USER MOD reduce.3.24.130724 H: found=0, std=0, add=848, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 704 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 111 LYS NZ :NH3+ -140:sc= -0.359 (180deg=-0.291) USER MOD Set 1.2: A 112 HIS : no HD1:sc= -6.33! C(o=-6.7!,f=-7.4!) USER MOD Set 2.1: A 57 HIS :FLIP no HD1:sc= -4.67! C(o=-5!,f=-4.7!) USER MOD Set 2.2: A 74 ASN :FLIP amide:sc= -0.0558 F(o=-5.3,f=-4.7) USER MOD Set 3.1: A 28 ASN :FLIP amide:sc= -11.4! C(o=-18!,f=-15!) USER MOD Set 3.2: A 71 CYS SG : rot -43:sc= -3.82 USER MOD Set 3.3: A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc=-0.00944 K(o=-0.0094,f=-0.58) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 HIS : no HD1:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 68 MET CE :methyl -131:sc= -3.31! (180deg=-10.8!) USER MOD Single : A 70 CYS SG : rot -18:sc= -3.5! USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ -119:sc= -0.109 (180deg=-0.822) USER MOD Single : A 96 MET CE :methyl -159:sc= 0 (180deg=-0.264) USER MOD Single : A 98 LYS NZ :NH3+ -165:sc=-9.54e-05 (180deg=-0.103) USER MOD Single : A 100 GLN : amide:sc= -0.119 K(o=-0.12,f=-0.86) USER MOD Single : A 102 ASN : amide:sc= -0.0119 X(o=-0.012,f=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 ASN : amide:sc=-0.00321 X(o=-0.0032,f=0) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 ASN : amide:sc= -0.0145 X(o=-0.015,f=0.47) USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 63:sc= -9.27! USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 ASN : amide:sc= -0.165 K(o=-0.16,f=-1.8!) USER MOD Single : A 136 ASN : amide:sc= -0.348 K(o=-0.35,f=-3.2!) USER MOD Single : A 138 MET CE :methyl 174:sc= -7.66! (180deg=-7.98!) USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 145 GLN : amide:sc= -1.93! C(o=-1.9!,f=-2.4!) USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 SER OG : rot 157:sc= 0.976 USER MOD Single : A 149 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 60 N GLN A 26 -7.388 9.509 -4.813 1.00 0.00 N ATOM 61 CA GLN A 26 -7.898 9.437 -6.172 1.00 0.00 C ATOM 62 C GLN A 26 -7.003 10.243 -7.117 1.00 0.00 C ATOM 63 O GLN A 26 -7.065 10.071 -8.333 1.00 0.00 O ATOM 64 CB GLN A 26 -9.347 9.922 -6.241 1.00 0.00 C ATOM 65 CG GLN A 26 -10.310 8.844 -5.739 1.00 0.00 C ATOM 66 CD GLN A 26 -11.112 8.243 -6.896 1.00 0.00 C ATOM 67 OE1 GLN A 26 -10.589 7.557 -7.757 1.00 0.00 O ATOM 68 NE2 GLN A 26 -12.408 8.539 -6.866 1.00 0.00 N ATOM 0 HA GLN A 26 -7.884 8.395 -6.490 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -9.461 10.825 -5.641 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -9.597 10.188 -7.268 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -9.750 8.058 -5.233 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -10.991 9.273 -5.004 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -12.781 9.120 -6.115 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -13.029 8.185 -7.594 1.00 0.00 H new ATOM 75 N LYS A 27 -6.195 11.107 -6.522 1.00 0.00 N ATOM 76 CA LYS A 27 -5.289 11.940 -7.294 1.00 0.00 C ATOM 77 C LYS A 27 -3.917 11.268 -7.363 1.00 0.00 C ATOM 78 O LYS A 27 -2.909 11.930 -7.604 1.00 0.00 O ATOM 79 CB LYS A 27 -5.251 13.360 -6.726 1.00 0.00 C ATOM 80 CG LYS A 27 -6.157 14.297 -7.528 1.00 0.00 C ATOM 81 CD LYS A 27 -7.631 14.045 -7.204 1.00 0.00 C ATOM 82 CE LYS A 27 -8.301 13.224 -8.308 1.00 0.00 C ATOM 83 NZ LYS A 27 -8.926 14.116 -9.311 1.00 0.00 N ATOM 0 H LYS A 27 -6.149 11.249 -5.513 1.00 0.00 H new ATOM 0 HA LYS A 27 -5.646 12.041 -8.319 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -5.568 13.347 -5.683 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -4.228 13.735 -6.743 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -5.904 15.333 -7.304 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -5.985 14.150 -8.594 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -7.713 13.519 -6.253 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -8.150 14.997 -7.088 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -7.563 12.584 -8.792 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -9.057 12.569 -7.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -9.376 13.543 -10.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -9.644 14.709 -8.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -8.197 14.724 -9.737 1.00 0.00 H new ATOM 93 N ASN A 28 -3.923 9.961 -7.148 1.00 0.00 N ATOM 94 CA ASN A 28 -2.690 9.192 -7.183 1.00 0.00 C ATOM 95 C ASN A 28 -2.981 7.794 -7.733 1.00 0.00 C ATOM 96 O ASN A 28 -2.191 6.871 -7.546 1.00 0.00 O ATOM 97 CB ASN A 28 -2.101 9.033 -5.779 1.00 0.00 C ATOM 98 CG ASN A 28 -0.688 8.450 -5.841 1.00 0.00 C ATOM 99 OD1 ASN A 28 -0.024 8.516 -4.690 1.00 0.00 O flip ATOM 100 ND2 ASN A 28 -0.230 7.971 -6.866 1.00 0.00 N flip ATOM 0 H ASN A 28 -4.761 9.415 -6.949 1.00 0.00 H new ATOM 0 HA ASN A 28 -1.979 9.723 -7.816 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -2.077 10.001 -5.279 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -2.741 8.382 -5.184 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -0.793 7.952 -7.716 1.00 0.00 H new ATOM 0 HD22 ASN A 28 0.716 7.590 -6.873 1.00 0.00 H new ATOM 106 N ILE A 29 -4.120 7.682 -8.403 1.00 0.00 N ATOM 107 CA ILE A 29 -4.525 6.413 -8.983 1.00 0.00 C ATOM 108 C ILE A 29 -4.563 6.542 -10.507 1.00 0.00 C ATOM 109 O ILE A 29 -4.555 7.651 -11.040 1.00 0.00 O ATOM 110 CB ILE A 29 -5.847 5.944 -8.372 1.00 0.00 C ATOM 111 CG1 ILE A 29 -6.905 7.047 -8.440 1.00 0.00 C ATOM 112 CG2 ILE A 29 -5.641 5.433 -6.945 1.00 0.00 C ATOM 113 CD1 ILE A 29 -7.181 7.454 -9.888 1.00 0.00 C ATOM 0 H ILE A 29 -4.774 8.449 -8.557 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.797 5.636 -8.747 1.00 0.00 H new ATOM 0 HB ILE A 29 -6.218 5.106 -8.963 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -7.827 6.700 -7.974 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -6.568 7.915 -7.873 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -6.596 5.106 -6.534 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -4.944 4.595 -6.956 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -5.235 6.234 -6.327 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -7.937 8.239 -9.907 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -6.262 7.823 -10.344 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -7.541 6.590 -10.446 1.00 0.00 H new ATOM 124 N ASP A 30 -4.603 5.393 -11.166 1.00 0.00 N ATOM 125 CA ASP A 30 -4.642 5.364 -12.617 1.00 0.00 C ATOM 126 C ASP A 30 -6.049 4.978 -13.078 1.00 0.00 C ATOM 127 O ASP A 30 -6.840 5.839 -13.460 1.00 0.00 O ATOM 128 CB ASP A 30 -3.662 4.331 -13.174 1.00 0.00 C ATOM 129 CG ASP A 30 -4.110 3.644 -14.466 1.00 0.00 C ATOM 130 OD1 ASP A 30 -4.607 4.372 -15.352 1.00 0.00 O ATOM 131 OD2 ASP A 30 -3.945 2.407 -14.539 1.00 0.00 O ATOM 0 H ASP A 30 -4.609 4.475 -10.721 1.00 0.00 H new ATOM 0 HA ASP A 30 -4.367 6.354 -12.981 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -2.705 4.821 -13.354 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -3.492 3.568 -12.415 1.00 0.00 H new ATOM 135 N GLY A 31 -6.319 3.681 -13.026 1.00 0.00 N ATOM 136 CA GLY A 31 -7.617 3.171 -13.432 1.00 0.00 C ATOM 137 C GLY A 31 -8.485 2.847 -12.214 1.00 0.00 C ATOM 138 O GLY A 31 -9.586 2.317 -12.355 1.00 0.00 O ATOM 0 H GLY A 31 -5.661 2.969 -12.709 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.122 3.908 -14.057 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -7.486 2.275 -14.038 1.00 0.00 H new ATOM 142 N TRP A 32 -7.956 3.179 -11.046 1.00 0.00 N ATOM 143 CA TRP A 32 -8.669 2.931 -9.804 1.00 0.00 C ATOM 144 C TRP A 32 -9.519 1.671 -9.990 1.00 0.00 C ATOM 145 O TRP A 32 -10.661 1.616 -9.535 1.00 0.00 O ATOM 146 CB TRP A 32 -9.494 4.152 -9.391 1.00 0.00 C ATOM 147 CG TRP A 32 -10.496 3.876 -8.269 1.00 0.00 C ATOM 148 CD1 TRP A 32 -11.782 3.513 -8.382 1.00 0.00 C ATOM 149 CD2 TRP A 32 -10.243 3.956 -6.851 1.00 0.00 C ATOM 150 NE1 TRP A 32 -12.372 3.354 -7.145 1.00 0.00 N ATOM 151 CE2 TRP A 32 -11.407 3.632 -6.185 1.00 0.00 C ATOM 152 CE3 TRP A 32 -9.069 4.291 -6.154 1.00 0.00 C ATOM 153 CZ2 TRP A 32 -11.511 3.610 -4.789 1.00 0.00 C ATOM 154 CZ3 TRP A 32 -9.189 4.266 -4.759 1.00 0.00 C ATOM 155 CH2 TRP A 32 -10.354 3.941 -4.073 1.00 0.00 C ATOM 0 H TRP A 32 -7.042 3.618 -10.933 1.00 0.00 H new ATOM 0 HA TRP A 32 -7.969 2.762 -8.985 1.00 0.00 H new ATOM 0 HB2 TRP A 32 -8.817 4.944 -9.072 1.00 0.00 H new ATOM 0 HB3 TRP A 32 -10.033 4.525 -10.262 1.00 0.00 H new ATOM 0 HD1 TRP A 32 -12.292 3.364 -9.323 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -13.339 3.082 -6.968 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -8.147 4.547 -6.655 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -12.434 3.352 -4.291 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -8.316 4.517 -4.175 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -10.366 3.944 -2.993 1.00 0.00 H new ATOM 300 N PHE A 44 -10.747 2.730 2.785 1.00 0.00 N ATOM 301 CA PHE A 44 -9.333 2.751 3.116 1.00 0.00 C ATOM 302 C PHE A 44 -9.102 2.303 4.560 1.00 0.00 C ATOM 303 O PHE A 44 -9.074 3.127 5.474 1.00 0.00 O ATOM 304 CB PHE A 44 -8.858 4.197 2.962 1.00 0.00 C ATOM 305 CG PHE A 44 -9.495 5.171 3.956 1.00 0.00 C ATOM 306 CD1 PHE A 44 -10.772 5.600 3.766 1.00 0.00 C ATOM 307 CD2 PHE A 44 -8.784 5.607 5.031 1.00 0.00 C ATOM 308 CE1 PHE A 44 -11.362 6.502 4.688 1.00 0.00 C ATOM 309 CE2 PHE A 44 -9.375 6.510 5.953 1.00 0.00 C ATOM 310 CZ PHE A 44 -10.652 6.939 5.762 1.00 0.00 C ATOM 0 HA PHE A 44 -8.788 2.072 2.461 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -7.775 4.228 3.082 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -9.076 4.534 1.949 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -11.337 5.254 2.913 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -7.770 5.266 5.183 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -12.376 6.842 4.537 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -8.811 6.857 6.806 1.00 0.00 H new ATOM 0 HZ PHE A 44 -11.102 7.626 6.463 1.00 0.00 H new ATOM 319 N ILE A 45 -8.941 0.997 4.723 1.00 0.00 N ATOM 320 CA ILE A 45 -8.713 0.429 6.041 1.00 0.00 C ATOM 321 C ILE A 45 -7.552 1.164 6.714 1.00 0.00 C ATOM 322 O ILE A 45 -7.700 1.687 7.816 1.00 0.00 O ATOM 323 CB ILE A 45 -8.510 -1.084 5.944 1.00 0.00 C ATOM 324 CG1 ILE A 45 -9.851 -1.811 5.831 1.00 0.00 C ATOM 325 CG2 ILE A 45 -7.675 -1.602 7.116 1.00 0.00 C ATOM 326 CD1 ILE A 45 -9.732 -3.260 6.311 1.00 0.00 C ATOM 0 H ILE A 45 -8.964 0.316 3.964 1.00 0.00 H new ATOM 0 HA ILE A 45 -9.589 0.570 6.674 1.00 0.00 H new ATOM 0 HB ILE A 45 -7.951 -1.295 5.032 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -10.603 -1.289 6.423 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -10.192 -1.794 4.796 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -7.546 -2.680 7.022 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -6.699 -1.118 7.109 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -8.185 -1.378 8.053 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -10.699 -3.754 6.220 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -8.997 -3.786 5.702 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -9.415 -3.273 7.354 1.00 0.00 H new ATOM 337 N MET A 46 -6.422 1.178 6.022 1.00 0.00 N ATOM 338 CA MET A 46 -5.236 1.839 6.539 1.00 0.00 C ATOM 339 C MET A 46 -4.722 2.892 5.556 1.00 0.00 C ATOM 340 O MET A 46 -4.554 2.610 4.370 1.00 0.00 O ATOM 341 CB MET A 46 -4.142 0.801 6.793 1.00 0.00 C ATOM 342 CG MET A 46 -3.519 0.328 5.478 1.00 0.00 C ATOM 343 SD MET A 46 -2.272 -0.907 5.802 1.00 0.00 S ATOM 344 CE MET A 46 -0.816 0.125 5.845 1.00 0.00 C ATOM 0 H MET A 46 -6.303 0.742 5.108 1.00 0.00 H new ATOM 0 HA MET A 46 -5.499 2.338 7.472 1.00 0.00 H new ATOM 0 HB2 MET A 46 -3.370 1.230 7.432 1.00 0.00 H new ATOM 0 HB3 MET A 46 -4.561 -0.051 7.328 1.00 0.00 H new ATOM 0 HG2 MET A 46 -4.291 -0.085 4.828 1.00 0.00 H new ATOM 0 HG3 MET A 46 -3.077 1.173 4.951 1.00 0.00 H new ATOM 0 HE1 MET A 46 0.062 -0.492 6.039 1.00 0.00 H new ATOM 0 HE2 MET A 46 -0.700 0.630 4.886 1.00 0.00 H new ATOM 0 HE3 MET A 46 -0.920 0.867 6.636 1.00 0.00 H new ATOM 352 N GLU A 47 -4.487 4.085 6.083 1.00 0.00 N ATOM 353 CA GLU A 47 -3.996 5.182 5.266 1.00 0.00 C ATOM 354 C GLU A 47 -2.570 5.552 5.677 1.00 0.00 C ATOM 355 O GLU A 47 -2.344 6.027 6.788 1.00 0.00 O ATOM 356 CB GLU A 47 -4.926 6.393 5.359 1.00 0.00 C ATOM 357 CG GLU A 47 -5.219 6.749 6.819 1.00 0.00 C ATOM 358 CD GLU A 47 -5.185 8.264 7.031 1.00 0.00 C ATOM 359 OE1 GLU A 47 -5.659 8.976 6.119 1.00 0.00 