USER MOD reduce.3.24.130724 H: found=0, std=0, add=981, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 980 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 73 CYS SG : rot 180:sc= -0.146 USER MOD Set 1.2: A 116 HIS : no HD1:sc= -3.07! C(o=-3.2!,f=-3!) USER MOD Set 2.1: A 49 GLN : amide:sc= 0.997 K(o=1.6,f=-1.1) USER MOD Set 2.2: A 64 ASN : amide:sc= 0.642 K(o=1.6,f=-1.6!) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 TYR OH : rot 180:sc= -0.281 USER MOD Single : A 17 SER OG : rot 35:sc= 0.513 USER MOD Single : A 18 LYS NZ :NH3+ 172:sc= -0.475 (180deg=-0.571) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 CYS SG : rot 180:sc=-0.00848 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 ASN : amide:sc= -0.0934 X(o=-0.093,f=-0.048) USER MOD Single : A 31 LYS NZ :NH3+ 145:sc= 0.357 (180deg=-0.0282) USER MOD Single : A 33 LYS NZ :NH3+ -135:sc= 0.0334 (180deg=-0.000521) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 HIS :FLIP no HE2:sc= -1.29 F(o=-2.1,f=-1.3) USER MOD Single : A 41 LYS NZ :NH3+ -137:sc= -0.826 (180deg=-4.2!) USER MOD Single : A 43 THR OG1 : rot 180:sc= -0.289 USER MOD Single : A 45 ASN : amide:sc= 0.155 K(o=0.15,f=-4.7!) USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 LYS NZ :NH3+ 144:sc= 0.287 (180deg=0.0136) USER MOD Single : A 48 THR OG1 : rot -70:sc= -0.849 USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.157 USER MOD Single : A 57 ASN : amide:sc=-0.000633 X(o=-0.00063,f=-0.42) USER MOD Single : A 60 ASN : amide:sc= -0.414 K(o=-0.41,f=-2.3) USER MOD Single : A 70 ASN : amide:sc= -1.24 K(o=-1.2,f=-3.3!) USER MOD Single : A 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 THR OG1 : rot 180:sc= -0.0444 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= 0.144 K(o=0.14,f=-0.96) USER MOD Single : A 80 ASN : amide:sc= -0.477 K(o=-0.48,f=-3.3!) USER MOD Single : A 85 CYS SG : rot 180:sc= 0 USER MOD Single : A 88 ASN : amide:sc= -0.789 K(o=-0.79,f=-2.6!) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 MET CE :methyl 177:sc= 0 (180deg=-0.0122) USER MOD Single : A 107 LYS NZ :NH3+ -115:sc= -0.0558 (180deg=-0.518) USER MOD Single : A 108 THR OG1 : rot -64:sc= -0.21 USER MOD Single : A 109 SER OG : rot 180:sc= -0.191 USER MOD Single : A 117 LYS NZ :NH3+ -165:sc= -0.0149 (180deg=-0.179) USER MOD Single : A 122 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.106) USER MOD Single : A 123 LYS NZ :NH3+ 136:sc= -0.298 (180deg=-1.03) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 8 14.068 15.587 -19.235 1.00 0.00 N ATOM 2 CA GLU A 8 13.135 14.640 -19.836 1.00 0.00 C ATOM 3 C GLU A 8 11.909 14.447 -18.948 1.00 0.00 C ATOM 4 O GLU A 8 11.964 14.667 -17.738 1.00 0.00 O ATOM 5 CB GLU A 8 13.823 13.294 -20.074 1.00 0.00 C ATOM 6 CG GLU A 8 13.102 12.412 -21.080 1.00 0.00 C ATOM 7 CD GLU A 8 13.313 12.867 -22.511 1.00 0.00 C ATOM 8 OE1 GLU A 8 14.351 13.507 -22.783 1.00 0.00 O ATOM 9 OE2 GLU A 8 12.441 12.584 -23.359 1.00 0.00 O ATOM 0 HA GLU A 8 12.809 15.047 -20.793 1.00 0.00 H new ATOM 0 HB2 GLU A 8 14.840 13.472 -20.423 1.00 0.00 H new ATOM 0 HB3 GLU A 8 13.900 12.762 -19.126 1.00 0.00 H new ATOM 0 HG2 GLU A 8 13.452 11.385 -20.974 1.00 0.00 H new ATOM 0 HG3 GLU A 8 12.035 12.410 -20.857 1.00 0.00 H new ATOM 16 N VAL A 9 10.802 14.035 -19.559 1.00 0.00 N ATOM 17 CA VAL A 9 9.562 13.812 -18.826 1.00 0.00 C ATOM 18 C VAL A 9 8.848 12.560 -19.323 1.00 0.00 C ATOM 19 O VAL A 9 8.765 12.315 -20.527 1.00 0.00 O ATOM 20 CB VAL A 9 8.611 15.016 -18.951 1.00 0.00 C ATOM 21 CG1 VAL A 9 7.317 14.756 -18.195 1.00 0.00 C ATOM 22 CG2 VAL A 9 9.287 16.283 -18.447 1.00 0.00 C ATOM 0 H VAL A 9 10.739 13.849 -20.560 1.00 0.00 H new ATOM 0 HA VAL A 9 9.833 13.681 -17.778 1.00 0.00 H new ATOM 0 HB VAL A 9 8.366 15.156 -20.004 1.00 0.00 H new ATOM 0 HG11 VAL A 9 6.658 15.618 -18.295 1.00 0.00 H new ATOM 0 HG12 VAL A 9 6.826 13.874 -18.607 1.00 0.00 H new ATOM 0 HG13 VAL A 9 7.539 14.589 -17.141 1.00 0.00 H new ATOM 0 HG21 VAL A 9 8.601 17.124 -18.543 1.00 0.00 H new ATOM 0 HG22 VAL A 9 9.562 16.157 -17.400 1.00 0.00 H new ATOM 0 HG23 VAL A 9 10.183 16.477 -19.037 1.00 0.00 H new ATOM 32 N LYS A 10 8.331 11.770 -18.388 1.00 0.00 N ATOM 33 CA LYS A 10 7.621 10.543 -18.729 1.00 0.00 C ATOM 34 C LYS A 10 6.207 10.556 -18.159 1.00 0.00 C ATOM 35 O LYS A 10 5.969 11.097 -17.079 1.00 0.00 O ATOM 36 CB LYS A 10 8.384 9.325 -18.203 1.00 0.00 C ATOM 37 CG LYS A 10 9.515 8.875 -19.112 1.00 0.00 C ATOM 38 CD LYS A 10 10.373 7.812 -18.449 1.00 0.00 C ATOM 39 CE LYS A 10 11.272 8.409 -17.378 1.00 0.00 C ATOM 40 NZ LYS A 10 12.512 7.607 -17.184 1.00 0.00 N ATOM 0 H LYS A 10 8.391 11.958 -17.387 1.00 0.00 H new ATOM 0 HA LYS A 10 7.555 10.481 -19.815 1.00 0.00 H new ATOM 0 HB2 LYS A 10 8.791 9.559 -17.219 1.00 0.00 H new ATOM 0 HB3 LYS A 10 7.685 8.499 -18.070 1.00 0.00 H new ATOM 0 HG2 LYS A 10 9.102 8.483 -20.041 1.00 0.00 H new ATOM 0 HG3 LYS A 10 10.135 9.732 -19.375 1.00 0.00 H new ATOM 0 HD2 LYS A 10 9.732 7.051 -18.004 1.00 0.00 H new ATOM 0 HD3 LYS A 10 10.984 7.314 -19.202 1.00 0.00 H new ATOM 0 HE2 LYS A 10 11.539 9.429 -17.655 1.00 0.00 H new ATOM 0 HE3 LYS A 10 10.726 8.467 -16.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 13.098 8.047 -16.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 12.259 6.641 -16.895 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 13.046 7.573 -18.076 1.00 0.00 H new ATOM 54 N GLU A 11 5.273 9.957 -18.890 1.00 0.00 N ATOM 55 CA GLU A 11 3.882 9.900 -18.455 1.00 0.00 C ATOM 56 C GLU A 11 3.611 8.623 -17.665 1.00 0.00 C ATOM 57 O GLU A 11 4.007 7.532 -18.075 1.00 0.00 O ATOM 58 CB GLU A 11 2.943 9.976 -19.661 1.00 0.00 C ATOM 59 CG GLU A 11 3.291 8.992 -20.766 1.00 0.00 C ATOM 60 CD GLU A 11 2.112 8.690 -21.670 1.00 0.00 C ATOM 61 OE1 GLU A 11 1.142 8.067 -21.191 1.00 0.00 O ATOM 62 OE2 GLU A 11 2.159 9.077 -22.856 1.00 0.00 O ATOM 0 H GLU A 11 5.454 9.504 -19.786 1.00 0.00 H new ATOM 0 HA GLU A 11 3.696 10.755 -17.805 1.00 0.00 H new ATOM 0 HB2 GLU A 11 1.922 9.790 -19.328 1.00 0.00 H new ATOM 0 HB3 GLU A 11 2.967 10.988 -20.066 1.00 0.00 H new ATOM 0 HG2 GLU A 11 4.108 9.396 -21.363 1.00 0.00 H new ATOM 0 HG3 GLU A 11 3.650 8.064 -20.321 1.00 0.00 H new ATOM 69 N GLU A 12 2.934 8.768 -16.530 1.00 0.00 N ATOM 70 CA GLU A 12 2.611 7.626 -15.683 1.00 0.00 C ATOM 71 C GLU A 12 1.253 7.813 -15.011 1.00 0.00 C ATOM 72 O GLU A 12 0.972 8.867 -14.440 1.00 0.00 O ATOM 73 CB GLU A 12 3.695 7.429 -14.621 1.00 0.00 C ATOM 74 CG GLU A 12 3.420 6.269 -13.679 1.00 0.00 C ATOM 75 CD GLU A 12 4.600 5.955 -12.779 1.00 0.00 C ATOM 76 OE1 GLU A 12 5.450 5.133 -13.182 1.00 0.00 O ATOM 77 OE2 GLU A 12 4.673 6.531 -11.674 1.00 0.00 O ATOM 0 H GLU A 12 2.599 9.664 -16.176 1.00 0.00 H new ATOM 0 HA GLU A 12 2.565 6.739 -16.315 1.00 0.00 H new ATOM 0 HB2 GLU A 12 4.652 7.265 -15.117 1.00 0.00 H new ATOM 0 HB3 GLU A 12 3.791 8.345 -14.038 1.00 0.00 H new ATOM 0 HG2 GLU A 12 2.551 6.504 -13.064 1.00 0.00 H new ATOM 0 HG3 GLU A 12 3.168 5.384 -14.263 1.00 0.00 H new ATOM 84 N ASP A 13 0.417 6.784 -15.085 1.00 0.00 N ATOM 85 CA ASP A 13 -0.911 6.834 -14.484 1.00 0.00 C ATOM 86 C ASP A 13 -0.829 7.240 -13.016 1.00 0.00 C ATOM 87 O ASP A 13 -1.600 8.077 -12.549 1.00 0.00 O ATOM 88 CB ASP A 13 -1.604 5.477 -14.613 1.00 0.00 C ATOM 89 CG ASP A 13 -3.115 5.598 -14.637 1.00 0.00 C ATOM 90 OD1 ASP A 13 -3.631 6.422 -15.420 1.00 0.00 O ATOM 91 OD2 ASP A 13 -3.781 4.868 -13.873 1.00 0.00 O ATOM 0 H ASP A 13 0.635 5.905 -15.555 1.00 0.00 H new ATOM 0 HA ASP A 13 -1.496 7.584 -15.017 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -1.267 4.986 -15.526 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -1.307 4.840 -13.780 1.00 0.00 H new ATOM 96 N ALA A 14 0.112 6.640 -12.293 1.00 0.00 N ATOM 97 CA ALA A 14 0.296 6.940 -10.879 1.00 0.00 C ATOM 98 C ALA A 14 0.979 8.289 -10.688 1.00 0.00 C ATOM 99 O ALA A 14 1.993 8.578 -11.323 1.00 0.00 O ATOM 100 CB ALA A 14 1.101 5.838 -10.206 1.00 0.00 C ATOM 0 H ALA A 14 0.758 5.943 -12.664 1.00 0.00 H new ATOM 0 HA ALA A 14 -0.688 6.992 -10.413 1.00 0.00 H new ATOM 0 HB1 ALA A 14 1.231 6.075 -9.150 1.00 0.00 H new ATOM 0 HB2 ALA A 14 0.572 4.890 -10.303 1.00 0.00 H new ATOM 0 HB3 ALA A 14 2.078 5.758 -10.683 1.00 0.00 H new ATOM 106 N PHE A 15 0.418 9.113 -9.809 1.00 0.00 N ATOM 107 CA PHE A 15 0.973 10.433 -9.536 1.00 0.00 C ATOM 108 C PHE A 15 2.146 10.340 -8.564 1.00 0.00 C ATOM 109 O PHE A 15 3.204 10.926 -8.794 1.00 0.00 O ATOM 110 CB PHE A 15 -0.106 11.355 -8.963 1.00 0.00 C ATOM 111 CG PHE A 15 -0.779 10.802 -7.739 1.00 0.00 C ATOM 112 CD1 PHE A 15 -0.249 11.026 -6.480 1.00 0.00 C ATOM 113 CD2 PHE A 15 -1.942 10.057 -7.849 1.00 0.00 C ATOM 114 CE1 PHE A 15 -0.865 10.519 -5.351 1.00 0.00 C ATOM 115 CE2 PHE A 15 -2.564 9.548 -6.725 1.00 0.00 C ATOM 116 CZ PHE A 15 -2.024 9.778 -5.474 1.00 0.00 C ATOM 0 H PHE A 15 -0.421 8.889 -9.274 1.00 0.00 H new ATOM 0 HA PHE A 15 1.335 10.849 -10.476 1.00 0.00 H new ATOM 0 HB2 PHE A 15 0.343 12.318 -8.718 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -0.859 11.540 -9.729 1.00 0.00 H new ATOM 0 HD1 PHE A 15 0.657 11.604 -6.378 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -2.367 9.872 -8.824 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -0.441 10.702 -4.375 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -3.471 8.971 -6.824 1.00 0.00 H new ATOM 0 HZ PHE A 15 -2.507 9.379 -4.594 1.00 0.00 H new ATOM 126 N TYR A 16 1.949 9.600 -7.479 1.00 0.00 N ATOM 127 CA TYR A 16 2.988 9.432 -6.470 1.00 0.00 C ATOM 128 C TYR A 16 3.732 8.115 -6.669 1.00 0.00 C ATOM 129 O TYR A 16 3.170 7.036 -6.480 1.00 0.00 O ATOM 130 CB TYR A 16 2.380 9.480 -5.068 1.00 0.00 C ATOM 131 CG TYR A 16 3.399 9.331 -3.960 1.00 0.00 C ATOM 132 CD1 TYR A 16 4.109 10.429 -3.491 1.00 0.00 C ATOM 133 CD2 TYR A 16 3.650 8.093 -3.383 1.00 0.00 C ATOM 134 CE1 TYR A 16 5.041 10.298 -2.480 1.00 0.00 C ATOM 135 CE2 TYR A 16 4.580 7.952 -2.370 1.00 0.00 C ATOM 136 CZ TYR A 16 5.273 9.058 -1.922 1.00 0.00 C ATOM 137 OH TYR A 16 6.199 8.923 -0.914 1.00 0.00 O ATOM 0 H TYR A 16 1.080 9.107 -7.276 1.00 0.00 H new ATOM 0 HA TYR A 16 3.699 10.251 -6.578 1.00 0.00 H new ATOM 0 HB2 TYR A 16 1.854 10.426 -4.941 1.00 0.00 H new ATOM 0 HB3 TYR A 16 1.637 8.688 -4.976 1.00 0.00 H new ATOM 0 HD1 TYR A 16 3.929 11.402 -3.924 1.00 0.00 H new ATOM 0 HD2 TYR A 16 3.109 7.226 -3.732 1.00 0.00 H new ATOM 0 HE1 TYR A 16 5.585 11.162 -2.128 1.00 0.00 H new ATOM 0 HE2 TYR A 16 4.763 6.982 -1.932 1.00 0.00 H new ATOM 0 HH TYR A 16 6.240 7.986 -0.631 1.00 0.00 H new ATOM 147 N SER A 17 5.002 8.211 -7.052 1.00 0.00 N ATOM 148 CA SER A 17 5.824 7.029 -7.280 1.00 0.00 C ATOM 149 C SER A 17 7.182 7.172 -6.600 1.00 0.00 C ATOM 150 O SER A 17 7.972 8.052 -6.944 1.00 0.00 O ATOM 151 CB SER A 17 6.013 6.795 -8.780 1.00 0.00 C ATOM 152 OG SER A 17 6.665 7.896 -9.389 1.00 0.00 O ATOM 0 H SER A 17 5.484 9.096 -7.211 1.00 0.00 H new ATOM 0 HA SER A 17 5.310 6.170 -6.848 1.00 0.00 H new ATOM 0 HB2 SER A 17 6.597 5.889 -8.939 1.00 0.00 H new ATOM 0 HB3 SER A 17 5.043 6.636 -9.252 1.00 0.00 H new ATOM 0 HG SER A 17 7.314 8.279 -8.763 1.00 0.00 H new ATOM 158 N LYS A 18 7.448 6.300 -5.633 1.00 0.00 N ATOM 159 CA LYS A 18 8.710 6.326 -4.904 1.00 0.00 C ATOM 160 C LYS A 18 9.072 4.936 -4.393 1.00 0.00 C ATOM 161 O LYS A 18 8.217 4.204 -3.895 1.00 0.00 O ATOM 162 CB LYS A 18 8.626 7.306 -3.732 1.00 0.00 C ATOM 163 CG LYS A 18 9.913 7.411 -2.932 1.00 0.00 C ATOM 164 CD LYS A 18 10.831 8.484 -3.491 1.00 0.00 C ATOM 165 CE LYS A 18 11.808 7.910 -4.506 1.00 0.00 C ATOM 166 NZ LYS A 18 13.061 7.431 -3.860 1.00 0.00 N ATOM 0 H LYS A 18 6.805 5.566 -5.336 1.00 0.00 H new ATOM 0 HA LYS A 18 9.490 6.656 -5.590 1.00 0.00 H new ATOM 0 HB2 LYS A 18 8.364 8.293 -4.113 1.00 0.00 H new ATOM 0 HB3 LYS A 18 7.819 6.996 -3.067 1.00 0.00 H new ATOM 0 HG2 LYS A 18 9.678 7.637 -1.892 1.00 0.00 H new ATOM 0 HG3 LYS A 18 10.427 6.450 -2.941 1.00 0.00 H new ATOM 0 HD2 LYS A 18 10.234 9.266 -3.961 1.00 0.00 H new ATOM 0 HD3 LYS A 18 11.384 8.951 -2.676 1.00 0.00 H new ATOM 0 HE2 LYS A 18 11.335 7.085 -5.038 1.00 0.00 H new ATOM 0 HE3 LYS A 18 12.050 8.671 -5.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 13.642 6.926 -4.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 13.594 8.244 -3.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 12.824 6.787 -3.078 1.00 0.00 H new ATOM 180 N LYS A 19 10.345 4.577 -4.518 1.00 0.00 N ATOM 181 CA LYS A 19 10.822 3.275 -4.067 1.00 0.00 C ATOM 182 C LYS A 19 10.852 3.205 -2.543 1.00 0.00 C ATOM 183 O LYS A 19 11.134 4.199 -1.872 1.00 0.00 O ATOM 184 CB LYS A 19 12.219 2.998 -4.628 1.00 0.00 C ATOM 185 CG LYS A 19 13.322 3.769 -3.922 1.00 0.00 C ATOM 186 CD LYS A 19 13.887 2.985 -2.750 1.00 0.00 C ATOM 187 CE LYS A 19 14.858 1.910 -3.215 1.00 0.00 C ATOM 188 NZ LYS A 19 15.888 1.609 -2.182 1.00 0.00 N ATOM 0 H LYS A 19 11.066 5.170 -4.929 1.00 0.00 H new ATOM 0 HA LYS A 19 10.132 2.516 -4.435 1.00 0.00 H new ATOM 0 HB2 LYS A 19 12.427 1.931 -4.552 1.00 0.00 H new ATOM 0 HB3 LYS A 19 12.232 3.250 -5.688 1.00 0.00 H new ATOM 0 HG2 LYS A 19 14.120 3.994 -4.629 1.00 0.00 H new ATOM 0 HG3 LYS A 19 12.931 4.723 -3.568 1.00 0.00 H new ATOM 0 HD2 LYS A 19 14.396 3.665 -2.067 1.00 0.00 H new ATOM 0 HD3 LYS A 19 13.072 2.524 -2.192 1.00 0.00 H new ATOM 0 HE2 LYS A 19 14.306 1.001 -3.454 1.00 0.00 H new ATOM 0 HE3 LYS A 19 15.348 2.235 -4.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 16.530 0.872 -2.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 16.432 2.470 -1.