5.443 0.056 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -10.174 3.250 -2.002 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -11.188 4.651 -1.716 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -9.099 6.074 -2.290 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -8.390 4.589 -2.891 1.00 0.00 H new ATOM 0 HE ARG A 65 -10.701 4.547 -4.268 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -8.716 7.359 -3.464 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -9.031 8.168 -5.003 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -11.065 5.580 -6.265 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -10.353 7.166 -6.579 1.00 0.00 H new ATOM 1063 N GLU A 66 -7.527 3.282 2.034 1.00 0.00 N ATOM 1064 CA GLU A 66 -6.983 3.404 3.375 1.00 0.00 C ATOM 1065 C GLU A 66 -5.468 3.477 3.291 1.00 0.00 C ATOM 1066 O GLU A 66 -4.827 4.274 3.979 1.00 0.00 O ATOM 1067 CB GLU A 66 -7.400 2.199 4.214 1.00 0.00 C ATOM 1068 CG GLU A 66 -8.883 2.147 4.544 1.00 0.00 C ATOM 1069 CD GLU A 66 -9.358 3.359 5.313 1.00 0.00 C ATOM 1070 OE1 GLU A 66 -9.997 4.246 4.711 1.00 0.00 O ATOM 1071 OE2 GLU A 66 -9.098 3.432 6.529 1.00 0.00 O ATOM 0 H GLU A 66 -7.851 2.346 1.793 1.00 0.00 H new ATOM 0 HA GLU A 66 -7.366 4.309 3.846 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -7.127 1.288 3.681 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -6.833 2.206 5.145 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -9.453 2.064 3.619 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -9.089 1.249 5.127 1.00 0.00 H new ATOM 1078 N LEU A 67 -4.916 2.627 2.429 1.00 0.00 N ATOM 1079 CA LEU A 67 -3.488 2.600 2.149 1.00 0.00 C ATOM 1080 C LEU A 67 -3.006 3.985 1.729 1.00 0.00 C ATOM 1081 O LEU A 67 -1.958 4.466 2.163 1.00 0.00 O ATOM 1082 CB LEU A 67 -3.220 1.615 1.011 1.00 0.00 C ATOM 1083 CG LEU A 67 -3.848 0.252 1.197 1.00 0.00 C ATOM 1084 CD1 LEU A 67 -3.478 -0.670 0.059 1.00 0.00 C ATOM 1085 CD2 LEU A 67 -3.448 -0.330 2.537 1.00 0.00 C ATOM 0 H LEU A 67 -5.451 1.936 1.904 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.955 2.293 3.049 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -3.589 2.046 0.080 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -2.143 1.492 0.901 1.00 0.00 H new ATOM 0 HG LEU A 67 -4.932 0.361 1.187 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -3.941 -1.644 0.215 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.831 -0.247 -0.882 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -2.395 -0.785 0.022 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -3.907 -1.311 2.659 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -2.363 -0.428 2.582 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -3.786 0.330 3.336 1.00 0.00 H new ATOM 1097 N GLU A 68 -3.808 4.615 0.878 1.00 0.00 N ATOM 1098 CA GLU A 68 -3.475 5.893 0.273 1.00 0.00 C ATOM 1099 C GLU A 68 -3.436 7.025 1.283 1.00 0.00 C ATOM 1100 O GLU A 68 -2.388 7.643 1.485 1.00 0.00 O ATOM 1101 CB GLU A 68 -4.495 6.221 -0.799 1.00 0.00 C ATOM 1102 CG GLU A 68 -4.187 7.496 -1.542 1.00 0.00 C ATOM 1103 CD GLU A 68 -4.997 8.688 -1.076 1.00 0.00 C ATOM 1104 OE1 GLU A 68 -4.406 9.767 -0.867 1.00 0.00 O ATOM 1105 OE2 GLU A 68 -6.227 8.554 -0.933 1.00 0.00 O ATOM 0 H GLU A 68 -4.714 4.248 0.588 1.00 0.00 H new ATOM 0 HA GLU A 68 -2.476 5.799 -0.154 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -4.543 5.396 -1.510 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -5.480 6.304 -0.340 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -3.127 7.723 -1.430 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -4.369 7.339 -2.605 1.00 0.00 H new ATOM 1112 N ARG A 69 -4.591 7.309 1.886 1.00 0.00 N ATOM 1113 CA ARG A 69 -4.706 8.352 2.906 1.00 0.00 C ATOM 1114 C ARG A 69 -3.633 8.174 3.959 1.00 0.00 C ATOM 1115 O ARG A 69 -3.174 9.131 4.582 1.00 0.00 O ATOM 1116 CB ARG A 69 -6.078 8.289 3.562 1.00 0.00 C ATOM 1117 CG ARG A 69 -6.266 9.345 4.626 1.00 0.00 C ATOM 1118 CD ARG A 69 -7.304 8.929 5.651 1.00 0.00 C ATOM 1119 NE ARG A 69 -6.977 7.661 6.300 1.00 0.00 N ATOM 1120 CZ ARG A 69 -7.713 6.557 6.180 1.00 0.00 C ATOM 1121 NH1 ARG A 69 -8.746 6.532 5.349 1.00 0.00 N ATOM 1122 NH2 ARG A 69 -7.402 5.472 6.874 1.00 0.00 N ATOM 0 H ARG A 69 -5.467 6.827 