USER MOD reduce.3.24.130724 H: found=0, std=0, add=831, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 834 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 23 ASN : amide:sc= 0.339! C(o=0.85!,f=-11!) USER MOD Set 1.2: B 205 LYS NZ :NH3+ 163:sc= 0.955 (180deg=-0.0595) USER MOD Set 1.3: B 211 GLN : amide:sc= -0.449! C(o=0.85!,f=-14!) USER MOD Set 2.1: A 7 CYS SG : rot 111:sc= 0.644 USER MOD Set 2.2: A 62 SER OG : rot -60:sc= 1.4 USER MOD Single : A 1 SER N :NH3+ 167:sc= 0.0984 (180deg=-0.0802) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0118 USER MOD Single : A 6 LYS NZ :NH3+ -170:sc= -0.0147 (180deg=-0.188) USER MOD Single : A 8 LYS NZ :NH3+ -145:sc= 0.368 (180deg=0.0311) USER MOD Single : A 10 MET CE :methyl 173:sc= -3.8 (180deg=-4.02) USER MOD Single : A 11 SER OG : rot 180:sc= 0.00925 USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 179:sc= 1.31 (180deg=1.25) USER MOD Single : A 17 GLN : amide:sc= -1.17! K(o=-1.2!,f=-0.051) USER MOD Single : A 19 SER OG : rot -47:sc= 1.24 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.046) USER MOD Single : A 35 HIS : no HD1:sc=-0.00554 X(o=-0.0055,f=0) USER MOD Single : A 38 GLN : amide:sc= -3.86! C(o=-3.9!,f=-7.9!) USER MOD Single : A 39 SER OG : rot -97:sc= 1.23 USER MOD Single : A 43 SER OG : rot 180:sc= 0.0383 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=-0.065) USER MOD Single : A 58 THR OG1 : rot 180:sc= -1.1 USER MOD Single : A 60 LYS NZ :NH3+ 153:sc= 1.28 (180deg=0.507) USER MOD Single : A 63 THR OG1 : rot 152:sc= 1.28 USER MOD Single : A 70 TYR OH : rot -169:sc= 1.21 USER MOD Single : A 72 THR OG1 : rot -7:sc= 0.427 USER MOD Single : A 73 SER OG : rot -53:sc= 1.11 USER MOD Single : A 74 CYS SG : rot 180:sc= -0.649 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ 169:sc= -0.0033 (180deg=-0.148) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : B 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 206 LYS NZ :NH3+ -138:sc= 1.13 (180deg=0.638) USER MOD Single : B 208 LYS NZ :NH3+ 164:sc= -0.966! (180deg=-2.5!) USER MOD Single : B 209 LYS NZ :NH3+ -168:sc=-0.00185 (180deg=-0.149) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -24.407 4.608 8.715 1.00 0.00 N ATOM 2 CA SER A 1 -24.074 4.111 7.359 1.00 0.00 C ATOM 3 C SER A 1 -22.869 4.850 6.793 1.00 0.00 C ATOM 4 O SER A 1 -22.545 4.733 5.608 1.00 0.00 O ATOM 5 CB SER A 1 -25.275 4.298 6.436 1.00 0.00 C ATOM 6 OG SER A 1 -26.443 3.721 6.999 1.00 0.00 O ATOM 0 H1 SER A 1 -25.346 4.258 8.992 1.00 0.00 H new ATOM 0 H2 SER A 1 -23.696 4.267 9.394 1.00 0.00 H new ATOM 0 H3 SER A 1 -24.412 5.648 8.712 1.00 0.00 H new ATOM 0 HA SER A 1 -23.827 3.052 7.428 1.00 0.00 H new ATOM 0 HB2 SER A 1 -25.439 5.361 6.258 1.00 0.00 H new ATOM 0 HB3 SER A 1 -25.069 3.841 5.468 1.00 0.00 H new ATOM 0 HG SER A 1 -27.200 3.855 6.391 1.00 0.00 H new ATOM 14 N GLU A 2 -22.203 5.607 7.646 1.00 0.00 N ATOM 15 CA GLU A 2 -21.124 6.472 7.216 1.00 0.00 C ATOM 16 C GLU A 2 -19.765 5.828 7.442 1.00 0.00 C ATOM 17 O GLU A 2 -18.736 6.442 7.188 1.00 0.00 O ATOM 18 CB GLU A 2 -21.209 7.808 7.953 1.00 0.00 C ATOM 19 CG GLU A 2 -22.341 8.700 7.464 1.00 0.00 C ATOM 20 CD GLU A 2 -23.705 8.055 7.618 1.00 0.00 C ATOM 21 OE1 GLU A 2 -24.115 7.778 8.766 1.00 0.00 O ATOM 22 OE2 GLU A 2 -24.360 7.785 6.590 1.00 0.00 O ATOM 0 H GLU A 2 -22.394 5.639 8.647 1.00 0.00 H new ATOM 0 HA GLU A 2 -21.231 6.641 6.145 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -21.341 7.619 9.018 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -20.264 8.338 7.838 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -22.323 9.639 8.018 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -22.177 8.946 6.415 1.00 0.00 H new ATOM 29 N GLU A 3 -19.759 4.587 7.906 1.00 0.00 N ATOM 30 CA GLU A 3 -18.506 3.909 8.202 1.00 0.00 C ATOM 31 C GLU A 3 -17.828 3.448 6.918 1.00 0.00 C ATOM 32 O GLU A 3 -16.644 3.707 6.707 1.00 0.00 O ATOM 33 CB GLU A 3 -18.728 2.723 9.147 1.00 0.00 C ATOM 34 CG GLU A 3 -19.396 3.112 10.457 1.00 0.00 C ATOM 35 CD GLU A 3 -18.710 4.278 11.142 1.00 0.00 C ATOM 36 OE1 GLU A 3 -17.657 4.066 11.784 1.00 0.00 O ATOM 37 OE2 GLU A 3 -19.223 5.413 11.043 1.00 0.00 O ATOM 0 H GLU A 3 -20.598 4.034 8.084 1.00 0.00 H new ATOM 0 HA GLU A 3 -17.851 4.622 8.704 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -19.341 1.976 8.643 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -17.768 2.255 9.362 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -20.438 3.370 10.266 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -19.399 2.253 11.128 1.00 0.00 H new ATOM 44 N GLU A 4 -18.583 2.789 6.047 1.00 0.00 N ATOM 45 CA GLU A 4 -18.027 2.312 4.786 1.00 0.00 C ATOM 46 C GLU A 4 -17.748 3.485 3.848 1.00 0.00 C ATOM 47 O GLU A 4 -16.802 3.452 3.061 1.00 0.00 O ATOM 48 CB GLU A 4 -18.974 1.314 4.107 1.00 0.00 C ATOM 49 CG GLU A 4 -18.408 0.731 2.820 1.00 0.00 C ATOM 50 CD GLU A 4 -19.434 -0.044 2.022 1.00 0.00 C ATOM 51 OE1 GLU A 4 -19.583 -1.262 2.254 1.00 0.00 O ATOM 52 OE2 GLU A 4 -20.089 0.565 1.148 1.00 0.00 O ATOM 0 H GLU A 4 -19.570 2.574 6.187 1.00 0.00 H new ATOM 0 HA GLU A 4 -17.090 1.801 5.007 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -19.194 0.502 4.800 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -19.919 1.811 3.888 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -18.012 1.539 2.205 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -17.572 0.075 3.062 1.00 0.00 H new ATOM 59 N ASP A 5 -18.554 4.535 3.959 1.00 0.00 N ATOM 60 CA ASP A 5 -18.436 5.674 3.056 1.00 0.00 C ATOM 61 C ASP A 5 -17.568 6.762 3.684 1.00 0.00 C ATOM 62 O ASP A 5 -17.445 7.867 3.158 1.00 0.00 O ATOM 63 CB ASP A 5 -19.825 6.210 2.688 1.00 0.00 C ATOM 64 CG ASP A 5 -19.798 7.132 1.484 1.00 0.00 C ATOM 65 OD1 ASP A 5 -19.569 6.639 0.357 1.00 0.00 O ATOM 66 OD2 ASP A 5 -20.031 8.346 1.650 1.00 0.00 O ATOM 0 H ASP A 5 -19.291 4.621 4.659 1.00 0.00 H new ATOM 0 HA ASP A 5 -17.950 5.347 2.137 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -20.491 5.372 2.483 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -20.241 6.746 3.541 1.00 0.00 H new ATOM 71 N LYS A 6 -16.957 6.431 4.818 1.00 0.00 N ATOM 72 CA LYS A 6 -15.995 7.318 5.468 1.00 0.00 C ATOM 73 C LYS A 6 -14.719 7.364 4.641 1.00 0.00 C ATOM 74 O LYS A 6 -14.027 8.382 4.577 1.00 0.00 O ATOM 75 CB LYS A 6 -15.670 6.800 6.879 1.00 0.00 C ATOM 76 CG LYS A 6 -15.937 7.795 7.997 1.00 0.00 C ATOM 77 CD LYS A 6 -15.109 9.059 7.851 1.00 0.00 C ATOM 78 CE LYS A 6 -15.234 9.941 9.083 1.00 0.00 C ATOM 79 NZ LYS A 6 -16.650 10.260 9.400 1.00 0.00 N ATOM 0 H LYS A 6 -17.112 5.550 5.309 1.00 0.00 H new ATOM 0 HA LYS A 6 -16.423 8.317 5.546 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -16.255 5.900 7.065 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -14.620 6.510 6.912 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -16.995 8.055 8.004 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -15.717 7.328 8.957 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -14.063 8.796 7.693 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -15.435 9.611 6.970 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -14.776 9.439 9.936 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -14.681 10.867 8.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -16.684 10.994 10.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -17.128 10.606 8.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -17.131 9.404 9.742 1.00 0.00 H new ATOM 93 N CYS A 7 -14.433 6.238 4.006 1.00 0.00 N ATOM 94 CA CYS A 7 -13.245 6.082 3.189 1.00 0.00 C ATOM 95 C CYS A 7 -13.472 6.661 1.796 1.00 0.00 C ATOM 96 O CYS A 7 -14.551 6.505 1.219 1.00 0.00 O ATOM 97 CB CYS A 7 -12.893 4.599 3.102 1.00 0.00 C ATOM 98 SG CYS A 7 -12.616 3.827 4.714 1.00 0.00 S ATOM 0 H CYS A 7 -15.021 5.406 4.044 1.00 0.00 H new ATOM 0 HA CYS A 7 -12.418 6.625 3.645 1.00 0.00 H new ATOM 0 HB2 CYS A 7 -13.698 4.072 2.589 1.00 0.00 H new ATOM 0 HB3 CYS A 7 -11.997 4.482 2.493 1.00 0.00 H new ATOM 0 HG CYS A 7 -13.580 2.993 4.967 1.00 0.00 H new ATOM 104 N LYS A 8 -12.460 7.330 1.262 1.00 0.00 N ATOM 105 CA LYS A 8 -12.568 7.958 -0.053 1.00 0.00 C ATOM 106 C LYS A 8 -12.183 6.988 -1.152 1.00 0.00 C ATOM 107 O LYS A 8 -11.204 6.250 -1.034 1.00 0.00 O ATOM 108 CB LYS A 8 -11.693 9.215 -0.152 1.00 0.00 C ATOM 109 CG LYS A 8 -12.311 10.468 0.442 1.00 0.00 C ATOM 110 CD LYS A 8 -12.598 10.321 1.926 1.00 0.00 C ATOM 111 CE LYS A 8 -13.244 11.568 2.494 1.00 0.00 C ATOM 112 NZ LYS A 8 -13.601 11.391 3.925 1.00 0.00 N ATOM 0 H LYS A 8 -11.555 7.453 1.716 1.00 0.00 H new ATOM 0 HA LYS A 8 -13.611 8.249 -0.181 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -10.745 9.021 0.350 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -11.466 9.401 -1.202 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -11.638 11.311 0.286 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -13.238 10.698 -0.084 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -13.253 9.465 2.088 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -11.669 10.117 2.459 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -12.563 12.412 2.389 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -14.140 11.808 1.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -14.483 11.904 4.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -13.734 10.380 4.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -12.837 11.766 4.522 1.00 0.00 H new ATOM 126 N PRO A 9 -12.950 6.999 -2.242 1.00 0.00 N ATOM 127 CA PRO A 9 -12.716 6.122 -3.383 1.00 0.00 C ATOM 128 C PRO A 9 -11.436 6.499 -4.119 1.00 0.00 C ATOM 129 O PRO A 9 -11.263 7.649 -4.530 1.00 0.00 O ATOM 130 CB PRO A 9 -13.944 6.339 -4.269 1.00 0.00 C ATOM 131 CG PRO A 9 -14.472 7.681 -3.890 1.00 0.00 C ATOM 132 CD PRO A 9 -14.106 7.891 -2.443 1.00 0.00 C ATOM 0 HA PRO A 9 -12.586 5.080 -3.089 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -13.677 6.305 -5.325 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -14.690 5.562 -4.104 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -14.038 8.460 -4.517 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -15.552 7.726 -4.028 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -13.849 8.931 -2.242 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -14.931 7.633 -1.780 1.00 0.00 H new ATOM 140 N MET A 10 -10.529 5.544 -4.268 1.00 0.00 N ATOM 141 CA MET A 10 -9.244 5.818 -4.892 1.00 0.00 C ATOM 142 C MET A 10 -9.305 5.531 -6.392 1.00 0.00 C ATOM 143 O MET A 10 -9.683 4.431 -6.802 1.00 0.00 O ATOM 144 CB MET A 10 -8.139 4.978 -4.254 1.00 0.00 C ATOM 145 CG MET A 10 -6.748 5.382 -4.708 1.00 0.00 C ATOM 146 SD MET A 10 -5.998 6.627 -3.651 1.00 0.00 S ATOM 147 CE MET A 10 -5.881 5.716 -2.125 1.00 0.00 C ATOM 0 H MET A 10 -10.658 4.578 -3.967 1.00 0.00 H new ATOM 0 HA MET A 10 -9.016 6.873 -4.738 1.00 0.00 H new ATOM 0 HB2 MET A 10 -8.202 5.069 -3.170 1.00 0.00 H new ATOM 0 HB3 MET A 10 -8.303 3.928 -4.496 1.00 0.00 H new ATOM 0 HG2 MET A 10 -6.109 4.500 -4.731 1.00 0.00 H new ATOM 0 HG3 MET A 10 -6.801 5.763 -5.728 1.00 0.00 H new ATOM 0 HE1 MET A 10 -5.323 6.301 -1.394 1.00 0.00 H new ATOM 0 HE2 MET A 10 -6.882 5.517 -1.743 1.00 0.00 H new ATOM 0 HE3 MET A 10 -5.366 4.772 -2.303 1.00 0.00 H new ATOM 157 N SER A 11 -8.929 6.510 -7.203 1.00 0.00 N ATOM 158 CA SER A 11 -8.990 6.371 -8.652 1.00 0.00 C ATOM 159 C SER A 11 -7.681 5.802 -9.219 1.00 0.00 C ATOM 160 O SER A 11 -6.740 5.541 -8.465 1.00 0.00 O ATOM 161 CB SER A 11 -9.305 7.731 -9.275 1.00 0.00 C ATOM 162 OG SER A 11 -8.405 8.726 -8.809 1.00 0.00 O ATOM 0 H SER A 11 -8.577 7.412 -6.881 1.00 0.00 H new ATOM 0 HA SER A 11 -9.781 5.664 -8.902 1.00 0.00 H new ATOM 0 HB2 SER A 11 -9.244 7.660 -10.361 1.00 0.00 H new ATOM 0 HB3 SER A 11 -10.328 8.018 -9.031 1.00 0.00 H new ATOM 0 HG SER A 11 -8.626 9.586 -9.223 1.00 0.00 H new ATOM 168 N TYR A 12 -7.620 5.619 -10.541 1.00 0.00 N ATOM 169 CA TYR A 12 -6.458 5.004 -11.192 1.00 0.00 C ATOM 170 C TYR A 12 -5.180 5.815 -10.948 1.00 0.00 C ATOM 171 O TYR A 12 -4.158 5.269 -10.526 1.00 0.00 O ATOM 172 CB TYR A 12 -6.731 4.825 -12.703 1.00 0.00 C ATOM 173 CG TYR A 12 -5.559 5.145 -13.622 1.00 0.00 C ATOM 174 CD1 TYR A 12 -4.429 4.339 -13.658 1.00 0.00 C ATOM 175 CD2 TYR A 12 -5.593 6.252 -14.459 1.00 0.00 C ATOM 176 CE1 TYR A 12 -3.368 4.626 -14.492 1.00 0.00 C ATOM 177 CE2 TYR A 12 -4.535 6.545 -15.300 1.00 0.00 C ATOM 178 CZ TYR A 12 -3.426 5.729 -15.311 1.00 0.00 C ATOM 179 OH TYR A 12 -2.366 6.017 -16.142 1.00 0.00 O ATOM 0 H TYR A 12 -8.364 5.889 -11.184 1.00 0.00 H new ATOM 0 HA TYR A 12 -6.298 4.021 -10.750 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -7.038 3.794 -12.880 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -7.572 5.460 -12.981 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -4.380 3.469 -13.020 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -6.460 6.895 -14.453 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -2.497 3.988 -14.502 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -4.578 7.410 -15.945 1.00 0.00 H new ATOM 0 HH TYR A 12 -2.564 6.827 -16.656 1.00 0.00 H new ATOM 189 N GLU A 13 -5.259 7.115 -11.205 1.00 0.00 N ATOM 190 CA GLU A 13 -4.137 8.034 -11.015 1.00 0.00 C ATOM 191 C GLU A 13 -3.609 7.955 -9.590 1.00 0.00 C ATOM 192 O GLU A 13 -2.415 8.102 -9.329 1.00 0.00 O ATOM 193 CB GLU A 13 -4.628 9.453 -11.298 1.00 0.00 C ATOM 194 CG GLU A 13 -4.923 9.713 -12.768 1.00 0.00 C ATOM 195 CD GLU A 13 -3.678 10.009 -13.573 1.00 0.00 C ATOM 196 OE1 GLU A 13 -2.975 10.983 -13.246 1.00 0.00 O ATOM 197 OE2 GLU A 13 -3.403 9.277 -14.543 1.00 0.00 O ATOM 0 H GLU A 13 -6.105 7.566 -11.553 1.00 0.00 H new ATOM 0 HA GLU A 13 -3.328 7.763 -11.693 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -5.531 9.639 -10.716 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -3.876 10.164 -10.956 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -5.426 8.844 -13.192 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -5.613 10.553 -12.852 1.00 0.00 H new ATOM 204 N GLU A 14 -4.523 7.703 -8.681 1.00 0.00 N ATOM 205 CA GLU A 14 -4.238 7.687 -7.266 1.00 0.00 C ATOM 206 C GLU A 14 -3.643 6.349 -6.843 1.00 0.00 C ATOM 207 O GLU A 14 -2.634 6.312 -6.147 1.00 0.00 O ATOM 208 CB GLU A 14 -5.523 7.980 -6.527 1.00 0.00 C ATOM 209 CG GLU A 14 -5.952 9.434 -6.624 1.00 0.00 C ATOM 210 CD GLU A 14 -5.273 10.337 -5.614 1.00 0.00 C ATOM 211 OE1 GLU A 14 -5.744 10.408 -4.457 1.00 0.00 O ATOM 212 OE2 GLU A 14 -4.283 11.007 -5.982 1.00 0.00 O ATOM 0 H GLU A 14 -5.497 7.501 -8.907 1.00 0.00 H new ATOM 0 HA GLU A 14 -3.495 8.447 -7.025 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -6.316 7.347 -6.925 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -5.399 7.714 -5.477 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -5.738 9.801 -7.628 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -7.031 9.495 -6.485 1.00 0.00 H new ATOM 219 N LYS A 15 -4.271 5.253 -7.273 1.00 0.00 N ATOM 220 CA LYS A 15 -3.726 3.912 -7.042 1.00 0.00 C ATOM 221 C LYS A 15 -2.309 3.810 -7.612 1.00 0.00 C ATOM 222 O LYS A 15 -1.449 3.138 -7.044 1.00 0.00 O ATOM 223 CB LYS A 15 -4.610 2.837 -7.673 1.00 0.00 C ATOM 224 CG LYS A 15 -5.938 2.638 -6.984 1.00 0.00 C ATOM 225 CD LYS A 15 -6.972 2.138 -7.964 1.00 0.00 C ATOM 226 CE LYS A 15 -8.015 1.295 -7.269 1.00 0.00 C ATOM 227 NZ LYS A 15 -8.964 0.671 -8.228 1.00 0.00 N ATOM 0 H LYS A 15 -5.155 5.266 -7.782 1.00 0.00 H new ATOM 0 HA LYS A 15 -3.698 3.747 -5.965 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -4.791 3.099 -8.716 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -4.068 1.891 -7.671 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -5.827 1.925 -6.167 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -6.270 3.578 -6.543 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -7.452 2.985 -8.455 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -6.486 1.551 -8.743 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -7.522 0.515 -6.689 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -8.569 1.914 -6.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -9.651 0.089 -7.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -9.467 1.415 -8.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -8.439 0.072 -8.896 1.00 0.00 H new ATOM 241 N ARG A 16 -2.076 4.480 -8.742 1.00 0.00 N ATOM 242 CA ARG A 16 -0.741 4.543 -9.333 1.00 0.00 C ATOM 243 C ARG A 16 0.230 5.227 -8.382 1.00 0.00 C ATOM 244 O ARG A 16 1.272 4.664 -8.043 1.00 0.00 O ATOM 245 CB ARG A 16 -0.748 5.293 -10.663 1.00 0.00 C ATOM 246 CG ARG A 16 0.638 5.394 -11.265 1.00 0.00 C ATOM 247 CD ARG A 16 0.703 6.382 -12.406 1.00 0.00 C ATOM 248 NE ARG A 16 0.352 7.739 -11.988 1.00 0.00 N ATOM 249 CZ ARG A 16 -0.577 8.482 -12.584 1.00 0.00 C ATOM 250 NH1 ARG A 16 -1.243 8.005 -13.629 1.00 0.00 N ATOM 251 NH2 ARG A 16 -0.836 9.706 -12.140 1.00 0.00 N ATOM 0 H ARG A 16 -2.793 4.985 -9.264 1.00 0.00 H new ATOM 0 HA ARG A 16 -0.421 3.517 -9.514 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -1.411 4.784 -11.363 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -1.152 6.294 -10.512 1.00 0.00 H new ATOM 0 HG2 ARG A 16 1.346 5.691 -10.491 1.00 0.00 H new ATOM 0 HG3 ARG A 16 0.948 4.412 -11.621 1.00 0.00 H new ATOM 0 HD2 ARG A 16 1.709 6.383 -12.826 1.00 0.00 H new ATOM 0 HD3 ARG A 16 0.027 6.062 -13.199 1.00 0.00 H new ATOM 0 HE ARG A 16 0.849 8.140 -11.192 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -1.043 7.067 -13.976 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -1.955 8.576 -14.084 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -0.323 10.078 -11.341 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -1.548 10.274 -12.598 1.00 0.00 H new ATOM 265 N GLN A 17 -0.119 6.441 -7.960 1.00 0.00 N ATOM 266 CA GLN A 17 0.702 7.197 -7.023 1.00 0.00 C ATOM 267 C GLN A 17 0.950 6.379 -5.764 1.00 0.00 C ATOM 268 O GLN A 17 2.061 6.351 -5.240 1.00 0.00 O ATOM 269 CB GLN A 17 0.022 8.522 -6.667 1.00 0.00 C ATOM 270 CG GLN A 17 0.876 9.401 -5.768 1.00 0.00 C ATOM 271 CD GLN A 17 2.060 10.009 -6.493 1.00 0.00 C ATOM 272 OE1 GLN A 17 3.136 10.180 -5.915 1.00 0.00 O ATOM 273 NE2 GLN A 17 1.859 10.383 -7.746 1.00 0.00 N ATOM 0 H GLN A 17 -0.969 6.922 -8.255 1.00 0.00 H new ATOM 0 HA GLN A 17 1.660 7.414 -7.496 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -0.209 9.064 -7.584 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -0.927 8.316 -6.171 1.00 0.00 H new ATOM 0 HG2 GLN A 17 0.259 10.200 -5.356 1.00 0.00 H new ATOM 0 HG3 GLN A 17 1.236 8.810 -4.926 1.00 0.00 H new ATOM 0 HE21 GLN A 17 0.953 10.223 -8.187 1.00 0.00 H new ATOM 0 HE22 GLN A 17 2.610 10.831 -8.271 1.00 0.00 H new ATOM 282 N LEU A 18 -0.097 5.700 -5.323 1.00 0.00 N ATOM 283 CA LEU A 18 -0.056 4.829 -4.154 1.00 0.00 C ATOM 284 C LEU A 18 0.989 3.730 -4.345 1.00 0.00 C ATOM 285 O LEU A 18 1.855 3.513 -3.506 1.00 0.00 O ATOM 286 CB LEU A 18 -1.433 4.200 -3.971 1.00 0.00 C ATOM 287 CG LEU A 18 -1.865 3.834 -2.556 1.00 0.00 C ATOM 288 CD1 LEU A 18 -3.134 3.024 -2.633 1.00 0.00 C ATOM 289 CD2 LEU A 18 -0.796 3.065 -1.805 1.00 0.00 C ATOM 0 H LEU A 18 -1.012 5.737 -5.771 1.00 0.00 H new ATOM 0 HA LEU A 18 0.214 5.412 -3.274 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -2.173 4.889 -4.379 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -1.471 3.295 -4.577 1.00 0.00 H new ATOM 0 HG LEU A 18 -2.033 4.757 -2.001 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -3.455 2.755 -1.627 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -3.913 3.613 -3.117 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -2.953 2.118 -3.211 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -1.154 2.829 -0.803 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -0.571 2.141 -2.337 1.00 0.00 H new ATOM 0 HD23 LEU A 18 0.107 3.672 -1.734 1.00 0.00 H new ATOM 301 N SER A 19 0.907 3.040 -5.462 1.00 0.00 N ATOM 302 CA SER A 19 1.830 1.959 -5.751 1.00 0.00 C ATOM 303 C SER A 19 3.270 2.478 -5.770 1.00 0.00 C ATOM 304 O SER A 19 4.221 1.750 -5.474 1.00 0.00 O ATOM 305 CB SER A 19 1.450 1.309 -7.084 1.00 0.00 C ATOM 306 OG SER A 19 1.999 2.011 -8.189 1.00 0.00 O ATOM 0 H SER A 19 0.210 3.207 -6.188 1.00 0.00 H new ATOM 0 HA SER A 19 1.766 1.204 -4.968 1.00 0.00 H new ATOM 0 HB2 SER A 19 1.801 0.277 -7.098 1.00 0.00 H new ATOM 0 HB3 SER A 19 0.364 1.278 -7.177 1.00 0.00 H new ATOM 0 HG SER A 19 1.835 2.971 -8.081 1.00 0.00 H new ATOM 312 N LEU A 20 3.407 3.761 -6.065 1.00 0.00 N ATOM 313 CA LEU A 20 4.705 4.395 -6.162 1.00 0.00 C ATOM 314 C LEU A 20 5.174 4.908 -4.797 1.00 0.00 C ATOM 315 O LEU A 20 6.371 4.908 -4.504 1.00 0.00 O ATOM 316 CB LEU A 20 4.640 5.516 -7.190 1.00 0.00 C ATOM 317 CG LEU A 20 4.325 5.047 -8.606 1.00 0.00 C ATOM 318 CD1 LEU A 20 4.534 6.170 -9.593 1.00 0.00 C ATOM 319 CD2 LEU A 20 5.168 3.841 -8.976 1.00 0.00 C ATOM 0 H LEU A 20 2.622 4.388 -6.243 1.00 0.00 H new ATOM 0 HA LEU A 20 5.440 3.660 -6.490 1.00 0.00 H new ATOM 0 HB2 LEU A 20 3.881 6.235 -6.880 1.00 0.00 H new ATOM 0 HB3 LEU A 20 5.594 6.043 -7.197 1.00 0.00 H new ATOM 0 HG LEU A 20 3.277 4.748 -8.642 1.00 0.00 H new ATOM 0 HD11 LEU A 20 4.305 5.818 -10.599 1.00 0.00 H new ATOM 0 HD12 LEU A 20 3.877 7.003 -9.341 1.00 0.00 H new ATOM 0 HD13 LEU A 20 5.572 6.502 -9.553 1.00 0.00 H new ATOM 0 HD21 LEU A 20 4.925 3.525 -9.991 1.00 0.00 H new ATOM 0 HD22 LEU A 20 6.224 4.105 -8.921 1.00 0.00 H new ATOM 0 HD23 LEU A 20 4.961 3.026 -8.283 1.00 0.00 H new ATOM 331 N ASP A 21 4.230 5.338 -3.961 1.00 0.00 N ATOM 332 CA ASP A 21 4.546 5.769 -2.597 1.00 0.00 C ATOM 333 C ASP A 21 4.810 4.559 -1.699 1.00 0.00 C ATOM 334 O ASP A 21 5.593 4.637 -0.752 1.00 0.00 O ATOM 335 CB ASP A 21 3.460 6.700 -2.029 1.00 0.00 C ATOM 336 CG ASP A 21 2.076 6.093 -1.903 1.00 0.00 C ATOM 337 OD1 ASP A 21 1.937 5.013 -1.306 1.00 0.00 O ATOM 338 OD2 ASP A 21 1.118 6.726 -2.396 1.00 0.00 O ATOM 0 H ASP A 21 3.241 5.398 -4.202 1.00 0.00 H new ATOM 0 HA ASP A 21 5.463 6.357 -2.628 1.00 0.00 H new ATOM 0 HB2 ASP A 21 3.778 7.041 -1.044 1.00 0.00 H new ATOM 0 HB3 ASP A 21 3.394 7.582 -2.666 1.00 0.00 H new ATOM 343 N ILE A 22 4.198 3.431 -2.029 1.00 0.00 N ATOM 344 CA ILE A 22 4.513 2.166 -1.382 1.00 0.00 C ATOM 345 C ILE A 22 5.939 1.744 -1.704 1.00 0.00 C ATOM 346 O ILE A 22 6.664 1.249 -0.842 1.00 0.00 O ATOM 347 CB ILE A 22 3.502 1.080 -1.815 1.00 0.00 C ATOM 348 CG1 ILE A 22 2.372 1.015 -0.791 1.00 0.00 C ATOM 349 CG2 ILE A 22 4.154 -0.288 -2.019 1.00 0.00 C ATOM 350 CD1 ILE A 22 1.175 0.218 -1.254 1.00 0.00 C ATOM 0 H ILE A 22 3.476 3.366 -2.746 1.00 0.00 H new ATOM 0 HA ILE A 22 4.436 2.294 -0.302 1.00 0.00 H new ATOM 0 HB ILE A 22 3.097 1.359 -2.788 1.00 0.00 H new ATOM 0 HG12 ILE A 22 2.754 0.577 0.131 1.00 0.00 H new ATOM 0 HG13 ILE A 22 2.051 2.029 -0.553 1.00 0.00 H new ATOM 0 HG21 ILE A 22 3.396 -1.011 -2.322 1.00 0.00 H new ATOM 0 HG22 ILE A 22 4.917 -0.215 -2.794 1.00 0.00 H new ATOM 0 HG23 ILE A 22 4.614 -0.614 -1.086 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.414 0.217 -0.473 1.00 0.00 H new ATOM 0 HD12 ILE A 22 0.766 0.668 -2.159 1.00 0.00 H new ATOM 0 HD13 ILE A 22 1.480 -0.807 -1.465 1.00 0.00 H new ATOM 362 N ASN A 23 6.345 1.967 -2.947 1.00 0.00 N ATOM 363 CA ASN A 23 7.707 1.653 -3.370 1.00 0.00 C ATOM 364 C ASN A 23 8.726 2.585 -2.721 1.00 0.00 C ATOM 365 O ASN A 23 9.922 2.294 -2.701 1.00 0.00 O ATOM 366 CB ASN A 23 7.838 1.729 -4.888 1.00 0.00 C ATOM 367 CG ASN A 23 7.306 0.495 -5.592 1.00 0.00 C ATOM 368 OD1 ASN A 23 6.791 0.577 -6.708 1.00 0.00 O ATOM 369 ND2 ASN A 23 7.442 -0.663 -4.958 1.00 0.00 N ATOM 0 H ASN A 23 5.755 2.362 -3.679 1.00 0.00 H new ATOM 0 HA ASN A 23 7.915 0.634 -3.044 1.00 0.00 H new ATOM 0 HB2 ASN A 23 7.302 2.606 -5.250 1.00 0.00 H new ATOM 0 HB3 ASN A 23 8.887 1.866 -5.150 1.00 0.00 H new ATOM 0 HD21 ASN A 23 7.115 -1.525 -5.394 1.00 0.00 H new ATOM 0 HD22 ASN A 23 7.874 -0.691 -4.034 1.00 0.00 H new ATOM 376 N LYS A 24 8.251 3.715 -2.215 1.00 0.00 N ATOM 377 CA LYS A 24 9.102 4.652 -1.494 1.00 0.00 C ATOM 378 C LYS A 24 9.412 4.137 -0.089 1.00 0.00 C ATOM 379 O LYS A 24 10.404 4.534 0.525 1.00 0.00 O ATOM 380 CB LYS A 24 8.423 6.012 -1.397 1.00 0.00 C ATOM 381 CG LYS A 24 8.624 6.917 -2.604 1.00 0.00 C ATOM 382 CD LYS A 24 7.843 8.220 -2.444 1.00 0.00 C ATOM 383 CE LYS A 24 8.193 9.248 -3.512 1.00 0.00 C ATOM 384 NZ LYS A 24 7.860 8.775 -4.879 1.00 0.00 N ATOM 0 H LYS A 24 7.276 4.006 -2.291 1.00 0.00 H new ATOM 0 HA LYS A 24 10.037 4.751 -2.046 1.00 0.00 H new ATOM 0 HB2 LYS A 24 7.354 5.858 -1.251 1.00 0.00 H new ATOM 0 HB3 LYS A 24 8.795 6.525 -0.510 1.00 0.00 H new ATOM 0 HG2 LYS A 24 9.685 7.137 -2.726 1.00 0.00 H new ATOM 0 HG3 LYS A 24 8.299 6.402 -3.508 1.00 0.00 H new ATOM 0 HD2 LYS A 24 6.775 8.007 -2.487 1.00 0.00 H new ATOM 0 HD3 LYS A 24 8.045 8.642 -1.459 1.00 0.00 H new ATOM 0 HE2 LYS A 24 7.657 10.175 -3.310 1.00 0.00 H new ATOM 0 HE3 LYS A 24 9.257 9.477 -3.