USER MOD reduce.3.24.130724 H: found=0, std=0, add=1091, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1084 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 103 CYS SG : rot -170:sc= 1.4 USER MOD Set 1.2: A 105 THR OG1 : rot 107:sc= 1.06 USER MOD Set 1.3: A 114 SER OG : rot -171:sc= 0.701 USER MOD Set 2.1: A 96 SER OG : rot -103:sc= -0.0353 USER MOD Set 2.2: A 100 GLN : amide:sc= 0.171 X(o=0.14,f=-0.21) USER MOD Set 3.1: A 29 ASN : amide:sc= 0.823 K(o=-2.4,f=-11!) USER MOD Set 3.2: A 91 ASN : amide:sc= -3.27 K(o=-2.4,f=-7.3!) USER MOD Set 4.1: A 44 SER OG : rot 135:sc= 0.0237 USER MOD Set 4.2: A 59 HIS : no HD1:sc= -2.9! C(o=-1.2!,f=-17!) USER MOD Set 4.3: A 67 SER OG : rot -140:sc= 1.3 USER MOD Set 4.4: A 112 TYR OH : rot 180:sc= 0.381 USER MOD Set 5.1: A 13 LYS NZ :NH3+ -158:sc= -1.75 (180deg=-2.81!) USER MOD Set 5.2: A 76 SER OG : rot 60:sc= -0.314 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl -127:sc= -0.248 (180deg=-0.453) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 14 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ -159:sc= -0.049 (180deg=-0.327) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.278 USER MOD Single : A 30 LYS NZ :NH3+ -144:sc= 0.219 (180deg=-0.0107) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 ASN : amide:sc= -0.0413 K(o=-0.041,f=-1.3) USER MOD Single : A 41 SER OG : rot 180:sc= -0.0105 USER MOD Single : A 46 THR OG1 : rot -120:sc= 0.498 USER MOD Single : A 47 TYR OH : rot 30:sc= 0 USER MOD Single : A 56 SER OG : rot 130:sc= -0.738 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 65 HIS : no HD1:sc= -1.12 K(o=-1.1,f=-2.1!) USER MOD Single : A 71 SER OG : rot 180:sc= -0.141 USER MOD Single : A 72 THR OG1 : rot -97:sc= 0.707 USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 82 GLN : amide:sc= -0.209 K(o=-0.21,f=-1.2) USER MOD Single : A 85 CYS SG : rot 46:sc= 0.393 USER MOD Single : A 86 MET CE :methyl -154:sc= -0.325 (180deg=-1) USER MOD Single : A 87 GLN : amide:sc= -6.4! C(o=-6.4!,f=-7.8!) USER MOD Single : A 93 SER OG : rot -160:sc= 0 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 99 HIS : no HD1:sc= -0.134 X(o=-0.13,f=0) USER MOD Single : A 101 HIS : no HD1:sc= -2.34! C(o=-2.3!,f=-2!) USER MOD Single : A 104 SER OG : rot -50:sc= 0.487 USER MOD Single : A 106 ASN : amide:sc= 0.0874 K(o=0.087,f=-2.5!) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 ASN : amide:sc= -0.71 X(o=-0.71,f=-1.2) USER MOD Single : A 111 LYS NZ :NH3+ -112:sc= 0.728 (180deg=-0.00132) USER MOD Single : A 113 ASN :FLIP amide:sc= -2.68 F(o=-4.9!,f=-2.7) USER MOD Single : A 118 GLN : amide:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 120 TYR OH : rot 84:sc= 0.00599 USER MOD Single : A 123 LYS NZ :NH3+ 141:sc= -0.415 (180deg=-1.5!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 83:sc= 0.282 USER MOD Single : A 130 GLN : amide:sc= -1 K(o=-1,f=-2.2!) USER MOD Single : A 132 THR OG1 : rot 73:sc= 0.506 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 HIS : no HD1:sc=-0.00946 X(o=-0.0095,f=0) USER MOD Single : A 137 THR OG1 : rot 180:sc= -0.0704 USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 147 SER OG : rot 50:sc= 0.327 USER MOD Single : A 148 SER OG : rot 4:sc= 1.05 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -13.288 26.299 3.238 1.00 0.00 N ATOM 2 CA GLY A 1 -12.410 27.453 3.286 1.00 0.00 C ATOM 3 C GLY A 1 -12.442 28.259 2.003 1.00 0.00 C ATOM 4 O GLY A 1 -12.447 27.697 0.908 1.00 0.00 O ATOM 0 H1 GLY A 1 -13.230 25.781 4.138 1.00 0.00 H new ATOM 0 H2 GLY A 1 -14.267 26.614 3.082 1.00 0.00 H new ATOM 0 H3 GLY A 1 -12.997 25.674 2.460 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -12.700 28.092 4.120 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -11.390 27.122 3.478 1.00 0.00 H new ATOM 8 N SER A 2 -12.467 29.581 2.137 1.00 0.00 N ATOM 9 CA SER A 2 -12.505 30.467 0.980 1.00 0.00 C ATOM 10 C SER A 2 -11.371 30.144 0.011 1.00 0.00 C ATOM 11 O SER A 2 -11.609 29.770 -1.137 1.00 0.00 O ATOM 12 CB SER A 2 -12.411 31.928 1.425 1.00 0.00 C ATOM 13 OG SER A 2 -13.684 32.436 1.782 1.00 0.00 O ATOM 0 H SER A 2 -12.462 30.062 3.036 1.00 0.00 H new ATOM 0 HA SER A 2 -13.454 30.312 0.466 1.00 0.00 H new ATOM 0 HB2 SER A 2 -11.732 32.010 2.274 1.00 0.00 H new ATOM 0 HB3 SER A 2 -11.989 32.530 0.620 1.00 0.00 H new ATOM 0 HG SER A 2 -13.596 33.370 2.064 1.00 0.00 H new ATOM 19 N SER A 3 -10.138 30.293 0.483 1.00 0.00 N ATOM 20 CA SER A 3 -8.966 30.020 -0.341 1.00 0.00 C ATOM 21 C SER A 3 -8.676 28.523 -0.397 1.00 0.00 C ATOM 22 O SER A 3 -8.655 27.846 0.630 1.00 0.00 O ATOM 23 CB SER A 3 -7.748 30.767 0.206 1.00 0.00 C ATOM 24 OG SER A 3 -6.715 30.836 -0.762 1.00 0.00 O ATOM 0 H SER A 3 -9.924 30.601 1.432 1.00 0.00 H new ATOM 0 HA SER A 3 -9.174 30.369 -1.352 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.039 31.774 0.504 1.00 0.00 H new ATOM 0 HB3 SER A 3 -7.380 30.264 1.100 1.00 0.00 H new ATOM 0 HG SER A 3 -5.949 31.320 -0.389 1.00 0.00 H new ATOM 30 N GLY A 4 -8.454 28.014 -1.604 1.00 0.00 N ATOM 31 CA GLY A 4 -8.169 26.602 -1.773 1.00 0.00 C ATOM 32 C GLY A 4 -6.729 26.257 -1.446 1.00 0.00 C ATOM 33 O GLY A 4 -6.118 26.877 -0.574 1.00 0.00 O ATOM 0 H GLY A 4 -8.466 28.555 -2.469 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -8.833 26.021 -1.132 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -8.384 26.312 -2.801 1.00 0.00 H new ATOM 37 N SER A 5 -6.185 25.265 -2.142 1.00 0.00 N ATOM 38 CA SER A 5 -4.810 24.836 -1.917 1.00 0.00 C ATOM 39 C SER A 5 -3.876 25.437 -2.962 1.00 0.00 C ATOM 40 O SER A 5 -4.295 25.764 -4.071 1.00 0.00 O ATOM 41 CB SER A 5 -4.719 23.309 -1.951 1.00 0.00 C ATOM 42 OG SER A 5 -3.593 22.850 -1.223 1.00 0.00 O ATOM 0 H SER A 5 -6.676 24.742 -2.867 1.00 0.00 H new ATOM 0 HA SER A 5 -4.500 25.189 -0.933 1.00 0.00 H new ATOM 0 HB2 SER A 5 -5.628 22.878 -1.532 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.652 22.968 -2.984 1.00 0.00 H new ATOM 0 HG SER A 5 -3.558 21.871 -1.258 1.00 0.00 H new ATOM 48 N SER A 6 -2.605 25.577 -2.599 1.00 0.00 N ATOM 49 CA SER A 6 -1.609 26.141 -3.502 1.00 0.00 C ATOM 50 C SER A 6 -0.412 25.206 -3.644 1.00 0.00 C ATOM 51 O SER A 6 0.301 24.941 -2.677 1.00 0.00 O ATOM 52 CB SER A 6 -1.145 27.508 -2.994 1.00 0.00 C ATOM 53 OG SER A 6 -0.303 28.143 -3.940 1.00 0.00 O ATOM 0 H SER A 6 -2.241 25.307 -1.685 1.00 0.00 H new ATOM 0 HA SER A 6 -2.071 26.263 -4.482 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.011 28.138 -2.792 1.00 0.00 H new ATOM 0 HB3 SER A 6 -0.612 27.388 -2.051 1.00 0.00 H new ATOM 0 HG SER A 6 -0.021 29.015 -3.593 1.00 0.00 H new ATOM 59 N GLY A 7 -0.197 24.709 -4.858 1.00 0.00 N ATOM 60 CA GLY A 7 0.913 23.809 -5.106 1.00 0.00 C ATOM 61 C GLY A 7 0.899 22.604 -4.187 1.00 0.00 C ATOM 62 O GLY A 7 1.819 22.411 -3.391 1.00 0.00 O ATOM 0 H GLY A 7 -0.773 24.914 -5.675 1.00 0.00 H new ATOM 0 HA2 GLY A 7 0.879 23.472 -6.142 1.00 0.00 H new ATOM 0 HA3 GLY A 7 1.851 24.349 -4.977 1.00 0.00 H new ATOM 66 N MET A 8 -0.147 21.791 -4.293 1.00 0.00 N ATOM 67 CA MET A 8 -0.278 20.600 -3.464 1.00 0.00 C ATOM 68 C MET A 8 1.074 19.917 -3.277 1.00 0.00 C ATOM 69 O MET A 8 1.447 19.552 -2.164 1.00 0.00 O ATOM 70 CB MET A 8 -1.273 19.622 -4.091 1.00 0.00 C ATOM 71 CG MET A 8 -1.948 18.710 -3.079 1.00 0.00 C ATOM 72 SD MET A 8 -1.043 17.172 -2.819 1.00 0.00 S ATOM 73 CE MET A 8 -2.365 15.972 -2.959 1.00 0.00 C ATOM 0 H MET A 8 -0.917 21.936 -4.946 1.00 0.00 H new ATOM 0 HA MET A 8 -0.649 20.908 -2.486 1.00 0.00 H new ATOM 0 HB2 MET A 8 -2.037 20.186 -4.626 1.00 0.00 H new ATOM 0 HB3 MET A 8 -0.753 19.011 -4.829 1.00 0.00 H new ATOM 0 HG2 MET A 8 -2.044 19.236 -2.129 1.00 0.00 H new ATOM 0 HG3 MET A 8 -2.958 18.480 -3.419 1.00 0.00 H new ATOM 0 HE1 MET A 8 -2.366 15.327 -2.080 1.00 0.00 H new ATOM 0 HE2 MET A 8 -3.321 16.491 -3.030 1.00 0.00 H new ATOM 0 HE3 MET A 8 -2.214 15.367 -3.853 1.00 0.00 H new ATOM 83 N GLY A 9 1.804 19.748 -4.376 1.00 0.00 N ATOM 84 CA GLY A 9 3.106 19.110 -4.312 1.00 0.00 C ATOM 85 C GLY A 9 3.013 17.639 -3.961 1.00 0.00 C ATOM 86 O GLY A 9 1.949 17.031 -4.082 1.00 0.00 O ATOM 0 H GLY A 9 1.517 20.042 -5.310 1.00 0.00 H new ATOM 0 HA2 GLY A 9 3.609 19.220 -5.273 1.00 0.00 H new ATOM 0 HA3 GLY A 9 3.721 19.619 -3.570 1.00 0.00 H new ATOM 90 N ASP A 10 4.129 17.064 -3.527 1.00 0.00 N ATOM 91 CA ASP A 10 4.169 15.653 -3.158 1.00 0.00 C ATOM 92 C ASP A 10 4.667 15.480 -1.727 1.00 0.00 C ATOM 93 O ASP A 10 5.375 16.328 -1.182 1.00 0.00 O ATOM 94 CB ASP A 10 5.069 14.878 -4.121 1.00 0.00 C ATOM 95 CG ASP A 10 6.396 15.572 -4.360 1.00 0.00 C ATOM 96 OD1 ASP A 10 6.853 16.306 -3.458 1.00 0.00 O ATOM 97 OD2 ASP A 10 6.977 15.382 -5.449 1.00 0.00 O ATOM 0 H ASP A 10 5.018 17.553 -3.422 1.00 0.00 H new ATOM 0 HA ASP A 10 3.155 15.257 -3.222 1.00 0.00 H new ATOM 0 HB2 ASP A 10 5.251 13.881 -3.720 1.00 0.00 H new ATOM 0 HB3 ASP A 10 4.553 14.750 -5.072 1.00 0.00 H new ATOM 102 N PRO A 11 4.288 14.356 -1.100 1.00 0.00 N ATOM 103 CA PRO A 11 4.685 14.045 0.276 1.00 0.00 C ATOM 104 C PRO A 11 6.171 13.726 0.394 1.00 0.00 C ATOM 105 O PRO A 11 6.784 13.223 -0.547 1.00 0.00 O ATOM 106 CB PRO A 11 3.844 12.811 0.618 1.00 0.00 C ATOM 107 CG PRO A 11 3.555 12.175 -0.697 1.00 0.00 C ATOM 108 CD PRO A 11 3.445 13.302 -1.688 1.00 0.00 C ATOM 0 HA PRO A 11 4.522 14.889 0.947 1.00 0.00 H new ATOM 0 HB2 PRO A 11 4.386 12.132 1.276 1.00 0.00 H new ATOM 0 HB3 PRO A 11 2.925 13.089 1.134 1.00 0.00 H new ATOM 0 HG2 PRO A 11 4.349 11.484 -0.979 1.00 0.00 H new ATOM 0 HG3 PRO A 11 2.630 11.599 -0.657 1.00 0.00 H new ATOM 0 HD2 PRO A 11 3.801 13.006 -2.675 1.00 0.00 H new ATOM 0 HD3 PRO A 11 2.413 13.633 -1.808 1.00 0.00 H new ATOM 116 N SER A 12 6.745 14.023 1.556 1.00 0.00 N ATOM 117 CA SER A 12 8.162 13.770 1.796 1.00 0.00 C ATOM 118 C SER A 12 8.355 12.504 2.623 1.00 0.00 C ATOM 119 O SER A 12 7.410 11.985 3.218 1.00 0.00 O ATOM 120 CB SER A 12 8.800 14.963 2.511 1.00 0.00 C ATOM 121 OG SER A 12 8.626 16.156 1.767 1.00 0.00 O ATOM 0 H SER A 12 6.251 14.439 2.346 1.00 0.00 H new ATOM 0 HA SER A 12 8.650 13.630 0.831 1.00 0.00 H new ATOM 0 HB2 SER A 12 8.355 15.079 3.499 1.00 0.00 H new ATOM 0 HB3 SER A 12 9.863 14.775 2.660 1.00 0.00 H new ATOM 0 HG SER A 12 9.041 16.904 2.246 1.00 0.00 H new ATOM 127 N LYS A 13 9.588 12.009 2.656 1.00 0.00 N ATOM 128 CA LYS A 13 9.910 10.804 3.410 1.00 0.00 C ATOM 129 C LYS A 13 9.168 10.783 4.743 1.00 0.00 C ATOM 130 O LYS A 13 8.412 9.854 5.028 1.00 0.00 O ATOM 131 CB LYS A 13 11.418 10.716 3.653 1.00 0.00 C ATOM 132 CG LYS A 13 11.814 9.626 4.633 1.00 0.00 C ATOM 133 CD LYS A 13 12.217 8.349 3.916 1.00 0.00 C ATOM 134 CE LYS A 13 11.069 7.353 3.865 1.00 0.00 C ATOM 135 NZ LYS A 13 10.357 7.394 2.558 1.00 0.00 N ATOM 0 H LYS A 13 10.381 12.425 2.168 1.00 0.00 H new ATOM 0 HA LYS A 13 9.593 9.942 2.823 1.00 0.00 H new ATOM 0 HB2 LYS A 13 11.921 10.538 2.702 1.00 0.00 H new ATOM 0 HB3 LYS A 13 11.774 11.676 4.027 1.00 0.00 H new ATOM 0 HG2 LYS A 13 12.642 9.974 5.250 1.00 0.00 H new ATOM 0 HG3 LYS A 13 10.981 9.419 5.305 1.00 0.00 H new ATOM 0 HD2 LYS A 13 12.540 8.586 2.902 1.00 0.00 H new ATOM 0 HD3 LYS A 13 13.069 7.898 4.425 1.00 0.00 H new ATOM 0 HE2 LYS A 13 11.453 6.348 4.038 1.00 0.00 H new ATOM 0 HE3 LYS A 13 10.365 7.569 4.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 9.398 7.008 2.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 10.297 8.378 2.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 10.878 6.825 1.861 1.00 0.00 H new ATOM 149 N GLN A 14 9.390 11.811 5.556 1.00 0.00 N ATOM 150 CA GLN A 14 8.742 11.910 6.858 1.00 0.00 C ATOM 151 C GLN A 14 7.250 11.613 6.747 1.00 0.00 C ATOM 152 O GLN A 14 6.732 10.724 7.424 1.00 0.00 O ATOM 153 CB GLN A 14 8.954 13.303 7.452 1.00 0.00 C ATOM 154 CG GLN A 14 10.416 13.649 7.688 1.00 0.00 C ATOM 155 CD GLN A 14 10.599 14.715 8.749 1.00 0.00 C ATOM 156 OE1 GLN A 14 10.481 15.909 8.474 1.00 0.00 O ATOM 157 NE2 GLN A 14 10.891 14.288 9.972 1.00 0.00 N ATOM 0 H GLN A 14 10.014 12.587 5.336 1.00 0.00 H new ATOM 0 HA GLN A 14 9.193 11.169 7.518 1.00 0.00 H new ATOM 0 HB2 GLN A 14 8.517 14.044 6.783 1.00 0.00 H new ATOM 0 HB3 GLN A 14 8.416 13.371 8.398 1.00 0.00 H new ATOM 0 HG2 GLN A 14 10.955 12.749 7.985 1.00 0.00 H new ATOM 0 HG3 GLN A 14 10.860 13.992 6.753 1.00 0.00 H new ATOM 0 HE21 GLN A 14 10.979 13.289 10.156 1.00 0.00 H new ATOM 0 HE22 GLN A 14 11.027 14.959 10.728 1.00 0.00 H new ATOM 166 N ASP A 15 6.565 12.362 5.890 1.00 0.00 N ATOM 167 CA ASP A 15 5.132 12.178 5.691 1.00 0.00 C ATOM 168 C ASP A 15 4.815 10.733 5.319 1.00 0.00 C ATOM 169 O ASP A 15 3.919 10.116 5.895 1.00 0.00 O ATOM 170 CB ASP A 15 4.622 13.121 4.600 1.00 0.00 C ATOM 171 CG ASP A 15 5.090 14.549 4.804 1.00 0.00 C ATOM 172 OD1 ASP A 15 4.761 15.136 5.856 1.00 0.00 O ATOM 173 OD2 ASP A 15 5.784 15.079 3.911 1.00 0.00 O ATOM 0 H ASP A 15 6.978 13.102 5.322 1.00 0.00 H new ATOM 0 HA ASP A 15 4.628 12.412 6.629 1.00 0.00 H new ATOM 0 HB2 ASP A 15 4.963 12.765 3.628 1.00 0.00 H new ATOM 0 HB3 ASP A 15 3.532 13.098 4.584 1.00 0.00 H new ATOM 178 N ILE A 16 5.557 10.199 4.354 1.00 0.00 N ATOM 179 CA ILE A 16 5.356 8.827 3.907 1.00 0.00 C ATOM 180 C ILE A 16 5.482 7.846 5.066 1.00 0.00 C ATOM 181 O ILE A 16 4.650 6.953 5.233 1.00 0.00 O ATOM 182 CB ILE A 16 6.364 8.440 2.808 1.00 0.00 C ATOM 183 CG1 ILE A 16 6.206 9.357 1.594 1.00 0.00 C ATOM 184 CG2 ILE A 16 6.176 6.984 2.407 1.00 0.00 C ATOM 185 CD1 ILE A 16 7.395 9.330 0.659 1.00 0.00 C ATOM 0 H ILE A 16 6.303 10.696 3.867 1.00 0.00 H new ATOM 0 HA ILE A 16 4.347 8.773 3.499 1.00 0.00 H new ATOM 0 HB ILE A 16 7.373 8.561 3.202 1.00 0.00 H new ATOM 0 HG12 ILE A 16 5.313 9.065 1.042 1.00 0.00 H new ATOM 0 HG13 ILE A 16 6.048 10.379 1.939 1.00 0.00 H new ATOM 0 HG21 ILE A 16 6.895 6.725 1.630 1.00 0.00 H new ATOM 0 HG22 ILE A 16 6.334 6.344 3.275 1.00 0.00 H new ATOM 0 HG23 ILE A 16 5.164 6.839 2.028 1.00 0.00 H new ATOM 0 HD11 ILE A 16 7.214 10.003 -0.179 1.00 0.00 H new ATOM 0 HD12 ILE A 16 8.288 9.651 1.196 1.00 0.00 H new ATOM 0 HD13 ILE A 16 7.541 8.317 0.285 1.00 0.00 H new ATOM 197 N LEU A 17 6.528 8.018 5.868 1.00 0.00 N ATOM 198 CA LEU A 17 6.763 7.150 7.015 1.00 0.00 C ATOM 199 C LEU A 17 5.509 7.031 7.876 1.00 0.00 C ATOM 200 O LEU A 17 5.227 5.973 8.440 1.00 0.00 O ATOM 201 CB LEU A 17 7.924 7.685 7.857 1.00 0.00 C ATOM 202 CG LEU A 17 9.302 7.655 7.194 1.00 0.00 C ATOM 203 CD1 LEU A 17 10.326 8.369 8.064 1.00 0.00 C ATOM 204 CD2 LEU A 17 9.734 6.222 6.926 1.00 0.00 C ATOM 0 H LEU A 17 7.226 8.751 5.744 1.00 0.00 H new ATOM 0 HA LEU A 17 7.020 6.159 6.641 1.00 0.00 H new ATOM 0 HB2 LEU A 17 7.700 8.714 8.137 1.00 0.00 H new ATOM 0 HB3 LEU A 17 7.974 7.107 8.780 1.00 0.00 H new ATOM 0 HG LEU A 17 9.237 8.177 6.239 1.00 0.00 H new ATOM 0 HD11 LEU A 17 11.301 8.338 7.578 1.00 0.00 H new ATOM 0 HD12 LEU A 17 10.023 9.407 8.205 1.00 0.00 H new ATOM 0 HD13 LEU A 17 10.388 7.874 9.033 1.00 0.00 H new ATOM 0 HD21 LEU A 17 10.717 6.220 6.454 1.00 0.00 H new ATOM 0 HD22 LEU A 17 9.783 5.675 7.867 1.00 0.00 H new ATOM 0 HD23 LEU A 17 9.013 5.742 6.264 1.00 0.00 H new ATOM 216 N THR A 18 4.758 8.124 7.971 1.00 0.00 N ATOM 217 CA THR A 18 3.533 8.142 8.760 1.00 0.00 C ATOM 218 C THR A 18 2.509 7.155 8.211 1.00 0.00 C ATOM 219 O THR A 18 2.201 6.148 8.849 1.00 0.00 O ATOM 220 CB THR A 18 2.907 9.549 8.793 1.00 0.00 C ATOM 221 OG1 THR A 18 3.818 10.477 9.392 1.00 0.00 O ATOM 222 CG2 THR A 18 1.598 9.541 9.570 1.00 0.00 C ATOM 0 H THR A 18 4.977 9.008 7.511 1.00 0.00 H new ATOM 0 HA THR A 18 3.807 7.850 9.774 1.00 0.00 H new ATOM 0 HB THR A 18 2.700 9.855 7.767 1.00 0.00 H new ATOM 0 HG1 THR A 18 3.413 11.369 9.407 1.00 0.00 H new ATOM 0 HG21 THR A 18 1.175 10.545 9.580 1.00 0.00 H new ATOM 0 HG22 THR A 18 0.896 8.856 9.094 1.00 0.00 H new ATOM 0 HG23 THR A 18 1.784 9.216 10.594 1.00 0.00 H new ATOM 230 N ILE A 19 1.986 7.450 7.026 1.00 0.00 N ATOM 231 CA ILE A 19 0.999 6.587 6.392 1.00 0.00 C ATOM 232 C ILE A 19 1.303 5.117 6.655 1.00 0.00 C ATOM 233 O ILE A 19 0.394 4.294 6.771 1.00 0.00 O ATOM 234 CB ILE A 19 0.940 6.823 4.870 1.00 0.00 C ATOM 235 CG1 ILE A 19 0.167 8.107 4.561 1.00 0.00 C ATOM 236 CG2 ILE A 19 0.298 5.632 4.174 1.00 0.00 C ATOM 237 CD1 ILE A 19 1.045 9.335 4.475 1.00 0.00 C ATOM 0 H ILE A 19 2.230 8.280 6.486 1.00 0.00 H new ATOM 0 HA ILE A 19 0.033 6.839 6.829 1.00 0.00 H new ATOM 0 HB ILE A 19 1.957 6.934 4.494 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -0.364 7.983 3.617 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -0.587 8.262 5.333 1.00 0.00 H new ATOM 0 HG21 ILE A 19 0.263 5.814 3.100 1.00 0.00 H new ATOM 0 HG22 ILE A 19 0.885 4.735 4.372 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -0.715 5.493 4.551 1.00 0.00 H new ATOM 0 HD11 ILE A 19 0.430 10.207 4.253 1.00 0.00 H new ATOM 0 HD12 ILE A 19 1.557 9.484 5.426 1.00 0.00 H new ATOM 0 HD13 ILE A 19 1.782 9.200 3.684 1.00 0.00 H new ATOM 249 N PHE A 20 2.589 4.792 6.750 1.00 0.00 N ATOM 250 CA PHE A 20 3.014 3.420 7.002 1.00 0.00 C ATOM 251 C PHE A 20 2.957 3.097 8.492 1.00 0.00 C ATOM 252 O PHE A 20 2.337 2.116 8.904 1.00 0.00 O ATOM 253 CB PHE A 20 4.433 3.200 6.475 1.00 0.00 C ATOM 254 CG PHE A 20 4.485 2.868 5.011 1.00 0.00 C ATOM 255 CD1 PHE A 20 3.820 1.758 4.515 1.00 0.00 C ATOM 256 CD2 PHE A 20 5.197 3.666 4.131 1.00 0.00 C ATOM 257 CE1 PHE A 20 3.866 1.451 3.168 1.00 0.00 C ATOM 258 CE2 PHE A 20 5.247 3.364 2.783 1.00 0.00 C ATOM 259 CZ PHE A 20 4.579 2.256 2.301 1.00 0.00 C ATOM 0 H PHE A 20 3.354 5.460 6.656 1.00 0.00 H new ATOM 0 HA PHE A 20 2.331 2.752 6.478 1.00 0.00 H new ATOM 0 HB2 PHE A 20 5.023 4.099 6.657 1.00 0.00 H new ATOM 0 HB3 PHE A 20 4.900 2.393 7.039 1.00 0.00 H new ATOM 0 HD1 PHE A 20 3.260 1.126 5.188 1.00 0.00 H new ATOM 0 HD2 PHE A 20 5.720 4.535 4.503 1.00 0.00 H new ATOM 0 HE1 PHE A 20 3.345 0.582 2.794 1.00 0.00 H new ATOM 0 HE2 PHE A 20 5.808 3.994 2.108 1.00 0.00 H new ATOM 0 HZ PHE A 20 4.614 2.019 1.248 1.00 0.00 H new ATOM 269 N LYS A 21 3.607 3.930 9.298 1.00 0.00 N ATOM 270 CA LYS A 21 3.631 3.735 10.742 1.00 0.00 C ATOM 271 C LYS A 21 2.241 3.389 11.268 1.00 0.00 C ATOM 272 O LYS A 21 2.104 2.758 12.316 1.00 0.00 O ATOM 273 CB LYS A 21 4.152 4.995 11.438 1.00 0.00 C ATOM 274 CG LYS A 21 3.052 5.953 11.864 1.00 0.00 C ATOM 275 CD LYS A 21 3.623 7.272 12.359 1.00 0.00 C ATOM 276 CE LYS A 21 3.873 7.242 13.859 1.00 0.00 C ATOM 277 NZ LYS A 21 2.602 7.213 14.633 1.00 0.00 N ATOM 0 H LYS A 21 4.125 4.747 8.975 1.00 0.00 H new ATOM 0 HA LYS A 21 4.300 2.903 10.960 1.00 0.00 H new ATOM 0 HB2 LYS A 21 4.728 4.703 12.316 1.00 0.00 H new ATOM 0 HB3 LYS A 21 4.835 5.515 10.766 1.00 0.00 H new ATOM 0 HG2 LYS A 21 2.383 6.138 11.023 1.00 0.00 H new ATOM 0 HG3 LYS A 21 2.454 5.495 12.652 1.00 0.00 H new ATOM 0 HD2 LYS A 21 4.556 7.484 11.838 1.00 0.00 H new ATOM 0 HD3 LYS A 21 2.933 8.081 12.120 1.00 0.00 H new ATOM 0 HE2 LYS A 21 4.471 6.366 14.110 1.00 0.00 H new ATOM 0 HE3 LYS A 21 4.454 8.118 14.