1.683 1.00 0.00 H new ATOM 0 HA ARG A 69 -4.579 9.323 2.427 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -6.847 8.408 2.798 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -6.219 7.303 4.006 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -5.315 9.532 5.126 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -6.570 10.282 4.159 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -7.394 9.708 6.408 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -8.276 8.844 5.165 1.00 0.00 H new ATOM 0 HE ARG A 69 -6.137 7.619 6.878 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -8.979 7.359 4.800 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -9.308 5.685 5.259 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -6.598 5.481 7.501 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -7.967 4.628 6.781 1.00 0.00 H new ATOM 1136 N TYR A 70 -3.214 6.942 4.118 1.00 0.00 N ATOM 1137 CA TYR A 70 -2.179 6.625 5.067 1.00 0.00 C ATOM 1138 C TYR A 70 -0.817 7.126 4.586 1.00 0.00 C ATOM 1139 O TYR A 70 -0.170 7.917 5.262 1.00 0.00 O ATOM 1140 CB TYR A 70 -2.113 5.123 5.312 1.00 0.00 C ATOM 1141 CG TYR A 70 -0.789 4.708 5.840 1.00 0.00 C ATOM 1142 CD1 TYR A 70 0.015 3.884 5.095 1.00 0.00 C ATOM 1143 CD2 TYR A 70 -0.317 5.192 7.053 1.00 0.00 C ATOM 1144 CE1 TYR A 70 1.254 3.541 5.530 1.00 0.00 C ATOM 1145 CE2 TYR A 70 0.930 4.848 7.508 1.00 0.00 C ATOM 1146 CZ TYR A 70 1.719 4.024 6.745 1.00 0.00 C ATOM 1147 OH TYR A 70 2.971 3.690 7.194 1.00 0.00 O ATOM 0 H TYR A 70 -3.576 6.141 3.600 1.00 0.00 H new ATOM 0 HA TYR A 70 -2.426 7.129 6.002 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -2.892 4.835 6.018 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -2.315 4.594 4.381 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -0.342 3.503 4.150 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -0.939 5.847 7.645 1.00 0.00 H new ATOM 0 HE1 TYR A 70 1.877 2.893 4.931 1.00 0.00 H new ATOM 0 HE2 TYR A 70 1.287 5.221 8.456 1.00 0.00 H new ATOM 0 HH TYR A 70 3.285 2.890 6.723 1.00 0.00 H new ATOM 1157 N VAL A 71 -0.370 6.659 3.430 1.00 0.00 N ATOM 1158 CA VAL A 71 0.962 7.008 2.959 1.00 0.00 C ATOM 1159 C VAL A 71 1.055 8.476 2.645 1.00 0.00 C ATOM 1160 O VAL A 71 2.069 9.099 2.910 1.00 0.00 O ATOM 1161 CB VAL A 71 1.390 6.199 1.733 1.00 0.00 C ATOM 1162 CG1 VAL A 71 1.384 4.737 2.072 1.00 0.00 C ATOM 1163 CG2 VAL A 71 0.483 6.441 0.544 1.00 0.00 C ATOM 0 H VAL A 71 -0.900 6.047 2.809 1.00 0.00 H new ATOM 0 HA VAL A 71 1.643 6.762 3.774 1.00 0.00 H new ATOM 0 HB VAL A 71 2.393 6.524 1.457 1.00 0.00 H new ATOM 0 HG11 VAL A 71 1.689 4.160 1.199 1.00 0.00 H new ATOM 0 HG12 VAL A 71 2.079 4.551 2.891 1.00 0.00 H new ATOM 0 HG13 VAL A 71 0.380 4.437 2.373 1.00 0.00 H new ATOM 0 HG21 VAL A 71 0.826 5.846 -0.302 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -0.537 6.154 0.800 1.00 0.00 H new ATOM 0 HG23 VAL A 71 0.507 7.498 0.278 1.00 0.00 H new ATOM 1173 N THR A 72 -0.016 9.040 2.122 1.00 0.00 N ATOM 1174 CA THR A 72 -0.028 10.446 1.814 1.00 0.00 C ATOM 1175 C THR A 72 0.129 11.244 3.115 1.00 0.00 C ATOM 1176 O THR A 72 0.653 12.348 3.114 1.00 0.00 O ATOM 1177 CB THR A 72 -1.321 10.843 1.057 1.00 0.00 C ATOM 1178 OG1 THR A 72 -1.139 12.083 0.362 1.00 0.00 O ATOM 1179 CG2 THR A 72 -2.498 10.967 2.006 1.00 0.00 C ATOM 0 H THR A 72 -0.881 8.545 1.905 1.00 0.00 H new ATOM 0 HA THR A 72 0.807 10.677 1.152 1.00 0.00 H new ATOM 0 HB THR A 72 -1.533 10.052 0.337 1.00 0.00 H new ATOM 0 HG1 THR A 72 -1.965 12.317 -0.111 1.00 0.00 H new ATOM 0 HG21 THR A 72 -3.390 11.246 1.445 1.00 0.00 H new ATOM 0 HG22 THR A 72 -2.667 10.012 2.503 1.00 0.00 H new ATOM 0 HG23 THR A 72 -2.284 11.732 2.753 1.00 0.00 H new ATOM 1187 N SER A 73 -0.261 10.636 4.238 1.00 0.00 N ATOM 1188 CA SER A 73 -0.130 11.279 5.535 1.00 0.00 C ATOM 1189 C SER A 73 1.327 11.249 5.995 1.00 0.00 C ATOM 1190 O SER A 73 1.770 12.096 6.774 1.00 0.00 O ATOM 1191 CB SER A 73 -1.034 10.589 6.563 1.00 0.00 C ATOM 1192 OG SER A 73 -0.370 9.526 7.230 1.00 0.00 O ATOM 0 H SER A 73 -0.668 9.701 4.269 1.00 0.00 H new ATOM 0 HA SER A 73 -0.442 12.319 5.445 1.00 0.00 H new ATOM 0 HB2 SER A 73 -1.373 11.321 7.296 1.00 0.00 H new ATOM 0 HB3 SER A 73 -1.923 10.204 6.063 1.00 0.00 H new ATOM 0 HG