O ATOM 360 OE2 GLU A 47 -4.687 8.676 8.100 1.00 0.00 O ATOM 0 H GLU A 47 -4.628 4.316 7.066 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.980 4.857 4.226 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -4.469 7.246 4.858 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -5.860 6.180 4.839 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -6.197 6.360 7.103 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -4.485 6.271 7.468 1.00 0.00 H new ATOM 365 N GLY A 48 -1.645 5.321 4.757 1.00 0.00 N ATOM 366 CA GLY A 48 -0.247 5.624 5.010 1.00 0.00 C ATOM 367 C GLY A 48 0.584 5.482 3.733 1.00 0.00 C ATOM 368 O GLY A 48 0.160 4.828 2.782 1.00 0.00 O ATOM 0 H GLY A 48 -1.836 4.928 3.836 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -0.155 6.639 5.397 1.00 0.00 H new ATOM 0 HA3 GLY A 48 0.141 4.954 5.777 1.00 0.00 H new ATOM 372 N THR A 49 1.752 6.107 3.752 1.00 0.00 N ATOM 373 CA THR A 49 2.647 6.058 2.608 1.00 0.00 C ATOM 374 C THR A 49 3.948 5.345 2.978 1.00 0.00 C ATOM 375 O THR A 49 4.622 5.730 3.931 1.00 0.00 O ATOM 376 CB THR A 49 2.859 7.491 2.113 1.00 0.00 C ATOM 377 OG1 THR A 49 4.221 7.517 1.697 1.00 0.00 O ATOM 378 CG2 THR A 49 2.795 8.517 3.246 1.00 0.00 C ATOM 0 H THR A 49 2.100 6.650 4.542 1.00 0.00 H new ATOM 0 HA THR A 49 2.216 5.477 1.793 1.00 0.00 H new ATOM 0 HB THR A 49 2.105 7.731 1.363 1.00 0.00 H new ATOM 0 HG1 THR A 49 4.443 8.410 1.360 1.00 0.00 H new ATOM 0 HG21 THR A 49 2.952 9.517 2.841 1.00 0.00 H new ATOM 0 HG22 THR A 49 1.817 8.469 3.726 1.00 0.00 H new ATOM 0 HG23 THR A 49 3.570 8.297 3.980 1.00 0.00 H new ATOM 386 N LEU A 50 4.262 4.317 2.203 1.00 0.00 N ATOM 387 CA LEU A 50 5.471 3.545 2.437 1.00 0.00 C ATOM 388 C LEU A 50 6.440 3.758 1.273 1.00 0.00 C ATOM 389 O LEU A 50 6.018 3.879 0.124 1.00 0.00 O ATOM 390 CB LEU A 50 5.128 2.075 2.690 1.00 0.00 C ATOM 391 CG LEU A 50 4.218 1.796 3.888 1.00 0.00 C ATOM 392 CD1 LEU A 50 2.765 2.149 3.568 1.00 0.00 C ATOM 393 CD2 LEU A 50 4.366 0.348 4.363 1.00 0.00 C ATOM 0 H LEU A 50 3.700 4.001 1.413 1.00 0.00 H new ATOM 0 HA LEU A 50 5.975 3.891 3.340 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.651 1.674 1.795 1.00 0.00 H new ATOM 0 HB3 LEU A 50 6.058 1.524 2.829 1.00 0.00 H new ATOM 0 HG LEU A 50 4.530 2.439 4.711 1.00 0.00 H new ATOM 0 HD11 LEU A 50 2.140 1.941 4.437 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.695 3.207 3.316 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.423 1.551 2.723 1.00 0.00 H new ATOM 0 HD21 LEU A 50 3.709 0.176 5.215 1.00 0.00 H new ATOM 0 HD22 LEU A 50 4.096 -0.330 3.553 1.00 0.00 H new ATOM 0 HD23 LEU A 50 5.399 0.166 4.659 1.00 0.00 H new ATOM 404 N THR A 51 7.720 3.798 1.611 1.00 0.00 N ATOM 405 CA THR A 51 8.754 3.994 0.608 1.00 0.00 C ATOM 406 C THR A 51 9.329 2.648 0.164 1.00 0.00 C ATOM 407 O THR A 51 9.487 1.739 0.977 1.00 0.00 O ATOM 408 CB THR A 51 9.803 4.943 1.190 1.00 0.00 C ATOM 409 OG1 THR A 51 9.493 6.205 0.607 1.00 0.00 O ATOM 410 CG2 THR A 51 11.215 4.635 0.684 1.00 0.00 C ATOM 0 H THR A 51 8.065 3.698 2.566 1.00 0.00 H new ATOM 0 HA THR A 51 8.348 4.450 -0.295 1.00 0.00 H new ATOM 0 HB THR A 51 9.785 4.880 2.278 1.00 0.00 H new ATOM 0 HG1 THR A 51 10.125 6.880 0.932 1.00 0.00 H new ATOM 0 HG21 THR A 51 11.921 5.337 1.127 1.00 0.00 H new ATOM 0 HG22 THR A 51 11.489 3.618 0.966 1.00 0.00 H new ATOM 0 HG23 THR A 51 11.241 4.730 -0.402 1.00 0.00 H new ATOM 418 N ARG A 52 9.628 2.565 -1.124 1.00 0.00 N ATOM 419 CA ARG A 52 10.183 1.345 -1.686 1.00 0.00 C ATOM 420 C ARG A 52 11.711 1.421 -1.715 1.00 0.00 C ATOM 421 O ARG A 52 12.288 2.079 -2.580 1.00 0.00 O ATOM 422 CB ARG A 52 9.665 1.106 -3.105 1.00 0.00 C ATOM 423 CG ARG A 52 9.690 -0.383 -3.455 1.00 0.00 C ATOM 424 CD ARG A 52 10.369 -0.617 -4.806 1.00 0.00 C ATOM 425 NE ARG A 52 11.388 -1.683 -4.683 1.00 0.00 N ATOM 426 CZ ARG A 52 11.840 -2.414 -5.712 1.00 0.00 C ATOM 427 NH1 ARG A 52 11.366 -2.197 -6.946 1.00 0.00 N ATOM 428 NH2 ARG A 52 12.766 -3.360 -5.506 1.00 0.00 N ATOM 0 H ARG A 52 9.497 3.322 -1.794 1.00 0.00 H new ATOM 0 HA ARG A 52 9.868 0.516 -1.052 1.00 0.00 H new ATOM 0 HB2 ARG A 52 8.648 1.487 -3.193 1.00 0.00 H new ATOM 0 HB3 ARG A 52 10.276 1.661 -3.817 1.00 0.00 H new ATOM 0 HG2 ARG A 52 10.219 -0.934 -2.678 1.00 0.00 H new ATOM 0 HG3 ARG A 52 8.672 -0.771 -3.484 1.00 0.00 H new ATOM 0 HD2 ARG A 52 9.626 -0.898 -5.552 1.00 0.00 H new ATOM 0 HD3 ARG A 52 10.836 0.305 -5.152 1.00 0.00 H new ATOM 0 HE ARG A 52 11.771 -1.874 -3.757 1.00 0.00 H new ATOM 0 HH11 ARG A 52 10.662 -1.476 -7.102 1.00 0.00 H new ATOM 0 HH12 ARG A 52 11.709 -2.753 -7.729 1.00 0.00 H new ATOM 0 HH21 ARG A 52 13.127 -3.524 -4.566 1.00 0.00 H new ATOM 0 HH22 ARG A 52 13.110 -3.916 -6.289 1.00 0.00 H new ATOM 439 N VAL A 53 12.324 0.740 -0.758 1.00 0.00 N ATOM 440 CA VAL A 53 13.774 0.722 -0.663 1.00 0.00 C ATOM 441 C VAL A 53 14.323 -0.417 -1.524 1.00 0.00 C ATOM 442 O VAL A 53 14.734 -1.452 -1.003 1.00 0.00 O ATOM 443 CB VAL A 53 14.201 0.622 0.803 1.00 0.00 C ATOM 444 CG1 VAL A 53 15.482 -0.202 0.946 1.00 0.00 C ATOM 445 CG2 VAL A 53 14.372 2.012 1.420 1.00 0.00 C ATOM 0 H VAL A 53 11.843 0.196 -0.041 1.00 0.00 H new ATOM 0 HA VAL A 53 14.193 1.652 -1.047 1.00 0.00 H new ATOM 0 HB VAL A 53 13.409 0.108 1.348 1.00 0.00 H new ATOM 0 HG11 VAL A 53 15.763 -0.257 1.998 1.00 0.00 H new ATOM 0 HG12 VAL A 53 15.312 -1.208 0.562 1.00 0.00 H new ATOM 0 HG13 VAL A 53 16.284 0.272 0.380 1.00 0.00 H new ATOM 0 HG21 VAL A 53 14.676 1.913 2.462 1.00 0.00 H new ATOM 0 HG22 VAL A 53 15.136 2.563 0.870 1.00 0.00 H new ATOM 0 HG23 VAL A 53 13.427 2.552 1.367 1.00 0.00 H new ATOM 455 N GLY A 54 14.313 -0.188 -2.829 1.00 0.00 N ATOM 456 CA GLY A 54 14.805 -1.182 -3.768 1.00 0.00 C ATOM 457 C GLY A 54 15.118 -0.547 -5.125 1.00 0.00 C ATOM 458 O GLY A 54 15.101 -1.225 -6.150 1.00 0.00 O ATOM 0 H GLY A 54 13.972 0.672 -3.259 1.00 0.00 H new ATOM 0 HA2 GLY A 54 15.703 -1.653 -3.367 1.00 0.00 H new ATOM 0 HA3 GLY A 54 14.061 -1.969 -3.893 1.00 0.00 H new ATOM 462 N ALA A 55 15.398 0.748 -5.085 1.00 0.00 N ATOM 463 CA ALA A 55 15.715 1.482 -6.299 1.00 0.00 C ATOM 464 C ALA A 55 15.584 2.982 -6.031 1.00 0.00 C ATOM 465 O ALA A 55 16.204 3.795 -6.715 1.00 0.00 O ATOM 466 CB ALA A 55 14.804 1.010 -7.433 1.00 0.00 C ATOM 0 H ALA A 55 15.412 1.307 -4.232 1.00 0.00 H new ATOM 0 HA ALA A 55 16.743 1.291 -6.606 1.00 0.00 H new ATOM 0 HB1 ALA A 55 15.041 1.560 -8.343 1.00 0.00 H new ATOM 0 HB2 ALA A 55 14.957 -0.056 -7.603 1.00 0.00 H new ATOM 0 HB3 ALA A 55 13.763 1.189 -7.162 1.00 0.00 H new ATOM 472 N LYS A 56 14.773 3.305 -5.035 1.00 0.00 N ATOM 473 CA LYS A 56 14.552 4.693 -4.667 1.00 0.00 C ATOM 474 C LYS A 56 13.238 5.177 -5.285 1.00 0.00 C ATOM 475 O LYS A 56 13.242 5.829 -6.327 1.00 0.00 O ATOM 476 CB LYS A 56 15.763 5.547 -5.050 1.00 0.00 C ATOM 477 CG LYS A 56 15.814 6.830 -4.218 1.00 0.00 C ATOM 478 CD LYS A 56 16.898 6.741 -3.141 1.00 0.00 C ATOM 479 CE LYS A 56 18.146 7.524 -3.554 1.00 0.00 C ATOM 480 NZ LYS A 56 19.369 6.749 -3.247 1.00 0.00 N ATOM 0 H LYS A 56 14.260 2.628 -4.470 1.00 0.00 H new ATOM 0 HA LYS A 56 14.451 4.790 -3.586 1.00 0.00 H new ATOM 0 HB2 LYS A 56 16.678 4.975 -4.899 1.00 0.00 H new ATOM 0 HB3 LYS A 56 15.715 5.798 -6.110 1.00 0.00 H new ATOM 0 HG2 LYS A 56 16.011 7.682 -4.868 1.00 0.00 H new ATOM 0 HG3 LYS A 56 14.845 7.004 -3.750 1.00 0.00 H new ATOM 0 HD2 LYS A 56 16.513 7.133 -2.199 1.00 0.00 H new ATOM 0 HD3 LYS A 56 17.160 5.697 -2.969 1.00 0.00 H new ATOM 0 HE2 LYS A 56 18.107 7.746 -4.620 1.00 0.00 H new ATOM 0 HE3 LYS A 56 18.173 8.480 -3.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 20.207 7.295 -3.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 19.412 6.559 -2.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 19.349 5.848 -3.766 1.00 0.00 H new ATOM 490 N HIS A 57 12.147 4.839 -4.614 1.00 0.00 N ATOM 491 CA HIS A 57 10.829 5.231 -5.085 1.00 0.00 C ATOM 492 C HIS A 57 9.818 5.105 -3.943 1.00 0.00 C ATOM 493 O HIS A 57 9.974 4.260 -3.061 1.00 0.00 O ATOM 494 CB HIS A 57 10.430 4.422 -6.320 1.00 0.00 C ATOM 495 CG HIS A 57 11.288 4.692 -7.533 1.00 0.00 C ATOM 496 ND1 HIS A 57 12.399 4.052 -8.000 1.00 0.00 N flip ATOM 497 CD2 HIS A 57 11.033 5.726 -8.417 1.00 0.00 C flip ATOM 498 CE1 HIS A 57 12.801 4.662 -9.108 1.00 0.00 C flip ATOM 499 NE2 HIS A 57 11.956 5.700 -9.368 1.00 0.00 N flip ATOM 0 H HIS A 57 12.148 4.299 -3.749 1.00 0.00 H new ATOM 0 HA HIS A 57 10.846 6.275 -5.396 1.00 0.00 H new ATOM 0 HB2 HIS A 57 10.483 3.360 -6.079 1.00 0.00 H new ATOM 0 HB3 HIS A 57 9.391 4.642 -6.566 1.00 0.00 H new ATOM 0 HD2 HIS A 57 10.220 6.434 -8.344 1.00 0.00 H new ATOM 0 HE1 HIS A 57 13.656 4.382 -9.705 1.00 0.00 H new ATOM 0 HE2 HIS A 57 12.022 6.344 -10.156 1.00 0.00 H new ATOM 506 N GLU A 58 8.806 5.957 -3.994 1.00 0.00 N ATOM 507 CA GLU A 58 7.770 5.953 -2.975 1.00 0.00 C ATOM 508 C GLU A 58 6.432 5.524 -3.580 1.00 0.00 C ATOM 509 O GLU A 58 6.299 5.433 -4.799 1.00 0.00 O ATOM 510 CB GLU A 58 7.654 7.323 -2.304 1.00 0.00 C ATOM 511 CG GLU A 58 9.032 7.962 -2.119 1.00 0.00 C ATOM 512 CD GLU A 58 9.222 9.142 -3.073 1.00 0.00 C ATOM 513 OE1 GLU A 58 8.898 8.965 -4.267 1.00 0.00 O ATOM 514 OE2 GLU A 58 9.687 10.196 -2.587 1.00 0.00 O ATOM 0 H GLU A 58 8.681 6.656 -4.726 1.00 0.00 H new ATOM 0 HA GLU A 58 8.047 5.232 -2.206 1.00 0.00 H new ATOM 0 HB2 GLU A 58 7.025 7.976 -2.909 1.00 0.00 H new ATOM 0 HB3 GLU A 58 7.165 7.217 -1.335 1.00 0.00 H new ATOM 0 HG2 GLU A 58 9.144 8.301 -1.089 1.00 0.00 H new ATOM 0 HG3 GLU A 58 9.809 7.218 -2.296 1.00 0.00 H new ATOM 519 N ARG A 59 5.475 5.270 -2.700 1.00 0.00 N ATOM 520 CA ARG A 59 4.152 4.853 -3.132 1.00 0.00 C ATOM 521 C ARG A 59 3.142 5.030 -1.995 1.00 0.00 C ATOM 522 O ARG A 59 3.354 4.533 -0.890 1.00 0.00 O ATOM 523 CB ARG A 59 4.155 3.390 -3.580 1.00 0.00 C ATOM 524 CG ARG A 59 4.612 2.470 -2.446 1.00 0.00 C ATOM 525 CD ARG A 59 5.672 1.483 -2.935 1.00 0.00 C ATOM 526 NE ARG A 59 5.023 0.271 -3.481 1.00 0.00 N ATOM 527 CZ ARG A 59 5.586 -0.542 -4.386 1.00 0.00 C ATOM 528 NH1 ARG A 59 6.812 -0.275 -4.854 1.00 0.00 N ATOM 529 NH2 ARG A 59 4.921 -1.620 -4.824 1.00 0.00 N ATOM 0 H ARG A 59 5.590 5.345 -1.689 1.00 0.00 H new ATOM 0 HA ARG A 59 3.866 5.479 -3.977 1.00 0.00 H new ATOM 0 HB2 ARG A 59 3.155 3.103 -3.905 1.00 0.00 H new ATOM 0 HB3 ARG A 59 4.816 3.270 -4.439 1.00 0.00 H new ATOM 0 HG2 ARG A 59 5.016 3.067 -1.629 1.00 0.00 H new ATOM 0 HG3 ARG A 59 3.757 1.923 -2.049 1.00 0.00 H new ATOM 0 HD2 ARG A 59 6.290 1.951 -3.701 1.00 0.00 H new ATOM 0 HD3 ARG A 59 6.334 1.212 -2.113 1.00 0.00 H new ATOM 0 HE ARG A 59 4.087 0.039 -3.148 1.00 0.00 H new ATOM 0 HH11 ARG A 59 7.317 0.547 -4.522 1.00 0.00 H new ATOM 0 HH12 ARG A 59 7.241 -0.893 -5.543 1.00 0.00 H new ATOM 0 HH21 ARG A 59 3.986 -1.822 -4.469 1.00 0.00 H new ATOM 0 HH22 ARG A 59 5.349 -2.239 -5.513 1.00 0.00 H new ATOM 540 N HIS A 60 2.066 5.736 -2.308 1.00 0.00 N ATOM 541 CA HIS A 60 1.023 5.983 -1.326 1.00 0.00 C ATOM 542 C HIS A 60 0.221 4.701 -1.096 1.00 0.00 C ATOM 543 O HIS A 60 -0.596 4.318 -1.931 1.00 0.00 O ATOM 544 CB HIS A 60 0.147 7.164 -1.751 1.00 0.00 C ATOM 545 CG HIS A 60 0.114 8.295 -0.751 1.00 0.00 C ATOM 546 ND1 HIS A 60 1.056 9.308 -0.735 1.00 0.00 N ATOM 547 CD2 HIS A 60 -0.756 8.563 0.264 1.00 0.00 C ATOM 548 CE1 HIS A 60 0.757 10.142 0.251 1.00 0.00 C ATOM 549 NE2 HIS A 60 -0.366 9.678 0.869 1.00 0.00 N ATOM 0 H HIS A 60 1.893 6.145 -3.226 1.00 0.00 H new ATOM 0 HA HIS A 60 1.473 6.264 -0.374 1.00 0.00 H new ATOM 0 HB2 HIS A 60 0.509 7.547 -2.705 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -0.870 6.808 -1.915 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -1.617 7.968 0.531 1.00 0.00 H new ATOM 0 HE1 HIS A 60 1.307 11.033 0.518 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -0.830 10.116 1.665 1.00 0.00 H new ATOM 556 N ILE A 61 0.482 4.075 0.041 1.00 0.00 N ATOM 557 CA ILE A 61 -0.206 2.844 0.392 1.00 0.00 C ATOM 558 C ILE A 61 -1.614 3.176 0.891 1.00 0.00 C ATOM 559 O ILE A 61 -1.791 4.084 1.701 1.00 0.00 O ATOM 560 CB ILE A 61 0.624 2.031 1.387 1.00 0.00 C ATOM 561 CG1 ILE A 61 1.984 1.659 0.793 1.00 0.00 C ATOM 562 CG2 ILE A 61 -0.148 0.801 1.868 1.00 0.00 C ATOM 563 CD1 ILE A 61 1.832 1.130 -0.635 1.00 0.00 C ATOM 0 H ILE A 61 1.160 4.397 0.732 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.321 2.208 -0.486 1.00 0.00 H new ATOM 0 HB ILE A 61 0.815 2.653 2.261 1.00 0.00 H new ATOM 0 HG12 ILE A 61 2.636 2.532 0.794 1.00 0.00 H new ATOM 0 HG13 ILE A 61 2.462 0.903 1.416 1.00 0.00 H new ATOM 0 HG21 ILE A 61 0.464 0.240 2.574 