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 8.116 9.507 -5.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 8.391 7.904 -5.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 6.840 8.581 -4.940 1.00 0.00 H new ATOM 398 N LEU A 25 8.550 3.263 0.412 1.00 0.00 N ATOM 399 CA LEU A 25 8.721 2.688 1.738 1.00 0.00 C ATOM 400 C LEU A 25 9.843 1.662 1.750 1.00 0.00 C ATOM 401 O LEU A 25 9.947 0.845 0.839 1.00 0.00 O ATOM 402 CB LEU A 25 7.425 2.025 2.207 1.00 0.00 C ATOM 403 CG LEU A 25 6.283 2.976 2.534 1.00 0.00 C ATOM 404 CD1 LEU A 25 5.243 2.244 3.339 1.00 0.00 C ATOM 405 CD2 LEU A 25 6.786 4.174 3.309 1.00 0.00 C ATOM 0 H LEU A 25 7.721 2.936 -0.084 1.00 0.00 H new ATOM 0 HA LEU A 25 8.979 3.500 2.417 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.090 1.335 1.433 1.00 0.00 H new ATOM 0 HB3 LEU A 25 7.643 1.428 3.093 1.00 0.00 H new ATOM 0 HG LEU A 25 5.844 3.334 1.602 1.00 0.00 H new ATOM 0 HD11 LEU A 25 4.423 2.922 3.576 1.00 0.00 H new ATOM 0 HD12 LEU A 25 4.863 1.401 2.762 1.00 0.00 H new ATOM 0 HD13 LEU A 25 5.690 1.878 4.264 1.00 0.00 H new ATOM 0 HD21 LEU A 25 5.952 4.840 3.531 1.00 0.00 H new ATOM 0 HD22 LEU A 25 7.242 3.839 4.241 1.00 0.00 H new ATOM 0 HD23 LEU A 25 7.527 4.707 2.714 1.00 0.00 H new ATOM 417 N PRO A 26 10.704 1.695 2.782 1.00 0.00 N ATOM 418 CA PRO A 26 11.741 0.678 2.960 1.00 0.00 C ATOM 419 C PRO A 26 11.125 -0.674 3.302 1.00 0.00 C ATOM 420 O PRO A 26 10.019 -0.717 3.843 1.00 0.00 O ATOM 421 CB PRO A 26 12.575 1.198 4.134 1.00 0.00 C ATOM 422 CG PRO A 26 11.684 2.148 4.863 1.00 0.00 C ATOM 423 CD PRO A 26 10.736 2.721 3.840 1.00 0.00 C ATOM 0 HA PRO A 26 12.331 0.524 2.057 1.00 0.00 H new ATOM 0 HB2 PRO A 26 12.893 0.381 4.782 1.00 0.00 H new ATOM 0 HB3 PRO A 26 13.478 1.697 3.784 1.00 0.00 H new ATOM 0 HG2 PRO A 26 11.137 1.636 5.654 1.00 0.00 H new ATOM 0 HG3 PRO A 26 12.266 2.938 5.338 1.00 0.00 H new ATOM 0 HD2 PRO A 26 9.746 2.892 4.263 1.00 0.00 H new ATOM 0 HD3 PRO A 26 11.089 3.679 3.459 1.00 0.00 H new ATOM 431 N GLY A 27 11.837 -1.757 3.001 1.00 0.00 N ATOM 432 CA GLY A 27 11.297 -3.102 3.176 1.00 0.00 C ATOM 433 C GLY A 27 10.604 -3.308 4.511 1.00 0.00 C ATOM 434 O GLY A 27 9.493 -3.836 4.571 1.00 0.00 O ATOM 0 H GLY A 27 12.789 -1.729 2.635 1.00 0.00 H new ATOM 0 HA2 GLY A 27 10.589 -3.308 2.373 1.00 0.00 H new ATOM 0 HA3 GLY A 27 12.107 -3.825 3.081 1.00 0.00 H new ATOM 438 N GLU A 28 11.250 -2.868 5.579 1.00 0.00 N ATOM 439 CA GLU A 28 10.701 -3.000 6.920 1.00 0.00 C ATOM 440 C GLU A 28 9.392 -2.217 7.082 1.00 0.00 C ATOM 441 O GLU A 28 8.404 -2.747 7.593 1.00 0.00 O ATOM 442 CB GLU A 28 11.722 -2.577 7.986 1.00 0.00 C ATOM 443 CG GLU A 28 12.753 -1.558 7.529 1.00 0.00 C ATOM 444 CD GLU A 28 13.851 -2.153 6.666 1.00 0.00 C ATOM 445 OE1 GLU A 28 14.748 -2.827 7.213 1.00 0.00 O ATOM 446 OE2 GLU A 28 13.823 -1.937 5.437 1.00 0.00 O ATOM 0 H GLU A 28 12.162 -2.413 5.543 1.00 0.00 H new ATOM 0 HA GLU A 28 10.474 -4.056 7.067 1.00 0.00 H new ATOM 0 HB2 GLU A 28 11.183 -2.166 8.839 1.00 0.00 H new ATOM 0 HB3 GLU A 28 12.245 -3.466 8.338 1.00 0.00 H new ATOM 0 HG2 GLU A 28 12.250 -0.769 6.970 1.00 0.00 H new ATOM 0 HG3 GLU A 28 13.203 -1.091 8.405 1.00 0.00 H new ATOM 453 N LYS A 29 9.361 -0.978 6.603 1.00 0.00 N ATOM 454 CA LYS A 29 8.172 -0.138 6.758 1.00 0.00 C ATOM 455 C LYS A 29 7.071 -0.582 5.806 1.00 0.00 C ATOM 456 O LYS A 29 5.883 -0.406 6.074 1.00 0.00 O ATOM 457 CB LYS A 29 8.503 1.331 6.477 1.00 0.00 C ATOM 458 CG LYS A 29 8.875 2.160 7.700 1.00 0.00 C ATOM 459 CD LYS A 29 10.041 1.567 8.466 1.00 0.00 C ATOM 460 CE LYS A 29 10.845 2.650 9.167 1.00 0.00 C ATOM 461 NZ LYS A 29 10.018 3.438 10.120 1.00 0.00 N ATOM 0 H LYS A 29 10.135 -0.534 6.109 1.00 0.00 H new ATOM 0 HA LYS A 29 7.829 -0.243 7.787 1.00 0.00 H new ATOM 0 HB2 LYS A 29 9.329 1.371 5.767 1.00 0.00 H new ATOM 0 HB3 LYS A 29 7.643 1.794 5.993 1.00 0.00 H new ATOM 0 HG2 LYS A 29 9.127 3.173 7.386 1.00 0.00 H new ATOM 0 HG3 LYS A 29 8.011 2.237 8.360 1.00 0.00 H new ATOM 0 HD2 LYS A 29 9.671 0.852 9.201 1.00 0.00 H new ATOM 0 HD3 LYS A 29 10.687 1.016 7.782 1.00 0.00 H new ATOM 0 HE2 LYS A 29 11.677 2.193 9.703 1.00 0.00 H new ATOM 0 HE3 LYS A 29 11.275 3.320 8.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 10.632 4.071 10.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 9.323 4.003 9.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 9.520 2.791 10.764 1.00 0.00 H new ATOM 475 N LEU A 30 7.467 -1.176 4.700 1.00 0.00 N ATOM 476 CA LEU A 30 6.512 -1.612 3.706 1.00 0.00 C ATOM 477 C LEU A 30 5.930 -2.978 4.064 1.00 0.00 C ATOM 478 O LEU A 30 4.930 -3.409 3.493 1.00 0.00 O ATOM 479 CB LEU A 30 7.147 -1.543 2.310 1.00 0.00 C ATOM 480 CG LEU A 30 6.984 -2.745 1.384 1.00 0.00 C ATOM 481 CD1 LEU A 30 7.285 -2.311 -0.028 1.00 0.00 C ATOM 482 CD2 LEU A 30 7.907 -3.887 1.788 1.00 0.00 C ATOM 0 H LEU A 30 8.442 -1.367 4.468 1.00 0.00 H new ATOM 0 HA LEU A 30 5.657 -0.936 3.690 1.00 0.00 H new ATOM 0 HB2 LEU A 30 6.736 -0.672 1.800 1.00 0.00 H new ATOM 0 HB3 LEU A 30 8.214 -1.364 2.438 1.00 0.00 H new ATOM 0 HG LEU A 30 5.960 -3.111 1.456 1.00 0.00 H new ATOM 0 HD11 LEU A 30 7.172 -3.161 -0.702 1.00 0.00 H new ATOM 0 HD12 LEU A 30 6.593 -1.521 -0.321 1.00 0.00 H new ATOM 0 HD13 LEU A 30 8.307 -1.937 -0.084 1.00 0.00 H new ATOM 0 HD21 LEU A 30 7.766 -4.727 1.108 1.00 0.00 H new ATOM 0 HD22 LEU A 30 8.943 -3.552 1.740 1.00 0.00 H new ATOM 0 HD23 LEU A 30 7.674 -4.201 2.806 1.00 0.00 H new ATOM 494 N GLY A 31 6.536 -3.646 5.036 1.00 0.00 N ATOM 495 CA GLY A 31 5.903 -4.819 5.615 1.00 0.00 C ATOM 496 C GLY A 31 4.587 -4.447 6.279 1.00 0.00 C ATOM 497 O GLY A 31 3.717 -5.290 6.470 1.00 0.00 O ATOM 0 H GLY A 31 7.444 -3.402 5.432 1.00 0.00 H new ATOM 0 HA2 GLY A 31 5.727 -5.564 4.839 1.00 0.00 H new ATOM 0 HA3 GLY A 31 6.570 -5.274 6.347 1.00 0.00 H new ATOM 501 N ARG A 32 4.438 -3.169 6.627 1.00 0.00 N ATOM 502 CA ARG A 32 3.180 -2.681 7.185 1.00 0.00 C ATOM 503 C ARG A 32 2.079 -2.677 6.142 1.00 0.00 C ATOM 504 O ARG A 32 0.952 -3.045 6.444 1.00 0.00 O ATOM 505 CB ARG A 32 3.310 -1.275 7.742 1.00 0.00 C ATOM 506 CG ARG A 32 2.026 -0.749 8.366 1.00 0.00 C ATOM 507 CD ARG A 32 2.274 -0.280 9.785 1.00 0.00 C ATOM 508 NE ARG A 32 2.692 -1.375 10.656 1.00 0.00 N ATOM 509 CZ ARG A 32 3.935 -1.531 11.119 1.00 0.00 C ATOM 510 NH1 ARG A 32 4.890 -0.668 10.784 1.00 0.00 N ATOM 511 NH2 ARG A 32 4.225 -2.556 11.906 1.00 0.00 N ATOM 0 H ARG A 32 5.166 -2.460 6.533 1.00 0.00 H new ATOM 0 HA ARG A 32 2.925 -3.366 7.994 1.00 0.00 H new ATOM 0 HB2 ARG A 32 4.101 -1.261 8.492 1.00 0.00 H new ATOM 0 HB3 ARG A 32 3.618 -0.602 6.941 1.00 0.00 H new ATOM 0 HG2 ARG A 32 1.636 0.075 7.768 1.00 0.00 H new ATOM 0 HG3 ARG A 32 1.267 -1.532 8.364 1.00 0.00 H new ATOM 0 HD2 ARG A 32 3.041 0.495 9.782 1.00 0.00 H new ATOM 0 HD3 ARG A 32 1.365 0.173 10.182 1.00 0.00 H new ATOM 0 HE ARG A 32 1.991 -2.064 10.928 1.00 0.00 H new ATOM 0 HH11 ARG A 32 4.675 0.118 10.171 1.00 0.00 H new ATOM 0 HH12 ARG A 32 5.838 -0.792 11.141 1.00 0.00 H new ATOM 0 HH21 ARG A 32 3.499 -3.226 12.159 1.00 0.00 H new ATOM 0 HH22 ARG A 32 5.174 -2.675 12.259 1.00 0.00 H new ATOM 525 N VAL A 33 2.389 -2.239 4.923 1.00 0.00 N ATOM 526 CA VAL A 33 1.374 -2.220 3.872 1.00 0.00 C ATOM 527 C VAL A 33 0.879 -3.629 3.605 1.00 0.00 C ATOM 528 O VAL A 33 -0.323 -3.864 3.568 1.00 0.00 O ATOM 529 CB VAL A 33 1.847 -1.558 2.554 1.00 0.00 C ATOM 530 CG1 VAL A 33 1.075 -0.284 2.318 1.00 0.00 C ATOM 531 CG2 VAL A 33 3.322 -1.232 2.567 1.00 0.00 C ATOM 0 H VAL A 33 3.310 -1.901 4.643 1.00 0.00 H new ATOM 0 HA VAL A 33 0.560 -1.598 4.244 1.00 0.00 H new ATOM 0 HB VAL A 33 1.666 -2.277 1.755 1.00 0.00 H new ATOM 0 HG11 VAL A 33 1.411 0.178 1.390 1.00 0.00 H new ATOM 0 HG12 VAL A 33 0.011 -0.511 2.246 1.00 0.00 H new ATOM 0 HG13 VAL A 33 1.244 0.403 3.147 1.00 0.00 H new ATOM 0 HG21 VAL A 33 3.601 -0.770 1.620 1.00 0.00 H new ATOM 0 HG22 VAL A 33 3.535 -0.542 3.384 1.00 0.00 H new ATOM 0 HG23 VAL A 33 3.896 -2.148 2.707 1.00 0.00 H new ATOM 541 N VAL A 34 1.812 -4.560 3.454 1.00 0.00 N ATOM 542 CA VAL A 34 1.473 -5.988 3.382 1.00 0.00 C ATOM 543 C VAL A 34 0.566 -6.375 4.562 1.00 0.00 C ATOM 544 O VAL A 34 -0.413 -7.090 4.384 1.00 0.00 O ATOM 545 CB VAL A 34 2.743 -6.904 3.369 1.00 0.00 C ATOM 546 CG1 VAL A 34 3.990 -6.138 2.958 1.00 0.00 C ATOM 547 CG2 VAL A 34 2.960 -7.619 4.699 1.00 0.00 C ATOM 0 H VAL A 34 2.809 -4.360 3.378 1.00 0.00 H new ATOM 0 HA VAL A 34 0.947 -6.145 2.441 1.00 0.00 H new ATOM 0 HB VAL A 34 2.556 -7.670 2.616 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.848 -6.810 2.962 1.00 0.00 H new ATOM 0 HG12 VAL A 34 3.853 -5.730 1.956 1.00 0.00 H new ATOM 0 HG13 VAL A 34 4.164 -5.323 3.660 1.00 0.00 H new ATOM 0 HG21 VAL A 34 3.853 -8.241 4.636 1.00 0.00 H new ATOM 0 HG22 VAL A 34 3.086 -6.882 5.492 1.00 0.00 H new ATOM 0 HG23 VAL A 34 2.096 -8.246 4.920 1.00 0.00 H new ATOM 557 N HIS A 35 0.880 -5.865 5.756 1.00 0.00 N ATOM 558 CA HIS A 35 0.123 -6.190 6.963 1.00 0.00 C ATOM 559 C HIS A 35 -1.276 -5.583 6.912 1.00 0.00 C ATOM 560 O HIS A 35 -2.261 -6.271 7.167 1.00 0.00 O ATOM 561 CB HIS A 35 0.875 -5.706 8.213 1.00 0.00 C ATOM 562 CG HIS A 35 0.170 -5.996 9.506 1.00 0.00 C ATOM 563 ND1 HIS A 35 0.346 -7.161 10.218 1.00 0.00 N ATOM 564 CD2 HIS A 35 -0.716 -5.257 10.217 1.00 0.00 C ATOM 565 CE1 HIS A 35 -0.397 -7.127 11.307 1.00 0.00 C ATOM 566 NE2 HIS A 35 -1.051 -5.983 11.331 1.00 0.00 N ATOM 0 H HIS A 35 1.657 -5.223 5.910 1.00 0.00 H new ATOM 0 HA HIS A 35 0.018 -7.274 7.016 1.00 0.00 H new ATOM 0 HB2 HIS A 35 1.859 -6.175 8.236 1.00 0.00 H new ATOM 0 HB3 HIS A 35 1.036 -4.631 8.133 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -1.089 -4.278 9.955 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -0.459 -7.905 12.053 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -1.700 -5.686 12.059 1.00 0.00 H new ATOM 575 N ILE A 36 -1.353 -4.295 6.595 1.00 0.00 N ATOM 576 CA ILE A 36 -2.633 -3.610 6.456 1.00 0.00 C ATOM 577 C ILE A 36 -3.480 -4.320 5.417 1.00 0.00 C ATOM 578 O ILE A 36 -4.654 -4.596 5.627 1.00 0.00 O ATOM 579 CB ILE A 36 -2.447 -2.141 6.021 1.00 0.00 C ATOM 580 CG1 ILE A 36 -1.645 -1.383 7.080 1.00 0.00 C ATOM 581 CG2 ILE A 36 -3.804 -1.483 5.785 1.00 0.00 C ATOM 582 CD1 ILE A 36 -1.149 -0.032 6.626 1.00 0.00 C ATOM 0 H ILE A 36 -0.540 -3.702 6.429 1.00 0.00 H new ATOM 0 HA ILE A 36 -3.124 -3.626 7.429 1.00 0.00 H new ATOM 0 HB ILE A 36 -1.892 -2.112 5.083 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -2.266 -1.251 7.966 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -0.791 -1.991 7.378 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.658 -0.447 5.479 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -4.338 -2.021 5.002 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -4.387 -1.510 6.706 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -0.590 0.441 7.434 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -0.500 -0.155 5.759 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -1.998 0.596 6.357 1.00 0.00 H new ATOM 594 N ILE A 37 -2.847 -4.620 4.307 1.00 0.00 N ATOM 595 CA ILE A 37 -3.485 -5.308 3.212 1.00 0.00 C ATOM 596 C ILE A 37 -3.961 -6.703 3.629 1.00 0.00 C ATOM 597 O ILE A 37 -5.146 -6.962 3.616 1.00 0.00 O ATOM 598 CB ILE A 37 -2.520 -5.365 2.025 1.00 0.00 C ATOM 599 CG1 ILE A 37 -2.458 -3.999 1.356 1.00 0.00 C ATOM 600 CG2 ILE A 37 -2.919 -6.441 1.041 1.00 0.00 C ATOM 601 CD1 ILE A 37 -1.213 -3.792 0.545 1.00 0.00 C ATOM 0 H ILE A 37 -1.867 -4.391 4.138 1.00 0.00 H new ATOM 0 HA ILE A 37 -4.377 -4.757 2.912 1.00 0.00 H new ATOM 0 HB ILE A 37 -1.527 -5.624 2.392 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -3.328 -3.878 0.711 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -2.518 -3.224 2.121 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -2.213 -6.454 0.211 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -2.912 -7.410 1.539 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -3.920 -6.235 0.663 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -1.232 -2.799 0.096 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -0.339 -3.881 1.191 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -1.162 -4.545 -0.241 1.00 0.00 H new ATOM 613 N GLN A 38 -3.047 -7.577 4.030 1.00 0.00 N ATOM 614 CA GLN A 38 -3.406 -8.941 4.460 1.00 0.00 C ATOM 615 C GLN A 38 -4.506 -8.948 5.528 1.00 0.00 C ATOM 616 O GLN A 38 -5.319 -9.871 5.584 1.00 0.00 O ATOM 617 CB GLN A 38 -2.188 -9.680 5.029 1.00 0.00 C ATOM 618 CG GLN A 38 -1.103 -9.993 4.019 1.00 0.00 C ATOM 619 CD GLN A 38 0.073 -10.720 4.647 1.00 0.00 C ATOM 620 OE1 GLN A 38 1.217 -10.541 4.239 1.00 0.00 O ATOM 621 NE2 GLN A 38 -0.199 -11.557 5.635 1.00 0.00 N ATOM 0 H GLN A 38 -2.048 -7.375 4.070 1.00 0.00 H new ATOM 0 HA GLN A 38 -3.774 -9.446 3.567 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -1.757 -9.078 5.829 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -2.525 -10.614 5.479 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -1.520 -10.604 3.218 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -0.754 -9.066 3.564 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -1.162 -11.681 5.948 1.00 0.00 H new ATOM 0 HE22 GLN A 38 0.554 -12.079 6.084 1.00 0.00 H new ATOM 630 N SER A 39 -4.514 -7.939 6.390 1.00 0.00 N ATOM 631 CA SER A 39 -5.480 -7.885 7.482 1.00 0.00 C ATOM 632 C SER A 39 -6.833 -7.368 7.000 1.00 0.00 C ATOM 633 O SER A 39 -7.876 -7.943 7.316 1.00 0.00 O ATOM 634 CB SER A 39 -4.945 -7.008 8.617 1.00 0.00 C ATOM 635 OG SER A 39 -4.658 -5.691 8.177 1.00 0.00 O ATOM 0 H SER A 39 -3.867 -7.151 6.356 1.00 0.00 H new ATOM 0 HA SER A 39 -5.625 -8.898 7.856 1.00 0.00 H new ATOM 0 HB2 SER A 39 -5.678 -6.970 9.423 1.00 0.00 H new ATOM 0 HB3 SER A 39 -4.042 -7.458 9.029 1.00 0.00 H new ATOM 0 HG SER A 39 -3.702 -5.615 7.975 1.00 0.00 H new ATOM 641 N ARG A 40 -6.807 -6.286 6.234 1.00 0.00 N ATOM 642 CA ARG A 40 -8.028 -5.693 5.702 1.00 0.00 C ATOM 643 C ARG A 40 -8.561 -6.516 4.542 1.00 0.00 C ATOM 644 O ARG A 40 -9.748 -6.481 4.229 1.00 0.00 O ATOM 645 CB ARG A 40 -7.768 -4.245 5.280 1.00 0.00 C ATOM 646 CG ARG A 40 -7.430 -3.375 6.460 1.00 0.00 C ATOM 647 CD ARG A 40 -7.200 -1.940 6.061 1.00 0.00 C ATOM 648 NE ARG A 40 -8.458 -1.207 5.987 1.00 0.00 N ATOM 649 CZ ARG A 40 -8.668 -0.026 6.570 1.00 0.00 C ATOM 650 NH1 ARG A 40 -7.662 0.633 7.138 1.00 0.00 N ATOM 651 NH2 ARG A 40 -9.885 0.498 6.581 1.00 0.00 N ATOM 0 H ARG A 40 -5.952 -5.799 5.966 1.00 0.00 H new ATOM 0 HA ARG A 40 -8.788 -5.690 6.483 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -6.950 -4.217 4.560 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -8.649 -3.849 4.776 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -8.240 -3.423 7.188 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -6.537 -3.762 6.951 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -6.538 -1.461 6.782 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -6.697 -1.904 5.094 1.00 0.00 H new ATOM 0 HE ARG A 40 -9.224 -1.623 5.457 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -6.723 0.236 7.130 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -7.830 1.536 7.582 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -10.659 -0.002 6.144 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -10.047 1.401 7.026 1.00 0.00 H new ATOM 665 N GLU A 41 -7.664 -7.261 3.926 1.00 0.00 N ATOM 666 CA GLU A 41 -7.998 -8.174 2.851 1.00 0.00 C ATOM 667 C GLU A 41 -7.695 -9.598 3.293 1.00 0.00 C ATOM 668 O GLU A 41 -6.676 -10.168 2.897 1.00 0.00 O ATOM 669 CB GLU A 41 -7.156 -7.868 1.620 1.00 0.00 C ATOM 670 CG GLU A 41 -7.053 -6.399 1.280 1.00 0.00 C ATOM 671 CD GLU A 41 -8.352 -5.811 0.747 1.00 0.00 C ATOM 672 OE1 GLU A 41 -9.202 -6.583 0.241 1.00 0.00 O ATOM 673 OE2 GLU A 41 -8.535 -4.574 0.846 1.00 0.00 O ATOM 0 H GLU A 41 -6.671 -7.249 4.161 1.00 0.00 H new ATOM 0 HA GLU A 41 -9.055 -8.061 2.610 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -6.152 -8.263 1.775 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -7.579 -8.397 0.766 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -6.751 -5.848 2.170 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -6.268 -6.259 0.537 1.00 0.00 H new ATOM 680 N PRO A 42 -8.563 -10.220 4.101 1.00 0.00 N ATOM 681 CA PRO A 42 -8.266 -11.533 4.669 1.00 0.00 C ATOM 682 C PRO A 42 -8.389 -12.626 3.624 1.00 0.00 C ATOM 683 O PRO A 42 -8.118 -13.800 3.873 1.00 0.00 O ATOM 684 CB PRO A 42 -9.321 -11.679 5.753 1.00 0.00 C ATOM 685 CG PRO A 42 -10.485 -10.898 5.252 1.00 0.00 C ATOM 686 CD PRO A 42 -9.904 -9.734 4.496 1.00 0.00 C ATOM 0 HA PRO A 42 -7.248 -11.618 5.048 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -9.584 -12.725 5.912 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -8.965 -11.291 6.708 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -11.116 -11.508 4.606 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -11.110 -10.556 6.077 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -10.510 -9.475 3.628 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -9.841 -8.841 5.118 1.00 0.00 H new ATOM 694 N SER A 43 -8.815 -12.210 2.455 1.00 0.00 N ATOM 695 CA SER A 43 -8.865 -13.069 1.288 1.00 0.00 C ATOM 696 C SER A 43 -7.462 -13.326 0.739 1.00 0.00 C ATOM 697 O SER A 43 -7.257 -14.247 -0.052 1.00 0.00 O ATOM 698 CB SER A 43 -9.749 -12.428 0.221 1.00 0.00 C ATOM 699 OG SER A 43 -9.478 -11.039 0.115 1.00 0.00 O ATOM 0 H SER A 43 -9.140 -11.259 2.282 1.00 0.00 H new ATOM 0 HA SER A 43 -9.290 -14.030 1.576 1.00 0.00 H new ATOM 0 HB2 SER A 43 -9.577 -12.912 -0.740 1.00 0.00 H new ATOM 0 HB3 SER A 43 -10.799 -12.581 0.471 1.00 0.00 H new ATOM 0 HG SER A 43 -10.052 -10.645 -0.575 1.00 0.00 H new ATOM 705 N LEU A 44 -6.495 -12.509 1.154 1.00 0.00 N ATOM 706 CA LEU A 44 -5.114 -12.701 0.739 1.00 0.00 C ATOM 707 C LEU A 44 -4.207 -12.936 1.944 1.00 0.00 C ATOM 708 O LEU A 44 -3.001 -12.711 1.886 1.00 0.00 O ATOM 709 CB LEU A 44 -4.628 -11.516 -0.120 1.00 0.00 C ATOM 710 CG LEU A 44 -4.650 -10.132 0.509 1.00 0.00 C ATOM 711 CD1 LEU A 44 -3.310 -9.798 1.124 1.00 0.00 C ATOM 712 CD2 LEU A 44 -5.017 -9.098 -0.542 1.00 0.00 C ATOM 0 H LEU A 44 -6.645 -11.713 1.774 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.066 -13.596 0.118 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -3.605 -11.726 -0.433 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -5.238 -11.484 -1.023 1.00 0.00 H new ATOM 0 HG LEU A 44 -5.398 -10.122 1.302 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -3.351 -8.803 1.567 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -3.071 -10.530 1.896 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -2.540 -9.820 0.353 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -5.032 -8.107 -0.088 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -4.280 -9.118 -1.345 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -6.003 -9.326 -0.948 1.00 0.00 H new ATOM 724 N LYS A 45 -4.791 -13.433 3.031 1.00 0.00 N ATOM 725 CA LYS A 45 -4.026 -13.726 4.241 1.00 0.00 C ATOM 726 C LYS A 45 -3.099 -14.917 4.010 1.00 0.00 C ATOM 727 O LYS A 45 -2.146 -15.124 4.759 1.00 0.00 O ATOM 728 CB LYS A 45 -4.952 -14.008 5.429 1.00 0.00 C ATOM 729 CG LYS A 45 -5.764 -15.285 5.293 1.00 0.00 C ATOM 730 CD LYS A 45 -6.599 -15.548 6.530 1.00 0.00 C ATOM 731 CE LYS A 45 -5.705 -15.869 7.710 1.00 0.00 C ATOM 732 NZ LYS A 45 -6.464 -16.455 8.846 1.00 0.00 N ATOM 0 H LYS A 45 -5.787 -13.641 3.100 1.00 0.00 H new ATOM 0 HA LYS A 45 -3.426 -12.847 4.476 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -4.352 -14.066 6.337 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -5.635 -13.167 5.551 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -6.415 -15.212 4.422 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -5.094 -16.127 5.120 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -7.211 -14.675 6.756 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -7.282 -16.377 6.346 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -4.928 -16.566 7.396 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -5.203 -14.960 8.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -5.812 -16.659 9.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -7.189 -15.780 9.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -6.923 -17.337 8.539 1.00 0.00 H new ATOM 746 N ASN A 46 -3.389 -15.699 2.972 1.00 0.00 N ATOM 747 CA ASN A 46 -2.553 -16.836 2.603 1.00 0.00 C ATOM 748 C ASN A 46 -1.242 -16.352 1.989 1.00 0.00 C ATOM 749 O ASN A 46 -0.265 -17.099 1.898 1.00 0.00 O ATOM 750 CB ASN A 46 -3.294 -17.732 1.609 1.00 0.00 C ATOM 751 CG ASN A 46 -2.613 -19.070 1.401 1.00 0.00 C ATOM 752 OD1 ASN A 46 -1.999 -19.621 2.315 1.00 0.00 O ATOM 753 ND2 ASN A 46 -2.716 -19.605 0.196 1.00 0.00 N ATOM 0 H ASN A 46 -4.201 -15.564 2.370 1.00 0.00 H new ATOM 0 HA ASN A 46 -2.330 -17.411 3.502 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -4.310 -17.899 1.965 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -3.372 -17.217 0.652 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -2.278 -20.505 -0.002 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -3.233 -19.118 -0.536 1.00 0.00 H new ATOM 760 N SER A 47 -1.224 -15.093 1.576 1.00 0.00 N ATOM 761 CA SER A 47 -0.037 -14.497 0.983 1.00 0.00 C ATOM 762 C SER A 47 1.027 -14.248 2.052 1.00 0.00 C ATOM 763 O SER A 47 0.714 -13.977 3.215 1.00 0.00 O ATOM 764 CB SER A 47 -0.406 -13.194 0.271 1.00 0.00 C ATOM 765 OG SER A 47 -1.319 -13.434 -0.789 1.00 0.00 O ATOM 0 H SER A 47 -2.023 -14.462 1.642 1.00 0.00 H new ATOM 0 HA SER A 47 0.376 -15.189 0.249 1.00 0.00 H new ATOM 0 HB2 SER A 47 -0.847 -12.498 0.985 1.00 0.00 H new ATOM 0 HB3 SER A 47 0.495 -12.722 -0.120 1.00 0.00 H new ATOM 0 HG SER A 47 -1.541 -12.586 -1.228 1.00 0.00 H new ATOM 771 N ASN A 48 2.282 -14.369 1.650 1.00 0.00 N ATOM 772 CA ASN A 48 3.410 -14.203 2.559 1.00 0.00 C ATOM 773 C ASN A 48 3.683 -12.723 2.786 1.00 0.00 C ATOM 774 O ASN A 48 3.661 -11.936 1.846 1.00 0.00 O ATOM 775 CB ASN A 48 4.658 -14.846 1.963 1.00 0.00 C ATOM 776 CG ASN A 48 4.460 -16.294 1.561 1.00 0.00 C ATOM 777 OD1 ASN A 48 4.008 -16.579 0.454 1.00 0.00 O ATOM 778 ND2 ASN A 48 4.810 -17.216 2.438 1.00 0.00 N ATOM 0 H ASN A 48 2.549 -14.584 0.689 1.00 0.00 H new ATOM 0 HA ASN A 48 3.164 -14.682 3.507 1.00 0.00 H new ATOM 0 HB2 ASN A 48 4.969 -14.274 1.089 1.00 0.00 H new ATOM 0 HB3 ASN A 48 5.469 -14.786 2.688 1.00 0.00 H new ATOM 0 HD21 ASN A 48 4.709 -18.204 2.207 1.00 0.00 H new ATOM 0 HD22 ASN A 48 5.181 -16.940 3.347 1.00 0.00 H new ATOM 785 N PRO A 49 3.967 -12.333 4.037 1.00 0.00 N ATOM 786 CA PRO A 49 4.205 -10.930 4.396 1.00 0.00 C ATOM 787 C PRO A 49 5.476 -10.357 3.769 1.00 0.00 C ATOM 788 O PRO A 49 5.616 -9.143 3.630 1.00 0.00 O ATOM 789 CB PRO A 49 4.327 -10.960 5.921 1.00 0.00 C ATOM 790 CG PRO A 49 4.702 -12.360 6.253 1.00 0.00 C ATOM 791 CD PRO A 