SER A 73 -0.393 8.723 6.669 1.00 0.00 H new ATOM 1198 N CYS A 74 2.065 10.260 5.498 1.00 0.00 N ATOM 1199 CA CYS A 74 3.470 10.085 5.841 1.00 0.00 C ATOM 1200 C CYS A 74 4.362 10.835 4.856 1.00 0.00 C ATOM 1201 O CYS A 74 5.397 11.394 5.225 1.00 0.00 O ATOM 1202 CB CYS A 74 3.802 8.597 5.826 1.00 0.00 C ATOM 1203 SG CYS A 74 5.467 8.191 6.406 1.00 0.00 S ATOM 0 H CYS A 74 1.706 9.560 4.848 1.00 0.00 H new ATOM 0 HA CYS A 74 3.651 10.492 6.836 1.00 0.00 H new ATOM 0 HB2 CYS A 74 3.077 8.070 6.446 1.00 0.00 H new ATOM 0 HB3 CYS A 74 3.684 8.222 4.809 1.00 0.00 H new ATOM 0 HG CYS A 74 6.248 9.216 6.235 1.00 0.00 H new ATOM 1209 N LEU A 75 3.946 10.825 3.602 1.00 0.00 N ATOM 1210 CA LEU A 75 4.704 11.439 2.515 1.00 0.00 C ATOM 1211 C LEU A 75 4.487 12.951 2.424 1.00 0.00 C ATOM 1212 O LEU A 75 5.455 13.701 2.313 1.00 0.00 O ATOM 1213 CB LEU A 75 4.329 10.767 1.195 1.00 0.00 C ATOM 1214 CG LEU A 75 4.407 9.247 1.237 1.00 0.00 C ATOM 1215 CD1 LEU A 75 3.799 8.646 -0.020 1.00 0.00 C ATOM 1216 CD2 LEU A 75 5.840 8.781 1.417 1.00 0.00 C ATOM 0 H LEU A 75 3.072 10.391 3.303 1.00 0.00 H new ATOM 0 HA LEU A 75 5.763 11.290 2.724 1.00 0.00 H new ATOM 0 HB2 LEU A 75 3.316 11.062 0.922 1.00 0.00 H new ATOM 0 HB3 LEU A 75 4.990 11.134 0.410 1.00 0.00 H new ATOM 0 HG LEU A 75 3.831 8.902 2.096 1.00 0.00 H new ATOM 0 HD11 LEU A 75 3.864 7.559 0.028 1.00 0.00 H new ATOM 0 HD12 LEU A 75 2.753 8.944 -0.097 1.00 0.00 H new ATOM 0 HD13 LEU A 75 4.343 9.003 -0.894 1.00 0.00 H new ATOM 0 HD21 LEU A 75 5.868 7.692 1.444 1.00 0.00 H new ATOM 0 HD22 LEU A 75 6.446 9.139 0.585 1.00 0.00 H new ATOM 0 HD23 LEU A 75 6.237 9.177 2.352 1.00 0.00 H new ATOM 1228 N ARG A 76 3.231 13.407 2.458 1.00 0.00 N ATOM 1229 CA ARG A 76 2.950 14.839 2.385 1.00 0.00 C ATOM 1230 C ARG A 76 3.634 15.573 3.532 1.00 0.00 C ATOM 1231 O ARG A 76 4.265 16.612 3.338 1.00 0.00 O ATOM 1232 CB ARG A 76 1.447 15.137 2.420 1.00 0.00 C ATOM 1233 CG ARG A 76 0.667 14.624 1.218 1.00 0.00 C ATOM 1234 CD ARG A 76 -0.745 15.194 1.196 1.00 0.00 C ATOM 1235 NE ARG A 76 -0.744 16.655 1.131 1.00 0.00 N ATOM 1236 CZ ARG A 76 -1.845 17.410 1.136 1.00 0.00 C ATOM 1237 NH1 ARG A 76 -3.049 16.849 1.203 1.00 0.00 N ATOM 1238 NH2 ARG A 76 -1.741 18.730 1.073 1.00 0.00 N ATOM 0 H ARG A 76 2.405 12.813 2.535 1.00 0.00 H new ATOM 0 HA ARG A 76 3.342 15.190 1.431 1.00 0.00 H new ATOM 0 HB2 ARG A 76 1.025 14.698 3.324 1.00 0.00 H new ATOM 0 HB3 ARG A 76 1.306 16.215 2.494 1.00 0.00 H new ATOM 0 HG2 ARG A 76 1.187 14.897 0.300 1.00 0.00 H new ATOM 0 HG3 ARG A 76 0.622 13.535 1.247 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -1.285 14.793 0.338 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -1.281 14.871 2.089 1.00 0.00 H new ATOM 0 HE ARG A 76 0.158 17.129 1.078 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -3.137 15.834 1.251 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -3.885 17.434 1.206 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -0.821 19.167 1.021 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -2.581 19.309 1.077 1.00 0.00 H new ATOM 1252 N LYS A 77 3.511 15.010 4.723 1.00 0.00 N ATOM 1253 CA LYS A 77 4.131 15.570 5.909 1.00 0.00 C ATOM 1254 C LYS A 77 4.998 14.527 6.593 1.00 0.00 C ATOM 1255 O LYS A 77 4.484 13.590 7.206 1.00 0.00 O ATOM 1256 CB LYS A 77 3.068 16.071 6.881 1.00 0.00 C ATOM 1257 CG LYS A 77 2.422 17.375 6.455 1.00 0.00 C ATOM 1258 CD LYS A 77 1.130 17.664 7.218 1.00 0.00 C ATOM 1259 CE LYS A 77 1.350 17.815 8.721 1.00 0.00 C ATOM 1260 NZ LYS A 77 1.497 16.505 9.417 1.00 0.00 N ATOM 0 H LYS A 77 2.981 14.156 4.893 1.00 0.00 H new ATOM 0 HA LYS A 77 4.756 16.410 5.604 1.00 0.00 H new ATOM 0 HB2 LYS A 77 2.295 15.309 6.985 1.00 0.00 H new ATOM 0 HB3 LYS A 77 3.520 16.203 7.864 1.00 0.00 H new ATOM 0 HG2 LYS A 77 3.124 18.193 6.613 1.00 0.00 H new ATOM 0 HG3 LYS A 77 2.209 17.339 5.387 1.00 0.00 H new ATOM 0 HD2 LYS A 77 0.680 18.577 6.828 1.00 0.00 H new ATOM 0 HD3 LYS A 77 0.420 16.857 7.039 1.00 0.00 H new ATOM 0 HE2 LYS A 77 2.243 18.416 8.894 1.00 0.00 H new ATOM 0 HE3 LYS A 77 0.511 18.359 9.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 0.899 16.495 10.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 1.204 15.738 8.