USER MOD reduce.3.24.130724 H: found=0, std=0, add=798, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 795 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 Single : A 1 GLY N :NH3+ 150:sc= 0.0497 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0213 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 14:sc= 0.786 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 GLN : amide:sc= -0.624 K(o=-0.62,f=0) USER MOD Single : A 17 ASN : amide:sc= -0.919 X(o=-0.92,f=-0.43) USER MOD Single : A 18 THR OG1 : rot 113:sc= -0.208 USER MOD Single : A 20 TYR OH : rot 180:sc= -1.54 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot 180:sc= -0.0421 USER MOD Single : A 35 SER OG : rot 180:sc= 0.079 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 MET CE :methyl -167:sc= 0 (180deg=-0.175) USER MOD Single : A 40 HIS : no HD1:sc= -5.87! C(o=-5.9!,f=-6.2!) USER MOD Single : A 54 SER OG : rot 180:sc= 0.0042 USER MOD Single : A 59 ASN : amide:sc= -5.21! C(o=-5.2!,f=-12!) USER MOD Single : A 60 CYS SG : rot -30:sc= 0.112 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 SER OG : rot 180:sc= -0.697 USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= -0.0577 X(o=-0.058,f=0) USER MOD Single : A 81 LYS NZ :NH3+ 178:sc= -1.12 (180deg=-1.19) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 25:sc= 0.357 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 17.035 8.689 -13.914 1.00 0.00 N ATOM 2 CA GLY A 1 15.891 9.574 -14.052 1.00 0.00 C ATOM 3 C GLY A 1 15.227 9.401 -15.419 1.00 0.00 C ATOM 4 O GLY A 1 15.879 9.007 -16.385 1.00 0.00 O ATOM 0 H1 GLY A 1 17.738 9.126 -13.285 1.00 0.00 H new ATOM 0 H2 GLY A 1 16.726 7.782 -13.510 1.00 0.00 H new ATOM 0 H3 GLY A 1 17.461 8.524 -14.848 1.00 0.00 H new ATOM 0 HA2 GLY A 1 15.168 9.366 -13.263 1.00 0.00 H new ATOM 0 HA3 GLY A 1 16.210 10.609 -13.927 1.00 0.00 H new ATOM 8 N SER A 2 13.938 9.705 -15.458 1.00 0.00 N ATOM 9 CA SER A 2 13.178 9.588 -16.691 1.00 0.00 C ATOM 10 C SER A 2 12.006 10.571 -16.678 1.00 0.00 C ATOM 11 O SER A 2 11.911 11.441 -17.543 1.00 0.00 O ATOM 12 CB SER A 2 12.669 8.159 -16.891 1.00 0.00 C ATOM 13 OG SER A 2 13.736 7.215 -16.946 1.00 0.00 O ATOM 0 H SER A 2 13.401 10.032 -14.655 1.00 0.00 H new ATOM 0 HA SER A 2 13.838 9.830 -17.524 1.00 0.00 H new ATOM 0 HB2 SER A 2 11.995 7.897 -16.076 1.00 0.00 H new ATOM 0 HB3 SER A 2 12.090 8.106 -17.813 1.00 0.00 H new ATOM 0 HG SER A 2 13.370 6.315 -17.073 1.00 0.00 H new ATOM 19 N SER A 3 11.142 10.401 -15.688 1.00 0.00 N ATOM 20 CA SER A 3 9.980 11.262 -15.552 1.00 0.00 C ATOM 21 C SER A 3 9.249 11.371 -16.891 1.00 0.00 C ATOM 22 O SER A 3 9.632 12.166 -17.749 1.00 0.00 O ATOM 23 CB SER A 3 10.380 12.652 -15.051 1.00 0.00 C ATOM 24 OG SER A 3 10.010 12.856 -13.691 1.00 0.00 O ATOM 0 H SER A 3 11.224 9.679 -14.972 1.00 0.00 H new ATOM 0 HA SER A 3 9.310 10.818 -14.815 1.00 0.00 H new ATOM 0 HB2 SER A 3 11.457 12.779 -15.157 1.00 0.00 H new ATOM 0 HB3 SER A 3 9.907 13.412 -15.673 1.00 0.00 H new ATOM 0 HG SER A 3 10.284 13.754 -13.409 1.00 0.00 H new ATOM 30 N GLY A 4 8.210 10.560 -17.030 1.00 0.00 N ATOM 31 CA GLY A 4 7.422 10.555 -18.250 1.00 0.00 C ATOM 32 C GLY A 4 5.977 10.139 -17.968 1.00 0.00 C ATOM 33 O GLY A 4 5.696 8.958 -17.766 1.00 0.00 O ATOM 0 H GLY A 4 7.896 9.902 -16.317 1.00 0.00 H new ATOM 0 HA2 GLY A 4 7.437 11.547 -18.701 1.00 0.00 H new ATOM 0 HA3 GLY A 4 7.867 9.870 -18.972 1.00 0.00 H new ATOM 37 N SER A 5 5.099 11.131 -17.964 1.00 0.00 N ATOM 38 CA SER A 5 3.690 10.882 -17.710 1.00 0.00 C ATOM 39 C SER A 5 3.530 9.988 -16.479 1.00 0.00 C ATOM 40 O SER A 5 3.607 8.764 -16.582 1.00 0.00 O ATOM 41 CB SER A 5 3.017 10.239 -18.925 1.00 0.00 C ATOM 42 OG SER A 5 2.178 11.159 -19.619 1.00 0.00 O ATOM 0 H SER A 5 5.336 12.109 -18.133 1.00 0.00 H new ATOM 0 HA SER A 5 3.202 11.838 -17.522 1.00 0.00 H new ATOM 0 HB2 SER A 5 3.781 9.861 -19.605 1.00 0.00 H new ATOM 0 HB3 SER A 5 2.426 9.382 -18.601 1.00 0.00 H new ATOM 0 HG SER A 5 1.768 10.712 -20.389 1.00 0.00 H new ATOM 48 N SER A 6 3.310 10.633 -15.343 1.00 0.00 N ATOM 49 CA SER A 6 3.138 9.911 -14.094 1.00 0.00 C ATOM 50 C SER A 6 4.209 8.826 -13.965 1.00 0.00 C ATOM 51 O SER A 6 3.897 7.636 -13.973 1.00 0.00 O ATOM 52 CB SER A 6 1.742 9.292 -14.003 1.00 0.00 C ATOM 53 OG SER A 6 1.512 8.339 -15.038 1.00 0.00 O ATOM 0 H SER A 6 3.247 11.648 -15.261 1.00 0.00 H new ATOM 0 HA SER A 6 3.246 10.619 -13.272 1.00 0.00 H new ATOM 0 HB2 SER A 6 1.622 8.810 -13.033 1.00 0.00 H new ATOM 0 HB3 SER A 6 0.991 10.080 -14.062 1.00 0.00 H new ATOM 0 HG SER A 6 2.363 8.112 -15.468 1.00 0.00 H new ATOM 59 N GLY A 7 5.450 9.275 -13.850 1.00 0.00 N ATOM 60 CA GLY A 7 6.569 8.358 -13.719 1.00 0.00 C ATOM 61 C GLY A 7 6.507 7.602 -12.390 1.00 0.00 C ATOM 62 O GLY A 7 7.287 6.679 -12.160 1.00 0.00 O ATOM 0 H GLY A 7 5.705 10.263 -13.845 1.00 0.00 H new ATOM 0 HA2 GLY A 7 6.560 7.648 -14.546 1.00 0.00 H new ATOM 0 HA3 GLY A 7 7.506 8.911 -13.783 1.00 0.00 H new ATOM 66 N LEU A 8 5.571 8.022 -11.551 1.00 0.00 N ATOM 67 CA LEU A 8 5.397 7.396 -10.251 1.00 0.00 C ATOM 68 C LEU A 8 5.120 5.903 -10.442 1.00 0.00 C ATOM 69 O LEU A 8 5.719 5.067 -9.768 1.00 0.00 O ATOM 70 CB LEU A 8 4.317 8.123 -9.447 1.00 0.00 C ATOM 71 CG LEU A 8 4.439 9.647 -9.386 1.00 0.00 C ATOM 72 CD1 LEU A 8 3.233 10.266 -8.677 1.00 0.00 C ATOM 73 CD2 LEU A 8 5.761 10.066 -8.738 1.00 0.00 C ATOM 0 H LEU A 8 4.926 8.788 -11.746 1.00 0.00 H new ATOM 0 HA LEU A 8 6.311 7.479 -9.663 1.00 0.00 H new ATOM 0 HB2 LEU A 8 3.345 7.873 -9.872 1.00 0.00 H new ATOM 0 HB3 LEU A 8 4.328 7.736 -8.428 1.00 0.00 H new ATOM 0 HG LEU A 8 4.444 10.030 -10.407 1.00 0.00 H new ATOM 0 HD11 LEU A 8 3.345 11.350 -8.647 1.00 0.00 H new ATOM 0 HD12 LEU A 8 2.322 10.010 -9.218 1.00 0.00 H new ATOM 0 HD13 LEU A 8 3.171 9.880 -7.660 1.00 0.00 H new ATOM 0 HD21 LEU A 8 5.822 11.154 -8.707 1.00 0.00 H new ATOM 0 HD22 LEU A 8 5.810 9.671 -7.723 1.00 0.00 H new ATOM 0 HD23 LEU A 8 6.593 9.672 -9.322 1.00 0.00 H new ATOM 85 N ARG A 9 4.213 5.615 -11.363 1.00 0.00 N ATOM 86 CA ARG A 9 3.850 4.237 -11.650 1.00 0.00 C ATOM 87 C ARG A 9 5.086 3.338 -11.584 1.00 0.00 C ATOM 88 O ARG A 9 5.119 2.378 -10.816 1.00 0.00 O ATOM 89 CB ARG A 9 3.211 4.114 -13.035 1.00 0.00 C ATOM 90 CG ARG A 9 1.955 4.981 -13.139 1.00 0.00 C ATOM 91 CD ARG A 9 0.999 4.437 -14.203 1.00 0.00 C ATOM 92 NE ARG A 9 1.229 5.128 -15.491 1.00 0.00 N ATOM 93 CZ ARG A 9 0.347 5.150 -16.499 1.00 0.00 C ATOM 94 NH1 ARG A 9 -0.829 4.520 -16.375 1.00 0.00 N ATOM 95 NH2 ARG A 9 0.640 5.803 -17.632 1.00 0.00 N ATOM 0 H ARG A 9 3.718 6.312 -11.920 1.00 0.00 H new ATOM 0 HA ARG A 9 3.126 3.921 -10.899 1.00 0.00 H new ATOM 0 HB2 ARG A 9 3.929 4.414 -13.798 1.00 0.00 H new ATOM 0 HB3 ARG A 9 2.955 3.073 -13.230 1.00 0.00 H new ATOM 0 HG2 ARG A 9 1.450 5.013 -12.174 1.00 0.00 H new ATOM 0 HG3 ARG A 9 2.235 6.005 -13.386 1.00 0.00 H new ATOM 0 HD2 ARG A 9 1.149 3.364 -14.324 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -0.033 4.580 -13.883 1.00 0.00 H new ATOM 0 HE ARG A 9 2.114 5.618 -15.619 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -1.053 4.023 -15.513 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -1.500 4.537 -17.143 1.00 0.00 H new ATOM 0 HH21 ARG A 9 1.535 6.283 -17.727 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -0.032 5.820 -18.399 1.00 0.00 H new ATOM 109 N LYS A 10 6.072 3.680 -12.400 1.00 0.00 N ATOM 110 CA LYS A 10 7.307 2.916 -12.444 1.00 0.00 C ATOM 111 C LYS A 10 7.907 2.844 -11.038 1.00 0.00 C ATOM 112 O LYS A 10 8.317 1.775 -10.588 1.00 0.00 O ATOM 113 CB LYS A 10 8.260 3.496 -13.490 1.00 0.00 C ATOM 114 CG LYS A 10 7.663 3.388 -14.895 1.00 0.00 C ATOM 115 CD LYS A 10 7.727 1.949 -15.409 1.00 0.00 C ATOM 116 CE LYS A 10 9.153 1.577 -15.821 1.00 0.00 C ATOM 117 NZ LYS A 10 9.326 1.725 -17.283 1.00 0.00 N ATOM 0 H LYS A 10 6.041 4.477 -13.036 1.00 0.00 H new ATOM 0 HA LYS A 10 7.110 1.892 -12.760 1.00 0.00 H new ATOM 0 HB2 LYS A 10 8.468 4.541 -13.258 1.00 0.00 H new ATOM 0 HB3 LYS A 10 9.212 2.966 -13.454 1.00 0.00 H new ATOM 0 HG2 LYS A 10 6.627 3.727 -14.881 1.00 0.00 H new ATOM 0 HG3 LYS A 10 8.204 4.045 -15.575 1.00 0.00 H new ATOM 0 HD2 LYS A 10 7.379 1.266 -14.634 1.00 0.00 H new ATOM 0 HD3 LYS A 10 7.057 1.833 -16.261 1.00 0.00 H new ATOM 0 HE2 LYS A 10 9.867 2.214 -15.298 1.00 0.00 H new ATOM 0 HE3 LYS A 10 9.367 0.550 -15.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 10.299 1.469 -17.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 8.658 1.099 -17.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 9.143 2.712 -17.556 1.00 0.00 H new ATOM 131 N GLN A 11 7.941 3.996 -10.384 1.00 0.00 N ATOM 132 CA GLN A 11 8.484 4.077 -9.039 1.00 0.00 C ATOM 133 C GLN A 11 7.699 3.166 -8.093 1.00 0.00 C ATOM 134 O GLN A 11 8.277 2.301 -7.437 1.00 0.00 O ATOM 135 CB GLN A 11 8.484 5.521 -8.534 1.00 0.00 C ATOM 136 CG GLN A 11 9.003 6.478 -9.609 1.00 0.00 C ATOM 137 CD GLN A 11 9.831 7.605 -8.988 1.00 0.00 C ATOM 138 OE1 GLN A 11 10.939 7.409 -8.516 1.00 0.00 O ATOM 139 NE2 GLN A 11 9.233 8.793 -9.013 1.00 0.00 N ATOM 0 H GLN A 11 7.601 4.881 -10.761 1.00 0.00 H new ATOM 0 HA GLN A 11 9.519 3.735 -9.065 1.00 0.00 H new ATOM 0 HB2 GLN A 11 7.473 5.808 -8.243 1.00 0.00 H new ATOM 0 HB3 GLN A 11 9.106 5.598 -7.642 1.00 0.00 H new ATOM 0 HG2 GLN A 11 9.612 5.928 -10.327 1.00 0.00 H new ATOM 0 HG3 GLN A 11 8.163 6.901 -10.161 1.00 0.00 H new ATOM 0 HE21 GLN A 11 8.304 8.888 -9.423 1.00 0.00 H new ATOM 0 HE22 GLN A 11 9.703 9.609 -8.622 1.00 0.00 H new ATOM 148 N VAL A 12 6.394 3.391 -8.054 1.00 0.00 N ATOM 149 CA VAL A 12 5.524 2.601 -7.199 1.00 0.00 C ATOM 150 C VAL A 12 5.837 1.116 -7.393 1.00 0.00 C ATOM 151 O VAL A 12 6.117 0.406 -6.429 1.00 0.00 O ATOM 152 CB VAL A 12 4.060 2.946 -7.482 1.00 0.00 C ATOM 153 CG1 VAL A 12 3.120 2.069 -6.651 1.00 0.00 C ATOM 154 CG2 VAL A 12 3.788 4.431 -7.232 1.00 0.00 C ATOM 0 H VAL A 12 5.918 4.109 -8.600 1.00 0.00 H new ATOM 0 HA VAL A 12 5.703 2.836 -6.150 1.00 0.00 H new ATOM 0 HB VAL A 12 3.865 2.743 -8.535 1.00 0.00 H new ATOM 0 HG11 VAL A 12 2.086 2.334 -6.871 1.00 0.00 H new ATOM 0 HG12 VAL A 12 3.286 1.021 -6.899 1.00 0.00 H new ATOM 0 HG13 VAL A 12 3.318 2.227 -5.591 1.00 0.00 H new ATOM 0 HG21 VAL A 12 2.741 4.649 -7.441 1.00 0.00 H new ATOM 0 HG22 VAL A 12 4.009 4.671 -6.192 1.00 0.00 H new ATOM 0 HG23 VAL A 12 4.421 5.032 -7.885 1.00 0.00 H new ATOM 164 N GLU A 13 5.778 0.691 -8.647 1.00 0.00 N ATOM 165 CA GLU A 13 6.052 -0.696 -8.980 1.00 0.00 C ATOM 166 C GLU A 13 