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 2.778 7.545 15.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 1.903 7.833 14.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 2.235 6.240 14.662 1.00 0.00 H new ATOM 291 N ARG A 22 1.215 3.805 10.532 1.00 0.00 N ATOM 292 CA ARG A 22 -0.163 3.537 10.925 1.00 0.00 C ATOM 293 C ARG A 22 -0.547 2.093 10.614 1.00 0.00 C ATOM 294 O ARG A 22 -1.180 1.419 11.428 1.00 0.00 O ATOM 295 CB ARG A 22 -1.115 4.495 10.205 1.00 0.00 C ATOM 296 CG ARG A 22 -2.485 4.593 10.855 1.00 0.00 C ATOM 297 CD ARG A 22 -2.518 5.673 11.925 1.00 0.00 C ATOM 298 NE ARG A 22 -3.881 5.983 12.349 1.00 0.00 N ATOM 299 CZ ARG A 22 -4.510 5.341 13.327 1.00 0.00 C ATOM 300 NH1 ARG A 22 -3.903 4.358 13.977 1.00 0.00 N ATOM 301 NH2 ARG A 22 -5.750 5.680 13.655 1.00 0.00 N ATOM 0 H ARG A 22 1.312 4.328 9.662 1.00 0.00 H new ATOM 0 HA ARG A 22 -0.245 3.692 12.001 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -0.665 5.487 10.175 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -1.235 4.167 9.172 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -3.235 4.810 10.094 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -2.748 3.632 11.298 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -1.936 5.347 12.787 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -2.043 6.577 11.543 1.00 0.00 H new ATOM 0 HE ARG A 22 -4.377 6.733 11.868 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -2.950 4.093 13.727 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -4.388 3.867 14.728 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -6.221 6.434 13.156 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -6.232 5.186 14.406 1.00 0.00 H new ATOM 315 N LEU A 23 -0.161 1.625 9.433 1.00 0.00 N ATOM 316 CA LEU A 23 -0.463 0.260 9.015 1.00 0.00 C ATOM 317 C LEU A 23 0.537 -0.726 9.608 1.00 0.00 C ATOM 318 O LEU A 23 0.153 -1.702 10.253 1.00 0.00 O ATOM 319 CB LEU A 23 -0.453 0.160 7.488 1.00 0.00 C ATOM 320 CG LEU A 23 -1.485 1.013 6.751 1.00 0.00 C ATOM 321 CD1 LEU A 23 -1.102 1.172 5.289 1.00 0.00 C ATOM 322 CD2 LEU A 23 -2.872 0.398 6.877 1.00 0.00 C ATOM 0 H LEU A 23 0.362 2.170 8.747 1.00 0.00 H new ATOM 0 HA LEU A 23 -1.457 0.005 9.383 1.00 0.00 H new ATOM 0 HB2 LEU A 23 0.539 0.439 7.133 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.609 -0.883 7.212 1.00 0.00 H new ATOM 0 HG LEU A 23 -1.504 2.002 7.209 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -1.849 1.782 4.781 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -0.128 1.657 5.219 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -1.053 0.191 4.817 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -3.595 1.018 6.346 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -2.867 -0.603 6.445 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -3.149 0.338 7.929 1.00 0.00 H new ATOM 334 N ARG A 24 1.820 -0.464 9.387 1.00 0.00 N ATOM 335 CA ARG A 24 2.877 -1.329 9.900 1.00 0.00 C ATOM 336 C ARG A 24 2.614 -1.700 11.357 1.00 0.00 C ATOM 337 O ARG A 24 2.666 -2.873 11.728 1.00 0.00 O ATOM 338 CB ARG A 24 4.236 -0.639 9.775 1.00 0.00 C ATOM 339 CG ARG A 24 4.604 -0.273 8.346 1.00 0.00 C ATOM 340 CD ARG A 24 5.949 0.434 8.282 1.00 0.00 C ATOM 341 NE ARG A 24 6.034 1.537 9.235 1.00 0.00 N ATOM 342 CZ ARG A 24 7.182 2.036 9.680 1.00 0.00 C ATOM 343 NH1 ARG A 24 8.335 1.534 9.259 1.00 0.00 N ATOM 344 NH2 ARG A 24 7.178 3.040 10.546 1.00 0.00 N ATOM 0 H ARG A 24 2.154 0.340 8.856 1.00 0.00 H new ATOM 0 HA ARG A 24 2.886 -2.243 9.306 1.00 0.00 H new ATOM 0 HB2 ARG A 24 4.232 0.265 10.383 1.00 0.00 H new ATOM 0 HB3 ARG A 24 5.006 -1.294 10.183 1.00 0.00 H new ATOM 0 HG2 ARG A 24 4.636 -1.175 7.735 1.00 0.00 H new ATOM 0 HG3 ARG A 24 3.833 0.371 7.924 1.00 0.00 H new ATOM 0 HD2 ARG A 24 6.745 -0.282 8.485 1.00 0.00 H new ATOM 0 HD3 ARG A 24 6.111 0.813 7.273 1.00 0.00 H new ATOM 0 HE ARG A 24 5.165 1.947 9.578 1.00 0.00 H new ATOM 0 HH11 ARG A 24 8.342 0.763 8.592 1.00 0.00 H new ATOM 0 HH12 ARG A 24 9.215 1.919 9.602 1.00 0.00 H new ATOM 0 HH21 ARG A 24 6.293 3.430 10.871 1.00 0.00 H new ATOM 0 HH22 ARG A 24 8.060 3.423 10.887 1.00 0.00 H new ATOM 358 N SER A 25 2.334 -0.693 12.177 1.00 0.00 N ATOM 359 CA SER A 25 2.068 -0.912 13.595 1.00 0.00 C ATOM 360 C SER A 25 1.295 -2.211 13.807 1.00 0.00 C ATOM 361 O SER A 25 1.682 -3.052 14.619 1.00 0.00 O ATOM 362 CB SER A 25 1.280 0.263 14.176 1.00 0.00 C ATOM 363 OG SER A 25 1.391 0.302 15.588 1.00 0.00 O ATOM 0 H SER A 25 2.285 0.283 11.885 1.00 0.00 H new ATOM 0 HA SER A 25 3.025 -0.989 14.111 1.00 0.00 H new ATOM 0 HB2 SER A 25 1.649 1.197 13.753 1.00 0.00 H new ATOM 0 HB3 SER A 25 0.231 0.177 13.893 1.00 0.00 H new ATOM 0 HG SER A 25 0.880 1.063 15.935 1.00 0.00 H new ATOM 369 N VAL A 26 0.200 -2.368 13.071 1.00 0.00 N ATOM 370 CA VAL A 26 -0.628 -3.563 13.177 1.00 0.00 C ATOM 371 C VAL A 26 0.213 -4.828 13.035 1.00 0.00 C ATOM 372 O VAL A 26 1.036 -4.957 12.129 1.00 0.00 O ATOM 373 CB VAL A 26 -1.738 -3.575 12.110 1.00 0.00 C ATOM 374 CG1 VAL A 26 -2.796 -4.612 12.450 1.00 0.00 C ATOM 375 CG2 VAL A 26 -2.358 -2.192 11.972 1.00 0.00 C ATOM 0 H VAL A 26 -0.135 -1.682 12.394 1.00 0.00 H new ATOM 0 HA VAL A 26 -1.087 -3.543 14.166 1.00 0.00 H new ATOM 0 HB VAL A 26 -1.294 -3.847 11.152 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -3.572 -4.605 11.684 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -2.337 -5.600 12.493 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -3.239 -4.376 13.417 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -3.141 -2.218 11.214 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -2.788 -1.889 12.927 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -1.590 -1.477 11.676 1.00 0.00 H new ATOM 385 N PRO A 27 0.001 -5.785 13.950 1.00 0.00 N ATOM 386 CA PRO A 27 0.728 -7.058 13.947 1.00 0.00 C ATOM 387 C PRO A 27 0.329 -7.952 12.777 1.00 0.00 C ATOM 388 O PRO A 27 0.737 -9.111 12.699 1.00 0.00 O ATOM 389 CB PRO A 27 0.321 -7.703 15.274 1.00 0.00 C ATOM 390 CG PRO A 27 -1.006 -7.103 15.596 1.00 0.00 C ATOM 391 CD PRO A 27 -0.967 -5.700 15.058 1.00 0.00 C ATOM 0 HA PRO A 27 1.803 -6.912 13.840 1.00 0.00 H new ATOM 0 HB2 PRO A 27 0.254 -8.787 15.183 1.00 0.00 H new ATOM 0 HB3 PRO A 27 1.051 -7.493 16.056 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -1.814 -7.674 15.139 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.184 -7.104 16.671 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -1.948 -5.376 14.710 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -0.646 -4.987 15.818 1.00 0.00 H new ATOM 399 N THR A 28 -0.472 -7.405 11.867 1.00 0.00 N ATOM 400 CA THR A 28 -0.926 -8.152 10.701 1.00 0.00 C ATOM 401 C THR A 28 -0.381 -7.546 9.413 1.00 0.00 C ATOM 402 O THR A 28 -0.441 -8.165 8.352 1.00 0.00 O ATOM 403 CB THR A 28 -2.465 -8.194 10.626 1.00 0.00 C ATOM 404 OG1 THR A 28 -2.985 -6.865 10.507 1.00 0.00 O ATOM 405 CG2 THR A 28 -3.049 -8.865 11.859 1.00 0.00 C ATOM 0 H THR A 28 -0.819 -6.447 11.916 1.00 0.00 H new ATOM 0 HA THR A 28 -0.547 -9.168 10.809 1.00 0.00 H new ATOM 0 HB THR A 28 -2.749 -8.775 9.748 1.00 0.00 H new ATOM 0 HG1 THR A 28 -3.963 -6.900 10.458 1.00 0.00 H new ATOM 0 HG21 THR A 28 -4.136 -8.883 11.783 1.00 0.00 H new ATOM 0 HG22 THR A 28 -2.674 -9.886 11.930 1.00 0.00 H new ATOM 0 HG23 THR A 28 -2.757 -8.308 12.749 1.00 0.00 H new ATOM 413 N ASN A 29 0.151 -6.333 9.514 1.00 0.00 N ATOM 414 CA ASN A 29 0.707 -5.643 8.356 1.00 0.00 C ATOM 415 C ASN A 29 2.232 -5.620 8.417 1.00 0.00 C ATOM 416 O ASN A 29 2.902 -5.440 7.401 1.00 0.00 O ATOM 417 CB ASN A 29 0.168 -4.214 8.279 1.00 0.00 C ATOM 418 CG ASN A 29 -1.270 -4.163 7.797 1.00 0.00 C ATOM 419 OD1 ASN A 29 -1.739 -5.075 7.115 1.00 0.00 O ATOM 420 ND2 ASN A 29 -1.975 -3.094 8.148 1.00 0.00 N ATOM 0 H ASN A 29 0.209 -5.807 10.386 1.00 0.00 H new ATOM 0 HA ASN A 29 0.404 -6.187 7.461 1.00 0.00 H new ATOM 0 HB2 ASN A 29 0.235 -3.750 9.263 1.00 0.00 H new ATOM 0 HB3 ASN A 29 0.795 -3.628 7.607 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -2.947 -3.004 7.851 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -1.545 -2.363 8.714 1.00 0.00 H new ATOM 427 N LYS A 30 2.774 -5.804 9.616 1.00 0.00 N ATOM 428 CA LYS A 30 4.218 -5.807 9.812 1.00 0.00 C ATOM 429 C LYS A 30 4.813 -7.167 9.460 1.00 0.00 C ATOM 430 O LYS A 30 5.971 -7.448 9.768 1.00 0.00 O ATOM 431 CB LYS A 30 4.559 -5.450 11.260 1.00 0.00 C ATOM 432 CG LYS A 30 4.023 -6.446 12.274 1.00 0.00 C ATOM 433 CD LYS A 30 4.472 -6.102 13.685 1.00 0.00 C ATOM 434 CE LYS A 30 3.964 -4.735 14.113 1.00 0.00 C ATOM 435 NZ LYS A 30 3.946 -4.588 15.594 1.00 0.00 N ATOM 0 H LYS A 30 2.233 -5.953 10.468 1.00 0.00 H new ATOM 0 HA LYS A 30 4.650 -5.058 9.148 1.00 0.00 H new ATOM 0 HB2 LYS A 30 5.642 -5.385 11.364 1.00 0.00 H new ATOM 0 HB3 LYS A 30 4.158 -4.462 11.486 1.00 0.00 H new ATOM 0 HG2 LYS A 30 2.934 -6.460 12.231 1.00 0.00 H new ATOM 0 HG3 LYS A 30 4.365 -7.448 12.017 1.00 0.00 H new ATOM 0 HD2 LYS A 30 4.108 -6.860 14.379 1.00 0.00 H new ATOM 0 HD3 LYS A 30 5.561 -6.119 13.736 1.00 0.00 H new ATOM 0 HE2 LYS A 30 4.596 -3.961 13.679 1.00 0.00 H new ATOM 0 HE3 LYS A 30 2.959 -4.582 13.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 3.121 -4.021 15.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 3.888 -5.528 16.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 4.817 -4.112 15.906 1.00 0.00 H new ATOM 449 N VAL A 31 4.012 -8.008 8.811 1.00 0.00 N ATOM 450 CA VAL A 31 4.460 -9.337 8.413 1.00 0.00 C ATOM 451 C VAL A 31 4.071 -9.641 6.972 1.00 0.00 C ATOM 452 O VAL A 31 2.888 -9.695 6.634 1.00 0.00 O ATOM 453 CB VAL A 31 3.872 -10.425 9.332 1.00 0.00 C ATOM 454 CG1 VAL A 31 4.586 -10.434 10.675 1.00 0.00 C ATOM 455 CG2 VAL A 31 2.376 -10.215 9.516 1.00 0.00 C ATOM 0 H VAL A 31 3.050 -7.792 8.550 1.00 0.00 H new ATOM 0 HA VAL A 31 5.546 -9.344 8.501 1.00 0.00 H new ATOM 0 HB VAL A 31 4.025 -11.396 8.860 1.00 0.00 H new ATOM 0 HG11 VAL A 31 4.157 -11.209 11.310 1.00 0.00 H new ATOM 0 HG12 VAL A 31 5.646 -10.636 10.522 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.468 -9.463 11.157 1.00 0.00 H new ATOM 0 HG21 VAL A 31 1.977 -10.992 10.168 1.00 0.00 H new ATOM 0 HG22 VAL A 31 2.198 -9.238 9.965 1.00 0.00 H new ATOM 0 HG23 VAL A 31 1.880 -10.264 8.547 1.00 0.00 H new ATOM 465 N CYS A 32 5.074 -9.838 6.123 1.00 0.00 N ATOM 466 CA CYS A 32 4.839 -10.137 4.715 1.00 0.00 C ATOM 467 C CYS A 32 3.573 -10.972 4.541 1.00 0.00 C ATOM 468 O CYS A 32 3.590 -12.190 4.723 1.00 0.00 O ATOM 469 CB CYS A 32 6.038 -10.878 4.122 1.00 0.00 C ATOM 470 SG CYS A 32 5.753 -11.530 2.445 1.00 0.00 S ATOM 0 H CYS A 32 6.059 -9.796 6.386 1.00 0.00 H new ATOM 0 HA CYS A 32 4.707 -9.193 4.186 1.00 0.00 H new ATOM 0 HB2 CYS A 32 6.893 -10.203 4.097 1.00 0.00 H new ATOM 0 HB3 CYS A 32 6.303 -11.704 4.781 1.00 0.00 H new ATOM 475 N PHE A 33 2.477 -10.308 4.187 1.00 0.00 N ATOM 476 CA PHE A 33 1.203 -10.989 3.988 1.00 0.00 C ATOM 477 C PHE A 33 1.404 -12.327 3.283 1.00 0.00 C ATOM 478 O PHE A 33 0.617 -13.257 3.458 1.00 0.00 O ATOM 479 CB PHE A 33 0.253 -10.108 3.174 1.00 0.00 C ATOM 480 CG PHE A 33 -0.704 -10.890 2.319 1.00 0.00 C ATOM 481 CD1 PHE A 33 -0.263 -11.539 1.178 1.00 0.00 C ATOM 482 CD2 PHE A 33 -2.045 -10.974 2.656 1.00 0.00 C ATOM 483 CE1 PHE A 33 -1.140 -12.259 0.389 1.00 0.00 C ATOM 484 CE2 PHE A 33 -2.927 -11.693 1.872 1.00 0.00 C ATOM 485 CZ PHE A 33 -2.474 -12.335 0.736 1.00 0.00 C ATOM 0 H PHE A 33 2.446 -9.300 4.032 1.00 0.00 H new ATOM 0 HA PHE A 33 0.764 -11.178 4.967 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -0.315 -9.474 3.855 1.00 0.00 H new ATOM 0 HB3 PHE A 33 0.840 -9.446 2.537 1.00 0.00 H new ATOM 0 HD1 PHE A 33 0.779 -11.482 0.901 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -2.405 -10.472 3.542 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -0.782 -12.761 -0.498 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -3.970 -11.753 2.147 1.00 0.00 H new ATOM 0 HZ PHE A 33 -3.162 -12.895 0.120 1.00 0.00 H new ATOM 495 N ASP A 34 2.464 -12.415 2.486 1.00 0.00 N ATOM 496 CA ASP A 34 2.770 -13.638 1.754 1.00 0.00 C ATOM 497 C ASP A 34 3.211 -14.745 2.707 1.00 0.00 C ATOM 498 O ASP A 34 2.480 -15.709 2.937 1.00 0.00 O ATOM 499 CB ASP A 34 3.862 -13.377 0.716 1.00 0.00 C ATOM 500 CG ASP A 34 3.710 -14.248 -0.515 1.00 0.00 C ATOM 501 OD1 ASP A 34 3.460 -15.461 -0.357 1.00 0.00 O ATOM 502 OD2 ASP A 34 3.844 -13.717 -1.638 1.00 0.00 O ATOM 0 H ASP A 34 3.125 -11.654 2.331 1.00 0.00 H new ATOM 0 HA ASP A 34 1.864 -13.963 1.242 1.00 0.00 H new ATOM 0 HB2 ASP A 34 3.836 -12.328 0.421 1.00 0.00 H new ATOM 0 HB3 ASP A 34 4.838 -13.557 1.167 1.00 0.00 H new ATOM 507 N CYS A 35 4.412 -14.601 3.258 1.00 0.00 N ATOM 508 CA CYS A 35 4.952 -15.588 4.185 1.00 0.00 C ATOM 509 C CYS A 35 4.729 -15.156 5.631 1.00 0.00 C ATOM 510 O CYS A 35 4.320 -15.955 6.473 1.00 0.00 O ATOM 511 CB CYS A 35 6.446 -15.796 3.927 1.00 0.00 C ATOM 512 SG CYS A 35 7.439 -14.272 4.043 1.00 0.00 S ATOM 0 H CYS A 35 5.030 -13.810 3.078 1.00 0.00 H new ATOM 0 HA CYS A 35 4.427 -16.529 4.021 1.00 0.00 H new ATOM 0 HB2 CYS A 35 6.830 -16.523 4.643 1.00 0.00 H new ATOM 0 HB3 CYS A 35 6.576 -16.227 2.934 1.00 0.00 H new ATOM 517 N GLY A 36 5.000 -13.885 5.912 1.00 0.00 N ATOM 518 CA GLY A 36 4.823 -13.368 7.256 1.00 0.00 C ATOM 519 C GLY A 36 6.079 -12.715 7.796 1.00 0.00 C ATOM 520 O GLY A 36 6.134 -12.330 8.964 1.00 0.00 O ATOM 0 H GLY A 36 5.339 -13.204 5.232 1.00 0.00 H new ATOM 0 HA2 GLY A 36 4.010 -12.642 7.258 1.00 0.00 H new ATOM 0 HA3 GLY A 36 4.526 -14.181 7.919 1.00 0.00 H new ATOM 524 N ALA A 37 7.092 -12.588 6.945 1.00 0.00 N ATOM 525 CA ALA A 37 8.353 -11.977 7.343 1.00 0.00 C ATOM 526 C ALA A 37 8.118 -10.650 8.056 1.00 0.00 C ATOM 527 O ALA A 37 7.468 -9.751 7.521 1.00 0.00 O ATOM 528 CB ALA A 37 9.248 -11.775 6.129 1.00 0.00 C ATOM 0 H ALA A 37 7.063 -12.901 5.975 1.00 0.00 H new ATOM 0 HA ALA A 37 8.851 -12.651 8.040 1.00 0.00 H new ATOM 0 HB1 ALA A 37 10.187 -11.318 6.441 1.00 0.00 H new ATOM 0 HB2 ALA A 37 9.451 -12.739 5.663 1.00 0.00 H new ATOM 0 HB3 ALA A 37 8.748 -11.124 5.412 1.00 0.00 H new ATOM 534 N LYS A 38 8.652 -10.532 9.267 1.00 0.00 N ATOM 535 CA LYS A 38 8.501 -9.314 10.055 1.00 0.00 C ATOM 536 C LYS A 38 9.305 -8.169 9.445 1.00 0.00 C ATOM 537 O LYS A 38 10.390 -8.380 8.905 1.00 0.00 O ATOM 538 CB LYS A 38 8.951 -9.556 11.498 1.00 0.00 C ATOM 539 CG LYS A 38 8.061 -10.524 12.258 1.00 0.00 C ATOM 540 CD LYS A 38 8.246 -10.390 13.760 1.00 0.00 C ATOM 541 CE LYS A 38 7.492 -11.473 14.513 1.00 0.00 C ATOM 542 NZ LYS A 38 6.096 -11.061 14.829 1.00 0.00 N ATOM 0 H LYS A 38 9.194 -11.265 9.724 1.00 0.00 H new ATOM 0 HA LYS A 38 7.447 -9.037 10.052 1.00 0.00 H new ATOM 0 HB2 LYS A 38 9.971 -9.941 11.492 1.00 0.00 H new ATOM 0 HB3 LYS A 38 8.973 -8.604 12.028 1.00 0.00 H new ATOM 0 HG2 LYS A 38 7.018 -10.339 12.001 1.00 0.00 H new ATOM 0 HG3 LYS A 38 8.288 -11.545 11.952 1.00 0.00 H new ATOM 0 HD2 LYS A 38 9.307 -10.448 14.003 1.00 0.00 H new ATOM 0 HD3 LYS A 38 7.897 -9.410 14.085 1.00 0.00 H new ATOM 0 HE2 LYS A 38 7.475 -12.385 13.916 1.00 0.00 H new ATOM 0 HE3 LYS A 38 8.020 -11.707 15.