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 2.491 16.367 9.690 1.00 0.00 H new ATOM 1274 N LYS A 78 6.309 14.682 6.478 1.00 0.00 N ATOM 1275 CA LYS A 78 7.245 13.775 7.118 1.00 0.00 C ATOM 1276 C LYS A 78 7.214 13.952 8.630 1.00 0.00 C ATOM 1277 O LYS A 78 6.676 14.942 9.136 1.00 0.00 O ATOM 1278 CB LYS A 78 8.661 14.027 6.590 1.00 0.00 C ATOM 1279 CG LYS A 78 9.035 13.187 5.376 1.00 0.00 C ATOM 1280 CD LYS A 78 8.083 13.410 4.214 1.00 0.00 C ATOM 1281 CE LYS A 78 8.413 12.506 3.036 1.00 0.00 C ATOM 1282 NZ LYS A 78 9.742 12.814 2.444 1.00 0.00 N ATOM 0 H LYS A 78 6.748 15.432 5.944 1.00 0.00 H new ATOM 0 HA LYS A 78 6.952 12.752 6.883 1.00 0.00 H new ATOM 0 HB2 LYS A 78 8.758 15.081 6.331 1.00 0.00 H new ATOM 0 HB3 LYS A 78 9.375 13.828 7.389 1.00 0.00 H new ATOM 0 HG2 LYS A 78 10.050 13.432 5.065 1.00 0.00 H new ATOM 0 HG3 LYS A 78 9.031 12.132 5.650 1.00 0.00 H new ATOM 0 HD2 LYS A 78 7.060 13.224 4.541 1.00 0.00 H new ATOM 0 HD3 LYS A 78 8.132 14.452 3.898 1.00 0.00 H new ATOM 0 HE2 LYS A 78 8.395 11.466 3.363 1.00 0.00 H new ATOM 0 HE3 LYS A 78 7.643 12.613 2.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 9.866 12.269 1.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 9.800 13.830 2.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 10.491 12.558 3.119 1.00 0.00 H new ATOM 1296 N ARG A 79 7.786 13.002 9.351 1.00 0.00 N ATOM 1297 CA ARG A 79 7.851 13.105 10.804 1.00 0.00 C ATOM 1298 C ARG A 79 9.122 12.458 11.335 1.00 0.00 C ATOM 1299 O ARG A 79 9.100 11.361 11.892 1.00 0.00 O ATOM 1300 CB ARG A 79 6.611 12.502 11.474 1.00 0.00 C ATOM 1301 CG ARG A 79 6.564 12.725 12.982 1.00 0.00 C ATOM 1302 CD ARG A 79 6.634 14.206 13.338 1.00 0.00 C ATOM 1303 NE ARG A 79 6.690 14.423 14.782 1.00 0.00 N ATOM 1304 CZ ARG A 79 7.041 15.578 15.348 1.00 0.00 C ATOM 1305 NH1 ARG A 79 7.354 16.625 14.597 1.00 0.00 N ATOM 1306 NH2 ARG A 79 7.087 15.683 16.669 1.00 0.00 N ATOM 0 H ARG A 79 8.208 12.159 8.962 1.00 0.00 H new ATOM 0 HA ARG A 79 7.873 14.165 11.055 1.00 0.00 H new ATOM 0 HB2 ARG A 79 5.718 12.934 11.023 1.00 0.00 H new ATOM 0 HB3 ARG A 79 6.584 11.431 11.272 1.00 0.00 H new ATOM 0 HG2 ARG A 79 5.645 12.298 13.384 1.00 0.00 H new ATOM 0 HG3 ARG A 79 7.394 12.198 13.453 1.00 0.00 H new ATOM 0 HD2 ARG A 79 7.513 14.649 12.871 1.00 0.00 H new ATOM 0 HD3 ARG A 79 5.763 14.718 12.929 1.00 0.00 H new ATOM 0 HE ARG A 79 6.446 13.644 15.394 1.00 0.00 H new ATOM 0 HH11 ARG A 79 7.327 16.550 13.580 1.00 0.00 H new ATOM 0 HH12 ARG A 79 7.622 17.506 15.036 1.00 0.00 H new ATOM 0 HH21 ARG A 79 6.854 14.880 17.253 1.00 0.00 H new ATOM 0 HH22 ARG A 79 7.356 16.567 17.101 1.00 0.00 H new ATOM 1320 N LYS A 80 10.229 13.147 11.127 1.00 0.00 N ATOM 1321 CA LYS A 80 11.513 12.742 11.679 1.00 0.00 C ATOM 1322 C LYS A 80 12.276 13.964 12.173 1.00 0.00 C ATOM 1323 O LYS A 80 13.152 14.481 11.481 1.00 0.00 O ATOM 1324 CB LYS A 80 12.352 11.980 10.648 1.00 0.00 C ATOM 1325 CG LYS A 80 11.884 10.552 10.404 1.00 0.00 C ATOM 1326 CD LYS A 80 12.012 9.706 11.664 1.00 0.00 C ATOM 1327 CE LYS A 80 11.531 8.283 11.443 1.00 0.00 C ATOM 1328 NZ LYS A 80 10.094 8.233 11.064 1.00 0.00 N ATOM 0 H LYS A 80 10.266 14.002 10.572 1.00 0.00 H new ATOM 0 HA LYS A 80 11.322 12.071 12.516 1.00 0.00 H new ATOM 0 HB2 LYS A 80 12.332 12.525 9.704 1.00 0.00 H new ATOM 0 HB3 LYS A 80 13.389 11.960 10.982 1.00 0.00 H new ATOM 0 HG2 LYS A 80 10.846 10.559 10.072 1.00 0.00 H new ATOM 0 HG3 LYS A 80 12.472 10.106 9.602 1.00 0.00 H new ATOM 0 HD2 LYS A 80 13.053 9.691 11.987 1.00 0.00 H new ATOM 0 HD3 LYS A 80 11.435 10.163 12.468 1.00 0.00 H new ATOM 0 HE2 LYS A 80 12.129 7.816 10.660 1.00 0.00 H new ATOM 0 HE3 LYS A 80 11.686 7.702 12.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 9.614 7.497 11.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 9.652 9.155 11.