7.264 -1.202 -8.194 1.00 0.00 C ATOM 167 O GLU A 13 7.185 -2.226 -7.517 1.00 0.00 O ATOM 168 CB GLU A 13 6.265 -0.867 -10.485 1.00 0.00 C ATOM 169 CG GLU A 13 5.011 -0.469 -11.265 1.00 0.00 C ATOM 170 CD GLU A 13 4.569 -1.593 -12.204 1.00 0.00 C ATOM 171 OE1 GLU A 13 4.123 -2.633 -11.674 1.00 0.00 O ATOM 172 OE2 GLU A 13 4.686 -1.387 -13.432 1.00 0.00 O ATOM 0 H GLU A 13 5.544 1.283 -9.444 1.00 0.00 H new ATOM 0 HA GLU A 13 5.185 -1.294 -8.699 1.00 0.00 H new ATOM 0 HB2 GLU A 13 7.108 -0.256 -10.808 1.00 0.00 H new ATOM 0 HB3 GLU A 13 6.520 -1.904 -10.704 1.00 0.00 H new ATOM 0 HG2 GLU A 13 4.205 -0.234 -10.570 1.00 0.00 H new ATOM 0 HG3 GLU A 13 5.209 0.435 -11.842 1.00 0.00 H new ATOM 179 N LEU A 14 8.356 -0.461 -8.310 1.00 0.00 N ATOM 180 CA LEU A 14 9.582 -0.821 -7.619 1.00 0.00 C ATOM 181 C LEU A 14 9.301 -0.938 -6.120 1.00 0.00 C ATOM 182 O LEU A 14 9.716 -1.904 -5.481 1.00 0.00 O ATOM 183 CB LEU A 14 10.699 0.167 -7.960 1.00 0.00 C ATOM 184 CG LEU A 14 12.086 -0.173 -7.410 1.00 0.00 C ATOM 185 CD1 LEU A 14 12.525 -1.570 -7.855 1.00 0.00 C ATOM 186 CD2 LEU A 14 13.107 0.899 -7.797 1.00 0.00 C ATOM 0 H LEU A 14 8.417 0.388 -8.873 1.00 0.00 H new ATOM 0 HA LEU A 14 9.937 -1.795 -7.955 1.00 0.00 H new ATOM 0 HB2 LEU A 14 10.769 0.245 -9.045 1.00 0.00 H new ATOM 0 HB3 LEU A 14 10.413 1.151 -7.587 1.00 0.00 H new ATOM 0 HG LEU A 14 12.028 -0.185 -6.322 1.00 0.00 H new ATOM 0 HD11 LEU A 14 13.514 -1.787 -7.451 1.00 0.00 H new ATOM 0 HD12 LEU A 14 11.813 -2.309 -7.488 1.00 0.00 H new ATOM 0 HD13 LEU A 14 12.561 -1.610 -8.944 1.00 0.00 H new ATOM 0 HD21 LEU A 14 14.084 0.633 -7.394 1.00 0.00 H new ATOM 0 HD22 LEU A 14 13.169 0.967 -8.883 1.00 0.00 H new ATOM 0 HD23 LEU A 14 12.796 1.861 -7.390 1.00 0.00 H new ATOM 198 N LEU A 15 8.599 0.059 -5.602 1.00 0.00 N ATOM 199 CA LEU A 15 8.258 0.079 -4.189 1.00 0.00 C ATOM 200 C LEU A 15 7.512 -1.207 -3.830 1.00 0.00 C ATOM 201 O LEU A 15 7.989 -2.001 -3.021 1.00 0.00 O ATOM 202 CB LEU A 15 7.487 1.355 -3.843 1.00 0.00 C ATOM 203 CG LEU A 15 6.846 1.394 -2.454 1.00 0.00 C ATOM 204 CD1 LEU A 15 7.903 1.255 -1.357 1.00 0.00 C ATOM 205 CD2 LEU A 15 5.999 2.656 -2.277 1.00 0.00 C ATOM 0 H LEU A 15 8.257 0.859 -6.135 1.00 0.00 H new ATOM 0 HA LEU A 15 9.161 0.104 -3.579 1.00 0.00 H new ATOM 0 HB2 LEU A 15 8.167 2.202 -3.932 1.00 0.00 H new ATOM 0 HB3 LEU A 15 6.703 1.496 -4.587 1.00 0.00 H new ATOM 0 HG LEU A 15 6.175 0.540 -2.364 1.00 0.00 H new ATOM 0 HD11 LEU A 15 7.420 1.286 -0.380 1.00 0.00 H new ATOM 0 HD12 LEU A 15 8.426 0.306 -1.473 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.618 2.074 -1.434 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.555 2.659 -1.282 1.00 0.00 H new ATOM 0 HD22 LEU A 15 6.630 3.537 -2.396 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.208 2.672 -3.027 1.00 0.00 H new ATOM 217 N PHE A 16 6.353 -1.374 -4.450 1.00 0.00 N ATOM 218 CA PHE A 16 5.536 -2.550 -4.207 1.00 0.00 C ATOM 219 C PHE A 16 6.326 -3.832 -4.475 1.00 0.00 C ATOM 220 O PHE A 16 6.423 -4.699 -3.607 1.00 0.00 O ATOM 221 CB PHE A 16 4.353 -2.482 -5.175 1.00 0.00 C ATOM 222 CG PHE A 16 3.301 -1.437 -4.801 1.00 0.00 C ATOM 223 CD1 PHE A 16 3.508 -0.614 -3.738 1.00 0.00 C ATOM 224 CD2 PHE A 16 2.158 -1.331 -5.530 1.00 0.00 C ATOM 225 CE1 PHE A 16 2.532 0.357 -3.391 1.00 0.00 C ATOM 226 CE2 PHE A 16 1.181 -0.360 -5.183 1.00 0.00 C ATOM 227 CZ PHE A 16 1.389 0.463 -4.120 1.00 0.00 C ATOM 0 H PHE A 16 5.960 -0.714 -5.121 1.00 0.00 H new ATOM 0 HA PHE A 16 5.210 -2.567 -3.167 1.00 0.00 H new ATOM 0 HB2 PHE A 16 4.727 -2.263 -6.175 1.00 0.00 H new ATOM 0 HB3 PHE A 16 3.877 -3.462 -5.220 1.00 0.00 H new ATOM 0 HD1 PHE A 16 4.415 -0.699 -3.158 1.00 0.00 H new ATOM 0 HD2 PHE A 16 1.993 -1.985 -6.373 1.00 0.00 H new ATOM 0 HE1 PHE A 16 2.697 1.011 -2.548 1.00 0.00 H new ATOM 0 HE2 PHE A 16 0.274 -0.275 -5.763 1.00 0.00 H new ATOM 0 HZ PHE A 16 0.646 1.201 -3.855 1.00 0.00 H new ATOM 237 N ASN A 17 6.873 -3.912 -5.679 1.00 0.00 N ATOM 238 CA ASN A 17 7.652 -5.073 -6.072 1.00 0.00 C ATOM 239 C ASN A 17 8.748 -5.322 -5.034 1.00 0.00 C ATOM 240 O ASN A 17 8.912 -6.444 -4.556 1.00 0.00 O ATOM 241 CB ASN A 17 8.327 -4.851 -7.427 1.00 0.00 C ATOM 242 CG ASN A 17 7.334 -5.054 -8.574 1.00 0.00 C ATOM 243 OD1 ASN A 17 6.303 -4.409 -8.658 1.00 0.00 O ATOM 244 ND2 ASN A 17 7.703 -5.986 -9.449 1.00 0.00 N ATOM 0 H ASN A 17 6.792 -3.191 -6.396 1.00 0.00 H new ATOM 0 HA ASN A 17 6.975 -5.925 -6.141 1.00 0.00 H new ATOM 0 HB2 ASN A 17 8.738 -3.843 -7.472 1.00 0.00 H new ATOM 0 HB3 ASN A 17 9.163 -5.542 -7.538 1.00 0.00 H new ATOM 0 HD21 ASN A 17 7.108 -6.197 -10.250 1.00 0.00 H new ATOM 0 HD22 ASN A 17 8.581 -6.489 -9.318 1.00 0.00 H new ATOM 251 N THR A 18 9.469 -4.257 -4.715 1.00 0.00 N ATOM 252 CA THR A 18 10.545 -4.346 -3.742 1.00 0.00 C ATOM 253 C THR A 18 10.010 -4.855 -2.402 1.00 0.00 C ATOM 254 O THR A 18 10.471 -5.877 -1.893 1.00 0.00 O ATOM 255 CB THR A 18 11.212 -2.973 -3.648 1.00 0.00 C ATOM 256 OG1 THR A 18 11.871 -2.820 -4.902 1.00 0.00 O ATOM 257 CG2 THR A 18 12.348 -2.943 -2.623 1.00 0.00 C ATOM 0 H THR A 18 9.329 -3.328 -5.113 1.00 0.00 H new ATOM 0 HA THR A 18 11.300 -5.069 -4.051 1.00 0.00 H new ATOM 0 HB THR A 18 10.465 -2.224 -3.384 1.00 0.00 H new ATOM 0 HG1 THR A 18 11.438 -2.105 -5.414 1.00 0.00 H new ATOM 0 HG21 THR A 18 12.787 -1.946 -2.596 1.00 0.00 H new ATOM 0 HG22 THR A 18 11.956 -3.194 -1.637 1.00 0.00 H new ATOM 0 HG23 THR A 18 13.111 -3.668 -2.905 1.00 0.00 H new ATOM 265 N ARG A 19 9.046 -4.120 -1.867 1.00 0.00 N ATOM 266 CA ARG A 19 8.444 -4.484 -0.596 1.00 0.00 C ATOM 267 C ARG A 19 8.111 -5.978 -0.575 1.00 0.00 C ATOM 268 O ARG A 19 8.441 -6.677 0.381 1.00 0.00 O ATOM 269 CB ARG A 19 7.168 -3.680 -0.340 1.00 0.00 C ATOM 270 CG ARG A 19 7.490 -2.204 -0.096 1.00 0.00 C ATOM 271 CD ARG A 19 8.066 -1.993 1.305 1.00 0.00 C ATOM 272 NE ARG A 19 9.050 -0.888 1.286 1.00 0.00 N ATOM 273 CZ ARG A 19 9.808 -0.539 2.334 1.00 0.00 C ATOM 274 NH1 ARG A 19 9.701 -1.207 3.491 1.00 0.00 N ATOM 275 NH2 ARG A 19 10.674 0.478 2.226 1.00 0.00 N ATOM 0 H ARG A 19 8.667 -3.273 -2.291 1.00 0.00 H new ATOM 0 HA ARG A 19 9.165 -4.258 0.189 1.00 0.00 H new ATOM 0 HB2 ARG A 19 6.498 -3.773 -1.194 1.00 0.00 H new ATOM 0 HB3 ARG A 19 6.643 -4.089 0.523 1.00 0.00 H new ATOM 0 HG2 ARG A 19 8.204 -1.856 -0.843 1.00 0.00 H new ATOM 0 HG3 ARG A 19 6.586 -1.606 -0.215 1.00 0.00 H new ATOM 0 HD2 ARG A 19 7.264 -1.765 2.006 1.00 0.00 H new ATOM 0 HD3 ARG A 19 8.542 -2.909 1.653 1.00 0.00 H new ATOM 0 HE ARG A 19 9.158 -0.359 0.421 1.00 0.00 H new ATOM 0 HH11 ARG A 19 9.042 -1.981 3.574 1.00 0.00 H new ATOM 0 HH12 ARG A 19 10.278 -0.941 4.289 1.00 0.00 H new ATOM 0 HH21 ARG A 19 10.756 0.987 1.346 1.00 0.00 H new ATOM 0 HH22 ARG A 19 11.251 0.743 3.024 1.00 0.00 H new ATOM 289 N TYR A 20 7.461 -6.421 -1.641 1.00 0.00 N ATOM 290 CA TYR A 20 7.079 -7.819 -1.757 1.00 0.00 C ATOM 291 C TYR A 20 8.270 -8.737 -1.475 1.00 0.00 C ATOM 292 O TYR A 20 8.144 -9.714 -0.739 1.00 0.00 O ATOM 293 CB TYR A 20 6.631 -8.014 -3.206 1.00 0.00 C ATOM 294 CG TYR A 20 5.897 -9.333 -3.458 1.00 0.00 C ATOM 295 CD1 TYR A 20 4.767 -9.644 -2.729 1.00 0.00 C ATOM 296 CD2 TYR A 20 6.365 -10.212 -4.414 1.00 0.00 C ATOM 297 CE1 TYR A 20 4.077 -10.886 -2.966 1.00 0.00 C ATOM 298 CE2 TYR A 20 5.675 -11.453 -4.651 1.00 0.00 C ATOM 299 CZ TYR A 20 4.565 -11.729 -3.915 1.00 0.00 C ATOM 300 OH TYR A 20 3.913 -12.901 -4.139 1.00 0.00 O ATOM 0 H TYR A 20 7.189 -5.837 -2.432 1.00 0.00 H new ATOM 0 HA TYR A 20 6.295 -8.064 -1.041 1.00 0.00 H new ATOM 0 HB2 TYR A 20 5.979 -7.187 -3.488 1.00 0.00 H new ATOM 0 HB3 TYR A 20 7.505 -7.967 -3.855 1.00 0.00 H new ATOM 0 HD1 TYR A 20 4.400 -8.956 -1.981 1.00 0.00 H new ATOM 0 HD2 TYR A 20 7.249 -9.969 -4.984 1.00 0.00 H new ATOM 0 HE1 TYR A 20 3.192 -11.142 -2.403 1.00 0.00 H new ATOM 0 HE2 TYR A 20 6.031 -12.149 -5.396 1.00 0.00 H new ATOM 0 HH TYR A 20 4.373 -13.402 -4.845 1.00 0.00 H new ATOM 310 N ALA A 21 9.399 -8.391 -2.077 1.00 0.00 N ATOM 311 CA ALA A 21 10.611 -9.172 -1.900 1.00 0.00 C ATOM 312 C ALA A 21 10.820 -9.451 -0.410 1.00 0.00 C ATOM 313 O ALA A 21 11.046 -10.594 -0.015 1.00 0.00 O ATOM 314 CB ALA A 21 11.793 -8.430 -2.526 1.00 0.00 C ATOM 0 H ALA A 21 9.499 -7.580 -2.688 1.00 0.00 H new ATOM 0 HA ALA A 21 10.525 -10.133 -2.406 1.00 0.00 H new ATOM 0 HB1 ALA A 21 12.702 -9.016 -2.393 1.00 0.00 H new ATOM 0 HB2 ALA A 21 11.608 -8.283 -3.590 1.00 0.00 H new ATOM 0 HB3 ALA A 21 11.912 -7.461 -2.042 1.00 0.00 H new ATOM 320 N LYS A 22 10.738 -8.388 0.375 1.00 0.00 N ATOM 321 CA LYS A 22 10.916 -8.504 1.813 1.00 0.00 C ATOM 322 C LYS A 22 9.876 -9.476 2.374 1.00 0.00 C ATOM 323 O LYS A 22 10.120 -10.138 3.382 1.00 0.00 O ATOM 324 CB LYS A 22 10.883 -7.122 2.470 1.00 0.00 C ATOM 325 CG LYS A 22 11.382 -7.191 3.915 1.00 0.00 C ATOM 326 CD LYS A 22 11.515 -5.790 4.516 1.00 0.00 C ATOM 327 CE LYS A 22 12.307 -5.827 5.824 1.00 0.00 C ATOM 328 NZ LYS A 22 11.407 -5.616 6.981 1.00 0.00 N ATOM 0 H LYS A 22 10.551 -7.442 0.043 1.00 0.00 H new ATOM 0 HA LYS A 22 11.898 -8.918 2.043 1.00 0.00 H new ATOM 0 HB2 LYS A 22 11.502 -6.429 1.900 1.00 0.00 H new ATOM 0 HB3 LYS A 22 9.866 -6.730 2.451 1.00 0.00 H new ATOM 0 HG2 LYS A 22 10.691 -7.784 4.514 1.00 0.00 H new ATOM 0 HG3 LYS A 22 12.347 -7.697 3.947 1.00 0.00 H new ATOM 0 HD2 LYS A 22 12.012 -5.131 3.804 1.00 0.00 H new ATOM 0 HD3 LYS A 22 10.524 -5.373 4.698 1.00 0.00 H new ATOM 0 HE2 LYS A 22 12.815 -6.786 5.921 1.00 0.00 H new ATOM 0 HE3 LYS A 22 13.079 -5.057 5.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 11.961 -5.644 7.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 10.941 -4.690 6.