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.069 1.118 2.358 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.390 0.167 1.015 1.00 0.00 H new ATOM 0 HD11 ILE A 61 2.813 0.873 -1.034 1.00 0.00 H new ATOM 0 HD12 ILE A 61 1.199 0.243 -0.629 1.00 0.00 H new ATOM 0 HD13 ILE A 61 1.376 1.897 -1.261 1.00 0.00 H new ATOM 574 N PHE A 62 -2.579 2.420 0.388 1.00 0.00 N ATOM 575 CA PHE A 62 -3.966 2.623 0.773 1.00 0.00 C ATOM 576 C PHE A 62 -4.745 1.307 0.731 1.00 0.00 C ATOM 577 O PHE A 62 -5.430 1.018 -0.248 1.00 0.00 O ATOM 578 CB PHE A 62 -4.573 3.594 -0.241 1.00 0.00 C ATOM 579 CG PHE A 62 -5.344 4.754 0.393 1.00 0.00 C ATOM 580 CD1 PHE A 62 -4.899 5.315 1.549 1.00 0.00 C ATOM 581 CD2 PHE A 62 -6.476 5.223 -0.199 1.00 0.00 C ATOM 582 CE1 PHE A 62 -5.615 6.391 2.137 1.00 0.00 C ATOM 583 CE2 PHE A 62 -7.192 6.299 0.389 1.00 0.00 C ATOM 584 CZ PHE A 62 -6.746 6.861 1.546 1.00 0.00 C ATOM 0 H PHE A 62 -2.428 1.666 -0.282 1.00 0.00 H new ATOM 0 HA PHE A 62 -4.017 3.012 1.790 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -3.775 3.999 -0.864 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -5.243 3.043 -0.900 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -4.001 4.942 2.020 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -6.830 4.777 -1.117 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -5.261 6.837 3.055 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -8.090 6.671 -0.081 1.00 0.00 H new ATOM 0 HZ PHE A 62 -7.290 7.679 1.994 1.00 0.00 H new ATOM 593 N LEU A 63 -4.612 0.544 1.806 1.00 0.00 N ATOM 594 CA LEU A 63 -5.296 -0.734 1.905 1.00 0.00 C ATOM 595 C LEU A 63 -6.794 -0.494 2.100 1.00 0.00 C ATOM 596 O LEU A 63 -7.193 0.294 2.955 1.00 0.00 O ATOM 597 CB LEU A 63 -4.663 -1.597 3.000 1.00 0.00 C ATOM 598 CG LEU A 63 -5.572 -1.958 4.177 1.00 0.00 C ATOM 599 CD1 LEU A 63 -6.713 -2.873 3.728 1.00 0.00 C ATOM 600 CD2 LEU A 63 -4.765 -2.568 5.325 1.00 0.00 C ATOM 0 H LEU A 63 -4.041 0.786 2.616 1.00 0.00 H new ATOM 0 HA LEU A 63 -5.182 -1.299 0.980 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -4.305 -2.521 2.546 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -3.789 -1.074 3.388 1.00 0.00 H new ATOM 0 HG LEU A 63 -6.025 -1.041 4.554 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -7.344 -3.114 4.583 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -7.309 -2.366 2.969 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -6.300 -3.792 3.311 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -5.434 -2.816 6.149 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -4.266 -3.473 4.978 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -4.019 -1.851 5.667 1.00 0.00 H new ATOM 611 N PHE A 64 -7.582 -1.188 1.292 1.00 0.00 N ATOM 612 CA PHE A 64 -9.028 -1.061 1.365 1.00 0.00 C ATOM 613 C PHE A 64 -9.659 -2.312 1.980 1.00 0.00 C ATOM 614 O PHE A 64 -9.104 -3.405 1.879 1.00 0.00 O ATOM 615 CB PHE A 64 -9.535 -0.901 -0.069 1.00 0.00 C ATOM 616 CG PHE A 64 -8.967 0.319 -0.798 1.00 0.00 C ATOM 617 CD1 PHE A 64 -8.214 1.227 -0.121 1.00 0.00 C ATOM 618 CD2 PHE A 64 -9.214 0.495 -2.124 1.00 0.00 C ATOM 619 CE1 PHE A 64 -7.686 2.358 -0.797 1.00 0.00 C ATOM 620 CE2 PHE A 64 -8.686 1.627 -2.800 1.00 0.00 C ATOM 621 CZ PHE A 64 -7.933 2.534 -2.122 1.00 0.00 C ATOM 0 H PHE A 64 -7.247 -1.840 0.583 1.00 0.00 H new ATOM 0 HA PHE A 64 -9.295 -0.208 1.989 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -9.284 -1.799 -0.634 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -10.622 -0.828 -0.053 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -8.018 1.087 0.932 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -9.811 -0.226 -2.663 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -7.088 3.079 -0.259 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -8.883 1.767 -3.853 1.00 0.00 H new ATOM 0 HZ PHE A 64 -7.531 3.394 -2.636 1.00 0.00 H new ATOM 630 N ASP A 65 -10.810 -2.109 2.604 1.00 0.00 N ATOM 631 CA ASP A 65 -11.522 -3.207 3.235 1.00 0.00 C ATOM 632 C ASP A 65 -11.889 -4.247 2.175 1.00 0.00 C ATOM 633 O ASP A 65 -12.286 -5.363 2.507 1.00 0.00 O ATOM 634 CB ASP A 65 -12.817 -2.720 3.889 1.00 0.00 C ATOM 635 CG ASP A 65 -13.221 -3.469 5.160 1.00 0.00 C ATOM 636 OD1 ASP A 65 -12.802 -4.640 5.286 1.00 0.00 O ATOM 637 OD2 ASP A 65 -13.942 -2.855 5.976 1.00 0.00 O ATOM 0 H ASP A 65 -11.267 -1.201 2.686 1.00 0.00 H new ATOM 0 HA ASP A 65 -10.872 -3.636 3.998 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -12.710 -1.662 4.127 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -13.626 -2.803 3.164 1.00 0.00 H new ATOM 641 N GLY A 66 -11.744 -3.844 0.921 1.00 0.00 N ATOM 642 CA GLY A 66 -12.054 -4.729 -0.189 1.00 0.00 C ATOM 643 C GLY A 66 -10.791 -5.409 -0.719 1.00 0.00 C ATOM 644 O GLY A 66 -10.836 -6.558 -1.156 1.00 0.00 O ATOM 0 H GLY A 66 -11.416 -2.917 0.649 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -12.770 -5.485 0.133 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -12.529 -4.161 -0.989 1.00 0.00 H new ATOM 648 N LEU A 67 -9.692 -4.670 -0.663 1.00 0.00 N ATOM 649 CA LEU A 67 -8.418 -5.188 -1.133 1.00 0.00 C ATOM 650 C LEU A 67 -7.315 -4.175 -0.820 1.00 0.00 C ATOM 651 O LEU A 67 -7.589 -2.991 -0.629 1.00 0.00 O ATOM 652 CB LEU A 67 -8.506 -5.563 -2.614 1.00 0.00 C ATOM 653 CG LEU A 67 -7.939 -4.540 -3.600 1.00 0.00 C ATOM 654 CD1 LEU A 67 -6.429 -4.720 -3.769 1.00 0.00 C ATOM 655 CD2 LEU A 67 -8.677 -4.601 -4.938 1.00 0.00 C ATOM 0 H LEU A 67 -9.658 -3.718 -0.300 1.00 0.00 H new ATOM 0 HA LEU A 67 -8.164 -6.109 -0.609 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -7.983 -6.508 -2.761 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -9.553 -5.736 -2.863 1.00 0.00 H new ATOM 0 HG LEU A 67 -8.100 -3.543 -3.189 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -6.051 -3.980 -4.475 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -5.937 -4.587 -2.806 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -6.222 -5.721 -4.147 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -8.254 -3.864 -5.621 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -8.570 -5.597 -5.368 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -9.734 -4.386 -4.781 1.00 0.00 H new ATOM 666 N MET A 68 -6.089 -4.677 -0.776 1.00 0.00 N ATOM 667 CA MET A 68 -4.944 -3.831 -0.489 1.00 0.00 C ATOM 668 C MET A 68 -4.429 -3.154 -1.761 1.00 0.00 C ATOM 669 O MET A 68 -4.033 -3.828 -2.711 1.00 0.00 O ATOM 670 CB MET A 68 -3.827 -4.676 0.126 1.00 0.00 C ATOM 671 CG MET A 68 -4.159 -5.056 1.571 1.00 0.00 C ATOM 672 SD MET A 68 -2.658 -5.217 2.522 1.00 0.00 S ATOM 673 CE MET A 68 -2.053 -3.539 2.431 1.00 0.00 C ATOM 0 H MET A 68 -5.864 -5.659 -0.934 1.00 0.00 H new ATOM 0 HA MET A 68 -5.255 -3.057 0.212 1.00 0.00 H new ATOM 0 HB2 MET A 68 -3.681 -5.579 -0.467 1.00 0.00 H new ATOM 0 HB3 MET A 68 -2.889 -4.121 0.098 1.00 0.00 H new ATOM 0 HG2 MET A 68 -4.802 -4.297 2.017 1.00 0.00 H new ATOM 0 HG3 MET A 68 -4.714 -5.994 1.590 1.00 0.00 H new ATOM 0 HE1 MET A 68 -1.003 -3.546 2.137 1.00 0.00 H new ATOM 0 HE2 MET A 68 -2.633 -2.983 1.694 1.00 0.00 H new ATOM 0 HE3 MET A 68 -2.153 -3.063 3.406 1.00 0.00 H new ATOM 681 N ILE A 69 -4.454 -1.830 -1.739 1.00 0.00 N ATOM 682 CA ILE A 69 -3.995 -1.054 -2.879 1.00 0.00 C ATOM 683 C ILE A 69 -2.695 -0.335 -2.512 1.00 0.00 C ATOM 684 O ILE A 69 -2.509 0.071 -1.366 1.00 0.00 O ATOM 685 CB ILE A 69 -5.100 -0.115 -3.368 1.00 0.00 C ATOM 686 CG1 ILE A 69 -4.745 1.346 -3.083 1.00 0.00 C ATOM 687 CG2 ILE A 69 -6.453 -0.502 -2.769 1.00 0.00 C ATOM 688 CD1 ILE A 69 -3.626 1.828 -4.009 1.00 0.00 C ATOM 0 H ILE A 69 -4.785 -1.274 -0.950 1.00 0.00 H new ATOM 0 HA ILE A 69 -3.770 -1.710 -3.720 1.00 0.00 H new ATOM 0 HB ILE A 69 -5.184 -0.221 -4.450 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -5.628 1.971 -3.217 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -4.433 1.452 -2.044 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -7.221 0.181 -3.133 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -6.704 -1.521 -3.065 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -6.400 -0.443 -1.682 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -3.392 2.869 -3.786 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -2.737 1.216 -3.855 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -3.950 1.743 -5.046 1.00 0.00 H new ATOM 699 N CYS A 70 -1.830 -0.199 -3.505 1.00 0.00 N ATOM 700 CA CYS A 70 -0.553 0.463 -3.302 1.00 0.00 C ATOM 701 C CYS A 70 -0.229 1.279 -4.555 1.00 0.00 C ATOM 702 O CYS A 70 0.359 0.759 -5.502 1.00 0.00 O ATOM 703 CB CYS A 70 0.556 -0.536 -2.967 1.00 0.00 C ATOM 704 SG CYS A 70 -0.021 -1.706 -1.685 1.00 0.00 S ATOM 0 H CYS A 70 -1.988 -0.537 -4.454 1.00 0.00 H new ATOM 0 HA CYS A 70 -0.620 1.131 -2.443 1.00 0.00 H new ATOM 0 HB2 CYS A 70 0.848 -1.082 -3.864 1.00 0.00 H new ATOM 0 HB3 CYS A 70 1.441 -0.005 -2.615 1.00 0.00 H new ATOM 0 HG CYS A 70 -1.063 -1.212 -1.084 1.00 0.00 H new ATOM 709 N CYS A 71 -0.626 2.542 -4.520 1.00 0.00 N ATOM 710 CA CYS A 71 -0.385 3.433 -5.642 1.00 0.00 C ATOM 711 C CYS A 71 1.064 3.917 -5.568 1.00 0.00 C ATOM 712 O CYS A 71 1.518 4.374 -4.521 1.00 0.00 O ATOM 713 CB CYS A 71 -1.375 4.600 -5.660 1.00 0.00 C ATOM 714 SG CYS A 71 -1.041 5.727 -4.258 1.00 0.00 S ATOM 0 H CYS A 71 -1.113 2.970 -3.732 1.00 0.00 H new ATOM 0 HA CYS A 71 -0.541 2.895 -6.577 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -1.292 5.143 -6.601 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -2.396 4.223 -5.598 1.00 0.00 H new ATOM 0 HG CYS A 71 -0.817 5.029 -3.184 1.00 0.00 H new ATOM 719 N LYS A 72 1.752 3.799 -6.696 1.00 0.00 N ATOM 720 CA LYS A 72 3.141 4.219 -6.771 1.00 0.00 C ATOM 721 C LYS A 72 3.201 5.728 -7.015 1.00 0.00 C ATOM 722 O LYS A 72 2.204 6.339 -7.392 1.00 0.00 O ATOM 723 CB LYS A 72 3.891 3.396 -7.821 1.00 0.00 C ATOM 724 CG LYS A 72 5.404 3.472 -7.599 1.00 0.00 C ATOM 725 CD LYS A 72 6.139 2.469 -8.489 1.00 0.00 C ATOM 726 CE LYS A 72 7.648 2.720 -8.468 1.00 0.00 C ATOM 727 NZ LYS A 72 8.250 2.376 -9.775 1.00 0.00 N ATOM 0 H LYS A 72 1.373 3.419 -7.564 1.00 0.00 H new ATOM 0 HA LYS A 72 3.649 4.029 -5.826 1.00 0.00 H new ATOM 0 HB2 LYS A 72 3.565 2.357 -7.775 1.00 0.00 H new ATOM 0 HB3 LYS A 72 3.647 3.763 -8.818 1.00 0.00 H new ATOM 0 HG2 LYS A 72 5.757 4.481 -7.814 1.00 0.00 H new ATOM 0 HG3 LYS A 72 5.632 3.271 -6.552 1.00 0.00 H new ATOM 0 HD2 LYS A 72 5.931 1.455 -8.149 1.00 0.00 H new ATOM 0 HD3 LYS A 72 5.768 2.545 -9.511 1.00 0.00 H new ATOM 0 HE2 LYS A 72 7.845 3.766 -8.235 1.00 0.00 H new ATOM 0 HE3 LYS A 72 8.110 2.125 -7.680 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 9.274 2.553 -9.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 8.078 1.372 -9.