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 10.010 8.013 10.051 1.00 0.00 H new ATOM 1342 N PRO A 81 11.934 14.448 13.375 1.00 0.00 N ATOM 1343 CA PRO A 81 12.587 15.605 13.984 1.00 0.00 C ATOM 1344 C PRO A 81 13.975 15.253 14.508 1.00 0.00 C ATOM 1345 O PRO A 81 14.174 15.070 15.710 1.00 0.00 O ATOM 1346 CB PRO A 81 11.659 15.989 15.149 1.00 0.00 C ATOM 1347 CG PRO A 81 10.461 15.102 15.038 1.00 0.00 C ATOM 1348 CD PRO A 81 10.885 13.905 14.241 1.00 0.00 C ATOM 0 HA PRO A 81 12.733 16.414 13.268 1.00 0.00 H new ATOM 0 HB2 PRO A 81 12.159 15.849 16.107 1.00 0.00 H new ATOM 0 HB3 PRO A 81 11.373 17.039 15.089 1.00 0.00 H new ATOM 0 HG2 PRO A 81 10.107 14.804 16.025 1.00 0.00 H new ATOM 0 HG3 PRO A 81 9.638 15.622 14.548 1.00 0.00 H new ATOM 0 HD2 PRO A 81 11.261 13.106 14.880 1.00 0.00 H new ATOM 0 HD3 PRO A 81 10.059 13.490 13.664 1.00 0.00 H new ATOM 1356 N GLN A 82 14.927 15.145 13.599 1.00 0.00 N ATOM 1357 CA GLN A 82 16.294 14.793 13.952 1.00 0.00 C ATOM 1358 C GLN A 82 17.199 16.012 13.834 1.00 0.00 C ATOM 1359 O GLN A 82 18.356 15.907 13.426 1.00 0.00 O ATOM 1360 CB GLN A 82 16.797 13.664 13.052 1.00 0.00 C ATOM 1361 CG GLN A 82 15.986 12.383 13.167 1.00 0.00 C ATOM 1362 CD GLN A 82 16.064 11.765 14.550 1.00 0.00 C ATOM 1363 OE1 GLN A 82 16.939 10.946 14.826 1.00 0.00 O ATOM 1364 NE2 GLN A 82 15.155 12.154 15.429 1.00 0.00 N ATOM 0 H GLN A 82 14.778 15.297 12.601 1.00 0.00 H new ATOM 0 HA GLN A 82 16.312 14.447 14.986 1.00 0.00 H new ATOM 0 HB2 GLN A 82 16.780 14.002 12.016 1.00 0.00 H new ATOM 0 HB3 GLN A 82 17.836 13.449 13.300 1.00 0.00 H new ATOM 0 HG2 GLN A 82 14.944 12.594 12.926 1.00 0.00 H new ATOM 0 HG3 GLN A 82 16.344 11.663 12.431 1.00 0.00 H new ATOM 0 HE21 GLN A 82 14.445 12.836 15.161 1.00 0.00 H new ATOM 0 HE22 GLN A 82 15.164 11.772 16.375 1.00 0.00 H new ATOM 1373 N ALA A 83 16.658 17.166 14.188 1.00 0.00 N ATOM 1374 CA ALA A 83 17.404 18.413 14.134 1.00 0.00 C ATOM 1375 C ALA A 83 17.188 19.212 15.408 1.00 0.00 C ATOM 1376 O ALA A 83 16.145 19.890 15.524 1.00 0.00 O ATOM 1377 CB ALA A 83 17.008 19.229 12.911 1.00 0.00 C ATOM 1378 OXT ALA A 83 18.055 19.143 16.302 1.00 0.00 O ATOM 0 H ALA A 83 15.698 17.265 14.518 1.00 0.00 H new ATOM 0 HA ALA A 83 18.465 18.176 14.050 1.00 0.00 H new ATOM 0 HB1 ALA A 83 17.579 20.157 12.892 1.00 0.00 H new ATOM 0 HB2 ALA A 83 17.217 18.656 12.008 1.00 0.00 H new ATOM 0 HB3 ALA A 83 15.943 19.459 12.956 1.00 0.00 H new TER 1384 ALA A 83 ATOM 1385 N LYS B 201 3.289 -6.696 -12.199 1.00 0.00 N ATOM 1386 CA LYS B 201 2.620 -5.660 -11.381 1.00 0.00 C ATOM 1387 C LYS B 201 3.303 -5.552 -10.026 1.00 0.00 C ATOM 1388 O LYS B 201 4.430 -6.020 -9.856 1.00 0.00 O ATOM 1389 CB LYS B 201 1.138 -5.995 -11.172 1.00 0.00 C ATOM 1390 CG LYS B 201 0.343 -6.181 -12.453 1.00 0.00 C ATOM 1391 CD LYS B 201 -1.148 -6.238 -12.160 1.00 0.00 C ATOM 1392 CE LYS B 201 -1.968 -6.522 -13.407 1.00 0.00 C ATOM 1393 NZ LYS B 201 -1.815 -7.928 -13.864 1.00 0.00 N ATOM 0 HA LYS B 201 2.693 -4.711 -11.912 1.00 0.00 H new ATOM 0 HB2 LYS B 201 1.066 -6.907 -10.580 1.00 0.00 H new ATOM 0 HB3 LYS B 201 0.678 -5.198 -10.587 1.00 0.00 H new ATOM 0 HG2 LYS B 201 0.552 -5.360 -13.139 1.00 0.00 H new ATOM 0 HG3 LYS B 201 0.656 -7.099 -12.950 1.00 0.00 H new ATOM 0 HD2 LYS B 201 -1.341 -7.011 -11.417 1.00 0.00 H new ATOM 0 HD3 LYS B 201 -1.467 -5.291 -11.725 1.00 0.00 H new ATOM 0 HE2 LYS B 201 -3.019 -6.319 -13.204 1.00 0.00 H new ATOM 0 HE3 LYS B 201 -1.661 -5.846 -14.205 1.00 0.00 H new ATOM 0 HZ1 LYS B 201 -2.466 -8.109 -14.654 1.00 0.00 H new ATOM 0 HZ2 LYS B 201 -0.836 -8.086 -14.179 1.00 0.00 H new ATOM 0 HZ3 LYS B 201 -2.035 -8.574 -13.079 1.00 0.00 H new ATOM 1409 N TRP B 202 2.623 -4.937 -9.066 1.00 0.00 N ATOM 1410 CA TRP B 202 3.115 -4.867 -7.698 1.00 0.00 C ATOM 1411 C TRP B 202 3.204 -6.274 -7.121 1.00 0.00 C ATOM 1412 O TRP B 202 2.195 -6.871 -6.756 1.00 0.00 O ATOM 1413 CB TRP B 202 2.178 -4.006 -6.853 1.00 0.00 C ATOM 1414 CG TRP B 202 2.804 -3.431 -5.614 1.00 0.00 C ATOM 1415 CD1 TRP B 202 4.105 -3.048 -5.442 1.00 0.00 C ATOM 1416 CD2 TRP B 202 2.135 -3.132 -4.386 1.00 0.00 C ATOM 1417 NE1 TRP B 202 4.281 -2.528 -4.181 1.00 0.00 N ATOM 1418 CE2 TRP B 202 3.085 -2.568 -3.514 1.00 0.00 C ATOM 1419 CE3 TRP B 202 0.822 -3.284 -3.942 1.00 0.00 C ATOM 1420 CZ2 TRP B 202 2.760 -2.152 -2.223 1.00 0.00 C ATOM 1421 CZ3 TRP B 202 0.504 -2.870 -2.659 1.00 0.00 C ATOM 1422 CH2 TRP B 202 1.465 -2.310 -1.817 1.00 0.00 C ATOM 0 H TRP B 202 1.724 -4.477 -9.212 1.00 0.00 H new ATOM 0 HA TRP B 202 4.106 -4.414 -7.689 1.00 0.00 H new ATOM 0 HB2 TRP B 202 1.804 -3.188 -7.468 1.00 0.00 H new ATOM 0 HB3 TRP B 202 1.316 -4.607 -6.563 1.00 0.00 H new ATOM 0 HD1 TRP