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 10.686 -6.365 7.001 1.00 0.00 H new ATOM 342 N ALA A 23 8.739 -9.533 1.696 1.00 0.00 N ATOM 343 CA ALA A 23 7.662 -10.413 2.115 1.00 0.00 C ATOM 344 C ALA A 23 8.024 -11.858 1.764 1.00 0.00 C ATOM 345 O ALA A 23 7.409 -12.796 2.268 1.00 0.00 O ATOM 346 CB ALA A 23 6.353 -9.965 1.461 1.00 0.00 C ATOM 0 H ALA A 23 8.541 -8.984 0.860 1.00 0.00 H new ATOM 0 HA ALA A 23 7.522 -10.361 3.195 1.00 0.00 H new ATOM 0 HB1 ALA A 23 5.545 -10.625 1.775 1.00 0.00 H new ATOM 0 HB2 ALA A 23 6.126 -8.943 1.765 1.00 0.00 H new ATOM 0 HB3 ALA A 23 6.455 -10.007 0.377 1.00 0.00 H new ATOM 352 N ILE A 24 9.021 -11.991 0.901 1.00 0.00 N ATOM 353 CA ILE A 24 9.473 -13.305 0.476 1.00 0.00 C ATOM 354 C ILE A 24 10.941 -13.485 0.866 1.00 0.00 C ATOM 355 O ILE A 24 11.552 -14.503 0.543 1.00 0.00 O ATOM 356 CB ILE A 24 9.203 -13.508 -1.016 1.00 0.00 C ATOM 357 CG1 ILE A 24 9.749 -12.338 -1.836 1.00 0.00 C ATOM 358 CG2 ILE A 24 7.714 -13.745 -1.276 1.00 0.00 C ATOM 359 CD1 ILE A 24 9.682 -12.640 -3.335 1.00 0.00 C ATOM 0 H ILE A 24 9.528 -11.210 0.485 1.00 0.00 H new ATOM 0 HA ILE A 24 8.909 -14.086 0.987 1.00 0.00 H new ATOM 0 HB ILE A 24 9.733 -14.403 -1.341 1.00 0.00 H new ATOM 0 HG12 ILE A 24 9.176 -11.437 -1.617 1.00 0.00 H new ATOM 0 HG13 ILE A 24 10.781 -12.137 -1.548 1.00 0.00 H new ATOM 0 HG21 ILE A 24 7.549 -13.886 -2.344 1.00 0.00 H new ATOM 0 HG22 ILE A 24 7.388 -14.635 -0.738 1.00 0.00 H new ATOM 0 HG23 ILE A 24 7.143 -12.883 -0.932 1.00 0.00 H new ATOM 0 HD11 ILE A 24 10.076 -11.792 -3.895 1.00 0.00 H new ATOM 0 HD12 ILE A 24 10.276 -13.527 -3.554 1.00 0.00 H new ATOM 0 HD13 ILE A 24 8.646 -12.816 -3.625 1.00 0.00 H new ATOM 371 N GLY A 25 11.465 -12.482 1.554 1.00 0.00 N ATOM 372 CA GLY A 25 12.851 -12.517 1.991 1.00 0.00 C ATOM 373 C GLY A 25 13.803 -12.319 0.810 1.00 0.00 C ATOM 374 O GLY A 25 14.918 -12.839 0.813 1.00 0.00 O ATOM 0 H GLY A 25 10.955 -11.640 1.820 1.00 0.00 H new ATOM 0 HA2 GLY A 25 13.021 -11.738 2.735 1.00 0.00 H new ATOM 0 HA3 GLY A 25 13.060 -13.471 2.475 1.00 0.00 H new ATOM 378 N ILE A 26 13.329 -11.566 -0.172 1.00 0.00 N ATOM 379 CA ILE A 26 14.124 -11.294 -1.357 1.00 0.00 C ATOM 380 C ILE A 26 14.683 -9.872 -1.275 1.00 0.00 C ATOM 381 O ILE A 26 14.029 -8.974 -0.747 1.00 0.00 O ATOM 382 CB ILE A 26 13.308 -11.562 -2.623 1.00 0.00 C ATOM 383 CG1 ILE A 26 13.067 -13.061 -2.813 1.00 0.00 C ATOM 384 CG2 ILE A 26 13.972 -10.928 -3.847 1.00 0.00 C ATOM 385 CD1 ILE A 26 12.909 -13.407 -4.295 1.00 0.00 C ATOM 0 H ILE A 26 12.404 -11.136 -0.171 1.00 0.00 H new ATOM 0 HA ILE A 26 14.977 -11.970 -1.407 1.00 0.00 H new ATOM 0 HB ILE A 26 12.332 -11.092 -2.507 1.00 0.00 H new ATOM 0 HG12 ILE A 26 13.900 -13.623 -2.391 1.00 0.00 H new ATOM 0 HG13 ILE A 26 12.172 -13.361 -2.268 1.00 0.00 H new ATOM 0 HG21 ILE A 26 13.372 -11.133 -4.734 1.00 0.00 H new ATOM 0 HG22 ILE A 26 14.049 -9.850 -3.702 1.00 0.00 H new ATOM 0 HG23 ILE A 26 14.969 -11.348 -3.978 1.00 0.00 H new ATOM 0 HD11 ILE A 26 12.739 -14.478 -4.402 1.00 0.00 H new ATOM 0 HD12 ILE A 26 12.060 -12.862 -4.707 1.00 0.00 H new ATOM 0 HD13 ILE A 26 13.815 -13.128 -4.832 1.00 0.00 H new ATOM 397 N SER A 27 15.887 -9.712 -1.804 1.00 0.00 N ATOM 398 CA SER A 27 16.541 -8.415 -1.797 1.00 0.00 C ATOM 399 C SER A 27 16.083 -7.591 -3.002 1.00 0.00 C ATOM 400 O SER A 27 15.878 -6.383 -2.891 1.00 0.00 O ATOM 401 CB SER A 27 18.064 -8.565 -1.806 1.00 0.00 C ATOM 402 OG SER A 27 18.643 -8.212 -0.553 1.00 0.00 O ATOM 0 H SER A 27 16.427 -10.459 -2.240 1.00 0.00 H new ATOM 0 HA SER A 27 16.259 -7.896 -0.881 1.00 0.00 H new ATOM 0 HB2 SER A 27 18.325 -9.595 -2.049 1.00 0.00 H new ATOM 0 HB3 SER A 27 18.486 -7.936 -2.590 1.00 0.00 H new ATOM 0 HG SER A 27 19.616 -8.323 -0.599 1.00 0.00 H new ATOM 408 N GLU A 28 15.935 -8.277 -4.126 1.00 0.00 N ATOM 409 CA GLU A 28 15.504 -7.624 -5.350 1.00 0.00 C ATOM 410 C GLU A 28 13.978 -7.527 -5.392 1.00 0.00 C ATOM 411 O GLU A 28 13.287 -8.223 -4.649 1.00 0.00 O ATOM 412 CB GLU A 28 16.040 -8.358 -6.581 1.00 0.00 C ATOM 413 CG GLU A 28 15.143 -9.542 -6.948 1.00 0.00 C ATOM 414 CD GLU A 28 15.636 -10.228 -8.223 1.00 0.00 C ATOM 415 OE1 GLU A 28 16.860 -10.470 -8.301 1.00 0.00 O ATOM 416 OE2 GLU A 28 14.778 -10.496 -9.092 1.00 0.00 O ATOM 0 H GLU A 28 16.106 -9.279 -4.214 1.00 0.00 H new ATOM 0 HA GLU A 28 15.913 -6.614 -5.362 1.00 0.00 H new ATOM 0 HB2 GLU A 28 16.100 -7.668 -7.423 1.00 0.00 H new ATOM 0 HB3 GLU A 28 17.053 -8.711 -6.386 1.00 0.00 H new ATOM 0 HG2 GLU A 28 15.128 -10.259 -6.127 1.00 0.00 H new ATOM 0 HG3 GLU A 28 14.119 -9.197 -7.089 1.00 0.00 H new ATOM 423 N PRO A 29 13.482 -6.636 -6.291 1.00 0.00 N ATOM 424 CA PRO A 29 12.050 -6.439 -6.439 1.00 0.00 C ATOM 425 C PRO A 29 11.411 -7.607 -7.193 1.00 0.00 C ATOM 426 O PRO A 29 11.953 -8.075 -8.194 1.00 0.00 O ATOM 427 CB PRO A 29 11.909 -5.113 -7.168 1.00 0.00 C ATOM 428 CG PRO A 29 13.260 -4.844 -7.811 1.00 0.00 C ATOM 429 CD PRO A 29 14.269 -5.794 -7.188 1.00 0.00 C ATOM 0 HA PRO A 29 11.528 -6.410 -5.483 1.00 0.00 H new ATOM 0 HB2 PRO A 29 11.122 -5.163 -7.920 1.00 0.00 H new ATOM 0 HB3 PRO A 29 11.640 -4.314 -6.477 1.00 0.00 H new ATOM 0 HG2 PRO A 29 13.207 -4.996 -8.889 1.00 0.00 H new ATOM 0 HG3 PRO A 29 13.560 -3.809 -7.650 1.00 0.00 H new ATOM 0 HD2 PRO A 29 14.774 -6.390 -7.949 1.00 0.00 H new ATOM 0 HD3 PRO A 29 15.041 -5.250 -6.644 1.00 0.00 H new ATOM 437 N VAL A 30 10.269 -8.044 -6.684 1.00 0.00 N ATOM 438 CA VAL A 30 9.551 -9.148 -7.297 1.00 0.00 C ATOM 439 C VAL A 30 8.138 -8.690 -7.666 1.00 0.00 C ATOM 440 O VAL A 30 7.684 -7.641 -7.214 1.00 0.00 O ATOM 441 CB VAL A 30 9.561 -10.361 -6.364 1.00 0.00 C ATOM 442 CG1 VAL A 30 8.606 -11.446 -6.865 1.00 0.00 C ATOM 443 CG2 VAL A 30 10.978 -10.913 -6.197 1.00 0.00 C ATOM 0 H VAL A 30 9.823 -7.654 -5.854 1.00 0.00 H new ATOM 0 HA VAL A 30 10.043 -9.459 -8.218 1.00 0.00 H new ATOM 0 HB VAL A 30 9.212 -10.033 -5.385 1.00 0.00 H new ATOM 0 HG11 VAL A 30 8.632 -12.297 -6.184 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.593 -11.047 -6.908 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.912 -11.768 -7.860 1.00 0.00 H new ATOM 0 HG21 VAL A 30 10.957 -11.774 -5.529 1.00 0.00 H new ATOM 0 HG22 VAL A 30 11.367 -11.217 -7.169 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.621 -10.142 -5.774 1.00 0.00 H new ATOM 453 N LYS A 31 7.483 -9.500 -8.485 1.00 0.00 N ATOM 454 CA LYS A 31 6.132 -9.191 -8.921 1.00 0.00 C ATOM 455 C LYS A 31 5.180 -9.295 -7.727 1.00 0.00 C ATOM 456 O LYS A 31 5.364 -10.142 -6.854 1.00 0.00 O ATOM 457 CB LYS A 31 5.734 -10.076 -10.103 1.00 0.00 C ATOM 458 CG LYS A 31 6.556 -9.731 -11.347 1.00 0.00 C ATOM 459 CD LYS A 31 5.999 -10.436 -12.585 1.00 0.00 C ATOM 460 CE LYS A 31 6.969 -11.507 -13.089 1.00 0.00 C ATOM 461 NZ LYS A 31 6.919 -11.599 -14.565 1.00 0.00 N ATOM 0 H LYS A 31 7.863 -10.370 -8.858 1.00 0.00 H new ATOM 0 HA LYS A 31 6.075 -8.166 -9.288 1.00 0.00 H new ATOM 0 HB2 LYS A 31 5.883 -11.124 -9.844 1.00 0.00 H new ATOM 0 HB3 LYS A 31 4.673 -9.948 -10.317 1.00 0.00 H new ATOM 0 HG2 LYS A 31 6.549 -8.652 -11.504 1.00 0.00 H new ATOM 0 HG3 LYS A 31 7.595 -10.024 -11.194 1.00 0.00 H new ATOM 0 HD2 LYS A 31 5.039 -10.893 -12.346 1.00 0.00 H new ATOM 0 HD3 LYS A 31 5.817 -9.705 -13.373 1.00 0.00 H new ATOM 0 HE2 LYS A 31 7.983 -11.268 -12.768 1.00 0.00 H new ATOM 0 HE3 LYS A 31 6.715 -12.472 -12.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 7.583 -12.330 -14.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 5.955 -11.849 -14.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 7.184 -10.682 -14.979 1.00 0.00 H new ATOM 475 N VAL A 32 4.183 -8.422 -7.728 1.00 0.00 N ATOM 476 CA VAL A 32 3.202 -8.405 -6.657 1.00 0.00 C ATOM 477 C VAL A 32 1.881 -8.981 -7.171 1.00 0.00 C ATOM 478 O VAL A 32 1.256 -8.409 -8.063 1.00 0.00 O ATOM 479 CB VAL A 32 3.060 -6.987 -6.100 1.00 0.00 C ATOM 480 CG1 VAL A 32 1.704 -6.800 -5.415 1.00 0.00 C ATOM 481 CG2 VAL A 32 4.207 -6.655 -5.144 1.00 0.00 C ATOM 0 H VAL A 32 4.034 -7.721 -8.454 1.00 0.00 H new ATOM 0 HA VAL A 32 3.530 -9.034 -5.829 1.00 0.00 H new ATOM 0 HB VAL A 32 3.111 -6.292 -6.938 1.00 0.00 H new ATOM 0 HG11 VAL A 32 1.629 -5.784 -5.028 1.00 0.00 H new ATOM 0 HG12 VAL A 32 0.905 -6.974 -6.136 1.00 0.00 H new ATOM 0 HG13 VAL A 32 1.611 -7.509 -4.593 1.00 0.00 H new ATOM 0 HG21 VAL A 32 4.081 -5.642 -4.763 1.00 0.00 H new ATOM 0 HG22 VAL A 32 4.202 -7.359 -4.312 1.00 0.00 H new ATOM 0 HG23 VAL A 32 5.156 -6.728 -5.675 1.00 0.00 H new ATOM 491 N PRO A 33 1.485 -10.135 -6.571 1.00 0.00 N ATOM 492 CA PRO A 33 0.250 -10.794 -6.959 1.00 0.00 C ATOM 493 C PRO A 33 -0.967 -10.049 -6.407 1.00 0.00 C ATOM 494 O PRO A 33 -1.674 -10.563 -5.541 1.00 0.00 O ATOM 495 CB PRO A 33 0.374 -12.210 -6.421 1.00 0.00 C ATOM 496 CG PRO A 33 1.458 -12.158 -5.357 1.00 0.00 C ATOM 497 CD PRO A 33 2.200 -10.840 -5.511 1.00 0.00 C ATOM 0 HA PRO A 33 0.100 -10.804 -8.039 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -0.571 -12.552 -5.999 1.00 0.00 H new ATOM 0 HB3 PRO A 33 0.639 -12.908 -7.215 1.00 0.00 H new ATOM 0 HG2 PRO A 33 1.020 -12.235 -4.362 1.00 0.00 H new ATOM 0 HG3 PRO A 33 2.144 -12.998 -5.470 1.00 0.00 H new ATOM 0 HD2 PRO A 33 2.193 -10.270 -4.582 1.00 0.00 H new ATOM 0 HD3 PRO A 33 3.244 -11.002 -5.778 1.00 0.00 H new ATOM 505 N TYR A 34 -1.173 -8.849 -6.930 1.00 0.00 N ATOM 506 CA TYR A 34 -2.292 -8.028 -6.499 1.00 0.00 C ATOM 507 C TYR A 34 -3.528 -8.886 -6.225 1.00 0.00 C ATOM 508 O TYR A 34 -4.072 -8.863 -5.121 1.00 0.00 O ATOM 509 CB TYR A 34 -2.592 -7.081 -7.663 1.00 0.00 C ATOM 510 CG TYR A 34 -1.487 -6.057 -7.932 1.00 0.00 C ATOM 511 CD1 TYR A 34 -0.779 -5.513 -6.880 1.00 0.00 C ATOM 512 CD2 TYR A 34 -1.199 -5.678 -9.228 1.00 0.00 C ATOM 513 CE1 TYR A 34 0.260 -4.549 -7.134 1.00 0.00 C ATOM 514 CE2 TYR A 34 -0.159 -4.714 -9.481 1.00 0.00 C ATOM 515 CZ TYR A 34 0.519 -4.197 -8.422 1.00 0.00 C ATOM 516 OH TYR A 34 1.501 -3.287 -8.661 1.00 0.00 O ATOM 0 H TYR A 34 -0.584 -8.426 -7.648 1.00 0.00 H new ATOM 0 HA TYR A 34 -2.047 -7.497 -5.579 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -2.754 -7.671 -8.565 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -3.522 -6.551 -7.457 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -1.004 -5.810 -5.866 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -1.753 -6.104 -10.051 1.00 0.00 H new ATOM 0 HE1 TYR A 34 0.821 -4.115 -6.320 1.00 0.00 H new ATOM 0 HE2 TYR A 34 0.077 -4.409 -10.490 1.00 0.00 H new ATOM 0 HH TYR A 34 1.576 -3.132 -9.626 1.00 0.00 H new ATOM 526 N SER A 35 -3.937 -9.623 -7.247 1.00 0.00 N ATOM 527 CA SER A 35 -5.099 -10.487 -7.129 1.00 0.00 C ATOM 528 C SER A 35 -5.078 -11.212 -5.782 1.00 0.00 C ATOM 529 O SER A 35 -6.045 -11.151 -5.025 1.00 0.00 O ATOM 530 CB SER A 35 -5.152 -11.499 -8.276 1.00 0.00 C ATOM 531 OG SER A 35 -4.475 -11.026 -9.437 1.00 0.00 O ATOM 0 H SER A 35 -3.484 -9.640 -8.161 1.00 0.00 H new ATOM 0 HA SER A 35 -5.993 -9.867 -7.186 1.00 0.00 H new ATOM 0 HB2 SER A 35 -4.703 -12.438 -7.952 1.00 0.00 H new ATOM 0 HB3 SER A 35 -6.192 -11.712 -8.524 1.00 0.00 H new ATOM 0 HG SER A 35 -4.530 -11.701 -10.145 1.00 0.00 H new ATOM 537 N LYS A 36 -3.965 -11.883 -5.525 1.00 0.00 N ATOM 538 CA LYS A 36 -3.805 -12.619 -4.282 1.00 0.00 C ATOM 539 C LYS A 36 -4.147 -11.704 -3.105 1.00 0.00 C ATOM 540 O LYS A 36 -4.769 -12.139 -2.136 1.00 0.00 O ATOM 541 CB LYS A 36 -2.405 -13.232 -4.198 1.00 0.00 C ATOM 542 CG LYS A 36 -2.157 -14.192 -5.363 1.00 0.00 C ATOM 543 CD LYS A 36 -2.996 -15.462 -5.215 1.00 0.00 C ATOM 544 CE LYS A 36 -2.876 -16.347 -6.458 1.00 0.00 C ATOM 545 NZ LYS A 36 -4.072 -17.208 -6.598 1.00 0.00 N ATOM 0 H LYS A 36 -3.165 -11.933 -6.156 1.00 0.00 H new ATOM 0 HA LYS A 36 -4.498 -13.459 -4.245 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -1.656 -12.440 -4.209 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -2.293 -13.764 -3.253 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -2.401 -13.698 -6.304 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -1.100 -14.453 -5.405 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -2.669 -16.017 -4.336 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -4.040 -15.195 -5.054 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -2.763 -15.724 -7.346 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -1.981 -16.966 -6.