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 7.821 2.962 -10.520 1.00 0.00 H new ATOM 737 N SER A 73 4.382 6.285 -6.788 1.00 0.00 N ATOM 738 CA SER A 73 4.585 7.711 -6.977 1.00 0.00 C ATOM 739 C SER A 73 6.045 8.073 -6.698 1.00 0.00 C ATOM 740 O SER A 73 6.651 7.548 -5.765 1.00 0.00 O ATOM 741 CB SER A 73 3.654 8.525 -6.076 1.00 0.00 C ATOM 742 OG SER A 73 3.691 8.074 -4.724 1.00 0.00 O ATOM 0 H SER A 73 5.208 5.774 -6.475 1.00 0.00 H new ATOM 0 HA SER A 73 4.348 7.956 -8.012 1.00 0.00 H new ATOM 0 HB2 SER A 73 3.939 9.576 -6.115 1.00 0.00 H new ATOM 0 HB3 SER A 73 2.634 8.457 -6.453 1.00 0.00 H new ATOM 0 HG SER A 73 3.085 8.620 -4.180 1.00 0.00 H new ATOM 747 N ASN A 74 6.568 8.968 -7.523 1.00 0.00 N ATOM 748 CA ASN A 74 7.945 9.407 -7.377 1.00 0.00 C ATOM 749 C ASN A 74 8.018 10.921 -7.580 1.00 0.00 C ATOM 750 O ASN A 74 8.610 11.632 -6.770 1.00 0.00 O ATOM 751 CB ASN A 74 8.848 8.745 -8.420 1.00 0.00 C ATOM 752 CG ASN A 74 10.315 9.113 -8.188 1.00 0.00 C ATOM 753 OD1 ASN A 74 10.875 8.481 -7.162 1.00 0.00 O flip ATOM 754 ND2 ASN A 74 10.899 9.918 -8.895 1.00 0.00 N flip ATOM 0 H ASN A 74 6.062 9.401 -8.296 1.00 0.00 H new ATOM 0 HA ASN A 74 8.283 9.129 -6.379 1.00 0.00 H new ATOM 0 HB2 ASN A 74 8.729 7.662 -8.374 1.00 0.00 H new ATOM 0 HB3 ASN A 74 8.545 9.057 -9.419 1.00 0.00 H new ATOM 0 HD21 ASN A 74 10.409 10.368 -9.668 1.00 0.00 H new ATOM 0 HD22 ASN A 74 11.878 10.141 -8.713 1.00 0.00 H new ATOM 899 N ALA A 86 -2.423 11.969 -10.958 1.00 0.00 N ATOM 900 CA ALA A 86 -2.397 10.672 -10.303 1.00 0.00 C ATOM 901 C ALA A 86 -0.969 10.363 -9.850 1.00 0.00 C ATOM 902 O ALA A 86 -0.514 9.225 -9.950 1.00 0.00 O ATOM 903 CB ALA A 86 -2.950 9.608 -11.254 1.00 0.00 C ATOM 0 HA ALA A 86 -3.031 10.677 -9.416 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -2.930 8.635 -10.763 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -3.976 9.858 -11.523 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -2.338 9.572 -12.155 1.00 0.00 H new ATOM 909 N GLU A 87 -0.302 11.397 -9.359 1.00 0.00 N ATOM 910 CA GLU A 87 1.065 11.251 -8.889 1.00 0.00 C ATOM 911 C GLU A 87 1.832 10.274 -9.783 1.00 0.00 C ATOM 912 O GLU A 87 2.839 10.640 -10.387 1.00 0.00 O ATOM 913 CB GLU A 87 1.097 10.797 -7.427 1.00 0.00 C ATOM 914 CG GLU A 87 0.024 11.515 -6.607 1.00 0.00 C ATOM 915 CD GLU A 87 0.198 11.236 -5.113 1.00 0.00 C ATOM 916 OE1 GLU A 87 1.255 10.669 -4.761 1.00 0.00 O ATOM 917 OE2 GLU A 87 -0.728 11.597 -4.356 1.00 0.00 O ATOM 0 H GLU A 87 -0.683 12.340 -9.276 1.00 0.00 H new ATOM 0 HA GLU A 87 1.553 12.224 -8.944 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.941 9.720 -7.373 1.00 0.00 H new ATOM 0 HB3 GLU A 87 2.080 10.998 -7.001 1.00 0.00 H new ATOM 0 HG2 GLU A 87 0.080 12.588 -6.789 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -0.965 11.188 -6.929 1.00 0.00 H new ATOM 922 N TYR A 88 1.327 9.050 -9.838 1.00 0.00 N ATOM 923 CA TYR A 88 1.952 8.019 -10.648 1.00 0.00 C ATOM 924 C TYR A 88 0.905 7.053 -11.209 1.00 0.00 C ATOM 925 O TYR A 88 0.602 7.084 -12.401 1.00 0.00 O ATOM 926 CB TYR A 88 2.885 7.253 -9.708 1.00 0.00 C ATOM 927 CG TYR A 88 4.349 7.251 -10.152 1.00 0.00 C ATOM 928 CD1 TYR A 88 4.865 8.333 -10.833 1.00 0.00 C ATOM 929 CD2 TYR A 88 5.153 6.165 -9.869 1.00 0.00 C ATOM 930 CE1 TYR A 88 6.244 8.331 -11.250 1.00 0.00 C ATOM 931 CE2 TYR A 88 6.532 6.163 -10.286 1.00 0.00 C ATOM 932 CZ TYR A 88 7.009 7.246 -10.955 1.00 0.00 C ATOM 933 OH TYR A 88 8.311 7.244 -11.349 1.00 0.00 O ATOM 0 H TYR A 88 0.492 8.750 -9.335 1.00 0.00 H new ATOM 0 HA TYR A 88 2.481 8.461 -11.492 1.00 0.00 H new ATOM 0 HB2 TYR A 88 2.819 7.689 -8.711 1.00 0.00 H new ATOM 0 HB3 TYR A 88 2.538 6.223 -9.629 1.00 0.00 H new ATOM 0 HD1 TYR A 88 4.235 9.182 -11.054 1.00 0.00 H new ATOM 0 HD2 TYR A 88 4.749 5.318 -9.335 1.00 0.00 H new ATOM 0 HE1 TYR A 88 6.661 9.172 -11.785 1.00 0.00 H new ATOM 0 HE2 TYR A 88 7.172 5.320 -10.072 1.00 0.00 H new ATOM 0 HH TYR A 88 8.736 6.406 -11.070 1.00 0.00 H new ATOM 942 N ARG A 89 0.383 6.218 -10.322 1.00 0.00 N ATOM 943 CA ARG A 89 -0.623 5.245 -10.714 1.00 0.00 C ATOM 944 C ARG A 89 -0.971 4.337 -9.532 1.00 0.00 C ATOM 945 O ARG A 89 -0.148 4.128 -8.642 1.00 0.00 O ATOM 946 CB ARG A 89 -0.133 4.386 -11.881 1.00 0.00 C ATOM 947 CG ARG A 89 1.231 3.767 -11.572 1.00 0.00 C ATOM 948 CD ARG A 89 1.528 2.598 -12.513 1.00 0.00 C ATOM 949 NE ARG A 89 2.724 1.863 -12.045 1.00 0.00 N ATOM 950 CZ ARG A 89 3.433 1.018 -12.806 1.00 0.00 C ATOM 951 NH1 ARG A 89 3.069 0.795 -14.076 1.00 0.00 N ATOM 952 NH2 ARG A 89 4.505 0.394 -12.297 1.00 0.00 N ATOM 0 H ARG A 89 0.637 6.195 -9.335 1.00 0.00 H new ATOM 0 HA ARG A 89 -1.510 5.794 -11.029 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -0.857 3.597 -12.085 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -0.064 4.996 -12.782 1.00 0.00 H new ATOM 0 HG2 ARG A 89 2.009 4.524 -11.670 1.00 0.00 H new ATOM 0 HG3 ARG A 89 1.252 3.421 -10.539 1.00 0.00 H new ATOM 0 HD2 ARG A 89 0.671 1.926 -12.553 1.00 0.00 H new ATOM 0 HD3 ARG A 89 1.691 2.968 -13.525 1.00 0.00 H new ATOM 0 HE ARG A 89 3.028 2.009 -11.082 1.00 0.00 H new ATOM 0 HH11 ARG A 89 2.253 1.268 -14.463 1.00 0.00 H new ATOM 0 HH12 ARG A 89 3.608 0.152 -14.656 1.00 0.00 H new ATOM 0 HH21 ARG A 89 4.782 0.562 -11.330 1.00 0.00 H new ATOM 0 HH22 ARG A 89 5.044 -0.249 -12.877 1.00 0.00 H new ATOM 963 N LEU A 90 -2.192 3.824 -9.562 1.00 0.00 N ATOM 964 CA LEU A 90 -2.659 2.943 -8.504 1.00 0.00 C ATOM 965 C LEU A 90 -2.215 1.510 -8.806 1.00 0.00 C ATOM 966 O LEU A 90 -2.356 1.037 -9.932 1.00 0.00 O ATOM 967 CB LEU A 90 -4.170 3.091 -8.312 1.00 0.00 C ATOM 968 CG LEU A 90 -5.027 1.931 -8.823 1.00 0.00 C ATOM 969 CD1 LEU A 90 -4.809 1.706 -10.321 1.00 0.00 C ATOM 970 CD2 LEU A 90 -4.773 0.661 -8.009 1.00 0.00 C ATOM 0 H LEU A 90 -2.872 4.001 -10.301 1.00 0.00 H new ATOM 0 HA LEU A 90 -2.211 3.222 -7.550 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -4.370 3.224 -7.249 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -4.492 4.004 -8.813 1.00 0.00 H new ATOM 0 HG LEU A 90 -6.076 2.196 -8.687 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -5.430 0.876 -10.658 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -5.081 2.609 -10.868 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -3.760 1.473 -10.505 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -5.395 -0.148 -8.393 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.723 0.381 -8.090 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -5.020 0.844 -6.963 1.00 0.00 H new ATOM 981 N LYS A 91 -1.687 0.860 -7.780 1.00 0.00 N ATOM 982 CA LYS A 91 -1.220 -0.509 -7.921 1.00 0.00 C ATOM 983 C LYS A 91 -2.055 -1.423 -7.020 1.00 0.00 C ATOM 984 O LYS A 91 -1.725 -1.617 -5.851 1.00 0.00 O ATOM 985 CB LYS A 91 0.284 -0.593 -7.657 1.00 0.00 C ATOM 986 CG LYS A 91 0.988 -1.398 -8.750 1.00 0.00 C ATOM 987 CD LYS A 91 0.540 -2.862 -8.727 1.00 0.00 C ATOM 988 CE LYS A 91 -0.026 -3.282 -10.084 1.00 0.00 C ATOM 989 NZ LYS A 91 0.380 -4.668 -10.409 1.00 0.00 N ATOM 0 H LYS A 91 -1.572 1.256 -6.847 1.00 0.00 H new ATOM 0 HA LYS A 91 -1.359 -0.855 -8.945 1.00 0.00 H new ATOM 0 HB2 LYS A 91 0.705 0.411 -7.611 1.00 0.00 H new ATOM 0 HB3 LYS A 91 0.461 -1.057 -6.687 1.00 0.00 H new ATOM 0 HG2 LYS A 91 0.770 -0.962 -9.725 1.00 0.00 H new ATOM 0 HG3 LYS A 91 2.068 -1.342 -8.610 1.00 0.00 H new ATOM 0 HD2 LYS A 91 1.384 -3.501 -8.468 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -0.216 -3.003 -7.954 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -1.113 -3.209 -10.069 1.00 0.00 H new ATOM 0 HE3 LYS A 91 0.328 -2.602 -10.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -0.013 -4.937 -11.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 1.418 -4.727 -10.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 0.021 -5.315 -9.679 1.00 0.00 H new ATOM 999 N GLU A 92 -3.119 -1.959 -7.599 1.00 0.00 N ATOM 1000 CA GLU A 92 -4.003 -2.847 -6.864 1.00 0.00 C ATOM 1001 C GLU A 92 -3.220 -4.044 -6.321 1.00 0.00 C ATOM 1002 O GLU A 92 -2.411 -4.636 -7.034 1.00 0.00 O ATOM 1003 CB GLU A 92 -5.171 -3.306 -7.738 1.00 0.00 C ATOM 1004 CG GLU A 92 -6.507 -2.829 -7.166 1.00 0.00 C ATOM 1005 CD GLU A 92 -7.667 -3.665 -7.709 1.00 0.00 C ATOM 1006 OE1 GLU A 92 -7.394 -4.813 -8.121 1.00 0.00 O ATOM 1007 OE2 GLU A 92 -8.800 -3.137 -7.701 1.00 0.00 O ATOM 0 H GLU A 92 -3.389 -1.795 -8.569 1.00 0.00 H new ATOM 0 HA GLU A 92 -4.419 -2.297 -6.020 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -5.046 -2.920 -8.750 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -5.170 -4.394 -7.810 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -6.485 -2.895 -6.078 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -6.661 -1.780 -7.419 1.00 0.00 H new ATOM 1012 N LYS A 93 -3.490 -4.365 -5.064 1.00 0.00 N ATOM 1013 CA LYS A 93 -2.821 -5.482 -4.417 1.00 0.00 C ATOM 1014 C LYS A 93 -3.848 -6.302 -3.634 1.00 0.00 C ATOM 1015 O LYS A 93 -3.914 -6.215 -2.408 1.00 0.00 O ATOM 1016 CB LYS A 93 -1.652 -4.985 -3.564 1.00 0.00 C ATOM 1017 CG LYS A 93 -0.474 -4.557 -4.443 1.00 0.00 C ATOM 1018 CD LYS A 93 0.821 -4.498 -3.633 1.00 0.00 C ATOM 1019 CE LYS A 93 2.007 -5.005 -4.456 1.00 0.00 C ATOM 1020 NZ LYS A 93 3.285 -4.603 -3.827 1.00 0.00 N ATOM 0 H LYS A 93 -4.162 -3.872 -4.476 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.383 -6.146 -5.162 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -1.977 -4.145 -2.950 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -1.334 -5.774 -2.882 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -0.359 -5.258 -5.269 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -0.678 -3.580 -4.881 1.00 0.00 H new ATOM 0 HD2 LYS A 93 1.008 -3.473 -3.313 1.00 0.00 H new ATOM 0 HD3 LYS A 93 0.717 -5.100 -2.730 1.00 0.00 H new ATOM 0 HE2 LYS A 93 1.962 -6.091 -4.539 1.00 0.00 H new ATOM 0 HE3 LYS A 93 1.952 -4.605 -5.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 3.820 -3.998 -4.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 3.091 -4.077 -2.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 3.844 -5.451 -3.604 1.00 0.00 H new ATOM 1030 N PHE A 94 -4.625 -7.080 -4.374 1.00 0.00 N ATOM 1031 CA PHE A 94 -5.646 -7.914 -3.764 1.00 0.00 C ATOM 1032 C PHE A 94 -5.015 -9.059 -2.968 1.00 0.00 C ATOM 1033 O PHE A 94 -4.997 -10.200 -3.423 1.00 0.00 O ATOM 1034 CB PHE A 94 -6.482 -8.502 -4.903 1.00 0.00 C ATOM 1035 CG PHE A 94 -5.661 -9.245 -5.959 1.00 0.00 C ATOM 1036 CD1 PHE A 94 -5.099 -8.559 -6.989 1.00 0.00 C ATOM 1037 CD2 PHE A 94 -5.493 -10.591 -5.866 1.00 0.00 C ATOM 1038 CE1 PHE A 94 -4.336 -9.249 -7.970 1.00 0.00 C ATOM 1039 CE2 PHE A 94 -4.731 -11.281 -6.846 1.00 0.00 C ATOM 1040 CZ PHE A 94 -4.169 -10.595 -7.877 1.00 0.00 C ATOM 0 H PHE A 94 -4.568 -7.150 -5.390 1.00 0.00 H new ATOM 0 HA PHE A 94 -6.251 -7.320 -3.079 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -7.219 -9.186 -4.483 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -7.034 -7.697 -5.387 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -5.232 -7.490 -7.062 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -5.939 -11.136 -5.047 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -3.889 -8.704 -8.789 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -4.598 -12.350 -6.772 1.00 0.00 H new ATOM 0 HZ PHE A 94 -3.590 -11.120 -8.622 1.00 0.00 H new ATOM 1049 N PHE A 95 -4.513 -8.712 -1.791 1.00 0.00 N ATOM 1050 CA PHE A 95 -3.882 -9.695 -0.927 1.00 0.00 C ATOM 1051 C PHE A 95 -4.444 -9.617 0.494 1.00 0.00 C ATOM 1052 O PHE A 95 -4.096 -10.430 1.349 1.00 0.00 O ATOM 1053 CB PHE A 95 -2.389 -9.367 -0.891 1.00 0.00 C ATOM 1054 CG PHE A 95 -1.775 -9.104 -2.268 1.00 0.00 C ATOM 1055 CD1 PHE A 95 -2.001 -9.973 -3.290 1.00 0.00 C ATOM 1056 CD2 PHE A 95 -1.005 -8.002 -2.471 1.00 0.00 C ATOM 1057 CE1 PHE A 95 -1.431 -9.730 -4.568 1.00 0.00 C ATOM 1058 CE2 PHE A 95 -0.436 -7.759 -3.748 1.00 0.00 C ATOM 1059 CZ PHE A 95 -0.661 -8.628 -4.770 1.00 0.00 C ATOM 0 H PHE A 95 -4.531 -7.764 -1.416 1.00 0.00 H new ATOM 0 HA PHE A 95 -4.068 -10.699 -1.308 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -2.236 -8.490 -0.263 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -1.857 -10.194 -0.420 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -2.614 -10.848 -3.130 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -0.826 -7.311 -1.660 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -1.609 -10.420 -5.379 1.00 0.00 H new ATOM 0 HE2 PHE A 95 0.176 -6.884 -3.909 1.00 0.00 H new ATOM 0 HZ PHE A 95 -0.228 -8.443 -5.742 1.00 0.00 H new ATOM 1068 N MET A 96 -5.306 -8.632 0.702 1.00 0.00 N ATOM 1069 CA MET A 96 -5.919 -8.438 2.004 1.00 0.00 C ATOM 1070 C MET A 96 -6.450 -9.760 2.563 1.00 0.00 C ATOM 1071 O MET A 96 -6.415 -9.985 3.772 1.00 0.00 O ATOM 1072 CB MET A 96 -7.070 -7.437 1.882 1.00 0.00 C ATOM 1073 CG MET A 96 -8.311 -8.099 1.280 1.00 0.00 C ATOM 1074 SD MET A 96 -9.729 -7.032 1.478 1.00 0.00 S ATOM 1075 CE MET A 96 -10.926 -8.215 2.074 1.00 0.00 C ATOM 0 H MET A 96 -5.594 -7.960 -0.010 1.00 0.00 H new ATOM 0 HA MET A 96 -5.162 -8.054 2.688 1.00 0.00 H new ATOM 0 HB2 MET A 96 -7.310 -7.032 2.865 1.00 0.00 H new ATOM 0 HB3 MET A 96 -6.762 -6.598 1.258 1.00 0.00 H new ATOM 0 HG2 MET A 96 -8.146 -8.306 0.223 1.00 0.00 H new ATOM 0 HG3 MET A 96 -8.495 -9.056 1.767 1.00 0.00 H new ATOM 0 HE1 MET A 96 -11.932 -7.833 1.900 1.00 0.00 H new ATOM 0 HE2 MET A 96 -10.799 -9.159 1.544 1.00 0.00 H new ATOM 0 HE3 MET A 96 -10.778 -8.376 3.142 1.00 0.00 H new ATOM 1083 N ARG A 97 -6.928 -10.600 1.657 1.00 0.00 N ATOM 1084 CA ARG A 97 -7.464 -11.893 2.044 1.00 0.00 C ATOM 1085 C ARG A 97 -6.363 -12.764 2.652 1.00 0.00 C ATOM 1086 O ARG A 97 -6.650 -13.762 3.313 1.00 0.00 O ATOM 1087 CB ARG A 97 -8.075 -12.619 0.843 1.00 0.00 C ATOM 1088 CG ARG A 97 -8.931 -13.803 1.296 1.00 0.00 C ATOM 1089 CD ARG A 97 -10.312 -13.336 1.761 1.00 0.00 C ATOM 1090 NE ARG A 97 -11.367 -14.039 0.997 1.00 0.00 N ATOM 1091 CZ ARG A 97 -12.681 -13.881 1.213 1.00 0.00 C ATOM 1092 NH1 ARG A 97 -13.108 -13.045 2.169 1.00 0.00 N ATOM 1093 NH2 ARG A 97 -13.567 -14.560 0.472 1.00 0.00 N ATOM 0 H ARG A 97 -6.955 -10.410 0.655 1.00 0.00 H new ATOM 0 HA ARG A 97 -8.245 -11.719 2.784 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -8.685 -11.924 0.265 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -7.281 -12.971 0.184 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -9.040 -14.512 0.475 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -8.429 -14.330 2.108 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -10.431 -13.532 2.827 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -10.407 -12.259 1.622 1.00 0.00 H new ATOM 0 HE ARG A 97 -11.077 -14.683 0.261 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -12.433 -12.528 2.733 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -14.108 -12.925 2.333 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -13.242 -15.196 -0.256 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -14.567 -14.440 0.636 1.00 0.00 H new ATOM 1104 N LYS A 98 -5.127 -12.356 2.406 1.00 0.00 N ATOM 1105 CA LYS A 98 -3.981 -13.087 2.921 1.00 0.00 C ATOM 1106 C LYS A 98 -2.700 -12.320 2.588 1.00 0.00 C ATOM 1107 O LYS A 98 -2.368 -12.138 1.418 1.00 0.00 O ATOM 1108 CB LYS A 98 -3.988 -14.526 2.403 1.00 0.00 C ATOM 1109 CG LYS A 98 -3.089 -15.421 3.259 1.00 0.00 C ATOM 1110 CD LYS A 98 -3.701 -16.813 3.427 1.00 0.00 C ATOM 1111 CE LYS A 98 -2.637 -17.834 3.835 1.00 0.00 C ATOM 1112 NZ LYS A 98 -1.789 -18.191 2.676 1.00 0.00 N ATOM 0 H LYS A 98 -4.894 -11.529 1.857 1.00 0.00 H new ATOM 0 HA LYS A 98 -4.034 -13.163 4.007 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -5.007 -14.914 2.410 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -3.647 -14.545 1.368 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -2.106 -15.506 2.795 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -2.941 -14.964 4.238 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -4.487 -16.780 4.182 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -4.169 -17.124 2.493 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -2.018 -17.424 4.633 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -3.117 -18.729 4.