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 15.422 1.274 -1.315 1.00 0.00 H new ATOM 202 N CYS A 20 10.560 2.027 -2.004 1.00 0.00 N ATOM 203 CA CYS A 20 10.554 1.827 -0.559 1.00 0.00 C ATOM 204 C CYS A 20 10.494 0.343 -0.216 1.00 0.00 C ATOM 205 O CYS A 20 10.165 -0.489 -1.062 1.00 0.00 O ATOM 206 CB CYS A 20 9.367 2.557 0.072 1.00 0.00 C ATOM 207 SG CYS A 20 7.755 2.001 -0.527 1.00 0.00 S ATOM 0 H CYS A 20 10.324 1.195 -2.546 1.00 0.00 H new ATOM 0 HA CYS A 20 11.480 2.237 -0.156 1.00 0.00 H new ATOM 0 HB2 CYS A 20 9.406 2.425 1.153 1.00 0.00 H new ATOM 0 HB3 CYS A 20 9.466 3.625 -0.122 1.00 0.00 H new ATOM 0 HG CYS A 20 6.815 2.675 0.066 1.00 0.00 H new ATOM 213 N LYS A 21 10.817 0.016 1.031 1.00 0.00 N ATOM 214 CA LYS A 21 10.801 -1.369 1.488 1.00 0.00 C ATOM 215 C LYS A 21 9.474 -1.704 2.161 1.00 0.00 C ATOM 216 O LYS A 21 8.749 -0.813 2.607 1.00 0.00 O ATOM 217 CB LYS A 21 11.956 -1.619 2.461 1.00 0.00 C ATOM 218 CG LYS A 21 12.451 -3.055 2.460 1.00 0.00 C ATOM 219 CD LYS A 21 13.899 -3.146 2.913 1.00 0.00 C ATOM 220 CE LYS A 21 14.852 -2.650 1.837 1.00 0.00 C ATOM 221 NZ LYS A 21 16.205 -2.357 2.386 1.00 0.00 N ATOM 0 H LYS A 21 11.093 0.692 1.744 1.00 0.00 H new ATOM 0 HA LYS A 21 10.920 -2.015 0.618 1.00 0.00 H new ATOM 0 HB2 LYS A 21 12.784 -0.958 2.206 1.00 0.00 H new ATOM 0 HB3 LYS A 21 11.635 -1.355 3.469 1.00 0.00 H new ATOM 0 HG2 LYS A 21 11.824 -3.657 3.118 1.00 0.00 H new ATOM 0 HG3 LYS A 21 12.355 -3.473 1.458 1.00 0.00 H new ATOM 0 HD2 LYS A 21 14.035 -2.558 3.820 1.00 0.00 H new ATOM 0 HD3 LYS A 21 14.138 -4.179 3.164 1.00 0.00 H new ATOM 0 HE2 LYS A 21 14.934 -3.400 1.051 1.00 0.00 H new ATOM 0 HE3 LYS A 21 14.444 -1.750 1.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 16.825 -2.022 1.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 16.131 -1.623 3.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 16.606 -3.222 2.802 1.00 0.00 H new ATOM 235 N LEU A 22 9.162 -2.993 2.233 1.00 0.00 N ATOM 236 CA LEU A 22 7.922 -3.447 2.854 1.00 0.00 C ATOM 237 C LEU A 22 8.203 -4.479 3.941 1.00 0.00 C ATOM 238 O LEU A 22 9.124 -5.288 3.821 1.00 0.00 O ATOM 239 CB LEU A 22 6.989 -4.043 1.798 1.00 0.00 C ATOM 240 CG LEU A 22 6.053 -3.057 1.097 1.00 0.00 C ATOM 241 CD1 LEU A 22 5.279 -3.753 -0.012 1.00 0.00 C ATOM 242 CD2 LEU A 22 5.099 -2.423 2.098 1.00 0.00 C ATOM 0 H LEU A 22 9.750 -3.743 1.869 1.00 0.00 H new ATOM 0 HA LEU A 22 7.438 -2.585 3.314 1.00 0.00 H new ATOM 0 HB2 LEU A 22 7.598 -4.536 1.041 1.00 0.00 H new ATOM 0 HB3 LEU A 22 6.383 -4.815 2.272 1.00 0.00 H new ATOM 0 HG LEU A 22 6.657 -2.267 0.651 1.00 0.00 H new ATOM 0 HD11 LEU A 22 4.618 -3.036 -0.500 1.00 0.00 H new ATOM 0 HD12 LEU A 22 5.977 -4.159 -0.744 1.00 0.00 H new ATOM 0 HD13 LEU A 22 4.686 -4.563 0.412 1.00 0.00 H new ATOM 0 HD21 LEU A 22 4.441 -1.724 1.581 1.00 0.00 H new ATOM 0 HD22 LEU A 22 4.501 -3.201 2.574 1.00 0.00 H new ATOM 0 HD23 LEU A 22 5.670 -1.889 2.857 1.00 0.00 H new ATOM 254 N PHE A 23 7.403 -4.447 5.001 1.00 0.00 N ATOM 255 CA PHE A 23 7.565 -5.380 6.110 1.00 0.00 C ATOM 256 C PHE A 23 6.221 -5.684 6.766 1.00 0.00 C ATOM 257 O PHE A 23 5.288 -4.882 6.696 1.00 0.00 O ATOM 258 CB PHE A 23 8.534 -4.810 7.147 1.00 0.00 C ATOM 259 CG PHE A 23 9.944 -4.686 6.645 1.00 0.00 C ATOM 260 CD1 PHE A 23 10.839 -5.734 6.786 1.00 0.00 C ATOM 261 CD2 PHE A 23 10.375 -3.520 6.032 1.00 0.00 C ATOM 262 CE1 PHE A 23 12.137 -5.623 6.325 1.00 0.00 C ATOM 263 CE2 PHE A 23 11.672 -3.404 5.568 1.00 0.00 C ATOM 264 CZ PHE A 23 12.554 -4.456 5.716 1.00 0.00 C ATOM 0 H PHE A 23 6.636 -3.785 5.116 1.00 0.00 H new ATOM 0 HA PHE A 23 7.974 -6.309 5.713 1.00 0.00 H new ATOM 0 HB2 PHE A 23 8.181 -3.828 7.461 1.00 0.00 H new ATOM 0 HB3 PHE A 23 8.526 -5.449 8.030 1.00 0.00 H new ATOM 0 HD1 PHE A 23 10.518 -6.649 7.262 1.00 0.00 H new ATOM 0 HD2 PHE A 23 9.690 -2.693 5.916 1.00 0.00 H new ATOM 0 HE1 PHE A 23 12.824 -6.448 6.441 1.00 0.00 H new ATOM 0 HE2 PHE A 23 11.995 -2.491 5.090 1.00 0.00 H new ATOM 0 HZ PHE A 23 13.568 -4.366 5.356 1.00 0.00 H new ATOM 274 N TYR A 24 6.129 -6.846 7.403 1.00 0.00 N ATOM 275 CA TYR A 24 4.899 -7.257 8.069 1.00 0.00 C ATOM 276 C TYR A 24 5.198 -7.874 9.432 1.00 0.00 C ATOM 277 O TYR A 24 6.178 -8.601 9.597 1.00 0.00 O ATOM 278 CB TYR A 24 4.134 -8.258 7.201 1.00 0.00 C ATOM 279 CG TYR A 24 4.894 -9.540 6.943 1.00 0.00 C ATOM 280 CD1 TYR A 24 5.006 -10.514 7.927 1.00 0.00 C ATOM 281 CD2 TYR A 24 5.499 -9.776 5.715 1.00 0.00 C ATOM 282 CE1 TYR A 24 5.699 -11.686 7.696 1.00 0.00 C ATOM 283 CE2 TYR A 24 6.193 -10.946 5.474 1.00 0.00 C ATOM 284 CZ TYR A 24 6.290 -11.898 6.468 1.00 0.00 C ATOM 285 OH TYR A 24 6.982 -13.064 6.233 1.00 0.00 O ATOM 0 H TYR A 24 6.892 -7.520 7.472 1.00 0.00 H new ATOM 0 HA TYR A 24 4.283 -6.370 8.218 1.00 0.00 H new ATOM 0 HB2 TYR A 24 3.188 -8.498 7.686 1.00 0.00 H new ATOM 0 HB3 TYR A 24 3.894 -7.789 6.247 1.00 0.00 H new ATOM 0 HD1 TYR A 24 4.543 -10.352 8.889 1.00 0.00 H new ATOM 0 HD2 TYR A 24 5.426 -9.032 4.935 1.00 0.00 H new ATOM 0 HE1 TYR A 24 5.778 -12.432 8.473 1.00 0.00 H new ATOM 0 HE2 TYR A 24 6.657 -11.114 4.513 1.00 0.00 H new ATOM 0 HH TYR A 24 7.335 -13.056 5.319 1.00 0.00 H new ATOM 295 N LYS A 25 4.346 -7.578 10.408 1.00 0.00 N ATOM 296 CA LYS A 25 4.515 -8.103 11.757 1.00 0.00 C ATOM 297 C LYS A 25 3.873 -9.481 11.890 1.00 0.00 C ATOM 298 O LYS A 25 2.652 -9.602 11.988 1.00 0.00 O ATOM 299 CB LYS A 25 3.903 -7.144 12.781 1.00 0.00 C ATOM 300 CG LYS A 25 4.058 -7.608 14.219 1.00 0.00 C ATOM 301 CD LYS A 25 3.985 -6.443 15.191 1.00 0.00 C ATOM 302 CE LYS A 25 4.316 -6.880 16.610 1.00 0.00 C ATOM 303 NZ LYS A 25 3.203 -7.653 17.226 1.00 0.00 N ATOM 0 H LYS A 25 3.531 -6.977 10.289 1.00 0.00 H new ATOM 0 HA LYS A 25 5.583 -8.199 11.950 1.00 0.00 H new ATOM 0 HB2 LYS A 25 4.369 -6.164 12.672 1.00 0.00 H new ATOM 0 HB3 LYS A 25 2.843 -7.019 12.561 1.00 0.00 H new ATOM 0 HG2 LYS A 25 3.277 -8.330 14.456 1.00 0.00 H new ATOM 0 HG3 LYS A 25 5.012 -8.121 14.336 1.00 0.00 H new ATOM 0 HD2 LYS A 25 4.679 -5.663 14.878 1.00 0.00 H new ATOM 0 HD3 LYS A 25 2.985 -6.009 15.166 1.00 0.00 H new ATOM 0 HE2 LYS A 25 5.220 -7.489 16.601 1.00 0.00 H new ATOM 0 HE3 LYS A 25 4.530 -6.002 17.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 3.468 -7.932 18.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 2.347 -7.063 17.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 3.016 -8.504 16.659 1.00 0.00 H new ATOM 317 N LYS A 26 4.704 -10.518 11.892 1.00 0.00 N ATOM 318 CA LYS A 26 4.219 -11.887 12.015 1.00 0.00 C ATOM 319 C LYS A 26 4.974 -12.635 13.110 1.00 0.00 C ATOM 320 O LYS A 26 6.198 -12.756 13.062 1.00 0.00 O ATOM 321 CB LYS A 26 4.369 -12.625 10.683 1.00 0.00 C ATOM 322 CG LYS A 26 3.716 -13.996 10.669 1.00 0.00 C ATOM 323 CD LYS A 26 3.624 -14.556 9.260 1.00 0.00 C ATOM 324 CE LYS A 26 2.544 -15.622 9.153 1.00 0.00 C ATOM 325 NZ LYS A 26 2.413 -16.141 7.764 1.00 0.00 N ATOM 0 H LYS A 26 5.717 -10.436 11.810 1.00 0.00 H new ATOM 0 HA LYS A 26 3.164 -11.849 12.286 1.00 0.00 H new ATOM 0 HB2 LYS A 26 3.934 -12.017 9.890 1.00 0.00 H new ATOM 0 HB3 LYS A 26 5.429 -12.735 10.456 1.00 0.00 H new ATOM 0 HG2 LYS A 26 4.289 -14.679 11.296 1.00 0.00 H new ATOM 0 HG3 LYS A 26 2.717 -13.929 11.101 1.00 0.00 H new ATOM 0 HD2 LYS A 26 3.410 -13.749 8.560 1.00 0.00 H new ATOM 0 HD3 LYS A 26 4.586 -14.981 8.973 1.00 0.00 H new ATOM 0 HE2 LYS A 26 2.778 -16.445 9.828 1.00 0.00 H new ATOM 0 HE3 LYS A 26 1.590 -15.206 9.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 1.667 -16.865 7.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 2.164 -15.360 7.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 3.316 -16.561 7.464 1.00 0.00 H new ATOM 339 N ASP A 27 4.235 -13.137 14.093 1.00 0.00 N ATOM 340 CA ASP A 27 4.835 -13.876 15.199 1.00 0.00 C ATOM 341 C ASP A 27 5.767 -12.981 16.008 1.00 0.00 C ATOM 342 O ASP A 27 6.856 -13.397 16.401 1.00 0.00 O ATOM 343 CB ASP A 27 5.602 -15.090 14.672 1.00 0.00 C ATOM 344 CG ASP A 27 6.169 -15.945 15.788 1.00 0.00 C ATOM 345 OD1 ASP A 27 5.373 -16.581 16.511 1.00 0.00 O ATOM 346 OD2 ASP A 27 7.408 -15.979 15.938 1.00 0.00 O ATOM 0 H ASP A 27 3.220 -13.046 14.147 1.00 0.00 H new ATOM 0 HA ASP A 27 4.033 -14.219 15.853 1.00 0.00 H new ATOM 0 HB2 ASP A 27 4.938 -15.696 14.055 1.00 0.00 H new ATOM 0 HB3 ASP A 27 6.414 -14.752 14.029 1.00 0.00 H new ATOM 351 N ASN A 28 5.333 -11.749 16.253 1.00 0.00 N ATOM 352 CA ASN A 28 6.130 -10.794 17.015 1.00 0.00 C ATOM 353 C ASN A 28 7.485 -10.567 16.353 1.00 0.00 C ATOM 354 O ASN A 28 8.520 -10.573 17.018 1.00 0.00 O ATOM 355 CB ASN A 28 6.327 -11.291 18.448 1.00 0.00 C ATOM 356 CG ASN A 28 6.733 -10.179 19.395 1.00 0.00 C ATOM 357 OD1 ASN A 28 7.825 -10.201 19.965 1.00 0.00 O ATOM 358 ND2 ASN A 28 5.855 -9.198 19.568 1.00 0.00 N ATOM 0 H ASN A 28 4.434 -11.388 15.935 1.00 0.00 H new ATOM 0 HA ASN A 28 5.593 -9.846 17.037 1.00 0.00 H new ATOM 0 HB2 ASN A 28 5.402 -11.746 18.802 1.00 0.00 H new ATOM 0 HB3 ASN A 28 7.090 -12.070 18.458 1.00 0.00 H new ATOM 0 HD21 ASN A 28 6.074 -8.422 20.193 1.00 0.00 H new ATOM 0 HD22 ASN A 28 4.962 -9.220 19.076 1.00 0.00 H new ATOM 365 N GLU A 29 7.470 -10.367 15.038 1.00 0.00 N ATOM 366 CA GLU A 29 8.698 -10.138 14.287 1.00 0.00 C ATOM 367 C GLU A 29 8.410 -9.395 12.986 1.00 0.00 C ATOM 368 O GLU A 29 7.306 -9.473 12.445 1.00 0.00 O ATOM 369 CB GLU A 29 9.393 -11.467 13.985 1.00 0.00 C ATOM 370 CG GLU A 29 10.489 -11.358 12.938 1.00 0.00 C ATOM 371 CD GLU A 29 11.167 -12.685 12.662 1.00 0.00 C ATOM 372 OE1 GLU A 29 10.491 -13.601 12.149 1.00 0.00 O ATOM 373 OE2 GLU A 29 12.374 -12.809 12.959 1.00 0.00 O ATOM 0 H GLU A 29 6.621 -10.359 14.472 1.00 0.00 H new ATOM 0 HA GLU A 29 9.358 -9.522 14.898 1.00 0.00 H new ATOM 0 HB2 GLU A 29 9.821 -11.861 14.907 1.00 0.00 H new ATOM 0 HB3 GLU A 29 8.649 -12.187 13.646 1.00 0.00 H new ATOM 0 HG2 GLU A 29 10.064 -10.972 12.012 1.00 0.00 H new ATOM 0 HG3 GLU A 29 11.234 -10.636 13.272 1.00 0.00 H new ATOM 380 N PHE A 30 9.409 -8.674 12.488 1.00 0.00 N ATOM 381 CA PHE A 30 9.263 -7.916 11.251 1.00 0.00 C ATOM 382 C PHE A 30 9.984 -8.610 10.099 1.00 0.00 C ATOM 383 O PHE A 30 11.214 -8.611 10.031 1.00 0.00 O ATOM 384 CB PHE A 30 9.811 -6.498 11.430 1.00 0.00 C ATOM 385 CG PHE A 30 8.786 -5.518 11.924 1.00 0.00 C ATOM 386 CD1 PHE A 30 8.598 -5.315 13.282 1.00 0.00 C ATOM 387 CD2 PHE A 30 8.009 -4.798 11.030 1.00 0.00 C ATOM 388 CE1 PHE A 30 7.655 -4.414 13.738 1.00 0.00 C ATOM 389 CE2 PHE A 30 7.065 -3.895 11.480 1.00 0.00 C ATOM 390 CZ PHE A 30 6.888 -3.702 12.836 1.00 0.00 C ATOM 0 H PHE A 30 10.329 -8.599 12.922 1.00 0.00 H new ATOM 0 HA PHE A 30 8.201 -7.861 11.011 1.00 0.00 H new ATOM 0 HB2 PHE A 30 10.644 -6.525 12.132 1.00 0.00 H new ATOM 0 HB3 PHE A 30 10.208 -6.147 10.477 1.00 0.00 H new ATOM 0 HD1 PHE A 30 9.196 -5.867 13.992 1.00 0.00 H new ATOM 0 HD2 PHE A 30 8.143 -4.945 9.968 1.00 0.00 H new ATOM 0 HE1 PHE A 30 7.518 -4.266 14.799 1.00 0.00 H new ATOM 0 HE2 PHE A 30 6.466 -3.341 10.772 1.00 0.00 H new ATOM 0 HZ PHE A 30 6.152 -2.996 13.191 1.00 0.00 H new ATOM 400 N LYS A 31 9.210 -9.201 9.195 1.00 0.00 N ATOM 401 CA LYS A 31 9.772 -9.898 8.045 1.00 0.00 C ATOM 402 C LYS A 31 9.390 -9.199 6.744 1.00 0.00 C ATOM 403 O LYS A 31 8.209 -9.018 6.451 1.00 0.00 O ATOM 404 CB LYS A 31 9.288 -11.350 8.017 1.00 0.00 C ATOM 405 CG LYS A 31 10.023 -12.255 8.991 1.00 0.00 C ATOM 406 CD LYS A 31 11.362 -12.705 8.432 1.00 0.00 C ATOM 407 CE LYS A 31 12.263 -13.261 9.524 1.00 0.00 C ATOM 408 NZ LYS A 31 13.090 -12.197 10.156 1.00 0.00 N ATOM 0 H LYS A 31 8.191 -9.211 9.237 1.00 0.00 H new ATOM 0 HA LYS A 31 10.858 -9.884 8.139 1.00 0.00 H new ATOM 0 HB2 LYS A 31 8.222 -11.373 8.246 1.00 0.00 H new ATOM 0 HB3 LYS A 31 9.406 -11.744 7.008 1.00 0.00 H new ATOM 0 HG2 LYS A 31 10.179 -11.728 9.932 1.00 0.00 H new ATOM 0 HG3 LYS A 31 9.409 -13.128 9.213 1.00 0.00 H new ATOM 0 HD2 LYS A 31 11.202 -13.466 7.669 1.00 0.00 H new ATOM 0 HD3 LYS A 31 11.855 -11.864 7.945 1.00 0.00 H new ATOM 0 HE2 LYS A 31 11.653 -13.747 10.285 1.00 0.00 H new ATOM 0 HE3 LYS A 31 12.915 -14.026 9.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 13.211 -12.406 11.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 14.022 -12.162 9.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 12.615 -11.278 10.047 1.00 0.00 H new ATOM 422 N GLU A 32 10.397 -8.809 5.969 1.00 0.00 N ATOM 423 CA GLU A 32 10.165 -8.130 4.700 1.00 0.00 C ATOM 424 C GLU A 32 9.353 -9.009 3.753 1.00 0.00 C ATOM 425 O GLU A 32 9.510 -10.230 3.732 1.00 0.00 O ATOM 426 CB GLU A 32 11.496 -7.753 4.047 1.00 0.00 C ATOM 427 CG GLU A 32 12.033 -8.814 3.101 1.00 0.00 C ATOM 428 CD GLU A 32 12.559 -10.035 3.831 1.00 0.00 C ATOM 429 OE1 GLU A 32 11.746 -10.751 4.453 1.00 0.00 O ATOM 430 OE2 GLU A 32 13.784 -10.273 3.780 1.00 0.00 O ATOM 0 H GLU A 32 11.381 -8.952 6.198 1.00 0.00 H new ATOM 0 HA GLU A 32 9.597 -7.222 4.902 1.00 0.00 H new ATOM 0 HB2 GLU A 32 11.370 -6.820 3.498 1.00 0.00 H new ATOM 0 HB3 GLU A 32 12.234 -7.567 4.827 1.00 0.00 H new ATOM 0 HG2 GLU A 32 11.242 -9.118 2.416 1.00 0.00 H new ATOM 0 HG3 GLU A 32 12.832 -8.385 2.496 1.00 0.00 H new ATOM 437 N LYS A 33 8.483 -8.380 2.971 1.00 0.00 N ATOM 438 CA LYS A 33 7.645 -9.102 2.021 1.00 0.00 C ATOM 439 C LYS A 33 8.269 -9.093 0.629 1.00 0.00 C ATOM 440 O LYS A 33 8.089 -10.029 -0.149 1.00 0.00 O ATOM 441 CB LYS A 33 6.247 -8.482 1.968 1.00 0.00 C ATOM 442 CG LYS A 33 5.347 -9.100 0.912 1.00 0.00 C ATOM 443 CD LYS A 33 4.962 -10.526 1.273 1.00 0.00 C ATOM 444 CE LYS A 33 4.301 -11.237 0.102 1.00 0.00 C ATOM 445 NZ LYS A 33 5.300 -11.700 -0.901 1.00 0.00 N ATOM 0 H LYS A 33 8.340 -7.370 2.976 1.00 0.00 H new ATOM 0 HA LYS A 33 7.565 -10.135 2.358 1.00 0.00 H new ATOM 0 HB2 LYS A 33 5.774 -8.589 2.944 1.00 0.00 H new ATOM 0 HB3 LYS A 33 6.340 -7.413 1.774 1.00 0.00 H new ATOM 0 HG2 LYS A 33 4.447 -8.496 0.801 1.00 0.00 H new ATOM 0 HG3 LYS A 33 5.857 -9.092 -0.052 1.00 0.00 H new ATOM 0 HD2 LYS A 33 5.851 -11.077 1.580 1.00 0.00 H new ATOM 0 HD3 LYS A 33 4.282 -10.516 2.125 1.00 0.00 H new ATOM 0 HE2 LYS A 33 3.733 -12.091 0.470 1.00 0.00 H new ATOM 0 HE3 LYS A 33 3.590 -10.564 -0.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 4.965 -11.466 -1.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 6.210 -11.228 -0.