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -3.975 -17.802 -7.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -4.163 -17.815 -5.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -4.920 -16.612 -6.688 1.00 0.00 H new ATOM 559 N PHE A 37 -3.726 -10.454 -3.227 1.00 0.00 N ATOM 560 CA PHE A 37 -3.980 -9.474 -2.184 1.00 0.00 C ATOM 561 C PHE A 37 -5.392 -8.896 -2.307 1.00 0.00 C ATOM 562 O PHE A 37 -5.928 -8.346 -1.346 1.00 0.00 O ATOM 563 CB PHE A 37 -2.963 -8.346 -2.373 1.00 0.00 C ATOM 564 CG PHE A 37 -1.571 -8.667 -1.825 1.00 0.00 C ATOM 565 CD1 PHE A 37 -0.743 -9.496 -2.515 1.00 0.00 C ATOM 566 CD2 PHE A 37 -1.162 -8.123 -0.647 1.00 0.00 C ATOM 567 CE1 PHE A 37 0.549 -9.793 -2.007 1.00 0.00 C ATOM 568 CE2 PHE A 37 0.130 -8.421 -0.139 1.00 0.00 C ATOM 569 CZ PHE A 37 0.959 -9.249 -0.829 1.00 0.00 C ATOM 0 H PHE A 37 -3.211 -10.097 -4.032 1.00 0.00 H new ATOM 0 HA PHE A 37 -3.891 -9.943 -1.204 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -2.881 -8.119 -3.436 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -3.337 -7.447 -1.883 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -1.068 -9.929 -3.450 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -1.820 -7.465 -0.099 1.00 0.00 H new ATOM 0 HE1 PHE A 37 1.207 -10.451 -2.556 1.00 0.00 H new ATOM 0 HE2 PHE A 37 0.455 -7.990 0.796 1.00 0.00 H new ATOM 0 HZ PHE A 37 1.942 -9.475 -0.442 1.00 0.00 H new ATOM 579 N LEU A 38 -5.954 -9.040 -3.498 1.00 0.00 N ATOM 580 CA LEU A 38 -7.293 -8.540 -3.759 1.00 0.00 C ATOM 581 C LEU A 38 -8.320 -9.547 -3.238 1.00 0.00 C ATOM 582 O LEU A 38 -9.193 -9.195 -2.446 1.00 0.00 O ATOM 583 CB LEU A 38 -7.460 -8.204 -5.243 1.00 0.00 C ATOM 584 CG LEU A 38 -6.587 -7.066 -5.775 1.00 0.00 C ATOM 585 CD1 LEU A 38 -6.807 -6.861 -7.275 1.00 0.00 C ATOM 586 CD2 LEU A 38 -6.821 -5.779 -4.981 1.00 0.00 C ATOM 0 H LEU A 38 -5.506 -9.496 -4.293 1.00 0.00 H new ATOM 0 HA LEU A 38 -7.461 -7.606 -3.223 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -7.247 -9.101 -5.824 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -8.504 -7.948 -5.422 1.00 0.00 H new ATOM 0 HG LEU A 38 -5.542 -7.344 -5.638 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -6.174 -6.046 -7.628 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -6.551 -7.776 -7.809 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -7.853 -6.614 -7.459 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -6.188 -4.986 -5.379 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -7.867 -5.485 -5.064 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -6.574 -5.948 -3.933 1.00 0.00 H new ATOM 598 N MET A 39 -8.182 -10.780 -3.703 1.00 0.00 N ATOM 599 CA MET A 39 -9.087 -11.840 -3.293 1.00 0.00 C ATOM 600 C MET A 39 -8.840 -12.240 -1.837 1.00 0.00 C ATOM 601 O MET A 39 -9.721 -12.795 -1.184 1.00 0.00 O ATOM 602 CB MET A 39 -8.888 -13.059 -4.198 1.00 0.00 C ATOM 603 CG MET A 39 -9.088 -12.687 -5.668 1.00 0.00 C ATOM 604 SD MET A 39 -9.139 -14.165 -6.669 1.00 0.00 S ATOM 605 CE MET A 39 -7.412 -14.614 -6.646 1.00 0.00 C ATOM 0 H MET A 39 -7.457 -11.069 -4.360 1.00 0.00 H new ATOM 0 HA MET A 39 -10.110 -11.473 -3.381 1.00 0.00 H new ATOM 0 HB2 MET A 39 -7.886 -13.464 -4.054 1.00 0.00 H new ATOM 0 HB3 MET A 39 -9.592 -13.843 -3.918 1.00 0.00 H new ATOM 0 HG2 MET A 39 -10.014 -12.125 -5.787 1.00 0.00 H new ATOM 0 HG3 MET A 39 -8.277 -12.039 -6.002 1.00 0.00 H new ATOM 0 HE1 MET A 39 -7.224 -15.375 -7.403 1.00 0.00 H new ATOM 0 HE2 MET A 39 -6.804 -13.734 -6.857 1.00 0.00 H new ATOM 0 HE3 MET A 39 -7.151 -15.007 -5.663 1.00 0.00 H new ATOM 615 N HIS A 40 -7.636 -11.941 -1.371 1.00 0.00 N ATOM 616 CA HIS A 40 -7.261 -12.262 -0.004 1.00 0.00 C ATOM 617 C HIS A 40 -6.623 -11.038 0.654 1.00 0.00 C ATOM 618 O HIS A 40 -5.431 -11.043 0.959 1.00 0.00 O ATOM 619 CB HIS A 40 -6.358 -13.496 0.036 1.00 0.00 C ATOM 620 CG HIS A 40 -6.841 -14.639 -0.824 1.00 0.00 C ATOM 621 ND1 HIS A 40 -7.738 -15.591 -0.371 1.00 0.00 N ATOM 622 CD2 HIS A 40 -6.543 -14.973 -2.113 1.00 0.00 C ATOM 623 CE1 HIS A 40 -7.962 -16.454 -1.351 1.00 0.00 C ATOM 624 NE2 HIS A 40 -7.221 -16.069 -2.430 1.00 0.00 N ATOM 0 H HIS A 40 -6.907 -11.480 -1.916 1.00 0.00 H new ATOM 0 HA HIS A 40 -8.151 -12.517 0.571 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -5.356 -13.211 -0.286 1.00 0.00 H new ATOM 0 HB3 HIS A 40 -6.276 -13.840 1.067 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -5.870 -14.436 -2.765 1.00 0.00 H new ATOM 0 HE1 HIS A 40 -8.616 -17.312 -1.304 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -7.193 -16.545 -3.332 1.00 0.00 H new ATOM 632 N PRO A 41 -7.465 -9.990 0.860 1.00 0.00 N ATOM 633 CA PRO A 41 -6.996 -8.761 1.476 1.00 0.00 C ATOM 634 C PRO A 41 -6.800 -8.944 2.983 1.00 0.00 C ATOM 635 O PRO A 41 -6.185 -8.104 3.638 1.00 0.00 O ATOM 636 CB PRO A 41 -8.051 -7.722 1.136 1.00 0.00 C ATOM 637 CG PRO A 41 -9.294 -8.504 0.743 1.00 0.00 C ATOM 638 CD PRO A 41 -8.883 -9.948 0.512 1.00 0.00 C ATOM 0 HA PRO A 41 -6.019 -8.451 1.106 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -8.251 -7.074 1.990 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -7.719 -7.080 0.320 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -10.048 -8.443 1.528 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -9.739 -8.085 -0.159 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -9.464 -10.629 1.134 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -9.045 -10.245 -0.524 1.00 0.00 H new ATOM 646 N GLU A 42 -7.334 -10.046 3.487 1.00 0.00 N ATOM 647 CA GLU A 42 -7.225 -10.350 4.904 1.00 0.00 C ATOM 648 C GLU A 42 -5.889 -11.035 5.199 1.00 0.00 C ATOM 649 O GLU A 42 -5.177 -10.642 6.121 1.00 0.00 O ATOM 650 CB GLU A 42 -8.399 -11.212 5.372 1.00 0.00 C ATOM 651 CG GLU A 42 -9.512 -10.348 5.968 1.00 0.00 C ATOM 652 CD GLU A 42 -9.946 -10.879 7.335 1.00 0.00 C ATOM 653 OE1 GLU A 42 -9.146 -10.727 8.284 1.00 0.00 O ATOM 654 OE2 GLU A 42 -11.068 -11.426 7.402 1.00 0.00 O ATOM 0 H GLU A 42 -7.844 -10.740 2.940 1.00 0.00 H new ATOM 0 HA GLU A 42 -7.261 -9.413 5.460 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -8.790 -11.786 4.532 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -8.054 -11.930 6.116 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -9.165 -9.319 6.067 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -10.367 -10.333 5.292 1.00 0.00 H new ATOM 661 N GLU A 43 -5.591 -12.048 4.399 1.00 0.00 N ATOM 662 CA GLU A 43 -4.353 -12.791 4.563 1.00 0.00 C ATOM 663 C GLU A 43 -3.181 -12.009 3.969 1.00 0.00 C ATOM 664 O GLU A 43 -2.171 -11.793 4.637 1.00 0.00 O ATOM 665 CB GLU A 43 -4.461 -14.181 3.933 1.00 0.00 C ATOM 666 CG GLU A 43 -5.548 -15.012 4.618 1.00 0.00 C ATOM 667 CD GLU A 43 -5.407 -14.950 6.140 1.00 0.00 C ATOM 668 OE1 GLU A 43 -4.255 -15.073 6.609 1.00 0.00 O ATOM 669 OE2 GLU A 43 -6.455 -14.781 6.801 1.00 0.00 O ATOM 0 H GLU A 43 -6.185 -12.372 3.636 1.00 0.00 H new ATOM 0 HA GLU A 43 -4.171 -12.924 5.629 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -4.686 -14.086 2.871 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -3.503 -14.695 4.011 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -6.531 -14.644 4.325 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -5.483 -16.048 4.285 1.00 0.00 H new ATOM 676 N LEU A 44 -3.354 -11.604 2.719 1.00 0.00 N ATOM 677 CA LEU A 44 -2.323 -10.850 2.027 1.00 0.00 C ATOM 678 C LEU A 44 -2.747 -9.383 1.931 1.00 0.00 C ATOM 679 O LEU A 44 -3.727 -9.060 1.261 1.00 0.00 O ATOM 680 CB LEU A 44 -2.009 -11.489 0.673 1.00 0.00 C ATOM 681 CG LEU A 44 -2.146 -13.012 0.602 1.00 0.00 C ATOM 682 CD1 LEU A 44 -2.005 -13.508 -0.839 1.00 0.00 C ATOM 683 CD2 LEU A 44 -1.154 -13.696 1.544 1.00 0.00 C ATOM 0 H LEU A 44 -4.193 -11.784 2.168 1.00 0.00 H new ATOM 0 HA LEU A 44 -1.390 -10.876 2.590 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -2.668 -11.049 -0.076 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.989 -11.222 0.395 1.00 0.00 H new ATOM 0 HG LEU A 44 -3.147 -13.282 0.939 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -2.106 -14.593 -0.862 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -2.782 -13.058 -1.456 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -1.026 -13.227 -1.226 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -1.272 -14.777 1.474 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -0.137 -13.423 1.262 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -1.345 -13.376 2.568 1.00 0.00 H new ATOM 695 N PHE A 45 -1.989 -8.535 2.610 1.00 0.00 N ATOM 696 CA PHE A 45 -2.274 -7.111 2.609 1.00 0.00 C ATOM 697 C PHE A 45 -0.989 -6.294 2.752 1.00 0.00 C ATOM 698 O PHE A 45 0.103 -6.855 2.823 1.00 0.00 O ATOM 699 CB PHE A 45 -3.177 -6.835 3.814 1.00 0.00 C ATOM 700 CG PHE A 45 -2.559 -7.228 5.157 1.00 0.00 C ATOM 701 CD1 PHE A 45 -1.678 -6.393 5.771 1.00 0.00 C ATOM 702 CD2 PHE A 45 -2.889 -8.413 5.737 1.00 0.00 C ATOM 703 CE1 PHE A 45 -1.105 -6.758 7.018 1.00 0.00 C ATOM 704 CE2 PHE A 45 -2.316 -8.778 6.983 1.00 0.00 C ATOM 705 CZ PHE A 45 -1.436 -7.943 7.598 1.00 0.00 C ATOM 0 H PHE A 45 -1.177 -8.807 3.165 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.750 -6.828 1.670 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -3.423 -5.773 3.835 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -4.114 -7.376 3.684 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -1.414 -5.453 5.310 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.588 -9.077 5.249 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -0.406 -6.095 7.506 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -2.579 -9.719 7.443 1.00 0.00 H new ATOM 0 HZ PHE A 45 -1.000 -8.221 8.546 1.00 0.00 H new ATOM 715 N VAL A 46 -1.161 -4.981 2.791 1.00 0.00 N ATOM 716 CA VAL A 46 -0.028 -4.081 2.925 1.00 0.00 C ATOM 717 C VAL A 46 -0.279 -3.121 4.090 1.00 0.00 C ATOM 718 O VAL A 46 -1.411 -2.694 4.314 1.00 0.00 O ATOM 719 CB VAL A 46 0.226 -3.359 1.600 1.00 0.00 C ATOM 720 CG1 VAL A 46 1.326 -2.307 1.751 1.00 0.00 C ATOM 721 CG2 VAL A 46 0.568 -4.355 0.490 1.00 0.00 C ATOM 0 H VAL A 46 -2.068 -4.519 2.732 1.00 0.00 H new ATOM 0 HA VAL A 46 0.879 -4.641 3.155 1.00 0.00 H new ATOM 0 HB VAL A 46 -0.692 -2.845 1.317 1.00 0.00 H new ATOM 0 HG11 VAL A 46 1.487 -1.809 0.795 1.00 0.00 H new ATOM 0 HG12 VAL A 46 1.026 -1.572 2.498 1.00 0.00 H new ATOM 0 HG13 VAL A 46 2.250 -2.790 2.068 1.00 0.00 H new ATOM 0 HG21 VAL A 46 0.744 -3.816 -0.441 1.00 0.00 H new ATOM 0 HG22 VAL A 46 1.465 -4.910 0.763 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -0.261 -5.049 0.356 1.00 0.00 H new ATOM 731 N VAL A 47 0.795 -2.810 4.800 1.00 0.00 N ATOM 732 CA VAL A 47 0.706 -1.908 5.936 1.00 0.00 C ATOM 733 C VAL A 47 1.677 -0.743 5.735 1.00 0.00 C ATOM 734 O VAL A 47 2.699 -0.891 5.067 1.00 0.00 O ATOM 735 CB VAL A 47 0.955 -2.677 7.235 1.00 0.00 C ATOM 736 CG1 VAL A 47 -0.206 -3.625 7.543 1.00 0.00 C ATOM 737 CG2 VAL A 47 2.282 -3.437 7.176 1.00 0.00 C ATOM 0 H VAL A 47 1.732 -3.166 4.611 1.00 0.00 H new ATOM 0 HA VAL A 47 -0.296 -1.486 6.011 1.00 0.00 H new ATOM 0 HB VAL A 47 1.019 -1.952 8.046 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -0.003 -4.159 8.471 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -1.126 -3.051 7.648 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -0.316 -4.341 6.729 1.00 0.00 H new ATOM 0 HG21 VAL A 47 2.435 -3.975 8.111 1.00 0.00 H new ATOM 0 HG22 VAL A 47 2.258 -4.147 6.349 1.00 0.00 H new ATOM 0 HG23 VAL A 47 3.099 -2.731 7.026 1.00 0.00 H new ATOM 747 N GLY A 48 1.323 0.388 6.326 1.00 0.00 N ATOM 748 CA GLY A 48 2.151 1.578 6.221 1.00 0.00 C ATOM 749 C GLY A 48 1.570 2.561 5.202 1.00 0.00 C ATOM 750 O GLY A 48 1.841 3.760 5.267 1.00 0.00 O ATOM 0 H GLY A 48 0.474 0.506 6.879 1.00 0.00 H new ATOM 0 HA2 GLY A 48 2.226 2.061 7.195 1.00 0.00 H new ATOM 0 HA3 GLY A 48 3.162 1.297 5.926 1.00 0.00 H new ATOM 754 N LEU A 49 0.783 2.018 4.286 1.00 0.00 N ATOM 755 CA LEU A 49 0.162 2.833 3.255 1.00 0.00 C ATOM 756 C LEU A 49 -0.401 4.107 3.888 1.00 0.00 C ATOM 757 O LEU A 49 -0.718 4.126 5.077 1.00 0.00 O ATOM 758 CB LEU A 49 -0.879 2.018 2.483 1.00 0.00 C ATOM 759 CG LEU A 49 -0.326 0.981 1.503 1.00 0.00 C ATOM 760 CD1 LEU A 49 -1.427 0.026 1.037 1.00 0.00 C ATOM 761 CD2 LEU A 49 0.380 1.659 0.328 1.00 0.00 C ATOM 0 H LEU A 49 0.561 1.024 4.236 1.00 0.00 H new ATOM 0 HA LEU A 49 0.902 3.143 2.517 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -1.517 1.505 3.203 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -1.515 2.709 1.930 1.00 0.00 H new ATOM 0 HG LEU A 49 0.421 0.382 2.024 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -1.008 -0.701 0.341 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.845 -0.495 1.898 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -2.214 0.593 0.539 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.764 0.900 -0.353 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.327 2.298 -0.202 1.00 0.00 H new ATOM 0 HD23 LEU A 49 1.207 2.264 0.700 1.00 0.00 H new ATOM 773 N PRO A 50 -0.511 5.168 3.045 1.00 0.00 N ATOM 774 CA PRO A 50 -1.030 6.443 3.509 1.00 0.00 C ATOM 775 C PRO A 50 -2.548 6.384 3.689 1.00 0.00 C ATOM 776 O PRO A 50 -3.161 5.337 3.486 1.00 0.00 O ATOM 777 CB PRO A 50 -0.595 7.451 2.459 1.00 0.00 C ATOM 778 CG PRO A 50 -0.253 6.641 1.219 1.00 0.00 C ATOM 779 CD PRO A 50 -0.145 5.182 1.631 1.00 0.00 C ATOM 0 HA PRO A 50 -0.647 6.721 4.491 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -1.391 8.166 2.251 1.00 0.00 H new ATOM 0 HB3 PRO A 50 0.267 8.024 2.801 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -1.022 6.767 0.457 1.00 0.00 H new ATOM 0 HG3 PRO A 50 0.685 6.986 0.785 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -0.814 4.554 1.043 1.00 0.00 H new ATOM 0 HD3 PRO A 50 0.865 4.801 1.480 1.00 0.00 H new ATOM 787 N GLU A 51 -3.112 7.522 4.067 1.00 0.00 N ATOM 788 CA GLU A 51 -4.547 7.613 4.276 1.00 0.00 C ATOM 789 C GLU A 51 -5.272 7.735 2.935 1.00 0.00 C ATOM 790 O GLU A 51 -4.808 8.435 2.035 1.00 0.00 O ATOM 791 CB GLU A 51 -4.893 8.786 5.196 1.00 0.00 C ATOM 792 CG GLU A 51 -4.531 10.121 4.542 1.00 0.00 C ATOM 793 CD GLU A 51 -3.758 11.016 5.513 1.00 0.00 C ATOM 794 OE1 GLU A 51 -4.400 11.504 6.468 1.00 0.00 O ATOM 795 OE2 GLU A 51 -2.542 11.190 5.279 1.00 0.00 O ATOM 0 H GLU A 51 -2.601 8.389 4.234 1.00 0.00 H new ATOM 0 HA GLU A 51 -4.882 6.699 4.766 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -5.958 8.768 5.429 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -4.358 8.683 6.140 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -3.930 9.942 3.650 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -5.439 10.629 4.218 1.00 0.00 H new ATOM 802 N GLY A 52 -6.398 7.044 2.842 1.00 0.00 N ATOM 803 CA GLY A 52 -7.192 7.066 1.625 1.00 0.00 C ATOM 804 C GLY A 52 -6.458 6.369 0.479 1.00 0.00 C ATOM 805 O GLY A 52 -6.644 6.718 -0.686 1.00 0.00 O ATOM 0 H GLY A 52 -6.780 6.465 3.590 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -8.148 6.574 1.802 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -7.411 8.097 1.348 1.00 0.00 H new ATOM 809 N ILE A 53 -5.639 5.396 0.849 1.00 0.00 N ATOM 810 CA ILE A 53 -4.875 4.646 -0.134 1.00 0.00 C ATOM 811 C ILE A 53 -4.721 3.200 0.341 1.00 0.00 C ATOM 812 O ILE A 53 -4.538 2.950 1.532 1.00 0.00 O ATOM 813 CB ILE A 53 -3.545 5.343 -0.425 1.00 0.00 C ATOM 814 CG1 ILE A 53 -3.764 6.812 -0.790 1.00 0.00 C ATOM 815 CG2 ILE A 53 -2.758 4.595 -1.503 1.00 0.00 C ATOM 816 CD1 ILE A 53 -2.472 7.448 -1.307 1.00 0.00 C ATOM 0 H ILE A 53 -5.487 5.109 1.816 1.00 0.00 H new ATOM 0 HA ILE A 53 -5.406 4.614 -1.085 1.00 0.00 H new ATOM 0 HB ILE A 53 -2.943 5.324 0.484 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -4.541 6.889 -1.550 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -4.118 7.359 0.084 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -1.817 5.112 -1.691 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -2.553 3.579 -1.165 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -3.343 4.561 -2.422 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -2.656 8.492 -1.559 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -1.704 7.391 -0.535 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -2.134 6.914 -2.195 1.00 0.00 H new ATOM 828 N SER A 54 -4.800 2.285 -0.614 1.00 0.00 N ATOM 829 CA SER A 54 -4.671 0.870 -0.308 1.00 0.00 C ATOM 830 C SER A 54 -3.747 0.197 -1.325 1.00 0.00 C ATOM 831 O SER A 54 -2.851 0.836 -1.874 1.00 0.00 O ATOM 832 CB SER A 54 -6.038 0.183 -0.295 1.00 0.00 C ATOM 833 OG SER A 54 -6.093 -0.878 0.654 1.00 0.00 O ATOM 0 H SER A 54 -4.952 2.496 -1.600 1.00 0.00 H new ATOM 0 HA SER A 54 -4.237 0.773 0.687 1.00 0.00 H new ATOM 0 HB2 SER A 54 -6.810 0.917 -0.064 1.00 0.00 H new ATOM 0 HB3 SER A 54 -6.257 -0.208 -1.289 1.00 0.00 H new ATOM 0 HG SER A 54 -6.982 -1.290 0.633 1.00 0.00 H new ATOM 839 N LEU A 55 -3.998 -1.086 -1.545 1.00 0.00 N ATOM 840 CA LEU A 55 -3.200 -1.853 -2.486 1.00 0.00 C ATOM 841 C LEU A 55 -3.982 -2.025 -3.790 1.00 0.00 C ATOM 842 O LEU A 55 -5.032 -2.665 -3.808 1.00 0.00 O ATOM 843 CB LEU A 55 -2.754 -3.175 -1.858 1.00 0.00 C ATOM 844 CG LEU A 55 -1.727 -3.983 -2.654 1.00 0.00 C ATOM 845 CD1 LEU A 55 -0.440 -3.183 -2.861 1.00 0.00 C ATOM 846 CD2 LEU A 55 -1.461 -5.336 -1.990 1.00 0.00 C ATOM 0 H LEU A 55 -4.742 -1.613 -1.088 1.00 0.00 H new ATOM 0 HA LEU A 55 -2.283 -1.318 -2.732 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -2.337 -2.964 -0.873 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -3.636 -3.797 -1.704 1.00 0.00 H new ATOM 0 HG LEU A 55 -2.142 -4.185 -3.642 1.00 0.00 H new ATOM 0 HD11 LEU A 55 0.273 -3.781 -3.429 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -0.665 -2.268 -3.409 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -0.009 -2.929 -1.892 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -0.728 -5.891 -2.575 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -1.076 -5.178 -0.983 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -2.389 -5.905 -1.939 1.00 0.00 H new ATOM 858 N ARG A 56 -3.440 -1.442 -4.849 1.00 0.00 N ATOM 859 CA ARG A 56 -4.074 -1.523 -6.154 1.00 0.00 C ATOM 860 C ARG A 56 -3.092 -1.099 -7.248 1.00 0.00 C ATOM 861 O ARG A 56 -2.040 -0.531 -6.958 1.00 0.00 O ATOM 862 CB ARG A 56 -5.316 -0.631 -6.219 1.00 0.00 C ATOM 863 CG ARG A 56 -6.538 -1.352 -5.647 1.00 0.00 C ATOM 864 CD ARG A 56 -7.766 -1.138 -6.535 1.00 0.00 C ATOM 865 NE ARG A 56 -8.790 -2.165 -6.238 1.00 0.00 N ATOM 866 CZ ARG A 56 -9.929 -2.311 -6.929 1.00 0.00 C ATOM 867 NH1 ARG A 56 -10.196 -1.498 -7.960 1.00 0.00 N ATOM 868 NH2 ARG A 56 -10.800 -3.271 -6.588 1.00 0.00 N ATOM 0 H ARG A 56 -2.569 -0.912 -4.830 1.00 0.00 H new ATOM 0 HA ARG A 56 -4.375 -2.558 -6.313 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -5.138 0.288 -5.661 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -5.509 -0.345 -7.253 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -6.328 -2.418 -5.561 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -6.744 -0.985 -4.641 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -8.178 -0.143 -6.367 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -7.479 -1.191 -7.585 1.00 0.00 H new ATOM 0 HE ARG A 56 -8.618 -2.801 -5.459 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -9.532 -0.768 -8.219 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -11.063 -1.609 -8.486 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -10.596 -3.890 -5.803 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -11.667 -3.383 -7.113 1.00 0.00 H new ATOM 882 N ARG A 57 -3.471 -1.391 -8.484 1.00 0.00 N ATOM 883 CA ARG A 57 -2.637 -1.047 -9.623 1.00 0.00 C ATOM 884 C ARG A 57 -2.119 0.386 -9.488 1.00 0.00 C ATOM 885 O ARG A 57 -2.884 1.301 -9.188 1.00 0.00 O ATOM 886 CB ARG A 57 -3.414 -1.179 -10.935 1.00 0.00 C ATOM 887 CG ARG A 57 -2.943 -2.398 -11.731 1.00 0.00 C ATOM 888 CD ARG A 57 -4.041 -2.897 -12.671 1.00 0.00 C ATOM 889 NE ARG A 57 -3.492 -3.912 -13.598 1.00 0.00 N ATOM 890 CZ ARG A 57 -4.225 -4.589 -14.492 