B 202 4.881 -3.140 -6.187 1.00 0.00 H new ATOM 0 HE1 TRP B 202 5.159 -2.171 -3.804 1.00 0.00 H new ATOM 0 HE3 TRP B 202 0.069 -3.715 -4.585 1.00 0.00 H new ATOM 0 HZ2 TRP B 202 3.504 -1.721 -1.569 1.00 0.00 H new ATOM 0 HZ3 TRP B 202 -0.509 -2.983 -2.303 1.00 0.00 H new ATOM 0 HH2 TRP B 202 1.180 -1.995 -0.824 1.00 0.00 H new ATOM 1433 N THR B 203 4.409 -6.810 -7.081 1.00 0.00 N ATOM 1434 CA THR B 203 4.619 -8.166 -6.612 1.00 0.00 C ATOM 1435 C THR B 203 5.806 -8.200 -5.653 1.00 0.00 C ATOM 1436 O THR B 203 6.280 -7.142 -5.223 1.00 0.00 O ATOM 1437 CB THR B 203 4.860 -9.131 -7.795 1.00 0.00 C ATOM 1438 OG1 THR B 203 4.261 -8.597 -8.982 1.00 0.00 O ATOM 1439 CG2 THR B 203 4.258 -10.502 -7.518 1.00 0.00 C ATOM 0 H THR B 203 5.259 -6.325 -7.368 1.00 0.00 H new ATOM 0 HA THR B 203 3.721 -8.494 -6.088 1.00 0.00 H new ATOM 0 HB THR B 203 5.937 -9.238 -7.927 1.00 0.00 H new ATOM 0 HG1 THR B 203 4.604 -7.693 -9.144 1.00 0.00 H new ATOM 0 HG21 THR B 203 4.443 -11.159 -8.368 1.00 0.00 H new ATOM 0 HG22 THR B 203 4.716 -10.926 -6.624 1.00 0.00 H new ATOM 0 HG23 THR B 203 3.184 -10.403 -7.363 1.00 0.00 H new ATOM 1447 N LEU B 204 6.281 -9.397 -5.321 1.00 0.00 N ATOM 1448 CA LEU B 204 7.387 -9.557 -4.384 1.00 0.00 C ATOM 1449 C LEU B 204 8.613 -8.760 -4.826 1.00 0.00 C ATOM 1450 O LEU B 204 9.394 -8.306 -3.996 1.00 0.00 O ATOM 1451 CB LEU B 204 7.753 -11.040 -4.214 1.00 0.00 C ATOM 1452 CG LEU B 204 8.495 -11.702 -5.386 1.00 0.00 C ATOM 1453 CD1 LEU B 204 9.041 -13.056 -4.963 1.00 0.00 C ATOM 1454 CD2 LEU B 204 7.586 -11.866 -6.594 1.00 0.00 C ATOM 0 H LEU B 204 5.914 -10.275 -5.690 1.00 0.00 H new ATOM 0 HA LEU B 204 7.056 -9.166 -3.422 1.00 0.00 H new ATOM 0 HB2 LEU B 204 8.369 -11.139 -3.320 1.00 0.00 H new ATOM 0 HB3 LEU B 204 6.835 -11.599 -4.032 1.00 0.00 H new ATOM 0 HG LEU B 204 9.322 -11.051 -5.669 1.00 0.00 H new ATOM 0 HD11 LEU B 204 9.565 -13.515 -5.802 1.00 0.00 H new ATOM 0 HD12 LEU B 204 9.733 -12.926 -4.131 1.00 0.00 H new ATOM 0 HD13 LEU B 204 8.218 -13.700 -4.653 1.00 0.00 H new ATOM 0 HD21 LEU B 204 8.141 -12.337 -7.405 1.00 0.00 H new ATOM 0 HD22 LEU B 204 6.734 -12.491 -6.326 1.00 0.00 H new ATOM 0 HD23 LEU B 204 7.231 -10.888 -6.917 1.00 0.00 H new ATOM 1466 N GLU B 205 8.767 -8.579 -6.129 1.00 0.00 N ATOM 1467 CA GLU B 205 9.886 -7.821 -6.662 1.00 0.00 C ATOM 1468 C GLU B 205 9.881 -6.393 -6.121 1.00 0.00 C ATOM 1469 O GLU B 205 10.692 -6.047 -5.266 1.00 0.00 O ATOM 1470 CB GLU B 205 9.840 -7.810 -8.188 1.00 0.00 C ATOM 1471 CG GLU B 205 9.864 -9.199 -8.802 1.00 0.00 C ATOM 1472 CD GLU B 205 11.069 -10.003 -8.364 1.00 0.00 C ATOM 1473 OE1 GLU B 205 12.175 -9.749 -8.884 1.00 0.00 O ATOM 1474 OE2 GLU B 205 10.915 -10.892 -7.506 1.00 0.00 O ATOM 0 H GLU B 205 8.130 -8.947 -6.836 1.00 0.00 H new ATOM 0 HA GLU B 205 10.809 -8.304 -6.342 1.00 0.00 H new ATOM 0 HB2 GLU B 205 8.937 -7.293 -8.513 1.00 0.00 H new ATOM 0 HB3 GLU B 205 10.688 -7.239 -8.566 1.00 0.00 H new ATOM 0 HG2 GLU B 205 8.955 -9.732 -8.524 1.00 0.00 H new ATOM 0 HG3 GLU B 205 9.864 -9.113 -9.889 1.00 0.00 H new ATOM 1481 N ARG B 206 8.945 -5.579 -6.593 1.00 0.00 N ATOM 1482 CA ARG B 206 8.875 -4.183 -6.180 1.00 0.00 C ATOM 1483 C ARG B 206 8.718 -4.066 -4.664 1.00 0.00 C ATOM 1484 O ARG B 206 9.501 -3.384 -4.002 1.00 0.00 O ATOM 1485 CB ARG B 206 7.712 -3.473 -6.884 1.00 0.00 C ATOM 1486 CG ARG B 206 7.597 -1.990 -6.557 1.00 0.00 C ATOM 1487 CD ARG B 206 8.794 -1.204 -7.070 1.00 0.00 C ATOM 1488 NE ARG B 206 8.680 0.228 -6.787 1.00 0.00 N ATOM 1489 CZ ARG B 206 9.579 1.137 -7.166 1.00 0.00 C ATOM 1490 NH1 ARG B 206 10.655 0.770 -7.852 1.00 0.00 N ATOM 1491 NH2 ARG B 206 9.398 2.420 -6.864 1.00 0.00 N ATOM 0 H ARG B 206 8.226 -5.860 -7.260 1.00 0.00 H new ATOM 0 HA ARG B 206 9.810 -3.702 -6.467 1.00 0.00 H new ATOM 0 HB2 ARG B 206 7.829 -3.588 -7.962 1.00 0.00 H new ATOM 0 HB3 ARG B 206 6.780 -3.967 -6.610 1.00 0.00 H new ATOM 0 HG2 ARG B 206 6.684 -1.590 -6.998 1.00 0.00 H new ATOM 0 HG3 ARG B 206 7.513 -1.861 -5.478 1.00 0.00 H new ATOM 0 HD2 ARG B 206 9.704 -1.592 -6.612 1.00 0.00 H new ATOM 0 HD3 ARG B 206 8.890 -1.353 -8.145 1.00 0.00 H new ATOM 0 HE ARG B 206 7.863 0.550 -6.268 1.00 0.00 H new ATOM 0 HH11 ARG B 206 10.797 -0.211 -8.092 1.00 0.00 H new ATOM 0 HH12 ARG