49 4.059 -13.223 5.207 1.00 0.00 C ATOM 0 HA PRO A 49 3.404 -10.288 4.030 1.00 0.00 H new ATOM 0 HB2 PRO A 49 5.083 -10.256 6.270 1.00 0.00 H new ATOM 0 HB3 PRO A 49 3.387 -10.680 6.397 1.00 0.00 H new ATOM 0 HG2 PRO A 49 5.785 -12.485 6.249 1.00 0.00 H new ATOM 0 HG3 PRO A 49 4.354 -12.631 7.250 1.00 0.00 H new ATOM 0 HD2 PRO A 49 4.658 -14.108 4.992 1.00 0.00 H new ATOM 0 HD3 PRO A 49 3.076 -13.573 5.524 1.00 0.00 H new ATOM 799 N ASP A 50 6.405 -11.228 3.403 1.00 0.00 N ATOM 800 CA ASP A 50 7.650 -10.795 2.771 1.00 0.00 C ATOM 801 C ASP A 50 7.586 -10.995 1.266 1.00 0.00 C ATOM 802 O ASP A 50 8.545 -10.716 0.549 1.00 0.00 O ATOM 803 CB ASP A 50 8.844 -11.572 3.329 1.00 0.00 C ATOM 804 CG ASP A 50 9.129 -11.259 4.782 1.00 0.00 C ATOM 805 OD1 ASP A 50 8.470 -11.852 5.661 1.00 0.00 O ATOM 806 OD2 ASP A 50 10.025 -10.428 5.055 1.00 0.00 O ATOM 0 H ASP A 50 6.324 -12.237 3.531 1.00 0.00 H new ATOM 0 HA ASP A 50 7.778 -9.735 2.990 1.00 0.00 H new ATOM 0 HB2 ASP A 50 8.656 -12.640 3.224 1.00 0.00 H new ATOM 0 HB3 ASP A 50 9.728 -11.344 2.734 1.00 0.00 H new ATOM 811 N GLU A 51 6.451 -11.481 0.795 1.00 0.00 N ATOM 812 CA GLU A 51 6.278 -11.809 -0.599 1.00 0.00 C ATOM 813 C GLU A 51 4.893 -11.388 -1.048 1.00 0.00 C ATOM 814 O GLU A 51 4.286 -12.005 -1.927 1.00 0.00 O ATOM 815 CB GLU A 51 6.489 -13.302 -0.812 1.00 0.00 C ATOM 816 CG GLU A 51 7.893 -13.661 -1.254 1.00 0.00 C ATOM 817 CD GLU A 51 8.060 -15.132 -1.539 1.00 0.00 C ATOM 818 OE1 GLU A 51 8.132 -15.928 -0.582 1.00 0.00 O ATOM 819 OE2 GLU A 51 8.130 -15.497 -2.731 1.00 0.00 O ATOM 0 H GLU A 51 5.628 -11.657 1.371 1.00 0.00 H new ATOM 0 HA GLU A 51 7.016 -11.274 -1.196 1.00 0.00 H new ATOM 0 HB2 GLU A 51 6.264 -13.828 0.116 1.00 0.00 H new ATOM 0 HB3 GLU A 51 5.780 -13.657 -1.560 1.00 0.00 H new ATOM 0 HG2 GLU A 51 8.143 -13.092 -2.149 1.00 0.00 H new ATOM 0 HG3 GLU A 51 8.600 -13.364 -0.479 1.00 0.00 H new ATOM 826 N ILE A 52 4.396 -10.343 -0.408 1.00 0.00 N ATOM 827 CA ILE A 52 3.020 -9.924 -0.567 1.00 0.00 C ATOM 828 C ILE A 52 2.714 -9.450 -1.973 1.00 0.00 C ATOM 829 O ILE A 52 3.595 -9.052 -2.739 1.00 0.00 O ATOM 830 CB ILE A 52 2.644 -8.830 0.453 1.00 0.00 C ATOM 831 CG1 ILE A 52 1.143 -8.865 0.751 1.00 0.00 C ATOM 832 CG2 ILE A 52 3.022 -7.459 -0.070 1.00 0.00 C ATOM 833 CD1 ILE A 52 0.646 -10.203 1.206 1.00 0.00 C ATOM 0 H ILE A 52 4.937 -9.764 0.235 1.00 0.00 H new ATOM 0 HA ILE A 52 2.411 -10.808 -0.378 1.00 0.00 H new ATOM 0 HB ILE A 52 3.196 -9.025 1.372 1.00 0.00 H new ATOM 0 HG12 ILE A 52 0.917 -8.124 1.518 1.00 0.00 H new ATOM 0 HG13 ILE A 52 0.597 -8.571 -0.146 1.00 0.00 H new ATOM 0 HG21 ILE A 52 2.748 -6.701 0.664 1.00 0.00 H new ATOM 0 HG22 ILE A 52 4.097 -7.421 -0.248 1.00 0.00 H new ATOM 0 HG23 ILE A 52 2.493 -7.267 -1.004 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -0.426 -10.147 1.397 1.00 0.00 H new ATOM 0 HD12 ILE A 52 0.838 -10.945 0.431 1.00 0.00 H new ATOM 0 HD13 ILE A 52 1.163 -10.491 2.121 1.00 0.00 H new ATOM 845 N GLU A 53 1.446 -9.535 -2.289 1.00 0.00 N ATOM 846 CA GLU A 53 0.915 -9.063 -3.542 1.00 0.00 C ATOM 847 C GLU A 53 -0.031 -7.913 -3.240 1.00 0.00 C ATOM 848 O GLU A 53 -1.189 -8.144 -2.881 1.00 0.00 O ATOM 849 CB GLU A 53 0.156 -10.216 -4.222 1.00 0.00 C ATOM 850 CG GLU A 53 -0.491 -9.882 -5.557 1.00 0.00 C ATOM 851 CD GLU A 53 0.515 -9.791 -6.675 1.00 0.00 C ATOM 852 OE1 GLU A 53 1.096 -8.712 -6.871 1.00 0.00 O ATOM 853 OE2 GLU A 53 0.727 -10.817 -7.360 1.00 0.00 O ATOM 0 H GLU A 53 0.743 -9.941 -1.672 1.00 0.00 H new ATOM 0 HA GLU A 53 1.708 -8.723 -4.208 1.00 0.00 H new ATOM 0 HB2 GLU A 53 0.849 -11.044 -4.372 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -0.619 -10.568 -3.541 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -1.232 -10.644 -5.799 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -1.024 -8.935 -5.473 1.00 0.00 H new ATOM 860 N ILE A 54 0.452 -6.679 -3.330 1.00 0.00 N ATOM 861 CA ILE A 54 -0.424 -5.554 -3.160 1.00 0.00 C ATOM 862 C ILE A 54 -1.238 -5.371 -4.431 1.00 0.00 C ATOM 863 O ILE A 54 -0.759 -4.814 -5.422 1.00 0.00 O ATOM 864 CB ILE A 54 0.346 -4.258 -2.857 1.00 0.00 C ATOM 865 CG1 ILE A 54 1.251 -4.416 -1.633 1.00 0.00 C ATOM 866 CG2 ILE A 54 -0.626 -3.120 -2.649 1.00 0.00 C ATOM 867 CD1 ILE A 54 1.861 -3.106 -1.179 1.00 0.00 C ATOM 0 H ILE A 54 1.428 -6.447 -3.516 1.00 0.00 H new ATOM 0 HA ILE A 54 -1.072 -5.756 -2.307 1.00 0.00 H new ATOM 0 HB ILE A 54 0.984 -4.035 -3.712 1.00 0.00 H new ATOM 0 HG12 ILE A 54 0.674 -4.846 -0.814 1.00 0.00 H new ATOM 0 HG13 ILE A 54 2.049 -5.121 -1.866 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -0.074 -2.205 -2.435 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -1.222 -2.981 -3.551 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -1.284 -3.352 -1.811 1.00 0.00 H new ATOM 0 HD11 ILE A 54 2.492 -3.281 -0.308 1.00 0.00 H new ATOM 0 HD12 ILE A 54 2.463 -2.686 -1.985 1.00 0.00 H new ATOM 0 HD13 ILE A 54 1.067 -2.407 -0.917 1.00 0.00 H new ATOM 879 N ASP A 55 -2.461 -5.854 -4.402 1.00 0.00 N ATOM 880 CA ASP A 55 -3.327 -5.789 -5.562 1.00 0.00 C ATOM 881 C ASP A 55 -4.282 -4.620 -5.412 1.00 0.00 C ATOM 882 O ASP A 55 -5.344 -4.745 -4.805 1.00 0.00 O ATOM 883 CB ASP A 55 -4.098 -7.101 -5.723 1.00 0.00 C ATOM 884 CG ASP A 55 -4.893 -7.144 -7.010 1.00 0.00 C ATOM 885 OD1 ASP A 55 -5.962 -6.509 -7.069 1.00 0.00 O ATOM 886 OD2 ASP A 55 -4.451 -7.815 -7.967 1.00 0.00 O ATOM 0 H ASP A 55 -2.881 -6.298 -3.585 1.00 0.00 H new ATOM 0 HA ASP A 55 -2.723 -5.641 -6.457 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -3.398 -7.936 -5.702 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -4.773 -7.230 -4.877 1.00 0.00 H new ATOM 891 N PHE A 56 -3.894 -3.484 -5.974 1.00 0.00 N ATOM 892 CA PHE A 56 -4.613 -2.228 -5.776 1.00 0.00 C ATOM 893 C PHE A 56 -6.020 -2.249 -6.377 1.00 0.00 C ATOM 894 O PHE A 56 -6.811 -1.336 -6.152 1.00 0.00 O ATOM 895 CB PHE A 56 -3.806 -1.071 -6.356 1.00 0.00 C ATOM 896 CG PHE A 56 -2.477 -0.879 -5.680 1.00 0.00 C ATOM 897 CD1 PHE A 56 -2.408 -0.286 -4.432 1.00 0.00 C ATOM 898 CD2 PHE A 56 -1.301 -1.290 -6.281 1.00 0.00 C ATOM 899 CE1 PHE A 56 -1.210 -0.102 -3.797 1.00 0.00 C ATOM 900 CE2 PHE A 56 -0.088 -1.110 -5.646 1.00 0.00 C ATOM 901 CZ PHE A 56 -0.046 -0.511 -4.399 1.00 0.00 C ATOM 0 H PHE A 56 -3.076 -3.404 -6.578 1.00 0.00 H new ATOM 0 HA PHE A 56 -4.733 -2.092 -4.701 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -3.644 -1.247 -7.419 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -4.386 -0.152 -6.270 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -3.318 0.038 -3.949 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -1.332 -1.756 -7.255 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -1.180 0.364 -2.823 1.00 0.00 H new ATOM 0 HE2 PHE A 56 0.825 -1.436 -6.121 1.00 0.00 H new ATOM 0 HZ PHE A 56 0.901 -0.366 -3.900 1.00 0.00 H new ATOM 911 N GLU A 57 -6.329 -3.292 -7.131 1.00 0.00 N ATOM 912 CA GLU A 57 -7.652 -3.444 -7.708 1.00 0.00 C ATOM 913 C GLU A 57 -8.591 -4.128 -6.723 1.00 0.00 C ATOM 914 O GLU A 57 -9.762 -3.759 -6.609 1.00 0.00 O ATOM 915 CB GLU A 57 -7.563 -4.237 -9.012 1.00 0.00 C ATOM 916 CG GLU A 57 -6.911 -3.457 -10.140 1.00 0.00 C ATOM 917 CD GLU A 57 -7.736 -2.262 -10.581 1.00 0.00 C ATOM 918 OE1 GLU A 57 -7.849 -1.282 -9.812 1.00 0.00 O ATOM 919 OE2 GLU A 57 -8.273 -2.295 -11.710 1.00 0.00 O ATOM 0 H GLU A 57 -5.680 -4.046 -7.357 1.00 0.00 H new ATOM 0 HA GLU A 57 -8.056 -2.456 -7.927 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -6.997 -5.152 -8.836 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -8.566 -4.536 -9.317 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -5.927 -3.115 -9.818 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -6.755 -4.120 -10.991 1.00 0.00 H new ATOM 926 N THR A 58 -8.075 -5.116 -6.006 1.00 0.00 N ATOM 927 CA THR A 58 -8.869 -5.839 -5.025 1.00 0.00 C ATOM 928 C THR A 58 -8.846 -5.134 -3.673 1.00 0.00 C ATOM 929 O THR A 58 -9.786 -5.265 -2.890 1.00 0.00 O ATOM 930 CB THR A 58 -8.390 -7.295 -4.862 1.00 0.00 C ATOM 931 OG1 THR A 58 -6.979 -7.328 -4.639 1.00 0.00 O ATOM 932 CG2 THR A 58 -8.730 -8.118 -6.093 1.00 0.00 C ATOM 0 H THR A 58 -7.109 -5.435 -6.086 1.00 0.00 H new ATOM 0 HA THR A 58 -9.893 -5.856 -5.398 1.00 0.00 H new ATOM 0 HB THR A 58 -8.903 -7.725 -4.002 1.00 0.00 H new ATOM 0 HG1 THR A 58 -6.686 -8.257 -4.536 1.00 0.00 H new ATOM 0 HG21 THR A 58 -8.382 -9.142 -5.954 1.00 0.00 H new ATOM 0 HG22 THR A 58 -9.810 -8.119 -6.243 1.00 0.00 H new ATOM 0 HG23 THR A 58 -8.243 -7.685 -6.966 1.00 0.00 H new ATOM 940 N LEU A 59 -7.774 -4.386 -3.406 1.00 0.00 N ATOM 941 CA LEU A 59 -7.680 -3.602 -2.184 1.00 0.00 C ATOM 942 C LEU A 59 -8.847 -2.640 -2.088 1.00 0.00 C ATOM 943 O LEU A 59 -9.103 -1.860 -3.011 1.00 0.00 O ATOM 944 CB LEU A 59 -6.371 -2.838 -2.127 1.00 0.00 C ATOM 945 CG LEU A 59 -5.143 -3.726 -2.072 1.00 0.00 C ATOM 946 CD1 LEU A 59 -3.889 -2.898 -1.949 1.00 0.00 C ATOM 947 CD2 LEU A 59 -5.263 -4.708 -0.924 1.00 0.00 C ATOM 0 H LEU A 59 -6.964 -4.310 -4.021 1.00 0.00 H new ATOM 0 HA LEU A 59 -7.712 -4.289 -1.338 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -6.301 -2.191 -3.002 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -6.378 -2.190 -1.251 1.00 0.00 H new ATOM 0 HG LEU A 59 -5.077 -4.290 -3.002 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.021 -3.556 -1.911 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -3.805 -2.235 -2.810 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -3.934 -2.303 -1.037 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -4.376 -5.341 -0.893 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -5.352 -4.161 0.015 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -6.147 -5.329 -1.067 1.00 0.00 H new ATOM 959 N LYS A 60 -9.575 -2.730 -0.991 1.00 0.00 N ATOM 960 CA LYS A 60 -10.708 -1.855 -0.757 1.00 0.00 C ATOM 961 C LYS A 60 -10.238 -0.417 -0.599 1.00 0.00 C ATOM 962 O LYS A 60 -9.112 -0.187 -0.150 1.00 0.00 O ATOM 963 CB LYS A 60 -11.472 -2.303 0.491 1.00 0.00 C ATOM 964 CG LYS A 60 -12.176 -3.634 0.326 1.00 0.00 C ATOM 965 CD LYS A 60 -12.727 -4.147 1.645 1.00 0.00 C ATOM 966 CE LYS A 60 -11.608 -4.435 2.634 1.00 0.00 C ATOM 967 NZ LYS A 60 -12.099 -5.154 3.837 1.00 0.00 N ATOM 0 H LYS A 60 -9.401 -3.403 -0.245 1.00 0.00 H new ATOM 0 HA LYS A 60 -11.377 -1.911 -1.616 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -10.777 -2.371 1.328 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -12.208 -1.542 0.749 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -12.990 -3.528 -0.392 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -11.480 -4.365 -0.086 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -13.409 -3.410 2.068 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -13.306 -5.054 1.472 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -10.837 -5.031 2.145 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -11.142 -3.497 2.937 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -11.326 -5.719 4.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -12.432 -4.465 4.