1.00 0.00 C ATOM 891 NH1 ARG A 57 -5.543 -4.363 -14.585 1.00 0.00 N ATOM 892 NH2 ARG A 57 -3.642 -5.491 -15.292 1.00 0.00 N ATOM 0 H ARG A 57 -4.344 -1.862 -8.721 1.00 0.00 H new ATOM 0 HA ARG A 57 -1.797 -1.741 -9.640 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -4.480 -1.268 -10.723 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -3.282 -0.277 -11.532 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -2.055 -2.139 -12.308 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -2.656 -3.196 -11.046 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -4.859 -3.326 -12.092 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -4.454 -2.062 -13.237 1.00 0.00 H new ATOM 0 HE ARG A 57 -2.492 -4.108 -13.553 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -5.987 -3.676 -13.975 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -6.102 -4.878 -15.265 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -2.639 -5.663 -15.221 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -4.201 -6.006 -15.972 1.00 0.00 H new ATOM 906 N PRO A 58 -0.788 0.541 -9.723 1.00 0.00 N ATOM 907 CA PRO A 58 -0.159 1.847 -9.630 1.00 0.00 C ATOM 908 C PRO A 58 -0.508 2.711 -10.844 1.00 0.00 C ATOM 909 O PRO A 58 0.381 3.200 -11.539 1.00 0.00 O ATOM 910 CB PRO A 58 1.329 1.559 -9.515 1.00 0.00 C ATOM 911 CG PRO A 58 1.518 0.135 -10.012 1.00 0.00 C ATOM 912 CD PRO A 58 0.149 -0.520 -10.081 1.00 0.00 C ATOM 0 HA PRO A 58 -0.508 2.422 -8.772 1.00 0.00 H new ATOM 0 HB2 PRO A 58 1.910 2.261 -10.113 1.00 0.00 H new ATOM 0 HB3 PRO A 58 1.668 1.661 -8.484 1.00 0.00 H new ATOM 0 HG2 PRO A 58 1.992 0.133 -10.994 1.00 0.00 H new ATOM 0 HG3 PRO A 58 2.173 -0.420 -9.341 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -0.055 -0.908 -11.079 1.00 0.00 H new ATOM 0 HD3 PRO A 58 0.077 -1.361 -9.391 1.00 0.00 H new ATOM 920 N ASN A 59 -1.805 2.873 -11.061 1.00 0.00 N ATOM 921 CA ASN A 59 -2.283 3.670 -12.178 1.00 0.00 C ATOM 922 C ASN A 59 -3.685 4.195 -11.862 1.00 0.00 C ATOM 923 O ASN A 59 -3.982 5.364 -12.102 1.00 0.00 O ATOM 924 CB ASN A 59 -2.369 2.831 -13.455 1.00 0.00 C ATOM 925 CG ASN A 59 -2.975 1.456 -13.168 1.00 0.00 C ATOM 926 OD1 ASN A 59 -4.113 1.325 -12.748 1.00 0.00 O ATOM 927 ND2 ASN A 59 -2.153 0.440 -13.418 1.00 0.00 N ATOM 0 H ASN A 59 -2.540 2.466 -10.482 1.00 0.00 H new ATOM 0 HA ASN A 59 -1.582 4.491 -12.331 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -2.975 3.352 -14.196 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -1.374 2.712 -13.884 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -2.464 -0.518 -13.259 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -1.212 0.620 -13.769 1.00 0.00 H new ATOM 934 N CYS A 60 -4.509 3.305 -11.327 1.00 0.00 N ATOM 935 CA CYS A 60 -5.872 3.665 -10.975 1.00 0.00 C ATOM 936 C CYS A 60 -5.821 4.828 -9.982 1.00 0.00 C ATOM 937 O CYS A 60 -6.811 5.533 -9.796 1.00 0.00 O ATOM 938 CB CYS A 60 -6.645 2.469 -10.415 1.00 0.00 C ATOM 939 SG CYS A 60 -8.417 2.895 -10.243 1.00 0.00 S ATOM 0 H CYS A 60 -4.259 2.336 -11.129 1.00 0.00 H new ATOM 0 HA CYS A 60 -6.412 3.977 -11.869 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -6.531 1.610 -11.076 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -6.236 2.182 -9.446 1.00 0.00 H new ATOM 0 HG CYS A 60 -8.536 4.167 -10.003 1.00 0.00 H new ATOM 945 N PHE A 61 -4.657 4.992 -9.372 1.00 0.00 N ATOM 946 CA PHE A 61 -4.464 6.057 -8.402 1.00 0.00 C ATOM 947 C PHE A 61 -4.084 7.367 -9.096 1.00 0.00 C ATOM 948 O PHE A 61 -3.830 7.385 -10.299 1.00 0.00 O ATOM 949 CB PHE A 61 -3.316 5.626 -7.487 1.00 0.00 C ATOM 950 CG PHE A 61 -3.665 4.464 -6.556 1.00 0.00 C ATOM 951 CD1 PHE A 61 -4.330 4.700 -5.393 1.00 0.00 C ATOM 952 CD2 PHE A 61 -3.311 3.194 -6.890 1.00 0.00 C ATOM 953 CE1 PHE A 61 -4.655 3.622 -4.528 1.00 0.00 C ATOM 954 CE2 PHE A 61 -3.635 2.116 -6.025 1.00 0.00 C ATOM 955 CZ PHE A 61 -4.300 2.352 -4.863 1.00 0.00 C ATOM 0 H PHE A 61 -3.838 4.405 -9.530 1.00 0.00 H new ATOM 0 HA PHE A 61 -5.386 6.226 -7.845 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -2.462 5.342 -8.102 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -3.005 6.480 -6.885 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -4.611 5.708 -5.127 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -2.783 3.006 -7.813 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -5.183 3.810 -3.605 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -3.353 1.108 -6.290 1.00 0.00 H new ATOM 0 HZ PHE A 61 -4.547 1.531 -4.206 1.00 0.00 H new ATOM 965 N GLY A 62 -4.056 8.431 -8.306 1.00 0.00 N ATOM 966 CA GLY A 62 -3.711 9.742 -8.829 1.00 0.00 C ATOM 967 C GLY A 62 -2.283 10.128 -8.440 1.00 0.00 C ATOM 968 O GLY A 62 -1.756 9.647 -7.439 1.00 0.00 O ATOM 0 H GLY A 62 -4.267 8.412 -7.308 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -3.809 9.742 -9.915 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -4.410 10.486 -8.446 1.00 0.00 H new ATOM 972 N ILE A 63 -1.696 10.994 -9.254 1.00 0.00 N ATOM 973 CA ILE A 63 -0.339 11.451 -9.008 1.00 0.00 C ATOM 974 C ILE A 63 -0.146 11.677 -7.507 1.00 0.00 C ATOM 975 O ILE A 63 0.678 11.014 -6.877 1.00 0.00 O ATOM 976 CB ILE A 63 -0.025 12.683 -9.860 1.00 0.00 C ATOM 977 CG1 ILE A 63 0.391 12.278 -11.276 1.00 0.00 C ATOM 978 CG2 ILE A 63 1.027 13.564 -9.183 1.00 0.00 C ATOM 979 CD1 ILE A 63 -0.720 12.587 -12.282 1.00 0.00 C ATOM 0 H ILE A 63 -2.136 11.391 -10.084 1.00 0.00 H new ATOM 0 HA ILE A 63 0.380 10.690 -9.312 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.934 13.278 -9.949 1.00 0.00 H new ATOM 0 HG12 ILE A 63 1.300 12.809 -11.558 1.00 0.00 H new ATOM 0 HG13 ILE A 63 0.623 11.213 -11.300 1.00 0.00 H new ATOM 0 HG21 ILE A 63 1.232 14.432 -9.809 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.655 13.895 -8.214 1.00 0.00 H new ATOM 0 HG23 ILE A 63 1.945 12.993 -9.043 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -0.400 12.290 -13.281 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -1.620 12.036 -12.011 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -0.933 13.656 -12.272 1.00 0.00 H new ATOM 991 N ALA A 64 -0.918 12.614 -6.977 1.00 0.00 N ATOM 992 CA ALA A 64 -0.842 12.935 -5.562 1.00 0.00 C ATOM 993 C ALA A 64 -0.769 11.639 -4.753 1.00 0.00 C ATOM 994 O ALA A 64 0.063 11.509 -3.856 1.00 0.00 O ATOM 995 CB ALA A 64 -2.042 13.800 -5.170 1.00 0.00 C ATOM 0 H ALA A 64 -1.600 13.162 -7.502 1.00 0.00 H new ATOM 0 HA ALA A 64 0.059 13.510 -5.346 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -1.985 14.041 -4.108 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -2.032 14.721 -5.752 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -2.964 13.255 -5.370 1.00 0.00 H new ATOM 1001 N LYS A 65 -1.651 10.712 -5.098 1.00 0.00 N ATOM 1002 CA LYS A 65 -1.696 9.431 -4.415 1.00 0.00 C ATOM 1003 C LYS A 65 -0.364 8.704 -4.613 1.00 0.00 C ATOM 1004 O LYS A 65 0.348 8.432 -3.647 1.00 0.00 O ATOM 1005 CB LYS A 65 -2.912 8.622 -4.873 1.00 0.00 C ATOM 1006 CG LYS A 65 -4.215 9.340 -4.515 1.00 0.00 C ATOM 1007 CD LYS A 65 -5.340 8.336 -4.254 1.00 0.00 C ATOM 1008 CE LYS A 65 -6.227 8.796 -3.096 1.00 0.00 C ATOM 1009 NZ LYS A 65 -7.655 8.720 -3.475 1.00 0.00 N ATOM 0 H LYS A 65 -2.340 10.823 -5.842 1.00 0.00 H new ATOM 0 HA LYS A 65 -1.824 9.576 -3.342 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -2.864 8.465 -5.950 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -2.895 7.637 -4.406 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -4.062 9.959 -3.631 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -4.501 10.009 -5.327 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -5.943 8.218 -5.154 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -4.915 7.359 -4.025 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -6.044 8.174 -2.220 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -5.972 9.819 -2.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -8.243 9.036 -2.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -7.829 9.332 -4.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -7.898 7.738 -3.717 1.00 0.00 H new ATOM 1023 N LEU A 66 -0.067 8.412 -5.870 1.00 0.00 N ATOM 1024 CA LEU A 66 1.167 7.722 -6.207 1.00 0.00 C ATOM 1025 C LEU A 66 2.304 8.271 -5.343 1.00 0.00 C ATOM 1026 O LEU A 66 3.046 7.506 -4.729 1.00 0.00 O ATOM 1027 CB LEU A 66 1.438 7.812 -7.710 1.00 0.00 C ATOM 1028 CG LEU A 66 0.484 7.025 -8.612 1.00 0.00 C ATOM 1029 CD1 LEU A 66 0.668 7.418 -10.079 1.00 0.00 C ATOM 1030 CD2 LEU A 66 0.644 5.519 -8.397 1.00 0.00 C ATOM 0 H LEU A 66 -0.659 8.640 -6.668 1.00 0.00 H new ATOM 0 HA LEU A 66 1.082 6.658 -5.985 1.00 0.00 H new ATOM 0 HB2 LEU A 66 1.401 8.861 -8.004 1.00 0.00 H new ATOM 0 HB3 LEU A 66 2.454 7.464 -7.897 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.539 7.282 -8.336 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -0.021 6.844 -10.699 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.464 8.482 -10.199 1.00 0.00 H new ATOM 0 HD13 LEU A 66 1.692 7.208 -10.386 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -0.045 4.983 -9.050 1.00 0.00 H new ATOM 0 HD22 LEU A 66 1.667 5.225 -8.630 1.00 0.00 H new ATOM 0 HD23 LEU A 66 0.424 5.274 -7.358 1.00 0.00 H new ATOM 1042 N ARG A 67 2.405 9.592 -5.324 1.00 0.00 N ATOM 1043 CA ARG A 67 3.440 10.252 -4.545 1.00 0.00 C ATOM 1044 C ARG A 67 3.358 9.821 -3.080 1.00 0.00 C ATOM 1045 O ARG A 67 4.320 9.285 -2.531 1.00 0.00 O ATOM 1046 CB ARG A 67 3.307 11.773 -4.631 1.00 0.00 C ATOM 1047 CG ARG A 67 3.472 12.258 -6.072 1.00 0.00 C ATOM 1048 CD ARG A 67 3.322 13.778 -6.160 1.00 0.00 C ATOM 1049 NE ARG A 67 3.525 14.227 -7.556 1.00 0.00 N ATOM 1050 CZ ARG A 67 3.574 15.513 -7.932 1.00 0.00 C ATOM 1051 NH1 ARG A 67 3.434 16.484 -7.019 1.00 0.00 N ATOM 1052 NH2 ARG A 67 3.762 15.827 -9.221 1.00 0.00 N ATOM 0 H ARG A 67 1.788 10.223 -5.835 1.00 0.00 H new ATOM 0 HA ARG A 67 4.405 9.959 -4.959 1.00 0.00 H new ATOM 0 HB2 ARG A 67 2.332 12.078 -4.250 1.00 0.00 H new ATOM 0 HB3 ARG A 67 4.058 12.244 -3.997 1.00 0.00 H new ATOM 0 HG2 ARG A 67 4.452 11.963 -6.449 1.00 0.00 H new ATOM 0 HG3 ARG A 67 2.728 11.778 -6.708 1.00 0.00 H new ATOM 0 HD2 ARG A 67 2.332 14.075 -5.814 1.00 0.00 H new ATOM 0 HD3 ARG A 67 4.046 14.262 -5.505 1.00 0.00 H new ATOM 0 HE ARG A 67 3.634 13.514 -8.277 1.00 0.00 H new ATOM 0 HH11 ARG A 67 3.290 16.245 -6.038 1.00 0.00 H new ATOM 0 HH12 ARG A 67 3.471 17.462 -7.305 1.00 0.00 H new ATOM 0 HH21 ARG A 67 3.868 15.088 -9.916 1.00 0.00 H new ATOM 0 HH22 ARG A 67 3.799 16.805 -9.507 1.00 0.00 H new ATOM 1066 N LYS A 68 2.199 10.070 -2.487 1.00 0.00 N ATOM 1067 CA LYS A 68 1.979 9.714 -1.096 1.00 0.00 C ATOM 1068 C LYS A 68 2.616 8.352 -0.815 1.00 0.00 C ATOM 1069 O LYS A 68 3.537 8.249 -0.005 1.00 0.00 O ATOM 1070 CB LYS A 68 0.488 9.777 -0.756 1.00 0.00 C ATOM 1071 CG LYS A 68 0.142 11.090 -0.050 1.00 0.00 C ATOM 1072 CD LYS A 68 -0.897 11.883 -0.845 1.00 0.00 C ATOM 1073 CE LYS A 68 -1.285 13.168 -0.111 1.00 0.00 C ATOM 1074 NZ LYS A 68 -0.316 14.247 -0.409 1.00 0.00 N ATOM 0 H LYS A 68 1.403 10.514 -2.945 1.00 0.00 H new ATOM 0 HA LYS A 68 2.464 10.435 -0.438 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -0.101 9.684 -1.668 1.00 0.00 H new ATOM 0 HB3 LYS A 68 0.221 8.935 -0.117 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -0.242 10.880 0.948 1.00 0.00 H new ATOM 0 HG3 LYS A 68 1.044 11.689 0.075 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -0.497 12.128 -1.829 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -1.784 11.269 -1.005 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -2.286 13.477 -0.411 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -1.316 12.985 0.