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -1.249 -19.053 2.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -2.391 -18.360 1.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -1.130 -17.412 2.475 1.00 0.00 H new ATOM 1122 N VAL A 99 -2.017 -11.889 3.638 1.00 0.00 N ATOM 1123 CA VAL A 99 -0.780 -11.145 3.471 1.00 0.00 C ATOM 1124 C VAL A 99 0.248 -11.638 4.492 1.00 0.00 C ATOM 1125 O VAL A 99 -0.028 -12.556 5.261 1.00 0.00 O ATOM 1126 CB VAL A 99 -1.054 -9.643 3.576 1.00 0.00 C ATOM 1127 CG1 VAL A 99 -2.199 -9.229 2.650 1.00 0.00 C ATOM 1128 CG2 VAL A 99 -1.345 -9.239 5.023 1.00 0.00 C ATOM 0 H VAL A 99 -2.296 -12.041 4.607 1.00 0.00 H new ATOM 0 HA VAL A 99 -0.362 -11.317 2.479 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.156 -9.115 3.255 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -2.373 -8.157 2.744 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -1.936 -9.465 1.619 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -3.104 -9.769 2.927 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -1.536 -8.167 5.070 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -2.220 -9.780 5.383 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -0.486 -9.482 5.648 1.00 0.00 H new ATOM 1138 N GLN A 100 1.411 -11.004 4.465 1.00 0.00 N ATOM 1139 CA GLN A 100 2.482 -11.368 5.377 1.00 0.00 C ATOM 1140 C GLN A 100 3.598 -10.322 5.330 1.00 0.00 C ATOM 1141 O GLN A 100 4.248 -10.149 4.300 1.00 0.00 O ATOM 1142 CB GLN A 100 3.025 -12.763 5.060 1.00 0.00 C ATOM 1143 CG GLN A 100 2.635 -13.763 6.149 1.00 0.00 C ATOM 1144 CD GLN A 100 3.861 -14.217 6.943 1.00 0.00 C ATOM 1145 OE1 GLN A 100 4.848 -13.511 7.066 1.00 0.00 O ATOM 1146 NE2 GLN A 100 3.746 -15.432 7.472 1.00 0.00 N ATOM 0 H GLN A 100 1.635 -10.241 3.826 1.00 0.00 H new ATOM 0 HA GLN A 100 2.076 -11.394 6.388 1.00 0.00 H new ATOM 0 HB2 GLN A 100 2.637 -13.098 4.098 1.00 0.00 H new ATOM 0 HB3 GLN A 100 4.111 -12.723 4.970 1.00 0.00 H new ATOM 0 HG2 GLN A 100 1.910 -13.307 6.823 1.00 0.00 H new ATOM 0 HG3 GLN A 100 2.150 -14.628 5.696 1.00 0.00 H new ATOM 0 HE21 GLN A 100 2.892 -15.971 7.331 1.00 0.00 H new ATOM 0 HE22 GLN A 100 4.512 -15.825 8.019 1.00 0.00 H new ATOM 1153 N ILE A 101 3.785 -9.651 6.457 1.00 0.00 N ATOM 1154 CA ILE A 101 4.811 -8.626 6.557 1.00 0.00 C ATOM 1155 C ILE A 101 6.036 -9.205 7.270 1.00 0.00 C ATOM 1156 O ILE A 101 5.902 -9.895 8.279 1.00 0.00 O ATOM 1157 CB ILE A 101 4.249 -7.369 7.222 1.00 0.00 C ATOM 1158 CG1 ILE A 101 5.369 -6.528 7.841 1.00 0.00 C ATOM 1159 CG2 ILE A 101 3.168 -7.725 8.245 1.00 0.00 C ATOM 1160 CD1 ILE A 101 5.353 -5.102 7.289 1.00 0.00 C ATOM 0 H ILE A 101 3.244 -9.797 7.309 1.00 0.00 H new ATOM 0 HA ILE A 101 5.137 -8.314 5.565 1.00 0.00 H new ATOM 0 HB ILE A 101 3.775 -6.759 6.453 1.00 0.00 H new ATOM 0 HG12 ILE A 101 5.254 -6.504 8.925 1.00 0.00 H new ATOM 0 HG13 ILE A 101 6.334 -6.991 7.633 1.00 0.00 H new ATOM 0 HG21 ILE A 101 2.786 -6.813 8.703 1.00 0.00 H new ATOM 0 HG22 ILE A 101 2.353 -8.250 7.746 1.00 0.00 H new ATOM 0 HG23 ILE A 101 3.594 -8.367 9.016 1.00 0.00 H new ATOM 0 HD11 ILE A 101 6.158 -4.526 7.745 1.00 0.00 H new ATOM 0 HD12 ILE A 101 5.493 -5.129 6.208 1.00 0.00 H new ATOM 0 HD13 ILE A 101 4.396 -4.633 7.520 1.00 0.00 H new ATOM 1171 N ASN A 102 7.200 -8.901 6.716 1.00 0.00 N ATOM 1172 CA ASN A 102 8.448 -9.382 7.287 1.00 0.00 C ATOM 1173 C ASN A 102 9.386 -8.196 7.523 1.00 0.00 C ATOM 1174 O ASN A 102 10.285 -7.943 6.724 1.00 0.00 O ATOM 1175 CB ASN A 102 9.147 -10.357 6.338 1.00 0.00 C ATOM 1176 CG ASN A 102 8.940 -11.804 6.788 1.00 0.00 C ATOM 1177 OD1 ASN A 102 7.843 -12.339 6.759 1.00 0.00 O ATOM 1178 ND2 ASN A 102 10.050 -12.406 7.204 1.00 0.00 N ATOM 0 H ASN A 102 7.306 -8.328 5.879 1.00 0.00 H new ATOM 0 HA ASN A 102 8.217 -9.892 8.222 1.00 0.00 H new ATOM 0 HB2 ASN A 102 8.759 -10.228 5.328 1.00 0.00 H new ATOM 0 HB3 ASN A 102 10.213 -10.133 6.301 1.00 0.00 H new ATOM 0 HD21 ASN A 102 10.016 -13.374 7.525 1.00 0.00 H new ATOM 0 HD22 ASN A 102 10.936 -11.900 7.202 1.00 0.00 H new ATOM 1184 N ASP A 103 9.144 -7.502 8.625 1.00 0.00 N ATOM 1185 CA ASP A 103 9.956 -6.349 8.977 1.00 0.00 C ATOM 1186 C ASP A 103 11.405 -6.796 9.183 1.00 0.00 C ATOM 1187 O ASP A 103 11.844 -6.985 10.317 1.00 0.00 O ATOM 1188 CB ASP A 103 9.468 -5.709 10.277 1.00 0.00 C ATOM 1189 CG ASP A 103 9.357 -6.664 11.468 1.00 0.00 C ATOM 1190 OD1 ASP A 103 8.924 -7.812 11.234 1.00 0.00 O ATOM 1191 OD2 ASP A 103 9.707 -6.223 12.584 1.00 0.00 O ATOM 0 H ASP A 103 8.397 -7.716 9.286 1.00 0.00 H new ATOM 0 HA ASP A 103 9.881 -5.623 8.168 1.00 0.00 H new ATOM 0 HB2 ASP A 103 10.147 -4.899 10.543 1.00 0.00 H new ATOM 0 HB3 ASP A 103 8.491 -5.260 10.099 1.00 0.00 H new ATOM 1195 N LYS A 104 12.107 -6.952 8.071 1.00 0.00 N ATOM 1196 CA LYS A 104 13.496 -7.372 8.116 1.00 0.00 C ATOM 1197 C LYS A 104 14.401 -6.146 7.974 1.00 0.00 C ATOM 1198 O LYS A 104 14.920 -5.874 6.893 1.00 0.00 O ATOM 1199 CB LYS A 104 13.763 -8.456 7.070 1.00 0.00 C ATOM 1200 CG LYS A 104 15.170 -9.036 7.226 1.00 0.00 C ATOM 1201 CD LYS A 104 15.130 -10.563 7.300 1.00 0.00 C ATOM 1202 CE LYS A 104 16.537 -11.155 7.205 1.00 0.00 C ATOM 1203 NZ LYS A 104 17.263 -10.973 8.482 1.00 0.00 N ATOM 0 H LYS A 104 11.739 -6.795 7.133 1.00 0.00 H new ATOM 0 HA LYS A 104 13.724 -7.828 9.080 1.00 0.00 H new ATOM 0 HB2 LYS A 104 13.025 -9.252 7.170 1.00 0.00 H new ATOM 0 HB3 LYS A 104 13.647 -8.038 6.070 1.00 0.00 H new ATOM 0 HG2 LYS A 104 15.790 -8.726 6.385 1.00 0.00 H new ATOM 0 HG3 LYS A 104 15.633 -8.637 8.128 1.00 0.00 H new ATOM 0 HD2 LYS A 104 14.664 -10.873 8.235 1.00 0.00 H new ATOM 0 HD3 LYS A 104 14.512 -10.953 6.491 1.00 0.00 H new ATOM 0 HE2 LYS A 104 16.476 -12.216 6.963 1.00 0.00 H new ATOM 0 HE3 LYS A 104 17.086 -10.674 6.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 18.216 -11.380 8.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 17.337 -9.958 8.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 16.746 -11.452 9.247 1.00 0.00 H new ATOM 1213 N ASP A 105 14.562 -5.438 9.083 1.00 0.00 N ATOM 1214 CA ASP A 105 15.394 -4.247 9.097 1.00 0.00 C ATOM 1215 C ASP A 105 16.252 -4.243 10.363 1.00 0.00 C ATOM 1216 O ASP A 105 16.049 -5.064 11.257 1.00 0.00 O ATOM 1217 CB ASP A 105 14.540 -2.978 9.100 1.00 0.00 C ATOM 1218 CG ASP A 105 15.219 -1.740 8.509 1.00 0.00 C ATOM 1219 OD1 ASP A 105 16.091 -1.934 7.636 1.00 0.00 O ATOM 1220 OD2 ASP A 105 14.850 -0.629 8.946 1.00 0.00 O ATOM 0 H ASP A 105 14.130 -5.667 9.978 1.00 0.00 H new ATOM 0 HA ASP A 105 16.016 -4.261 8.202 1.00 0.00 H new ATOM 0 HB2 ASP A 105 13.624 -3.173 8.542 1.00 0.00 H new ATOM 0 HB3 ASP A 105 14.247 -2.758 10.126 1.00 0.00 H new ATOM 1224 N ASP A 106 17.191 -3.310 10.401 1.00 0.00 N ATOM 1225 CA ASP A 106 18.080 -3.189 11.545 1.00 0.00 C ATOM 1226 C ASP A 106 18.384 -1.711 11.793 1.00 0.00 C ATOM 1227 O ASP A 106 19.321 -1.379 12.519 1.00 0.00 O ATOM 1228 CB ASP A 106 19.406 -3.909 11.291 1.00 0.00 C ATOM 1229 CG ASP A 106 19.670 -5.115 12.193 1.00 0.00 C ATOM 1230 OD1 ASP A 106 19.012 -6.152 11.962 1.00 0.00 O ATOM 1231 OD2 ASP A 106 20.524 -4.973 13.094 1.00 0.00 O ATOM 0 H ASP A 106 17.356 -2.630 9.659 1.00 0.00 H new ATOM 0 HA ASP A 106 17.586 -3.639 12.406 1.00 0.00 H new ATOM 0 HB2 ASP A 106 19.430 -4.239 10.252 1.00 0.00 H new ATOM 0 HB3 ASP A 106 20.220 -3.195 11.417 1.00 0.00 H new ATOM 1235 N THR A 107 17.576 -0.860 11.177 1.00 0.00 N ATOM 1236 CA THR A 107 17.748 0.575 11.322 1.00 0.00 C ATOM 1237 C THR A 107 19.108 0.889 11.947 1.00 0.00 C ATOM 1238 O THR A 107 20.027 1.325 11.256 1.00 0.00 O ATOM 1239 CB THR A 107 16.567 1.112 12.135 1.00 0.00 C ATOM 1240 OG1 THR A 107 16.116 -0.016 12.879 1.00 0.00 O ATOM 1241 CG2 THR A 107 15.371 1.482 11.256 1.00 0.00 C ATOM 0 H THR A 107 16.800 -1.138 10.576 1.00 0.00 H new ATOM 0 HA THR A 107 17.749 1.073 10.353 1.00 0.00 H new ATOM 0 HB THR A 107 16.885 1.987 12.702 1.00 0.00 H new ATOM 0 HG1 THR A 107 15.352 0.243 13.436 1.00 0.00 H new ATOM 0 HG21 THR A 107 14.561 1.857 11.882 1.00 0.00 H new ATOM 0 HG22 THR A 107 15.667 2.253 10.545 1.00 0.00 H new ATOM 0 HG23 THR A 107 15.031 0.600 10.714 1.00 0.00 H new ATOM 1249 N ASN A 108 19.195 0.655 13.249 1.00 0.00 N ATOM 1250 CA ASN A 108 20.428 0.908 13.975 1.00 0.00 C ATOM 1251 C ASN A 108 21.619 0.674 13.043 1.00 0.00 C ATOM 1252 O ASN A 108 22.649 1.335 13.170 1.00 0.00 O ATOM 1253 CB ASN A 108 20.568 -0.039 15.167 1.00 0.00 C ATOM 1254 CG ASN A 108 21.974 0.039 15.768 1.00 0.00 C ATOM 1255 OD1 ASN A 108 22.357 1.014 16.393 1.00 0.00 O ATOM 1256 ND2 ASN A 108 22.719 -1.040 15.542 1.00 0.00 N ATOM 0 H ASN A 108 18.431 0.293 13.820 1.00 0.00 H new ATOM 0 HA ASN A 108 20.405 1.937 14.333 1.00 0.00 H new ATOM 0 HB2 ASN A 108 19.829 0.216 15.927 1.00 0.00 H new ATOM 0 HB3 ASN A 108 20.360 -1.061 14.850 1.00 0.00 H new ATOM 0 HD21 ASN A 108 23.673 -1.085 15.900 1.00 0.00 H new ATOM 0 HD22 ASN A 108 22.336 -1.822 15.011 1.00 0.00 H new ATOM 1262 N GLU A 109 21.439 -0.268 12.128 1.00 0.00 N ATOM 1263 CA GLU A 109 22.486 -0.596 11.177 1.00 0.00 C ATOM 1264 C GLU A 109 22.057 -0.212 9.760 1.00 0.00 C ATOM 1265 O GLU A 109 22.890 0.143 8.928 1.00 0.00 O ATOM 1266 CB GLU A 109 22.853 -2.080 11.255 1.00 0.00 C ATOM 1267 CG GLU A 109 24.119 -2.375 10.449 1.00 0.00 C ATOM 1268 CD GLU A 109 25.165 -3.085 11.313 1.00 0.00 C ATOM 1269 OE1 GLU A 109 25.627 -2.446 12.283 1.00 0.00 O ATOM 1270 OE2 GLU A 109 25.478 -4.249 10.983 1.00 0.00 O ATOM 0 H GLU A 109 20.583 -0.814 12.026 1.00 0.00 H new ATOM 0 HA GLU A 109 23.375 -0.021 11.434 1.00 0.00 H new ATOM 0 HB2 GLU A 109 23.005 -2.366 12.296 1.00 0.00 H new ATOM 0 HB3 GLU A 109 22.028 -2.683 10.876 1.00 0.00 H new ATOM 0 HG2 GLU A 109 23.870 -2.996 9.588 1.00 0.00 H new ATOM 0 HG3 GLU A 109 24.533 -1.444 10.061 1.00 0.00 H new ATOM 1275 N TYR A 110 20.754 -0.294 9.529 1.00 0.00 N ATOM 1276 CA TYR A 110 20.203 0.042 8.227 1.00 0.00 C ATOM 1277 C TYR A 110 19.512 1.406 8.259 1.00 0.00 C ATOM 1278 O TYR A 110 19.629 2.143 9.237 1.00 0.00 O ATOM 1279 CB TYR A 110 19.163 -1.037 7.918 1.00 0.00 C ATOM 1280 CG TYR A 110 19.716 -2.462 7.951 1.00 0.00 C ATOM 1281 CD1 TYR A 110 21.079 -2.673 7.997 1.00 0.00 C ATOM 1282 CD2 TYR A 110 18.852 -3.539 7.936 1.00 0.00 C ATOM 1283 CE1 TYR A 110 21.601 -4.015 8.027 1.00 0.00 C ATOM 1284 CE2 TYR A 110 19.374 -4.881 7.968 1.00 0.00 C ATOM 1285 CZ TYR A 110 20.722 -5.053 8.012 1.00 0.00 C ATOM 1286 OH TYR A 110 21.214 -6.320 8.041 1.00 0.00 O ATOM 0 H TYR A 110 20.065 -0.588 10.221 1.00 0.00 H new ATOM 0 HA TYR A 110 20.992 0.089 7.477 1.00 0.00 H new ATOM 0 HB2 TYR A 110 18.348 -0.958 8.637 1.00 0.00 H new ATOM 0 HB3 TYR A 110 18.738 -0.846 6.933 1.00 0.00 H new ATOM 0 HD1 TYR A 110 21.755 -1.831 8.011 1.00 0.00 H new ATOM 0 HD2 TYR A 110 17.785 -3.375 7.900 1.00 0.00 H new ATOM 0 HE1 TYR A 110 22.666 -4.193 8.061 1.00 0.00 H new ATOM 0 HE2 TYR A 110 18.709 -5.732 7.957 1.00 0.00 H new ATOM 0 HH TYR A 110 20.472 -6.960 8.027 1.00 0.00 H new ATOM 1295 N LYS A 111 18.804 1.702 7.178 1.00 0.00 N ATOM 1296 CA LYS A 111 18.094 2.964 7.070 1.00 0.00 C ATOM 1297 C LYS A 111 16.733 2.839 7.759 1.00 0.00 C ATOM 1298 O LYS A 111 16.607 3.126 8.949 1.00 0.00 O ATOM 1299 CB LYS A 111 18.004 3.406 5.609 1.00 0.00 C ATOM 1300 CG LYS A 111 18.711 4.746 5.397 1.00 0.00 C ATOM 1301 CD LYS A 111 18.068 5.846 6.244 1.00 0.00 C ATOM 1302 CE LYS A 111 16.572 5.963 5.944 1.00 0.00 C ATOM 1303 NZ LYS A 111 16.350 6.215 4.503 1.00 0.00 N ATOM 0 H LYS A 111 18.707 1.088 6.369 1.00 0.00 H new ATOM 0 HA LYS A 111 18.642 3.754 7.584 1.00 0.00 H new ATOM 0 HB2 LYS A 111 18.454 2.648 4.968 1.00 0.00 H new ATOM 0 HB3 LYS A 111 16.958 3.492 5.315 1.00 0.00 H new ATOM 0 HG2 LYS A 111 19.765 4.650 5.658 1.00 0.00 H new ATOM 0 HG3 LYS A 111 18.667 5.021 4.343 1.00 0.00 H new ATOM 0 HD2 LYS A 111 18.215 5.628 7.302 1.00 0.00 H new ATOM 0 HD3 LYS A 111 18.559 6.798 6.043 1.00 0.00 H new ATOM 0 HE2 LYS A 111 16.063 5.046 6.241 1.00 0.00 H new ATOM 0 HE3 LYS A 111 16.140 6.773 6.