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -12.883 -5.782 3.570 1.00 0.00 H new ATOM 981 N PRO A 61 -11.065 0.567 -0.988 1.00 0.00 N ATOM 982 CA PRO A 61 -10.737 1.981 -0.815 1.00 0.00 C ATOM 983 C PRO A 61 -10.187 2.268 0.577 1.00 0.00 C ATOM 984 O PRO A 61 -9.238 3.038 0.742 1.00 0.00 O ATOM 985 CB PRO A 61 -12.076 2.684 -1.014 1.00 0.00 C ATOM 986 CG PRO A 61 -12.852 1.787 -1.909 1.00 0.00 C ATOM 987 CD PRO A 61 -12.366 0.381 -1.655 1.00 0.00 C ATOM 0 HA PRO A 61 -9.964 2.313 -1.508 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -12.589 2.833 -0.064 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -11.942 3.669 -1.462 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -13.920 1.869 -1.705 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -12.705 2.063 -2.953 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -13.061 -0.174 -1.025 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -12.261 -0.179 -2.584 1.00 0.00 H new ATOM 995 N SER A 62 -10.782 1.612 1.566 1.00 0.00 N ATOM 996 CA SER A 62 -10.363 1.733 2.948 1.00 0.00 C ATOM 997 C SER A 62 -8.881 1.377 3.114 1.00 0.00 C ATOM 998 O SER A 62 -8.125 2.134 3.725 1.00 0.00 O ATOM 999 CB SER A 62 -11.230 0.824 3.813 1.00 0.00 C ATOM 1000 OG SER A 62 -12.605 1.007 3.522 1.00 0.00 O ATOM 0 H SER A 62 -11.571 0.980 1.427 1.00 0.00 H new ATOM 0 HA SER A 62 -10.487 2.769 3.264 1.00 0.00 H new ATOM 0 HB2 SER A 62 -10.954 -0.217 3.643 1.00 0.00 H new ATOM 0 HB3 SER A 62 -11.046 1.035 4.866 1.00 0.00 H new ATOM 0 HG SER A 62 -12.854 1.940 3.690 1.00 0.00 H new ATOM 1006 N THR A 63 -8.467 0.237 2.559 1.00 0.00 N ATOM 1007 CA THR A 63 -7.075 -0.183 2.645 1.00 0.00 C ATOM 1008 C THR A 63 -6.200 0.779 1.866 1.00 0.00 C ATOM 1009 O THR A 63 -5.208 1.263 2.385 1.00 0.00 O ATOM 1010 CB THR A 63 -6.865 -1.616 2.098 1.00 0.00 C ATOM 1011 OG1 THR A 63 -8.017 -2.418 2.401 1.00 0.00 O ATOM 1012 CG2 THR A 63 -5.619 -2.269 2.698 1.00 0.00 C ATOM 0 H THR A 63 -9.074 -0.405 2.049 1.00 0.00 H new ATOM 0 HA THR A 63 -6.799 -0.180 3.699 1.00 0.00 H new ATOM 0 HB THR A 63 -6.726 -1.548 1.019 1.00 0.00 H new ATOM 0 HG1 THR A 63 -8.116 -3.118 1.723 1.00 0.00 H new ATOM 0 HG21 THR A 63 -5.503 -3.274 2.291 1.00 0.00 H new ATOM 0 HG22 THR A 63 -4.741 -1.673 2.449 1.00 0.00 H new ATOM 0 HG23 THR A 63 -5.724 -2.326 3.781 1.00 0.00 H new ATOM 1020 N LEU A 64 -6.603 1.088 0.637 1.00 0.00 N ATOM 1021 CA LEU A 64 -5.821 1.955 -0.236 1.00 0.00 C ATOM 1022 C LEU A 64 -5.561 3.313 0.408 1.00 0.00 C ATOM 1023 O LEU A 64 -4.431 3.796 0.403 1.00 0.00 O ATOM 1024 CB LEU A 64 -6.529 2.134 -1.578 1.00 0.00 C ATOM 1025 CG LEU A 64 -6.658 0.869 -2.420 1.00 0.00 C ATOM 1026 CD1 LEU A 64 -7.479 1.144 -3.664 1.00 0.00 C ATOM 1027 CD2 LEU A 64 -5.285 0.359 -2.801 1.00 0.00 C ATOM 0 H LEU A 64 -7.471 0.749 0.222 1.00 0.00 H new ATOM 0 HA LEU A 64 -4.857 1.475 -0.402 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -7.527 2.531 -1.394 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -5.990 2.883 -2.158 1.00 0.00 H new ATOM 0 HG LEU A 64 -7.167 0.106 -1.831 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -7.562 0.231 -4.254 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -8.475 1.481 -3.376 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -6.992 1.917 -4.258 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -5.386 -0.545 -3.402 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -4.761 1.121 -3.377 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -4.718 0.132 -1.898 1.00 0.00 H new ATOM 1039 N ARG A 65 -6.598 3.922 0.973 1.00 0.00 N ATOM 1040 CA ARG A 65 -6.442 5.209 1.639 1.00 0.00 C ATOM 1041 C ARG A 65 -5.585 5.066 2.891 1.00 0.00 C ATOM 1042 O ARG A 65 -4.908 6.011 3.297 1.00 0.00 O ATOM 1043 CB ARG A 65 -7.800 5.808 1.991 1.00 0.00 C ATOM 1044 CG ARG A 65 -8.610 6.260 0.783 1.00 0.00 C ATOM 1045 CD ARG A 65 -7.944 7.406 0.030 1.00 0.00 C ATOM 1046 NE ARG A 65 -8.731 7.813 -1.138 1.00 0.00 N ATOM 1047 CZ ARG A 65 -8.286 8.620 -2.106 1.00 0.00 C ATOM 1048 NH1 ARG A 65 -7.034 9.069 -2.095 1.00 0.00 N ATOM 1049 NH2 ARG A 65 -9.091 8.958 -3.109 1.00 0.00 N ATOM 0 H ARG A 65 -7.547 3.549 0.983 1.00 0.00 H new ATOM 0 HA ARG A 65 -5.938 5.886 0.949 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -8.378 5.070 2.547 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -7.649 6.660 2.654 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -8.749 5.417 0.106 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -9.602 6.572 1.111 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -7.818 8.257 0.699 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -6.947 7.102 -0.290 1.00 0.00 H new ATOM 0 HE ARG A 65 -9.683 7.456 -1.217 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -6.402 8.798 -1.342 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -6.706 9.684 -2.840 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -10.046 8.602 -3.139 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -8.753 9.574 -3.849 1.00 0.00 H new ATOM 1063 N GLU A 66 -5.610 3.883 3.495 1.00 0.00 N ATOM 1064 CA GLU A 66 -4.757 3.591 4.634 1.00 0.00 C ATOM 1065 C GLU A 66 -3.304 3.466 4.182 1.00 0.00 C ATOM 1066 O GLU A 66 -2.439 4.159 4.698 1.00 0.00 O ATOM 1067 CB GLU A 66 -5.211 2.302 5.322 1.00 0.00 C ATOM 1068 CG GLU A 66 -4.295 1.858 6.446 1.00 0.00 C ATOM 1069 CD GLU A 66 -4.275 2.833 7.602 1.00 0.00 C ATOM 1070 OE1 GLU A 66 -5.214 2.796 8.427 1.00 0.00 O ATOM 1071 OE2 GLU A 66 -3.327 3.634 7.695 1.00 0.00 O ATOM 0 H GLU A 66 -6.214 3.111 3.212 1.00 0.00 H new ATOM 0 HA GLU A 66 -4.834 4.411 5.348 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -6.216 2.447 5.719 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -5.273 1.506 4.580 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -4.616 0.880 6.806 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -3.283 1.739 6.059 1.00 0.00 H new ATOM 1078 N LEU A 67 -3.058 2.579 3.215 1.00 0.00 N ATOM 1079 CA LEU A 67 -1.733 2.400 2.616 1.00 0.00 C ATOM 1080 C LEU A 67 -1.131 3.759 2.254 1.00 0.00 C ATOM 1081 O LEU A 67 -0.024 4.086 2.674 1.00 0.00 O ATOM 1082 CB LEU A 67 -1.855 1.513 1.363 1.00 0.00 C ATOM 1083 CG LEU A 67 -2.759 0.296 1.530 1.00 0.00 C ATOM 1084 CD1 LEU A 67 -2.960 -0.399 0.207 1.00 0.00 C ATOM 1085 CD2 LEU A 67 -2.172 -0.677 2.531 1.00 0.00 C ATOM 0 H LEU A 67 -3.772 1.964 2.825 1.00 0.00 H new ATOM 0 HA LEU A 67 -1.073 1.914 3.334 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -2.233 2.120 0.540 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.860 1.173 1.077 1.00 0.00 H new ATOM 0 HG LEU A 67 -3.723 0.644 1.901 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -3.607 -1.265 0.346 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.422 0.290 -0.500 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -1.996 -0.726 -0.183 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -2.834 -1.537 2.634 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -1.194 -1.011 2.183 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -2.065 -0.184 3.497 1.00 0.00 H new ATOM 1097 N GLU A 68 -1.899 4.551 1.512 1.00 0.00 N ATOM 1098 CA GLU A 68 -1.505 5.906 1.117 1.00 0.00 C ATOM 1099 C GLU A 68 -1.151 6.771 2.337 1.00 0.00 C ATOM 1100 O GLU A 68 -0.035 7.260 2.468 1.00 0.00 O ATOM 1101 CB GLU A 68 -2.663 6.559 0.357 1.00 0.00 C ATOM 1102 CG GLU A 68 -2.424 8.000 -0.030 1.00 0.00 C ATOM 1103 CD GLU A 68 -3.694 8.825 0.025 1.00 0.00 C ATOM 1104 OE1 GLU A 68 -4.554 8.680 -0.865 1.00 0.00 O ATOM 1105 OE2 GLU A 68 -3.844 9.632 0.971 1.00 0.00 O ATOM 0 H GLU A 68 -2.817 4.273 1.165 1.00 0.00 H new ATOM 0 HA GLU A 68 -0.620 5.834 0.485 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -2.860 5.981 -0.546 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -3.561 6.505 0.972 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -1.681 8.435 0.638 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -2.010 8.040 -1.037 1.00 0.00 H new ATOM 1112 N ARG A 69 -2.116 6.952 3.230 1.00 0.00 N ATOM 1113 CA ARG A 69 -1.936 7.796 4.420 1.00 0.00 C ATOM 1114 C ARG A 69 -0.833 7.266 5.321 1.00 0.00 C ATOM 1115 O ARG A 69 -0.237 8.005 6.107 1.00 0.00 O ATOM 1116 CB ARG A 69 -3.240 7.860 5.202 1.00 0.00 C ATOM 1117 CG ARG A 69 -4.074 9.105 4.949 1.00 0.00 C ATOM 1118 CD ARG A 69 -3.745 10.209 5.943 1.00 0.00 C ATOM 1119 NE ARG A 69 -2.345 10.626 5.874 1.00 0.00 N ATOM 1120 CZ ARG A 69 -1.572 10.834 6.945 1.00 0.00 C ATOM 1121 NH1 ARG A 69 -2.048 10.640 8.168 1.00 0.00 N ATOM 1122 NH2 ARG A 69 -0.317 11.220 6.790 1.00 0.00 N ATOM 0 H ARG A 69 -3.040 6.525 3.158 1.00 0.00 H new ATOM 0 HA ARG A 69 -1.649 8.792 4.084 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -3.838 6.983 4.956 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -3.012 7.802 6.266 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -3.897 9.463 3.935 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -5.133 8.855 5.019 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -4.387 11.069 5.751 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -3.968 9.863 6.952 1.00 0.00 H new ATOM 0 HE ARG A 69 -1.933 10.767 4.952 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -3.011 10.330 8.297 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -1.451 10.801 8.979 1.00 0.00 H new ATOM 0 HH21 ARG A 69 0.062 11.359 5.853 1.00 0.00 H new ATOM 0 HH22 ARG A 69 0.272 11.379 7.607 1.00 0.00 H new ATOM 1136 N TYR A 70 -0.570 5.986 5.212 1.00 0.00 N ATOM 1137 CA TYR A 70 0.472 5.371 5.989 1.00 0.00 C ATOM 1138 C TYR A 70 1.829 5.769 5.439 1.00 0.00 C ATOM 1139 O TYR A 70 2.703 6.227 6.179 1.00 0.00 O ATOM 1140 CB TYR A 70 0.331 3.860 5.972 1.00 0.00 C ATOM 1141 CG TYR A 70 1.555 3.176 6.492 1.00 0.00 C ATOM 1142 CD1 TYR A 70 1.997 3.389 7.790 1.00 0.00 C ATOM 1143 CD2 TYR A 70 2.283 2.345 5.672 1.00 0.00 C ATOM 1144 CE1 TYR A 70 3.141 2.783 8.255 1.00 0.00 C ATOM 1145 CE2 TYR A 70 3.427 1.734 6.122 1.00 0.00 C ATOM 1146 CZ TYR A 70 3.856 1.956 7.420 1.00 0.00 C ATOM 1147 OH TYR A 70 5.003 1.352 7.884 1.00 0.00 O ATOM 0 H TYR A 70 -1.067 5.350 4.589 1.00 0.00 H new ATOM 0 HA TYR A 70 0.385 5.716 7.019 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -0.530 3.570 6.574 1.00 0.00 H new ATOM 0 HB3 TYR A 70 0.134 3.526 4.953 1.00 0.00 H new ATOM 0 HD1 TYR A 70 1.435 4.039 8.444 1.00 0.00 H new ATOM 0 HD2 TYR A 70 1.950 2.171 4.660 1.00 0.00 H new ATOM 0 HE1 TYR A 70 3.475 2.955 9.267 1.00 0.00 H new ATOM 0 HE2 TYR A 70 3.989 1.084 5.468 1.00 0.00 H new ATOM 0 HH TYR A 70 5.485 0.946 7.134 1.00 0.00 H new ATOM 1157 N VAL A 71 2.005 5.612 4.137 1.00 0.00 N ATOM 1158 CA VAL A 71 3.272 5.939 3.524 1.00 0.00 C ATOM 1159 C VAL A 71 3.560 7.418 3.709 1.00 0.00 C ATOM 1160 O VAL A 71 4.696 7.804 3.930 1.00 0.00 O ATOM 1161 CB VAL A 71 3.323 5.614 2.016 1.00 0.00 C ATOM 1162 CG1 VAL A 71 2.832 4.214 1.720 1.00 0.00 C ATOM 1163 CG2 VAL A 71 2.544 6.619 1.209 1.00 0.00 C ATOM 0 H VAL A 71 1.293 5.264 3.495 1.00 0.00 H new ATOM 0 HA VAL A 71 4.023 5.322 4.018 1.00 0.00 H new ATOM 0 HB VAL A 71 4.371 5.671 1.722 1.00 0.00 H new ATOM 0 HG11 VAL A 71 2.886 4.029 0.647 1.00 0.00 H new ATOM 0 HG12 VAL A 71 3.456 3.491 2.245 1.00 0.00 H new ATOM 0 HG13 VAL A 71 1.800 4.112 2.055 1.00 0.00 H new ATOM 0 HG21 VAL A 71 2.601 6.360 0.152 1.00 0.00 H new ATOM 0 HG22 VAL A 71 1.502 6.613 1.528 1.00 0.00 H new ATOM 0 HG23 VAL A 71 2.964 7.613 1.362 1.00 0.00 H new ATOM 1173 N THR A 72 2.515 8.241 3.669 1.00 0.00 N ATOM 1174 CA THR A 72 2.695 9.678 3.707 1.00 0.00 C ATOM 1175 C THR A 72 3.263 10.123 5.043 1.00 0.00 C ATOM 1176 O THR A 72 3.982 11.117 5.122 1.00 0.00 O ATOM 1177 CB THR A 72 1.399 10.436 3.393 1.00 0.00 C ATOM 1178 OG1 THR A 72 0.358 10.066 4.295 1.00 0.00 O ATOM 1179 CG2 THR A 72 0.980 10.115 1.984 1.00 0.00 C ATOM 0 H THR A 72 1.544 7.934 3.611 1.00 0.00 H new ATOM 0 HA THR A 72 3.413 9.925 2.925 1.00 0.00 H new ATOM 0 HB THR A 72 1.580 11.505 3.503 1.00 0.00 H new ATOM 0 HG1 THR A 72 0.658 9.318 4.852 1.00 0.00 H new ATOM 0 HG21 THR A 72 0.059 10.648 1.748 1.00 0.00 H new ATOM 0 HG22 THR A 72 1.764 10.422 1.292 1.00 0.00 H new ATOM 0 HG23 THR A 72 0.813 9.042 1.890 1.00 0.00 H new ATOM 1187 N SER A 73 2.961 9.358 6.085 1.00 0.00 N ATOM 1188 CA SER A 73 3.517 9.613 7.403 1.00 0.00 C ATOM 1189 C SER A 73 5.035 9.401 7.377 1.00 0.00 C ATOM 1190 O SER A 73 5.777 9.992 8.163 1.00 0.00 O ATOM 1191 CB SER A 73 2.860 8.691 8.435 1.00 0.00 C ATOM 1192 OG SER A 73 3.379 7.376 8.366 1.00 0.00 O ATOM 0 H SER A 73 2.333 8.555 6.040 1.00 0.00 H new ATOM 0 HA SER A 73 3.315 10.646 7.686 1.00 0.00 H new ATOM 0 HB2 SER A 73 3.019 9.093 9.436 1.00 0.00 H new ATOM 0 HB3 SER A 73 1.783 8.667 8.268 1.00 0.00 H new ATOM 0 HG SER A 73 3.316 7.047 7.445 1.00 0.00 H new ATOM 1198 N CYS A 74 5.481 8.557 6.451 1.00 0.00 N ATOM 1199 CA CYS A 74 6.904 8.248 6.301 1.00 0.00 C ATOM 