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 5.423 -12.729 -0.819 1.00 0.00 H new ATOM 459 N GLY A 34 9.006 -8.030 0.322 1.00 0.00 N ATOM 460 CA GLY A 34 9.646 -7.921 -0.976 1.00 0.00 C ATOM 461 C GLY A 34 9.922 -6.482 -1.367 1.00 0.00 C ATOM 462 O GLY A 34 9.086 -5.603 -1.154 1.00 0.00 O ATOM 0 H GLY A 34 9.171 -7.242 0.949 1.00 0.00 H new ATOM 0 HA2 GLY A 34 10.583 -8.477 -0.963 1.00 0.00 H new ATOM 0 HA3 GLY A 34 9.011 -8.384 -1.731 1.00 0.00 H new ATOM 466 N ILE A 35 11.097 -6.241 -1.938 1.00 0.00 N ATOM 467 CA ILE A 35 11.480 -4.900 -2.359 1.00 0.00 C ATOM 468 C ILE A 35 10.791 -4.515 -3.664 1.00 0.00 C ATOM 469 O ILE A 35 10.805 -5.273 -4.633 1.00 0.00 O ATOM 470 CB ILE A 35 13.005 -4.781 -2.543 1.00 0.00 C ATOM 471 CG1 ILE A 35 13.726 -5.125 -1.238 1.00 0.00 C ATOM 472 CG2 ILE A 35 13.376 -3.380 -3.005 1.00 0.00 C ATOM 473 CD1 ILE A 35 15.193 -5.445 -1.424 1.00 0.00 C ATOM 0 H ILE A 35 11.800 -6.957 -2.120 1.00 0.00 H new ATOM 0 HA ILE A 35 11.163 -4.219 -1.569 1.00 0.00 H new ATOM 0 HB ILE A 35 13.320 -5.490 -3.309 1.00 0.00 H new ATOM 0 HG12 ILE A 35 13.630 -4.287 -0.548 1.00 0.00 H new ATOM 0 HG13 ILE A 35 13.232 -5.979 -0.774 1.00 0.00 H new ATOM 0 HG21 ILE A 35 14.457 -3.312 -3.130 1.00 0.00 H new ATOM 0 HG22 ILE A 35 12.887 -3.169 -3.956 1.00 0.00 H new ATOM 0 HG23 ILE A 35 13.051 -2.653 -2.260 1.00 0.00 H new ATOM 0 HD11 ILE A 35 15.640 -5.679 -0.458 1.00 0.00 H new ATOM 0 HD12 ILE A 35 15.297 -6.302 -2.089 1.00 0.00 H new ATOM 0 HD13 ILE A 35 15.701 -4.584 -1.859 1.00 0.00 H new ATOM 485 N GLY A 36 10.190 -3.329 -3.682 1.00 0.00 N ATOM 486 CA GLY A 36 9.505 -2.862 -4.873 1.00 0.00 C ATOM 487 C GLY A 36 9.242 -1.370 -4.844 1.00 0.00 C ATOM 488 O GLY A 36 9.971 -0.615 -4.199 1.00 0.00 O ATOM 0 H GLY A 36 10.165 -2.683 -2.893 1.00 0.00 H new ATOM 0 HA2 GLY A 36 10.103 -3.105 -5.751 1.00 0.00 H new ATOM 0 HA3 GLY A 36 8.558 -3.393 -4.975 1.00 0.00 H new ATOM 492 N THR A 37 8.199 -0.940 -5.547 1.00 0.00 N ATOM 493 CA THR A 37 7.844 0.472 -5.602 1.00 0.00 C ATOM 494 C THR A 37 6.352 0.674 -5.360 1.00 0.00 C ATOM 495 O THR A 37 5.527 -0.121 -5.811 1.00 0.00 O ATOM 496 CB THR A 37 8.221 1.094 -6.959 1.00 0.00 C ATOM 497 OG1 THR A 37 9.605 0.857 -7.239 1.00 0.00 O ATOM 498 CG2 THR A 37 7.947 2.591 -6.964 1.00 0.00 C ATOM 0 H THR A 37 7.585 -1.550 -6.086 1.00 0.00 H new ATOM 0 HA THR A 37 8.408 0.970 -4.813 1.00 0.00 H new ATOM 0 HB THR A 37 7.609 0.626 -7.730 1.00 0.00 H new ATOM 0 HG1 THR A 37 9.836 1.254 -8.104 1.00 0.00 H new ATOM 0 HG21 THR A 37 8.221 3.008 -7.933 1.00 0.00 H new ATOM 0 HG22 THR A 37 6.887 2.768 -6.780 1.00 0.00 H new ATOM 0 HG23 THR A 37 8.536 3.071 -6.183 1.00 0.00 H new ATOM 506 N LEU A 38 6.012 1.743 -4.648 1.00 0.00 N ATOM 507 CA LEU A 38 4.618 2.050 -4.347 1.00 0.00 C ATOM 508 C LEU A 38 4.018 2.957 -5.416 1.00 0.00 C ATOM 509 O LEU A 38 4.691 3.844 -5.942 1.00 0.00 O ATOM 510 CB LEU A 38 4.507 2.716 -2.975 1.00 0.00 C ATOM 511 CG LEU A 38 3.136 3.291 -2.617 1.00 0.00 C ATOM 512 CD1 LEU A 38 2.911 3.239 -1.114 1.00 0.00 C ATOM 513 CD2 LEU A 38 3.006 4.719 -3.129 1.00 0.00 C ATOM 0 H LEU A 38 6.682 2.412 -4.268 1.00 0.00 H new ATOM 0 HA LEU A 38 4.059 1.114 -4.335 1.00 0.00 H new ATOM 0 HB2 LEU A 38 4.782 1.985 -2.215 1.00 0.00 H new ATOM 0 HB3 LEU A 38 5.241 3.520 -2.923 1.00 0.00 H new ATOM 0 HG LEU A 38 2.371 2.682 -3.099 1.00 0.00 H new ATOM 0 HD11 LEU A 38 1.930 3.652 -0.878 1.00 0.00 H new ATOM 0 HD12 LEU A 38 2.960 2.204 -0.774 1.00 0.00 H new ATOM 0 HD13 LEU A 38 3.681 3.823 -0.610 1.00 0.00 H new ATOM 0 HD21 LEU A 38 2.024 5.112 -2.865 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.779 5.340 -2.676 1.00 0.00 H new ATOM 0 HD23 LEU A 38 3.122 4.729 -4.213 1.00 0.00 H new ATOM 525 N HIS A 39 2.746 2.730 -5.732 1.00 0.00 N ATOM 526 CA HIS A 39 2.054 3.529 -6.736 1.00 0.00 C ATOM 527 C HIS A 39 0.634 3.858 -6.285 1.00 0.00 C ATOM 528 O HIS A 39 -0.212 2.970 -6.166 1.00 0.00 O ATOM 529 CB HIS A 39 2.018 2.787 -8.073 1.00 0.00 C ATOM 530 CG HIS A 39 3.376 2.502 -8.636 1.00 0.00 C ATOM 531 ND1 HIS A 39 4.374 1.709 -8.182 1.00 0.00 N flip ATOM 532 CD2 HIS A 39 3.838 3.065 -9.807 1.00 0.00 C flip ATOM 533 CE1 HIS A 39 5.410 1.805 -9.078 1.00 0.00 C flip ATOM 534 NE2 HIS A 39 5.061 2.629 -10.049 1.00 0.00 N flip ATOM 0 H HIS A 39 2.175 2.000 -5.307 1.00 0.00 H new ATOM 0 HA HIS A 39 2.602 4.463 -6.862 1.00 0.00 H new ATOM 0 HB2 HIS A 39 1.483 1.846 -7.943 1.00 0.00 H new ATOM 0 HB3 HIS A 39 1.452 3.379 -8.793 1.00 0.00 H new ATOM 0 HD1 HIS A 39 4.359 1.145 -7.332 1.00 0.00 H new ATOM 0 HD2 HIS A 39 3.286 3.754 -10.429 1.00 0.00 H new ATOM 0 HE1 HIS A 39 6.356 1.290 -9.001 1.00 0.00 H new ATOM 542 N LEU A 40 0.379 5.137 -6.034 1.00 0.00 N ATOM 543 CA LEU A 40 -0.939 5.583 -5.595 1.00 0.00 C ATOM 544 C LEU A 40 -1.781 6.045 -6.780 1.00 0.00 C ATOM 545 O LEU A 40 -1.469 7.046 -7.425 1.00 0.00 O ATOM 546 CB LEU A 40 -0.802 6.718 -4.579 1.00 0.00 C ATOM 547 CG LEU A 40 -0.459 6.301 -3.148 1.00 0.00 C ATOM 548 CD1 LEU A 40 0.008 7.502 -2.340 1.00 0.00 C ATOM 549 CD2 LEU A 40 -1.658 5.642 -2.483 1.00 0.00 C ATOM 0 H LEU A 40 1.067 5.884 -6.127 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.442 4.739 -5.123 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.031 7.403 -4.931 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.738 7.276 -4.559 1.00 0.00 H new ATOM 0 HG LEU A 40 0.354 5.576 -3.186 1.00 0.00 H new ATOM 0 HD11 LEU A 40 0.248 7.186 -1.325 1.00 0.00 H new ATOM 0 HD12 LEU A 40 0.895 7.931 -2.806 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.784 8.250 -2.310 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.396 5.352 -1.466 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -2.491 6.344 -2.457 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.947 4.757 -3.050 1.00 0.00 H new ATOM 561 N LYS A 41 -2.850 5.309 -7.061 1.00 0.00 N ATOM 562 CA LYS A 41 -3.741 5.643 -8.167 1.00 0.00 C ATOM 563 C LYS A 41 -5.189 5.724 -7.694 1.00 0.00 C ATOM 564 O LYS A 41 -5.645 4.925 -6.875 1.00 0.00 O ATOM 565 CB LYS A 41 -3.615 4.603 -9.283 1.00 0.00 C ATOM 566 CG LYS A 41 -2.193 4.419 -9.785 1.00 0.00 C ATOM 567 CD LYS A 41 -2.102 3.292 -10.800 1.00 0.00 C ATOM 568 CE LYS A 41 -2.166 1.930 -10.128 1.00 0.00 C ATOM 569 NZ LYS A 41 -2.011 0.820 -11.108 1.00 0.00 N ATOM 0 H LYS A 41 -3.121 4.476 -6.538 1.00 0.00 H new ATOM 0 HA LYS A 41 -3.449 6.619 -8.554 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -3.990 3.646 -8.920 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -4.251 4.899 -10.118 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -1.843 5.347 -10.238 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -1.534 4.206 -8.944 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -2.916 3.382 -11.519 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -1.171 3.379 -11.360 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -1.382 1.860 -9.373 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -3.119 1.826 -9.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -2.700 0.070 -10.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -2.177 1.180 -12.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -1.048 0.433 -11.045 1.00 0.00 H new ATOM 583 N PRO A 42 -5.930 6.709 -8.221 1.00 0.00 N ATOM 584 CA PRO A 42 -7.338 6.916 -7.868 1.00 0.00 C ATOM 585 C PRO A 42 -8.240 5.813 -8.413 1.00 0.00 C ATOM 586 O PRO A 42 -7.944 5.206 -9.442 1.00 0.00 O ATOM 587 CB PRO A 42 -7.675 8.256 -8.526 1.00 0.00 C ATOM 588 CG PRO A 42 -6.714 8.375 -9.658 1.00 0.00 C ATOM 589 CD PRO A 42 -5.452 7.698 -9.202 1.00 0.00 C ATOM 0 HA PRO A 42 -7.494 6.904 -6.789 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -8.706 8.276 -8.879 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -7.563 9.081 -7.823 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -7.109 7.901 -10.557 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -6.529 9.420 -9.905 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -4.930 7.221 -10.031 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -4.756 8.406 -8.752 1.00 0.00 H new ATOM 597 N THR A 43 -9.343 5.559 -7.716 1.00 0.00 N ATOM 598 CA THR A 43 -10.288 4.529 -8.129 1.00 0.00 C ATOM 599 C THR A 43 -11.659 5.127 -8.423 1.00 0.00 C ATOM 600 O THR A 43 -11.909 6.299 -8.142 1.00 0.00 O ATOM 601 CB THR A 43 -10.436 3.438 -7.052 1.00 0.00 C ATOM 602 OG1 THR A 43 -11.293 2.394 -7.527 1.00 0.00 O ATOM 603 CG2 THR A 43 -11.002 4.020 -5.766 1.00 0.00 C ATOM 0 H THR A 43 -9.604 6.053 -6.862 1.00 0.00 H new ATOM 0 HA THR A 43 -9.888 4.079 -9.038 1.00 0.00 H new ATOM 0 HB THR A 43 -9.448 3.029 -6.842 1.00 0.00 H new ATOM 0 HG1 THR A 43 -11.381 1.703 -6.837 1.00 0.00 H new ATOM 0 HG21 THR A 43 -11.097 3.231 -5.020 1.00 0.00 H new ATOM 0 HG22 THR A 43 -10.332 4.794 -5.391 1.00 0.00 H new ATOM 0 HG23 THR A 43 -11.983 4.453 -5.963 1.00 0.00 H new ATOM 611 N ALA A 44 -12.545 4.314 -8.989 1.00 0.00 N ATOM 612 CA ALA A 44 -13.892 4.762 -9.318 1.00 0.00 C ATOM 613 C ALA A 44 -14.444 5.682 -8.235 1.00 0.00 C ATOM 614 O ALA A 44 -15.205 6.606 -8.520 1.00 0.00 O ATOM 615 CB ALA A 44 -14.812 3.567 -9.518 1.00 0.00 C ATOM 0 H ALA A 44 -12.354 3.341 -9.229 1.00 0.00 H new ATOM 0 HA ALA A 44 -13.843 5.328 -10.248 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -15.815 3.917 -9.763 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -14.434 2.949 -10.333 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -14.847 2.978 -8.602 1.00 0.00 H new ATOM 621 N ASN A 45 -14.057 5.422 -6.990 1.00 0.00 N ATOM 622 CA ASN A 45 -14.516 6.226 -5.863 1.00 0.00 C ATOM 623 C ASN A 45 -13.524 7.344 -5.554 1.00 0.00 C ATOM 624 O ASN A 45 -12.375 7.306 -5.994 1.00 0.00 O ATOM 625 CB ASN A 45 -14.711 5.346 -4.627 1.00 0.00 C ATOM 626 CG ASN A 45 -15.568 6.016 -3.570 1.00 0.00 C ATOM 627 OD1 ASN A 45 -16.206 7.036 -3.828 1.00 0.00 O ATOM 628 ND2 ASN A 45 -15.586 5.442 -2.373 1.00 0.00 N ATOM 0 H ASN A 45 -13.427 4.661 -6.736 1.00 0.00 H new ATOM 0 HA ASN A 45 -15.471 6.676 -6.134 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -15.174 4.405 -4.924 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -13.738 5.102 -4.201 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -16.145 5.846 -1.622 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -15.041 4.596 -2.205 1.00 0.00 H new ATOM 635 N GLN A 46 -13.977 8.336 -4.794 1.00 0.00 N ATOM 636 CA GLN A 46 -13.129 9.464 -4.426 1.00 0.00 C ATOM 637 C GLN A 46 -11.942 9.001 -3.587 1.00 0.00 C ATOM 638 O GLN A 46 -11.033 9.779 -3.296 1.00 0.00 O ATOM 639 CB GLN A 46 -13.939 10.507 -3.653 1.00 0.00 C ATOM 640 CG GLN A 46 -15.140 11.034 -4.421 1.00 0.00 C ATOM 641 CD GLN A 46 -15.904 12.095 -3.652 1.00 0.00 C ATOM 642 OE1 GLN A 46 -15.472 13.245 -3.564 1.00 0.00 O ATOM 643 NE2 GLN A 46 -17.045 11.714 -3.092 1.00 0.00 N ATOM 0 H GLN A 46 -14.925 8.382 -4.421 1.00 0.00 H new ATOM 0 HA GLN A 46 -12.749 9.915 -5.343 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -14.281 10.068 -2.716 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -13.288 11.342 -3.395 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -14.805 11.450 -5.371 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -15.810 10.206 -4.654 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -17.365 10.750 -3.191 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -17.602 12.385 -2.563 1.00 0.00 H new ATOM 652 N LYS A 47 -11.956 7.730 -3.201 1.00 0.00 N ATOM 653 CA LYS A 47 -10.881 7.162 -2.396 1.00 0.00 C ATOM 654 C LYS A 47 -9.697 6.766 -3.272 1.00 0.00 C ATOM 655 O LYS A 47 -9.801 6.733 -4.499 1.00 0.00 O ATOM 656 CB LYS A 47 -11.385 5.944 -1.621 1.00 0.00 C ATOM 657 CG LYS A 47 -12.571 6.244 -0.720 1.00 0.00 C ATOM 658 CD LYS A 47 -12.135 6.918 0.570 1.00 0.00 C ATOM 659 CE LYS A 47 -13.243 7.784 1.149 1.00 0.00 C ATOM 660 NZ LYS A 47 -12.718 8.774 2.129 1.00 0.00 N ATOM 0 H LYS A 47 -12.701 7.073 -3.433 1.00 0.00 H new ATOM 0 HA LYS A 47 -10.550 7.923 -1.689 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -11.665 5.164 -2.329 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -10.571 5.547 -1.015 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -13.276 6.887 -1.247 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -13.096 5.318 -0.488 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -11.846 6.160 1.298 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -11.254 7.531 0.382 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -13.754 8.308 0.341 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -13.984 7.149 1.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -13.255 9.661 2.