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 15.584 6.908 4.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 17.223 6.588 4.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 16.087 5.326 4.032 1.00 0.00 H new ATOM 1313 N HIS A 112 15.750 2.410 6.982 1.00 0.00 N ATOM 1314 CA HIS A 112 14.403 2.243 7.502 1.00 0.00 C ATOM 1315 C HIS A 112 13.518 1.594 6.436 1.00 0.00 C ATOM 1316 O HIS A 112 12.735 2.274 5.775 1.00 0.00 O ATOM 1317 CB HIS A 112 13.845 3.577 8.003 1.00 0.00 C ATOM 1318 CG HIS A 112 13.453 4.532 6.901 1.00 0.00 C ATOM 1319 ND1 HIS A 112 13.930 4.419 5.607 1.00 0.00 N ATOM 1320 CD2 HIS A 112 12.624 5.615 6.913 1.00 0.00 C ATOM 1321 CE1 HIS A 112 13.406 5.397 4.882 1.00 0.00 C ATOM 1322 NE2 HIS A 112 12.598 6.138 5.693 1.00 0.00 N ATOM 0 H HIS A 112 15.859 2.173 5.996 1.00 0.00 H new ATOM 0 HA HIS A 112 14.422 1.576 8.364 1.00 0.00 H new ATOM 0 HB2 HIS A 112 12.974 3.383 8.628 1.00 0.00 H new ATOM 0 HB3 HIS A 112 14.591 4.056 8.637 1.00 0.00 H new ATOM 0 HD2 HIS A 112 12.081 5.985 7.770 1.00 0.00 H new ATOM 0 HE1 HIS A 112 13.587 5.576 3.832 1.00 0.00 H new ATOM 0 HE2 HIS A 112 12.062 6.958 5.409 1.00 0.00 H new ATOM 1329 N ALA A 113 13.673 0.284 6.302 1.00 0.00 N ATOM 1330 CA ALA A 113 12.898 -0.465 5.329 1.00 0.00 C ATOM 1331 C ALA A 113 12.850 -1.936 5.744 1.00 0.00 C ATOM 1332 O ALA A 113 13.680 -2.390 6.530 1.00 0.00 O ATOM 1333 CB ALA A 113 13.503 -0.272 3.936 1.00 0.00 C ATOM 0 H ALA A 113 14.324 -0.277 6.852 1.00 0.00 H new ATOM 0 HA ALA A 113 11.872 -0.099 5.293 1.00 0.00 H new ATOM 0 HB1 ALA A 113 12.921 -0.834 3.206 1.00 0.00 H new ATOM 0 HB2 ALA A 113 13.487 0.786 3.676 1.00 0.00 H new ATOM 0 HB3 ALA A 113 14.532 -0.630 3.934 1.00 0.00 H new ATOM 1339 N PHE A 114 11.870 -2.641 5.199 1.00 0.00 N ATOM 1340 CA PHE A 114 11.703 -4.052 5.504 1.00 0.00 C ATOM 1341 C PHE A 114 11.120 -4.806 4.307 1.00 0.00 C ATOM 1342 O PHE A 114 10.627 -4.192 3.362 1.00 0.00 O ATOM 1343 CB PHE A 114 10.723 -4.143 6.674 1.00 0.00 C ATOM 1344 CG PHE A 114 10.233 -2.786 7.185 1.00 0.00 C ATOM 1345 CD1 PHE A 114 9.280 -2.104 6.494 1.00 0.00 C ATOM 1346 CD2 PHE A 114 10.751 -2.262 8.328 1.00 0.00 C ATOM 1347 CE1 PHE A 114 8.826 -0.845 6.967 1.00 0.00 C ATOM 1348 CE2 PHE A 114 10.296 -1.003 8.800 1.00 0.00 C ATOM 1349 CZ PHE A 114 9.343 -0.320 8.110 1.00 0.00 C ATOM 0 H PHE A 114 11.183 -2.261 4.548 1.00 0.00 H new ATOM 0 HA PHE A 114 12.668 -4.497 5.745 1.00 0.00 H new ATOM 0 HB2 PHE A 114 9.862 -4.736 6.367 1.00 0.00 H new ATOM 0 HB3 PHE A 114 11.202 -4.677 7.495 1.00 0.00 H new ATOM 0 HD1 PHE A 114 8.869 -2.520 5.586 1.00 0.00 H new ATOM 0 HD2 PHE A 114 11.508 -2.803 8.876 1.00 0.00 H new ATOM 0 HE1 PHE A 114 8.069 -0.304 6.419 1.00 0.00 H new ATOM 0 HE2 PHE A 114 10.707 -0.587 9.708 1.00 0.00 H new ATOM 0 HZ PHE A 114 8.997 0.638 8.470 1.00 0.00 H new ATOM 1358 N GLU A 115 11.195 -6.126 4.386 1.00 0.00 N ATOM 1359 CA GLU A 115 10.682 -6.971 3.321 1.00 0.00 C ATOM 1360 C GLU A 115 9.252 -7.414 3.638 1.00 0.00 C ATOM 1361 O GLU A 115 8.977 -7.901 4.734 1.00 0.00 O ATOM 1362 CB GLU A 115 11.592 -8.179 3.092 1.00 0.00 C ATOM 1363 CG GLU A 115 11.511 -9.157 4.265 1.00 0.00 C ATOM 1364 CD GLU A 115 12.407 -10.374 4.027 1.00 0.00 C ATOM 1365 OE1 GLU A 115 13.557 -10.156 3.589 1.00 0.00 O ATOM 1366 OE2 GLU A 115 11.922 -11.496 4.289 1.00 0.00 O ATOM 0 H GLU A 115 11.604 -6.632 5.172 1.00 0.00 H new ATOM 0 HA GLU A 115 10.666 -6.390 2.399 1.00 0.00 H new ATOM 0 HB2 GLU A 115 11.304 -8.686 2.171 1.00 0.00 H new ATOM 0 HB3 GLU A 115 12.621 -7.844 2.964 1.00 0.00 H new ATOM 0 HG2 GLU A 115 11.812 -8.654 5.184 1.00 0.00 H new ATOM 0 HG3 GLU A 115 10.479 -9.482 4.402 1.00 0.00 H new ATOM 1371 N ILE A 116 8.378 -7.229 2.659 1.00 0.00 N ATOM 1372 CA ILE A 116 6.983 -7.603 2.819 1.00 0.00 C ATOM 1373 C ILE A 116 6.715 -8.896 2.047 1.00 0.00 C ATOM 1374 O ILE A 116 7.544 -9.329 1.248 1.00 0.00 O ATOM 1375 CB ILE A 116 6.069 -6.445 2.418 1.00 0.00 C ATOM 1376 CG1 ILE A 116 6.732 -5.097 2.703 1.00 0.00 C ATOM 1377 CG2 ILE A 116 4.702 -6.566 3.095 1.00 0.00 C ATOM 1378 CD1 ILE A 116 7.086 -4.963 4.187 1.00 0.00 C ATOM 0 H ILE A 116 8.609 -6.825 1.752 1.00 0.00 H new ATOM 0 HA ILE A 116 6.760 -7.805 3.867 1.00 0.00 H new ATOM 0 HB ILE A 116 5.902 -6.499 1.342 1.00 0.00 H new ATOM 0 HG12 ILE A 116 7.634 -4.997 2.100 1.00 0.00 H new ATOM 0 HG13 ILE A 116 6.062 -4.289 2.411 1.00 0.00 H new ATOM 0 HG21 ILE A 116 4.071 -5.730 2.793 1.00 0.00 H new ATOM 0 HG22 ILE A 116 4.230 -7.503 2.798 1.00 0.00 H new ATOM 0 HG23 ILE A 116 4.830 -6.552 4.177 1.00 0.00 H new ATOM 0 HD11 ILE A 116 7.556 -3.996 4.363 1.00 0.00 H new ATOM 0 HD12 ILE A 116 6.179 -5.040 4.786 1.00 0.00 H new ATOM 0 HD13 ILE A 116 7.776 -5.758 4.470 1.00 0.00 H new ATOM 1389 N ILE A 117 5.553 -9.476 2.312 1.00 0.00 N ATOM 1390 CA ILE A 117 5.165 -10.711 1.652 1.00 0.00 C ATOM 1391 C ILE A 117 3.640 -10.780 1.565 1.00 0.00 C ATOM 1392 O ILE A 117 2.972 -11.102 2.547 1.00 0.00 O ATOM 1393 CB ILE A 117 5.797 -11.915 2.353 1.00 0.00 C ATOM 1394 CG1 ILE A 117 7.322 -11.885 2.230 1.00 0.00 C ATOM 1395 CG2 ILE A 117 5.206 -13.226 1.830 1.00 0.00 C ATOM 1396 CD1 ILE A 117 7.951 -13.104 2.907 1.00 0.00 C ATOM 0 H ILE A 117 4.868 -9.113 2.975 1.00 0.00 H new ATOM 0 HA ILE A 117 5.544 -10.732 0.630 1.00 0.00 H new ATOM 0 HB ILE A 117 5.559 -11.855 3.415 1.00 0.00 H new ATOM 0 HG12 ILE A 117 7.605 -11.863 1.178 1.00 0.00 H new ATOM 0 HG13 ILE A 117 7.709 -10.973 2.684 1.00 0.00 H new ATOM 0 HG21 ILE A 117 5.672 -14.066 2.345 1.00 0.00 H new ATOM 0 HG22 ILE A 117 4.132 -13.239 2.013 1.00 0.00 H new ATOM 0 HG23 ILE A 117 5.393 -13.308 0.759 1.00 0.00 H new ATOM 0 HD11 ILE A 117 9.035 -13.058 2.805 1.00 0.00 H new ATOM 0 HD12 ILE A 117 7.686 -13.110 3.964 1.00 0.00 H new ATOM 0 HD13 ILE A 117 7.581 -14.014 2.435 1.00 0.00 H new ATOM 1407 N LEU A 118 3.132 -10.472 0.380 1.00 0.00 N ATOM 1408 CA LEU A 118 1.697 -10.496 0.153 1.00 0.00 C ATOM 1409 C LEU A 118 1.346 -11.682 -0.748 1.00 0.00 C ATOM 1410 O LEU A 118 2.221 -12.247 -1.404 1.00 0.00 O ATOM 1411 CB LEU A 118 1.218 -9.149 -0.392 1.00 0.00 C ATOM 1412 CG LEU A 118 2.073 -8.533 -1.502 1.00 0.00 C ATOM 1413 CD1 LEU A 118 1.751 -9.167 -2.857 1.00 0.00 C ATOM 1414 CD2 LEU A 118 1.920 -7.011 -1.531 1.00 0.00 C ATOM 0 H LEU A 118 3.688 -10.205 -0.432 1.00 0.00 H new ATOM 0 HA LEU A 118 1.166 -10.641 1.094 1.00 0.00 H new ATOM 0 HB2 LEU A 118 0.203 -9.272 -0.769 1.00 0.00 H new ATOM 0 HB3 LEU A 118 1.168 -8.442 0.436 1.00 0.00 H new ATOM 0 HG LEU A 118 3.120 -8.747 -1.286 1.00 0.00 H new ATOM 0 HD11 LEU A 118 2.372 -8.712 -3.628 1.00 0.00 H new ATOM 0 HD12 LEU A 118 1.952 -10.238 -2.815 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.700 -9.004 -3.094 1.00 0.00 H new ATOM 0 HD21 LEU A 118 2.538 -6.598 -2.329 1.00 0.00 H new ATOM 0 HD22 LEU A 118 0.876 -6.754 -1.711 1.00 0.00 H new ATOM 0 HD23 LEU A 118 2.237 -6.595 -0.575 1.00 0.00 H new ATOM 1425 N LYS A 119 0.066 -12.025 -0.750 1.00 0.00 N ATOM 1426 CA LYS A 119 -0.410 -13.134 -1.559 1.00 0.00 C ATOM 1427 C LYS A 119 0.172 -13.018 -2.969 1.00 0.00 C ATOM 1428 O LYS A 119 0.865 -12.050 -3.280 1.00 0.00 O ATOM 1429 CB LYS A 119 -1.938 -13.202 -1.527 1.00 0.00 C ATOM 1430 CG LYS A 119 -2.418 -14.642 -1.330 1.00 0.00 C ATOM 1431 CD LYS A 119 -3.736 -14.886 -2.067 1.00 0.00 C ATOM 1432 CE LYS A 119 -3.521 -15.767 -3.299 1.00 0.00 C ATOM 1433 NZ LYS A 119 -4.819 -16.226 -3.842 1.00 0.00 N ATOM 0 H LYS A 119 -0.656 -11.554 -0.204 1.00 0.00 H new ATOM 0 HA LYS A 119 -0.063 -14.082 -1.149 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -2.317 -12.575 -0.720 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -2.343 -12.804 -2.457 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -1.660 -15.335 -1.694 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -2.549 -14.843 -0.267 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -4.450 -15.363 -1.395 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -4.170 -13.933 -2.369 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -2.978 -15.209 -4.062 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -2.906 -16.627 -3.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -4.654 -16.823 -4.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -5.323 -16.776 -3.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -5.393 -15.402 -4.113 1.00 0.00 H new ATOM 1443 N ASP A 120 -0.133 -14.016 -3.785 1.00 0.00 N ATOM 1444 CA ASP A 120 0.351 -14.038 -5.154 1.00 0.00 C ATOM 1445 C ASP A 120 1.863 -14.275 -5.153 1.00 0.00 C ATOM 1446 O ASP A 120 2.504 -14.221 -6.201 1.00 0.00 O ATOM 1447 CB ASP A 120 0.083 -12.705 -5.855 1.00 0.00 C ATOM 1448 CG ASP A 120 -0.417 -12.820 -7.296 1.00 0.00 C ATOM 1449 OD1 ASP A 120 -0.354 -13.949 -7.830 1.00 0.00 O ATOM 1450 OD2 ASP A 120 -0.851 -11.777 -7.831 1.00 0.00 O ATOM 0 H ASP A 120 -0.710 -14.816 -3.524 1.00 0.00 H new ATOM 0 HA ASP A 120 -0.171 -14.835 -5.683 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -0.653 -12.148 -5.275 1.00 0.00 H new ATOM 0 HB3 ASP A 120 1.002 -12.119 -5.851 1.00 0.00 H new ATOM 1454 N GLU A 121 2.388 -14.534 -3.965 1.00 0.00 N ATOM 1455 CA GLU A 121 3.813 -14.779 -3.814 1.00 0.00 C ATOM 1456 C GLU A 121 4.616 -13.593 -4.350 1.00 0.00 C ATOM 1457 O GLU A 121 5.192 -13.668 -5.435 1.00 0.00 O ATOM 1458 CB GLU A 121 4.222 -16.079 -4.509 1.00 0.00 C ATOM 1459 CG GLU A 121 4.636 -17.140 -3.489 1.00 0.00 C ATOM 1460 CD GLU A 121 4.323 -18.547 -4.004 1.00 0.00 C ATOM 1461 OE1 GLU A 121 4.967 -18.943 -4.999 1.00 0.00 O ATOM 1462 OE2 GLU A 121 3.446 -19.194 -3.391 1.00 0.00 O ATOM 0 H GLU A 121 1.853 -14.580 -3.098 1.00 0.00 H new ATOM 0 HA GLU A 121 4.032 -14.889 -2.752 1.00 0.00 H new ATOM 0 HB2 GLU A 121 3.392 -16.451 -5.109 1.00 0.00 H new ATOM 0 HB3 GLU A 121 5.048 -15.885 -5.193 1.00 0.00 H new ATOM 0 HG2 GLU A 121 5.703 -17.054 -3.282 1.00 0.00 H new ATOM 0 HG3 GLU A 121 4.113 -16.969 -2.548 1.00 0.00 H new ATOM 1467 N ASN A 122 4.629 -12.524 -3.567 1.00 0.00 N ATOM 1468 CA ASN A 122 5.351 -11.324 -3.950 1.00 0.00 C ATOM 1469 C ASN A 122 5.844 -10.607 -2.691 1.00 0.00 C ATOM 1470 O ASN A 122 5.117 -10.506 -1.705 1.00 0.00 O ATOM 1471 CB ASN A 122 4.447 -10.359 -4.719 1.00 0.00 C ATOM 1472 CG ASN A 122 4.920 -10.201 -6.166 1.00 0.00 C ATOM 1473 OD1 ASN A 122 5.000 -11.150 -6.928 1.00 0.00 O ATOM 1474 ND2 ASN A 122 5.229 -8.951 -6.501 1.00 0.00 N ATOM 0 H ASN A 122 4.150 -12.465 -2.668 1.00 0.00 H new ATOM 0 HA ASN A 122 6.185 -11.621 -4.586 1.00 0.00 H new ATOM 0 HB2 ASN A 122 3.421 -10.727 -4.706 1.00 0.00 H new ATOM 0 HB3 ASN A 122 4.443 -9.387 -4.226 1.00 0.00 H new ATOM 0 HD21 ASN A 122 5.555 -8.742 -7.444 1.00 0.00 H new ATOM 0 HD22 ASN A 122 5.139 -8.202 -5.814 1.00 0.00 H new ATOM 1480 N SER A 123 7.077 -10.128 -2.766 1.00 0.00 N ATOM 1481 CA SER A 123 7.676 -9.424 -1.644 1.00 0.00 C ATOM 1482 C SER A 123 7.917 -7.959 -2.016 1.00 0.00 C ATOM 1483 O SER A 123 8.140 -7.639 -3.182 1.00 0.00 O ATOM 1484 CB SER A 123 8.987 -10.085 -1.216 1.00 0.00 C ATOM 1485 OG SER A 123 10.087 -9.182 -1.281 1.00 0.00 O ATOM 0 H SER A 123 7.678 -10.213 -3.586 1.00 0.00 H new ATOM 0 HA SER A 123 6.986 -9.471 -0.802 1.00 0.00 H new ATOM 0 HB2 SER A 123 8.887 -10.462 -0.198 1.00 0.00 H new ATOM 0 HB3 SER A 123 9.185 -10.945 -1.856 1.00 0.00 H