1200 C CYS A 74 7.538 9.060 5.169 1.00 0.00 C ATOM 1201 O CYS A 74 8.722 9.378 5.213 1.00 0.00 O ATOM 1202 CB CYS A 74 7.101 6.742 6.058 1.00 0.00 C ATOM 1203 SG CYS A 74 8.821 6.242 5.827 1.00 0.00 S ATOM 0 H CYS A 74 4.876 8.071 5.789 1.00 0.00 H new ATOM 0 HA CYS A 74 7.405 8.525 7.228 1.00 0.00 H new ATOM 0 HB2 CYS A 74 6.686 6.193 6.903 1.00 0.00 H new ATOM 0 HB3 CYS A 74 6.529 6.451 5.177 1.00 0.00 H new ATOM 0 HG CYS A 74 8.877 4.958 5.632 1.00 0.00 H new ATOM 1209 N LEU A 75 6.738 9.406 4.171 1.00 0.00 N ATOM 1210 CA LEU A 75 7.240 10.020 2.949 1.00 0.00 C ATOM 1211 C LEU A 75 7.079 11.532 2.954 1.00 0.00 C ATOM 1212 O LEU A 75 8.031 12.268 2.707 1.00 0.00 O ATOM 1213 CB LEU A 75 6.489 9.433 1.757 1.00 0.00 C ATOM 1214 CG LEU A 75 6.519 7.917 1.666 1.00 0.00 C ATOM 1215 CD1 LEU A 75 5.964 7.472 0.329 1.00 0.00 C ATOM 1216 CD2 LEU A 75 7.934 7.399 1.872 1.00 0.00 C ATOM 0 H LEU A 75 5.727 9.270 4.184 1.00 0.00 H new ATOM 0 HA LEU A 75 8.307 9.807 2.880 1.00 0.00 H new ATOM 0 HB2 LEU A 75 5.450 9.759 1.804 1.00 0.00 H new ATOM 0 HB3 LEU A 75 6.911 9.846 0.841 1.00 0.00 H new ATOM 0 HG LEU A 75 5.894 7.499 2.455 1.00 0.00 H new ATOM 0 HD11 LEU A 75 5.988 6.384 0.269 1.00 0.00 H new ATOM 0 HD12 LEU A 75 4.935 7.818 0.229 1.00 0.00 H new ATOM 0 HD13 LEU A 75 6.569 7.893 -0.474 1.00 0.00 H new ATOM 0 HD21 LEU A 75 7.937 6.311 1.804 1.00 0.00 H new ATOM 0 HD22 LEU A 75 8.588 7.813 1.104 1.00 0.00 H new ATOM 0 HD23 LEU A 75 8.293 7.702 2.856 1.00 0.00 H new ATOM 1228 N ARG A 76 5.872 11.997 3.229 1.00 0.00 N ATOM 1229 CA ARG A 76 5.572 13.417 3.132 1.00 0.00 C ATOM 1230 C ARG A 76 5.938 14.140 4.415 1.00 0.00 C ATOM 1231 O ARG A 76 5.880 15.367 4.494 1.00 0.00 O ATOM 1232 CB ARG A 76 4.107 13.626 2.789 1.00 0.00 C ATOM 1233 CG ARG A 76 3.765 13.071 1.429 1.00 0.00 C ATOM 1234 CD ARG A 76 2.364 13.433 1.016 1.00 0.00 C ATOM 1235 NE ARG A 76 2.025 12.855 -0.282 1.00 0.00 N ATOM 1236 CZ ARG A 76 0.793 12.520 -0.654 1.00 0.00 C ATOM 1237 NH1 ARG A 76 -0.234 12.743 0.156 1.00 0.00 N ATOM 1238 NH2 ARG A 76 0.591 11.964 -1.839 1.00 0.00 N ATOM 0 H ARG A 76 5.086 11.415 3.520 1.00 0.00 H new ATOM 0 HA ARG A 76 6.176 13.840 2.330 1.00 0.00 H new ATOM 0 HB2 ARG A 76 3.485 13.146 3.544 1.00 0.00 H new ATOM 0 HB3 ARG A 76 3.876 14.691 2.816 1.00 0.00 H new ATOM 0 HG2 ARG A 76 4.472 13.453 0.692 1.00 0.00 H new ATOM 0 HG3 ARG A 76 3.872 11.986 1.441 1.00 0.00 H new ATOM 0 HD2 ARG A 76 1.659 13.080 1.768 1.00 0.00 H new ATOM 0 HD3 ARG A 76 2.265 14.518 0.970 1.00 0.00 H new ATOM 0 HE ARG A 76 2.783 12.698 -0.946 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -0.080 13.173 1.068 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -1.177 12.484 -0.133 1.00 0.00 H new ATOM 0 HH21 ARG A 76 1.379 11.794 -2.464 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -0.353 11.706 -2.127 1.00 0.00 H new ATOM 1252 N LYS A 77 6.331 13.371 5.415 1.00 0.00 N ATOM 1253 CA LYS A 77 6.711 13.934 6.700 1.00 0.00 C ATOM 1254 C LYS A 77 8.223 13.911 6.865 1.00 0.00 C ATOM 1255 O LYS A 77 8.777 14.613 7.711 1.00 0.00 O ATOM 1256 CB LYS A 77 6.037 13.180 7.844 1.00 0.00 C ATOM 1257 CG LYS A 77 4.541 13.419 7.896 1.00 0.00 C ATOM 1258 CD LYS A 77 4.197 14.849 8.285 1.00 0.00 C ATOM 1259 CE LYS A 77 4.664 15.183 9.691 1.00 0.00 C ATOM 1260 NZ LYS A 77 4.211 16.535 10.114 1.00 0.00 N ATOM 0 H LYS A 77 6.396 12.354 5.363 1.00 0.00 H new ATOM 0 HA LYS A 77 6.374 14.970 6.731 1.00 0.00 H new ATOM 0 HB2 LYS A 77 6.227 12.113 7.733 1.00 0.00 H new ATOM 0 HB3 LYS A 77 6.484 13.487 8.790 1.00 0.00 H new ATOM 0 HG2 LYS A 77 4.106 13.195 6.922 1.00 0.00 H new ATOM 0 HG3 LYS A 77 4.090 12.732 8.612 1.00 0.00 H new ATOM 0 HD2 LYS A 77 4.657 15.538 7.577 1.00 0.00 H new ATOM 0 HD3 LYS A 77 3.119 14.994 8.217 1.00 0.00 H new ATOM 0 HE2 LYS A 77 4.283 14.437 10.388 1.00 0.00 H new ATOM 0 HE3 LYS A 77 5.752 15.133 9.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 4.548 16.728 11.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 4.595 17.249 9.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 3.172 16.574 10.096 1.00 0.00 H new ATOM 1274 N LYS A 78 8.884 13.113 6.038 1.00 0.00 N ATOM 1275 CA LYS A 78 10.328 12.986 6.092 1.00 0.00 C ATOM 1276 C LYS A 78 10.847 12.405 4.784 1.00 0.00 C ATOM 1277 O LYS A 78 10.960 11.190 4.638 1.00 0.00 O ATOM 1278 CB LYS A 78 10.738 12.088 7.262 1.00 0.00 C ATOM 1279 CG LYS A 78 12.204 12.212 7.644 1.00 0.00 C ATOM 1280 CD LYS A 78 12.534 13.595 8.194 1.00 0.00 C ATOM 1281 CE LYS A 78 11.773 13.896 9.478 1.00 0.00 C ATOM 1282 NZ LYS A 78 12.108 12.939 10.565 1.00 0.00 N ATOM 0 H LYS A 78 8.438 12.543 5.320 1.00 0.00 H new ATOM 0 HA LYS A 78 10.762 13.975 6.240 1.00 0.00 H new ATOM 0 HB2 LYS A 78 10.124 12.333 8.129 1.00 0.00 H new ATOM 0 HB3 LYS A 78 10.526 11.051 7.004 1.00 0.00 H new ATOM 0 HG2 LYS A 78 12.450 11.457 8.390 1.00 0.00 H new ATOM 0 HG3 LYS A 78 12.825 12.011 6.771 1.00 0.00 H new ATOM 0 HD2 LYS A 78 13.605 13.663 8.383 1.00 0.00 H new ATOM 0 HD3 LYS A 78 12.294 14.350 7.445 1.00 0.00 H new ATOM 0 HE2 LYS A 78 12.002 14.910 9.805 1.00 0.00 H new ATOM 0 HE3 LYS A 78 10.702 13.859 9.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 11.718 13.285 11.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 11.700 12.008 10.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 13.141 12.854 10.646 1.00 0.00 H new ATOM 1296 N ARG A 79 11.144 13.276 3.827 1.00 0.00 N ATOM 1297 CA ARG A 79 11.635 12.834 2.523 1.00 0.00 C ATOM 1298 C ARG A 79 12.935 12.042 2.663 1.00 0.00 C ATOM 1299 O ARG A 79 13.806 12.389 3.467 1.00 0.00 O ATOM 1300 CB ARG A 79 11.800 14.031 1.571 1.00 0.00 C ATOM 1301 CG ARG A 79 12.612 15.197 2.129 1.00 0.00 C ATOM 1302 CD ARG A 79 14.110 14.959 2.027 1.00 0.00 C ATOM 1303 NE ARG A 79 14.883 16.084 2.550 1.00 0.00 N ATOM 1304 CZ ARG A 79 16.027 15.953 3.224 1.00 0.00 C ATOM 1305 NH1 ARG A 79 16.521 14.749 3.481 1.00 0.00 N ATOM 1306 NH2 ARG A 79 16.676 17.029 3.642 1.00 0.00 N ATOM 0 H ARG A 79 11.055 14.287 3.926 1.00 0.00 H new ATOM 0 HA ARG A 79 10.894 12.164 2.088 1.00 0.00 H new ATOM 0 HB2 ARG A 79 12.276 13.683 0.654 1.00 0.00 H new ATOM 0 HB3 ARG A 79 10.810 14.396 1.297 1.00 0.00 H new ATOM 0 HG2 ARG A 79 12.354 16.108 1.589 1.00 0.00 H new ATOM 0 HG3 ARG A 79 12.342 15.358 3.173 1.00 0.00 H new ATOM 0 HD2 ARG A 79 14.371 14.054 2.576 1.00 0.00 H new ATOM 0 HD3 ARG A 79 14.379 14.788 0.985 1.00 0.00 H new ATOM 0 HE ARG A 79 14.526 17.026 2.390 1.00 0.00 H new ATOM 0 HH11 ARG A 79 16.026 13.916 3.163 1.00 0.00 H new ATOM 0 HH12 ARG A 79 17.396 14.656 3.997 1.00 0.00 H new ATOM 0 HH21 ARG A 79 16.301 17.958 3.449 1.00 0.00 H new ATOM 0 HH22 ARG A 79 17.551 16.929 4.157 1.00 0.00 H new ATOM 1320 N LYS A 80 13.037 10.967 1.884 1.00 0.00 N ATOM 1321 CA LYS A 80 14.181 10.058 1.930 1.00 0.00 C ATOM 1322 C LYS A 80 14.409 9.515 3.342 1.00 0.00 C ATOM 1323 O LYS A 80 15.417 9.817 3.986 1.00 0.00 O ATOM 1324 CB LYS A 80 15.446 10.743 1.399 1.00 0.00 C ATOM 1325 CG LYS A 80 15.371 11.090 -0.080 1.00 0.00 C ATOM 1326 CD LYS A 80 15.231 9.840 -0.937 1.00 0.00 C ATOM 1327 CE LYS A 80 15.037 10.186 -2.402 1.00 0.00 C ATOM 1328 NZ LYS A 80 14.877 8.971 -3.243 1.00 0.00 N ATOM 0 H LYS A 80 12.327 10.701 1.202 1.00 0.00 H new ATOM 0 HA LYS A 80 13.954 9.211 1.283 1.00 0.00 H new ATOM 0 HB2 LYS A 80 15.623 11.655 1.970 1.00 0.00 H new ATOM 0 HB3 LYS A 80 16.302 10.090 1.568 1.00 0.00 H new ATOM 0 HG2 LYS A 80 14.523 11.752 -0.258 1.00 0.00 H new ATOM 0 HG3 LYS A 80 16.268 11.636 -0.373 1.00 0.00 H new ATOM 0 HD2 LYS A 80 16.120 9.219 -0.824 1.00 0.00 H new ATOM 0 HD3 LYS A 80 14.384 9.251 -0.586 1.00 0.00 H new ATOM 0 HE2 LYS A 80 14.158 10.821 -2.511 1.00 0.00 H new ATOM 0 HE3 LYS A 80 15.892 10.762 -2.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 14.747 9.251 -4.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 15.726 8.376 -3.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 14.046 8.434 -2.923 1.00 0.00 H new ATOM 1342 N PRO A 81 13.477 8.682 3.832 1.00 0.00 N ATOM 1343 CA PRO A 81 13.563 8.098 5.168 1.00 0.00 C ATOM 1344 C PRO A 81 14.469 6.874 5.199 1.00 0.00 C ATOM 1345 O PRO A 81 14.716 6.291 6.254 1.00 0.00 O ATOM 1346 CB PRO A 81 12.116 7.707 5.460 1.00 0.00 C ATOM 1347 CG PRO A 81 11.542 7.375 4.123 1.00 0.00 C ATOM 1348 CD PRO A 81 12.258 8.246 3.121 1.00 0.00 C ATOM 0 HA PRO A 81 13.991 8.784 5.899 1.00 0.00 H new ATOM 0 HB2 PRO A 81 12.064 6.854 6.137 1.00 0.00 H new ATOM 0 HB3 PRO A 81 11.572 8.524 5.934 1.00 0.00 H new ATOM 0 HG2 PRO A 81 11.684 6.320 3.891 1.00 0.00 H new ATOM 0 HG3 PRO A 81 10.469 7.564 4.104 1.00 0.00 H new ATOM 0 HD2 PRO A 81 12.501 7.693 2.214 1.00 0.00 H new ATOM 0 HD3 PRO A 81 11.645 9.096 2.821 1.00 0.00 H new ATOM 1356 N GLN A 82 14.964 6.496 4.031 1.00 0.00 N ATOM 1357 CA GLN A 82 15.839 5.340 3.905 1.00 0.00 C ATOM 1358 C GLN A 82 17.302 5.754 4.032 1.00 0.00 C ATOM 1359 O GLN A 82 18.196 4.910 4.044 1.00 0.00 O ATOM 1360 CB GLN A 82 15.607 4.641 2.564 1.00 0.00 C ATOM 1361 CG GLN A 82 14.185 4.142 2.375 1.00 0.00 C ATOM 1362 CD GLN A 82 14.023 3.319 1.113 1.00 0.00 C ATOM 1363 OE1 GLN A 82 14.215 2.102 1.125 1.00 0.00 O ATOM 1364 NE2 GLN A 82 13.661 3.969 0.019 1.00 0.00 N ATOM 0 H GLN A 82 14.773 6.976 3.151 1.00 0.00 H new ATOM 0 HA GLN A 82 15.604 4.645 4.711 1.00 0.00 H new ATOM 0 HB2 GLN A 82 15.851 5.332 1.757 1.00 0.00 H new ATOM 0 HB3 GLN A 82 16.293 3.798 2.480 1.00 0.00 H new ATOM 0 HG2 GLN A 82 13.897 3.540 3.237 1.00 0.00 H new ATOM 0 HG3 GLN A 82 13.506 4.994 2.339 1.00 0.00 H new ATOM 0 HE21 GLN A 82 13.512 4.978 0.051 1.00 0.00 H new ATOM 0 HE22 GLN A 82 13.531 3.462 -0.856 1.00 0.00 H new ATOM 1373 N ALA A 83 17.540 7.053 4.130 1.00 0.00 N ATOM 1374 CA ALA A 83 18.892 7.570 4.251 1.00 0.00 C ATOM 1375 C ALA A 83 18.927 8.745 5.217 1.00 0.00 C ATOM 1376 O ALA A 83 18.826 9.900 4.760 1.00 0.00 O ATOM 1377 CB ALA A 83 19.426 7.980 2.887 1.00 0.00 C ATOM 1378 OXT ALA A 83 19.038 8.510 6.438 1.00 0.00 O ATOM 0 H ALA A 83 16.813 7.768 4.128 1.00 0.00 H new ATOM 0 HA ALA A 83 19.532 6.782 4.648 1.00 0.00 H new ATOM 0 HB1 ALA A 83 20.440 8.365 2.994 1.00 0.00 H new ATOM 0 HB2 ALA A 83 19.435 7.114 2.225 1.00 0.00 H new ATOM 0 HB3 ALA A 83 18.786 8.754 2.464 1.00 0.00 H new TER 1384 ALA A 83 ATOM 1385 N VAL B 201 -5.122 -0.852 -15.646 1.00 0.00 N ATOM 1386 CA VAL B 201 -4.551 0.493 -15.398 1.00 0.00 C ATOM 1387 C VAL B 201 -3.498 0.461 -14.289 1.00 0.00 C ATOM 1388 O VAL B 201 -2.518 1.206 -14.336 1.00 0.00 O ATOM 1389 CB VAL B 201 -5.646 1.526 -15.037 1.00 0.00 C ATOM 1390 CG1 VAL B 201 -6.553 1.789 -16.228 1.00 0.00 C ATOM 1391 CG2 VAL B 201 -6.464 1.063 -13.840 1.00 0.00 C ATOM 0 HA VAL B 201 -4.075 0.800 -16.329 1.00 0.00 H new ATOM 0 HB VAL B 201 -5.148 2.458 -14.768 1.00 0.00 H new ATOM 0 HG11 VAL B 201 -7.315 2.518 -15.951 1.00 0.00 H new ATOM 0 HG12 VAL B 201 -5.962 2.179 -17.057 1.00 0.00 H new ATOM 0 HG13 VAL B 201 -7.034 0.859 -16.532 1.00 0.00 H new ATOM 0 HG21 VAL B 201 -7.225 1.808 -13.609 1.00 0.00 H new ATOM 0 HG22 VAL B 201 -6.945 0.113 -14.074 1.00 0.00 H new ATOM 0 HG23 VAL B 201 -5.808 0.936 -12.979 1.00 0.00 H new ATOM 1403 N VAL B 202 -3.700 -0.400 -13.296 1.00 0.00 N ATOM 1404 CA VAL B 202 -2.755 -0.541 -12.196 1.00 0.00 C ATOM 1405 C VAL B 202 -2.402 -2.008 -11.996 1.00 0.00 C ATOM 1406 O VAL B 202 -3.273 -2.833 -11.708 1.00 0.00 O ATOM 1407 CB VAL B 202 -3.313 0.037 -10.874 1.00 0.00 C ATOM 1408 CG1 VAL B 202 -2.380 -0.273 -9.710 1.00 0.00 C ATOM 1409 CG2 VAL B 202 -3.516 1.538 -10.989 1.00 0.00 C ATOM 0 H VAL B 202 -4.513 -1.012 -13.232 1.00 0.00 H new ATOM 0 HA VAL B 202 -1.862 0.026 -12.461 1.00 0.00 H new ATOM 0 HB VAL B 202 -4.277 -0.435 -10.683 1.00 0.00 H new ATOM 0 HG11 VAL B 202 -2.793 0.143 -8.791 1.00 0.00 H new ATOM 0 HG12 VAL B 202 -2.276 -1.353 -9.604 1.00 0.00 H new ATOM 0 HG13 VAL B 202 -1.402 0.168 -9.900 1.00 0.00 H new ATOM 0 HG21 VAL B 202 -3.909 1.925 -10.049 1.00 0.00 H new ATOM 0 HG22 VAL