B 206 11.340 1.469 -8.139 1.00 0.00 H new ATOM 0 HH21 ARG B 206 8.571 2.709 -6.342 1.00 0.00 H new ATOM 0 HH22 ARG B 206 10.086 3.114 -7.154 1.00 0.00 H new ATOM 1505 N LEU B 207 7.727 -4.759 -4.119 1.00 0.00 N ATOM 1506 CA LEU B 207 7.408 -4.632 -2.704 1.00 0.00 C ATOM 1507 C LEU B 207 8.429 -5.341 -1.825 1.00 0.00 C ATOM 1508 O LEU B 207 9.207 -4.693 -1.137 1.00 0.00 O ATOM 1509 CB LEU B 207 6.011 -5.178 -2.406 1.00 0.00 C ATOM 1510 CG LEU B 207 5.616 -5.162 -0.925 1.00 0.00 C ATOM 1511 CD1 LEU B 207 5.616 -3.744 -0.383 1.00 0.00 C ATOM 1512 CD2 LEU B 207 4.256 -5.795 -0.732 1.00 0.00 C ATOM 0 H LEU B 207 7.134 -5.411 -4.632 1.00 0.00 H new ATOM 0 HA LEU B 207 7.436 -3.568 -2.471 1.00 0.00 H new ATOM 0 HB2 LEU B 207 5.281 -4.595 -2.968 1.00 0.00 H new ATOM 0 HB3 LEU B 207 5.951 -6.203 -2.772 1.00 0.00 H new ATOM 0 HG LEU B 207 6.354 -5.743 -0.371 1.00 0.00 H new ATOM 0 HD11 LEU B 207 5.333 -3.757 0.669 1.00 0.00 H new ATOM 0 HD12 LEU B 207 6.613 -3.315 -0.485 1.00 0.00 H new ATOM 0 HD13 LEU B 207 4.902 -3.140 -0.943 1.00 0.00 H new ATOM 0 HD21 LEU B 207 3.992 -5.775 0.325 1.00 0.00 H new ATOM 0 HD22 LEU B 207 3.512 -5.239 -1.302 1.00 0.00 H new ATOM 0 HD23 LEU B 207 4.283 -6.828 -1.080 1.00 0.00 H new ATOM 1524 N LYS B 208 8.440 -6.668 -1.883 1.00 0.00 N ATOM 1525 CA LYS B 208 9.191 -7.480 -0.929 1.00 0.00 C ATOM 1526 C LYS B 208 10.689 -7.192 -0.993 1.00 0.00 C ATOM 1527 O LYS B 208 11.415 -7.434 -0.030 1.00 0.00 O ATOM 1528 CB LYS B 208 8.918 -8.970 -1.181 1.00 0.00 C ATOM 1529 CG LYS B 208 9.466 -9.903 -0.112 1.00 0.00 C ATOM 1530 CD LYS B 208 8.961 -11.328 -0.306 1.00 0.00 C ATOM 1531 CE LYS B 208 9.713 -12.074 -1.398 1.00 0.00 C ATOM 1532 NZ LYS B 208 11.041 -12.545 -0.937 1.00 0.00 N ATOM 0 H LYS B 208 7.934 -7.208 -2.585 1.00 0.00 H new ATOM 0 HA LYS B 208 8.854 -7.217 0.073 1.00 0.00 H new ATOM 0 HB2 LYS B 208 7.841 -9.121 -1.259 1.00 0.00 H new ATOM 0 HB3 LYS B 208 9.349 -9.247 -2.143 1.00 0.00 H new ATOM 0 HG2 LYS B 208 10.556 -9.894 -0.143 1.00 0.00 H new ATOM 0 HG3 LYS B 208 9.172 -9.542 0.874 1.00 0.00 H new ATOM 0 HD2 LYS B 208 9.056 -11.874 0.633 1.00 0.00 H new ATOM 0 HD3 LYS B 208 7.900 -11.302 -0.554 1.00 0.00 H new ATOM 0 HE2 LYS B 208 9.120 -12.927 -1.728 1.00 0.00 H new ATOM 0 HE3 LYS B 208 9.840 -11.421 -2.262 1.00 0.00 H new ATOM 0 HZ1 LYS B 208 11.652 -12.720 -1.760 1.00 0.00 H new ATOM 0 HZ2 LYS B 208 11.475 -11.820 -0.331 1.00 0.00 H new ATOM 0 HZ3 LYS B 208 10.928 -13.426 -0.396 1.00 0.00 H new ATOM 1546 N ARG B 209 11.166 -6.688 -2.124 1.00 0.00 N ATOM 1547 CA ARG B 209 12.582 -6.387 -2.261 1.00 0.00 C ATOM 1548 C ARG B 209 12.905 -4.992 -1.738 1.00 0.00 C ATOM 1549 O ARG B 209 13.879 -4.819 -1.017 1.00 0.00 O ATOM 1550 CB ARG B 209 13.036 -6.555 -3.711 1.00 0.00 C ATOM 1551 CG ARG B 209 13.441 -7.981 -4.095 1.00 0.00 C ATOM 1552 CD ARG B 209 12.457 -9.053 -3.613 1.00 0.00 C ATOM 1553 NE ARG B 209 12.575 -9.302 -2.171 1.00 0.00 N ATOM 1554 CZ ARG B 209 13.216 -10.339 -1.636 1.00 0.00 C ATOM 1555 NH1 ARG B 209 13.807 -11.234 -2.415 1.00 0.00 N ATOM 1556 NH2 ARG B 209 13.258 -10.482 -0.317 1.00 0.00 N ATOM 0 H ARG B 209 10.601 -6.482 -2.948 1.00 0.00 H new ATOM 0 HA ARG B 209 13.136 -7.100 -1.651 1.00 0.00 H new ATOM 0 HB2 ARG B 209 12.230 -6.231 -4.369 1.00 0.00 H new ATOM 0 HB3 ARG B 209 13.881 -5.891 -3.892 1.00 0.00 H new ATOM 0 HG2 ARG B 209 13.530 -8.044 -5.179 1.00 0.00 H new ATOM 0 HG3 ARG B 209 14.427 -8.193 -3.681 1.00 0.00 H new ATOM 0 HD2 ARG B 209 11.439 -8.740 -3.844 1.00 0.00 H new ATOM 0 HD3 ARG B 209 12.637 -9.980 -4.157 1.00 0.00 H new ATOM 0 HE ARG B 209 12.136 -8.635 -1.536 1.00 0.00 H new ATOM 0 HH11 ARG B 209 13.772 -11.130 -3.429 1.00 0.00 H new ATOM 0 HH12 ARG B 209 14.297 -12.027 -2.000 1.00 0.00 H new ATOM 0 HH21 ARG B 209 12.800 -9.798 0.285 1.00 0.00 H new ATOM 0 HH22 ARG B 209 13.749 -11.276 0.095 1.00 0.00 H new ATOM 1570 N LYS B 210 12.081 -4.003 -2.068 1.00 0.00 N ATOM 1571 CA LYS B 210 12.296 -2.652 -1.552 1.00 0.00 C ATOM 1572 C LYS B 210 12.000 -2.610 -0.055 1.00 0.00 C ATOM 1573 O LYS B 210 12.639 -1.881 0.705 1.00 0.00 O ATOM 1574 CB LYS B 210 11.409 -1.648 -2.289 1.00 0.00 C ATOM 1575 CG LYS B 210 11.613 -0.209 -1.844 1.00 0.00 C ATOM 1576 CD LYS B 210 12.955 0.339 -2.300 1.00 