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -12.818 8.395 3.092 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -11.714 8.958 1.932 1.00 0.00 H new ATOM 674 N THR A 48 -8.569 6.465 -2.635 1.00 0.00 N ATOM 675 CA THR A 48 -7.366 6.070 -3.356 1.00 0.00 C ATOM 676 C THR A 48 -7.097 4.578 -3.202 1.00 0.00 C ATOM 677 O THR A 48 -7.484 3.968 -2.206 1.00 0.00 O ATOM 678 CB THR A 48 -6.134 6.856 -2.866 1.00 0.00 C ATOM 679 OG1 THR A 48 -6.353 8.261 -3.027 1.00 0.00 O ATOM 680 CG2 THR A 48 -4.887 6.440 -3.631 1.00 0.00 C ATOM 0 H THR A 48 -8.464 6.488 -1.621 1.00 0.00 H new ATOM 0 HA THR A 48 -7.539 6.298 -4.408 1.00 0.00 H new ATOM 0 HB THR A 48 -5.984 6.632 -1.810 1.00 0.00 H new ATOM 0 HG1 THR A 48 -6.346 8.486 -3.981 1.00 0.00 H new ATOM 0 HG21 THR A 48 -4.031 7.008 -3.268 1.00 0.00 H new ATOM 0 HG22 THR A 48 -4.706 5.376 -3.481 1.00 0.00 H new ATOM 0 HG23 THR A 48 -5.029 6.638 -4.693 1.00 0.00 H new ATOM 688 N GLN A 49 -6.431 3.996 -4.195 1.00 0.00 N ATOM 689 CA GLN A 49 -6.111 2.574 -4.168 1.00 0.00 C ATOM 690 C GLN A 49 -4.610 2.357 -4.012 1.00 0.00 C ATOM 691 O GLN A 49 -3.816 2.820 -4.832 1.00 0.00 O ATOM 692 CB GLN A 49 -6.606 1.894 -5.446 1.00 0.00 C ATOM 693 CG GLN A 49 -6.106 0.468 -5.610 1.00 0.00 C ATOM 694 CD GLN A 49 -6.442 -0.116 -6.968 1.00 0.00 C ATOM 695 OE1 GLN A 49 -7.106 0.524 -7.785 1.00 0.00 O ATOM 696 NE2 GLN A 49 -5.985 -1.338 -7.217 1.00 0.00 N ATOM 0 H GLN A 49 -6.103 4.487 -5.027 1.00 0.00 H new ATOM 0 HA GLN A 49 -6.615 2.130 -3.310 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -7.696 1.890 -5.447 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -6.289 2.483 -6.307 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -5.026 0.447 -5.467 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -6.543 -0.158 -4.832 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -5.439 -1.832 -6.511 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -6.180 -1.783 -8.114 1.00 0.00 H new ATOM 705 N LEU A 50 -4.226 1.650 -2.955 1.00 0.00 N ATOM 706 CA LEU A 50 -2.819 1.371 -2.690 1.00 0.00 C ATOM 707 C LEU A 50 -2.349 0.149 -3.473 1.00 0.00 C ATOM 708 O LEU A 50 -2.842 -0.961 -3.267 1.00 0.00 O ATOM 709 CB LEU A 50 -2.595 1.149 -1.193 1.00 0.00 C ATOM 710 CG LEU A 50 -1.141 0.999 -0.747 1.00 0.00 C ATOM 711 CD1 LEU A 50 -0.472 -0.153 -1.481 1.00 0.00 C ATOM 712 CD2 LEU A 50 -0.377 2.295 -0.977 1.00 0.00 C ATOM 0 H LEU A 50 -4.870 1.259 -2.267 1.00 0.00 H new ATOM 0 HA LEU A 50 -2.236 2.233 -3.014 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.035 1.987 -0.652 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -3.140 0.254 -0.893 1.00 0.00 H new ATOM 0 HG LEU A 50 -1.130 0.777 0.320 1.00 0.00 H new ATOM 0 HD11 LEU A 50 0.562 -0.244 -1.150 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -1.004 -1.080 -1.266 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -0.494 0.037 -2.554 1.00 0.00 H new ATOM 0 HD21 LEU A 50 0.657 2.170 -0.654 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -0.398 2.546 -2.037 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -0.842 3.098 -0.405 1.00 0.00 H new ATOM 724 N LEU A 51 -1.393 0.360 -4.371 1.00 0.00 N ATOM 725 CA LEU A 51 -0.854 -0.725 -5.184 1.00 0.00 C ATOM 726 C LEU A 51 0.671 -0.721 -5.155 1.00 0.00 C ATOM 727 O LEU A 51 1.306 0.288 -5.461 1.00 0.00 O ATOM 728 CB LEU A 51 -1.349 -0.602 -6.626 1.00 0.00 C ATOM 729 CG LEU A 51 -0.816 -1.644 -7.610 1.00 0.00 C ATOM 730 CD1 LEU A 51 -1.499 -2.985 -7.389 1.00 0.00 C ATOM 731 CD2 LEU A 51 -1.011 -1.173 -9.043 1.00 0.00 C ATOM 0 H LEU A 51 -0.975 1.272 -4.555 1.00 0.00 H new ATOM 0 HA LEU A 51 -1.204 -1.669 -4.766 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -2.437 -0.659 -6.621 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -1.083 0.388 -6.997 1.00 0.00 H new ATOM 0 HG LEU A 51 0.252 -1.770 -7.433 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -1.107 -3.714 -8.098 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -1.307 -3.328 -6.372 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -2.573 -2.875 -7.538 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -0.626 -1.927 -9.729 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -2.073 -1.017 -9.234 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -0.474 -0.237 -9.194 1.00 0.00 H new ATOM 743 N VAL A 52 1.253 -1.858 -4.787 1.00 0.00 N ATOM 744 CA VAL A 52 2.704 -1.987 -4.721 1.00 0.00 C ATOM 745 C VAL A 52 3.213 -2.997 -5.744 1.00 0.00 C ATOM 746 O VAL A 52 2.933 -4.192 -5.643 1.00 0.00 O ATOM 747 CB VAL A 52 3.166 -2.418 -3.317 1.00 0.00 C ATOM 748 CG1 VAL A 52 4.676 -2.602 -3.284 1.00 0.00 C ATOM 749 CG2 VAL A 52 2.722 -1.403 -2.275 1.00 0.00 C ATOM 0 H VAL A 52 0.742 -2.703 -4.530 1.00 0.00 H new ATOM 0 HA VAL A 52 3.120 -1.005 -4.946 1.00 0.00 H new ATOM 0 HB VAL A 52 2.702 -3.375 -3.079 1.00 0.00 H new ATOM 0 HG11 VAL A 52 4.984 -2.907 -2.284 1.00 0.00 H new ATOM 0 HG12 VAL A 52 4.965 -3.370 -4.002 1.00 0.00 H new ATOM 0 HG13 VAL A 52 5.163 -1.662 -3.543 1.00 0.00 H new ATOM 0 HG21 VAL A 52 3.057 -1.724 -1.289 1.00 0.00 H new ATOM 0 HG22 VAL A 52 3.155 -0.430 -2.507 1.00 0.00 H new ATOM 0 HG23 VAL A 52 1.635 -1.327 -2.282 1.00 0.00 H new ATOM 759 N ARG A 53 3.961 -2.509 -6.728 1.00 0.00 N ATOM 760 CA ARG A 53 4.508 -3.370 -7.770 1.00 0.00 C ATOM 761 C ARG A 53 5.909 -3.847 -7.400 1.00 0.00 C ATOM 762 O ARG A 53 6.833 -3.046 -7.260 1.00 0.00 O ATOM 763 CB ARG A 53 4.548 -2.626 -9.106 1.00 0.00 C ATOM 764 CG ARG A 53 3.203 -2.057 -9.526 1.00 0.00 C ATOM 765 CD ARG A 53 3.360 -0.985 -10.593 1.00 0.00 C ATOM 766 NE ARG A 53 2.133 -0.792 -11.361 1.00 0.00 N ATOM 767 CZ ARG A 53 1.886 0.287 -12.095 1.00 0.00 C ATOM 768 NH1 ARG A 53 2.778 1.266 -12.160 1.00 0.00 N ATOM 769 NH2 ARG A 53 0.746 0.389 -12.765 1.00 0.00 N ATOM 0 H ARG A 53 4.202 -1.523 -6.826 1.00 0.00 H new ATOM 0 HA ARG A 53 3.859 -4.241 -7.865 1.00 0.00 H new ATOM 0 HB2 ARG A 53 5.272 -1.814 -9.038 1.00 0.00 H new ATOM 0 HB3 ARG A 53 4.903 -3.306 -9.880 1.00 0.00 H new ATOM 0 HG2 ARG A 53 2.570 -2.859 -9.905 1.00 0.00 H new ATOM 0 HG3 ARG A 53 2.698 -1.636 -8.657 1.00 0.00 H new ATOM 0 HD2 ARG A 53 3.644 -0.044 -10.122 1.00 0.00 H new ATOM 0 HD3 ARG A 53 4.170 -1.261 -11.268 1.00 0.00 H new ATOM 0 HE ARG A 53 1.426 -1.527 -11.332 1.00 0.00 H new ATOM 0 HH11 ARG A 53 3.656 1.191 -11.646 1.00 0.00 H new ATOM 0 HH12 ARG A 53 2.586 2.094 -12.724 1.00 0.00 H new ATOM 0 HH21 ARG A 53 0.057 -0.362 -12.717 1.00 0.00 H new ATOM 0 HH22 ARG A 53 0.558 1.218 -13.328 1.00 0.00 H new ATOM 783 N ALA A 54 6.060 -5.159 -7.243 1.00 0.00 N ATOM 784 CA ALA A 54 7.347 -5.743 -6.891 1.00 0.00 C ATOM 785 C ALA A 54 8.381 -5.493 -7.984 1.00 0.00 C ATOM 786 O ALA A 54 8.032 -5.174 -9.120 1.00 0.00 O ATOM 787 CB ALA A 54 7.197 -7.236 -6.635 1.00 0.00 C ATOM 0 H ALA A 54 5.306 -5.837 -7.354 1.00 0.00 H new ATOM 0 HA ALA A 54 7.699 -5.262 -5.978 1.00 0.00 H new ATOM 0 HB1 ALA A 54 8.167 -7.659 -6.373 1.00 0.00 H new ATOM 0 HB2 ALA A 54 6.497 -7.396 -5.815 1.00 0.00 H new ATOM 0 HB3 ALA A 54 6.819 -7.723 -7.534 1.00 0.00 H new ATOM 793 N ASP A 55 9.654 -5.639 -7.632 1.00 0.00 N ATOM 794 CA ASP A 55 10.739 -5.429 -8.584 1.00 0.00 C ATOM 795 C ASP A 55 11.433 -6.746 -8.916 1.00 0.00 C ATOM 796 O ASP A 55 12.213 -7.268 -8.118 1.00 0.00 O ATOM 797 CB ASP A 55 11.752 -4.431 -8.022 1.00 0.00 C ATOM 798 CG ASP A 55 12.907 -4.181 -8.973 1.00 0.00 C ATOM 799 OD1 ASP A 55 13.201 -5.073 -9.796 1.00 0.00 O ATOM 800 OD2 ASP A 55 13.516 -3.094 -8.893 1.00 0.00 O ATOM 0 H ASP A 55 9.960 -5.902 -6.695 1.00 0.00 H new ATOM 0 HA ASP A 55 10.312 -5.024 -9.501 1.00 0.00 H new ATOM 0 HB2 ASP A 55 11.249 -3.488 -7.810 1.00 0.00 H new ATOM 0 HB3 ASP A 55 12.140 -4.806 -7.075 1.00 0.00 H new ATOM 805 N THR A 56 11.143 -7.281 -10.098 1.00 0.00 N ATOM 806 CA THR A 56 11.738 -8.538 -10.534 1.00 0.00 C ATOM 807 C THR A 56 11.724 -8.654 -12.054 1.00 0.00 C ATOM 808 O THR A 56 11.063 -7.875 -12.740 1.00 0.00 O ATOM 809 CB THR A 56 10.998 -9.748 -9.932 1.00 0.00 C ATOM 810 OG1 THR A 56 11.709 -10.954 -10.231 1.00 0.00 O ATOM 811 CG2 THR A 56 9.580 -9.841 -10.475 1.00 0.00 C ATOM 0 H THR A 56 10.500 -6.863 -10.770 1.00 0.00 H new ATOM 0 HA THR A 56 12.769 -8.539 -10.181 1.00 0.00 H new ATOM 0 HB THR A 56 10.947 -9.614 -8.851 1.00 0.00 H new ATOM 0 HG1 THR A 56 11.234 -11.719 -9.844 1.00 0.00 H new ATOM 0 HG21 THR A 56 9.078 -10.703 -10.035 1.00 0.00 H new ATOM 0 HG22 THR A 56 9.033 -8.933 -10.221 1.00 0.00 H new ATOM 0 HG23 THR A 56 9.612 -9.954 -11.559 1.00 0.00 H new ATOM 819 N ASN A 57 12.459 -9.632 -12.575 1.00 0.00 N ATOM 820 CA ASN A 57 12.531 -9.849 -14.015 1.00 0.00 C ATOM 821 C ASN A 57 11.195 -9.531 -14.681 1.00 0.00 C ATOM 822 O ASN A 57 11.104 -8.631 -15.516 1.00 0.00 O ATOM 823 CB ASN A 57 12.931 -11.295 -14.314 1.00 0.00 C ATOM 824 CG ASN A 57 14.368 -11.589 -13.928 1.00 0.00 C ATOM 825 OD1 ASN A 57 15.268 -10.791 -14.189 1.00 0.00 O ATOM 826 ND2 ASN A 57 14.589 -12.740 -13.303 1.00 0.00 N ATOM 0 H ASN A 57 13.013 -10.286 -12.021 1.00 0.00 H new ATOM 0 HA ASN A 57 13.288 -9.178 -14.421 1.00 0.00 H new ATOM 0 HB2 ASN A 57 12.267 -11.971 -13.775 1.00 0.00 H new ATOM 0 HB3 ASN A 57 12.795 -11.494 -15.377 1.00 0.00 H new ATOM 0 HD21 ASN A 57 15.536 -12.993 -13.019 1.00 0.00 H new ATOM 0 HD22 ASN A 57 13.812 -13.371 -13.107 1.00 0.00 H new ATOM 833 N LEU A 58 10.161 -10.276 -14.305 1.00 0.00 N ATOM 834 CA LEU A 58 8.830 -10.074 -14.865 1.00 0.00 C ATOM 835 C LEU A 58 8.032 -9.079 -14.027 1.00 0.00 C ATOM 836 O LEU A 58 7.681 -7.997 -14.497 1.00 0.00 O ATOM 837 CB LEU A 58 8.081 -11.405 -14.946 1.00 0.00 C ATOM 838 CG LEU A 58 8.464 -12.321 -16.110 1.00 0.00 C ATOM 839 CD1 LEU A 58 8.126 -11.664 -17.439 1.00 0.00 C ATOM 840 CD2 LEU A 58 9.943 -12.673 -16.047 1.00 0.00 C ATOM 0 H LEU A 58 10.219 -11.025 -13.615 1.00 0.00 H new ATOM 0 HA LEU A 58 8.944 -9.667 -15.870 1.00 0.00 H new ATOM 0 HB2 LEU A 58 8.243 -11.947 -14.015 1.00 0.00 H new ATOM 0 HB3 LEU A 58 7.013 -11.195 -15.011 1.00 0.00 H new ATOM 0 HG LEU A 58 7.888 -13.243 -16.027 1.00 0.00 H new ATOM 0 HD11 LEU A 58 8.405 -12.330 -18.256 1.00 0.00 H new ATOM 0 HD12 LEU A 58 7.055 -11.464 -17.484 1.00 0.00 H new ATOM 0 HD13 LEU A 58 8.675 -10.727 -17.531 1.00 0.00 H new ATOM 0 HD21 LEU A 58 10.198 -13.325 -16.882 1.00 0.00 H new ATOM 0 HD22 LEU A 58 10.537 -11.761 -16.104 1.00 0.00 H new ATOM 0 HD23 LEU A 58 10.155 -13.186 -15.109 1.00 0.00 H new ATOM 852 N GLY A 59 7.751 -9.453 -12.783 1.00 0.00 N ATOM 853 CA GLY A 59 6.999 -8.582 -11.899 1.00 0.00 C ATOM 854 C GLY A 59 5.810 -9.281 -11.269 1.00 0.00 C ATOM 855 O GLY A 59 5.245 -10.205 -11.852 1.00 0.00 O ATOM 0 H GLY A 59 8.031 -10.343 -12.371 1.00 0.00 H new ATOM 0 HA2 GLY A 59 7.657 -8.212 -11.113 1.00 0.00 H new ATOM 0 HA3 GLY A 59 6.651 -7.714 -12.459 1.00 0.00 H new ATOM 859 N ASN A 60 5.432 -8.841 -10.073 1.00 0.00 N ATOM 860 CA ASN A 60 4.304 -9.433 -9.362 1.00 0.00 C ATOM 861 C ASN A 60 3.670 -8.423 -8.412 1.00 0.00 C ATOM 862 O ASN A 60 4.185 -7.319 -8.228 1.00 0.00 O ATOM 863 CB ASN A 60 4.758 -10.669 -8.583 1.00 0.00 C ATOM 864 CG ASN A 60 5.985 -10.398 -7.733 1.00 0.00 C ATOM 865 OD1 ASN A 60 7.056 -10.084 -8.252 1.00 0.00 O ATOM 866 ND2 ASN A 60 5.832 -10.519 -6.419 1.00 0.00 N ATOM 0 H ASN A 60 5.890 -8.077 -9.576 1.00 0.00 H new ATOM 0 HA ASN A 60 3.557 -9.730 -10.098 1.00 0.00 H new ATOM 0 HB2 ASN A 60 3.944 -11.011 -7.943 1.00 0.00 H new ATOM 0 HB3 ASN A 60 4.975 -11.477 -9.282 1.00 0.00 H new ATOM 0 HD21 ASN A 60 6.621 -10.349 -5.796 1.00 0.00 H new ATOM 0 HD22 ASN A 60 4.925 -10.782 -6.033 1.00 0.00 H new ATOM 873 N ILE A 61 2.549 -8.807 -7.810 1.00 0.00 N ATOM 874 CA ILE A 61 1.846 -7.936 -6.877 1.00 0.00 C ATOM 875 C ILE A 61 2.261 -8.222 -5.438 1.00 0.00 C ATOM 876 O ILE A 61 2.208 -9.364 -4.981 1.00 0.00 O ATOM 877 CB ILE A 61 0.319 -8.095 -7.001 1.00 0.00 C ATOM 878 CG1 ILE A 61 -0.149 -7.675 -8.396 1.00 0.00 C ATOM 879 CG2 ILE A 61 -0.387 -7.276 -5.930 1.00 0.00 C ATOM 880 CD1 ILE A 61 -1.588 -8.040 -8.686 1.00 0.00 C ATOM 0 H ILE A 61 2.108 -9.716 -7.952 1.00 0.00 H new ATOM 0 HA ILE A 61 2.119 -6.912 -7.134 1.00 0.00 H new ATOM 0 HB ILE A 61 0.065 -9.145 -6.855 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -0.028 -6.597 -8.502 1.00 0.00 H new ATOM 0 HG13 ILE A 61 0.493 -8.143 -9.142 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -1.465 -7.398 -6.030 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -0.073 -7.619 -4.944 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.129 -6.224 -6.048 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -1.851 -7.712 -9.692 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -1.711 -9.121 -8.613 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -2.240 -7.551 -7.963 1.00 0.00 H new ATOM 892 N LEU A 62 2.672 -7.177 -4.728 1.00 0.00 N ATOM 893 CA LEU A 62 3.094 -7.315 -3.339 1.00 0.00 C ATOM 894 C LEU A 62 1.959 -6.955 -2.386 1.00 0.00 C ATOM 895 O LEU A 62 1.711 -7.658 -1.405 1.00 0.00 O ATOM 896 CB LEU A 62 4.307 -6.424 -3.063 1.00 0.00 C ATOM 897 CG LEU A 62 5.665 -6.995 -3.473 1.00 0.00 C ATOM 898 CD1 LEU A 62 6.772 -5.987 -3.203 1.00 0.00 C ATOM 899 CD2 LEU A 62 5.939 -8.300 -2.740 1.00 0.00 C ATOM 0 H LEU A 62 2.722 -6.225 -5.091 1.00 0.00 H new ATOM 0 HA LEU A 62 3.369 -8.356 -3.171 1.00 0.00 H new ATOM 0 HB2 LEU A 62 4.162 -5.476 -3.581 1.00 0.00 H new ATOM 0 HB3 LEU A 62 4.335 -6.203 -1.996 1.00 0.00 H new ATOM 0 HG LEU A 62 5.642 -7.201 -4.543 1.00 0.00 H new ATOM 0 HD11 LEU A 62 7.731 -6.411 -3.501 1.00 0.00 H new ATOM 0 HD12 LEU A 62 6.584 -5.078 -3.775 1.00 0.00 H new ATOM 0 HD13 LEU A 62 6.796 -5.749 -2.140 1.00 0.00 H new ATOM 0 HD21 LEU A 62 6.910 -8.691 -3.044 1.00 0.00 H new ATOM 0 HD22 LEU A 62 5.941 -8.120 -1.665 1.00 0.00 H new ATOM 0 HD23 LEU A 62 5.163 -9.025 -2.985 1.00 0.00 H new ATOM 911 N LEU A 63 1.270 -5.858 -2.682 1.00 0.00 N ATOM 912 CA LEU A 63 0.158 -5.406 -1.853 1.00 0.00 C ATOM 913 C LEU A 63 -0.814 -4.554 -2.663 1.00 0.00 C ATOM 914 O LEU A 63 -0.452 -3.490 -3.165 1.00 0.00 O ATOM 915 CB LEU A 63 0.680 -4.608 -0.657 1.00 0.00 C ATOM 916 CG LEU A 63 -0.375 -3.875 0.172 1.00 0.00 C ATOM 917 CD1 LEU A 63 -1.172 -4.859 1.014 1.00 0.00 C ATOM 918 CD2 LEU A 63 0.278 -2.821 1.055 1.00 0.00 C ATOM 0 H LEU A 63 1.462 -5.265 -3.490 1.00 0.00 H new ATOM 0 HA LEU A 63 -0.374 -6.285 -1.491 1.00 0.00 H new ATOM 0 HB2 LEU A 63 1.221 -5.289 0.000 1.00 0.00 H new ATOM 0 HB3 LEU A 63 1.401 -3.876 -1.021 1.00 0.00 H new ATOM 0 HG LEU A 63 -1.061 -3.374 -0.511 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -1.918 -4.318 1.597 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -1.671 -5.575 0.361 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.499 -5.389 1.688 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -0.488 -2.309 1.638 1.00 0.00 H new ATOM 0 HD22 LEU A 63 0.988 -3.300 1.729 1.00 0.00 H new ATOM 0 HD23 LEU A 63 0.803 -2.098 0.431 1.00 0.00 H new ATOM 930 N ASN A 64 -2.049 -5.028 -2.784 1.00 0.00 N ATOM 931 CA ASN A 64 -3.074 -4.308 -3.532 1.00 0.00 C ATOM 932 C ASN A 64 -4.349 -4.163 -2.706 1.00 0.00 C ATOM 933 O ASN A 64 -5.080 -5.131 -2.498 1.00 0.00 O ATOM 934 CB ASN A 64 -3.382 -5.034 -4.843 1.00 0.00 C ATOM 935 CG ASN A 64 -4.264 -4.213 -5.764 1.00 0.00 C ATOM 936 OD1 ASN A 64 -4.698 -3.116 -5.412 1.00 0.00 O ATOM 937 ND2 ASN A 64 -4.535 -4.744 -6.951 1.00 0.00 N ATOM 0 H ASN A 64 -2.365 -5.907 -2.374 1.00 0.00 H new ATOM 0 HA ASN A 64 -2.693 -3.312 -3.757 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -2.448 -5.269 -5.353 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -3.873 -5.982 -4.624 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -5.125 -4.239 -7.613 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -4.154 -5.656 -7.201 1.00 0.00 H new ATOM 944 N VAL A 65 -4.609 -2.946 -2.239 1.00 0.00 N ATOM 945 CA VAL A 65 -5.796 -2.673 -1.437 1.00 0.00 C ATOM 946 C VAL A 65 -6.312 -1.260 -1.683 1.00 0.00 C ATOM 947 O VAL A 65 -5.657 -0.455 -2.346 1.00 0.00 O ATOM 948 