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 5.616 -11.827 15.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 6.112 -10.205 15.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 5.584 -10.863 13.946 1.00 0.00 H new ATOM 556 N ASN A 39 8.767 -6.957 9.540 1.00 0.00 N ATOM 557 CA ASN A 39 9.435 -5.780 8.999 1.00 0.00 C ATOM 558 C ASN A 39 9.584 -5.886 7.485 1.00 0.00 C ATOM 559 O ASN A 39 10.659 -5.669 6.924 1.00 0.00 O ATOM 560 CB ASN A 39 10.811 -5.605 9.647 1.00 0.00 C ATOM 561 CG ASN A 39 10.750 -4.778 10.916 1.00 0.00 C ATOM 562 OD1 ASN A 39 9.673 -4.513 11.447 1.00 0.00 O ATOM 563 ND2 ASN A 39 11.913 -4.366 11.409 1.00 0.00 N ATOM 0 H ASN A 39 7.870 -6.765 9.987 1.00 0.00 H new ATOM 0 HA ASN A 39 8.820 -4.909 9.226 1.00 0.00 H new ATOM 0 HB2 ASN A 39 11.230 -6.585 9.875 1.00 0.00 H new ATOM 0 HB3 ASN A 39 11.486 -5.127 8.937 1.00 0.00 H new ATOM 0 HD21 ASN A 39 11.936 -3.806 12.261 1.00 0.00 H new ATOM 0 HD22 ASN A 39 12.783 -4.610 10.935 1.00 0.00 H new ATOM 570 N PRO A 40 8.481 -6.230 6.804 1.00 0.00 N ATOM 571 CA PRO A 40 8.462 -6.372 5.345 1.00 0.00 C ATOM 572 C PRO A 40 8.606 -5.033 4.630 1.00 0.00 C ATOM 573 O PRO A 40 7.620 -4.451 4.177 1.00 0.00 O ATOM 574 CB PRO A 40 7.087 -6.983 5.065 1.00 0.00 C ATOM 575 CG PRO A 40 6.244 -6.562 6.219 1.00 0.00 C ATOM 576 CD PRO A 40 7.165 -6.504 7.406 1.00 0.00 C ATOM 0 HA PRO A 40 9.294 -6.977 4.984 1.00 0.00 H new ATOM 0 HB2 PRO A 40 6.677 -6.621 4.122 1.00 0.00 H new ATOM 0 HB3 PRO A 40 7.144 -8.069 4.991 1.00 0.00 H new ATOM 0 HG2 PRO A 40 5.785 -5.591 6.033 1.00 0.00 H new ATOM 0 HG3 PRO A 40 5.433 -7.270 6.389 1.00 0.00 H new ATOM 0 HD2 PRO A 40 6.872 -5.720 8.104 1.00 0.00 H new ATOM 0 HD3 PRO A 40 7.165 -7.442 7.961 1.00 0.00 H new ATOM 584 N SER A 41 9.840 -4.548 4.532 1.00 0.00 N ATOM 585 CA SER A 41 10.112 -3.275 3.874 1.00 0.00 C ATOM 586 C SER A 41 9.278 -3.132 2.604 1.00 0.00 C ATOM 587 O SER A 41 8.427 -2.248 2.505 1.00 0.00 O ATOM 588 CB SER A 41 11.599 -3.159 3.538 1.00 0.00 C ATOM 589 OG SER A 41 12.358 -2.833 4.688 1.00 0.00 O ATOM 0 H SER A 41 10.667 -5.017 4.900 1.00 0.00 H new ATOM 0 HA SER A 41 9.839 -2.473 4.559 1.00 0.00 H new ATOM 0 HB2 SER A 41 11.955 -4.100 3.119 1.00 0.00 H new ATOM 0 HB3 SER A 41 11.744 -2.395 2.774 1.00 0.00 H new ATOM 0 HG SER A 41 13.305 -2.766 4.447 1.00 0.00 H new ATOM 595 N TRP A 42 9.530 -4.006 1.637 1.00 0.00 N ATOM 596 CA TRP A 42 8.802 -3.977 0.373 1.00 0.00 C ATOM 597 C TRP A 42 7.301 -3.873 0.610 1.00 0.00 C ATOM 598 O TRP A 42 6.759 -4.518 1.508 1.00 0.00 O ATOM 599 CB TRP A 42 9.116 -5.229 -0.448 1.00 0.00 C ATOM 600 CG TRP A 42 10.557 -5.329 -0.852 1.00 0.00 C ATOM 601 CD1 TRP A 42 11.582 -5.839 -0.108 1.00 0.00 C ATOM 602 CD2 TRP A 42 11.130 -4.907 -2.094 1.00 0.00 C ATOM 603 NE1 TRP A 42 12.759 -5.760 -0.814 1.00 0.00 N ATOM 604 CE2 TRP A 42 12.508 -5.192 -2.035 1.00 0.00 C ATOM 605 CE3 TRP A 42 10.613 -4.318 -3.250 1.00 0.00 C ATOM 606 CZ2 TRP A 42 13.373 -4.906 -3.088 1.00 0.00 C ATOM 607 CZ3 TRP A 42 11.472 -4.034 -4.295 1.00 0.00 C ATOM 608 CH2 TRP A 42 12.840 -4.329 -4.208 1.00 0.00 C ATOM 0 H TRP A 42 10.232 -4.743 1.703 1.00 0.00 H new ATOM 0 HA TRP A 42 9.124 -3.096 -0.182 1.00 0.00 H new ATOM 0 HB2 TRP A 42 8.847 -6.112 0.132 1.00 0.00 H new ATOM 0 HB3 TRP A 42 8.494 -5.233 -1.343 1.00 0.00 H new ATOM 0 HD1 TRP A 42 11.483 -6.245 0.888 1.00 0.00 H new ATOM 0 HE1 TRP A 42 13.671 -6.073 -0.482 1.00 0.00 H new ATOM 0 HE3 TRP A 42 9.560 -4.088 -3.326 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 14.427 -5.132 -3.023 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 11.083 -3.577 -5.193 1.00 0.00 H new ATOM 0 HH2 TRP A 42 13.486 -4.096 -5.042 1.00 0.00 H new ATOM 619 N ALA A 43 6.633 -3.057 -0.199 1.00 0.00 N ATOM 620 CA ALA A 43 5.192 -2.872 -0.077 1.00 0.00 C ATOM 621 C ALA A 43 4.535 -2.759 -1.449 1.00 0.00 C ATOM 622 O ALA A 43 4.930 -1.931 -2.270 1.00 0.00 O ATOM 623 CB ALA A 43 4.887 -1.638 0.759 1.00 0.00 C ATOM 0 H ALA A 43 7.066 -2.514 -0.946 1.00 0.00 H new ATOM 0 HA ALA A 43 4.779 -3.748 0.424 1.00 0.00 H new ATOM 0 HB1 ALA A 43 3.807 -1.512 0.842 1.00 0.00 H new ATOM 0 HB2 ALA A 43 5.316 -1.758 1.754 1.00 0.00 H new ATOM 0 HB3 ALA A 43 5.319 -0.759 0.281 1.00 0.00 H new ATOM 629 N SER A 44 3.531 -3.596 -1.691 1.00 0.00 N ATOM 630 CA SER A 44 2.823 -3.593 -2.965 1.00 0.00 C ATOM 631 C SER A 44 1.591 -2.696 -2.899 1.00 0.00 C ATOM 632 O SER A 44 0.617 -3.010 -2.214 1.00 0.00 O ATOM 633 CB SER A 44 2.413 -5.016 -3.348 1.00 0.00 C ATOM 634 OG SER A 44 1.443 -5.006 -4.382 1.00 0.00 O ATOM 0 H SER A 44 3.190 -4.285 -1.021 1.00 0.00 H new ATOM 0 HA SER A 44 3.497 -3.200 -3.726 1.00 0.00 H new ATOM 0 HB2 SER A 44 3.290 -5.576 -3.673 1.00 0.00 H new ATOM 0 HB3 SER A 44 2.013 -5.530 -2.474 1.00 0.00 H new ATOM 0 HG SER A 44 1.681 -5.672 -5.060 1.00 0.00 H new ATOM 640 N ILE A 45 1.641 -1.578 -3.616 1.00 0.00 N ATOM 641 CA ILE A 45 0.529 -0.636 -3.640 1.00 0.00 C ATOM 642 C ILE A 45 -0.704 -1.258 -4.287 1.00 0.00 C ATOM 643 O ILE A 45 -1.829 -1.054 -3.828 1.00 0.00 O ATOM 644 CB ILE A 45 0.899 0.651 -4.399 1.00 0.00 C ATOM 645 CG1 ILE A 45 2.159 1.280 -3.800 1.00 0.00 C ATOM 646 CG2 ILE A 45 -0.259 1.638 -4.365 1.00 0.00 C ATOM 647 CD1 ILE A 45 3.003 2.023 -4.811 1.00 0.00 C ATOM 0 H ILE A 45 2.440 -1.303 -4.188 1.00 0.00 H new ATOM 0 HA ILE A 45 0.305 -0.385 -2.603 1.00 0.00 H new ATOM 0 HB ILE A 45 1.103 0.395 -5.439 1.00 0.00 H new ATOM 0 HG12 ILE A 45 1.869 1.968 -3.005 1.00 0.00 H new ATOM 0 HG13 ILE A 45 2.762 0.497 -3.340 1.00 0.00 H new ATOM 0 HG21 ILE A 45 0.018 2.543 -4.906 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -1.134 1.188 -4.834 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -0.492 1.891 -3.330 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.879 2.442 -4.316 1.00 0.00 H new ATOM 0 HD12 ILE A 45 3.323 1.335 -5.594 1.00 0.00 H new ATOM 0 HD13 ILE A 45 2.416 2.828 -5.253 1.00 0.00 H new ATOM 659 N THR A 46 -0.486 -2.018 -5.355 1.00 0.00 N ATOM 660 CA THR A 46 -1.579 -2.670 -6.065 1.00 0.00 C ATOM 661 C THR A 46 -2.538 -3.349 -5.093 1.00 0.00 C ATOM 662 O THR A 46 -3.723 -3.019 -5.043 1.00 0.00 O ATOM 663 CB THR A 46 -1.053 -3.717 -7.066 1.00 0.00 C ATOM 664 OG1 THR A 46 -0.164 -3.098 -8.001 1.00 0.00 O ATOM 665 CG2 THR A 46 -2.203 -4.378 -7.811 1.00 0.00 C ATOM 0 H THR A 46 0.438 -2.197 -5.748 1.00 0.00 H new ATOM 0 HA THR A 46 -2.111 -1.891 -6.611 1.00 0.00 H new ATOM 0 HB THR A 46 -0.515 -4.483 -6.508 1.00 0.00 H new ATOM 0 HG1 THR A 46 -0.514 -3.211 -8.909 1.00 0.00 H new ATOM 0 HG21 THR A 46 -1.808 -5.113 -8.512 1.00 0.00 H new ATOM 0 HG22 THR A 46 -2.861 -4.874 -7.098 1.00 0.00 H new ATOM 0 HG23 THR A 46 -2.765 -3.621 -8.358 1.00 0.00 H new ATOM 673 N TYR A 47 -2.019 -4.299 -4.323 1.00 0.00 N ATOM 674 CA TYR A 47 -2.830 -5.025 -3.354 1.00 0.00 C ATOM 675 C TYR A 47 -2.712 -4.399 -1.968 1.00 0.00 C ATOM 676 O TYR A 47 -3.053 -5.022 -0.962 1.00 0.00 O ATOM 677 CB TYR A 47 -2.406 -6.494 -3.301 1.00 0.00 C ATOM 678 CG TYR A 47 -2.612 -7.230 -4.606 1.00 0.00 C ATOM 679 CD1 TYR A 47 -1.814 -6.962 -5.711 1.00 0.00 C ATOM 680 CD2 TYR A 47 -3.604 -8.195 -4.733 1.00 0.00 C ATOM 681 CE1 TYR A 47 -1.998 -7.633 -6.905 1.00 0.00 C ATOM 682 CE2 TYR A 47 -3.794 -8.871 -5.922 1.00 0.00 C ATOM 683 CZ TYR A 47 -2.989 -8.586 -7.004 1.00 0.00 C ATOM 684 OH TYR A 47 -3.177 -9.256 -8.192 1.00 0.00 O ATOM 0 H TYR A 47 -1.040 -4.584 -4.351 1.00 0.00 H new ATOM 0 HA TYR A 47 -3.871 -4.966 -3.672 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -1.353 -6.550 -3.024 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -2.970 -6.998 -2.516 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -1.036 -6.216 -5.636 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -4.237 -8.420 -3.887 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -1.369 -7.412 -7.755 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -4.569 -9.619 -6.004 1.00 0.00 H new ATOM 0 HH TYR A 47 -2.323 -9.325 -8.668 1.00 0.00 H new ATOM 694 N GLY A 48 -2.228 -3.162 -1.923 1.00 0.00 N ATOM 695 CA GLY A 48 -2.073 -2.472 -0.655 1.00 0.00 C ATOM 696 C GLY A 48 -1.672 -3.406 0.469 1.00 0.00 C ATOM 697 O GLY A 48 -2.259 -3.374 1.551 1.00 0.00 O ATOM 0 H GLY A 48 -1.940 -2.625 -2.741 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -1.320 -1.691 -0.760 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -3.010 -1.979 -0.396 1.00 0.00 H new ATOM 701 N VAL A 49 -0.669 -4.240 0.213 1.00 0.00 N ATOM 702 CA VAL A 49 -0.191 -5.188 1.212 1.00 0.00 C ATOM 703 C VAL A 49 1.319 -5.075 1.399 1.00 0.00 C ATOM 704 O VAL A 49 1.980 -4.281 0.730 1.00 0.00 O ATOM 705 CB VAL A 49 -0.542 -6.637 0.825 1.00 0.00 C ATOM 706 CG1 VAL A 49 -2.046 -6.851 0.864 1.00 0.00 C ATOM 707 CG2 VAL A 49 0.017 -6.970 -0.550 1.00 0.00 C ATOM 0 H VAL A 49 -0.172 -4.278 -0.677 1.00 0.00 H new ATOM 0 HA VAL A 49 -0.690 -4.939 2.148 1.00 0.00 H new ATOM 0 HB VAL A 49 -0.085 -7.310 1.551 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -2.274 -7.880 0.588 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -2.415 -6.655 1.871 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -2.529 -6.171 0.162 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -0.240 -7.997 -0.808 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -0.409 -6.292 -1.290 1.00 0.00 H new ATOM 0 HG23 VAL A 49 1.101 -6.859 -0.539 1.00 0.00 H new ATOM 717 N PHE A 50 1.858 -5.874 2.313 1.00 0.00 N ATOM 718 CA PHE A 50 3.289 -5.864 2.589 1.00 0.00 C ATOM 719 C PHE A 50 3.949 -7.147 2.091 1.00 0.00 C ATOM 720 O PHE A 50 3.322 -8.207 2.053 1.00 0.00 O ATOM 721 CB PHE A 50 3.541 -5.696 4.089 1.00 0.00 C ATOM 722 CG PHE A 50 3.323 -4.294 4.580 1.00 0.00 C ATOM 723 CD1 PHE A 50 4.320 -3.340 4.461 1.00 0.00 C ATOM 724 CD2 PHE A 50 2.118 -3.930 5.163 1.00 0.00 C ATOM 725 CE1 PHE A 50 4.122 -2.049 4.912 1.00 0.00 C ATOM 726 CE2 PHE A 50 1.915 -2.641 5.615 1.00 0.00 C ATOM 727 CZ PHE A 50 2.918 -1.698 5.490 1.00 0.00 C ATOM 0 H PHE A 50 1.325 -6.537 2.876 1.00 0.00 H new ATOM 0 HA PHE A 50 3.729 -5.020 2.058 1.00 0.00 H new ATOM 0 HB2 PHE A 50 2.884 -6.371 4.637 1.00 0.00 H new ATOM 0 HB3 PHE A 50 4.565 -5.996 4.313 1.00 0.00 H new ATOM 0 HD1 PHE A 50 5.264 -3.608 4.010 1.00 0.00 H new ATOM 0 HD2 PHE A 50 1.331 -4.662 5.264 1.00 0.00 H new ATOM 0 HE1 PHE A 50 4.908 -1.315 4.813 1.00 0.00 H new ATOM 0 HE2 PHE A 50 0.972 -2.370 6.066 1.00 0.00 H new ATOM 0 HZ PHE A 50 2.760 -0.690 5.843 1.00 0.00 H new ATOM 737 N LEU A 51 5.217 -7.043 1.709 1.00 0.00 N ATOM 738 CA LEU A 51 5.963 -8.195 1.213 1.00 0.00 C ATOM 739 C LEU A 51 7.433 -8.103 1.608 1.00 0.00 C ATOM 740 O LEU A 51 7.880 -7.089 2.147 1.00 0.00 O ATOM 741 CB LEU A 51 5.838 -8.292 -0.308 1.00 0.00 C ATOM 742 CG LEU A 51 4.417 -8.228 -0.870 1.00 0.00 C ATOM 743 CD1 LEU A 51 4.447 -8.048 -2.380 1.00 0.00 C ATOM 744 CD2 LEU A 51 3.639 -9.481 -0.495 1.00 0.00 C ATOM 0 H LEU A 51 5.750 -6.174 1.733 1.00 0.00 H new ATOM 0 HA LEU A 51 5.540 -9.092 1.665 1.00 0.00 H new ATOM 0 HB2 LEU A 51 6.420 -7.485 -0.753 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.293 -9.228 -0.631 1.00 0.00 H new ATOM 0 HG LEU A 51 3.912 -7.366 -0.433 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.427 -8.005 -2.762 1.00 0.00 H new ATOM 0 HD12 LEU A 51 4.966 -7.122 -2.626 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.970 -8.889 -2.836 1.00 0.00 H new ATOM 0 HD21 LEU A 51 2.630 -9.419 -0.903 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.142 -10.357 -0.903 1.00 0.00 H new ATOM 0 HD23 LEU A 51 3.587 -9.566 0.590 1.00 0.00 H new ATOM 756 N CYS A 52 8.182 -9.167 1.338 1.00 0.00 N ATOM 757 CA CYS A 52 9.602 -9.207 1.663 1.00 0.00 C ATOM 758 C CYS A 52 10.445 -9.359 0.400 1.00 0.00 C ATOM 759 O CYS A 52 10.005 -9.955 -0.584 1.00 0.00 O ATOM 760 CB CYS A 52 9.893 -10.360 2.626 1.00 0.00 C ATOM 761 SG CYS A 52 9.686 -12.014 1.892 1.00 0.00 S ATOM 0 H CYS A 52 7.828 -10.014 0.894 1.00 0.00 H new ATOM 0 HA CYS A 52 9.866 -8.265 2.144 1.00 0.00 H new ATOM 0 HB2 CYS A 52 10.915 -10.263 2.994 1.00 0.00 H new ATOM 0 HB3 CYS A 52 9.234 -10.273 3.490 1.00 0.00 H new ATOM 766 N ILE A 53 11.657 -8.818 0.436 1.00 0.00 N ATOM 767 CA ILE A 53 12.563 -8.894 -0.703 1.00 0.00 C ATOM 768 C ILE A 53 12.380 -10.204 -1.464 1.00 0.00 C ATOM 769 O ILE A 53 12.413 -10.229 -2.694 1.00 0.00 O ATOM 770 CB ILE A 53 14.034 -8.770 -0.265 1.00 0.00 C ATOM 771 CG1 ILE A 53 14.964 -8.959 -1.465 1.00 0.00 C ATOM 772 CG2 ILE A 53 14.350 -9.785 0.823 1.00 0.00 C ATOM 773 CD1 ILE A 53 15.045 -7.746 -2.364 1.00 0.00 C ATOM 0 H ILE A 53 12.035 -8.321 1.243 1.00 0.00 H new ATOM 0 HA ILE A 53 12.317 -8.057 -1.357 1.00 0.00 H new ATOM 0 HB ILE A 53 14.194 -7.771 0.140 1.00 0.00 H new ATOM 0 HG12 ILE A 53 15.964 -9.201 -1.105 1.00 0.00 H new ATOM 0 HG13 ILE A 53 14.620 -9.812 -2.050 1.00 0.00 H new ATOM 0 HG21 ILE A 53 15.393 -9.685 1.122 1.00 0.00 H new ATOM 0 HG22 ILE A 53 13.707 -9.607 1.685 1.00 0.00 H new ATOM 0 HG23 ILE A 53 14.177 -10.792 0.443 1.00 0.00 H new ATOM 0 HD11 ILE A 53 15.722 -7.952 -3.193 1.00 0.00 H new ATOM 0 HD12 ILE A 53 14.054 -7.515 -2.754 1.00 0.00 H new ATOM 0 HD13 ILE A 53 15.418 -6.895 -1.794 1.00 0.00 H new ATOM 785 N ASP A 54 12.185 -11.289 -0.722 1.00 0.00 N ATOM 786 CA ASP A 54 11.995 -12.603 -1.325 1.00 0.00 C ATOM 787 C ASP A 54 10.716 -12.638 -2.156 1.00 0.00 C ATOM 788 O ASP A 54 10.761 -12.673 -3.386 1.00 0.00 O ATOM 789 CB ASP A 54 11.944 -13.682 -0.244 1.00 0.00 C ATOM 790 CG ASP A 54 12.387 -15.038 -0.756 1.00 0.00 C ATOM 791 OD1 ASP A 54 13.605 -15.315 -0.728 1.00 0.00 O ATOM 792 OD2 ASP A 54 11.517 -15.823 -1.187 1.00 0.00 O ATOM 0 H ASP A 54 12.154 -11.284 0.298 1.00 0.00 H new ATOM 0 HA ASP A 54 12.842 -12.800 -1.983 1.00 0.00 H new ATOM 0 HB2 ASP A 54 12.581 -13.386 0.590 1.00 0.00 H new ATOM 0 HB3 ASP A 54 10.927 -13.757 0.142 1.00 0.00 H new ATOM 797 N CYS A 55 9.573 -12.630 -1.477 1.00 0.00 N ATOM 798 CA CYS A 55 8.281 -12.663 -2.150 1.00 0.00 C ATOM 799 C CYS A 55 8.156 -11.511 -3.143 1.00 0.00 C ATOM 800 O CYS A 55 7.912 -11.726 -4.331 1.00 0.00 O ATOM 801 CB CYS A 55 7.147 -12.593 -1.125 1.00 0.00 C ATOM 802 SG CYS A 55 7.132 -13.973 0.064 1.00 0.00 S ATOM 0 H CYS A 55 9.516 -12.601 -0.459 1.00 0.00 H new ATOM 0 HA CYS A 55 8.208 -13.602 -2.699 1.00 0.00 H new ATOM 0 HB2 CYS A 55 7.226 -11.655 -0.575 1.00 0.00 H new ATOM 0 HB3 CYS A 55 6.194 -12.573 -1.654 1.00 0.00 H new ATOM 807 N SER A 56 8.326 -10.289 -2.649 1.00 0.00 N ATOM 808 CA SER A 56 8.229 -9.104 -3.491 1.00 0.00 C ATOM 809 C SER A 56 8.680 -9.411 -4.916 1.00 0.00 C ATOM 810 O SER A 56 8.042 -8.998 -5.883 1.00 0.00 O ATOM 811 CB SER A 56 9.075 -7.969 -2.910 1.00 0.00 C ATOM 812 OG SER A 56 10.423 -8.370 -2.744 1.00 0.00 O ATOM 0 H SER A 56 8.532 -10.094 -1.669 1.00 0.00 H new ATOM 0 HA SER A 56 7.185 -8.793 -3.518 1.00 0.00 H new ATOM 0 HB2 SER A 56 9.029 -7.103 -3.570 1.00 0.00 H new ATOM 0 HB3 SER A 56 8.664 -7.660 -1.949 1.00 0.00 H new ATOM 0 HG SER A 56 11.015 -7.701 -3.146 1.00 0.00 H new ATOM 818 N GLY A 57 9.786 -10.138 -5.035 1.00 0.00 N ATOM 819 CA GLY A 57 10.304 -10.490 -6.344 1.00 0.00 C ATOM 820 C GLY A 57 9.265 -11.164 -7.218 1.00 0.00 C ATOM 821 O GLY A 57 9.078 -10.786 -8.375 1.00 0.00 O ATOM 0 H GLY A 57 10.333 -10.490 -4.249 1.00 0.00 H new ATOM 0 HA2 GLY A 57 10.665 -9.590 -6.842 1.00 0.00 H new ATOM 0 HA3 GLY A 57 11.160 -11.154 -6.226 1.00 0.00 H new ATOM 825 N SER A 58 8.590 -12.165 -6.665 1.00 0.00 N ATOM 826 CA SER A 58 7.568 -12.898 -7.404 1.00 0.00 C ATOM 827 C SER