B 202 -2.563 2.018 -11.209 1.00 0.00 H new ATOM 0 HG23 VAL B 202 -4.222 1.749 -11.792 1.00 0.00 H new ATOM 1419 N PRO B 203 -1.122 -2.355 -12.162 1.00 0.00 N ATOM 1420 CA PRO B 203 -0.656 -3.728 -12.017 1.00 0.00 C ATOM 1421 C PRO B 203 -0.486 -4.128 -10.557 1.00 0.00 C ATOM 1422 O PRO B 203 -0.208 -3.290 -9.695 1.00 0.00 O ATOM 1423 CB PRO B 203 0.694 -3.704 -12.728 1.00 0.00 C ATOM 1424 CG PRO B 203 1.197 -2.318 -12.524 1.00 0.00 C ATOM 1425 CD PRO B 203 -0.019 -1.429 -12.500 1.00 0.00 C ATOM 0 HA PRO B 203 -1.360 -4.452 -12.426 1.00 0.00 H new ATOM 0 HB2 PRO B 203 1.378 -4.441 -12.306 1.00 0.00 H new ATOM 0 HB3 PRO B 203 0.589 -3.936 -13.788 1.00 0.00 H new ATOM 0 HG2 PRO B 203 1.755 -2.240 -11.591 1.00 0.00 H new ATOM 0 HG3 PRO B 203 1.875 -2.028 -13.326 1.00 0.00 H new ATOM 0 HD2 PRO B 203 0.079 -0.636 -11.759 1.00 0.00 H new ATOM 0 HD3 PRO B 203 -0.182 -0.947 -13.464 1.00 0.00 H new ATOM 1433 N LYS B 204 -0.668 -5.412 -10.288 1.00 0.00 N ATOM 1434 CA LYS B 204 -0.461 -5.960 -8.956 1.00 0.00 C ATOM 1435 C LYS B 204 1.004 -5.823 -8.554 1.00 0.00 C ATOM 1436 O LYS B 204 1.905 -6.117 -9.346 1.00 0.00 O ATOM 1437 CB LYS B 204 -0.906 -7.424 -8.921 1.00 0.00 C ATOM 1438 CG LYS B 204 -0.304 -8.280 -10.026 1.00 0.00 C ATOM 1439 CD LYS B 204 -0.945 -9.658 -10.081 1.00 0.00 C ATOM 1440 CE LYS B 204 -2.398 -9.581 -10.524 1.00 0.00 C ATOM 1441 NZ LYS B 204 -3.038 -10.921 -10.561 1.00 0.00 N ATOM 0 H LYS B 204 -0.961 -6.100 -10.982 1.00 0.00 H new ATOM 0 HA LYS B 204 -1.062 -5.401 -8.239 1.00 0.00 H new ATOM 0 HB2 LYS B 204 -0.636 -7.852 -7.956 1.00 0.00 H new ATOM 0 HB3 LYS B 204 -1.993 -7.465 -8.995 1.00 0.00 H new ATOM 0 HG2 LYS B 204 -0.434 -7.780 -10.986 1.00 0.00 H new ATOM 0 HG3 LYS B 204 0.769 -8.384 -9.863 1.00 0.00 H new ATOM 0 HD2 LYS B 204 -0.387 -10.292 -10.770 1.00 0.00 H new ATOM 0 HD3 LYS B 204 -0.888 -10.126 -9.098 1.00 0.00 H new ATOM 0 HE2 LYS B 204 -2.951 -8.933 -9.844 1.00 0.00 H new ATOM 0 HE3 LYS B 204 -2.452 -9.125 -11.513 1.00 0.00 H new ATOM 0 HZ1 LYS B 204 -4.027 -10.825 -10.868 1.00 0.00 H new ATOM 0 HZ2 LYS B 204 -2.526 -11.532 -11.229 1.00 0.00 H new ATOM 0 HZ3 LYS B 204 -3.009 -11.346 -9.612 1.00 0.00 H new ATOM 1455 N LYS B 205 1.238 -5.358 -7.337 1.00 0.00 N ATOM 1456 CA LYS B 205 2.584 -5.054 -6.882 1.00 0.00 C ATOM 1457 C LYS B 205 3.145 -6.187 -6.028 1.00 0.00 C ATOM 1458 O LYS B 205 2.932 -6.236 -4.812 1.00 0.00 O ATOM 1459 CB LYS B 205 2.581 -3.724 -6.112 1.00 0.00 C ATOM 1460 CG LYS B 205 3.948 -3.272 -5.605 1.00 0.00 C ATOM 1461 CD LYS B 205 4.051 -1.756 -5.554 1.00 0.00 C ATOM 1462 CE LYS B 205 4.003 -1.133 -6.943 1.00 0.00 C ATOM 1463 NZ LYS B 205 5.212 -1.445 -7.750 1.00 0.00 N ATOM 0 H LYS B 205 0.510 -5.183 -6.645 1.00 0.00 H new ATOM 0 HA LYS B 205 3.235 -4.954 -7.750 1.00 0.00 H new ATOM 0 HB2 LYS B 205 2.175 -2.947 -6.759 1.00 0.00 H new ATOM 0 HB3 LYS B 205 1.906 -3.815 -5.261 1.00 0.00 H new ATOM 0 HG2 LYS B 205 4.122 -3.683 -4.611 1.00 0.00 H new ATOM 0 HG3 LYS B 205 4.728 -3.669 -6.255 1.00 0.00 H new ATOM 0 HD2 LYS B 205 3.236 -1.358 -4.950 1.00 0.00 H new ATOM 0 HD3 LYS B 205 4.981 -1.472 -5.062 1.00 0.00 H new ATOM 0 HE2 LYS B 205 3.118 -1.492 -7.468 1.00 0.00 H new ATOM 0 HE3 LYS B 205 3.902 -0.052 -6.849 1.00 0.00 H new ATOM 0 HZ1 LYS B 205 5.017 -1.256 -8.754 1.00 0.00 H new ATOM 0 HZ2 LYS B 205 6.004 -0.850 -7.433 1.00 0.00 H new ATOM 0 HZ3 LYS B 205 5.462 -2.447 -7.628 1.00 0.00 H new ATOM 1477 N LYS B 206 3.837 -7.110 -6.687 1.00 0.00 N ATOM 1478 CA LYS B 206 4.542 -8.182 -6.000 1.00 0.00 C ATOM 1479 C LYS B 206 5.733 -7.610 -5.253 1.00 0.00 C ATOM 1480 O LYS B 206 6.635 -7.037 -5.865 1.00 0.00 O ATOM 1481 CB LYS B 206 5.033 -9.237 -6.994 1.00 0.00 C ATOM 1482 CG LYS B 206 3.925 -9.934 -7.761 1.00 0.00 C ATOM 1483 CD LYS B 206 4.486 -11.016 -8.667 1.00 0.00 C ATOM 1484 CE LYS B 206 3.383 -11.792 -9.366 1.00 0.00 C ATOM 1485 NZ LYS B 206 2.467 -12.452 -8.398 1.00 0.00 N ATOM 0 H LYS B 206 3.924 -7.135 -7.703 1.00 0.00 H new ATOM 0 HA LYS B 206 3.852 -8.653 -5.300 1.00 0.00 H new ATOM 0 HB2 LYS B 206 5.709 -8.763 -7.705 1.00 0.00 H new ATOM 0 HB3 LYS B 206 5.613 -9.986 -6.454 1.00 0.00 H new ATOM 0 HG2 LYS B 206 3.214 -10.373 -7.061 1.00 0.00 H new ATOM 0 HG3 LYS B 206 3.376 -9.205 -8.357 1.00 0.00 H new ATOM 0 HD2 LYS B 206 5.141 -10.563 -9.412 1.00 0.00 H new ATOM 0 HD3 LYS B 206 5.097 -11.701 -8.080 1.00 0.00 H new ATOM 0 HE2 LYS B 206 2.812 -11.116 -10.003 1.00 0.00 H new ATOM 0 HE3 LYS B 206 3.826 -12.545 -10.017 1.00 0.00 H new ATOM 0 HZ1 LYS B 206 2.244 -13.412 -8.730 1.00 0.00 H new ATOM 0 HZ2 LYS B 206 2.927 -12.506 -7.467 1.00 0.00 H new ATOM 0 HZ3 LYS B 206 1.589 -11.900 -8.319 1.00 0.00 H new ATOM 1499 N ILE B 207 5.735 -7.750 -3.943 1.00 0.00 N ATOM 1500 CA ILE B 207 6.801 -7.194 -3.136 1.00 0.00 C ATOM 1501 C ILE B 207 7.634 -8.284 -2.486 1.00 0.00 C ATOM 1502 O ILE B 207 7.098 -9.268 -1.978 1.00 0.00 O ATOM 1503 CB ILE B 207 6.251 -6.278 -2.027 1.00 0.00 C ATOM 1504 CG1 ILE B 207 5.254 -5.272 -2.604 1.00 0.00 C ATOM 1505 CG2 ILE B 207 7.388 -5.566 -1.321 1.00 0.00 C ATOM 1506 CD1 ILE B 207 4.991 -4.085 -1.707 1.00 0.00 C ATOM 0 H ILE B 207 5.013 -8.242 -3.416 1.00 0.00 H new ATOM 0 HA ILE B 207 7.426 -6.612 -3.814 1.00 0.00 H new ATOM 0 HB ILE B 207 5.725 -6.893 -1.297 1.00 0.00 H new ATOM 0 HG12 ILE B 207 5.628 -4.914 -3.563 1.00 0.00 H new ATOM 0 HG13 ILE B 207 4.311 -5.782 -2.800 1.00 0.00 H new ATOM 0 HG21 ILE B 207 6.985 -4.922 -0.540 1.00 0.00 H new ATOM 0 HG22 ILE B 207 8.057 -6.302 -0.875 1.00 0.00 H new ATOM 0 HG23 ILE B 207 7.941 -4.961 -2.040 1.00 0.00 H new ATOM 0 HD11 ILE B 207 4.274 -3.418 -2.186 1.00 0.00 H new ATOM 0 HD12 ILE B 207 4.586 -4.430 -0.756 1.00 0.00 H new ATOM 0 HD13 ILE B 207 5.923 -3.549 -1.531 1.00 0.00 H new ATOM 1518 N LYS B 208 8.945 -8.116 -2.539 1.00 0.00 N ATOM 1519 CA LYS B 208 9.862 -8.922 -1.751 1.00 0.00 C ATOM 1520 C LYS B 208 10.574 -7.996 -0.772 1.00 0.00 C ATOM 1521 O LYS B 208 10.287 -6.799 -0.749 1.00 0.00 O ATOM 1522 CB LYS B 208 10.902 -9.618 -2.640 1.00 0.00 C ATOM 1523 CG LYS B 208 10.331 -10.360 -3.841 1.00 0.00 C ATOM 1524 CD LYS B 208 9.365 -11.459 -3.437 1.00 0.00 C ATOM 1525 CE LYS B 208 9.008 -12.331 -4.630 1.00 0.00 C ATOM 1526 NZ LYS B 208 7.859 -13.233 -4.358 1.00 0.00 N ATOM 0 H LYS B 208 9.402 -7.419 -3.127 1.00 0.00 H new ATOM 0 HA LYS B 208 9.301 -9.696 -1.228 1.00 0.00 H new ATOM 0 HB2 LYS B 208 11.610 -8.871 -2.997 1.00 0.00 H new ATOM 0 HB3 LYS B 208 11.465 -10.324 -2.030 1.00 0.00 H new ATOM 0 HG2 LYS B 208 9.819 -9.652 -4.492 1.00 0.00 H new ATOM 0 HG3 LYS B 208 11.148 -10.792 -4.419 1.00 0.00 H new ATOM 0 HD2 LYS B 208 9.812 -12.072 -2.654 1.00 0.00 H new ATOM 0 HD3 LYS B 208 8.460 -11.018 -3.020 1.00 0.00 H new ATOM 0 HE2 LYS B 208 8.771 -11.694 -5.482 1.00 0.00 H new ATOM 0 HE3 LYS B 208 9.875 -12.929 -4.910 1.00 0.00 H new ATOM 0 HZ1 LYS B 208 7.485 -13.600 -5.257 1.00 0.00 H new ATOM 0 HZ2 LYS B 208 8.174 -14.027 -3.764 1.00 0.00 H new ATOM 0 HZ3 LYS B 208 7.113 -12.705 -3.863 1.00 0.00 H new ATOM 1540 N LYS B 209 11.497 -8.520 0.023 1.00 0.00 N ATOM 1541 CA LYS B 209 12.330 -7.655 0.849 1.00 0.00 C ATOM 1542 C LYS B 209 13.109 -6.711 -0.063 1.00 0.00 C ATOM 1543 O LYS B 209 13.236 -5.515 0.205 1.00 0.00 O ATOM 1544 CB LYS B 209 13.283 -8.474 1.727 1.00 0.00 C ATOM 1545 CG LYS B 209 14.183 -7.626 2.616 1.00 0.00 C ATOM 1546 CD LYS B 209 13.379 -6.640 3.451 1.00 0.00 C ATOM 1547 CE LYS B 209 14.270 -5.836 4.385 1.00 0.00 C ATOM 1548 NZ LYS B 209 14.904 -6.690 5.424 1.00 0.00 N ATOM 0 H LYS B 209 11.686 -9.518 0.114 1.00 0.00 H new ATOM 0 HA LYS B 209 11.694 -7.077 1.520 1.00 0.00 H new ATOM 0 HB2 LYS B 209 12.697 -9.145 2.355 1.00 0.00 H new ATOM 0 HB3 LYS B 209 13.906 -9.099 1.086 1.00 0.00 H new ATOM 0 HG2 LYS B 209 14.760 -8.275 3.274 1.00 0.00 H new ATOM 0 HG3 LYS B 209 14.897 -7.082 1.998 1.00 0.00 H new ATOM 0 HD2 LYS B 209 12.837 -5.962 2.792 1.00 0.00 H new ATOM 0 HD3 LYS B 209 12.634 -7.180 4.035 1.00 0.00 H new ATOM 0 HE2 LYS B 209 15.045 -5.336 3.805 1.00 0.00 H new ATOM 0 HE3 LYS B 209 13.680 -5.057 4.867 1.00 0.00 H new ATOM 0 HZ1 LYS B 209 15.334 -6.087 6.154 1.00 0.00 H new ATOM 0 HZ2 LYS B 209 14.183 -7.300 5.859 1.00 0.00 H new ATOM 0 HZ3 LYS B 209 15.639 -7.281 4.986 1.00 0.00 H new ATOM 1562 N GLU B 210 13.606 -7.265 -1.158 1.00 0.00 N ATOM 1563 CA GLU B 210 14.189 -6.468 -2.219 1.00 0.00 C ATOM 1564 C GLU B 210 13.110 -6.118 -3.236 1.00 0.00 C ATOM 1565 O GLU B 210 13.045 -6.708 -4.314 1.00 0.00 O ATOM 1566 CB GLU B 210 15.321 -7.231 -2.907 1.00 0.00 C ATOM 1567 CG GLU B 210 16.488 -7.559 -1.995 1.00 0.00 C ATOM 1568 CD GLU B 210 17.525 -8.417 -2.685 1.00 0.00 C ATOM 1569 OE1 GLU B 210 18.434 -7.859 -3.332 1.00 0.00 O ATOM 1570 OE2 GLU B 210 17.429 -9.658 -2.594 1.00 0.00 O ATOM 0 H GLU B 210 13.616 -8.270 -1.333 1.00 0.00 H new ATOM 0 HA GLU B 210 14.601 -5.555 -1.789 1.00 0.00 H new ATOM 0 HB2 GLU B 210 14.923 -8.159 -3.318 1.00 0.00 H new ATOM 0 HB3 GLU B 210 15.685 -6.640 -3.748 1.00 0.00 H new ATOM 0 HG2 GLU B 210 16.952 -6.634 -1.654 1.00 0.00 H new ATOM 0 HG3 GLU B 210 16.121 -8.077 -1.109 1.00 0.00 H new ATOM 1577 N GLN B 211 12.249 -5.169 -2.873 1.00 0.00 N ATOM 1578 CA GLN B 211 11.142 -4.755 -3.736 1.00 0.00 C ATOM 1579 C GLN B 211 11.645 -4.233 -5.078 1.00 0.00 C ATOM 1580 O GLN B 211 10.954 -4.325 -6.091 1.00 0.00 O ATOM 1581 CB GLN B 211 10.303 -3.674 -3.054 1.00 0.00 C ATOM 1582 CG GLN B 211 11.091 -2.420 -2.712 1.00 0.00 C ATOM 1583 CD GLN B 211 10.207 -1.271 -2.280 1.00 0.00 C ATOM 1584 OE1 GLN B 211 9.070 -1.142 -2.731 1.00 0.00 O ATOM 1585 NE2 GLN B 211 10.729 -0.429 -1.408 1.00 0.00 N ATOM 0 H GLN B 211 12.296 -4.670 -1.984 1.00 0.00 H new ATOM 0 HA GLN B 211 10.525 -5.635 -3.915 1.00 0.00 H new ATOM 0 HB2 GLN B 211 9.472 -3.405 -3.706 1.00 0.00 H new ATOM 0 HB3 GLN B 211 9.871 -4.083 -2.140 1.00 0.00 H new ATOM 0 HG2 GLN B 211 11.799 -2.647 -1.915 1.00 0.00 H new ATOM 0 HG3 GLN B 211 11.676 -2.116 -3.580 1.00 0.00 H new ATOM 0 HE21 GLN B 211 11.677 -0.576 -1.061 1.00 0.00 H new ATOM 0 HE22 GLN B 211 10.185 0.369 -1.081 1.00 0.00 H new ATOM 1594 N VAL B 212 12.850 -3.679 -5.076 1.00 0.00 N ATOM 1595 CA VAL B 212 13.449 -3.166 -6.294 1.00 0.00 C ATOM 1596 C VAL B 212 13.990 -4.311 -7.141 1.00 0.00 C ATOM 1597 O VAL B 212 14.541 -5.281 -6.617 1.00 0.00 O ATOM 1598 CB VAL B 212 14.582 -2.155 -5.997 1.00 0.00 C ATOM 1599 CG1 VAL B 212 14.029 -0.929 -5.287 1.00 0.00 C ATOM 1600 CG2 VAL B 212 15.689 -2.795 -5.170 1.00 0.00 C ATOM 0 H VAL B 212 13.429 -3.575 -4.243 1.00 0.00 H new ATOM 0 HA VAL B 212 12.667 -2.643 -6.845 1.00 0.00 H new ATOM 0 HB VAL B 212 15.011 -1.844 -6.949 1.00 0.00 H new ATOM 0 HG11 VAL B 212 14.840 -0.229 -5.086 1.00 0.00 H new ATOM 0 HG12 VAL B 212 13.282 -0.448 -5.919 1.00 0.00 H new ATOM 0 HG13 VAL B 212 13.568 -1.230 -4.346 1.00 0.00 H new ATOM 0 HG21 VAL B 212 16.471 -2.060 -4.978 1.00 0.00 H new ATOM 0 HG22 VAL B 212 15.279 -3.145 -4.223 1.00 0.00 H new ATOM 0 HG23 VAL B 212 16.111 -3.638 -5.717 1.00 0.00 H new ATOM 1610 N GLU B 213 13.809 -4.205 -8.444 1.00 0.00 N ATOM 1611 CA GLU B 213 14.280 -5.223 -9.363 1.00 0.00 C ATOM 1612 C GLU B 213 15.078 -4.582 -10.492 1.00 0.00 C ATOM 1613 O GLU B 213 16.313 -4.752 -10.508 1.00 0.00 O ATOM 1614 CB GLU B 213 13.105 -6.053 -9.900 1.00 0.00 C ATOM 1615 CG GLU B 213 11.944 -5.224 -10.429 1.00 0.00 C ATOM 1616 CD GLU B 213 10.769 -6.077 -10.857 1.00 0.00 C ATOM 1617 OE1 GLU B 213 10.896 -6.818 -11.855 1.00 0.00 O ATOM 1618 OE2 GLU B 213 9.712 -6.016 -10.195 1.00 0.00 O ATOM 1619 OXT GLU B 213 14.478 -3.864 -11.321 1.00 0.00 O ATOM 0 H GLU B 213 13.336 -3.419 -8.891 1.00 0.00 H new ATOM 0 HA GLU B 213 14.942 -5.904 -8.829 1.00 0.00 H new ATOM 0 HB2 GLU B 213 13.467 -6.701 -10.698 1.00 0.00 H new ATOM 0 HB3 GLU B 213 12.740 -6.702 -9.104 1.00 0.00 H new ATOM 0 HG2 GLU B 213 11.620 -4.525 -9.658 1.00 0.00 H new ATOM 0 HG3 GLU B 213 12.284 -4.628 -11.276 1.00 0.00 H new TER 1626 GLU B 213