CB VAL A 65 -5.511 -2.849 0.066 1.00 0.00 C ATOM 949 CG1 VAL A 65 -5.023 -4.261 0.355 1.00 0.00 C ATOM 950 CG2 VAL A 65 -4.499 -1.818 0.541 1.00 0.00 C ATOM 0 H VAL A 65 -4.014 -2.134 -2.402 1.00 0.00 H new ATOM 0 HA VAL A 65 -6.556 -3.393 -1.742 1.00 0.00 H new ATOM 0 HB VAL A 65 -6.439 -2.692 0.615 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -4.827 -4.367 1.422 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -5.786 -4.979 0.054 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -4.106 -4.450 -0.203 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -4.310 -1.957 1.605 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -3.568 -1.940 -0.012 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -4.893 -0.816 0.371 1.00 0.00 H new ATOM 960 N LEU A 66 -7.490 -0.964 -1.145 1.00 0.00 N ATOM 961 CA LEU A 66 -8.095 0.354 -1.305 1.00 0.00 C ATOM 962 C LEU A 66 -8.157 1.090 0.030 1.00 0.00 C ATOM 963 O LEU A 66 -8.827 0.647 0.963 1.00 0.00 O ATOM 964 CB LEU A 66 -9.501 0.223 -1.894 1.00 0.00 C ATOM 965 CG LEU A 66 -10.400 1.453 -1.764 1.00 0.00 C ATOM 966 CD1 LEU A 66 -9.816 2.625 -2.538 1.00 0.00 C ATOM 967 CD2 LEU A 66 -11.807 1.138 -2.251 1.00 0.00 C ATOM 0 H LEU A 66 -8.045 -1.619 -0.594 1.00 0.00 H new ATOM 0 HA LEU A 66 -7.473 0.932 -1.989 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -9.409 -0.025 -2.951 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -9.998 -0.618 -1.412 1.00 0.00 H new ATOM 0 HG LEU A 66 -10.455 1.730 -0.711 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -10.469 3.491 -2.434 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -8.829 2.866 -2.144 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -9.731 2.359 -3.592 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -12.433 2.024 -2.151 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -11.771 0.835 -3.297 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -12.226 0.328 -1.653 1.00 0.00 H new ATOM 979 N ILE A 67 -7.458 2.216 0.111 1.00 0.00 N ATOM 980 CA ILE A 67 -7.436 3.016 1.330 1.00 0.00 C ATOM 981 C ILE A 67 -8.851 3.334 1.803 1.00 0.00 C ATOM 982 O ILE A 67 -9.578 4.113 1.186 1.00 0.00 O ATOM 983 CB ILE A 67 -6.667 4.334 1.126 1.00 0.00 C ATOM 984 CG1 ILE A 67 -5.202 4.047 0.789 1.00 0.00 C ATOM 985 CG2 ILE A 67 -6.769 5.205 2.369 1.00 0.00 C ATOM 986 CD1 ILE A 67 -4.448 5.260 0.289 1.00 0.00 C ATOM 0 H ILE A 67 -6.899 2.596 -0.653 1.00 0.00 H new ATOM 0 HA ILE A 67 -6.926 2.422 2.088 1.00 0.00 H new ATOM 0 HB ILE A 67 -7.114 4.873 0.291 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -4.703 3.659 1.677 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -5.158 3.264 0.032 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -6.220 6.133 2.209 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -7.816 5.432 2.569 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -6.344 4.674 3.221 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -3.417 4.983 0.070 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -4.923 5.636 -0.617 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -4.460 6.037 1.054 1.00 0.00 H new ATOM 998 N PRO A 68 -9.251 2.720 2.926 1.00 0.00 N ATOM 999 CA PRO A 68 -10.580 2.924 3.509 1.00 0.00 C ATOM 1000 C PRO A 68 -10.747 4.321 4.097 1.00 0.00 C ATOM 1001 O PRO A 68 -9.790 5.084 4.228 1.00 0.00 O ATOM 1002 CB PRO A 68 -10.649 1.867 4.614 1.00 0.00 C ATOM 1003 CG PRO A 68 -9.229 1.609 4.981 1.00 0.00 C ATOM 1004 CD PRO A 68 -8.437 1.779 3.714 1.00 0.00 C ATOM 0 HA PRO A 68 -11.370 2.833 2.764 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -11.220 2.226 5.470 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -11.138 0.959 4.263 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -8.892 2.305 5.749 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -9.107 0.604 5.386 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -7.442 2.177 3.913 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -8.303 0.831 3.194 1.00 0.00 H new ATOM 1012 N PRO A 69 -11.991 4.666 4.461 1.00 0.00 N ATOM 1013 CA PRO A 69 -12.312 5.973 5.042 1.00 0.00 C ATOM 1014 C PRO A 69 -11.750 6.135 6.451 1.00 0.00 C ATOM 1015 O PRO A 69 -11.800 7.220 7.028 1.00 0.00 O ATOM 1016 CB PRO A 69 -13.843 5.981 5.073 1.00 0.00 C ATOM 1017 CG PRO A 69 -14.228 4.543 5.121 1.00 0.00 C ATOM 1018 CD PRO A 69 -13.180 3.807 4.334 1.00 0.00 C ATOM 0 HA PRO A 69 -11.879 6.792 4.467 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -14.219 6.521 5.942 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -14.254 6.472 4.191 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -14.268 4.184 6.149 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -15.218 4.390 4.691 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -13.001 2.811 4.738 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -13.475 3.681 3.292 1.00 0.00 H new ATOM 1026 N ASN A 70 -11.215 5.049 6.998 1.00 0.00 N ATOM 1027 CA ASN A 70 -10.643 5.071 8.339 1.00 0.00 C ATOM 1028 C ASN A 70 -9.358 4.251 8.396 1.00 0.00 C ATOM 1029 O ASN A 70 -9.393 3.021 8.379 1.00 0.00 O ATOM 1030 CB ASN A 70 -11.652 4.530 9.355 1.00 0.00 C ATOM 1031 CG ASN A 70 -12.283 3.227 8.906 1.00 0.00 C ATOM 1032 OD1 ASN A 70 -11.790 2.569 7.989 1.00 0.00 O ATOM 1033 ND2 ASN A 70 -13.379 2.847 9.551 1.00 0.00 N ATOM 0 H ASN A 70 -11.166 4.142 6.533 1.00 0.00 H new ATOM 0 HA ASN A 70 -10.404 6.105 8.588 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -11.153 4.378 10.312 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -12.434 5.272 9.517 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -13.847 1.979 9.293 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -13.753 3.423 10.305 1.00 0.00 H new ATOM 1040 N MET A 71 -8.225 4.942 8.466 1.00 0.00 N ATOM 1041 CA MET A 71 -6.928 4.277 8.528 1.00 0.00 C ATOM 1042 C MET A 71 -5.967 5.043 9.432 1.00 0.00 C ATOM 1043 O MET A 71 -5.562 6.167 9.137 1.00 0.00 O ATOM 1044 CB MET A 71 -6.331 4.145 7.125 1.00 0.00 C ATOM 1045 CG MET A 71 -4.900 3.634 7.120 1.00 0.00 C ATOM 1046 SD MET A 71 -3.954 4.233 5.706 1.00 0.00 S ATOM 1047 CE MET A 71 -3.122 5.645 6.430 1.00 0.00 C ATOM 0 H MET A 71 -8.178 5.961 8.481 1.00 0.00 H new ATOM 0 HA MET A 71 -7.078 3.282 8.947 1.00 0.00 H new ATOM 0 HB2 MET A 71 -6.952 3.469 6.537 1.00 0.00 H new ATOM 0 HB3 MET A 71 -6.363 5.117 6.632 1.00 0.00 H new ATOM 0 HG2 MET A 71 -4.405 3.943 8.041 1.00 0.00 H new ATOM 0 HG3 MET A 71 -4.907 2.544 7.112 1.00 0.00 H new ATOM 0 HE1 MET A 71 -2.496 6.124 5.677 1.00 0.00 H new ATOM 0 HE2 MET A 71 -3.863 6.358 6.792 1.00 0.00 H new ATOM 0 HE3 MET A 71 -2.500 5.314 7.262 1.00 0.00 H new ATOM 1057 N PRO A 72 -5.593 4.422 10.561 1.00 0.00 N ATOM 1058 CA PRO A 72 -4.676 5.027 11.530 1.00 0.00 C ATOM 1059 C PRO A 72 -3.251 5.126 10.997 1.00 0.00 C ATOM 1060 O PRO A 72 -2.763 4.213 10.330 1.00 0.00 O ATOM 1061 CB PRO A 72 -4.735 4.068 12.722 1.00 0.00 C ATOM 1062 CG PRO A 72 -5.133 2.758 12.134 1.00 0.00 C ATOM 1063 CD PRO A 72 -6.037 3.081 10.977 1.00 0.00 C ATOM 0 HA PRO A 72 -4.960 6.051 11.774 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -3.770 4.000 13.224 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -5.458 4.404 13.465 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -4.259 2.198 11.802 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -5.647 2.140 12.870 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -5.933 2.355 10.171 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -7.086 3.079 11.274 1.00 0.00 H new ATOM 1071 N CYS A 73 -2.589 6.239 11.294 1.00 0.00 N ATOM 1072 CA CYS A 73 -1.219 6.457 10.843 1.00 0.00 C ATOM 1073 C CYS A 73 -0.299 6.754 12.023 1.00 0.00 C ATOM 1074 O CYS A 73 -0.691 7.427 12.977 1.00 0.00 O ATOM 1075 CB CYS A 73 -1.167 7.609 9.839 1.00 0.00 C ATOM 1076 SG CYS A 73 0.260 7.559 8.731 1.00 0.00 S ATOM 0 H CYS A 73 -2.979 7.004 11.845 1.00 0.00 H new ATOM 0 HA CYS A 73 -0.874 5.545 10.356 1.00 0.00 H new ATOM 0 HB2 CYS A 73 -2.078 7.597 9.241 1.00 0.00 H new ATOM 0 HB3 CYS A 73 -1.157 8.552 10.385 1.00 0.00 H new ATOM 0 HG CYS A 73 0.214 8.573 7.918 1.00 0.00 H new ATOM 1082 N THR A 74 0.927 6.245 11.954 1.00 0.00 N ATOM 1083 CA THR A 74 1.902 6.453 13.017 1.00 0.00 C ATOM 1084 C THR A 74 3.310 6.602 12.450 1.00 0.00 C ATOM 1085 O THR A 74 3.861 5.662 11.877 1.00 0.00 O ATOM 1086 CB THR A 74 1.888 5.290 14.027 1.00 0.00 C ATOM 1087 OG1 THR A 74 1.571 4.064 13.359 1.00 0.00 O ATOM 1088 CG2 THR A 74 0.876 5.547 15.133 1.00 0.00 C ATOM 0 H THR A 74 1.268 5.685 11.172 1.00 0.00 H new ATOM 0 HA THR A 74 1.620 7.373 13.529 1.00 0.00 H new ATOM 0 HB THR A 74 2.879 5.214 14.473 1.00 0.00 H new ATOM 0 HG1 THR A 74 1.566 3.330 14.008 1.00 0.00 H new ATOM 0 HG21 THR A 74 0.884 4.713 15.834 1.00 0.00 H new ATOM 0 HG22 THR A 74 1.137 6.465 15.659 1.00 0.00 H new ATOM 0 HG23 THR A 74 -0.119 5.647 14.700 1.00 0.00 H new ATOM 1096 N ARG A 75 3.887 7.787 12.616 1.00 0.00 N ATOM 1097 CA ARG A 75 5.231 8.059 12.120 1.00 0.00 C ATOM 1098 C ARG A 75 6.285 7.537 13.093 1.00 0.00 C ATOM 1099 O ARG A 75 6.276 7.876 14.276 1.00 0.00 O ATOM 1100 CB ARG A 75 5.423 9.561 11.901 1.00 0.00 C ATOM 1101 CG ARG A 75 6.729 9.913 11.208 1.00 0.00 C ATOM 1102 CD ARG A 75 6.718 9.487 9.749 1.00 0.00 C ATOM 1103 NE ARG A 75 7.612 10.306 8.933 1.00 0.00 N ATOM 1104 CZ ARG A 75 8.936 10.229 8.991 1.00 0.00 C ATOM 1105 NH1 ARG A 75 9.519 9.375 9.822 1.00 0.00 N ATOM 1106 NH2 ARG A 75 9.682 11.007 8.217 1.00 0.00 N ATOM 0 H ARG A 75 3.445 8.575 13.090 1.00 0.00 H new ATOM 0 HA ARG A 75 5.352 7.542 11.168 1.00 0.00 H new ATOM 0 HB2 ARG A 75 4.592 9.942 11.307 1.00 0.00 H new ATOM 0 HB3 ARG A 75 5.385 10.068 12.865 1.00 0.00 H new ATOM 0 HG2 ARG A 75 6.898 10.988 11.273 1.00 0.00 H new ATOM 0 HG3 ARG A 75 7.558 9.428 11.724 1.00 0.00 H new ATOM 0 HD2 ARG A 75 7.015 8.441 9.674 1.00 0.00 H new ATOM 0 HD3 ARG A 75 5.703 9.558 9.358 1.00 0.00 H new ATOM 0 HE ARG A 75 7.196 10.973 8.283 1.00 0.00 H new ATOM 0 HH11 ARG A 75 8.950 8.775 10.419 1.00 0.00 H new ATOM 0 HH12 ARG A 75 10.537 9.318 9.864 1.00 0.00 H new ATOM 0 HH21 ARG A 75 9.238 11.665 7.577 1.00 0.00 H new ATOM 0 HH22 ARG A 75 10.699 10.947 8.263 1.00 0.00 H new ATOM 1120 N THR A 76 7.192 6.708 12.585 1.00 0.00 N ATOM 1121 CA THR A 76 8.251 6.138 13.408 1.00 0.00 C ATOM 1122 C THR A 76 9.611 6.285 12.734 1.00 0.00 C ATOM 1123 O THR A 76 9.700 6.390 11.512 1.00 0.00 O ATOM 1124 CB THR A 76 7.995 4.648 13.700 1.00 0.00 C ATOM 1125 OG1 THR A 76 9.053 4.117 14.505 1.00 0.00 O ATOM 1126 CG2 THR A 76 7.886 3.853 12.407 1.00 0.00 C ATOM 0 H THR A 76 7.214 6.417 11.608 1.00 0.00 H new ATOM 0 HA THR A 76 8.252 6.690 14.348 1.00 0.00 H new ATOM 0 HB THR A 76 7.052 4.564 14.240 1.00 0.00 H new ATOM 0 HG1 THR A 76 8.881 3.170 14.687 1.00 0.00 H new ATOM 0 HG21 THR A 76 7.705 2.804 12.639 1.00 0.00 H new ATOM 0 HG22 THR A 76 7.060 4.240 11.810 1.00 0.00 H new ATOM 0 HG23 THR A 76 8.815 3.945 11.844 1.00 0.00 H new ATOM 1134 N GLY A 77 10.668 6.292 13.540 1.00 0.00 N ATOM 1135 CA GLY A 77 12.010 6.426 13.003 1.00 0.00 C ATOM 1136 C GLY A 77 12.196 7.713 12.225 1.00 0.00 C ATOM 1137 O GLY A 77 11.456 8.678 12.419 1.00 0.00 O ATOM 0 H GLY A 77 10.619 6.207 14.555 1.00 0.00 H new ATOM 0 HA2 GLY A 77 12.730 6.392 13.820 1.00 0.00 H new ATOM 0 HA3 GLY A 77 12.225 5.578 12.353 1.00 0.00 H new ATOM 1141 N LYS A 78 13.189 7.730 11.342 1.00 0.00 N ATOM 1142 CA LYS A 78 13.472 8.908 10.531 1.00 0.00 C ATOM 1143 C LYS A 78 12.842 8.781 9.147 1.00 0.00 C ATOM 1144 O LYS A 78 12.140 9.681 8.690 1.00 0.00 O ATOM 1145 CB LYS A 78 14.983 9.110 10.398 1.00 0.00 C ATOM 1146 CG LYS A 78 15.364 10.339 9.590 1.00 0.00 C ATOM 1147 CD LYS A 78 16.857 10.379 9.307 1.00 0.00 C ATOM 1148 CE LYS A 78 17.249 9.372 8.237 1.00 0.00 C ATOM 1149 NZ LYS A 78 18.676 8.965 8.355 1.00 0.00 N ATOM 0 H LYS A 78 13.812 6.941 11.170 1.00 0.00 H new ATOM 0 HA LYS A 78 13.038 9.774 11.030 1.00 0.00 H new ATOM 0 HB2 LYS A 78 15.419 9.191 11.394 1.00 0.00 H new ATOM 0 HB3 LYS A 78 15.419 8.228 9.929 1.00 0.00 H new ATOM 0 HG2 LYS A 78 14.814 10.342 8.649 1.00 0.00 H new ATOM 0 HG3 LYS A 78 15.071 11.238 10.133 1.00 0.00 H new ATOM 0 HD2 LYS A 78 17.141 11.381 8.986 1.00 0.00 H new ATOM 0 HD3 LYS A 78 17.408 10.170 10.224 1.00 0.00 H new ATOM 0 HE2 LYS A 78 16.612 8.491 8.317 1.00 0.00 H new ATOM 0 HE3 LYS A 78 17.075 9.803 7.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 18.904 8.278 7.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 19.285 9.802 8.