A 58 6.609 -11.938 -8.102 1.00 0.00 C ATOM 828 O SER A 58 6.244 -12.140 -9.261 1.00 0.00 O ATOM 829 CB SER A 58 6.790 -13.819 -6.463 1.00 0.00 C ATOM 830 OG SER A 58 7.399 -15.096 -6.381 1.00 0.00 O ATOM 0 H SER A 58 8.732 -12.488 -5.708 1.00 0.00 H new ATOM 0 HA SER A 58 8.066 -13.502 -8.162 1.00 0.00 H new ATOM 0 HB2 SER A 58 6.740 -13.372 -5.470 1.00 0.00 H new ATOM 0 HB3 SER A 58 5.764 -13.924 -6.817 1.00 0.00 H new ATOM 0 HG SER A 58 6.884 -15.666 -5.772 1.00 0.00 H new ATOM 836 N HIS A 59 6.206 -10.891 -7.389 1.00 0.00 N ATOM 837 CA HIS A 59 5.289 -9.898 -7.939 1.00 0.00 C ATOM 838 C HIS A 59 5.949 -9.121 -9.074 1.00 0.00 C ATOM 839 O HIS A 59 5.345 -8.906 -10.125 1.00 0.00 O ATOM 840 CB HIS A 59 4.831 -8.935 -6.844 1.00 0.00 C ATOM 841 CG HIS A 59 3.736 -9.485 -5.982 1.00 0.00 C ATOM 842 ND1 HIS A 59 2.456 -8.971 -5.973 1.00 0.00 N ATOM 843 CD2 HIS A 59 3.734 -10.511 -5.100 1.00 0.00 C ATOM 844 CE1 HIS A 59 1.716 -9.656 -5.120 1.00 0.00 C ATOM 845 NE2 HIS A 59 2.468 -10.596 -4.578 1.00 0.00 N ATOM 0 H HIS A 59 6.500 -10.708 -6.429 1.00 0.00 H new ATOM 0 HA HIS A 59 4.420 -10.422 -8.338 1.00 0.00 H new ATOM 0 HB2 HIS A 59 5.684 -8.681 -6.215 1.00 0.00 H new ATOM 0 HB3 HIS A 59 4.488 -8.009 -7.306 1.00 0.00 H new ATOM 0 HD2 HIS A 59 4.573 -11.145 -4.853 1.00 0.00 H new ATOM 0 HE1 HIS A 59 0.673 -9.478 -4.903 1.00 0.00 H new ATOM 0 HE2 HIS A 59 2.158 -11.276 -3.883 1.00 0.00 H new ATOM 853 N ARG A 60 7.191 -8.701 -8.854 1.00 0.00 N ATOM 854 CA ARG A 60 7.931 -7.946 -9.857 1.00 0.00 C ATOM 855 C ARG A 60 7.881 -8.647 -11.212 1.00 0.00 C ATOM 856 O ARG A 60 7.655 -8.012 -12.242 1.00 0.00 O ATOM 857 CB ARG A 60 9.385 -7.763 -9.419 1.00 0.00 C ATOM 858 CG ARG A 60 9.533 -7.089 -8.064 1.00 0.00 C ATOM 859 CD ARG A 60 10.991 -6.802 -7.741 1.00 0.00 C ATOM 860 NE ARG A 60 11.820 -8.000 -7.846 1.00 0.00 N ATOM 861 CZ ARG A 60 12.969 -8.157 -7.197 1.00 0.00 C ATOM 862 NH1 ARG A 60 13.421 -7.198 -6.401 1.00 0.00 N ATOM 863 NH2 ARG A 60 13.668 -9.276 -7.344 1.00 0.00 N ATOM 0 H ARG A 60 7.705 -8.871 -7.990 1.00 0.00 H new ATOM 0 HA ARG A 60 7.463 -6.967 -9.956 1.00 0.00 H new ATOM 0 HB2 ARG A 60 9.871 -8.738 -9.385 1.00 0.00 H new ATOM 0 HB3 ARG A 60 9.910 -7.171 -10.169 1.00 0.00 H new ATOM 0 HG2 ARG A 60 8.967 -6.157 -8.056 1.00 0.00 H new ATOM 0 HG3 ARG A 60 9.107 -7.727 -7.290 1.00 0.00 H new ATOM 0 HD2 ARG A 60 11.369 -6.038 -8.420 1.00 0.00 H new ATOM 0 HD3 ARG A 60 11.066 -6.396 -6.732 1.00 0.00 H new ATOM 0 HE ARG A 60 11.500 -8.757 -8.450 1.00 0.00 H new ATOM 0 HH11 ARG A 60 12.887 -6.337 -6.285 1.00 0.00 H new ATOM 0 HH12 ARG A 60 14.303 -7.321 -5.904 1.00 0.00 H new ATOM 0 HH21 ARG A 60 13.323 -10.016 -7.955 1.00 0.00 H new ATOM 0 HH22 ARG A 60 14.550 -9.396 -6.846 1.00 0.00 H new ATOM 877 N SER A 61 8.094 -9.959 -11.202 1.00 0.00 N ATOM 878 CA SER A 61 8.078 -10.745 -12.429 1.00 0.00 C ATOM 879 C SER A 61 6.743 -10.593 -13.154 1.00 0.00 C ATOM 880 O SER A 61 6.703 -10.367 -14.364 1.00 0.00 O ATOM 881 CB SER A 61 8.337 -12.221 -12.118 1.00 0.00 C ATOM 882 OG SER A 61 8.747 -12.922 -13.279 1.00 0.00 O ATOM 0 H SER A 61 8.280 -10.500 -10.357 1.00 0.00 H new ATOM 0 HA SER A 61 8.870 -10.374 -13.080 1.00 0.00 H new ATOM 0 HB2 SER A 61 9.105 -12.305 -11.349 1.00 0.00 H new ATOM 0 HB3 SER A 61 7.432 -12.675 -11.716 1.00 0.00 H new ATOM 0 HG SER A 61 8.908 -13.862 -13.054 1.00 0.00 H new ATOM 888 N LEU A 62 5.653 -10.719 -12.405 1.00 0.00 N ATOM 889 CA LEU A 62 4.316 -10.597 -12.975 1.00 0.00 C ATOM 890 C LEU A 62 4.224 -9.380 -13.891 1.00 0.00 C ATOM 891 O LEU A 62 3.728 -9.470 -15.012 1.00 0.00 O ATOM 892 CB LEU A 62 3.273 -10.491 -11.861 1.00 0.00 C ATOM 893 CG LEU A 62 3.137 -11.713 -10.952 1.00 0.00 C ATOM 894 CD1 LEU A 62 2.299 -11.377 -9.729 1.00 0.00 C ATOM 895 CD2 LEU A 62 2.526 -12.880 -11.714 1.00 0.00 C ATOM 0 H LEU A 62 5.669 -10.905 -11.402 1.00 0.00 H new ATOM 0 HA LEU A 62 4.117 -11.490 -13.567 1.00 0.00 H new ATOM 0 HB2 LEU A 62 3.518 -9.628 -11.242 1.00 0.00 H new ATOM 0 HB3 LEU A 62 2.303 -10.292 -12.316 1.00 0.00 H new ATOM 0 HG LEU A 62 4.132 -12.005 -10.617 1.00 0.00 H new ATOM 0 HD11 LEU A 62 2.213 -12.258 -9.094 1.00 0.00 H new ATOM 0 HD12 LEU A 62 2.777 -10.572 -9.170 1.00 0.00 H new ATOM 0 HD13 LEU A 62 1.305 -11.059 -10.045 1.00 0.00 H new ATOM 0 HD21 LEU A 62 2.437 -13.741 -11.051 1.00 0.00 H new ATOM 0 HD22 LEU A 62 1.538 -12.599 -12.079 1.00 0.00 H new ATOM 0 HD23 LEU A 62 3.165 -13.137 -12.559 1.00 0.00 H new ATOM 907 N GLY A 63 4.708 -8.241 -13.403 1.00 0.00 N ATOM 908 CA GLY A 63 4.672 -7.023 -14.191 1.00 0.00 C ATOM 909 C GLY A 63 4.164 -5.834 -13.398 1.00 0.00 C ATOM 910 O GLY A 63 3.116 -5.910 -12.755 1.00 0.00 O ATOM 0 H GLY A 63 5.124 -8.141 -12.477 1.00 0.00 H new ATOM 0 HA2 GLY A 63 5.673 -6.806 -14.565 1.00 0.00 H new ATOM 0 HA3 GLY A 63 4.033 -7.175 -15.061 1.00 0.00 H new ATOM 914 N VAL A 64 4.907 -4.733 -13.442 1.00 0.00 N ATOM 915 CA VAL A 64 4.526 -3.525 -12.721 1.00 0.00 C ATOM 916 C VAL A 64 3.036 -3.240 -12.875 1.00 0.00 C ATOM 917 O VAL A 64 2.422 -2.612 -12.012 1.00 0.00 O ATOM 918 CB VAL A 64 5.324 -2.303 -13.215 1.00 0.00 C ATOM 919 CG1 VAL A 64 6.819 -2.547 -13.070 1.00 0.00 C ATOM 920 CG2 VAL A 64 4.966 -1.980 -14.658 1.00 0.00 C ATOM 0 H VAL A 64 5.776 -4.653 -13.969 1.00 0.00 H new ATOM 0 HA VAL A 64 4.753 -3.699 -11.669 1.00 0.00 H new ATOM 0 HB VAL A 64 5.058 -1.444 -12.598 1.00 0.00 H new ATOM 0 HG11 VAL A 64 7.366 -1.673 -13.424 1.00 0.00 H new ATOM 0 HG12 VAL A 64 7.059 -2.725 -12.022 1.00 0.00 H new ATOM 0 HG13 VAL A 64 7.105 -3.418 -13.660 1.00 0.00 H new ATOM 0 HG21 VAL A 64 5.539 -1.114 -14.990 1.00 0.00 H new ATOM 0 HG22 VAL A 64 5.201 -2.835 -15.291 1.00 0.00 H new ATOM 0 HG23 VAL A 64 3.901 -1.759 -14.728 1.00 0.00 H new ATOM 930 N HIS A 65 2.461 -3.707 -13.978 1.00 0.00 N ATOM 931 CA HIS A 65 1.041 -3.504 -14.244 1.00 0.00 C ATOM 932 C HIS A 65 0.189 -4.438 -13.390 1.00 0.00 C ATOM 933 O HIS A 65 -0.861 -4.045 -12.880 1.00 0.00 O ATOM 934 CB HIS A 65 0.740 -3.733 -15.726 1.00 0.00 C ATOM 935 CG HIS A 65 1.236 -5.050 -16.241 1.00 0.00 C ATOM 936 ND1 HIS A 65 2.536 -5.257 -16.650 1.00 0.00 N ATOM 937 CD2 HIS A 65 0.597 -6.231 -16.410 1.00 0.00 C ATOM 938 CE1 HIS A 65 2.676 -6.507 -17.051 1.00 0.00 C ATOM 939 NE2 HIS A 65 1.515 -7.121 -16.914 1.00 0.00 N ATOM 0 H HIS A 65 2.956 -4.228 -14.702 1.00 0.00 H new ATOM 0 HA HIS A 65 0.792 -2.475 -13.985 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -0.337 -3.673 -15.883 1.00 0.00 H new ATOM 0 HB3 HIS A 65 1.192 -2.931 -16.309 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -0.440 -6.436 -16.190 1.00 0.00 H new ATOM 0 HE1 HIS A 65 3.585 -6.952 -17.427 1.00 0.00 H new ATOM 0 HE2 HIS A 65 1.330 -8.097 -17.145 1.00 0.00 H new ATOM 947 N LEU A 66 0.648 -5.675 -13.237 1.00 0.00 N ATOM 948 CA LEU A 66 -0.073 -6.665 -12.445 1.00 0.00 C ATOM 949 C LEU A 66 0.052 -6.366 -10.954 1.00 0.00 C ATOM 950 O LEU A 66 -0.921 -6.467 -10.206 1.00 0.00 O ATOM 951 CB LEU A 66 0.459 -8.069 -12.740 1.00 0.00 C ATOM 952 CG LEU A 66 -0.557 -9.207 -12.641 1.00 0.00 C ATOM 953 CD1 LEU A 66 -0.051 -10.442 -13.371 1.00 0.00 C ATOM 954 CD2 LEU A 66 -0.854 -9.532 -11.184 1.00 0.00 C ATOM 0 H LEU A 66 1.516 -6.016 -13.651 1.00 0.00 H new ATOM 0 HA LEU A 66 -1.127 -6.616 -12.720 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.881 -8.072 -13.745 1.00 0.00 H new ATOM 0 HB3 LEU A 66 1.277 -8.278 -12.050 1.00 0.00 H new ATOM 0 HG LEU A 66 -1.482 -8.883 -13.117 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -0.788 -11.241 -13.289 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.110 -10.203 -14.422 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.889 -10.768 -12.926 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -1.579 -10.344 -11.133 1.00 0.00 H new ATOM 0 HD22 LEU A 66 0.066 -9.835 -10.684 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.262 -8.650 -10.690 1.00 0.00 H new ATOM 966 N SER A 67 1.256 -5.995 -10.529 1.00 0.00 N ATOM 967 CA SER A 67 1.509 -5.682 -9.127 1.00 0.00 C ATOM 968 C SER A 67 2.719 -4.763 -8.986 1.00 0.00 C ATOM 969 O SER A 67 3.861 -5.196 -9.127 1.00 0.00 O ATOM 970 CB SER A 67 1.734 -6.967 -8.329 1.00 0.00 C ATOM 971 OG SER A 67 1.229 -6.842 -7.010 1.00 0.00 O ATOM 0 H SER A 67 2.071 -5.904 -11.135 1.00 0.00 H new ATOM 0 HA SER A 67 0.634 -5.166 -8.731 1.00 0.00 H new ATOM 0 HB2 SER A 67 1.245 -7.802 -8.832 1.00 0.00 H new ATOM 0 HB3 SER A 67 2.799 -7.196 -8.294 1.00 0.00 H new ATOM 0 HG SER A 67 1.844 -7.275 -6.382 1.00 0.00 H new ATOM 977 N PHE A 68 2.457 -3.490 -8.706 1.00 0.00 N ATOM 978 CA PHE A 68 3.523 -2.509 -8.546 1.00 0.00 C ATOM 979 C PHE A 68 4.143 -2.601 -7.155 1.00 0.00 C ATOM 980 O PHE A 68 3.437 -2.571 -6.146 1.00 0.00 O ATOM 981 CB PHE A 68 2.985 -1.096 -8.784 1.00 0.00 C ATOM 982 CG PHE A 68 4.037 -0.120 -9.226 1.00 0.00 C ATOM 983 CD1 PHE A 68 4.353 0.018 -10.568 1.00 0.00 C ATOM 984 CD2 PHE A 68 4.711 0.660 -8.299 1.00 0.00 C ATOM 985 CE1 PHE A 68 5.321 0.915 -10.978 1.00 0.00 C ATOM 986 CE2 PHE A 68 5.679 1.559 -8.704 1.00 0.00 C ATOM 987 CZ PHE A 68 5.985 1.687 -10.045 1.00 0.00 C ATOM 0 H PHE A 68 1.516 -3.115 -8.585 1.00 0.00 H new ATOM 0 HA PHE A 68 4.295 -2.726 -9.284 1.00 0.00 H new ATOM 0 HB2 PHE A 68 2.199 -1.137 -9.538 1.00 0.00 H new ATOM 0 HB3 PHE A 68 2.526 -0.731 -7.865 1.00 0.00 H new ATOM 0 HD1 PHE A 68 3.837 -0.583 -11.302 1.00 0.00 H new ATOM 0 HD2 PHE A 68 4.477 0.564 -7.249 1.00 0.00 H new ATOM 0 HE1 PHE A 68 5.558 1.012 -12.027 1.00 0.00 H new ATOM 0 HE2 PHE A 68 6.196 2.162 -7.972 1.00 0.00 H new ATOM 0 HZ PHE A 68 6.742 2.389 -10.363 1.00 0.00 H new ATOM 997 N ILE A 69 5.467 -2.712 -7.109 1.00 0.00 N ATOM 998 CA ILE A 69 6.181 -2.809 -5.843 1.00 0.00 C ATOM 999 C ILE A 69 6.956 -1.528 -5.550 1.00 0.00 C ATOM 1000 O ILE A 69 7.430 -0.855 -6.465 1.00 0.00 O ATOM 1001 CB ILE A 69 7.159 -4.000 -5.837 1.00 0.00 C ATOM 1002 CG1 ILE A 69 6.637 -5.120 -6.738 1.00 0.00 C ATOM 1003 CG2 ILE A 69 7.367 -4.507 -4.418 1.00 0.00 C ATOM 1004 CD1 ILE A 69 5.422 -5.828 -6.181 1.00 0.00 C ATOM 0 H ILE A 69 6.066 -2.737 -7.934 1.00 0.00 H new ATOM 0 HA ILE A 69 5.430 -2.963 -5.068 1.00 0.00 H new ATOM 0 HB ILE A 69 8.120 -3.665 -6.226 1.00 0.00 H new ATOM 0 HG12 ILE A 69 6.389 -4.704 -7.714 1.00 0.00 H new ATOM 0 HG13 ILE A 69 7.432 -5.849 -6.895 1.00 0.00 H new ATOM 0 HG21 ILE A 69 8.060 -5.348 -4.430 1.00 0.00 H new ATOM 0 HG22 ILE A 69 7.778 -3.707 -3.802 1.00 0.00 H new ATOM 0 HG23 ILE A 69 6.412 -4.830 -4.003 1.00 0.00 H new ATOM 0 HD11 ILE A 69 5.107 -6.609 -6.873 1.00 0.00 H new ATOM 0 HD12 ILE A 69 5.671 -6.274 -5.218 1.00 0.00 H new ATOM 0 HD13 ILE A 69 4.611 -5.111 -6.050 1.00 0.00 H new ATOM 1016 N ARG A 70 7.082 -1.200 -4.269 1.00 0.00 N ATOM 1017 CA ARG A 70 7.801 0.000 -3.856 1.00 0.00 C ATOM 1018 C ARG A 70 8.287 -0.126 -2.415 1.00 0.00 C ATOM 1019 O ARG A 70 7.502 -0.395 -1.505 1.00 0.00 O ATOM 1020 CB ARG A 70 6.903 1.231 -3.996 1.00 0.00 C ATOM 1021 CG ARG A 70 6.518 1.543 -5.432 1.00 0.00 C ATOM 1022 CD ARG A 70 6.174 3.014 -5.611 1.00 0.00 C ATOM 1023 NE ARG A 70 7.335 3.801 -6.021 1.00 0.00 N ATOM 1024 CZ ARG A 70 7.438 5.111 -5.833 1.00 0.00 C ATOM 1025 NH1 ARG A 70 6.455 5.779 -5.243 1.00 0.00 N ATOM 1026 NH2 ARG A 70 8.525 5.757 -6.234 1.00 0.00 N ATOM 0 H ARG A 70 6.696 -1.747 -3.499 1.00 0.00 H new ATOM 0 HA ARG A 70 8.669 0.115 -4.505 1.00 0.00 H new ATOM 0 HB2 ARG A 70 5.996 1.077 -3.411 1.00 0.00 H new ATOM 0 HB3 ARG A 70 7.415 2.094 -3.570 1.00 0.00 H new ATOM 0 HG2 ARG A 70 7.341 1.277 -6.096 1.00 0.00 H new ATOM 0 HG3 ARG A 70 5.664 0.931 -5.722 1.00 0.00 H new ATOM 0 HD2 ARG A 70 5.386 3.114 -6.358 1.00 0.00 H new ATOM 0 HD3 ARG A 70 5.779 3.411 -4.676 1.00 0.00 H new ATOM 0 HE ARG A 70 8.109 3.317 -6.477 1.00 0.00 H new ATOM 0 HH11 ARG A 70 5.618 5.286 -4.933 1.00 0.00 H new ATOM 0 HH12 ARG A 70 6.537 6.786 -5.100 1.00 0.00 H new ATOM 0 HH21 ARG A 70 9.283 5.247 -6.688 1.00 0.00 H new ATOM 0 HH22 ARG A 70 8.603 6.764 -6.089 1.00 0.00 H new ATOM 1040 N SER A 71 9.587 0.068 -2.215 1.00 0.00 N ATOM 1041 CA SER A 71 10.178 -0.029 -0.886 1.00 0.00 C ATOM 1042 C SER A 71 9.640 1.067 0.030 1.00 0.00 C ATOM 1043 O SER A 71 9.093 2.067 -0.435 1.00 0.00 O ATOM 1044 CB SER A 71 11.702 0.068 -0.974 1.00 0.00 C ATOM 1045 OG SER A 71 12.285 0.142 0.315 1.00 0.00 O ATOM 0 H SER A 71 10.250 0.293 -2.956 1.00 0.00 H new ATOM 0 HA SER A 71 9.906 -0.997 -0.465 1.00 0.00 H new ATOM 0 HB2 SER A 71 12.094 -0.800 -1.504 1.00 0.00 H new ATOM 0 HB3 SER A 71 11.980 0.948 -1.553 1.00 0.00 H new ATOM 0 HG SER A 71 13.260 0.201 0.230 1.00 0.00 H new ATOM 1051 N THR A 72 9.801 0.871 1.335 1.00 0.00 N ATOM 1052 CA THR A 72 9.331 1.840 2.317 1.00 0.00 C ATOM 1053 C THR A 72 10.493 2.633 2.906 1.00 0.00 C ATOM 1054 O THR A 72 10.349 3.810 3.233 1.00 0.00 O ATOM 1055 CB THR A 72 8.561 1.153 3.461 1.00 0.00 C ATOM 1056 OG1 THR A 72 9.334 0.071 3.992 1.00 0.00 O ATOM 1057 CG2 THR A 72 7.218 0.630 2.971 1.00 0.00 C ATOM 0 H THR A 72 10.253 0.050 1.736 1.00 0.00 H new ATOM 0 HA THR A 72 8.659 2.520 1.794 1.00 0.00 H new ATOM 0 HB THR A 72 8.383 1.890 4.244 1.00 0.00 H new ATOM 0 HG1 THR A 72 9.041 -0.771 3.585 1.00 0.00 H new ATOM 0 HG21 THR A 72 6.692 0.149 3.796 1.00 0.00 H new ATOM 0 HG22 THR A 72 6.620 1.460 2.594 1.00 0.00 H new ATOM 0 HG23 THR A 72 7.379 -0.094 2.172 1.00 0.00 H new ATOM 1065 N GLU A 73 11.642 1.978 3.040 1.00 0.00 N ATOM 1066 CA GLU A 73 12.828 2.624 3.590 1.00 0.00 C ATOM 1067 C GLU A 73 13.572 3.407 2.511 1.00 0.00 C ATOM 1068 O GLU A 73 13.706 4.629 2.595 1.00 0.00 O ATOM 1069 CB GLU A 73 13.759 1.582 4.213 1.00 0.00 C ATOM 1070 CG GLU A 73 13.031 0.511 5.006 1.00 0.00 C ATOM 1071 CD GLU A 73 13.849 -0.011 6.171 1.00 0.00 C ATOM 1072 OE1 GLU A 73 14.487 0.811 6.862 1.00 0.00 O ATOM 1073 OE2 GLU A 73 13.853 -1.240 6.391 1.00 0.00 O ATOM 0 H GLU A 73 11.777 1.002 2.776 1.00 0.00 H new ATOM 0 HA GLU A 73 12.505 3.322 4.363 1.00 0.00 H new ATOM 0 HB2 GLU A 73 14.338 1.106 3.422 1.00 0.00 H new ATOM 0 HB3 GLU A 73 14.469 2.087 4.868 1.00 0.00 H new ATOM 0 HG2 GLU A 73 12.091 0.917 5.380 1.00 0.00 H new ATOM 0 HG3 GLU A 73 12.779 -0.317 4.344 1.00 0.00 H new ATOM 1080 N LEU A 74 14.054 2.694 1.498 1.00 0.00 N ATOM 1081 CA LEU A 74 14.785 3.321 0.403 1.00 0.00 C ATOM 1082 C LEU A 74 13.878 4.254 -0.395 1.00 0.00 C ATOM 1083 O LEU A 74 14.040 5.473 -0.359 1.00 0.00 O ATOM 1084 CB LEU A 74 15.375 2.253 -0.519 1.00 0.00 C ATOM 1085 CG LEU A 74 16.144 1.123 0.167 1.00 0.00 C ATOM 1086 CD1 LEU A 74 16.289 -0.068 -0.767 1.00 0.00 C ATOM 1087 CD2 LEU A 74 17.508 1.611 0.629 1.00 0.00 C ATOM 0 H LEU A 74 13.952 1.683 1.413 1.00 0.00 H new ATOM 0 HA LEU A 74 15.595 3.911 0.831 1.00 0.00 H new ATOM 0 HB2 LEU A 74 14.563 1.813 -1.098 1.00 0.00 H new ATOM 0 HB3 LEU A 74 16.043 2.742 -1.227 1.00 0.00 H new ATOM 0 HG LEU A 74 15.579 0.804 1.043 1.00 0.00 H new ATOM 0 HD11 LEU A 74 16.839 -0.862 -0.262 1.00 0.00 H new ATOM 0 HD12 LEU A 74 15.301 -0.433 -1.048 1.00 0.00 H new ATOM 0 HD13 LEU A 74 16.831 0.236 -1.662 1.00 0.00 H new ATOM 0 HD21 LEU A 74 18.041 0.794 1.115 1.00 0.00 H new ATOM 0 HD22 LEU A 74 18.081 1.958 -0.231 1.00 0.00 H new ATOM 0 HD23 LEU A 74 17.381 2.432 1.335 1.00 0.00 H new ATOM 1099 N ASP A 75 12.923 3.670 -1.111 1.00 0.00 N ATOM 1100 CA ASP A 75 11.987 4.449 -1.914 1.00 0.00 C ATOM 1101 C ASP A 75 11.276 5.493 -1.061 1.00 0.00 C ATOM 1102 O ASP A 75 10.572 5.157 -0.108 1.00 0.00 O ATOM 1103 CB ASP A 75 10.961 3.527 -2.576 1.00 0.00 C ATOM 1104 CG ASP A 75 11.548 2.740 -3.730 1.00 0.00 C ATOM 1105 OD1 ASP A 75 12.321 3.326 -4.516 1.00 0.00 O ATOM 1106 OD2 ASP A 75 11.235 1.537 -3.848 1.00 0.00 O ATOM 0 H ASP A 75 12.777 2.661 -1.152 1.00 0.00 H new ATOM 0 HA ASP A 75 12.554 4.966 -2.689 1.00 0.00 H new ATOM 0 HB2 ASP A 75 10.566 2.835 -1.832 1.00 0.00 H new ATOM 0 HB3 ASP A 75 10.121 4.122 -2.936 1.00 0.00 H new ATOM 1111 N SER A 76 11.465 6.762 -1.408 1.00 0.00 N ATOM 1112 CA SER A 76 10.845 7.858 -0.670 1.00 0.00 C ATOM 1113 C SER A 76 10.145 8.825 -1.620 1.00 0.00 C ATOM 1114 O SER A 76 10.121 10.032 -1.387 1.00 0.00 O ATOM 1115 CB SER A 76 11.896 8.604 0.154 1.00 0.00 C ATOM 1116 OG SER A 76 12.732 7.699 0.855 1.00 0.00 O ATOM 0 H SER A 76 12.042 7.057 -2.195 1.00 0.00 H new ATOM 0 HA SER A 76 10.099 7.435 0.003 1.00 0.00 H new ATOM 0 HB2 SER A 76 12.501 9.229 -0.503 1.00 0.00 H new ATOM 0 HB3 SER A 76 11.402 9.270 0.861 1.00 0.00 H new ATOM 0 HG SER A 76 13.193 7.117 0.215 1.00 0.00 H new ATOM 1122 N ASN A 77 9.577 8.283 -2.692 1.00 0.00 N ATOM 1123 CA ASN A 77 8.875 9.097 -3.679 1.00 0.00 C ATOM 1124 C ASN A 77 7.441 8.612 -3.865 1.00 0.00 C ATOM 1125 O ASN A 77 6.917 8.605 -4.978 1.00 0.00 O ATOM 1126 CB ASN A 77 9.615 9.063 -5.018 1.00 0.00 C ATOM 1127 CG ASN A 77 10.945 9.789 -4.962 1.00 0.00 C ATOM 1128 OD1 ASN A 77 11.004 11.011 -5.093 1.00 0.00 O ATOM 1129 ND2 ASN A 77 12.022 9.036 -4.767 1.00 0.00 N ATOM 0 H ASN A 77 9.589 7.284 -2.900 1.00 0.00 H new ATOM 0 HA ASN A 77 8.847 10.123 -3.313 1.00 0.00 H new ATOM 0 HB2 ASN A 77 9.782 8.027 -5.312 1.00 0.00 H new ATOM 0 HB3 ASN A 77 8.989 9.515 -5.787 1.00 0.00 H new ATOM 0 HD21 ASN A 77 12.945 9.468 -4.721 1.00 0.00 H new ATOM 0 HD22 ASN A 77 11.926 8.026 -4.664 1.00 0.00 H new ATOM 1136 N TRP A 78 6.812 8.209 -2.766 1.00 0.00 N ATOM 1137 CA TRP A 78 5.438 7.722 -2.808 1.00 0.00 C ATOM 1138 C TRP A 78 4.460 8.871 -3.028 1.00 0.00 C ATOM 1139 O TRP A 78 4.650 9.969 -2.503 1.00 0.00 O ATOM 1140 CB TRP A 78 5.096 6.987 -1.512 1.00 0.00 C ATOM 1141 CG TRP A 78 5.604 5.577 -1.476 1.00 0.00 C ATOM 1142 CD1 TRP A 78 6.907 5.174 -1.551 1.00 0.00 C ATOM 1143 CD2 TRP A 78 4.820 4.385 -1.359 1.00 0.00 C ATOM 1144 NE1 TRP A 78 6.978 3.803 -1.487 1.00 0.00 N ATOM 1145 CE2 TRP A 78 5.712 3.296 -1.369 1.00 0.00 C ATOM 1146 CE3 TRP A 78 3.449 4.133 -1.245 1.00 0.00 C ATOM 1147 CZ2 TRP A 78 5.276 1.977 -1.269 1.00 0.00 C ATOM 1148 CZ3 TRP A 78 3.019 2.824 -1.147 1.00 0.00 C ATOM 1149 CH2 TRP A 78 3.930 1.759 -1.159 1.00 0.00 C ATOM 0 H TRP A 78 7.231 8.210 -1.836 1.00 0.00 H new ATOM 0 HA TRP A 78 5.350 7.029 -3.645 1.00 0.00 H new ATOM 0 HB2 TRP A 78 5.514 7.538 -0.669 1.00 0.00 H new ATOM 0 HB3 TRP A 78 4.014 6.979 -1.382 1.00 0.00 H new ATOM 0 HD1 TRP A 78 7.756 5.835 -1.646 1.00 0.00 H new ATOM 0 HE1 TRP A 78 7.836 3.252 -1.522 1.00 0.00 H new ATOM 0 HE3 TRP A 78 2.739 4.947 -1.234 1.00 0.00 H new ATOM 0 HZ2 TRP A 78 5.976 1.155 -1.278 1.00 0.00 H new ATOM 0 HZ3 TRP A 78 1.963 2.618 -1.060 1.00 0.00 H new ATOM 0 HH2 TRP A 78 3.562 0.747 -1.080 1.00 0.00 H new ATOM 1160 N SER A 79 3.415 8.612 -3.808 1.00 0.00 N ATOM 1161 CA SER A 79 2.409 9.626 -4.100 1.00 0.00 C ATOM 1162 C SER A 79 1.308 9.621 -3.043 1.00 0.00 C ATOM 1163 O SER A 79 1.003 8.583 -2.455 1.00 0.00 O ATOM 1164 CB SER A 79 1.804 9.391 -5.484 1.00 0.00 C ATOM 1165 OG SER A 79 1.409 10.613 -6.083 1.00 0.00 O ATOM 0 H SER A 79 3.243 7.708 -4.249 1.00 0.00 H new ATOM 0 HA SER A 79 2.897 10.600 -4.086 1.00 0.00 H new ATOM 0 HB2 SER A 79 2.531 8.888 -6.122 1.00 0.00 H new ATOM 0 HB3 SER A 79 0.942 8.729 -5.400 1.00 0.00 H new ATOM 0 HG SER A 79 1.027 10.435 -6.968 1.00 0.00 H new ATOM 1171 N TRP A 80 0.718 10.787 -2.808 1.00 0.00 N ATOM 1172 CA TRP A 80 -0.350 10.917 -1.821 1.00 0.00 C ATOM 1173 C TRP A 80 -1.447 9.887 -2.068 1.00 0.00 C ATOM 1174 O TRP A 80 -2.032 9.352 -1.125 1.00 0.00 O ATOM 1175 CB TRP A 80 -0.939 12.328 -1.861 1.00 0.00 C ATOM 1176 CG TRP A 80 -0.239 13.290 -0.949 1.00 0.00 C ATOM 1177 CD1 TRP A 80 0.301 14.497 -1.290 1.00 0.00 C ATOM 1178 CD2 TRP A 80 -0.002 13.123 0.454 1.00 0.00 C ATOM 1179 NE1 TRP A 80 0.859 15.091 -0.183 1.00 0.00 N ATOM 1180 CE2 TRP A 80 0.685 14.269 0.898 1.00 0.00 C ATOM 1181 CE3 TRP A 80 -0.305 12.119 1.376 1.00 0.00 C ATOM 1182 CZ2 TRP A 80 1.074 14.435 2.225 1.00 0.00 C ATOM 1183 CZ3 TRP A 80 0.082 12.285 2.693 1.00 0.00 C ATOM 1184 CH2 TRP A 80 0.764 13.436 3.107 1.00 0.00 C ATOM 0 H TRP A 80 0.960 11.655 -3.286 1.00 0.00 H new ATOM 0 HA TRP A 80 0.076 10.737 -0.834 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -0.890 12.706 -2.882 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -1.993 12.282 -1.588 1.00 0.00 H new ATOM 0 HD1 TRP A 80 0.291 14.922 -2.283 1.00 0.00 H new ATOM 0 HE1 TRP A 80 1.327 15.997 -0.169 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -0.832 11.229 1.066 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 1.602 15.321 2.546 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -0.145 11.514 3.414 1.00 0.00 H new ATOM 0 HH2 TRP A 80 1.051 13.537 4.143 1.00 0.00 H new ATOM 1195 N PHE A 81 -1.721 9.613 -3.338 1.00 0.00 N ATOM 1196 CA PHE A 81 -2.749 8.647 -3.707 1.00 0.00 C ATOM 1197 C PHE A 81 -2.290 7.223 -3.409 1.00 0.00 C ATOM 1198 O PHE A 81 -3.027 6.431 -2.824 1.00 0.00 O ATOM 1199 CB PHE A 81 -3.097 8.782 -5.191 1.00 0.00 C ATOM 1200 CG PHE A 81 -4.223 7.889 -5.627 1.00 0.00 C ATOM 1201 CD1 PHE A 81 -5.540 8.236 -5.373 1.00 0.00 C ATOM 1202 CD2 PHE A 81 -3.963 6.701 -6.292 1.00 0.00 C ATOM 1203 CE1 PHE A 81 -6.577 7.415 -5.772 1.00 0.00 C ATOM 1204 CE2 PHE A 81 -4.997 5.876 -6.694 1.00 0.00 C ATOM 1205 CZ PHE A 81 -6.305 6.234 -6.435 1.00 0.00 C ATOM 0 H PHE A 81 -1.246 10.046 -4.130 1.00 0.00 H new ATOM 0 HA PHE A 81 -3.638 8.856 -3.112 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -3.364 9.818 -5.401 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -2.212 8.554 -5.785 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -5.759 9.159 -4.857 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -2.942 6.417 -6.498 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -7.599 7.696 -5.566 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -4.782 4.952 -7.210 1.00 0.00 H new ATOM 0 HZ PHE A 81 -7.114 5.592 -6.750 1.00 0.00 H new ATOM 1215 N GLN A 82 -1.065 6.906 -3.818 1.00 0.00 N ATOM 1216 CA GLN A 82 -0.507 5.576 -3.595 1.00 0.00 C ATOM 1217 C GLN A 82 -0.404 5.272 -2.106 1.00 0.00 C ATOM 1218 O GLN A 82 -0.712 4.162 -1.665 1.00 0.00 O ATOM 1219 CB GLN A 82 0.872 5.464 -4.247 1.00 0.00 C ATOM 1220 CG GLN A 82 0.824 5.402 -5.766 1.00 0.00 C ATOM 1221 CD GLN A 82 2.202 5.296 -6.389 1.00 0.00 C ATOM 1222 OE1 GLN A 82 3.217 5.439 -5.707 1.00 0.00 O ATOM 1223 NE2 GLN A 82 2.245 5.044 -7.693 1.00 0.00 N ATOM 0 H GLN A 82 -0.441 7.550 -4.304 1.00 0.00 H new ATOM 0 HA GLN A 82 -1.177 4.847 -4.050 1.00 0.00 H new ATOM 0 HB2 GLN A 82 1.478 6.319 -3.946 1.00 0.00 H new ATOM 0 HB3 GLN A 82 1.371 4.571 -3.871 1.00 0.00 H new ATOM 0 HG2 GLN A 82 0.224 4.545 -6.072 1.00 0.00 H new ATOM 0 HG3 GLN A 82 0.325 6.293 -6.147 1.00 0.00 H new ATOM 0 HE21 GLN A 82 1.379 4.933 -8.220 1.00 0.00 H new ATOM 0 HE22 GLN A 82 3.144 4.962 -8.167 1.00 0.00 H new ATOM 1232 N LEU A 83 0.030 6.260 -1.332 1.00 0.00 N ATOM 1233 CA LEU A 83 0.175 6.098 0.110 1.00 0.00 C ATOM 1234 C LEU A 83 -1.126 5.600 0.734 1.00 0.00 C ATOM 1235 O LEU A 83 -1.142 4.587 1.434 1.00 0.00 O ATOM 1236 CB LEU A 83 0.589 7.423 0.753 1.00 0.00 C ATOM 1237 CG LEU A 83 2.049 7.832 0.566 1.00 0.00 C ATOM 1238 CD1 LEU A 83 2.241 9.299 0.918 1.00 0.00 C ATOM 1239 CD2 LEU A 83 2.962 6.955 1.411 1.00 0.00 C ATOM 0 H LEU A 83 0.288 7.184 -1.680 1.00 0.00 H new ATOM 0 HA LEU A 83 0.952 5.356 0.292 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -0.043 8.213 0.349 1.00 0.00 H new ATOM 0 HB3 LEU A 83 0.383 7.365 1.822 1.00 0.00 H new ATOM 0 HG LEU A 83 2.314 7.693 -0.482 1.00 0.00 H new ATOM 0 HD11 LEU A 83 3.287 9.573 0.779 1.00 0.00 H new ATOM 0 HD12 LEU A 83 1.616 9.913 0.270 1.00 0.00 H new ATOM 0 HD13 LEU A 83 1.958 9.464 1.958 1.00 0.00 H new ATOM 0 HD21 LEU A 83 3.998 7.261 1.265 1.00 0.00 H new ATOM 0 HD22 LEU A 83 2.697 7.061 2.463 1.00 0.00 H new ATOM 0 HD23 LEU A 83 2.846 5.914 1.111 1.00 0.00 H new ATOM 1251 N ARG A 84 -2.213 6.318 0.475 1.00 0.00 N ATOM 1252 CA ARG A 84 -3.518 5.949 1.011 1.00 0.00 C ATOM 1253 C ARG A 84 -3.877 4.515 0.629 1.00 0.00 C ATOM 1254 O ARG A 84 -4.403 3.758 1.447 1.00 0.00 O ATOM 1255 CB ARG A 84 -4.594 6.908 0.497 1.00 0.00 C ATOM 1256 CG ARG A 84 -4.298 8.369 0.793 1.00 0.00 C ATOM 1257 CD ARG A 84 -4.379 8.663 2.283 1.00 0.00 C ATOM 1258 NE ARG A 84 -4.842 10.023 2.548 1.00 0.00 N ATOM 1259 CZ ARG A 84 -4.029 11.066 2.666 1.00 0.00 C ATOM 1260 NH1 ARG A 84 -2.719 10.908 2.541 1.00 0.00 N ATOM 1261 NH2 ARG A 84 -4.527 12.272 2.908 1.00 0.00 N ATOM 0 H ARG A 84 -2.217 7.159 -0.103 1.00 0.00 H new ATOM 0 HA ARG A 84 -3.469 6.017 2.098 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -4.700 6.778 -0.580 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -5.551 6.642 0.946 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -3.304 8.622 0.425 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -5.007 9.001 0.257 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -5.055 7.951 2.757 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -3.397 8.520 2.735 1.00 0.00 H new ATOM 0 HE ARG A 84 -5.845 10.180 2.648 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -2.332 9.983 2.354 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -2.097 11.712 2.632 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -5.535 12.398 3.003 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -3.902 13.073 2.999 1.00 0.00 H new ATOM 1275 N CYS A 85 -3.588 4.150 -0.614 1.00 0.00 N ATOM 1276 CA CYS A 85 -3.881 2.808 -1.104 1.00 0.00 C ATOM 1277 C CYS A 85 -3.460 1.753 -0.086 1.00 0.00 C ATOM 1278 O CYS A 85 -4.056 0.680 -0.005 1.00 0.00 O ATOM 1279 CB CYS A 85 -3.170 2.561 -2.435 1.00 0.00 C ATOM 1280 SG CYS A 85 -3.629 3.723 -3.744 1.00 0.00 S ATOM 0 H CYS A 85 -3.151 4.764 -1.301 1.00 0.00 H new ATOM 0 HA CYS A 85 -4.958 2.731 -1.256 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -2.093 2.617 -2.275 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -3.390 1.547 -2.770 1.00 0.00 H new ATOM 0 HG CYS A 85 -3.614 4.935 -3.273 1.00 0.00 H new ATOM 1286 N MET A 86 -2.426 2.066 0.688 1.00 0.00 N ATOM 1287 CA MET A 86 -1.924 1.145 1.702 1.00 0.00 C ATOM 1288 C MET A 86 -2.841 1.125 2.920 1.00 0.00 C ATOM 1289 O MET A 86 -3.064 0.075 3.521 1.00 0.00 O ATOM 1290 CB MET A 86 -0.506 1.539 2.122 1.00 0.00 C ATOM 1291 CG MET A 86 0.480 1.581 0.967 1.00 0.00 C ATOM 1292 SD MET A 86 0.397 0.111 -0.073 1.00 0.00 S ATOM 1293 CE MET A 86 0.925 -1.152 1.082 1.00 0.00 C ATOM 0 H MET A 86 -1.919 2.950 0.633 1.00 0.00 H new ATOM 0 HA MET A 86 -1.902 0.145 1.270 1.00 0.00 H new ATOM 0 HB2 MET A 86 -0.536 2.519 2.599 1.00 0.00 H new ATOM 0 HB3 MET A 86 -0.147 0.831 2.870 1.00 0.00 H new ATOM 0 HG2 MET A 86 0.283 2.463 0.358 1.00 0.00 H new ATOM 0 HG3 MET A 86 1.491 1.685 1.361 1.00 0.00 H new ATOM 0 HE1 MET A 86 1.364 -1.985 0.534 1.00 0.00 H new ATOM 0 HE2 MET A 86 1.666 -0.735 1.764 1.00 0.00 H new ATOM 0 HE3 MET A 86 0.066 -1.505 1.652 1.00 0.00 H new ATOM 1303 N GLN A 87 -3.370 2.290 3.278 1.00 0.00 N ATOM 1304 CA GLN A 87 -4.262 2.404 4.425 1.00 0.00 C ATOM 1305 C GLN A 87 -5.630 1.806 4.112 1.00 0.00 C ATOM 1306 O GLN A 87 -6.115 0.932 4.832 1.00 0.00 O ATOM 1307 CB GLN A 87 -4.415 3.870 4.834 1.00 0.00 C ATOM 1308 CG GLN A 87 -3.109 4.523 5.259 1.00 0.00 C ATOM 1309 CD GLN A 87 -3.306 5.574 6.335 1.00 0.00 C ATOM 1310 OE1 GLN A 87 -4.405 6.098 6.513 1.00 0.00 O ATOM 1311 NE2 GLN A 87 -2.238 5.886 7.059 1.00 0.00 N ATOM 0 H GLN A 87 -3.196 3.169 2.790 1.00 0.00 H new ATOM 0 HA GLN A 87 -3.823 1.847 5.252 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -4.836 4.429 3.999 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -5.129 3.937 5.655 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -2.426 3.757 5.626 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -2.637 4.982 4.390 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -1.346 5.426 6.877 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -2.309 6.586 7.798 1.00 0.00 H new ATOM 1320 N VAL A 88 -6.247 2.282 3.036 1.00 0.00 N ATOM 1321 CA VAL A 88 -7.558 1.793 2.628 1.00 0.00 C ATOM 1322 C VAL A 88 -7.543 0.282 2.423 1.00 0.00 C ATOM 1323 O VAL A 88 -8.592 -0.349 2.302 1.00 0.00 O ATOM 1324 CB VAL A 88 -8.031 2.471 1.328 1.00 0.00 C ATOM 1325 CG1 VAL A 88 -8.095 3.980 1.506 1.00 0.00 C ATOM 1326 CG2 VAL A 88 -7.115 2.101 0.172 1.00 0.00 C ATOM 0 H VAL A 88 -5.860 3.006 2.431 1.00 0.00 H new ATOM 0 HA VAL A 88 -8.251 2.041 3.432 1.00 0.00 H new ATOM 0 HB VAL A 88 -9.034 2.114 1.096 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -8.431 4.442 0.578 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -8.794 4.223 2.306 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -7.105 4.358 1.762 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -7.463 2.588 -0.739 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -6.099 2.429 0.393 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -7.125 1.020 0.032 1.00 0.00 H new ATOM 1336 N GLY A 89 -6.345 -0.292 2.388 1.00 0.00 N ATOM 1337 CA GLY A 89 -6.214 -1.725 2.199 1.00 0.00 C ATOM 1338 C GLY A 89 -5.598 -2.415 3.399 1.00 0.00 C ATOM 1339 O GLY A 89 -6.043 -2.223 4.530 1.00 0.00 O ATOM 0 H GLY A 89 -5.462 0.210 2.487 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -7.197 -2.154 2.003 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -5.601 -1.917 1.319 1.00 0.00 H new ATOM 1343 N GLY A 90 -4.570 -3.222 3.154 1.00 0.00 N ATOM 1344 CA GLY A 90 -3.910 -3.932 4.234 1.00 0.00 C ATOM 1345 C GLY A 90 -3.763 -5.413 3.949 1.00 0.00 C ATOM 1346 O GLY A 90 -4.378 -5.938 3.022 1.00 0.00 O ATOM 0 H GLY A 90 -4.183 -3.397 2.227 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -2.924 -3.498 4.401 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -4.478 -3.797 5.154 1.00 0.00 H new ATOM 1350 N ASN A 91 -2.943 -6.090 4.747 1.00 0.00 N ATOM 1351 CA ASN A 91 -2.715 -7.520 4.575 1.00 0.00 C ATOM 1352 C ASN A 91 -4.006 -8.305 4.782 1.00 0.00 C ATOM 1353 O ASN A 91 -4.609 -8.793 3.827 1.00 0.00 O ATOM 1354 CB ASN A 91 -1.645 -8.008 5.554 1.00 0.00 C ATOM 1355 CG ASN A 91 -0.307 -7.330 5.332 1.00 0.00 C ATOM 1356 OD1 ASN A 91 -0.246 -6.173 4.919 1.00 0.00 O ATOM 1357 ND2 ASN A 91 0.774 -8.051 5.607 1.00 0.00 N ATOM 0 H ASN A 91 -2.425 -5.671 5.519 1.00 0.00 H new ATOM 0 HA ASN A 91 -2.368 -7.688 3.555 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -1.979 -7.822 6.575 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -1.525 -9.086 5.449 1.00 0.00 H new ATOM 0 HD21 ASN A 91 1.702 -7.648 5.478 1.00 0.00 H new ATOM 0 HD22 ASN A 91 0.676 -9.007 5.948 1.00 0.00 H new ATOM 1364 N ALA A 92 -4.426 -8.423 6.037 1.00 0.00 N ATOM 1365 CA ALA A 92 -5.647 -9.146 6.370 1.00 0.00 C ATOM 1366 C ALA A 92 -6.727 -8.914 5.320 1.00 0.00 C ATOM 1367 O ALA A 92 -7.322 -9.862 4.807 1.00 0.00 O ATOM 1368 CB ALA A 92 -6.148 -8.732 7.746 1.00 0.00 C ATOM 0 H ALA A 92 -3.938 -8.027 6.840 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.415 -10.211 6.385 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -7.060 -9.280 7.981 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -5.387 -8.957 8.493 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -6.356 -7.662 7.751 1.00 0.00 H new ATOM 1374 N SER A 93 -6.976 -7.647 5.004 1.00 0.00 N ATOM 1375 CA SER A 93 -7.988 -7.291 4.016 1.00 0.00 C ATOM 1376 C SER A 93 -8.040 -8.322 2.894 1.00 0.00 C ATOM 1377 O SER A 93 -9.104 -8.851 2.572 1.00 0.00 O ATOM 1378 CB SER A 93 -7.698 -5.905 3.437 1.00 0.00 C ATOM 1379 OG SER A 93 -7.627 -4.928 4.462 1.00 0.00 O ATOM 0 H SER A 93 -6.491 -6.850 5.417 1.00 0.00 H new ATOM 0 HA SER A 93 -8.957 -7.275 4.515 1.00 0.00 H new ATOM 0 HB2 SER A 93 -6.758 -5.927 2.886 1.00 0.00 H new ATOM 0 HB3 SER A 93 -8.478 -5.634 2.726 1.00 0.00 H new ATOM 0 HG SER A 93 -7.759 -4.038 4.075 1.00 0.00 H new ATOM 1385 N ALA A 94 -6.884 -8.605 2.304 1.00 0.00 N ATOM 1386 CA ALA A 94 -6.796 -9.575 1.219 1.00 0.00 C ATOM 1387 C ALA A 94 -6.932 -10.999 1.745 1.00 0.00 C ATOM 1388 O ALA A 94 -7.683 -11.805 1.194 1.00 0.00 O ATOM 1389 CB ALA A 94 -5.483 -9.410 0.469 1.00 0.00 C ATOM 0 H ALA A 94 -5.994 -8.176 2.559 1.00 0.00 H new ATOM 0 HA ALA A 94 -7.620 -9.390 0.530 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -5.431 -10.141 -0.338 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -5.426 -8.404 0.053 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -4.650 -9.567 1.155 1.00 0.00 H new ATOM 1395 N SER A 95 -6.203 -11.304 2.814 1.00 0.00 N ATOM 1396 CA SER A 95 -6.240 -12.634 3.411 1.00 0.00 C ATOM 1397 C SER A 95 -7.654 -13.204 3.379 1.00 0.00 C ATOM 1398 O SER A 95 -7.853 -14.384 3.091 1.00 0.00 O ATOM 1399 CB SER A 95 -5.730 -12.583 4.852 1.00 0.00 C ATOM 1400 OG SER A 95 -5.195 -13.833 5.248 1.00 0.00 O ATOM 0 H SER A 95 -5.580 -10.648 3.284 1.00 0.00 H new ATOM 0 HA SER A 95 -5.591 -13.286 2.827 1.00 0.00 H new ATOM 0 HB2 SER A 95 -4.966 -11.811 4.943 1.00 0.00 H new ATOM 0 HB3 SER A 95 -6.545 -12.305 5.520 1.00 0.00 H new ATOM 0 HG SER A 95 -4.874 -13.774 6.172 1.00 0.00 H new ATOM 1406 N SER A 96 -8.634 -12.357 3.678 1.00 0.00 N ATOM 1407 CA SER A 96 -10.031 -12.776 3.688 1.00 0.00 C ATOM 1408 C SER A 96 -10.672 -12.563 2.321 1.00 0.00 C ATOM 1409 O SER A 96 -11.305 -13.465 1.771 1.00 0.00 O ATOM 1410 