new ATOM 0 HG SER A 123 10.905 -9.642 -0.998 1.00 0.00 H new ATOM 1490 N VAL A 124 7.864 -7.109 -1.001 1.00 0.00 N ATOM 1491 CA VAL A 124 8.074 -5.686 -1.205 1.00 0.00 C ATOM 1492 C VAL A 124 9.144 -5.187 -0.232 1.00 0.00 C ATOM 1493 O VAL A 124 9.610 -5.939 0.622 1.00 0.00 O ATOM 1494 CB VAL A 124 6.747 -4.936 -1.069 1.00 0.00 C ATOM 1495 CG1 VAL A 124 6.728 -3.689 -1.955 1.00 0.00 C ATOM 1496 CG2 VAL A 124 5.564 -5.853 -1.388 1.00 0.00 C ATOM 0 H VAL A 124 7.679 -7.379 -0.035 1.00 0.00 H new ATOM 0 HA VAL A 124 8.438 -5.496 -2.214 1.00 0.00 H new ATOM 0 HB VAL A 124 6.650 -4.612 -0.033 1.00 0.00 H new ATOM 0 HG11 VAL A 124 5.774 -3.175 -1.839 1.00 0.00 H new ATOM 0 HG12 VAL A 124 7.538 -3.021 -1.661 1.00 0.00 H new ATOM 0 HG13 VAL A 124 6.859 -3.981 -2.997 1.00 0.00 H new ATOM 0 HG21 VAL A 124 4.633 -5.296 -1.284 1.00 0.00 H new ATOM 0 HG22 VAL A 124 5.654 -6.221 -2.410 1.00 0.00 H new ATOM 0 HG23 VAL A 124 5.561 -6.696 -0.698 1.00 0.00 H new ATOM 1506 N ILE A 125 9.504 -3.921 -0.396 1.00 0.00 N ATOM 1507 CA ILE A 125 10.511 -3.315 0.458 1.00 0.00 C ATOM 1508 C ILE A 125 10.027 -1.935 0.907 1.00 0.00 C ATOM 1509 O ILE A 125 10.445 -0.916 0.358 1.00 0.00 O ATOM 1510 CB ILE A 125 11.867 -3.290 -0.249 1.00 0.00 C ATOM 1511 CG1 ILE A 125 12.314 -4.703 -0.628 1.00 0.00 C ATOM 1512 CG2 ILE A 125 12.915 -2.566 0.600 1.00 0.00 C ATOM 1513 CD1 ILE A 125 12.583 -4.808 -2.131 1.00 0.00 C ATOM 0 H ILE A 125 9.117 -3.300 -1.107 1.00 0.00 H new ATOM 0 HA ILE A 125 10.657 -3.912 1.358 1.00 0.00 H new ATOM 0 HB ILE A 125 11.758 -2.727 -1.176 1.00 0.00 H new ATOM 0 HG12 ILE A 125 13.216 -4.964 -0.074 1.00 0.00 H new ATOM 0 HG13 ILE A 125 11.545 -5.421 -0.341 1.00 0.00 H new ATOM 0 HG21 ILE A 125 13.870 -2.562 0.074 1.00 0.00 H new ATOM 0 HG22 ILE A 125 12.594 -1.539 0.777 1.00 0.00 H new ATOM 0 HG23 ILE A 125 13.028 -3.080 1.555 1.00 0.00 H new ATOM 0 HD11 ILE A 125 12.899 -5.822 -2.374 1.00 0.00 H new ATOM 0 HD12 ILE A 125 11.673 -4.570 -2.681 1.00 0.00 H new ATOM 0 HD13 ILE A 125 13.369 -4.106 -2.410 1.00 0.00 H new ATOM 1524 N PHE A 126 9.152 -1.945 1.902 1.00 0.00 N ATOM 1525 CA PHE A 126 8.605 -0.707 2.432 1.00 0.00 C ATOM 1526 C PHE A 126 9.623 0.001 3.329 1.00 0.00 C ATOM 1527 O PHE A 126 10.552 -0.626 3.836 1.00 0.00 O ATOM 1528 CB PHE A 126 7.380 -1.080 3.268 1.00 0.00 C ATOM 1529 CG PHE A 126 6.096 -1.241 2.450 1.00 0.00 C ATOM 1530 CD1 PHE A 126 5.855 -0.420 1.393 1.00 0.00 C ATOM 1531 CD2 PHE A 126 5.195 -2.205 2.783 1.00 0.00 C ATOM 1532 CE1 PHE A 126 4.664 -0.571 0.635 1.00 0.00 C ATOM 1533 CE2 PHE A 126 4.004 -2.354 2.025 1.00 0.00 C ATOM 1534 CZ PHE A 126 3.763 -1.534 0.967 1.00 0.00 C ATOM 0 H PHE A 126 8.808 -2.791 2.355 1.00 0.00 H new ATOM 0 HA PHE A 126 8.349 -0.033 1.614 1.00 0.00 H new ATOM 0 HB2 PHE A 126 7.582 -2.012 3.795 1.00 0.00 H new ATOM 0 HB3 PHE A 126 7.222 -0.313 4.026 1.00 0.00 H new ATOM 0 HD1 PHE A 126 6.569 0.346 1.130 1.00 0.00 H new ATOM 0 HD2 PHE A 126 5.386 -2.856 3.623 1.00 0.00 H new ATOM 0 HE1 PHE A 126 4.473 0.079 -0.206 1.00 0.00 H new ATOM 0 HE2 PHE A 126 3.289 -3.119 2.289 1.00 0.00 H new ATOM 0 HZ PHE A 126 2.857 -1.648 0.391 1.00 0.00 H new ATOM 1543 N SER A 127 9.414 1.298 3.497 1.00 0.00 N ATOM 1544 CA SER A 127 10.301 2.099 4.325 1.00 0.00 C ATOM 1545 C SER A 127 9.488 3.092 5.157 1.00 0.00 C ATOM 1546 O SER A 127 9.008 4.096 4.634 1.00 0.00 O ATOM 1547 CB SER A 127 11.331 2.840 3.470 1.00 0.00 C ATOM 1548 OG SER A 127 12.367 1.976 3.013 1.00 0.00 O ATOM 0 H SER A 127 8.643 1.815 3.074 1.00 0.00 H new ATOM 0 HA SER A 127 10.839 1.430 4.996 1.00 0.00 H new ATOM 0 HB2 SER A 127 10.832 3.293 2.613 1.00 0.00 H new ATOM 0 HB3 SER A 127 11.767 3.653 4.051 1.00 0.00 H new ATOM 0 HG SER A 127 11.985 1.285 2.432 1.00 0.00 H new ATOM 1553 N ALA A 128 9.357 2.775 6.436 1.00 0.00 N ATOM 1554 CA ALA A 128 8.611 3.628 7.346 1.00 0.00 C ATOM 1555 C ALA A 128 9.587 4.389 8.243 1.00 0.00 C ATOM 1556 O ALA A 128 10.601 3.839 8.671 1.00 0.00 O ATOM 1557 CB ALA A 128 7.623 2.778 8.147 1.00 0.00 C ATOM 0 H ALA A 128 9.755 1.939 6.864 1.00 0.00 H new ATOM 0 HA ALA A 128 8.032 4.366 6.791 1.00 0.00 H new ATOM 0 HB1 ALA A 128 7.063 3.417 8.830 1.00 0.00 H new ATOM 0 HB2 ALA A 128 6.932 2.283 7.464 1.00 0.00 H new ATOM 0 HB3 ALA A 128 8.169 2.027 8.718 1.00 0.00 H new ATOM 1563 N LYS A 129 9.249 5.644 8.503 1.00 0.00 N ATOM 1564 CA LYS A 129 10.083 6.486 9.342 1.00 0.00 C ATOM 1565 C LYS A 129 9.398 6.690 10.695 1.00 0.00 C ATOM 1566 O LYS A 129 9.993 7.242 11.619 1.00 0.00 O ATOM 1567 CB LYS A 129 10.423 7.792 8.622 1.00 0.00 C ATOM 1568 CG LYS A 129 9.166 8.632 8.387 1.00 0.00 C ATOM 1569 CD LYS A 129 9.019 8.998 6.909 1.00 0.00 C ATOM 1570 CE LYS A 129 8.643 10.473 6.744 1.00 0.00 C ATOM 1571 NZ LYS A 129 7.895 10.679 5.485 1.00 0.00 N ATOM 0 H LYS A 129 8.408 6.098 8.147 1.00 0.00 H new ATOM 0 HA LYS A 129 11.038 5.999 9.538 1.00 0.00 H new ATOM 0 HB2 LYS A 129 11.140 8.361 9.213 1.00 0.00 H new ATOM 0 HB3 LYS A 129 10.901 7.571 7.668 1.00 0.00 H new ATOM 0 HG2 LYS A 129 8.287 8.078 8.717 1.00 0.00 H new ATOM 0 HG3 LYS A 129 9.214 9.541 8.987 1.00 0.00 H new ATOM 0 HD2 LYS A 129 9.954 8.797 6.386 1.00 0.00 H new ATOM 0 HD3 LYS A 129 8.255 8.371 6.449 1.00 0.00 H new ATOM 0 HE2 LYS A 129 8.038 10.797 7.591 1.00 0.00 H new ATOM 0 HE3 LYS A 129 9.544 11.086 6.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 7.648 11.685 5.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 8.485 10.389 4.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 7.025 10.109 5.501 1.00 0.00 H new ATOM 1581 N SER A 130 8.156 6.233 10.768 1.00 0.00 N ATOM 1582 CA SER A 130 7.383 6.359 11.992 1.00 0.00 C ATOM 1583 C SER A 130 7.269 4.997 12.680 1.00 0.00 C ATOM 1584 O SER A 130 6.636 4.083 12.154 1.00 0.00 O ATOM 1585 CB SER A 130 5.992 6.929 11.708 1.00 0.00 C ATOM 1586 OG SER A 130 5.973 8.352 11.782 1.00 0.00 O ATOM 0 H SER A 130 7.666 5.775 9.999 1.00 0.00 H new ATOM 0 HA SER A 130 7.901 7.052 12.655 1.00 0.00 H new ATOM 0 HB2 SER A 130 5.666 6.613 10.717 1.00 0.00 H new ATOM 0 HB3 SER A 130 5.279 6.519 12.424 1.00 0.00 H new ATOM 0 HG SER A 130 5.068 8.677 11.593 1.00 0.00 H new ATOM 1591 N ALA A 131 7.890 4.906 13.847 1.00 0.00 N ATOM 1592 CA ALA A 131 7.865 3.671 14.613 1.00 0.00 C ATOM 1593 C ALA A 131 6.433 3.136 14.662 1.00 0.00 C ATOM 1594 O ALA A 131 6.219 1.924 14.661 1.00 0.00 O ATOM 1595 CB ALA A 131 8.441 3.925 16.008 1.00 0.00 C ATOM 0 H ALA A 131 8.413 5.667 14.281 1.00 0.00 H new ATOM 0 HA ALA A 131 8.485 2.911 14.137 1.00 0.00 H new ATOM 0 HB1 ALA A 131 8.423 2.999 16.583 1.00 0.00 H new ATOM 0 HB2 ALA A 131 9.469 4.276 15.919 1.00 0.00 H new ATOM 0 HB3 ALA A 131 7.842 4.680 16.517 1.00 0.00 H new ATOM 1601 N GLU A 132 5.489 4.064 14.704 1.00 0.00 N ATOM 1602 CA GLU A 132 4.083 3.699 14.754 1.00 0.00 C ATOM 1603 C GLU A 132 3.636 3.127 13.408 1.00 0.00 C ATOM 1604 O GLU A 132 2.923 2.125 13.362 1.00 0.00 O ATOM 1605 CB GLU A 132 3.220 4.897 15.155 1.00 0.00 C ATOM 1606 CG GLU A 132 2.564 4.670 16.518 1.00 0.00 C ATOM 1607 CD GLU A 132 1.089 4.291 16.360 1.00 0.00 C ATOM 1608 OE1 GLU A 132 0.349 5.120 15.786 1.00 0.00 O ATOM 1609 OE2 GLU A 132 0.736 3.183 16.817 1.00 0.00 O ATOM 0 H GLU A 132 5.670 5.068 14.704 1.00 0.00 H new ATOM 0 HA GLU A 132 3.954 2.929 15.515 1.00 0.00 H new ATOM 0 HB2 GLU A 132 3.834 5.797 15.189 1.00 0.00 H new ATOM 0 HB3 GLU A 132 2.451 5.064 14.401 1.00 0.00 H new ATOM 0 HG2 GLU A 132 3.091 3.880 17.052 1.00 0.00 H new ATOM 0 HG3 GLU A 132 2.648 5.574 17.121 1.00 0.00 H new ATOM 1614 N GLU A 133 4.072 3.786 12.345 1.00 0.00 N ATOM 1615 CA GLU A 133 3.725 3.355 11.002 1.00 0.00 C ATOM 1616 C GLU A 133 4.242 1.937 10.750 1.00 0.00 C ATOM 1617 O GLU A 133 3.537 1.109 10.174 1.00 0.00 O ATOM 1618 CB GLU A 133 4.269 4.330 9.956 1.00 0.00 C ATOM 1619 CG GLU A 133 3.334 5.530 9.788 1.00 0.00 C ATOM 1620 CD GLU A 133 3.636 6.282 8.490 1.00 0.00 C ATOM 1621 OE1 GLU A 133 4.686 6.961 8.459 1.00 0.00 O ATOM 1622 OE2 GLU A 133 2.811 6.163 7.559 1.00 0.00 O ATOM 0 H GLU A 133 4.663 4.616 12.387 1.00 0.00 H new ATOM 0 HA GLU A 133 2.639 3.346 10.913 1.00 0.00 H new ATOM 0 HB2 GLU A 133 5.259 4.675 10.255 1.00 0.00 H new ATOM 0 HB3 GLU A 133 4.384 3.818 9.001 1.00 0.00 H new ATOM 0 HG2 GLU A 133 2.298 5.191 9.784 1.00 0.00 H new ATOM 0 HG3 GLU A 133 3.445 6.204 10.637 1.00 0.00 H new ATOM 1627 N LYS A 134 5.468 1.700 11.194 1.00 0.00 N ATOM 1628 CA LYS A 134 6.086 0.396 11.024 1.00 0.00 C ATOM 1629 C LYS A 134 5.196 -0.673 11.661 1.00 0.00 C ATOM 1630 O LYS A 134 4.993 -1.741 11.084 1.00 0.00 O ATOM 1631 CB LYS A 134 7.517 0.408 11.566 1.00 0.00 C ATOM 1632 CG LYS A 134 8.092 -1.009 11.626 1.00 0.00 C ATOM 1633 CD LYS A 134 9.427 -1.029 12.373 1.00 0.00 C ATOM 1634 CE LYS A 134 9.327 -1.861 13.653 1.00 0.00 C ATOM 1635 NZ LYS A 134 10.562 -2.649 13.856 1.00 0.00 N ATOM 0 H LYS A 134 6.050 2.389 11.671 1.00 0.00 H new ATOM 0 HA LYS A 134 6.172 0.150 9.966 1.00 0.00 H new ATOM 0 HB2 LYS A 134 8.145 1.033 10.931 1.00 0.00 H new ATOM 0 HB3 LYS A 134 7.529 0.852 12.561 1.00 0.00 H new ATOM 0 HG2 LYS A 134 7.384 -1.672 12.123 1.00 0.00 H new ATOM 0 HG3 LYS A 134 8.231 -1.392 10.615 1.00 0.00 H new ATOM 0 HD2 LYS A 134 10.203 -1.440 11.727 1.00 0.00 H new ATOM 0 HD3 LYS A 134 9.725 -0.010 12.620 1.00 0.00 H new ATOM 0 HE2 LYS A 134 9.162 -1.205 14.508 1.00 0.00 H new ATOM 0 HE3 LYS A 134 8.468 -2.529 13.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 10.478 -3.208 14.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 10.703 -3.288 13.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 11.375 -2.006 13.934 1.00 0.00 H new ATOM 1645 N ASN A 135 4.689 -0.350 12.841 1.00 0.00 N ATOM 1646 CA ASN A 135 3.825 -1.269 13.562 1.00 0.00 C ATOM 1647 C ASN A 135 2.434 -1.261 12.926 1.00 0.00 C ATOM 1648 O ASN A 135 1.806 -2.308 12.786 1.00 0.00 O ATOM 1649 CB ASN A 135 3.678 -0.852 15.028 1.00 0.00 C ATOM 1650 CG ASN A 135 3.399 -2.066 15.917 1.00 0.00 C ATOM 1651 OD1 ASN A 135 3.730 -3.194 15.595 1.00 0.00 O ATOM 1652 ND2 ASN A 135 2.771 -1.771 17.052 1.00 0.00 N ATOM 0 H ASN A 135 4.860 0.536 13.316 1.00 0.00 H new ATOM 0 HA ASN A 135 4.273 -2.261 13.513 1.00 0.00 H new ATOM 0 HB2 ASN A 135 4.588 -0.354 15.361 1.00 0.00 H new ATOM 0 HB3 ASN A 135 2.866 -0.131 15.125 1.00 0.00 H new ATOM 0 HD21 ASN A 135 2.539 -2.512 17.714 1.00 0.00 H new ATOM 0 HD22 ASN A 135 2.522 -0.804 17.261 1.00 0.00 H new ATOM 1658 N ASN A 136 1.994 -0.066 12.559 1.00 0.00 N ATOM 1659 CA ASN A 136 0.689 0.093 11.940 1.00 0.00 C ATOM 1660 C ASN A 136 0.766 -0.344 10.477 1.00 0.00 C ATOM 1661 O ASN A 136 -0.261 -0.571 9.837 1.00 0.00 O ATOM 1662 CB ASN A 136 0.237 1.554 11.975 1.00 0.00 C ATOM 1663 CG ASN A 136 -1.036 1.715 12.809 1.00 0.00 C ATOM 1664 OD1 ASN A 136 -1.579 0.766 13.349 1.00 0.00 O ATOM 1665 ND2 ASN A 136 -1.479 2.967 12.882 1.00 0.00 N ATOM 0 H ASN A 136 2.518 0.801 12.678 1.00 0.00 H new ATOM 0 HA ASN A 136 -0.023 -0.518 12.494 1.00 0.00 H new ATOM 0 HB2 ASN A 136 1.030 2.174 12.393 1.00 0.00 H new ATOM 0 HB3 ASN A 136 0.058 1.907 10.960 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -2.322 3.179 13.415 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -0.975 3.715 12.405 1.00 0.00 H new ATOM 1671 N TRP A 137 1.993 -0.448 9.987 1.00 0.00 N ATOM 1672 CA TRP A 137 2.217 -0.854 8.609 1.00 0.00 C ATOM 1673 C TRP A 137 2.109 -2.378 8.542 1.00 0.00 C ATOM 1674 O TRP A 137 1.482 -2.920 7.632 1.00 0.00 O ATOM 1675 CB TRP A 137 3.558 -0.326 8.095 1.00 0.00 C ATOM 1676 CG TRP A 137 3.540 1.157 7.719 1.00 0.00 C ATOM 1677 CD1 TRP A 137 2.602 2.070 8.006 1.00 0.00 C ATOM 1678 CD2 TRP A 137 4.550 1.867 6.970 1.00 0.00 C ATOM 1679 NE1 TRP A 137 2.932 3.310 7.499 1.00 0.00 N ATOM 1680 CE2 TRP A 137 4.155 3.183 6.850 1.00 0.00 C ATOM 1681 CE3 TRP A 137 5.759 1.411 6.415 1.00 0.00 C ATOM 1682 CZ2 TRP A 137 4.909 4.152 6.177 1.00 0.00 C ATOM 1683 CZ3 TRP A 137 6.501 2.391 5.746 1.00 0.00 C ATOM 1684 CH2 TRP A 137 6.116 3.720 5.615 1.00 0.00 C ATOM 0 H TRP A 137 2.842 -0.258 10.519 1.00 0.00 H new ATOM 0 HA TRP A 137 1.462 -0.423 7.951 1.00 0.00 H new ATOM 0 HB2 TRP A 137 4.318 -0.487 8.860 1.00 0.00 H new ATOM 0 HB3 TRP A 137 3.856 -0.908 7.223 1.00 0.00 H new ATOM 0 HD1 TRP A 137 1.701 1.861 8.564 1.00 0.00 H new ATOM 0 HE1 TRP A 137 2.380 4.163 7.585 1.00 0.00 H new ATOM 0 HE3 TRP A 137 6.089 0.386 6.498 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 4.577 5.177 6.096 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 7.439 2.094 5.300 1.00 0.00 H new ATOM 0 HH2 TRP A 137 6.746 4.417 5.082 