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 18.837 8.530 9.286 1.00 0.00 H new ATOM 1163 N ASN A 79 13.098 7.656 8.487 1.00 0.00 N ATOM 1164 CA ASN A 79 12.555 7.411 7.156 1.00 0.00 C ATOM 1165 C ASN A 79 11.568 6.248 7.177 1.00 0.00 C ATOM 1166 O ASN A 79 11.218 5.699 6.133 1.00 0.00 O ATOM 1167 CB ASN A 79 13.685 7.117 6.167 1.00 0.00 C ATOM 1168 CG ASN A 79 14.454 5.860 6.525 1.00 0.00 C ATOM 1169 OD1 ASN A 79 15.166 5.818 7.529 1.00 0.00 O ATOM 1170 ND2 ASN A 79 14.313 4.826 5.703 1.00 0.00 N ATOM 0 H ASN A 79 13.678 6.900 8.852 1.00 0.00 H new ATOM 0 HA ASN A 79 12.026 8.309 6.836 1.00 0.00 H new ATOM 0 HB2 ASN A 79 13.269 7.012 5.165 1.00 0.00 H new ATOM 0 HB3 ASN A 79 14.371 7.964 6.141 1.00 0.00 H new ATOM 0 HD21 ASN A 79 14.805 3.953 5.893 1.00 0.00 H new ATOM 0 HD22 ASN A 79 13.712 4.905 4.882 1.00 0.00 H new ATOM 1177 N ASN A 80 11.122 5.879 8.373 1.00 0.00 N ATOM 1178 CA ASN A 80 10.175 4.781 8.531 1.00 0.00 C ATOM 1179 C ASN A 80 8.761 5.310 8.750 1.00 0.00 C ATOM 1180 O ASN A 80 8.571 6.405 9.280 1.00 0.00 O ATOM 1181 CB ASN A 80 10.586 3.890 9.705 1.00 0.00 C ATOM 1182 CG ASN A 80 12.072 3.588 9.709 1.00 0.00 C ATOM 1183 OD1 ASN A 80 12.768 3.827 8.722 1.00 0.00 O ATOM 1184 ND2 ASN A 80 12.565 3.060 10.824 1.00 0.00 N ATOM 0 H ASN A 80 11.401 6.324 9.247 1.00 0.00 H new ATOM 0 HA ASN A 80 10.185 4.191 7.615 1.00 0.00 H new ATOM 0 HB2 ASN A 80 10.315 4.379 10.641 1.00 0.00 H new ATOM 0 HB3 ASN A 80 10.028 2.955 9.660 1.00 0.00 H new ATOM 0 HD21 ASN A 80 13.558 2.836 10.886 1.00 0.00 H new ATOM 0 HD22 ASN A 80 11.950 2.879 11.618 1.00 0.00 H new ATOM 1191 N VAL A 81 7.770 4.525 8.339 1.00 0.00 N ATOM 1192 CA VAL A 81 6.373 4.912 8.491 1.00 0.00 C ATOM 1193 C VAL A 81 5.504 3.709 8.838 1.00 0.00 C ATOM 1194 O VAL A 81 5.430 2.743 8.077 1.00 0.00 O ATOM 1195 CB VAL A 81 5.831 5.572 7.210 1.00 0.00 C ATOM 1196 CG1 VAL A 81 4.406 6.060 7.422 1.00 0.00 C ATOM 1197 CG2 VAL A 81 6.735 6.715 6.775 1.00 0.00 C ATOM 0 H VAL A 81 7.910 3.616 7.898 1.00 0.00 H new ATOM 0 HA VAL A 81 6.331 5.633 9.307 1.00 0.00 H new ATOM 0 HB VAL A 81 5.820 4.826 6.416 1.00 0.00 H new ATOM 0 HG11 VAL A 81 4.040 6.524 6.506 1.00 0.00 H new ATOM 0 HG12 VAL A 81 3.767 5.216 7.682 1.00 0.00 H new ATOM 0 HG13 VAL A 81 4.388 6.791 8.230 1.00 0.00 H new ATOM 0 HG21 VAL A 81 6.336 7.169 5.868 1.00 0.00 H new ATOM 0 HG22 VAL A 81 6.781 7.464 7.566 1.00 0.00 H new ATOM 0 HG23 VAL A 81 7.737 6.332 6.579 1.00 0.00 H new ATOM 1207 N LEU A 82 4.846 3.774 9.990 1.00 0.00 N ATOM 1208 CA LEU A 82 3.979 2.689 10.438 1.00 0.00 C ATOM 1209 C LEU A 82 2.521 2.983 10.103 1.00 0.00 C ATOM 1210 O LEU A 82 2.066 4.122 10.214 1.00 0.00 O ATOM 1211 CB LEU A 82 4.135 2.475 11.945 1.00 0.00 C ATOM 1212 CG LEU A 82 5.210 1.474 12.373 1.00 0.00 C ATOM 1213 CD1 LEU A 82 5.423 1.531 13.878 1.00 0.00 C ATOM 1214 CD2 LEU A 82 4.830 0.066 11.939 1.00 0.00 C ATOM 0 H LEU A 82 4.896 4.566 10.631 1.00 0.00 H new ATOM 0 HA LEU A 82 4.276 1.780 9.915 1.00 0.00 H new ATOM 0 HB2 LEU A 82 4.358 3.437 12.407 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.177 2.143 12.346 1.00 0.00 H new ATOM 0 HG LEU A 82 6.146 1.743 11.884 1.00 0.00 H new ATOM 0 HD11 LEU A 82 6.191 0.812 14.164 1.00 0.00 H new ATOM 0 HD12 LEU A 82 5.740 2.534 14.163 1.00 0.00 H new ATOM 0 HD13 LEU A 82 4.490 1.287 14.387 1.00 0.00 H new ATOM 0 HD21 LEU A 82 5.606 -0.633 12.252 1.00 0.00 H new ATOM 0 HD22 LEU A 82 3.883 -0.214 12.400 1.00 0.00 H new ATOM 0 HD23 LEU A 82 4.729 0.034 10.854 1.00 0.00 H new ATOM 1226 N ILE A 83 1.792 1.949 9.696 1.00 0.00 N ATOM 1227 CA ILE A 83 0.384 2.097 9.349 1.00 0.00 C ATOM 1228 C ILE A 83 -0.350 0.765 9.453 1.00 0.00 C ATOM 1229 O ILE A 83 0.196 -0.286 9.116 1.00 0.00 O ATOM 1230 CB ILE A 83 0.212 2.655 7.924 1.00 0.00 C ATOM 1231 CG1 ILE A 83 0.889 1.735 6.906 1.00 0.00 C ATOM 1232 CG2 ILE A 83 0.782 4.063 7.834 1.00 0.00 C ATOM 1233 CD1 ILE A 83 0.307 1.842 5.514 1.00 0.00 C ATOM 0 H ILE A 83 2.153 1.000 9.599 1.00 0.00 H new ATOM 0 HA ILE A 83 -0.045 2.802 10.061 1.00 0.00 H new ATOM 0 HB ILE A 83 -0.853 2.699 7.694 1.00 0.00 H new ATOM 0 HG12 ILE A 83 1.952 1.971 6.866 1.00 0.00 H new ATOM 0 HG13 ILE A 83 0.805 0.704 7.248 1.00 0.00 H new ATOM 0 HG21 ILE A 83 0.653 4.444 6.821 1.00 0.00 H new ATOM 0 HG22 ILE A 83 0.259 4.713 8.535 1.00 0.00 H new ATOM 0 HG23 ILE A 83 1.843 4.042 8.081 1.00 0.00 H new ATOM 0 HD11 ILE A 83 0.835 1.162 4.846 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -0.750 1.577 5.540 1.00 0.00 H new ATOM 0 HD13 ILE A 83 0.416 2.864 5.152 1.00 0.00 H new ATOM 1245 N VAL A 84 -1.594 0.816 9.921 1.00 0.00 N ATOM 1246 CA VAL A 84 -2.405 -0.386 10.067 1.00 0.00 C ATOM 1247 C VAL A 84 -3.398 -0.522 8.918 1.00 0.00 C ATOM 1248 O VAL A 84 -4.268 0.329 8.732 1.00 0.00 O ATOM 1249 CB VAL A 84 -3.177 -0.383 11.400 1.00 0.00 C ATOM 1250 CG1 VAL A 84 -3.718 -1.772 11.707 1.00 0.00 C ATOM 1251 CG2 VAL A 84 -2.288 0.113 12.529 1.00 0.00 C ATOM 0 H VAL A 84 -2.061 1.677 10.205 1.00 0.00 H new ATOM 0 HA VAL A 84 -1.720 -1.234 10.054 1.00 0.00 H new ATOM 0 HB VAL A 84 -4.023 0.298 11.308 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -4.260 -1.751 12.652 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -4.392 -2.085 10.909 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -2.890 -2.477 11.780 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -2.850 0.109 13.463 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -1.421 -0.541 12.624 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -1.955 1.128 12.311 1.00 0.00 H new ATOM 1261 N CYS A 85 -3.261 -1.597 8.150 1.00 0.00 N ATOM 1262 CA CYS A 85 -4.146 -1.846 7.017 1.00 0.00 C ATOM 1263 C CYS A 85 -4.207 -3.334 6.691 1.00 0.00 C ATOM 1264 O CYS A 85 -3.258 -4.076 6.947 1.00 0.00 O ATOM 1265 CB CYS A 85 -3.673 -1.062 5.792 1.00 0.00 C ATOM 1266 SG CYS A 85 -1.971 -1.421 5.298 1.00 0.00 S ATOM 0 H CYS A 85 -2.546 -2.310 8.291 1.00 0.00 H new ATOM 0 HA CYS A 85 -5.147 -1.511 7.289 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -4.337 -1.281 4.955 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -3.763 0.004 6.000 1.00 0.00 H new ATOM 0 HG CYS A 85 -1.664 -0.712 4.253 1.00 0.00 H new ATOM 1272 N VAL A 86 -5.330 -3.765 6.125 1.00 0.00 N ATOM 1273 CA VAL A 86 -5.515 -5.166 5.764 1.00 0.00 C ATOM 1274 C VAL A 86 -4.607 -5.559 4.605 1.00 0.00 C ATOM 1275 O VAL A 86 -4.776 -5.112 3.471 1.00 0.00 O ATOM 1276 CB VAL A 86 -6.978 -5.456 5.377 1.00 0.00 C ATOM 1277 CG1 VAL A 86 -7.133 -6.900 4.924 1.00 0.00 C ATOM 1278 CG2 VAL A 86 -7.907 -5.152 6.542 1.00 0.00 C ATOM 0 H VAL A 86 -6.125 -3.165 5.907 1.00 0.00 H new ATOM 0 HA VAL A 86 -5.254 -5.757 6.642 1.00 0.00 H new ATOM 0 HB VAL A 86 -7.252 -4.807 4.545 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -8.172 -7.087 4.655 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -6.496 -7.080 4.058 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -6.842 -7.569 5.734 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -8.936 -5.362 6.251 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -7.637 -5.774 7.395 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -7.815 -4.101 6.816 1.00 0.00 H new ATOM 1288 N PRO A 87 -3.618 -6.418 4.894 1.00 0.00 N ATOM 1289 CA PRO A 87 -2.662 -6.893 3.888 1.00 0.00 C ATOM 1290 C PRO A 87 -3.308 -7.826 2.870 1.00 0.00 C ATOM 1291 O PRO A 87 -3.967 -8.798 3.237 1.00 0.00 O ATOM 1292 CB PRO A 87 -1.619 -7.645 4.718 1.00 0.00 C ATOM 1293 CG PRO A 87 -2.347 -8.071 5.946 1.00 0.00 C ATOM 1294 CD PRO A 87 -3.356 -6.992 6.224 1.00 0.00 C ATOM 0 HA PRO A 87 -2.248 -6.074 3.299 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -1.224 -8.503 4.174 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -0.771 -7.005 4.962 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -2.836 -9.033 5.796 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -1.661 -8.190 6.785 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -4.263 -7.396 6.673 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -2.965 -6.244 6.914 1.00 0.00 H new ATOM 1302 N ASN A 88 -3.113 -7.525 1.591 1.00 0.00 N ATOM 1303 CA ASN A 88 -3.677 -8.338 0.519 1.00 0.00 C ATOM 1304 C ASN A 88 -2.577 -8.888 -0.383 1.00 0.00 C ATOM 1305 O ASN A 88 -1.853 -8.144 -1.045 1.00 0.00 O ATOM 1306 CB ASN A 88 -4.667 -7.514 -0.308 1.00 0.00 C ATOM 1307 CG ASN A 88 -6.066 -7.535 0.276 1.00 0.00 C ATOM 1308 OD1 ASN A 88 -6.242 -7.582 1.493 1.00 0.00 O ATOM 1309 ND2 ASN A 88 -7.070 -7.500 -0.593 1.00 0.00 N ATOM 0 H ASN A 88 -2.569 -6.724 1.271 1.00 0.00 H new ATOM 0 HA ASN A 88 -4.204 -9.178 0.972 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -4.317 -6.484 -0.368 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -4.696 -7.901 -1.327 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -8.034 -7.512 -0.259 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -6.877 -7.461 -1.594 1.00 0.00 H new ATOM 1316 N PRO A 89 -2.447 -10.223 -0.412 1.00 0.00 N ATOM 1317 CA PRO A 89 -3.303 -11.118 0.373 1.00 0.00 C ATOM 1318 C PRO A 89 -3.022 -11.025 1.869 1.00 0.00 C ATOM 1319 O PRO A 89 -2.022 -10.453 2.303 1.00 0.00 O ATOM 1320 CB PRO A 89 -2.938 -12.508 -0.154 1.00 0.00 C ATOM 1321 CG PRO A 89 -1.551 -12.363 -0.678 1.00 0.00 C ATOM 1322 CD PRO A 89 -1.455 -10.960 -1.211 1.00 0.00 C ATOM 0 HA PRO A 89 -4.359 -10.870 0.267 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -2.986 -13.256 0.637 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -3.626 -12.827 -0.937 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -0.817 -12.533 0.109 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -1.352 -13.093 -1.462 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -0.453 -10.550 -1.085 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -1.685 -10.918 -2.276 1.00 0.00 H new ATOM 1330 N PRO A 90 -3.925 -11.599 2.678 1.00 0.00 N ATOM 1331 CA PRO A 90 -3.795 -11.595 4.138 1.00 0.00 C ATOM 1332 C PRO A 90 -2.652 -12.481 4.621 1.00 0.00 C ATOM 1333 O PRO A 90 -2.361 -13.516 4.021 1.00 0.00 O ATOM 1334 CB PRO A 90 -5.140 -12.148 4.615 1.00 0.00 C ATOM 1335 CG PRO A 90 -5.634 -12.974 3.479 1.00 0.00 C ATOM 1336 CD PRO A 90 -5.141 -12.298 2.230 1.00 0.00 C ATOM 0 HA PRO A 90 -3.566 -10.602 4.524 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -5.024 -12.746 5.519 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -5.837 -11.344 4.852 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -5.256 -13.994 3.545 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -6.722 -13.036 3.486 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -4.923 -13.019 1.442 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -5.880 -11.603 1.831 1.00 0.00 H new ATOM 1344 N ILE A 91 -2.009 -12.069 5.708 1.00 0.00 N ATOM 1345 CA ILE A 91 -0.899 -12.828 6.272 1.00 0.00 C ATOM 1346 C ILE A 91 -1.333 -14.241 6.646 1.00 0.00 C ATOM 1347 O ILE A 91 -0.618 -15.209 6.389 1.00 0.00 O ATOM 1348 CB ILE A 91 -0.319 -12.134 7.519 1.00 0.00 C ATOM 1349 CG1 ILE A 91 0.043 -10.682 7.200 1.00 0.00 C ATOM 1350 CG2 ILE A 91 0.899 -12.890 8.027 1.00 0.00 C ATOM 1351 CD1 ILE A 91 1.242 -10.545 6.289 1.00 0.00 C ATOM 0 H ILE A 91 -2.237 -11.214 6.216 1.00 0.00 H new ATOM 0 HA ILE A 91 -0.128 -12.879 5.503 1.00 0.00 H new ATOM 0 HB ILE A 91 -1.076 -12.136 8.303 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -0.814 -10.196 6.734 1.00 0.00 H new ATOM 0 HG13 ILE A 91 0.242 -10.153 8.132 1.00 0.00 H new ATOM 0 HG21 ILE A 91 1.298 -12.388 8.908 1.00 0.00 H new ATOM 0 HG22 ILE A 91 0.612 -13.908 8.289 1.00 0.00 H new ATOM 0 HG23 ILE A 91 1.662 -12.917 7.249 1.00 0.00 H new ATOM 0 HD11 ILE A 91 1.441 -9.489 6.106 1.00 0.00 H new ATOM 0 HD12 ILE A 91 2.112 -11.001 6.761 1.00 0.00 H new ATOM 0 HD13 ILE A 91 1.039 -11.046 5.342 1.00 0.00 H new ATOM 1363 N ASP A 92 -2.510 -14.351 7.252 1.00 0.00 N ATOM 1364 CA ASP A 92 -3.041 -15.647 7.659 1.00 0.00 C ATOM 1365 C ASP A 92 -4.543 -15.722 7.405 1.00 0.00 C ATOM 1366 O ASP A 92 -5.158 -14.749 6.969 1.00 0.00 O ATOM 1367 CB ASP A 92 -2.748 -15.901 9.139 1.00 0.00 C ATOM 1368 CG ASP A 92 -3.544 -14.988 10.051 1.00 0.00 C ATOM 1369 OD1 ASP A 92 -4.003 -13.928 9.576 1.00 0.00 O ATOM 1370 OD2 ASP A 92 -3.708 -15.333 11.240 1.00 0.00 O ATOM 0 H ASP A 92 -3.114 -13.559 7.472 1.00 0.00 H new ATOM 0 HA ASP A 92 -2.551 -16.416 7.063 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -2.977 -16.939 9.379 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -1.684 -15.758 9.326 1.00 0.00 H new ATOM 1375 N GLU A 93 -5.128 -16.884 7.680 1.00 0.00 N ATOM 1376 CA GLU A 93 -6.558 -17.086 7.478 1.00 0.00 C ATOM 1377 C GLU A 93 -7.341 -16.719 8.736 1.00 0.00 C ATOM 1378 O GLU A 93 -8.458 -16.206 8.658 1.00 0.00 O ATOM 1379 CB GLU A 93 -6.841 -18.539 7.093 1.00 0.00 C ATOM 1380 CG GLU A 93 -8.312 -18.913 7.169 1.00 0.00 C ATOM 1381 CD GLU A 93 -9.149 -18.202 6.124 1.00 0.00 C ATOM 1382 OE1 GLU A 93 -9.531 -17.037 6.363 1.00 0.00 O ATOM 1383 OE2 GLU A 93 -9.423 -18.809 5.068 1.00 0.00 O ATOM 0 H GLU A 93 -4.634 -17.699 8.043 1.00 0.00 H new ATOM 0 HA GLU A 93 -6.881 -16.434 6.666 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -6.482 -18.714 6.079 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -6.273 -19.197 7.750 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -8.416 -19.990 7.041 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -8.694 -18.671 8.161 1.00 0.00 H new ATOM 1390 N LYS A 94 -6.748 -16.986 9.894 1.00 0.00 N ATOM 1391 CA LYS A 94 -7.388 -16.684 11.169 1.00 0.00 C ATOM 1392 C LYS A 94 -7.547 -15.179 11.355 1.00 0.00 C ATOM 1393 O LYS A 94 -8.664 -14.671 11.453 1.00 0.00 O ATOM 1394 CB LYS A 94 -6.570 -17.268 12.324 1.00 0.00 C ATOM 1395 CG LYS A 94 -6.925 -18.707 12.654 1.00 0.00 C ATOM 1396 CD LYS A 94 -6.248 -19.680 11.703 1.00 0.00 C ATOM 1397 CE LYS A 94 -6.710 -21.109 11.945 1.00 0.00 C ATOM 1398 NZ LYS A 94 -6.188 -22.044 10.910 1.00 0.00 N ATOM 0 H LYS A 94 -5.825 -17.411 9.976 1.00 0.00 H new ATOM 0 HA LYS A 94 -8.379 -17.138 11.167 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -5.511 -17.212 12.073 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -6.720 -16.653 13.211 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -6.627 -18.931 13.678 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -8.006 -18.837 12.601 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -6.466 -19.395 10.674 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -5.167 -19.620 11.828 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -6.378 -21.436 12.930 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -7.799 -21.143 11.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -6.525 -23.007 11.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -6.526 -21.747 9.