CB SER A 96 -10.809 -12.005 4.756 1.00 0.00 C ATOM 1411 OG SER A 96 -12.186 -12.339 4.723 1.00 0.00 O ATOM 0 H SER A 96 -8.486 -11.376 3.917 1.00 0.00 H new ATOM 0 HA SER A 96 -10.064 -13.840 3.923 1.00 0.00 H new ATOM 0 HB2 SER A 96 -10.400 -12.229 5.741 1.00 0.00 H new ATOM 0 HB3 SER A 96 -10.687 -10.934 4.597 1.00 0.00 H new ATOM 0 HG SER A 96 -12.688 -11.616 4.292 1.00 0.00 H new ATOM 1417 N PHE A 97 -10.504 -11.362 1.777 1.00 0.00 N ATOM 1418 CA PHE A 97 -11.067 -11.029 0.474 1.00 0.00 C ATOM 1419 C PHE A 97 -10.922 -12.197 -0.497 1.00 0.00 C ATOM 1420 O PHE A 97 -11.890 -12.608 -1.140 1.00 0.00 O ATOM 1421 CB PHE A 97 -10.379 -9.787 -0.100 1.00 0.00 C ATOM 1422 CG PHE A 97 -11.090 -9.202 -1.286 1.00 0.00 C ATOM 1423 CD1 PHE A 97 -11.210 -9.924 -2.463 1.00 0.00 C ATOM 1424 CD2 PHE A 97 -11.639 -7.932 -1.225 1.00 0.00 C ATOM 1425 CE1 PHE A 97 -11.863 -9.388 -3.557 1.00 0.00 C ATOM 1426 CE2 PHE A 97 -12.293 -7.391 -2.316 1.00 0.00 C ATOM 1427 CZ PHE A 97 -12.406 -8.120 -3.483 1.00 0.00 C ATOM 0 H PHE A 97 -9.983 -10.604 2.218 1.00 0.00 H new ATOM 0 HA PHE A 97 -12.128 -10.820 0.608 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -10.306 -9.029 0.680 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -9.360 -10.047 -0.389 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -10.789 -10.916 -2.526 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -11.555 -7.358 -0.314 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -11.949 -9.960 -4.469 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -12.715 -6.399 -2.256 1.00 0.00 H new ATOM 0 HZ PHE A 97 -12.918 -7.700 -4.336 1.00 0.00 H new ATOM 1437 N PHE A 98 -9.709 -12.728 -0.598 1.00 0.00 N ATOM 1438 CA PHE A 98 -9.437 -13.848 -1.491 1.00 0.00 C ATOM 1439 C PHE A 98 -10.370 -15.019 -1.196 1.00 0.00 C ATOM 1440 O PHE A 98 -11.120 -15.465 -2.064 1.00 0.00 O ATOM 1441 CB PHE A 98 -7.979 -14.296 -1.353 1.00 0.00 C ATOM 1442 CG PHE A 98 -7.032 -13.529 -2.231 1.00 0.00 C ATOM 1443 CD1 PHE A 98 -6.804 -13.927 -3.539 1.00 0.00 C ATOM 1444 CD2 PHE A 98 -6.369 -12.412 -1.749 1.00 0.00 C ATOM 1445 CE1 PHE A 98 -5.932 -13.224 -4.350 1.00 0.00 C ATOM 1446 CE2 PHE A 98 -5.498 -11.706 -2.555 1.00 0.00 C ATOM 1447 CZ PHE A 98 -5.278 -12.112 -3.857 1.00 0.00 C ATOM 0 H PHE A 98 -8.898 -12.401 -0.073 1.00 0.00 H new ATOM 0 HA PHE A 98 -9.613 -13.515 -2.514 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -7.670 -14.185 -0.314 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -7.908 -15.356 -1.595 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -7.313 -14.796 -3.929 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -6.535 -12.090 -0.732 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -5.763 -13.544 -5.367 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -4.989 -10.836 -2.167 1.00 0.00 H new ATOM 0 HZ PHE A 98 -4.596 -11.561 -4.488 1.00 0.00 H new ATOM 1457 N HIS A 99 -10.316 -15.514 0.038 1.00 0.00 N ATOM 1458 CA HIS A 99 -11.156 -16.633 0.450 1.00 0.00 C ATOM 1459 C HIS A 99 -12.631 -16.321 0.213 1.00 0.00 C ATOM 1460 O HIS A 99 -13.311 -17.026 -0.532 1.00 0.00 O ATOM 1461 CB HIS A 99 -10.922 -16.958 1.925 1.00 0.00 C ATOM 1462 CG HIS A 99 -11.331 -18.348 2.304 1.00 0.00 C ATOM 1463 ND1 HIS A 99 -10.511 -19.209 3.001 1.00 0.00 N ATOM 1464 CD2 HIS A 99 -12.483 -19.024 2.081 1.00 0.00 C ATOM 1465 CE1 HIS A 99 -11.140 -20.357 3.189 1.00 0.00 C ATOM 1466 NE2 HIS A 99 -12.337 -20.270 2.640 1.00 0.00 N ATOM 0 H HIS A 99 -9.700 -15.158 0.769 1.00 0.00 H new ATOM 0 HA HIS A 99 -10.885 -17.500 -0.152 1.00 0.00 H new ATOM 0 HB2 HIS A 99 -9.865 -16.824 2.155 1.00 0.00 H new ATOM 0 HB3 HIS A 99 -11.475 -16.246 2.538 1.00 0.00 H new ATOM 0 HD2 HIS A 99 -13.354 -18.653 1.561 1.00 0.00 H new ATOM 0 HE1 HIS A 99 -10.742 -21.219 3.704 1.00 0.00 H new ATOM 0 HE2 HIS A 99 -13.040 -21.009 2.632 1.00 0.00 H new ATOM 1474 N GLN A 100 -13.117 -15.261 0.851 1.00 0.00 N ATOM 1475 CA GLN A 100 -14.511 -14.858 0.710 1.00 0.00 C ATOM 1476 C GLN A 100 -14.997 -15.070 -0.720 1.00 0.00 C ATOM 1477 O GLN A 100 -16.095 -15.577 -0.944 1.00 0.00 O ATOM 1478 CB GLN A 100 -14.682 -13.391 1.109 1.00 0.00 C ATOM 1479 CG GLN A 100 -14.332 -13.110 2.560 1.00 0.00 C ATOM 1480 CD GLN A 100 -15.058 -11.900 3.113 1.00 0.00 C ATOM 1481 OE1 GLN A 100 -14.461 -10.843 3.317 1.00 0.00 O ATOM 1482 NE2 GLN A 100 -16.354 -12.049 3.358 1.00 0.00 N ATOM 0 H GLN A 100 -12.566 -14.666 1.470 1.00 0.00 H new ATOM 0 HA GLN A 100 -15.112 -15.480 1.373 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -14.055 -12.773 0.467 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -15.715 -13.092 0.929 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -14.577 -13.983 3.164 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -13.257 -12.954 2.647 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -16.808 -12.943 3.174 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -16.896 -11.269 3.730 1.00 0.00 H new ATOM 1491 N HIS A 101 -14.171 -14.675 -1.685 1.00 0.00 N ATOM 1492 CA HIS A 101 -14.518 -14.821 -3.094 1.00 0.00 C ATOM 1493 C HIS A 101 -14.568 -16.294 -3.491 1.00 0.00 C ATOM 1494 O HIS A 101 -15.584 -16.779 -3.987 1.00 0.00 O ATOM 1495 CB HIS A 101 -13.507 -14.080 -3.969 1.00 0.00 C ATOM 1496 CG HIS A 101 -13.810 -14.158 -5.433 1.00 0.00 C ATOM 1497 ND1 HIS A 101 -14.457 -13.154 -6.122 1.00 0.00 N ATOM 1498 CD2 HIS A 101 -13.550 -15.128 -6.341 1.00 0.00 C ATOM 1499 CE1 HIS A 101 -14.583 -13.504 -7.390 1.00 0.00 C ATOM 1500 NE2 HIS A 101 -14.041 -14.697 -7.549 1.00 0.00 N ATOM 0 H HIS A 101 -13.258 -14.252 -1.517 1.00 0.00 H new ATOM 0 HA HIS A 101 -15.506 -14.387 -3.246 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -13.477 -13.033 -3.668 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -12.514 -14.491 -3.790 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -13.050 -16.066 -6.151 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -15.050 -12.914 -8.165 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -13.994 -15.215 -8.427 1.00 0.00 H new ATOM 1508 N GLY A 102 -13.463 -17.000 -3.269 1.00 0.00 N ATOM 1509 CA GLY A 102 -13.402 -18.409 -3.611 1.00 0.00 C ATOM 1510 C GLY A 102 -12.194 -18.749 -4.460 1.00 0.00 C ATOM 1511 O GLY A 102 -12.320 -19.398 -5.499 1.00 0.00 O ATOM 0 H GLY A 102 -12.609 -16.621 -2.859 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -13.377 -19.001 -2.696 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -14.309 -18.689 -4.147 1.00 0.00 H new ATOM 1515 N CYS A 103 -11.021 -18.307 -4.020 1.00 0.00 N ATOM 1516 CA CYS A 103 -9.785 -18.566 -4.749 1.00 0.00 C ATOM 1517 C CYS A 103 -8.977 -19.670 -4.076 1.00 0.00 C ATOM 1518 O CYS A 103 -8.583 -20.645 -4.717 1.00 0.00 O ATOM 1519 CB CYS A 103 -8.946 -17.290 -4.842 1.00 0.00 C ATOM 1520 SG CYS A 103 -7.559 -17.401 -5.997 1.00 0.00 S ATOM 0 H CYS A 103 -10.900 -17.768 -3.163 1.00 0.00 H new ATOM 0 HA CYS A 103 -10.048 -18.894 -5.754 1.00 0.00 H new ATOM 0 HB2 CYS A 103 -9.591 -16.465 -5.144 1.00 0.00 H new ATOM 0 HB3 CYS A 103 -8.561 -17.048 -3.851 1.00 0.00 H new ATOM 0 HG CYS A 103 -6.791 -16.362 -5.854 1.00 0.00 H new ATOM 1526 N SER A 104 -8.732 -19.511 -2.779 1.00 0.00 N ATOM 1527 CA SER A 104 -7.967 -20.493 -2.018 1.00 0.00 C ATOM 1528 C SER A 104 -6.790 -21.015 -2.837 1.00 0.00 C ATOM 1529 O SER A 104 -6.518 -22.215 -2.860 1.00 0.00 O ATOM 1530 CB SER A 104 -8.866 -21.656 -1.597 1.00 0.00 C ATOM 1531 OG SER A 104 -8.176 -22.547 -0.737 1.00 0.00 O ATOM 0 H SER A 104 -9.052 -18.711 -2.233 1.00 0.00 H new ATOM 0 HA SER A 104 -7.578 -20.003 -1.125 1.00 0.00 H new ATOM 0 HB2 SER A 104 -9.752 -21.271 -1.092 1.00 0.00 H new ATOM 0 HB3 SER A 104 -9.211 -22.192 -2.481 1.00 0.00 H new ATOM 0 HG SER A 104 -7.316 -22.789 -1.139 1.00 0.00 H new ATOM 1537 N THR A 105 -6.093 -20.103 -3.509 1.00 0.00 N ATOM 1538 CA THR A 105 -4.946 -20.470 -4.329 1.00 0.00 C ATOM 1539 C THR A 105 -3.641 -20.020 -3.683 1.00 0.00 C ATOM 1540 O THR A 105 -3.426 -18.830 -3.462 1.00 0.00 O ATOM 1541 CB THR A 105 -5.045 -19.858 -5.739 1.00 0.00 C ATOM 1542 OG1 THR A 105 -6.259 -20.279 -6.372 1.00 0.00 O ATOM 1543 CG2 THR A 105 -3.855 -20.269 -6.593 1.00 0.00 C ATOM 0 H THR A 105 -6.304 -19.105 -3.501 1.00 0.00 H new ATOM 0 HA THR A 105 -4.951 -21.557 -4.411 1.00 0.00 H new ATOM 0 HB THR A 105 -5.044 -18.773 -5.640 1.00 0.00 H new ATOM 0 HG1 THR A 105 -6.892 -19.532 -6.394 1.00 0.00 H new ATOM 0 HG21 THR A 105 -3.948 -19.825 -7.584 1.00 0.00 H new ATOM 0 HG22 THR A 105 -2.934 -19.922 -6.124 1.00 0.00 H new ATOM 0 HG23 THR A 105 -3.830 -21.355 -6.683 1.00 0.00 H new ATOM 1551 N ASN A 106 -2.772 -20.980 -3.384 1.00 0.00 N ATOM 1552 CA ASN A 106 -1.487 -20.681 -2.762 1.00 0.00 C ATOM 1553 C ASN A 106 -0.500 -20.137 -3.790 1.00 0.00 C ATOM 1554 O ASN A 106 0.315 -19.265 -3.482 1.00 0.00 O ATOM 1555 CB ASN A 106 -0.913 -21.936 -2.101 1.00 0.00 C ATOM 1556 CG ASN A 106 -1.960 -22.713 -1.326 1.00 0.00 C ATOM 1557 OD1 ASN A 106 -2.854 -23.323 -1.912 1.00 0.00 O ATOM 1558 ND2 ASN A 106 -1.854 -22.691 -0.004 1.00 0.00 N ATOM 0 H ASN A 106 -2.934 -21.971 -3.562 1.00 0.00 H new ATOM 0 HA ASN A 106 -1.648 -19.919 -2.000 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -0.479 -22.580 -2.866 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -0.104 -21.651 -1.428 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -2.531 -23.194 0.570 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -1.096 -22.171 0.438 1.00 0.00 H new ATOM 1565 N ASP A 107 -0.577 -20.656 -5.009 1.00 0.00 N ATOM 1566 CA ASP A 107 0.308 -20.221 -6.084 1.00 0.00 C ATOM 1567 C ASP A 107 0.374 -18.698 -6.151 1.00 0.00 C ATOM 1568 O ASP A 107 -0.338 -18.002 -5.426 1.00 0.00 O ATOM 1569 CB ASP A 107 -0.169 -20.783 -7.425 1.00 0.00 C ATOM 1570 CG ASP A 107 0.364 -22.177 -7.691 1.00 0.00 C ATOM 1571 OD1 ASP A 107 0.733 -22.867 -6.717 1.00 0.00 O ATOM 1572 OD2 ASP A 107 0.411 -22.579 -8.872 1.00 0.00 O ATOM 0 H ASP A 107 -1.244 -21.379 -5.279 1.00 0.00 H new ATOM 0 HA ASP A 107 1.308 -20.601 -5.875 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -1.259 -20.805 -7.439 1.00 0.00 H new ATOM 0 HB3 ASP A 107 0.147 -20.117 -8.228 1.00 0.00 H new ATOM 1577 N THR A 108 1.234 -18.187 -7.025 1.00 0.00 N ATOM 1578 CA THR A 108 1.396 -16.747 -7.185 1.00 0.00 C ATOM 1579 C THR A 108 0.968 -16.298 -8.578 1.00 0.00 C ATOM 1580 O THR A 108 0.253 -15.307 -8.728 1.00 0.00 O ATOM 1581 CB THR A 108 2.855 -16.316 -6.944 1.00 0.00 C ATOM 1582 OG1 THR A 108 3.249 -16.645 -5.608 1.00 0.00 O ATOM 1583 CG2 THR A 108 3.022 -14.821 -7.173 1.00 0.00 C ATOM 0 H THR A 108 1.830 -18.749 -7.633 1.00 0.00 H new ATOM 0 HA THR A 108 0.757 -16.272 -6.441 1.00 0.00 H new ATOM 0 HB THR A 108 3.490 -16.850 -7.651 1.00 0.00 H new ATOM 0 HG1 THR A 108 4.178 -16.369 -5.464 1.00 0.00 H new ATOM 0 HG21 THR A 108 4.060 -14.540 -6.997 1.00 0.00 H new ATOM 0 HG22 THR A 108 2.749 -14.577 -8.200 1.00 0.00 H new ATOM 0 HG23 THR A 108 2.376 -14.273 -6.486 1.00 0.00 H new ATOM 1591 N ASN A 109 1.410 -17.031 -9.594 1.00 0.00 N ATOM 1592 CA ASN A 109 1.073 -16.708 -10.975 1.00 0.00 C ATOM 1593 C ASN A 109 -0.392 -17.020 -11.264 1.00 0.00 C ATOM 1594 O ASN A 109 -0.894 -16.739 -12.353 1.00 0.00 O ATOM 1595 CB ASN A 109 1.972 -17.486 -11.937 1.00 0.00 C ATOM 1596 CG ASN A 109 1.539 -17.334 -13.383 1.00 0.00 C ATOM 1597 OD1 ASN A 109 0.739 -18.122 -13.888 1.00 0.00 O ATOM 1598 ND2 ASN A 109 2.066 -16.318 -14.056 1.00 0.00 N ATOM 0 H ASN A 109 2.003 -17.854 -9.487 1.00 0.00 H new ATOM 0 HA ASN A 109 1.234 -15.640 -11.122 1.00 0.00 H new ATOM 0 HB2 ASN A 109 3.000 -17.140 -11.830 1.00 0.00 H new ATOM 0 HB3 ASN A 109 1.962 -18.542 -11.666 1.00 0.00 H new ATOM 0 HD21 ASN A 109 1.811 -16.166 -15.032 1.00 0.00 H new ATOM 0 HD22 ASN A 109 2.725 -15.690 -13.597 1.00 0.00 H new ATOM 1605 N ALA A 110 -1.073 -17.602 -10.282 1.00 0.00 N ATOM 1606 CA ALA A 110 -2.480 -17.951 -10.430 1.00 0.00 C ATOM 1607 C ALA A 110 -3.338 -17.216 -9.407 1.00 0.00 C ATOM 1608 O ALA A 110 -4.309 -16.546 -9.760 1.00 0.00 O ATOM 1609 CB ALA A 110 -2.668 -19.455 -10.297 1.00 0.00 C ATOM 0 H ALA A 110 -0.672 -17.842 -9.375 1.00 0.00 H new ATOM 0 HA ALA A 110 -2.803 -17.643 -11.424 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -3.724 -19.701 -10.410 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -2.092 -19.963 -11.070 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -2.323 -19.779 -9.315 1.00 0.00 H new ATOM 1615 N LYS A 111 -2.975 -17.345 -8.135 1.00 0.00 N ATOM 1616 CA LYS A 111 -3.710 -16.694 -7.058 1.00 0.00 C ATOM 1617 C LYS A 111 -3.892 -15.207 -7.346 1.00 0.00 C ATOM 1618 O LYS A 111 -4.957 -14.641 -7.096 1.00 0.00 O ATOM 1619 CB LYS A 111 -2.979 -16.881 -5.727 1.00 0.00 C ATOM 1620 CG LYS A 111 -3.612 -16.121 -4.574 1.00 0.00 C ATOM 1621 CD LYS A 111 -2.641 -15.953 -3.417 1.00 0.00 C ATOM 1622 CE LYS A 111 -3.193 -15.012 -2.358 1.00 0.00 C ATOM 1623 NZ LYS A 111 -4.398 -15.575 -1.689 1.00 0.00 N ATOM 0 H LYS A 111 -2.174 -17.896 -7.825 1.00 0.00 H new ATOM 0 HA LYS A 111 -4.695 -17.157 -6.992 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -2.954 -17.943 -5.482 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -1.945 -16.556 -5.841 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -3.940 -15.141 -4.920 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -4.500 -16.652 -4.231 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -2.435 -16.925 -2.969 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -1.693 -15.566 -3.790 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -2.423 -14.813 -1.612 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -3.446 -14.057 -2.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -5.234 -15.013 -1.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -4.535 -16.560 -1.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -4.268 -15.545 -0.658 1.00 0.00 H new ATOM 1637 N TYR A 112 -2.847 -14.579 -7.874 1.00 0.00 N ATOM 1638 CA TYR A 112 -2.892 -13.157 -8.195 1.00 0.00 C ATOM 1639 C TYR A 112 -3.527 -12.928 -9.563 1.00 0.00 C ATOM 1640 O TYR A 112 -4.110 -11.875 -9.820 1.00 0.00 O ATOM 1641 CB TYR A 112 -1.483 -12.562 -8.167 1.00 0.00 C ATOM 1642 CG TYR A 112 -0.921 -12.399 -6.773 1.00 0.00 C ATOM 1643 CD1 TYR A 112 -1.375 -11.391 -5.934 1.00 0.00 C ATOM 1644 CD2 TYR A 112 0.065 -13.255 -6.296 1.00 0.00 C ATOM 1645 CE1 TYR A 112 -0.865 -11.237 -4.659 1.00 0.00 C ATOM 1646 CE2 TYR A 112 0.579 -13.111 -5.022 1.00 0.00 C ATOM 1647 CZ TYR A 112 0.112 -12.100 -4.208 1.00 0.00 C ATOM 1648 OH TYR A 112 0.624 -11.952 -2.939 1.00 0.00 O ATOM 0 H TYR A 112 -1.959 -15.032 -8.089 1.00 0.00 H new ATOM 0 HA TYR A 112 -3.504 -12.659 -7.443 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -0.816 -13.201 -8.746 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -1.499 -11.590 -8.659 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -2.141 -10.715 -6.284 1.00 0.00 H new ATOM 0 HD2 TYR A 112 0.435 -14.046 -6.932 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -1.229 -10.446 -4.020 1.00 0.00 H new ATOM 0 HE2 TYR A 112 1.342 -13.786 -4.665 1.00 0.00 H new ATOM 0 HH TYR A 112 1.303 -12.640 -2.778 1.00 0.00 H new ATOM 1658 N ASN A 113 -3.408 -13.921 -10.438 1.00 0.00 N ATOM 1659 CA ASN A 113 -3.970 -13.829 -11.780 1.00 0.00 C ATOM 1660 C ASN A 113 -5.423 -14.293 -11.795 1.00 0.00 C ATOM 1661 O ASN A 113 -5.960 -14.650 -12.843 1.00 0.00 O ATOM 1662 CB ASN A 113 -3.145 -14.667 -12.759 1.00 0.00 C ATOM 1663 CG ASN A 113 -1.785 -14.057 -13.038 1.00 0.00 C ATOM 1664 OD1 ASN A 113 -0.833 -14.300 -12.145 1.00 0.00 O flip ATOM 1665 ND2 ASN A 113 -1.593 -13.377 -14.046 1.00 0.00 N flip ATOM 0 H ASN A 113 -2.927 -14.799 -10.242 1.00 0.00 H new ATOM 0 HA ASN A 113 -3.938 -12.784 -12.089 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -3.014 -15.670 -12.354 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -3.693 -14.771 -13.696 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -2.354 -13.216 -14.705 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -0.672 -12.974 -14.222 1.00 0.00 H new ATOM 1672 N SER A 114 -6.053 -14.285 -10.624 1.00 0.00 N ATOM 1673 CA SER A 114 -7.443 -14.707 -10.501 1.00 0.00 C ATOM 1674 C SER A 114 -8.370 -13.501 -10.387 1.00 0.00 C ATOM 1675 O SER A 114 -7.915 -12.367 -10.235 1.00 0.00 O ATOM 1676 CB SER A 114 -7.616 -15.615 -9.283 1.00 0.00 C ATOM 1677 OG SER A 114 -7.781 -14.855 -8.099 1.00 0.00 O ATOM 0 H SER A 114 -5.622 -13.991 -9.747 1.00 0.00 H new ATOM 0 HA SER A 114 -7.709 -15.263 -11.400 1.00 0.00 H new ATOM 0 HB2 SER A 114 -8.482 -16.261 -9.427 1.00 0.00 H new ATOM 0 HB3 SER A 114 -6.746 -16.265 -9.183 1.00 0.00 H new ATOM 0 HG SER A 114 -7.746 -15.450 -7.321 1.00 0.00 H new ATOM 1683 N ARG A 115 -9.673 -13.754 -10.458 1.00 0.00 N ATOM 1684 CA ARG A 115 -10.664 -12.690 -10.362 1.00 0.00 C ATOM 1685 C ARG A 115 -10.597 -12.004 -9.001 1.00 0.00 C ATOM 1686 O ARG A 115 -10.422 -10.789 -8.915 1.00 0.00 O ATOM 1687 CB ARG A 115 -12.068 -13.250 -10.595 1.00 0.00 C ATOM 1688 CG ARG A 115 -13.176 -12.237 -10.353 1.00 0.00 C ATOM 1689 CD ARG A 115 -13.279 -11.241 -11.498 1.00 0.00 C ATOM 1690 NE ARG A 115 -14.597 -10.613 -11.559 1.00 0.00 N ATOM 1691 CZ ARG A 115 -14.890 -9.598 -12.365 1.00 0.00 C ATOM 1692 NH1 ARG A 115 -13.964 -9.102 -13.174 1.00 0.00 N ATOM 1693 NH2 ARG A 115 -16.112 -9.080 -12.363 1.00 0.00 N ATOM 0 H ARG A 115 -10.066 -14.687 -10.582 1.00 0.00 H new ATOM 0 HA ARG A 115 -10.442 -11.951 -11.132 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -12.139 -13.615 -11.619 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -12.221 -14.107 -9.939 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -14.127 -12.757 -10.235 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -12.986 -11.704 -9.421 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -12.516 -10.472 -11.379 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -13.075 -11.749 -12.440 1.00 0.00 H new ATOM 0 HE ARG A 115 -15.332 -10.973 -10.950 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -13.025 -9.500 -13.178 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -14.191 -8.323 -13.792 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -16.826 -9.461 -11.743 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -16.337 -8.301 -12.982 1.00 0.00 H new ATOM 1707 N ALA A 116 -10.738 -12.792 -7.940 1.00 0.00 N ATOM 1708 CA ALA A 116 -10.692 -12.262 -6.583 1.00 0.00 C ATOM 1709 C ALA A 116 -9.562 -11.249 -6.428 1.00 0.00 C ATOM 1710 O ALA A 116 -9.763 -10.158 -5.895 1.00 0.00 O ATOM 1711 CB ALA A 116 -10.530 -13.393 -5.580 1.00 0.00 C ATOM 0 H ALA A 116 -10.885 -13.800 -7.994 1.00 0.00 H new ATOM 0 HA ALA A 116 -11.634 -11.750 -6.387 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -10.497 -12.982 -4.571 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -11.373 -14.079 -5.666 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -9.604 -13.930 -5.784 1.00 0.00 H new ATOM 1717 N ALA A 117 -8.374 -11.619 -6.896 1.00 0.00 N ATOM 1718 CA ALA A 117 -7.212 -10.742 -6.809 1.00 0.00 C ATOM 1719 C ALA A 117 -7.483 -9.404 -7.490 1.00 0.00 C ATOM 1720 O ALA A 117 -7.250 -8.345 -6.911 1.00 0.00 O ATOM 1721 CB ALA A 117 -5.996 -11.415 -7.427 1.00 0.00 C ATOM 0 H ALA A 117 -8.191 -12.519 -7.339 1.00 0.00 H new ATOM 0 HA ALA A 117 -7.010 -10.549 -5.755 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -5.136 -10.749 -7.355 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -5.783 -12.342 -6.894 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -6.196 -11.637 -8.475 1.00 0.00 H new ATOM 1727 N GLN A 118 -7.975 -9.463 -8.724 1.00 0.00 N ATOM 1728 CA GLN A 118 -8.274 -8.255 -9.484 1.00 0.00 C ATOM 1729 C GLN A 118 -9.282 -7.383 -8.744 1.00 0.00 C ATOM 1730 O GLN A 118 -8.993 -6.235 -8.400 1.00 0.00 O ATOM 1731 CB GLN A 118 -8.816 -8.619 -10.868 1.00 0.00 C ATOM 1732 CG GLN A 118 -7.887 -9.519 -11.666 1.00 0.00 C ATOM 1733 CD GLN A 118 -8.002 -9.297 -13.161 1.00 0.00 C ATOM 1734 OE1 GLN A 118 -9.102 -9.181 -13.701 1.00 0.00 O ATOM 1735 NE2 GLN A 118 -6.862 -9.233 -13.840 1.00 0.00 N ATOM 0 H GLN A 118 -8.175 -10.333 -9.218 1.00 0.00 H new ATOM 0 HA GLN A 118 -7.349 -7.691 -9.601 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -9.779 -9.116 -10.753 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -8.995 -7.703 -11.432 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -6.858 -9.341 -11.354 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -8.113 -10.561 -11.439 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -5.972 -9.334 -13.353 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -6.877 -9.082 -14.849 1.00 0.00 H new ATOM 1744 N LEU A 119 -10.467 -7.931 -8.502 1.00 0.00 N ATOM 1745 CA LEU A 119 -11.520 -7.203 -7.802 1.00 0.00 C ATOM 1746 C LEU A 119 -10.940 -6.362 -6.670 1.00 0.00 C ATOM 1747 O LEU A 119 -11.400 -5.249 -6.412 1.00 0.00 O ATOM 1748 CB LEU A 119 -12.560 -8.178 -7.247 1.00 0.00 C ATOM 1749 CG LEU A 119 -13.158 -9.164 -8.250 1.00 0.00 C ATOM 1750 CD1 LEU A 119 -14.054 -10.169 -7.542 1.00 0.00 C ATOM 1751 CD2 LEU A 119 -13.934 -8.424 -9.330 1.00 0.00 C ATOM 0 H LEU A 119 -10.724 -8.878 -8.780 1.00 0.00 H new ATOM 0 HA LEU A 119 -12.002 -6.535 -8.516 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -12.100 -8.747 -6.439 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -13.373 -7.600 -6.808 1.00 0.00 H new ATOM 0 HG LEU A 119 -12.341 -9.707 -8.726 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -14.471 -10.863 -8.272 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -13.470 -10.723 -6.807 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -14.865 -9.642 -7.038 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -14.352 -9.143 -10.035 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -14.742 -7.853 -8.871 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -13.265 -7.745 -9.858 1.00 0.00 H new ATOM 1763 N TYR A 120 -9.927 -6.899 -6.001 1.00 0.00 N ATOM 1764 CA TYR A 120 -9.284 -6.197 -4.896 1.00 0.00 C ATOM 1765 C TYR A 120 -8.585 -4.933 -5.386 1.00 0.00 C ATOM 1766 O TYR A 120 -8.917 -3.824 -4.967 1.00 0.00 O ATOM 1767 CB TYR A 120 -8.274 -7.113 -4.201 1.00 0.00 C ATOM 1768 CG TYR A 120 -7.699 -6.528 -2.931 1.00 0.00 C ATOM 1769 CD1 TYR A 120 -8.348 -6.691 -1.713 1.00 0.00 C ATOM 1770 CD2 TYR A 120 -6.509 -5.811 -2.950 1.00 0.00 C ATOM 1771 CE1 TYR A 120 -7.827 -6.157 -0.549 1.00 0.00 C ATOM 1772 CE2 TYR A 120 -5.980 -5.276 -1.792 1.00 0.00 C ATOM 1773 CZ TYR A 120 -6.642 -5.451 -0.594 1.00 0.00 C ATOM 1774 OH TYR A 120 -6.119 -4.917 0.561 1.00 0.00 O ATOM 0 H TYR A 120 -9.533 -7.818 -6.204 1.00 0.00 H new ATOM 0 HA TYR A 120 -10.057 -5.910 -4.183 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -8.757 -8.062 -3.968 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -7.459 -7.332 -4.892 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -9.275 -7.244 -1.675 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -5.989 -5.670 -3.886 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -8.344 -6.291 0.390 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -5.053 -4.723 -1.824 1.00 0.00 H new ATOM 0 HH TYR A 120 -5.604 -5.603 1.035 1.00 0.00 H new ATOM 1784 N ARG A 121 -7.615 -5.108 -6.278 1.00 0.00 N ATOM 1785 CA ARG A 121 -6.868 -3.983 -6.826 1.00 0.00 C ATOM 1786 C ARG A 121 -7.790 -2.796 -7.090 1.00 0.00 C ATOM 1787 O ARG A 121 -7.651 -1.741 -6.474 1.00 0.00 O ATOM 1788 CB ARG A 121 -6.163 -4.392 -8.120 1.00 0.00 C ATOM 1789 CG ARG A 121 -5.326 -5.654 -7.985 1.00 0.00 C ATOM 1790 CD ARG A 121 -4.604 -5.986 -9.281 1.00 0.00 C ATOM 1791 NE ARG A 121 -5.450 -5.762 -10.451 1.00 0.00 N ATOM 1792 CZ ARG A 121 -5.548 -4.594 -11.075 1.00 0.00 C ATOM 1793 NH1 ARG A 121 -4.855 -3.549 -10.644 1.00 0.00 N ATOM 1794 NH2 ARG A 121 -6.339 -4.470 -12.133 1.00 0.00 N ATOM 0 H ARG A 121 -7.328 -6.019 -6.636 1.00 0.00 H new ATOM 0 HA ARG A 121 -6.120 -3.684 -6.092 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -6.910 -4.543 -8.899 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -5.522 -3.574 -8.449 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -4.598 -5.525 -7.185 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -5.967 -6.488 -7.701 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -3.705 -5.376 -9.362 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -4.282 -7.027 -9.260 1.00 0.00 H new ATOM 0 HE ARG A 121 -5.996 -6.546 -10.808 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -4.245 -3.641 -9.832 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -4.932 -2.653 -11.125 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -6.873 -5.272 -12.468 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -6.414 -3.572 -12.612 1.00 0.00 H new ATOM 1808 N GLU A 122 -8.730 -2.978 -8.013 1.00 0.00 N ATOM 1809 CA GLU A 122 -9.674 -1.920 -8.359 1.00 0.00 C ATOM 1810 C GLU A 122 -10.235 -1.259 -7.104 1.00 0.00 C ATOM 1811 O GLU A 122 -10.206 -0.036 -6.966 1.00 0.00 O ATOM 1812 CB GLU A 122 -10.817 -2.485 -9.206 1.00 0.00 C ATOM 1813 CG GLU A 122 -10.373 -2.984 -10.570 1.00 0.00 C ATOM 1814 CD GLU A 122 -11.506 -3.011 -11.579 1.00 0.00 C ATOM 1815 OE1 GLU A 122 -12.251 -4.014 -11.607 1.00 0.00 O ATOM 1816 OE2 GLU A 122 -11.648 -2.031 -12.338 1.00 0.00 O ATOM 0 H GLU A 122 -8.858 -3.846 -8.534 1.00 0.00 H new ATOM 0 HA GLU A 122 -9.140 -1.166 -8.937 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -11.289 -3.305 -8.664 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -11.575 -1.713 -9.340 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -9.574 -2.344 -10.944 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -9.958 -3.987 -10.468 1.00 0.00 H new ATOM 1823 N LYS A 123 -10.746 -2.077 -6.189 1.00 0.00 N ATOM 1824 CA LYS A 123 -11.314 -1.574 -4.944 1.00 0.00 C ATOM 1825 C LYS A 123 -10.345 -0.622 -4.249 1.00 0.00 C ATOM 1826 O LYS A 123 -10.724 0.477 -3.845 1.00 0.00 O ATOM 1827 CB LYS A 123 -11.660 -2.736 -4.011 1.00 0.00 C ATOM 1828 CG LYS A 123 -12.165 -2.293 -2.649 1.00 0.00 C ATOM 1829 CD LYS A 123 -12.662 -3.472 -1.828 1.00 0.00 C ATOM 1830 CE LYS A 123 -14.135 -3.749 -2.086 1.00 0.00 C ATOM 1831 NZ LYS A 123 -14.535 -5.104 -1.613 1.00 0.00 N ATOM 0 H LYS A 123 -10.778 -3.092 -6.287 1.00 0.00 H new ATOM 0 HA LYS A 123 -12.225 -1.026 -5.185 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -12.419 -3.358 -4.486 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -10.775 -3.359 -3.876 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -11.365 -1.785 -2.111 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -12.972 -1.571 -2.776 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -12.076 -4.358 -2.071 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -12.509 -3.269 -0.768 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -14.740 -2.995 -1.582 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -14.340 -3.662 -3.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -15.482 -5.057 -1.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -14.550 -5.762 -2.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -13.852 -5.440 -0.904 1.00 0.00 H new ATOM 1845 N ILE A 124 -9.094 -1.052 -4.117 1.00 0.00 N ATOM 1846 CA ILE A 124 -8.071 -0.236 -3.474 1.00 0.00 C ATOM 1847 C ILE A 124 -8.032 1.167 -4.070 1.00 0.00 C ATOM 1848 O ILE A 124 -7.962 2.160 -3.344 1.00 0.00 O ATOM 1849 CB ILE A 124 -6.677 -0.876 -3.606 1.00 0.00 C ATOM 1850 CG1 ILE A 124 -6.593 -2.148 -2.759 1.00 0.00 C ATOM 1851 CG2 ILE A 124 -5.599 0.114 -3.191 1.00 0.00 C ATOM 1852 CD1 ILE A 124 -6.913 -1.924 -1.297 1.00 0.00 C ATOM 0 H ILE A 124 -8.765 -1.960 -4.446 1.00 0.00 H new ATOM 0 HA ILE A 124 -8.335 -0.172 -2.418 1.00 0.00 H new ATOM 0 HB ILE A 124 -6.515 -1.145 -4.650 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -7.281 -2.890 -3.164 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -5.589 -2.565 -2.843 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -4.619 -0.353 -3.290 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -5.648 0.995 -3.832 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -5.757 0.410 -2.154 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -6.834 -2.868 -0.758 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -6.209 -1.206 -0.876 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -7.927 -1.536 -1.202 1.00 0.00 H new ATOM 1864 N LYS A 125 -8.081 1.243 -5.395 1.00 0.00 N ATOM 1865 CA LYS A 125 -8.055 2.525 -6.090 1.00 0.00 C ATOM 1866 C LYS A 125 -9.210 3.412 -5.637 1.00 0.00 C ATOM 1867 O LYS A 125 -9.023 4.598 -5.362 1.00 0.00 O ATOM 1868 CB LYS A 125 -8.126 2.309 -7.603 1.00 0.00 C ATOM 1869 CG LYS A 125 -7.950 3.585 -8.407 1.00 0.00 C ATOM 1870 CD LYS A 125 -7.815 3.294 -9.893 1.00 0.00 C ATOM 1871 CE LYS A 125 -9.165 2.993 -10.527 1.00 0.00 C ATOM 1872 NZ LYS A 125 -9.816 4.225 -11.053 1.00 0.00 N ATOM 0 H LYS A 125 -8.139 0.431 -6.010 1.00 0.00 H new ATOM 0 HA LYS A 125 -7.118 3.025 -5.844 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -7.356 1.595 -7.896 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -9.088 1.861 -7.853 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -8.804 4.242 -8.240 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -7.065 4.117 -8.058 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -7.360 4.149 -10.392 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -7.146 2.446 -10.040 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -9.034 2.277 -11.338 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -9.816 2.524 -9.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -10.733 3.979 -11.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -9.964 4.899 -10.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -9.206 4.659 -11.775 1.00 0.00 H new ATOM 1886 N SER A 126 -10.403 2.832 -5.561 1.00 0.00 N ATOM 1887 CA SER A 126 -11.589 3.571 -5.143 1.00 0.00 C ATOM 1888 C SER A 126 -11.391 4.176 -3.757 1.00 0.00 C ATOM 1889 O SER A 126 -11.318 5.396 -3.603 1.00 0.00 O ATOM 1890 CB SER A 126 -12.814 2.655 -5.142 1.00 0.00 C ATOM 1891 OG SER A 126 -13.429 2.624 -6.419 1.00 0.00 O ATOM 0 H SER A 126 -10.574 1.851 -5.784 1.00 0.00 H new ATOM 0 HA SER A 126 -11.751 4.381 -5.854 1.00 0.00 H new ATOM 0 HB2 SER A 126 -12.518 1.647 -4.853 1.00 0.00 H new ATOM 0 HB3 SER A 126 -13.531 3.002 -4.398 1.00 0.00 H new ATOM 0 HG SER A 126 -14.208 2.030 -6.392 1.00 0.00 H new ATOM 1897 N LEU A 127 -11.306 3.314 -2.748 1.00 0.00 N ATOM 1898 CA LEU A 127 -11.117 3.762 -1.373 1.00 0.00 C ATOM 1899 C LEU A 127 -10.011 4.809 -1.289 1.00 0.00 C ATOM 1900 O LEU A 127 -10.203 5.884 -0.722 1.00 0.00 O ATOM 1901 CB LEU A 127 -10.780 2.574 -0.471 1.00 0.00 C ATOM 1902 CG LEU A 127 -11.750 1.393 -0.527 1.00 0.00 C ATOM 1903 CD1 LEU A 127 -11.156 0.181 0.174 1.00 0.00 C ATOM 1904 CD2 LEU A 127 -13.086 1.771 0.098 1.00 0.00 C ATOM 0 H LEU A 127 -11.365 2.302 -2.857 1.00 0.00 H new ATOM 0 HA LEU A 127 -12.048 4.216 -1.033 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -9.785 2.214 -0.734 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -10.729 2.928 0.559 1.00 0.00 H new ATOM 0 HG LEU A 127 -11.920 1.136 -1.572 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -11.860 -0.650 0.124 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -10.225 -0.103 -0.316 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -10.957 0.426 1.217 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -13.764 0.919 0.050 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -12.933 2.055 1.139 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -13.518 2.610 -0.447 1.00 0.00 H new ATOM 1916 N ALA A 128 -8.854 4.487 -1.858 1.00 0.00 N ATOM 1917 CA ALA A 128 -7.718 5.402 -1.850 1.00 0.00 C ATOM 1918 C ALA A 128 -8.159 6.826 -2.168 1.00 0.00 C ATOM 1919 O ALA A 128 -7.722 7.780 -1.525 1.00 0.00 O ATOM 1920 CB ALA A 128 -6.662 4.939 -2.842 1.00 0.00 C ATOM 0 H ALA A 128 -8.678 3.600 -2.330 1.00 0.00 H new ATOM 0 HA ALA A 128 -7.286 5.399 -0.849 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -5.820 5.631 -2.826 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -6.318 3.942 -2.568 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -7.091 4.912 -3.844 1.00 0.00 H new ATOM 1926 N SER A 129 -9.025 6.963 -3.167 1.00 0.00 N ATOM 1927 CA SER A 129 -9.521 8.273 -3.574 1.00 0.00 C ATOM 1928 C SER A 129 -10.114 9.024 -2.386 1.00 0.00 C ATOM 1929 O SER A 129 -9.823 10.200 -2.175 1.00 0.00 O ATOM 1930 CB SER A 129 -10.573 8.124 -4.675 1.00 0.00 C ATOM 1931 OG SER A 129 -10.141 7.217 -5.674 1.00 0.00 O ATOM 0 H SER A 129 -9.398 6.184 -3.709 1.00 0.00 H new ATOM 0 HA SER A 129 -8.680 8.848 -3.961 1.00 0.00 H new ATOM 0 HB2 SER A 129 -11.510 7.774 -4.242 1.00 0.00 H new ATOM 0 HB3 SER A 129 -10.774 9.096 -5.125 1.00 0.00 H new ATOM 0 HG SER A 129 -10.334 6.300 -5.389 1.00 0.00 H new ATOM 1937 N GLN A 130 -10.947 8.332 -1.614 1.00 0.00 N ATOM 1938 CA GLN A 130 -11.582 8.933 -0.447 1.00 0.00 C ATOM 1939 C GLN A 130 -10.548 9.606 0.449 1.00 0.00 C ATOM 1940 O GLN A 130 -10.638 10.801 0.728 1.00 0.00 O ATOM 1941 CB GLN A 130 -12.347 