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -0.594 15.112 0.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 0.634 13.956 -0.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -0.306 14.432 -1.432 1.00 0.00 H new ATOM 1088 N ILE A 69 2.101 7.341 -1.498 1.00 0.00 N ATOM 1089 CA ILE A 69 2.609 5.990 -1.333 1.00 0.00 C ATOM 1090 C ILE A 69 4.138 6.019 -1.347 1.00 0.00 C ATOM 1091 O ILE A 69 4.781 5.516 -0.426 1.00 0.00 O ATOM 1092 CB ILE A 69 2.002 5.057 -2.382 1.00 0.00 C ATOM 1093 CG1 ILE A 69 0.513 4.827 -2.116 1.00 0.00 C ATOM 1094 CG2 ILE A 69 2.780 3.742 -2.463 1.00 0.00 C ATOM 1095 CD1 ILE A 69 -0.183 4.252 -3.351 1.00 0.00 C ATOM 0 H ILE A 69 1.337 7.430 -2.167 1.00 0.00 H new ATOM 0 HA ILE A 69 2.307 5.585 -0.367 1.00 0.00 H new ATOM 0 HB ILE A 69 2.084 5.540 -3.356 1.00 0.00 H new ATOM 0 HG12 ILE A 69 0.392 4.144 -1.275 1.00 0.00 H new ATOM 0 HG13 ILE A 69 0.041 5.768 -1.833 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.327 3.097 -3.216 1.00 0.00 H new ATOM 0 HG22 ILE A 69 3.815 3.948 -2.736 1.00 0.00 H new ATOM 0 HG23 ILE A 69 2.753 3.243 -1.494 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -1.240 4.098 -3.134 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -0.081 4.948 -4.183 1.00 0.00 H new ATOM 0 HD13 ILE A 69 0.275 3.299 -3.616 1.00 0.00 H new ATOM 1107 N LEU A 70 4.677 6.612 -2.402 1.00 0.00 N ATOM 1108 CA LEU A 70 6.119 6.713 -2.548 1.00 0.00 C ATOM 1109 C LEU A 70 6.706 7.402 -1.314 1.00 0.00 C ATOM 1110 O LEU A 70 7.798 7.057 -0.867 1.00 0.00 O ATOM 1111 CB LEU A 70 6.477 7.403 -3.866 1.00 0.00 C ATOM 1112 CG LEU A 70 6.266 6.575 -5.135 1.00 0.00 C ATOM 1113 CD1 LEU A 70 6.405 7.445 -6.386 1.00 0.00 C ATOM 1114 CD2 LEU A 70 7.208 5.370 -5.167 1.00 0.00 C ATOM 0 H LEU A 70 4.141 7.027 -3.164 1.00 0.00 H new ATOM 0 HA LEU A 70 6.566 5.721 -2.602 1.00 0.00 H new ATOM 0 HB2 LEU A 70 5.885 8.315 -3.948 1.00 0.00 H new ATOM 0 HB3 LEU A 70 7.523 7.705 -3.823 1.00 0.00 H new ATOM 0 HG LEU A 70 5.248 6.187 -5.124 1.00 0.00 H new ATOM 0 HD11 LEU A 70 6.251 6.832 -7.274 1.00 0.00 H new ATOM 0 HD12 LEU A 70 5.661 8.241 -6.360 1.00 0.00 H new ATOM 0 HD13 LEU A 70 7.403 7.882 -6.416 1.00 0.00 H new ATOM 0 HD21 LEU A 70 7.037 4.799 -6.079 1.00 0.00 H new ATOM 0 HD22 LEU A 70 8.242 5.715 -5.143 1.00 0.00 H new ATOM 0 HD23 LEU A 70 7.017 4.736 -4.301 1.00 0.00 H new ATOM 1126 N GLU A 71 5.954 8.364 -0.800 1.00 0.00 N ATOM 1127 CA GLU A 71 6.385 9.105 0.373 1.00 0.00 C ATOM 1128 C GLU A 71 6.261 8.235 1.626 1.00 0.00 C ATOM 1129 O GLU A 71 6.938 8.476 2.624 1.00 0.00 O ATOM 1130 CB GLU A 71 5.590 10.403 0.526 1.00 0.00 C ATOM 1131 CG GLU A 71 5.672 11.249 -0.746 1.00 0.00 C ATOM 1132 CD GLU A 71 5.810 12.735 -0.409 1.00 0.00 C ATOM 1133 OE1 GLU A 71 6.860 13.090 0.168 1.00 0.00 O ATOM 1134 OE2 GLU A 71 4.862 13.481 -0.735 1.00 0.00 O ATOM 0 H GLU A 71 5.049 8.647 -1.175 1.00 0.00 H new ATOM 0 HA GLU A 71 7.433 9.374 0.243 1.00 0.00 H new ATOM 0 HB2 GLU A 71 4.548 10.172 0.747 1.00 0.00 H new ATOM 0 HB3 GLU A 71 5.976 10.973 1.371 1.00 0.00 H new ATOM 0 HG2 GLU A 71 6.523 10.928 -1.346 1.00 0.00 H new ATOM 0 HG3 GLU A 71 4.779 11.091 -1.350 1.00 0.00 H new ATOM 1141 N ALA A 72 5.390 7.240 1.533 1.00 0.00 N ATOM 1142 CA ALA A 72 5.168 6.333 2.646 1.00 0.00 C ATOM 1143 C ALA A 72 5.763 4.965 2.309 1.00 0.00 C ATOM 1144 O ALA A 72 5.284 3.940 2.792 1.00 0.00 O ATOM 1145 CB ALA A 72 3.671 6.258 2.952 1.00 0.00 C ATOM 0 H ALA A 72 4.830 7.042 0.704 1.00 0.00 H new ATOM 0 HA ALA A 72 5.667 6.698 3.544 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.504 5.578 3.787 1.00 0.00 H new ATOM 0 HB2 ALA A 72 3.303 7.250 3.213 1.00 0.00 H new ATOM 0 HB3 ALA A 72 3.138 5.893 2.074 1.00 0.00 H new ATOM 1151 N SER A 73 6.799 4.992 1.483 1.00 0.00 N ATOM 1152 CA SER A 73 7.465 3.766 1.077 1.00 0.00 C ATOM 1153 C SER A 73 8.056 3.061 2.300 1.00 0.00 C ATOM 1154 O SER A 73 7.595 1.988 2.684 1.00 0.00 O ATOM 1155 CB SER A 73 8.560 4.050 0.047 1.00 0.00 C ATOM 1156 OG SER A 73 9.833 3.576 0.477 1.00 0.00 O ATOM 0 H SER A 73 7.193 5.844 1.084 1.00 0.00 H new ATOM 0 HA SER A 73 6.726 3.113 0.612 1.00 0.00 H new ATOM 0 HB2 SER A 73 8.298 3.578 -0.900 1.00 0.00 H new ATOM 0 HB3 SER A 73 8.616 5.123 -0.136 1.00 0.00 H new ATOM 0 HG SER A 73 10.505 3.775 -0.208 1.00 0.00 H new ATOM 1162 N ASN A 74 9.067 3.694 2.877 1.00 0.00 N ATOM 1163 CA ASN A 74 9.725 3.141 4.048 1.00 0.00 C ATOM 1164 C ASN A 74 8.669 2.591 5.009 1.00 0.00 C ATOM 1165 O ASN A 74 8.869 1.544 5.623 1.00 0.00 O ATOM 1166 CB ASN A 74 10.525 4.214 4.789 1.00 0.00 C ATOM 1167 CG ASN A 74 12.006 4.155 4.408 1.00 0.00 C ATOM 1168 OD1 ASN A 74 12.371 3.957 3.261 1.00 0.00 O ATOM 1169 ND2 ASN A 74 12.835 4.336 5.432 1.00 0.00 N ATOM 0 H ASN A 74 9.446 4.584 2.555 1.00 0.00 H new ATOM 0 HA ASN A 74 10.401 2.354 3.714 1.00 0.00 H new ATOM 0 HB2 ASN A 74 10.124 5.200 4.553 1.00 0.00 H new ATOM 0 HB3 ASN A 74 10.417 4.075 5.865 1.00 0.00 H new ATOM 0 HD21 ASN A 74 13.844 4.314 5.282 1.00 0.00 H new ATOM 0 HD22 ASN A 74 12.462 4.497 6.368 1.00 0.00 H new ATOM 1176 N SER A 75 7.568 3.321 5.109 1.00 0.00 N ATOM 1177 CA SER A 75 6.480 2.919 5.984 1.00 0.00 C ATOM 1178 C SER A 75 5.776 1.687 5.413 1.00 0.00 C ATOM 1179 O SER A 75 5.586 0.695 6.115 1.00 0.00 O ATOM 1180 CB SER A 75 5.479 4.060 6.178 1.00 0.00 C ATOM 1181 OG SER A 75 6.054 5.161 6.877 1.00 0.00 O ATOM 0 H SER A 75 7.406 4.189 4.598 1.00 0.00 H new ATOM 0 HA SER A 75 6.900 2.670 6.959 1.00 0.00 H new ATOM 0 HB2 SER A 75 5.119 4.396 5.206 1.00 0.00 H new ATOM 0 HB3 SER A 75 4.613 3.693 6.729 1.00 0.00 H new ATOM 0 HG SER A 75 5.384 5.869 6.979 1.00 0.00 H new ATOM 1187 N ILE A 76 5.409 1.789 4.144 1.00 0.00 N ATOM 1188 CA ILE A 76 4.730 0.696 3.470 1.00 0.00 C ATOM 1189 C ILE A 76 5.422 -0.623 3.823 1.00 0.00 C ATOM 1190 O ILE A 76 6.606 -0.636 4.157 1.00 0.00 O ATOM 1191 CB ILE A 76 4.646 0.963 1.966 1.00 0.00 C ATOM 1192 CG1 ILE A 76 3.451 1.859 1.635 1.00 0.00 C ATOM 1193 CG2 ILE A 76 4.615 -0.348 1.177 1.00 0.00 C ATOM 1194 CD1 ILE A 76 3.411 2.190 0.141 1.00 0.00 C ATOM 0 H ILE A 76 5.569 2.613 3.564 1.00 0.00 H new ATOM 0 HA ILE A 76 3.699 0.618 3.814 1.00 0.00 H new ATOM 0 HB ILE A 76 5.545 1.500 1.663 1.00 0.00 H new ATOM 0 HG12 ILE A 76 2.526 1.360 1.926 1.00 0.00 H new ATOM 0 HG13 ILE A 76 3.511 2.781 2.214 1.00 0.00 H new ATOM 0 HG21 ILE A 76 4.555 -0.130 0.111 1.00 0.00 H new ATOM 0 HG22 ILE A 76 5.522 -0.917 1.381 1.00 0.00 H new ATOM 0 HG23 ILE A 76 3.745 -0.933 1.477 1.00 0.00 H new ATOM 0 HD11 ILE A 76 2.552 2.828 -0.067 1.00 0.00 H new ATOM 0 HD12 ILE A 76 4.326 2.710 -0.141 1.00 0.00 H new ATOM 0 HD13 ILE A 76 3.326 1.268 -0.434 1.00 0.00 H new ATOM 1206 N GLN A 77 4.655 -1.699 3.735 1.00 0.00 N ATOM 1207 CA GLN A 77 5.179 -3.019 4.041 1.00 0.00 C ATOM 1208 C GLN A 77 4.170 -4.097 3.640 1.00 0.00 C ATOM 1209 O GLN A 77 2.997 -4.019 4.000 1.00 0.00 O ATOM 1210 CB GLN A 77 5.545 -3.134 5.522 1.00 0.00 C ATOM 1211 CG GLN A 77 6.562 -4.255 5.750 1.00 0.00 C ATOM 1212 CD GLN A 77 7.234 -4.115 7.118 1.00 0.00 C ATOM 1213 OE1 GLN A 77 7.057 -4.928 8.010 1.00 0.00 O ATOM 1214 NE2 GLN A 77 8.013 -3.043 7.231 1.00 0.00 N ATOM 0 H GLN A 77 3.674 -1.684 3.456 1.00 0.00 H new ATOM 0 HA GLN A 77 6.091 -3.169 3.463 1.00 0.00 H new ATOM 0 HB2 GLN A 77 5.957 -2.188 5.873 1.00 0.00 H new ATOM 0 HB3 GLN A 77 4.647 -3.328 6.108 1.00 0.00 H new ATOM 0 HG2 GLN A 77 6.064 -5.222 5.683 1.00 0.00 H new ATOM 0 HG3 GLN A 77 7.318 -4.230 4.965 1.00 0.00 H new ATOM 0 HE21 GLN A 77 8.117 -2.403 6.444 1.00 0.00 H new ATOM 0 HE22 GLN A 77 8.507 -2.861 8.105 1.00 0.00 H new ATOM 1223 N PHE A 78 4.664 -5.079 2.899 1.00 0.00 N ATOM 1224 CA PHE A 78 3.820 -6.171 2.445 1.00 0.00 C ATOM 1225 C PHE A 78 3.829 -7.324 3.450 1.00 0.00 C ATOM 1226 O PHE A 78 4.758 -8.130 3.468 1.00 0.00 O ATOM 1227 CB PHE A 78 4.401 -6.663 1.118 1.00 0.00 C ATOM 1228 CG PHE A 78 4.026 -5.795 -0.085 1.00 0.00 C ATOM 1229 CD1 PHE A 78 4.237 -4.452 -0.047 1.00 0.00 C ATOM 1230 CD2 PHE A 78 3.481 -6.367 -1.193 1.00 0.00 C ATOM 1231 CE1 PHE A 78 3.889 -3.647 -1.164 1.00 0.00 C ATOM 1232 CE2 PHE A 78 3.133 -5.561 -2.309 1.00 0.00 C ATOM 1233 CZ PHE A 78 3.345 -4.218 -2.271 1.00 0.00 C ATOM 0 H PHE A 78 5.638 -5.141 2.602 1.00 0.00 H new ATOM 0 HA PHE A 78 2.792 -5.826 2.336 1.00 0.00 H new ATOM 0 HB2 PHE A 78 5.487 -6.702 1.201 1.00 0.00 H new ATOM 0 HB3 PHE A 78 4.058 -7.682 0.939 1.00 0.00 H new ATOM 0 HD1 PHE A 78 4.669 -3.998 0.832 1.00 0.00 H new ATOM 0 HD2 PHE A 78 3.313 -7.433 -1.223 1.00 0.00 H new ATOM 0 HE1 PHE A 78 4.057 -2.581 -1.134 1.00 0.00 H new ATOM 0 HE2 PHE A 78 2.700 -6.014 -3.188 1.00 0.00 H new ATOM 0 HZ PHE A 78 3.081 -3.605 -3.120 1.00 0.00 H new ATOM 1243 N VAL A 79 2.783 -7.366 4.263 1.00 0.00 N ATOM 1244 CA VAL A 79 2.658 -8.408 5.268 1.00 0.00 C ATOM 1245 C VAL A 79 2.013 -9.644 4.639 1.00 0.00 C ATOM 1246 O VAL A 79 0.988 -9.540 3.966 1.00 0.00 O ATOM 1247 CB VAL A 79 1.882 -7.878 6.476 1.00 0.00 C ATOM 1248 CG1 VAL A 79 1.581 -9.002 7.470 1.00 0.00 C ATOM 1249 CG2 VAL A 79 2.637 -6.734 7.154 1.00 0.00 C ATOM 0 H VAL A 79 2.015 -6.695 4.246 1.00 0.00 H new ATOM 0 HA VAL A 79 3.641 -8.706 5.634 1.00 0.00 H new ATOM 0 HB VAL A 79 0.931 -7.485 6.117 1.00 0.00 H new ATOM 0 HG11 VAL A 79 1.029 -8.599 8.319 1.00 0.00 H new ATOM 0 HG12 VAL A 79 0.983 -9.770 6.980 1.00 0.00 H new ATOM 0 HG13 VAL