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -5.148 -22.031 10.924 1.00 0.00 H new ATOM 1412 N ASN A 95 -6.424 -14.471 11.402 1.00 0.00 N ATOM 1413 CA ASN A 95 -6.440 -13.022 11.575 1.00 0.00 C ATOM 1414 C ASN A 95 -6.518 -12.314 10.226 1.00 0.00 C ATOM 1415 O ASN A 95 -6.261 -11.115 10.127 1.00 0.00 O ATOM 1416 CB ASN A 95 -5.192 -12.565 12.332 1.00 0.00 C ATOM 1417 CG ASN A 95 -5.322 -12.757 13.831 1.00 0.00 C ATOM 1418 OD1 ASN A 95 -5.847 -11.894 14.535 1.00 0.00 O ATOM 1419 ND2 ASN A 95 -4.844 -13.892 14.326 1.00 0.00 N ATOM 0 H ASN A 95 -5.491 -14.876 11.323 1.00 0.00 H new ATOM 0 HA ASN A 95 -7.325 -12.760 12.154 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -4.327 -13.122 11.971 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -5.006 -11.513 12.118 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -4.904 -14.077 15.327 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -4.417 -14.579 13.705 1.00 0.00 H new ATOM 1426 N ALA A 96 -6.876 -13.065 9.189 1.00 0.00 N ATOM 1427 CA ALA A 96 -6.990 -12.509 7.847 1.00 0.00 C ATOM 1428 C ALA A 96 -7.898 -11.283 7.836 1.00 0.00 C ATOM 1429 O ALA A 96 -7.492 -10.200 7.413 1.00 0.00 O ATOM 1430 CB ALA A 96 -7.513 -13.563 6.882 1.00 0.00 C ATOM 0 H ALA A 96 -7.092 -14.060 9.253 1.00 0.00 H new ATOM 0 HA ALA A 96 -5.997 -12.197 7.524 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -7.593 -13.134 5.883 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -6.826 -14.409 6.860 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -8.495 -13.902 7.211 1.00 0.00 H new ATOM 1436 N THR A 97 -9.130 -11.460 8.304 1.00 0.00 N ATOM 1437 CA THR A 97 -10.095 -10.369 8.346 1.00 0.00 C ATOM 1438 C THR A 97 -9.564 -9.196 9.162 1.00 0.00 C ATOM 1439 O THR A 97 -10.032 -8.067 9.020 1.00 0.00 O ATOM 1440 CB THR A 97 -11.438 -10.830 8.944 1.00 0.00 C ATOM 1441 OG1 THR A 97 -12.317 -9.710 9.096 1.00 0.00 O ATOM 1442 CG2 THR A 97 -11.227 -11.502 10.293 1.00 0.00 C ATOM 0 H THR A 97 -9.482 -12.349 8.659 1.00 0.00 H new ATOM 0 HA THR A 97 -10.255 -10.049 7.317 1.00 0.00 H new ATOM 0 HB THR A 97 -11.886 -11.552 8.261 1.00 0.00 H new ATOM 0 HG1 THR A 97 -13.169 -10.012 9.475 1.00 0.00 H new ATOM 0 HG21 THR A 97 -12.189 -11.819 10.696 1.00 0.00 H new ATOM 0 HG22 THR A 97 -10.581 -12.371 10.169 1.00 0.00 H new ATOM 0 HG23 THR A 97 -10.760 -10.798 10.981 1.00 0.00 H new ATOM 1450 N MET A 98 -8.584 -9.472 10.017 1.00 0.00 N ATOM 1451 CA MET A 98 -7.988 -8.437 10.854 1.00 0.00 C ATOM 1452 C MET A 98 -6.723 -7.878 10.211 1.00 0.00 C ATOM 1453 O MET A 98 -5.918 -8.608 9.632 1.00 0.00 O ATOM 1454 CB MET A 98 -7.664 -8.997 12.240 1.00 0.00 C ATOM 1455 CG MET A 98 -7.651 -7.942 13.334 1.00 0.00 C ATOM 1456 SD MET A 98 -7.664 -8.657 14.990 1.00 0.00 S ATOM 1457 CE MET A 98 -9.046 -7.787 15.724 1.00 0.00 C ATOM 0 H MET A 98 -8.186 -10.402 10.148 1.00 0.00 H new ATOM 0 HA MET A 98 -8.710 -7.627 10.956 1.00 0.00 H new ATOM 0 HB2 MET A 98 -8.397 -9.763 12.494 1.00 0.00 H new ATOM 0 HB3 MET A 98 -6.690 -9.486 12.207 1.00 0.00 H new ATOM 0 HG2 MET A 98 -6.766 -7.317 13.220 1.00 0.00 H new ATOM 0 HG3 MET A 98 -8.518 -7.292 13.217 1.00 0.00 H new ATOM 0 HE1 MET A 98 -9.181 -8.121 16.753 1.00 0.00 H new ATOM 0 HE2 MET A 98 -8.848 -6.715 15.714 1.00 0.00 H new ATOM 0 HE3 MET A 98 -9.951 -7.994 15.153 1.00 0.00 H new ATOM 1467 N PRO A 99 -6.542 -6.553 10.312 1.00 0.00 N ATOM 1468 CA PRO A 99 -5.376 -5.868 9.746 1.00 0.00 C ATOM 1469 C PRO A 99 -4.089 -6.200 10.493 1.00 0.00 C ATOM 1470 O PRO A 99 -4.123 -6.678 11.627 1.00 0.00 O ATOM 1471 CB PRO A 99 -5.723 -4.386 9.909 1.00 0.00 C ATOM 1472 CG PRO A 99 -6.673 -4.343 11.055 1.00 0.00 C ATOM 1473 CD PRO A 99 -7.461 -5.622 10.988 1.00 0.00 C ATOM 0 HA PRO A 99 -5.189 -6.165 8.714 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -4.832 -3.791 10.111 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -6.177 -3.984 9.003 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -6.139 -4.263 12.002 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -7.330 -3.476 10.985 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -7.735 -5.978 11.981 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -8.388 -5.494 10.428 1.00 0.00 H new ATOM 1481 N VAL A 100 -2.954 -5.942 9.851 1.00 0.00 N ATOM 1482 CA VAL A 100 -1.655 -6.212 10.455 1.00 0.00 C ATOM 1483 C VAL A 100 -0.730 -5.007 10.330 1.00 0.00 C ATOM 1484 O VAL A 100 -0.899 -4.169 9.443 1.00 0.00 O ATOM 1485 CB VAL A 100 -0.979 -7.435 9.809 1.00 0.00 C ATOM 1486 CG1 VAL A 100 -1.992 -8.546 9.577 1.00 0.00 C ATOM 1487 CG2 VAL A 100 -0.300 -7.041 8.506 1.00 0.00 C ATOM 0 H VAL A 100 -2.908 -5.546 8.912 1.00 0.00 H new ATOM 0 HA VAL A 100 -1.833 -6.421 11.510 1.00 0.00 H new ATOM 0 HB VAL A 100 -0.216 -7.809 10.492 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -1.495 -9.402 9.120 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -2.428 -8.846 10.530 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -2.780 -8.187 8.915 1.00 0.00 H new ATOM 0 HG21 VAL A 100 0.173 -7.917 8.063 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -1.042 -6.641 7.815 1.00 0.00 H new ATOM 0 HG23 VAL A 100 0.457 -6.282 8.705 1.00 0.00 H new ATOM 1497 N THR A 101 0.251 -4.925 11.223 1.00 0.00 N ATOM 1498 CA THR A 101 1.204 -3.823 11.214 1.00 0.00 C ATOM 1499 C THR A 101 2.135 -3.911 10.009 1.00 0.00 C ATOM 1500 O THR A 101 2.599 -4.993 9.650 1.00 0.00 O ATOM 1501 CB THR A 101 2.050 -3.800 12.501 1.00 0.00 C ATOM 1502 OG1 THR A 101 1.200 -3.909 13.648 1.00 0.00 O ATOM 1503 CG2 THR A 101 2.867 -2.520 12.589 1.00 0.00 C ATOM 0 H THR A 101 0.406 -5.610 11.963 1.00 0.00 H new ATOM 0 HA THR A 101 0.622 -2.903 11.154 1.00 0.00 H new ATOM 0 HB THR A 101 2.734 -4.648 12.475 1.00 0.00 H new ATOM 0 HG1 THR A 101 1.746 -3.895 14.462 1.00 0.00 H new ATOM 0 HG21 THR A 101 3.456 -2.527 13.506 1.00 0.00 H new ATOM 0 HG22 THR A 101 3.534 -2.454 11.730 1.00 0.00 H new ATOM 0 HG23 THR A 101 2.197 -1.660 12.595 1.00 0.00 H new ATOM 1511 N MET A 102 2.404 -2.766 9.390 1.00 0.00 N ATOM 1512 CA MET A 102 3.281 -2.715 8.226 1.00 0.00 C ATOM 1513 C MET A 102 4.271 -1.560 8.342 1.00 0.00 C ATOM 1514 O MET A 102 3.909 -0.459 8.759 1.00 0.00 O ATOM 1515 CB MET A 102 2.457 -2.570 6.946 1.00 0.00 C ATOM 1516 CG MET A 102 1.908 -3.888 6.424 1.00 0.00 C ATOM 1517 SD MET A 102 1.618 -3.864 4.644 1.00 0.00 S ATOM 1518 CE MET A 102 2.040 -5.549 4.210 1.00 0.00 C ATOM 0 H MET A 102 2.028 -1.862 9.675 1.00 0.00 H new ATOM 0 HA MET A 102 3.842 -3.648 8.184 1.00 0.00 H new ATOM 0 HB2 MET A 102 1.627 -1.889 7.133 1.00 0.00 H new ATOM 0 HB3 MET A 102 3.077 -2.113 6.175 1.00 0.00 H new ATOM 0 HG2 MET A 102 2.608 -4.689 6.663 1.00 0.00 H new ATOM 0 HG3 MET A 102 0.974 -4.117 6.937 1.00 0.00 H new ATOM 0 HE1 MET A 102 1.860 -5.707 3.147 1.00 0.00 H new ATOM 0 HE2 MET A 102 3.092 -5.729 4.431 1.00 0.00 H new ATOM 0 HE3 MET A 102 1.425 -6.239 4.788 1.00 0.00 H new ATOM 1528 N LEU A 103 5.520 -1.818 7.972 1.00 0.00 N ATOM 1529 CA LEU A 103 6.563 -0.799 8.034 1.00 0.00 C ATOM 1530 C LEU A 103 7.030 -0.412 6.635 1.00 0.00 C ATOM 1531 O LEU A 103 7.532 -1.249 5.884 1.00 0.00 O ATOM 1532 CB LEU A 103 7.748 -1.304 8.859 1.00 0.00 C ATOM 1533 CG LEU A 103 8.689 -0.232 9.408 1.00 0.00 C ATOM 1534 CD1 LEU A 103 9.567 0.326 8.299 1.00 0.00 C ATOM 1535 CD2 LEU A 103 7.896 0.883 10.075 1.00 0.00 C ATOM 0 H LEU A 103 5.836 -2.724 7.626 1.00 0.00 H new ATOM 0 HA LEU A 103 6.145 0.086 8.514 1.00 0.00 H new ATOM 0 HB2 LEU A 103 7.361 -1.883 9.697 1.00 0.00 H new ATOM 0 HB3 LEU A 103 8.330 -1.988 8.241 1.00 0.00 H new ATOM 0 HG LEU A 103 9.334 -0.691 10.158 1.00 0.00 H new ATOM 0 HD11 LEU A 103 10.230 1.088 8.709 1.00 0.00 H new ATOM 0 HD12 LEU A 103 10.162 -0.478 7.866 1.00 0.00 H new ATOM 0 HD13 LEU A 103 8.939 0.769 7.526 1.00 0.00 H new ATOM 0 HD21 LEU A 103 8.582 1.637 10.460 1.00 0.00 H new ATOM 0 HD22 LEU A 103 7.227 1.340 9.346 1.00 0.00 H new ATOM 0 HD23 LEU A 103 7.311 0.472 10.897 1.00 0.00 H new ATOM 1547 N ILE A 104 6.864 0.861 6.293 1.00 0.00 N ATOM 1548 CA ILE A 104 7.273 1.359 4.985 1.00 0.00 C ATOM 1549 C ILE A 104 8.420 2.356 5.110 1.00 0.00 C ATOM 1550 O ILE A 104 8.250 3.449 5.651 1.00 0.00 O ATOM 1551 CB ILE A 104 6.100 2.033 4.248 1.00 0.00 C ATOM 1552 CG1 ILE A 104 4.956 1.037 4.047 1.00 0.00 C ATOM 1553 CG2 ILE A 104 6.565 2.591 2.911 1.00 0.00 C ATOM 1554 CD1 ILE A 104 3.611 1.697 3.839 1.00 0.00 C ATOM 0 H ILE A 104 6.450 1.566 6.903 1.00 0.00 H new ATOM 0 HA ILE A 104 7.606 0.496 4.409 1.00 0.00 H new ATOM 0 HB ILE A 104 5.734 2.860 4.857 1.00 0.00 H new ATOM 0 HG12 ILE A 104 5.180 0.408 3.186 1.00 0.00 H new ATOM 0 HG13 ILE A 104 4.899 0.381 4.915 1.00 0.00 H new ATOM 0 HG21 ILE A 104 5.725 3.064 2.402 1.00 0.00 H new ATOM 0 HG22 ILE A 104 7.350 3.328 3.078 1.00 0.00 H new ATOM 0 HG23 ILE A 104 6.953 1.781 2.294 1.00 0.00 H new ATOM 0 HD11 ILE A 104 2.847 0.931 3.703 1.00 0.00 H new ATOM 0 HD12 ILE A 104 3.365 2.304 4.710 1.00 0.00 H new ATOM 0 HD13 ILE A 104 3.650 2.332 2.954 1.00 0.00 H new ATOM 1566 N ARG A 105 9.588 1.972 4.606 1.00 0.00 N ATOM 1567 CA ARG A 105 10.764 2.832 4.660 1.00 0.00 C ATOM 1568 C ARG A 105 11.129 3.342 3.270 1.00 0.00 C ATOM 1569 O ARG A 105 11.236 2.566 2.320 1.00 0.00 O ATOM 1570 CB ARG A 105 11.948 2.075 5.265 1.00 0.00 C ATOM 1571 CG ARG A 105 12.275 0.779 4.542 1.00 0.00 C ATOM 1572 CD ARG A 105 13.719 0.361 4.775 1.00 0.00 C ATOM 1573 NE ARG A 105 14.657 1.189 4.023 1.00 0.00 N ATOM 1574 CZ ARG A 105 15.932 1.349 4.361 1.00 0.00 C ATOM 1575 NH1 ARG A 105 16.417 0.738 5.433 1.00 0.00 N ATOM 1576 NH2 ARG A 105 16.723 2.119 3.626 1.00 0.00 N ATOM 0 H ARG A 105 9.745 1.071 4.155 1.00 0.00 H new ATOM 0 HA ARG A 105 10.528 3.689 5.292 1.00 0.00 H new ATOM 0 HB2 ARG A 105 12.826 2.720 5.251 1.00 0.00 H new ATOM 0 HB3 ARG A 105 11.731 1.854 6.310 1.00 0.00 H new ATOM 0 HG2 ARG A 105 11.606 -0.010 4.886 1.00 0.00 H new ATOM 0 HG3 ARG A 105 12.098 0.902 3.473 1.00 0.00 H new ATOM 0 HD2 ARG A 105 13.949 0.428 5.838 1.00 0.00 H new ATOM 0 HD3 ARG A 105 13.845 -0.683 4.487 1.00 0.00 H new ATOM 0 HE ARG A 105 14.315 1.671 3.192 1.00 0.00 H new ATOM 0 HH11 ARG A 105 15.811 0.144 5.999 1.00 0.00 H new ATOM 0 HH12 ARG A 105 17.396 0.862 5.691 1.00 0.00 H new ATOM 0 HH21 ARG A 105 16.353 2.589 2.800 1.00 0.00 H new ATOM 0 HH22 ARG A 105 17.702 2.241 3.887 1.00 0.00 H new ATOM 1590 N VAL A 106 11.319 4.653 3.157 1.00 0.00 N ATOM 1591 CA VAL A 106 11.673 5.268 1.883 1.00 0.00 C ATOM 1592 C VAL A 106 13.175 5.515 1.790 1.00 0.00 C ATOM 1593 O VAL A 106 13.895 5.413 2.784 1.00 0.00 O ATOM 1594 CB VAL A 106 10.930 6.601 1.678 1.00 0.00 C ATOM 1595 CG1 VAL A 106 11.538 7.690 2.549 1.00 0.00 C ATOM 1596 CG2 VAL A 106 10.955 7.004 0.211 1.00 0.00 C ATOM 0 H VAL A 106 11.234 5.310 3.933 1.00 0.00 H new ATOM 0 HA VAL A 106 11.374 4.570 1.101 1.00 0.00 H new ATOM 0 HB VAL A 106 9.890 6.468 1.977 1.00 0.00 H new ATOM 0 HG11 VAL A 106 11.000 8.625 2.391 1.00 0.00 H new ATOM 0 HG12 VAL A 106 11.464 7.401 3.597 1.00 0.00 H new ATOM 0 HG13 VAL A 106 12.586 7.825 2.284 1.00 0.00 H new ATOM 0 HG21 VAL A 106 10.425 7.948 0.084 1.00 0.00 H new ATOM 0 HG22 VAL A 106 11.988 7.120 -0.117 1.00 0.00 H new ATOM 0 HG23 VAL A 106 10.469 6.232 -0.387 1.00 0.00 H new ATOM 1606 N LYS A 107 13.642 5.842 0.590 1.00 0.00 N ATOM 1607 CA LYS A 107 15.058 6.107 0.366 1.00 0.00 C ATOM 1608 C LYS A 107 15.529 7.291 1.203 1.00 0.00 C ATOM 1609 O LYS A 107 16.498 7.186 1.957 1.00 0.00 O ATOM 1610 CB LYS A 107 15.318 6.381 -1.117 1.00 0.00 C ATOM 1611 CG LYS A 107 16.790 6.541 -1.457 1.00 0.00 C ATOM 1612 CD LYS A 107 17.040 6.373 -2.946 1.00 0.00 C ATOM 1613 CE LYS A 107 16.594 7.598 -3.728 1.00 0.00 C ATOM 1614 NZ LYS A 107 17.403 8.800 -3.385 1.00 0.00 N ATOM 0 H LYS A 107 13.060 5.930 -0.243 1.00 0.00 H new ATOM 0 HA LYS A 107 15.620 5.224 0.670 1.00 0.00 H new ATOM 0 HB2 LYS A 107 14.904 5.563 -1.707 1.00 0.00 H new ATOM 0 HB3 LYS A 107 14.786 7.286 -1.409 1.00 0.00 H new ATOM 0 HG2 LYS A 107 17.133 7.525 -1.138 1.00 0.00 H new ATOM 0 HG3 LYS A 107 17.374 5.806 -0.904 1.00 0.00 H new ATOM 0 HD2 LYS A 107 18.101 6.196 -3.120 1.00 0.00 H new ATOM 0 HD3 LYS A 107 16.506 5.494 -3.309 1.00 0.00 H new ATOM 0 HE2 LYS A 107 16.677 7.397 -4.796 1.00 0.00 H new ATOM 0 HE3 LYS A 107 15.542 7.797 -3.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 16.795 9.509 -2.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 18.169 8.529 -2.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 17.811 9.203 -4.253 1.00 0.00 H new ATOM 1628 N THR A 108 14.838 8.419 1.068 1.00 0.00 N ATOM 1629 CA THR A 108 15.186 9.622 1.812 1.00 0.00 C ATOM 1630 C THR A 108 14.098 9.980 2.819 1.00 0.00 C ATOM 1631 O THR A 108 12.911 9.965 2.495 1.00 0.00 O ATOM 1632 CB THR A 108 15.411 10.820 0.870 1.00 0.00 C ATOM 1633 OG1 THR A 108 14.258 11.016 0.043 1.00 0.00 O ATOM 1634 CG2 THR A 108 16.636 10.598 -0.004 1.00 0.00 C ATOM 0 H THR A 108 14.034 8.524 0.450 1.00 0.00 H new ATOM 0 HA THR A 108 16.113 9.407 2.343 1.00 0.00 H new ATOM 0 HB THR A 108 15.575 11.708 1.480 1.00 0.00 H new ATOM 0 HG1 THR A 108 14.135 10.236 -0.537 1.00 0.00 H new ATOM 0 HG21 THR A 108 16.775 11.457 -0.661 1.00 0.00 H new ATOM 0 HG22 THR A 108 17.516 10.478 0.627 1.00 0.00 H new ATOM 0 HG23 THR A 108 16.496 9.700 -0.606 1.00 0.00 H new ATOM 1642 N SER A 109 14.512 10.302 4.040 1.00 0.00 N ATOM 1643 CA SER A 109 13.572 10.661 5.096 1.00 0.00 C ATOM 1644 C SER A 109 12.544 11.667 4.588 1.00 0.00 C ATOM 1645 O SER A 109 11.338 11.466 4.734 1.00 0.00 O ATOM 1646 CB SER A 109 14.319 11.240 6.298 1.00 0.00 C ATOM 1647 OG SER A 109 15.021 12.419 5.943 1.00 0.00 O ATOM 0 H SER A 109 15.492 10.322 4.323 1.00 0.00 H new ATOM 0 HA SER A 109 13.048 9.757 5.405 1.00 0.00 H new ATOM 0 HB2 SER A 109 13.612 11.461 7.098 1.00 0.00 H new ATOM 0 HB3 SER A 109 15.018 10.500 6.687 1.00 0.00 H new ATOM 0 HG SER A 109 15.489 12.770 6.729 1.00 0.00 H new ATOM 1653 N GLU A 110 13.030 12.751 3.992 1.00 0.00 N ATOM 1654 CA GLU A 110 12.154 13.790 3.464 1.00 0.00 C ATOM 1655 C GLU A 110 10.982 13.178 2.703 1.00 0.00 C ATOM 1656 O GLU A 110 9.824 13.526 2.939 1.00 0.00 O ATOM 1657 CB GLU A 110 12.937 14.731 2.546 1.00 0.00 C ATOM 1658 CG GLU A 110 13.566 14.032 1.352 1.00 0.00 C ATOM 1659 CD GLU A 110 14.781 14.767 0.819 1.00 0.00 C ATOM 1660 OE1 GLU A 110 15.680 15.088 1.623 1.00 0.00 O ATOM 1661 OE2 GLU A 110 14.831 15.020 -0.403 1.00 0.00 O ATOM 0 H GLU A 110 14.025 12.933 3.863 1.00 0.00 H new ATOM 0 HA GLU A 110 11.761 14.360 4.306 1.00 0.00 H new ATOM 0 HB2 GLU A 110 12.269 15.514 2.187 1.00 0.00 H new ATOM 0 HB3 GLU A 110 13.721 15.220 3.124 1.00 0.00 H new ATOM 0 HG2 GLU A 110 13.855 13.021 1.638 1.00 0.00 H new ATOM 0 HG3 GLU A 110 12.825 13.939 0.558 1.00 0.00 H new ATOM 1668 N ASP A 111 11.290 12.266 1.788 1.00 0.00 N ATOM 1669 CA ASP A 111 10.263 11.604 0.991 1.00 0.00 C ATOM 1670 C ASP A 111 9.182 11.007 1.887 1.00 0.00 C ATOM 1671 O ASP A 111 7.990 11.153 1.618 1.00 0.00 O ATOM 1672 CB ASP A 111 10.887 10.509 0.125 1.00 0.00 C ATOM 1673 CG ASP A 111 11.528 11.061 -1.133 1.00 0.00 C ATOM 1674 OD1 ASP A 