0.00 C ATOM 1577 CE LYS B 210 13.146 1.783 -1.863 1.00 0.00 C ATOM 1578 NZ LYS B 210 13.308 1.907 -0.389 1.00 0.00 N ATOM 0 H LYS B 210 11.271 -4.106 -2.679 1.00 0.00 H new ATOM 0 HA LYS B 210 13.339 -2.380 -1.717 1.00 0.00 H new ATOM 0 HB2 LYS B 210 11.606 -1.719 -3.359 1.00 0.00 H new ATOM 0 HB3 LYS B 210 10.364 -1.921 -2.139 1.00 0.00 H new ATOM 0 HG2 LYS B 210 10.812 0.412 -2.245 1.00 0.00 H new ATOM 0 HG3 LYS B 210 11.548 -0.152 -0.757 1.00 0.00 H new ATOM 0 HD2 LYS B 210 13.758 -0.275 -1.891 1.00 0.00 H new ATOM 0 HD3 LYS B 210 13.026 0.274 -3.386 1.00 0.00 H new ATOM 0 HE2 LYS B 210 14.023 2.198 -2.359 1.00 0.00 H new ATOM 0 HE3 LYS B 210 12.288 2.374 -2.184 1.00 0.00 H new ATOM 0 HZ1 LYS B 210 13.553 2.889 -0.148 1.00 0.00 H new ATOM 0 HZ2 LYS B 210 12.418 1.647 0.081 1.00 0.00 H new ATOM 0 HZ3 LYS B 210 14.067 1.272 -0.069 1.00 0.00 H new ATOM 1592 N TYR B 211 11.020 -3.403 0.346 1.00 0.00 N ATOM 1593 CA TYR B 211 10.614 -3.513 1.739 1.00 0.00 C ATOM 1594 C TYR B 211 11.740 -4.116 2.578 1.00 0.00 C ATOM 1595 O TYR B 211 12.137 -3.554 3.600 1.00 0.00 O ATOM 1596 CB TYR B 211 9.357 -4.393 1.815 1.00 0.00 C ATOM 1597 CG TYR B 211 8.669 -4.447 3.159 1.00 0.00 C ATOM 1598 CD1 TYR B 211 7.350 -4.040 3.280 1.00 0.00 C ATOM 1599 CD2 TYR B 211 9.317 -4.918 4.295 1.00 0.00 C ATOM 1600 CE1 TYR B 211 6.695 -4.097 4.496 1.00 0.00 C ATOM 1601 CE2 TYR B 211 8.671 -4.972 5.513 1.00 0.00 C ATOM 1602 CZ TYR B 211 7.360 -4.562 5.608 1.00 0.00 C ATOM 1603 OH TYR B 211 6.710 -4.619 6.820 1.00 0.00 O ATOM 0 H TYR B 211 10.480 -3.992 -0.288 1.00 0.00 H new ATOM 0 HA TYR B 211 10.394 -2.523 2.138 1.00 0.00 H new ATOM 0 HB2 TYR B 211 8.641 -4.034 1.076 1.00 0.00 H new ATOM 0 HB3 TYR B 211 9.630 -5.408 1.527 1.00 0.00 H new ATOM 0 HD1 TYR B 211 6.825 -3.672 2.410 1.00 0.00 H new ATOM 0 HD2 TYR B 211 10.343 -5.247 4.223 1.00 0.00 H new ATOM 0 HE1 TYR B 211 5.666 -3.778 4.573 1.00 0.00 H new ATOM 0 HE2 TYR B 211 9.191 -5.334 6.388 1.00 0.00 H new ATOM 0 HH TYR B 211 6.434 -5.542 7.000 1.00 0.00 H new ATOM 1613 N ARG B 212 12.259 -5.251 2.128 1.00 0.00 N ATOM 1614 CA ARG B 212 13.244 -5.999 2.898 1.00 0.00 C ATOM 1615 C ARG B 212 14.646 -5.413 2.753 1.00 0.00 C ATOM 1616 O ARG B 212 15.438 -5.455 3.695 1.00 0.00 O ATOM 1617 CB ARG B 212 13.249 -7.469 2.470 1.00 0.00 C ATOM 1618 CG ARG B 212 14.170 -8.360 3.297 1.00 0.00 C ATOM 1619 CD ARG B 212 13.662 -8.546 4.722 1.00 0.00 C ATOM 1620 NE ARG B 212 13.690 -7.305 5.503 1.00 0.00 N ATOM 1621 CZ ARG B 212 12.895 -7.069 6.547 1.00 0.00 C ATOM 1622 NH1 ARG B 212 12.024 -7.989 6.939 1.00 0.00 N ATOM 1623 NH2 ARG B 212 12.977 -5.918 7.202 1.00 0.00 N ATOM 0 H ARG B 212 12.014 -5.674 1.233 1.00 0.00 H new ATOM 0 HA ARG B 212 12.959 -5.926 3.947 1.00 0.00 H new ATOM 0 HB2 ARG B 212 12.233 -7.858 2.535 1.00 0.00 H new ATOM 0 HB3 ARG B 212 13.548 -7.530 1.423 1.00 0.00 H new ATOM 0 HG2 ARG B 212 14.260 -9.333 2.815 1.00 0.00 H new ATOM 0 HG3 ARG B 212 15.168 -7.923 3.323 1.00 0.00 H new ATOM 0 HD2 ARG B 212 12.641 -8.928 4.692 1.00 0.00 H new ATOM 0 HD3 ARG B 212 14.269 -9.299 5.224 1.00 0.00 H new ATOM 0 HE ARG B 212 14.356 -6.581 5.232 1.00 0.00 H new ATOM 0 HH11 ARG B 212 11.962 -8.877 6.442 1.00 0.00 H new ATOM 0 HH12 ARG B 212 11.416 -7.808 7.738 1.00 0.00 H new ATOM 0 HH21 ARG B 212 13.650 -5.210 6.907 1.00 0.00 H new ATOM 0 HH22 ARG B 212 12.367 -5.741 8.000 1.00 0.00 H new ATOM 1637 N ASN B 213 14.955 -4.883 1.579 1.00 0.00 N ATOM 1638 CA ASN B 213 16.280 -4.335 1.324 1.00 0.00 C ATOM 1639 C ASN B 213 16.256 -2.821 1.464 1.00 0.00 C ATOM 1640 O ASN B 213 16.169 -2.123 0.432 1.00 0.00 O ATOM 1641 CB ASN B 213 16.772 -4.717 -0.078 1.00 0.00 C ATOM 1642 CG ASN B 213 16.814 -6.216 -0.308 1.00 0.00 C ATOM 1643 OD1 ASN B 213 17.023 -7.000 0.619 1.00 0.00 O ATOM 1644 ND2 ASN B 213 16.610 -6.626 -1.551 1.00 0.00 N ATOM 1645 OXT ASN B 213 16.308 -2.330 2.612 1.00 0.00 O ATOM 0 H ASN B 213 14.310 -4.820 0.791 1.00 0.00 H new ATOM 0 HA ASN B 213 16.967 -4.756 2.058 1.00 0.00 H new ATOM 0 HB2 ASN B 213 16.120 -4.260 -0.822 1.00 0.00 H new ATOM 0 HB3 ASN B 213 17.769 -4.304 -0.231 1.00 0.00 H new ATOM 0 HD21 ASN B 213 16.623 -7.623 -1.768 1.00 0.00 H new ATOM 0 HD22 ASN B 213 16.440 -5.945 -2.291 1.00 0.00 H new TER 1652 ASN B 213