7.872 0.346 1.00 0.00 C ATOM 1942 CG GLN A 130 -13.661 7.460 -0.300 1.00 0.00 C ATOM 1943 CD GLN A 130 -14.500 8.649 -0.724 1.00 0.00 C ATOM 1944 OE1 GLN A 130 -14.406 9.730 -0.142 1.00 0.00 O ATOM 1945 NE2 GLN A 130 -15.328 8.454 -1.745 1.00 0.00 N ATOM 0 H GLN A 130 -11.197 7.356 -1.776 1.00 0.00 H new ATOM 0 HA GLN A 130 -12.283 9.692 -0.796 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -11.716 6.991 0.461 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -12.548 8.253 1.347 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -13.454 6.837 -1.170 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -14.230 6.850 0.401 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -15.373 7.541 -2.198 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -15.918 9.217 -2.076 1.00 0.00 H new ATOM 1954 N ALA A 131 -9.565 8.831 0.897 1.00 0.00 N ATOM 1955 CA ALA A 131 -8.513 9.353 1.760 1.00 0.00 C ATOM 1956 C ALA A 131 -7.672 10.396 1.032 1.00 0.00 C ATOM 1957 O ALA A 131 -7.248 11.391 1.623 1.00 0.00 O ATOM 1958 CB ALA A 131 -7.631 8.220 2.263 1.00 0.00 C ATOM 0 H ALA A 131 -9.476 7.839 0.676 1.00 0.00 H new ATOM 0 HA ALA A 131 -8.986 9.837 2.614 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -6.850 8.625 2.906 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -8.236 7.512 2.829 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -7.174 7.710 1.415 1.00 0.00 H new ATOM 1964 N THR A 132 -7.435 10.164 -0.256 1.00 0.00 N ATOM 1965 CA THR A 132 -6.644 11.084 -1.065 1.00 0.00 C ATOM 1966 C THR A 132 -7.313 12.449 -1.159 1.00 0.00 C ATOM 1967 O THR A 132 -6.807 13.437 -0.625 1.00 0.00 O ATOM 1968 CB THR A 132 -6.423 10.533 -2.486 1.00 0.00 C ATOM 1969 OG1 THR A 132 -5.786 9.252 -2.422 1.00 0.00 O ATOM 1970 CG2 THR A 132 -5.574 11.488 -3.310 1.00 0.00 C ATOM 0 H THR A 132 -7.779 9.347 -0.761 1.00 0.00 H new ATOM 0 HA THR A 132 -5.679 11.190 -0.570 1.00 0.00 H new ATOM 0 HB THR A 132 -7.396 10.430 -2.967 1.00 0.00 H new ATOM 0 HG1 THR A 132 -6.427 8.583 -2.103 1.00 0.00 H new ATOM 0 HG21 THR A 132 -5.431 11.078 -4.310 1.00 0.00 H new ATOM 0 HG22 THR A 132 -6.077 12.452 -3.382 1.00 0.00 H new ATOM 0 HG23 THR A 132 -4.604 11.619 -2.830 1.00 0.00 H new ATOM 1978 N ARG A 133 -8.453 12.499 -1.840 1.00 0.00 N ATOM 1979 CA ARG A 133 -9.192 13.745 -2.004 1.00 0.00 C ATOM 1980 C ARG A 133 -9.076 14.613 -0.754 1.00 0.00 C ATOM 1981 O ARG A 133 -8.672 15.774 -0.826 1.00 0.00 O ATOM 1982 CB ARG A 133 -10.663 13.455 -2.303 1.00 0.00 C ATOM 1983 CG ARG A 133 -11.424 14.656 -2.842 1.00 0.00 C ATOM 1984 CD ARG A 133 -12.646 14.229 -3.639 1.00 0.00 C ATOM 1985 NE ARG A 133 -13.231 15.342 -4.382 1.00 0.00 N ATOM 1986 CZ ARG A 133 -12.802 15.734 -5.577 1.00 0.00 C ATOM 1987 NH1 ARG A 133 -11.789 15.107 -6.160 1.00 0.00 N ATOM 1988 NH2 ARG A 133 -13.385 16.756 -6.190 1.00 0.00 N ATOM 0 H ARG A 133 -8.885 11.691 -2.287 1.00 0.00 H new ATOM 0 HA ARG A 133 -8.759 14.288 -2.844 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -10.724 12.642 -3.027 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -11.149 13.107 -1.391 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -11.733 15.294 -2.014 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -10.766 15.251 -3.474 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -12.367 13.436 -4.333 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -13.392 13.812 -2.963 1.00 0.00 H new ATOM 0 HE ARG A 133 -14.011 15.846 -3.961 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -11.337 14.322 -5.691 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -11.462 15.410 -7.077 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -14.163 17.242 -5.744 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -13.055 17.056 -7.107 1.00 0.00 H new ATOM 2002 N LYS A 134 -9.435 14.044 0.391 1.00 0.00 N ATOM 2003 CA LYS A 134 -9.374 14.764 1.657 1.00 0.00 C ATOM 2004 C LYS A 134 -8.069 15.545 1.775 1.00 0.00 C ATOM 2005 O LYS A 134 -7.128 15.322 1.010 1.00 0.00 O ATOM 2006 CB LYS A 134 -9.504 13.789 2.829 1.00 0.00 C ATOM 2007 CG LYS A 134 -10.226 14.375 4.030 1.00 0.00 C ATOM 2008 CD LYS A 134 -11.695 14.620 3.733 1.00 0.00 C ATOM 2009 CE LYS A 134 -12.239 15.792 4.536 1.00 0.00 C ATOM 2010 NZ LYS A 134 -13.633 16.136 4.140 1.00 0.00 N ATOM 0 H LYS A 134 -9.772 13.084 0.468 1.00 0.00 H new ATOM 0 HA LYS A 134 -10.204 15.470 1.686 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -10.037 12.900 2.493 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -8.509 13.467 3.135 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -10.134 13.696 4.878 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -9.751 15.313 4.319 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -11.824 14.816 2.669 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -12.268 13.722 3.964 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -12.213 15.548 5.598 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -11.596 16.660 4.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -13.968 16.939 4.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -13.654 16.394 3.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -14.252 15.316 4.301 1.00 0.00 H new ATOM 2024 N HIS A 135 -8.016 16.459 2.738 1.00 0.00 N ATOM 2025 CA HIS A 135 -6.824 17.272 2.956 1.00 0.00 C ATOM 2026 C HIS A 135 -5.564 16.504 2.568 1.00 0.00 C ATOM 2027 O HIS A 135 -5.054 15.696 3.342 1.00 0.00 O ATOM 2028 CB HIS A 135 -6.739 17.706 4.421 1.00 0.00 C ATOM 2029 CG HIS A 135 -7.519 18.950 4.722 1.00 0.00 C ATOM 2030 ND1 HIS A 135 -7.240 19.770 5.794 1.00 0.00 N ATOM 2031 CD2 HIS A 135 -8.571 19.511 4.084 1.00 0.00 C ATOM 2032 CE1 HIS A 135 -8.089 20.782 5.804 1.00 0.00 C ATOM 2033 NE2 HIS A 135 -8.907 20.649 4.775 1.00 0.00 N ATOM 0 H HIS A 135 -8.784 16.656 3.380 1.00 0.00 H new ATOM 0 HA HIS A 135 -6.898 18.158 2.325 1.00 0.00 H new ATOM 0 HB2 HIS A 135 -7.103 16.896 5.053 1.00 0.00 H new ATOM 0 HB3 HIS A 135 -5.694 17.870 4.683 1.00 0.00 H new ATOM 0 HD2 HIS A 135 -9.057 19.134 3.196 1.00 0.00 H new ATOM 0 HE1 HIS A 135 -8.111 21.582 6.530 1.00 0.00 H new ATOM 0 HE2 HIS A 135 -9.665 21.288 4.533 1.00 0.00 H new ATOM 2041 N GLY A 136 -5.068 16.763 1.361 1.00 0.00 N ATOM 2042 CA GLY A 136 -3.873 16.088 0.891 1.00 0.00 C ATOM 2043 C GLY A 136 -2.687 16.299 1.810 1.00 0.00 C ATOM 2044 O GLY A 136 -2.642 15.755 2.915 1.00 0.00 O ATOM 0 H GLY A 136 -5.473 17.428 0.702 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -4.074 15.020 0.802 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -3.624 16.450 -0.107 1.00 0.00 H new ATOM 2048 N THR A 137 -1.720 17.091 1.357 1.00 0.00 N ATOM 2049 CA THR A 137 -0.527 17.372 2.145 1.00 0.00 C ATOM 2050 C THR A 137 -0.845 17.388 3.636 1.00 0.00 C ATOM 2051 O THR A 137 -0.111 16.815 4.442 1.00 0.00 O ATOM 2052 CB THR A 137 0.103 18.721 1.751 1.00 0.00 C ATOM 2053 OG1 THR A 137 -0.803 19.790 2.050 1.00 0.00 O ATOM 2054 CG2 THR A 137 0.451 18.744 0.271 1.00 0.00 C ATOM 0 H THR A 137 -1.740 17.550 0.446 1.00 0.00 H new ATOM 0 HA THR A 137 0.185 16.573 1.936 1.00 0.00 H new ATOM 0 HB THR A 137 1.020 18.850 2.325 1.00 0.00 H new ATOM 0 HG1 THR A 137 -0.395 20.645 1.798 1.00 0.00 H new ATOM 0 HG21 THR A 137 0.894 19.707 0.016 1.00 0.00 H new ATOM 0 HG22 THR A 137 1.162 17.948 0.052 1.00 0.00 H new ATOM 0 HG23 THR A 137 -0.454 18.594 -0.318 1.00 0.00 H new ATOM 2062 N ASP A 138 -1.942 18.045 3.995 1.00 0.00 N ATOM 2063 CA ASP A 138 -2.357 18.133 5.390 1.00 0.00 C ATOM 2064 C ASP A 138 -2.928 16.803 5.873 1.00 0.00 C ATOM 2065 O ASP A 138 -4.132 16.561 5.777 1.00 0.00 O ATOM 2066 CB ASP A 138 -3.396 19.242 5.566 1.00 0.00 C ATOM 2067 CG ASP A 138 -2.789 20.626 5.452 1.00 0.00 C ATOM 2068 OD1 ASP A 138 -1.862 20.936 6.230 1.00 0.00 O ATOM 2069 OD2 ASP A 138 -3.241 21.401 4.583 1.00 0.00 O ATOM 0 H ASP A 138 -2.560 18.524 3.340 1.00 0.00 H new ATOM 0 HA ASP A 138 -1.478 18.370 5.990 1.00 0.00 H new ATOM 0 HB2 ASP A 138 -4.177 19.128 4.814 1.00 0.00 H new ATOM 0 HB3 ASP A 138 -3.874 19.137 6.540 1.00 0.00 H new ATOM 2074 N LEU A 139 -2.057 15.944 6.390 1.00 0.00 N ATOM 2075 CA LEU A 139 -2.474 14.637 6.887 1.00 0.00 C ATOM 2076 C LEU A 139 -3.880 14.701 7.474 1.00 0.00 C ATOM 2077 O LEU A 139 -4.098 15.306 8.524 1.00 0.00 O ATOM 2078 CB LEU A 139 -1.489 14.135 7.944 1.00 0.00 C ATOM 2079 CG LEU A 139 -0.200 13.505 7.416 1.00 0.00 C ATOM 2080 CD1 LEU A 139 0.879 14.563 7.244 1.00 0.00 C ATOM 2081 CD2 LEU A 139 0.277 12.401 8.349 1.00 0.00 C ATOM 0 H LEU A 139 -1.058 16.129 6.476 1.00 0.00 H new ATOM 0 HA LEU A 139 -2.483 13.941 6.048 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -1.223 14.972 8.590 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -1.999 13.401 8.568 1.00 0.00 H new ATOM 0 HG LEU A 139 -0.407 13.064 6.441 1.00 0.00 H new ATOM 0 HD11 LEU A 139 1.789 14.096 6.867 1.00 0.00 H new ATOM 0 HD12 LEU A 139 0.538 15.318 6.536 1.00 0.00 H new ATOM 0 HD13 LEU A 139 1.084 15.034 8.206 1.00 0.00 H new ATOM 0 HD21 LEU A 139 1.195 11.965 7.957 1.00 0.00 H new ATOM 0 HD22 LEU A 139 0.467 12.817 9.338 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -0.489 11.629 8.421 1.00 0.00 H new ATOM 2093 N TRP A 140 -4.830 14.073 6.792 1.00 0.00 N ATOM 2094 CA TRP A 140 -6.215 14.056 7.247 1.00 0.00 C ATOM 2095 C TRP A 140 -6.287 13.942 8.766 1.00 0.00 C ATOM 2096 O TRP A 140 -6.990 14.710 9.423 1.00 0.00 O ATOM 2097 CB TRP A 140 -6.973 12.897 6.599 1.00 0.00 C ATOM 2098 CG TRP A 140 -6.613 11.559 7.169 1.00 0.00 C ATOM 2099 CD1 TRP A 140 -7.259 10.895 8.173 1.00 0.00 C ATOM 2100 CD2 TRP A 140 -5.521 10.723 6.770 1.00 0.00 C ATOM 2101 NE1 TRP A 140 -6.634 9.697 8.422 1.00 0.00 N ATOM 2102 CE2 TRP A 140 -5.566 9.567 7.574 1.00 0.00 C ATOM 2103 CE3 TRP A 140 -4.512 10.837 5.811 1.00 0.00 C ATOM 2104 CZ2 TRP A 140 -4.639 8.536 7.447 1.00 0.00 C ATOM 2105 CZ3 TRP A 140 -3.592 9.813 5.686 1.00 0.00 C ATOM 2106 CH2 TRP A 140 -3.661 8.675 6.499 1.00 0.00 C ATOM 0 H TRP A 140 -4.667 13.568 5.921 1.00 0.00 H new ATOM 0 HA TRP A 140 -6.681 14.995 6.949 1.00 0.00 H new ATOM 0 HB2 TRP A 140 -8.044 13.060 6.721 1.00 0.00 H new ATOM 0 HB3 TRP A 140 -6.771 12.894 5.528 1.00 0.00 H new ATOM 0 HD1 TRP A 140 -8.132 11.258 8.694 1.00 0.00 H new ATOM 0 HE1 TRP A 140 -6.919 9.015 9.125 1.00 0.00 H new ATOM 0 HE3 TRP A 140 -4.452 11.710 5.178 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 -4.690 7.658 8.074 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 -2.807 9.892 4.949 1.00 0.00 H new ATOM 0 HH2 TRP A 140 -2.928 7.891 6.376 1.00 0.00 H new ATOM 2117 N LEU A 141 -5.558 12.977 9.317 1.00 0.00 N ATOM 2118 CA LEU A 141 -5.539 12.762 10.760 1.00 0.00 C ATOM 2119 C LEU A 141 -4.652 13.792 11.452 1.00 0.00 C ATOM 2120 O LEU A 141 -3.930 14.545 10.798 1.00 0.00 O ATOM 2121 CB LEU A 141 -5.045 11.350 11.077 1.00 0.00 C ATOM 2122 CG LEU A 141 -3.529 11.158 11.097 1.00 0.00 C ATOM 2123 CD1 LEU A 141 -3.132 10.151 12.166 1.00 0.00 C ATOM 2124 CD2 LEU A 141 -3.031 10.710 9.730 1.00 0.00 C ATOM 0 H LEU A 141 -4.973 12.332 8.787 1.00 0.00 H new ATOM 0 HA LEU A 141 -6.556 12.877 11.134 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -5.441 11.058 12.050 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -5.468 10.665 10.342 1.00 0.00 H new ATOM 0 HG LEU A 141 -3.064 12.114 11.337 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -2.049 10.027 12.165 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -3.455 10.511 13.143 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -3.607 9.192 11.957 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -1.949 10.578 9.762 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -3.504 9.765 9.462 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -3.282 11.466 8.986 1.00 0.00 H new ATOM 2136 N ASP A 142 -4.709 13.817 12.779 1.00 0.00 N ATOM 2137 CA ASP A 142 -3.908 14.751 13.562 1.00 0.00 C ATOM 2138 C ASP A 142 -2.466 14.778 13.066 1.00 0.00 C ATOM 2139 O ASP A 142 -1.691 13.857 13.327 1.00 0.00 O ATOM 2140 CB ASP A 142 -3.944 14.371 15.043 1.00 0.00 C ATOM 2141 CG ASP A 142 -5.339 14.460 15.629 1.00 0.00 C ATOM 2142 OD1 ASP A 142 -6.130 13.515 15.422 1.00 0.00 O ATOM 2143 OD2 ASP A 142 -5.640 15.472 16.295 1.00 0.00 O ATOM 0 H ASP A 142 -5.302 13.201 13.335 1.00 0.00 H new ATOM 0 HA ASP A 142 -4.334 15.747 13.441 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -3.566 13.356 15.164 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -3.276 15.028 15.600 1.00 0.00 H new ATOM 2148 N SER A 143 -2.112 15.840 12.348 1.00 0.00 N ATOM 2149 CA SER A 143 -0.764 15.984 11.811 1.00 0.00 C ATOM 2150 C SER A 143 0.229 16.319 12.919 1.00 0.00 C ATOM 2151 O SER A 143 0.233 17.431 13.449 1.00 0.00 O ATOM 2152 CB SER A 143 -0.734 17.073 10.737 1.00 0.00 C ATOM 2153 OG SER A 143 0.537 17.142 10.114 1.00 0.00 O ATOM 0 H SER A 143 -2.740 16.612 12.125 1.00 0.00 H new ATOM 0 HA SER A 143 -0.474 15.034 11.363 1.00 0.00 H new ATOM 0 HB2 SER A 143 -1.499 16.870 9.988 1.00 0.00 H new ATOM 0 HB3 SER A 143 -0.975 18.037 11.185 1.00 0.00 H new ATOM 0 HG SER A 143 0.529 17.845 9.431 1.00 0.00 H new ATOM 2159 N SER A 144 1.071 15.351 13.264 1.00 0.00 N ATOM 2160 CA SER A 144 2.067 15.541 14.312 1.00 0.00 C ATOM 2161 C SER A 144 3.443 15.813 13.711 1.00 0.00 C ATOM 2162 O SER A 144 3.836 15.189 12.726 1.00 0.00 O ATOM 2163 CB SER A 144 2.128 14.309 15.218 1.00 0.00 C ATOM 2164 OG SER A 144 2.804 13.240 14.579 1.00 0.00 O ATOM 0 H SER A 144 1.084 14.427 12.833 1.00 0.00 H new ATOM 0 HA SER A 144 1.772 16.406 14.907 1.00 0.00 H new ATOM 0 HB2 SER A 144 2.638 14.562 16.148 1.00 0.00 H new ATOM 0 HB3 SER A 144 1.117 13.998 15.483 1.00 0.00 H new ATOM 0 HG SER A 144 2.831 12.465 15.179 1.00 0.00 H new ATOM 2170 N GLY A 145 4.170 16.748 14.313 1.00 0.00 N ATOM 2171 CA GLY A 145 5.495 17.087 13.825 1.00 0.00 C ATOM 2172 C GLY A 145 5.690 18.581 13.668 1.00 0.00 C ATOM 2173 O GLY A 145 4.887 19.387 14.140 1.00 0.00 O ATOM 0 H GLY A 145 3.866 17.277 15.130 1.00 0.00 H new ATOM 0 HA2 GLY A 145 6.244 16.696 14.514 1.00 0.00 H new ATOM 0 HA3 GLY A 145 5.661 16.599 12.864 1.00 0.00 H new ATOM 2177 N PRO A 146 6.780 18.971 12.991 1.00 0.00 N ATOM 2178 CA PRO A 146 7.105 20.383 12.759 1.00 0.00 C ATOM 2179 C PRO A 146 6.140 21.046 11.781 1.00 0.00 C ATOM 2180 O PRO A 146 5.234 20.400 11.254 1.00 0.00 O ATOM 2181 CB PRO A 146 8.515 20.330 12.166 1.00 0.00 C ATOM 2182 CG PRO A 146 8.613 18.979 11.544 1.00 0.00 C ATOM 2183 CD PRO A 146 7.780 18.067 12.400 1.00 0.00 C ATOM 0 HA PRO A 146 7.034 20.973 13.673 1.00 0.00 H new ATOM 0 HB2 PRO A 146 8.664 21.118 11.428 1.00 0.00 H new ATOM 0 HB3 PRO A 146 9.274 20.467 12.936 1.00 0.00 H new ATOM 0 HG2 PRO A 146 8.246 18.994 10.518 1.00 0.00 H new ATOM 0 HG3 PRO A 146 9.649 18.641 11.507 1.00 0.00 H new ATOM 0 HD2 PRO A 146 7.311 17.280 11.810 1.00 0.00 H new ATOM 0 HD3 PRO A 146 8.380 17.576 13.166 1.00 0.00 H new ATOM 2191 N SER A 147 6.342 22.338 11.544 1.00 0.00 N ATOM 2192 CA SER A 147 5.487 23.090 10.632 1.00 0.00 C ATOM 2193 C SER A 147 5.827 22.766 9.179 1.00 0.00 C ATOM 2194 O SER A 147 6.585 23.489 8.533 1.00 0.00 O ATOM 2195 CB SER A 147 5.636 24.591 10.880 1.00 0.00 C ATOM 2196 OG SER A 147 7.000 24.978 10.864 1.00 0.00 O ATOM 0 H SER A 147 7.089 22.886 11.970 1.00 0.00 H new ATOM 0 HA SER A 147 4.453 22.800 10.819 1.00 0.00 H new ATOM 0 HB2 SER A 147 5.089 25.145 10.117 1.00 0.00 H new ATOM 0 HB3 SER A 147 5.193 24.850 11.842 1.00 0.00 H new ATOM 0 HG SER A 147 7.430 24.627 10.056 1.00 0.00 H new ATOM 2202 N SER A 148 5.258 21.677 8.674 1.00 0.00 N ATOM 2203 CA SER A 148 5.503 21.254 7.299 1.00 0.00 C ATOM 2204 C SER A 148 4.405 20.312 6.818 1.00 0.00 C ATOM 2205 O SER A 148 3.827 19.561 7.604 1.00 0.00 O ATOM 2206 CB SER A 148 6.866 20.569 7.190 1.00 0.00 C ATOM 2207 OG SER A 148 7.920 21.510 7.281 1.00 0.00 O ATOM 0 H SER A 148 4.624 21.071 9.195 1.00 0.00 H new ATOM 0 HA SER A 148 5.499 22.140 6.665 1.00 0.00 H new ATOM 0 HB2 SER A 148 6.968 19.827 7.982 1.00 0.00 H new ATOM 0 HB3 SER A 148 6.933 20.035 6.242 1.00 0.00 H new ATOM 0 HG SER A 148 7.549 22.401 7.452 1.00 0.00 H new ATOM 2213 N GLY A 149 4.123 20.356 5.519 1.00 0.00 N ATOM 2214 CA GLY A 149 3.096 19.500 4.954 1.00 0.00 C ATOM 2215 C GLY A 149 2.792 19.838 3.507 1.00 0.00 C ATOM 2216 O GLY A 149 3.643 19.611 2.648 1.00 0.00 O ATOM 0 H GLY A 149 4.587 20.969 4.849 1.00 0.00 H new ATOM 0 HA2 GLY A 149 3.416 18.460 5.022 1.00 0.00 H new ATOM 0 HA3 GLY A 149 2.185 19.592 5.545 1.00 0.00 H new TER 2220 GLY A 149 HETATM 2221 ZN ZN A 401 7.573 -12.966 2.142 1.00 0.00 ZN