1.00 0.00 H new ATOM 1694 N MET A 138 2.728 -3.028 9.517 1.00 0.00 N ATOM 1695 CA MET A 138 2.709 -4.479 9.579 1.00 0.00 C ATOM 1696 C MET A 138 1.430 -4.982 10.252 1.00 0.00 C ATOM 1697 O MET A 138 0.871 -6.001 9.848 1.00 0.00 O ATOM 1698 CB MET A 138 3.926 -4.973 10.363 1.00 0.00 C ATOM 1699 CG MET A 138 4.053 -4.238 11.699 1.00 0.00 C ATOM 1700 SD MET A 138 4.114 -5.416 13.040 1.00 0.00 S ATOM 1701 CE MET A 138 2.492 -6.146 12.884 1.00 0.00 C ATOM 0 H MET A 138 3.246 -2.576 10.270 1.00 0.00 H new ATOM 0 HA MET A 138 2.739 -4.868 8.561 1.00 0.00 H new ATOM 0 HB2 MET A 138 3.838 -6.045 10.540 1.00 0.00 H new ATOM 0 HB3 MET A 138 4.830 -4.821 9.773 1.00 0.00 H new ATOM 0 HG2 MET A 138 4.954 -3.624 11.702 1.00 0.00 H new ATOM 0 HG3 MET A 138 3.207 -3.564 11.834 1.00 0.00 H new ATOM 0 HE1 MET A 138 2.400 -6.980 13.580 1.00 0.00 H new ATOM 0 HE2 MET A 138 1.733 -5.398 13.111 1.00 0.00 H new ATOM 0 HE3 MET A 138 2.352 -6.507 11.865 1.00 0.00 H new ATOM 1709 N ALA A 139 1.004 -4.244 11.267 1.00 0.00 N ATOM 1710 CA ALA A 139 -0.199 -4.603 11.999 1.00 0.00 C ATOM 1711 C ALA A 139 -1.401 -4.552 11.054 1.00 0.00 C ATOM 1712 O ALA A 139 -2.220 -5.470 11.035 1.00 0.00 O ATOM 1713 CB ALA A 139 -0.361 -3.669 13.201 1.00 0.00 C ATOM 0 H ALA A 139 1.470 -3.400 11.599 1.00 0.00 H new ATOM 0 HA ALA A 139 -0.126 -5.620 12.383 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.263 -3.937 13.751 1.00 0.00 H new ATOM 0 HB2 ALA A 139 0.505 -3.765 13.856 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -0.441 -2.639 12.853 1.00 0.00 H new ATOM 1719 N ALA A 140 -1.469 -3.470 10.292 1.00 0.00 N ATOM 1720 CA ALA A 140 -2.557 -3.287 9.346 1.00 0.00 C ATOM 1721 C ALA A 140 -2.562 -4.449 8.351 1.00 0.00 C ATOM 1722 O ALA A 140 -3.621 -4.975 8.011 1.00 0.00 O ATOM 1723 CB ALA A 140 -2.412 -1.929 8.657 1.00 0.00 C ATOM 0 H ALA A 140 -0.788 -2.711 10.310 1.00 0.00 H new ATOM 0 HA ALA A 140 -3.518 -3.290 9.861 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -3.228 -1.792 7.948 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -2.444 -1.136 9.405 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -1.460 -1.890 8.127 1.00 0.00 H new ATOM 1729 N LEU A 141 -1.367 -4.815 7.911 1.00 0.00 N ATOM 1730 CA LEU A 141 -1.220 -5.904 6.961 1.00 0.00 C ATOM 1731 C LEU A 141 -1.659 -7.213 7.621 1.00 0.00 C ATOM 1732 O LEU A 141 -2.423 -7.980 7.039 1.00 0.00 O ATOM 1733 CB LEU A 141 0.205 -5.943 6.406 1.00 0.00 C ATOM 1734 CG LEU A 141 0.343 -5.731 4.897 1.00 0.00 C ATOM 1735 CD1 LEU A 141 0.461 -4.243 4.561 1.00 0.00 C ATOM 1736 CD2 LEU A 141 1.513 -6.539 4.334 1.00 0.00 C ATOM 0 H LEU A 141 -0.491 -4.376 8.195 1.00 0.00 H new ATOM 0 HA LEU A 141 -1.868 -5.747 6.099 1.00 0.00 H new ATOM 0 HB2 LEU A 141 0.793 -5.180 6.915 1.00 0.00 H new ATOM 0 HB3 LEU A 141 0.646 -6.907 6.659 1.00 0.00 H new ATOM 0 HG LEU A 141 -0.563 -6.099 4.417 1.00 0.00 H new ATOM 0 HD11 LEU A 141 0.558 -4.120 3.482 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -0.431 -3.720 4.907 1.00 0.00 H new ATOM 0 HD13 LEU A 141 1.340 -3.827 5.054 1.00 0.00 H new ATOM 0 HD21 LEU A 141 1.588 -6.370 3.260 1.00 0.00 H new ATOM 0 HD22 LEU A 141 2.438 -6.224 4.817 1.00 0.00 H new ATOM 0 HD23 LEU A 141 1.347 -7.600 4.524 1.00 0.00 H new ATOM 1747 N ILE A 142 -1.156 -7.427 8.828 1.00 0.00 N ATOM 1748 CA ILE A 142 -1.486 -8.630 9.573 1.00 0.00 C ATOM 1749 C ILE A 142 -2.960 -8.583 9.982 1.00 0.00 C ATOM 1750 O ILE A 142 -3.542 -9.606 10.339 1.00 0.00 O ATOM 1751 CB ILE A 142 -0.527 -8.812 10.751 1.00 0.00 C ATOM 1752 CG1 ILE A 142 0.891 -9.117 10.260 1.00 0.00 C ATOM 1753 CG2 ILE A 142 -1.041 -9.879 11.718 1.00 0.00 C ATOM 1754 CD1 ILE A 142 0.896 -10.318 9.313 1.00 0.00 C ATOM 0 H ILE A 142 -0.523 -6.788 9.308 1.00 0.00 H new ATOM 0 HA ILE A 142 -1.356 -9.513 8.947 1.00 0.00 H new ATOM 0 HB ILE A 142 -0.482 -7.874 11.304 1.00 0.00 H new ATOM 0 HG12 ILE A 142 1.298 -8.245 9.749 1.00 0.00 H new ATOM 0 HG13 ILE A 142 1.540 -9.319 11.113 1.00 0.00 H new ATOM 0 HG21 ILE A 142 -0.340 -9.988 12.546 1.00 0.00 H new ATOM 0 HG22 ILE A 142 -2.016 -9.581 12.105 1.00 0.00 H new ATOM 0 HG23 ILE A 142 -1.134 -10.830 11.194 1.00 0.00 H new ATOM 0 HD11 ILE A 142 1.915 -10.514 8.979 1.00 0.00 H new ATOM 0 HD12 ILE A 142 0.511 -11.194 9.835 1.00 0.00 H new ATOM 0 HD13 ILE A 142 0.266 -10.103 8.450 1.00 0.00 H new ATOM 1765 N SER A 143 -3.520 -7.384 9.919 1.00 0.00 N ATOM 1766 CA SER A 143 -4.915 -7.189 10.280 1.00 0.00 C ATOM 1767 C SER A 143 -5.820 -7.853 9.241 1.00 0.00 C ATOM 1768 O SER A 143 -6.792 -8.519 9.595 1.00 0.00 O ATOM 1769 CB SER A 143 -5.249 -5.701 10.402 1.00 0.00 C ATOM 1770 OG SER A 143 -6.409 -5.479 11.201 1.00 0.00 O ATOM 0 H SER A 143 -3.034 -6.538 9.623 1.00 0.00 H new ATOM 0 HA SER A 143 -5.086 -7.652 11.252 1.00 0.00 H new ATOM 0 HB2 SER A 143 -4.401 -5.174 10.839 1.00 0.00 H new ATOM 0 HB3 SER A 143 -5.407 -5.282 9.408 1.00 0.00 H new ATOM 0 HG SER A 143 -6.589 -4.517 11.257 1.00 0.00 H new ATOM 1775 N LEU A 144 -5.470 -7.648 7.980 1.00 0.00 N ATOM 1776 CA LEU A 144 -6.239 -8.218 6.887 1.00 0.00 C ATOM 1777 C LEU A 144 -6.058 -9.737 6.879 1.00 0.00 C ATOM 1778 O LEU A 144 -7.028 -10.483 7.006 1.00 0.00 O ATOM 1779 CB LEU A 144 -5.867 -7.548 5.563 1.00 0.00 C ATOM 1780 CG LEU A 144 -6.298 -6.089 5.406 1.00 0.00 C ATOM 1781 CD1 LEU A 144 -5.879 -5.537 4.042 1.00 0.00 C ATOM 1782 CD2 LEU A 144 -7.800 -5.929 5.653 1.00 0.00 C ATOM 0 H LEU A 144 -4.664 -7.095 7.691 1.00 0.00 H new ATOM 0 HA LEU A 144 -7.302 -8.024 7.028 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -4.785 -7.601 5.443 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -6.307 -8.126 4.750 1.00 0.00 H new ATOM 0 HG LEU A 144 -5.784 -5.499 6.164 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -6.198 -4.498 3.956 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -4.795 -5.593 3.944 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -6.346 -6.126 3.252 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -8.079 -4.882 5.535 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -8.353 -6.535 4.936 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -8.039 -6.256 6.665 1.00 0.00 H new ATOM 1793 N GLN A 145 -4.808 -10.151 6.728 1.00 0.00 N ATOM 1794 CA GLN A 145 -4.486 -11.568 6.703 1.00 0.00 C ATOM 1795 C GLN A 145 -5.186 -12.292 7.855 1.00 0.00 C ATOM 1796 O GLN A 145 -5.416 -13.499 7.786 1.00 0.00 O ATOM 1797 CB GLN A 145 -2.973 -11.787 6.755 1.00 0.00 C ATOM 1798 CG GLN A 145 -2.466 -11.773 8.198 1.00 0.00 C ATOM 1799 CD GLN A 145 -2.553 -13.167 8.824 1.00 0.00 C ATOM 1800 OE1 GLN A 145 -2.179 -14.165 8.232 1.00 0.00 O ATOM 1801 NE2 GLN A 145 -3.065 -13.177 10.052 1.00 0.00 N ATOM 0 H GLN A 145 -4.006 -9.530 6.622 1.00 0.00 H new ATOM 0 HA GLN A 145 -4.848 -11.987 5.764 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -2.724 -12.740 6.287 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -2.469 -11.009 6.181 1.00 0.00 H new ATOM 0 HG2 GLN A 145 -1.434 -11.424 8.221 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -3.054 -11.069 8.787 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -3.359 -12.303 10.489 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -3.164 -14.058 10.556 1.00 0.00 H new ATOM 1808 N TYR A 146 -5.503 -11.526 8.888 1.00 0.00 N ATOM 1809 CA TYR A 146 -6.171 -12.078 10.054 1.00 0.00 C ATOM 1810 C TYR A 146 -7.656 -12.317 9.772 1.00 0.00 C ATOM 1811 O TYR A 146 -8.241 -13.275 10.275 1.00 0.00 O ATOM 1812 CB TYR A 146 -6.036 -11.027 11.156 1.00 0.00 C ATOM 1813 CG TYR A 146 -5.019 -11.390 12.242 1.00 0.00 C ATOM 1814 CD1 TYR A 146 -4.904 -12.697 12.669 1.00 0.00 C ATOM 1815 CD2 TYR A 146 -4.219 -10.409 12.793 1.00 0.00 C ATOM 1816 CE1 TYR A 146 -3.947 -13.038 13.690 1.00 0.00 C ATOM 1817 CE2 TYR A 146 -3.264 -10.751 13.814 1.00 0.00 C ATOM 1818 CZ TYR A 146 -3.175 -12.049 14.212 1.00 0.00 C ATOM 1819 OH TYR A 146 -2.272 -12.371 15.176 1.00 0.00 O ATOM 0 H TYR A 146 -5.309 -10.526 8.942 1.00 0.00 H new ATOM 0 HA TYR A 146 -5.728 -13.034 10.333 1.00 0.00 H new ATOM 0 HB2 TYR A 146 -5.747 -10.078 10.705 1.00 0.00 H new ATOM 0 HB3 TYR A 146 -7.010 -10.876 11.621 1.00 0.00 H new ATOM 0 HD1 TYR A 146 -5.531 -13.464 12.238 1.00 0.00 H new ATOM 0 HD2 TYR A 146 -4.310 -9.386 12.458 1.00 0.00 H new ATOM 0 HE1 TYR A 146 -3.845 -14.057 14.033 1.00 0.00 H new ATOM 0 HE2 TYR A 146 -2.632 -9.994 14.254 1.00 0.00 H new ATOM 0 HH TYR A 146 -1.790 -11.565 15.455 1.00 0.00 H new ATOM 1828 N ARG A 147 -8.224 -11.429 8.971 1.00 0.00 N ATOM 1829 CA ARG A 147 -9.630 -11.531 8.616 1.00 0.00 C ATOM 1830 C ARG A 147 -9.818 -12.531 7.473 1.00 0.00 C ATOM 1831 O ARG A 147 -10.507 -12.240 6.496 1.00 0.00 O ATOM 1832 CB ARG A 147 -10.191 -10.172 8.193 1.00 0.00 C ATOM 1833 CG ARG A 147 -11.573 -9.935 8.807 1.00 0.00 C ATOM 1834 CD ARG A 147 -11.923 -8.446 8.808 1.00 0.00 C ATOM 1835 NE ARG A 147 -13.135 -8.211 7.991 1.00 0.00 N ATOM 1836 CZ ARG A 147 -13.564 -6.999 7.614 1.00 0.00 C ATOM 1837 NH1 ARG A 147 -12.882 -5.904 7.979 1.00 0.00 N ATOM 1838 NH2 ARG A 147 -14.675 -6.880 6.873 1.00 0.00 N ATOM 0 H ARG A 147 -7.736 -10.635 8.557 1.00 0.00 H new ATOM 0 HA ARG A 147 -10.170 -11.876 9.498 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -9.510 -9.380 8.505 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -10.259 -10.125 7.106 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -12.325 -10.489 8.245 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -11.592 -10.318 9.827 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -12.091 -8.104 9.829 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -11.089 -7.867 8.411 1.00 0.00 H new ATOM 0 HE ARG A 147 -13.678 -9.023 7.697 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -12.037 -5.994 8.543 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -13.208 -4.981 7.692 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -15.195 -7.713 6.596 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -15.001 -5.957 6.587 1.00 0.00 H new ATOM 1849 N SER A 148 -9.193 -13.688 7.634 1.00 0.00 N ATOM 1850 CA SER A 148 -9.284 -14.733 6.627 1.00 0.00 C ATOM 1851 C SER A 148 -9.684 -16.057 7.282 1.00 0.00 C ATOM 1852 O SER A 148 -9.354 -17.128 6.775 1.00 0.00 O ATOM 1853 CB SER A 148 -7.960 -14.890 5.877 1.00 0.00 C ATOM 1854 OG SER A 148 -8.161 -15.198 4.501 1.00 0.00 O ATOM 0 H SER A 148 -8.622 -13.925 8.445 1.00 0.00 H new ATOM 0 HA SER A 148 -10.048 -14.447 5.904 1.00 0.00 H new ATOM 0 HB2 SER A 148 -7.383 -13.969 5.962 1.00 0.00 H new ATOM 0 HB3 SER A 148 -7.370 -15.679 6.343 1.00 0.00 H new ATOM 0 HG SER A 148 -7.371 -14.930 3.987 1.00 0.00 H new ATOM 1859 N THR A 149 -10.389 -15.940 8.398 1.00 0.00 N ATOM 1860 CA THR A 149 -10.837 -17.114 9.127 1.00 0.00 C ATOM 1861 C THR A 149 -11.806 -16.713 10.240 1.00 0.00 C ATOM 1862 O THR A 149 -12.800 -17.398 10.480 1.00 0.00 O ATOM 1863 CB THR A 149 -9.599 -17.855 9.637 1.00 0.00 C ATOM 1864 OG1 THR A 149 -9.918 -19.232 9.454 1.00 0.00 O ATOM 1865 CG2 THR A 149 -9.414 -17.713 11.149 1.00 0.00 C ATOM 0 H THR A 149 -10.661 -15.050 8.815 1.00 0.00 H new ATOM 0 HA THR A 149 -11.396 -17.791 8.481 1.00 0.00 H new ATOM 0 HB THR A 149 -8.714 -17.477 9.126 1.00 0.00 H new ATOM 0 HG1 THR A 149 -9.168 -19.785 9.758 1.00 0.00 H new ATOM 0 HG21 THR A 149 -8.522 -18.257 11.459 1.00 0.00 H new ATOM 0 HG22 THR A 149 -9.303 -16.659 11.405 1.00 0.00 H new ATOM 0 HG23 THR A 149 -10.285 -18.121 11.662 1.00 0.00 H new ATOM 1873 N LEU A 150 -11.484 -15.604 10.890 1.00 0.00 N ATOM 1874 CA LEU A 150 -12.315 -15.104 11.973 1.00 0.00 C ATOM 1875 C LEU A 150 -13.378 -14.164 11.401 1.00 0.00 C ATOM 1876 O LEU A 150 -13.672 -14.206 10.208 1.00 0.00 O ATOM 1877 CB LEU A 150 -11.449 -14.464 13.060 1.00 0.00 C ATOM 1878 CG LEU A 150 -10.822 -13.113 12.709 1.00 0.00 C ATOM 1879 CD1 LEU A 150 -11.290 -12.023 13.676 1.00 0.00 C ATOM 1880 CD2 LEU A 150 -9.295 -13.214 12.656 1.00 0.00 C ATOM 0 H LEU A 150 -10.660 -15.038 10.688 1.00 0.00 H new ATOM 0 HA LEU A 150 -12.842 -15.924 12.460 1.00 0.00 H new ATOM 0 HB2 LEU A 150 -12.058 -14.338 13.955 1.00 0.00 H new ATOM 0 HB3 LEU A 150 -10.648 -15.159 13.315 1.00 0.00 H new ATOM 0 HG LEU A 150 -11.161 -12.828 11.713 1.00 0.00 H new ATOM 0 HD11 LEU A 150 -10.830 -11.073 13.404 1.00 0.00 H new ATOM 0 HD12 LEU A 150 -12.375 -11.929 13.621 1.00 0.00 H new ATOM 0 HD13 LEU A 150 -11.000 -12.289 14.692 1.00 0.00 H new ATOM 0 HD21 LEU A 150 -8.874 -12.240 12.405 1.00 0.00 H new ATOM 0 HD22 LEU A 150 -8.917 -13.532 13.628 1.00 0.00 H new ATOM 0 HD23 LEU A 150 -9.005 -13.941 11.898 1.00 0.00 H new