111 11.033 12.084 -1.651 1.00 0.00 O ATOM 1675 OD2 ASP A 111 12.524 10.470 -1.600 1.00 0.00 O ATOM 0 H ASP A 111 12.243 11.968 1.579 1.00 0.00 H new ATOM 0 HA ASP A 111 9.802 12.350 0.343 1.00 0.00 H new ATOM 0 HB2 ASP A 111 11.637 9.973 0.707 1.00 0.00 H new ATOM 0 HB3 ASP A 111 10.120 9.785 -0.149 1.00 0.00 H new ATOM 1680 N ALA A 112 9.606 10.334 2.951 1.00 0.00 N ATOM 1681 CA ALA A 112 8.675 9.716 3.886 1.00 0.00 C ATOM 1682 C ALA A 112 7.716 10.748 4.468 1.00 0.00 C ATOM 1683 O ALA A 112 6.505 10.530 4.513 1.00 0.00 O ATOM 1684 CB ALA A 112 9.434 9.011 5.000 1.00 0.00 C ATOM 0 H ALA A 112 10.590 10.203 3.187 1.00 0.00 H new ATOM 0 HA ALA A 112 8.087 8.979 3.340 1.00 0.00 H new ATOM 0 HB1 ALA A 112 8.725 8.554 5.691 1.00 0.00 H new ATOM 0 HB2 ALA A 112 10.073 8.239 4.572 1.00 0.00 H new ATOM 0 HB3 ALA A 112 10.048 9.734 5.536 1.00 0.00 H new ATOM 1690 N ASP A 113 8.264 11.873 4.914 1.00 0.00 N ATOM 1691 CA ASP A 113 7.457 12.940 5.494 1.00 0.00 C ATOM 1692 C ASP A 113 6.243 13.239 4.620 1.00 0.00 C ATOM 1693 O ASP A 113 5.144 13.465 5.125 1.00 0.00 O ATOM 1694 CB ASP A 113 8.297 14.206 5.671 1.00 0.00 C ATOM 1695 CG ASP A 113 9.023 14.237 7.002 1.00 0.00 C ATOM 1696 OD1 ASP A 113 8.344 14.198 8.049 1.00 0.00 O ATOM 1697 OD2 ASP A 113 10.270 14.301 6.996 1.00 0.00 O ATOM 0 H ASP A 113 9.264 12.070 4.885 1.00 0.00 H new ATOM 0 HA ASP A 113 7.107 12.607 6.471 1.00 0.00 H new ATOM 0 HB2 ASP A 113 9.024 14.272 4.862 1.00 0.00 H new ATOM 0 HB3 ASP A 113 7.652 15.081 5.592 1.00 0.00 H new ATOM 1702 N GLU A 114 6.451 13.240 3.307 1.00 0.00 N ATOM 1703 CA GLU A 114 5.373 13.513 2.363 1.00 0.00 C ATOM 1704 C GLU A 114 4.353 12.379 2.360 1.00 0.00 C ATOM 1705 O GLU A 114 3.155 12.605 2.537 1.00 0.00 O ATOM 1706 CB GLU A 114 5.937 13.712 0.955 1.00 0.00 C ATOM 1707 CG GLU A 114 4.951 14.348 -0.011 1.00 0.00 C ATOM 1708 CD GLU A 114 4.799 15.841 0.210 1.00 0.00 C ATOM 1709 OE1 GLU A 114 4.299 16.232 1.286 1.00 0.00 O ATOM 1710 OE2 GLU A 114 5.179 16.617 -0.691 1.00 0.00 O ATOM 0 H GLU A 114 7.355 13.055 2.873 1.00 0.00 H new ATOM 0 HA GLU A 114 4.871 14.428 2.678 1.00 0.00 H new ATOM 0 HB2 GLU A 114 6.828 14.336 1.015 1.00 0.00 H new ATOM 0 HB3 GLU A 114 6.250 12.746 0.558 1.00 0.00 H new ATOM 0 HG2 GLU A 114 5.282 14.168 -1.034 1.00 0.00 H new ATOM 0 HG3 GLU A 114 3.979 13.867 0.099 1.00 0.00 H new ATOM 1717 N LEU A 115 4.835 11.158 2.156 1.00 0.00 N ATOM 1718 CA LEU A 115 3.966 9.987 2.128 1.00 0.00 C ATOM 1719 C LEU A 115 2.951 10.035 3.266 1.00 0.00 C ATOM 1720 O LEU A 115 1.755 9.829 3.054 1.00 0.00 O ATOM 1721 CB LEU A 115 4.798 8.707 2.226 1.00 0.00 C ATOM 1722 CG LEU A 115 4.029 7.431 2.573 1.00 0.00 C ATOM 1723 CD1 LEU A 115 3.040 7.088 1.470 1.00 0.00 C ATOM 1724 CD2 LEU A 115 4.992 6.276 2.807 1.00 0.00 C ATOM 0 H LEU A 115 5.823 10.953 2.008 1.00 0.00 H new ATOM 0 HA LEU A 115 3.425 9.990 1.182 1.00 0.00 H new ATOM 0 HB2 LEU A 115 5.306 8.554 1.274 1.00 0.00 H new ATOM 0 HB3 LEU A 115 5.572 8.857 2.979 1.00 0.00 H new ATOM 0 HG LEU A 115 3.470 7.604 3.493 1.00 0.00 H new ATOM 0 HD11 LEU A 115 2.502 6.178 1.734 1.00 0.00 H new ATOM 0 HD12 LEU A 115 2.331 7.907 1.350 1.00 0.00 H new ATOM 0 HD13 LEU A 115 3.578 6.933 0.534 1.00 0.00 H new ATOM 0 HD21 LEU A 115 4.428 5.376 3.053 1.00 0.00 H new ATOM 0 HD22 LEU A 115 5.578 6.102 1.904 1.00 0.00 H new ATOM 0 HD23 LEU A 115 5.661 6.521 3.632 1.00 0.00 H new ATOM 1736 N HIS A 116 3.435 10.310 4.473 1.00 0.00 N ATOM 1737 CA HIS A 116 2.569 10.388 5.644 1.00 0.00 C ATOM 1738 C HIS A 116 1.426 11.372 5.410 1.00 0.00 C ATOM 1739 O HIS A 116 0.264 11.064 5.675 1.00 0.00 O ATOM 1740 CB HIS A 116 3.375 10.808 6.873 1.00 0.00 C ATOM 1741 CG HIS A 116 2.536 11.027 8.094 1.00 0.00 C ATOM 1742 ND1 HIS A 116 1.656 12.081 8.223 1.00 0.00 N ATOM 1743 CD2 HIS A 116 2.444 10.320 9.244 1.00 0.00 C ATOM 1744 CE1 HIS A 116 1.061 12.014 9.400 1.00 0.00 C ATOM 1745 NE2 HIS A 116 1.521 10.954 10.040 1.00 0.00 N ATOM 0 H HIS A 116 4.422 10.482 4.666 1.00 0.00 H new ATOM 0 HA HIS A 116 2.144 9.399 5.818 1.00 0.00 H new ATOM 0 HB2 HIS A 116 4.121 10.042 7.087 1.00 0.00 H new ATOM 0 HB3 HIS A 116 3.917 11.726 6.645 1.00 0.00 H new ATOM 0 HD2 HIS A 116 2.994 9.424 9.490 1.00 0.00 H new ATOM 0 HE1 HIS A 116 0.324 12.708 9.776 1.00 0.00 H new ATOM 0 HE2 HIS A 116 1.237 10.655 10.973 1.00 0.00 H new ATOM 1753 N LYS A 117 1.765 12.557 4.914 1.00 0.00 N ATOM 1754 CA LYS A 117 0.768 13.587 4.643 1.00 0.00 C ATOM 1755 C LYS A 117 -0.155 13.165 3.506 1.00 0.00 C ATOM 1756 O LYS A 117 -1.371 13.076 3.681 1.00 0.00 O ATOM 1757 CB LYS A 117 1.454 14.910 4.294 1.00 0.00 C ATOM 1758 CG LYS A 117 1.730 15.789 5.501 1.00 0.00 C ATOM 1759 CD LYS A 117 2.903 15.268 6.314 1.00 0.00 C ATOM 1760 CE LYS A 117 3.336 16.270 7.373 1.00 0.00 C ATOM 1761 NZ LYS A 117 3.984 17.468 6.772 1.00 0.00 N ATOM 0 H LYS A 117 2.723 12.828 4.691 1.00 0.00 H new ATOM 0 HA LYS A 117 0.168 13.722 5.543 1.00 0.00 H new ATOM 0 HB2 LYS A 117 2.395 14.699 3.786 1.00 0.00 H new ATOM 0 HB3 LYS A 117 0.828 15.459 3.590 1.00 0.00 H new ATOM 0 HG2 LYS A 117 1.938 16.807 5.171 1.00 0.00 H new ATOM 0 HG3 LYS A 117 0.841 15.834 6.130 1.00 0.00 H new ATOM 0 HD2 LYS A 117 2.627 14.328 6.792 1.00 0.00 H new ATOM 0 HD3 LYS A 117 3.741 15.054 5.650 1.00 0.00 H new ATOM 0 HE2 LYS A 117 2.468 16.580 7.955 1.00 0.00 H new ATOM 0 HE3 LYS A 117 4.029 15.791 8.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 4.486 17.999 7.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 4.661 17.167 6.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 3.258 18.076 6.342 1.00 0.00 H new ATOM 1775 N ILE A 118 0.429 12.904 2.341 1.00 0.00 N ATOM 1776 CA ILE A 118 -0.342 12.489 1.176 1.00 0.00 C ATOM 1777 C ILE A 118 -1.428 11.490 1.563 1.00 0.00 C ATOM 1778 O ILE A 118 -2.578 11.610 1.139 1.00 0.00 O ATOM 1779 CB ILE A 118 0.560 11.858 0.099 1.00 0.00 C ATOM 1780 CG1 ILE A 118 1.571 12.885 -0.415 1.00 0.00 C ATOM 1781 CG2 ILE A 118 -0.282 11.316 -1.046 1.00 0.00 C ATOM 1782 CD1 ILE A 118 2.737 12.266 -1.154 1.00 0.00 C ATOM 0 H ILE A 118 1.434 12.973 2.179 1.00 0.00 H new ATOM 0 HA ILE A 118 -0.806 13.387 0.769 1.00 0.00 H new ATOM 0 HB ILE A 118 1.108 11.028 0.545 1.00 0.00 H new ATOM 0 HG12 ILE A 118 1.061 13.585 -1.077 1.00 0.00 H new ATOM 0 HG13 ILE A 118 1.951 13.463 0.428 1.00 0.00 H new ATOM 0 HG21 ILE A 118 0.370 10.873 -1.799 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -0.966 10.557 -0.667 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -0.854 12.129 -1.494 1.00 0.00 H new ATOM 0 HD11 ILE A 118 3.413 13.052 -1.490 1.00 0.00 H new ATOM 0 HD12 ILE A 118 3.271 11.588 -0.488 1.00 0.00 H new ATOM 0 HD13 ILE A 118 2.368 11.712 -2.017 1.00 0.00 H new ATOM 1794 N LEU A 119 -1.055 10.504 2.372 1.00 0.00 N ATOM 1795 CA LEU A 119 -1.997 9.483 2.818 1.00 0.00 C ATOM 1796 C LEU A 119 -3.168 10.113 3.565 1.00 0.00 C ATOM 1797 O LEU A 119 -4.308 9.662 3.448 1.00 0.00 O ATOM 1798 CB LEU A 119 -1.291 8.468 3.718 1.00 0.00 C ATOM 1799 CG LEU A 119 -0.213 7.614 3.049 1.00 0.00 C ATOM 1800 CD1 LEU A 119 0.773 7.093 4.083 1.00 0.00 C ATOM 1801 CD2 LEU A 119 -0.846 6.460 2.284 1.00 0.00 C ATOM 0 H LEU A 119 -0.108 10.390 2.732 1.00 0.00 H new ATOM 0 HA LEU A 119 -2.384 8.971 1.937 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -0.836 9.005 4.550 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -2.043 7.802 4.141 1.00 0.00 H new ATOM 0 HG LEU A 119 0.331 8.239 2.341 1.00 0.00 H new ATOM 0 HD11 LEU A 119 1.533 6.488 3.589 1.00 0.00 H new ATOM 0 HD12 LEU A 119 1.250 7.934 4.587 1.00 0.00 H new ATOM 0 HD13 LEU A 119 0.244 6.484 4.816 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -0.065 5.863 1.814 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -1.415 5.836 2.973 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -1.512 6.854 1.517 1.00 0.00 H new ATOM 1813 N LEU A 120 -2.881 11.160 4.331 1.00 0.00 N ATOM 1814 CA LEU A 120 -3.911 11.854 5.096 1.00 0.00 C ATOM 1815 C LEU A 120 -4.705 12.803 4.204 1.00 0.00 C ATOM 1816 O LEU A 120 -5.867 13.100 4.477 1.00 0.00 O ATOM 1817 CB LEU A 120 -3.279 12.632 6.251 1.00 0.00 C ATOM 1818 CG LEU A 120 -2.570 11.794 7.316 1.00 0.00 C ATOM 1819 CD1 LEU A 120 -1.827 12.691 8.294 1.00 0.00 C ATOM 1820 CD2 LEU A 120 -3.568 10.912 8.052 1.00 0.00 C ATOM 0 H LEU A 120 -1.943 11.547 4.439 1.00 0.00 H new ATOM 0 HA LEU A 120 -4.594 11.107 5.500 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -2.561 13.339 5.836 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -4.059 13.218 6.738 1.00 0.00 H new ATOM 0 HG LEU A 120 -1.843 11.151 6.820 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -1.329 12.077 9.044 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -1.084 13.280 7.756 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -2.535 13.360 8.784 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -3.046 10.323 8.806 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -4.319 11.537 8.536 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -4.055 10.243 7.342 1.00 0.00 H new ATOM 1832 N GLU A 121 -4.069 13.273 3.135 1.00 0.00 N ATOM 1833 CA GLU A 121 -4.718 14.187 2.202 1.00 0.00 C ATOM 1834 C GLU A 121 -5.620 13.427 1.234 1.00 0.00 C ATOM 1835 O GLU A 121 -6.639 13.946 0.778 1.00 0.00 O ATOM 1836 CB GLU A 121 -3.670 14.983 1.422 1.00 0.00 C ATOM 1837 CG GLU A 121 -3.055 16.123 2.217 1.00 0.00 C ATOM 1838 CD GLU A 121 -3.991 17.308 2.357 1.00 0.00 C ATOM 1839 OE1 GLU A 121 -5.054 17.153 2.994 1.00 0.00 O ATOM 1840 OE2 GLU A 121 -3.660 18.390 1.830 1.00 0.00 O ATOM 0 H GLU A 121 -3.107 13.036 2.894 1.00 0.00 H new ATOM 0 HA GLU A 121 -5.334 14.878 2.778 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -2.878 14.307 1.100 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -4.130 15.387 0.520 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -2.780 15.763 3.208 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -2.136 16.447 1.729 1.00 0.00 H new ATOM 1847 N LYS A 122 -5.237 12.193 0.923 1.00 0.00 N ATOM 1848 CA LYS A 122 -6.009 11.359 0.010 1.00 0.00 C ATOM 1849 C LYS A 122 -7.219 10.755 0.716 1.00 0.00 C ATOM 1850 O LYS A 122 -8.324 10.741 0.174 1.00 0.00 O ATOM 1851 CB LYS A 122 -5.130 10.244 -0.563 1.00 0.00 C ATOM 1852 CG LYS A 122 -4.101 10.736 -1.566 1.00 0.00 C ATOM 1853 CD LYS A 122 -4.736 11.037 -2.913 1.00 0.00 C ATOM 1854 CE LYS A 122 -3.789 11.815 -3.814 1.00 0.00 C ATOM 1855 NZ LYS A 122 -3.636 13.227 -3.369 1.00 0.00 N ATOM 0 H LYS A 122 -4.396 11.748 1.290 1.00 0.00 H new ATOM 0 HA LYS A 122 -6.363 11.989 -0.806 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -4.615 9.741 0.256 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -5.767 9.501 -1.043 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -3.617 11.634 -1.182 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -3.323 9.983 -1.690 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -5.019 10.104 -3.400 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -5.652 11.609 -2.765 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -2.813 11.329 -3.822 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -4.163 11.795 -4.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -3.169 13.778 -4.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -4.573 13.633 -3.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -3.059 13.258 -2.505 1.00 0.00 H new ATOM 1869 N LYS A 123 -7.003 10.257 1.929 1.00 0.00 N ATOM 1870 CA LYS A 123 -8.075 9.654 2.711 1.00 0.00 C ATOM 1871 C LYS A 123 -9.229 10.633 2.898 1.00 0.00 C ATOM 1872 O LYS A 123 -10.393 10.235 2.945 1.00 0.00 O ATOM 1873 CB LYS A 123 -7.548 9.203 4.075 1.00 0.00 C ATOM 1874 CG LYS A 123 -7.198 10.354 5.002 1.00 0.00 C ATOM 1875 CD LYS A 123 -6.821 9.859 6.388 1.00 0.00 C ATOM 1876 CE LYS A 123 -7.049 10.930 7.444 1.00 0.00 C ATOM 1877 NZ LYS A 123 -8.453 11.426 7.436 1.00 0.00 N ATOM 0 H LYS A 123 -6.094 10.259 2.392 1.00 0.00 H new ATOM 0 HA LYS A 123 -8.444 8.785 2.166 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -8.298 8.575 4.556 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -6.663 8.585 3.927 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -6.370 10.923 4.580 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -8.047 11.034 5.076 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -7.410 8.975 6.632 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -5.774 9.557 6.395 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -6.812 10.526 8.428 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -6.368 11.763 7.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -8.800 11.502 8.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -8.488 12.361 6.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -9.053 10.762 6.906 1.00 0.00 H new ATOM 1891 N ASP A 124 -8.899 11.916 3.004 1.00 0.00 N ATOM 1892 CA ASP A 124 -9.908 12.953 3.183 1.00 0.00 C ATOM 1893 C ASP A 124 -10.578 13.295 1.856 1.00 0.00 C ATOM 1894 O ASP A 124 -11.801 13.407 1.776 1.00 0.00 O ATOM 1895 CB ASP A 124 -9.279 14.208 3.790 1.00 0.00 C ATOM 1896 CG ASP A 124 -8.712 15.139 2.736 1.00 0.00 C ATOM 1897 OD1 ASP A 124 -9.503 15.683 1.937 1.00 0.00 O ATOM 1898 OD2 ASP A 124 -7.477 15.323 2.710 1.00 0.00 O ATOM 0 H ASP A 124 -7.940 12.262 2.969 1.00 0.00 H new ATOM 0 HA ASP A 124 -10.668 12.571 3.865 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -10.029 14.740 4.375 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -8.485 13.917 4.478 1.00 0.00 H new ATOM 1903 N ALA A 125 -9.767 13.462 0.816 1.00 0.00 N ATOM 1904 CA ALA A 125 -10.281 13.791 -0.508 1.00 0.00 C ATOM 1905 C ALA A 125 -11.229 12.709 -1.013 1.00 0.00 C ATOM 1906 O ALA A 125 -11.008 11.520 -0.783 1.00 0.00 O ATOM 1907 CB ALA A 125 -9.132 13.987 -1.486 1.00 0.00 C ATOM 0 H ALA A 125 -8.752 13.375 0.865 1.00 0.00 H new ATOM 0 HA ALA A 125 -10.842 14.722 -0.432 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -9.530 14.232 -2.471 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -8.494 14.800 -1.140 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -8.547 13.069 -1.549 1.00 0.00 H new TER 1913 ALA A 125