A 79 2.516 -9.439 7.820 1.00 0.00 H new ATOM 0 HG21 VAL A 79 2.064 -6.376 8.009 1.00 0.00 H new ATOM 0 HG22 VAL A 79 3.610 -7.090 7.493 1.00 0.00 H new ATOM 0 HG23 VAL A 79 2.777 -5.919 6.444 1.00 0.00 H new ATOM 1259 N ILE A 80 2.640 -10.786 4.879 1.00 0.00 N ATOM 1260 CA ILE A 80 2.140 -12.041 4.344 1.00 0.00 C ATOM 1261 C ILE A 80 1.599 -12.900 5.489 1.00 0.00 C ATOM 1262 O ILE A 80 2.270 -13.081 6.504 1.00 0.00 O ATOM 1263 CB ILE A 80 3.219 -12.736 3.512 1.00 0.00 C ATOM 1264 CG1 ILE A 80 3.973 -11.729 2.641 1.00 0.00 C ATOM 1265 CG2 ILE A 80 2.623 -13.877 2.684 1.00 0.00 C ATOM 1266 CD1 ILE A 80 3.062 -11.151 1.557 1.00 0.00 C ATOM 0 H ILE A 80 3.490 -10.869 5.437 1.00 0.00 H new ATOM 0 HA ILE A 80 1.310 -11.860 3.661 1.00 0.00 H new ATOM 0 HB ILE A 80 3.945 -13.178 4.195 1.00 0.00 H new ATOM 0 HG12 ILE A 80 4.360 -10.922 3.264 1.00 0.00 H new ATOM 0 HG13 ILE A 80 4.832 -12.215 2.178 1.00 0.00 H new ATOM 0 HG21 ILE A 80 3.411 -14.354 2.102 1.00 0.00 H new ATOM 0 HG22 ILE A 80 2.169 -14.611 3.350 1.00 0.00 H new ATOM 0 HG23 ILE A 80 1.864 -13.480 2.010 1.00 0.00 H new ATOM 0 HD11 ILE A 80 3.623 -10.438 0.952 1.00 0.00 H new ATOM 0 HD12 ILE A 80 2.696 -11.957 0.921 1.00 0.00 H new ATOM 0 HD13 ILE A 80 2.217 -10.645 2.024 1.00 0.00 H new ATOM 1278 N LYS A 81 0.390 -13.405 5.288 1.00 0.00 N ATOM 1279 CA LYS A 81 -0.248 -14.239 6.291 1.00 0.00 C ATOM 1280 C LYS A 81 -0.410 -15.658 5.741 1.00 0.00 C ATOM 1281 O LYS A 81 -0.166 -16.634 6.449 1.00 0.00 O ATOM 1282 CB LYS A 81 -1.562 -13.607 6.757 1.00 0.00 C ATOM 1283 CG LYS A 81 -1.374 -12.122 7.073 1.00 0.00 C ATOM 1284 CD LYS A 81 -1.007 -11.916 8.544 1.00 0.00 C ATOM 1285 CE LYS A 81 -2.257 -11.671 9.391 1.00 0.00 C ATOM 1286 NZ LYS A 81 -3.298 -12.677 9.083 1.00 0.00 N ATOM 0 H LYS A 81 -0.164 -13.252 4.445 1.00 0.00 H new ATOM 0 HA LYS A 81 0.378 -14.311 7.180 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -2.321 -13.725 5.983 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -1.926 -14.128 7.643 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -0.591 -11.708 6.438 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -2.291 -11.579 6.844 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -0.477 -12.792 8.917 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -0.328 -11.069 8.638 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -2.001 -11.717 10.449 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -2.643 -10.670 9.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -4.127 -12.516 9.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -3.579 -12.592 8.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -2.921 -13.631 9.256 1.00 0.00 H new ATOM 1300 N ARG A 82 -0.820 -15.727 4.483 1.00 0.00 N ATOM 1301 CA ARG A 82 -1.017 -17.009 3.829 1.00 0.00 C ATOM 1302 C ARG A 82 -0.430 -16.981 2.416 1.00 0.00 C ATOM 1303 O ARG A 82 -1.101 -16.572 1.470 1.00 0.00 O ATOM 1304 CB ARG A 82 -2.503 -17.365 3.750 1.00 0.00 C ATOM 1305 CG ARG A 82 -3.056 -17.720 5.131 1.00 0.00 C ATOM 1306 CD ARG A 82 -4.327 -18.563 5.012 1.00 0.00 C ATOM 1307 NE ARG A 82 -4.022 -19.982 5.305 1.00 0.00 N ATOM 1308 CZ ARG A 82 -3.730 -20.451 6.526 1.00 0.00 C ATOM 1309 NH1 ARG A 82 -3.700 -19.617 7.575 1.00 0.00 N ATOM 1310 NH2 ARG A 82 -3.466 -21.753 6.698 1.00 0.00 N ATOM 0 H ARG A 82 -1.021 -14.915 3.899 1.00 0.00 H new ATOM 0 HA ARG A 82 -0.505 -17.766 4.423 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -3.060 -16.525 3.336 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -2.643 -18.206 3.071 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -2.304 -18.268 5.698 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -3.271 -16.807 5.686 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -5.084 -18.195 5.704 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -4.742 -18.471 4.008 1.00 0.00 H new ATOM 0 HE ARG A 82 -4.035 -20.644 4.529 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -3.899 -18.625 7.444 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -3.478 -19.974 8.504 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -3.487 -22.387 5.900 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -3.244 -22.110 7.627 1.00 0.00 H new ATOM 1324 N PRO A 83 0.849 -17.431 2.316 1.00 0.00 N ATOM 1325 CA PRO A 83 1.534 -17.461 1.035 1.00 0.00 C ATOM 1326 C PRO A 83 1.023 -18.613 0.167 1.00 0.00 C ATOM 1327 O PRO A 83 1.260 -18.638 -1.040 1.00 0.00 O ATOM 1328 CB PRO A 83 3.009 -17.586 1.379 1.00 0.00 C ATOM 1329 CG PRO A 83 3.061 -18.088 2.813 1.00 0.00 C ATOM 1330 CD PRO A 83 1.675 -17.923 3.415 1.00 0.00 C ATOM 0 HA PRO A 83 1.352 -16.566 0.440 1.00 0.00 H new ATOM 0 HB2 PRO A 83 3.510 -18.280 0.704 1.00 0.00 H new ATOM 0 HB3 PRO A 83 3.515 -16.626 1.283 1.00 0.00 H new ATOM 0 HG2 PRO A 83 3.367 -19.134 2.841 1.00 0.00 H new ATOM 0 HG3 PRO A 83 3.796 -17.525 3.388 1.00 0.00 H new ATOM 0 HD2 PRO A 83 1.296 -18.869 3.802 1.00 0.00 H new ATOM 0 HD3 PRO A 83 1.686 -17.220 4.248 1.00 0.00 H new ATOM 1338 N GLU A 84 0.331 -19.539 0.815 1.00 0.00 N ATOM 1339 CA GLU A 84 -0.215 -20.691 0.118 1.00 0.00 C ATOM 1340 C GLU A 84 -1.211 -20.240 -0.952 1.00 0.00 C ATOM 1341 O GLU A 84 -1.430 -20.943 -1.937 1.00 0.00 O ATOM 1342 CB GLU A 84 -0.868 -21.666 1.099 1.00 0.00 C ATOM 1343 CG GLU A 84 -2.114 -21.050 1.737 1.00 0.00 C ATOM 1344 CD GLU A 84 -3.099 -22.136 2.176 1.00 0.00 C ATOM 1345 OE1 GLU A 84 -2.636 -23.087 2.842 1.00 0.00 O ATOM 1346 OE2 GLU A 84 -4.293 -21.991 1.835 1.00 0.00 O ATOM 0 H GLU A 84 0.136 -19.515 1.816 1.00 0.00 H new ATOM 0 HA GLU A 84 0.604 -21.216 -0.374 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -1.138 -22.585 0.578 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -0.154 -21.938 1.876 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -1.826 -20.446 2.597 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -2.598 -20.381 1.026 1.00 0.00 H new ATOM 1353 N LEU A 85 -1.788 -19.069 -0.723 1.00 0.00 N ATOM 1354 CA LEU A 85 -2.756 -18.516 -1.655 1.00 0.00 C ATOM 1355 C LEU A 85 -2.045 -18.135 -2.955 1.00 0.00 C ATOM 1356 O LEU A 85 -2.543 -18.415 -4.044 1.00 0.00 O ATOM 1357 CB LEU A 85 -3.520 -17.359 -1.010 1.00 0.00 C ATOM 1358 CG LEU A 85 -4.349 -17.709 0.228 1.00 0.00 C ATOM 1359 CD1 LEU A 85 -4.976 -16.455 0.841 1.00 0.00 C ATOM 1360 CD2 LEU A 85 -5.398 -18.773 -0.098 1.00 0.00 C ATOM 0 H LEU A 85 -1.603 -18.488 0.095 1.00 0.00 H new ATOM 0 HA LEU A 85 -3.509 -19.262 -1.910 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -2.803 -16.585 -0.736 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -4.185 -16.927 -1.758 1.00 0.00 H new ATOM 0 HG LEU A 85 -3.681 -18.134 0.977 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -5.560 -16.732 1.719 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -4.189 -15.760 1.133 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -5.627 -15.978 0.108 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -5.973 -19.004 0.799 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -6.068 -18.399 -0.872 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -4.902 -19.676 -0.453 1.00 0.00 H new ATOM 1372 N LEU A 86 -0.892 -17.501 -2.798 1.00 0.00 N ATOM 1373 CA LEU A 86 -0.108 -17.079 -3.946 1.00 0.00 C ATOM 1374 C LEU A 86 -0.110 -18.191 -4.997 1.00 0.00 C ATOM 1375 O LEU A 86 -0.012 -17.920 -6.193 1.00 0.00 O ATOM 1376 CB LEU A 86 1.294 -16.650 -3.508 1.00 0.00 C ATOM 1377 CG LEU A 86 1.359 -15.517 -2.481 1.00 0.00 C ATOM 1378 CD1 LEU A 86 2.795 -15.291 -2.004 1.00 0.00 C ATOM 1379 CD2 LEU A 86 0.731 -14.237 -3.037 1.00 0.00 C ATOM 0 H LEU A 86 -0.482 -17.269 -1.893 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.555 -16.200 -4.411 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.805 -17.519 -3.094 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.852 -16.344 -4.393 1.00 0.00 H new ATOM 0 HG LEU A 86 0.773 -15.811 -1.610 1.00 0.00 H new ATOM 0 HD11 LEU A 86 2.813 -14.481 -1.275 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.173 -16.203 -1.542 1.00 0.00 H new ATOM 0 HD13 LEU A 86 3.424 -15.028 -2.855 1.00 0.00 H new ATOM 0 HD21 LEU A 86 0.790 -13.448 -2.288 1.00 0.00 H new ATOM 0 HD22 LEU A 86 1.269 -13.928 -3.933 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.314 -14.423 -3.287 1.00 0.00 H new ATOM 1391 N THR A 87 -0.224 -19.419 -4.513 1.00 0.00 N ATOM 1392 CA THR A 87 -0.241 -20.573 -5.396 1.00 0.00 C ATOM 1393 C THR A 87 -0.655 -21.828 -4.625 1.00 0.00 C ATOM 1394 O THR A 87 -1.650 -22.467 -4.961 1.00 0.00 O ATOM 1395 CB THR A 87 1.138 -20.688 -6.049 1.00 0.00 C ATOM 1396 OG1 THR A 87 1.161 -22.010 -6.579 1.00 0.00 O ATOM 1397 CG2 THR A 87 2.274 -20.676 -5.025 1.00 0.00 C ATOM 0 H THR A 87 -0.306 -19.640 -3.521 1.00 0.00 H new ATOM 0 HA THR A 87 -0.982 -20.456 -6.186 1.00 0.00 H new ATOM 0 HB THR A 87 1.276 -19.867 -6.753 1.00 0.00 H new ATOM 0 HG1 THR A 87 2.020 -22.170 -7.022 1.00 0.00 H new ATOM 0 HG21 THR A 87 3.230 -20.760 -5.541 1.00 0.00 H new ATOM 0 HG22 THR A 87 2.246 -19.743 -4.462 1.00 0.00 H new ATOM 0 HG23 THR A 87 2.156 -21.516 -4.341 1.00 0.00 H new ATOM 1405 N GLU A 88 0.130 -22.143 -3.605 1.00 0.00 N ATOM 1406 CA GLU A 88 -0.142 -23.310 -2.784 1.00 0.00 C ATOM 1407 C GLU A 88 0.829 -23.367 -1.603 1.00 0.00 C ATOM 1408 O GLU A 88 0.437 -23.708 -0.488 1.00 0.00 O ATOM 1409 CB GLU A 88 -0.071 -24.593 -3.614 1.00 0.00 C ATOM 1410 CG GLU A 88 1.382 -24.983 -3.897 1.00 0.00 C ATOM 1411 CD GLU A 88 1.452 -26.216 -4.800 1.00 0.00 C ATOM 1412 OE1 GLU A 88 1.449 -26.017 -6.034 1.00 0.00 O ATOM 1413 OE2 GLU A 88 1.508 -27.330 -4.236 1.00 0.00 O ATOM 0 H GLU A 88 0.955 -21.610 -3.329 1.00 0.00 H new ATOM 0 HA GLU A 88 -1.156 -23.225 -2.392 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -0.572 -25.402 -3.083 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -0.603 -24.452 -4.555 1.00 0.00 H new ATOM 0 HG2 GLU A 88 1.900 -24.150 -4.372 1.00 0.00 H new ATOM 0 HG3 GLU A 88 1.898 -25.185 -2.958 1.00 0.00 H new ATOM 1420 N GLY A 89 2.077 -23.027 -1.887 1.00 0.00 N ATOM 1421 CA GLY A 89 3.107 -23.034 -0.863 1.00 0.00 C ATOM 1422 C GLY A 89 4.497 -23.192 -1.483 1.00 0.00 C ATOM 1423 O GLY A 89 4.697 -22.879 -2.655 1.00 0.00 O ATOM 0 H GLY A 89 2.399 -22.745 -2.813 1.00 0.00 H new ATOM 0 HA2 GLY A 89 3.063 -22.107 -0.292 1.00 0.00 H new ATOM 0 HA3 GLY A 89 2.923 -23.849 -0.163 1.00 0.00 H new ATOM 1427 N VAL A 90 5.422 -23.678 -0.668 1.00 0.00 N ATOM 1428 CA VAL A 90 6.787 -23.881 -1.122 1.00 0.00 C ATOM 1429 C VAL A 90 6.796 -24.917 -2.248 1.00 0.00 C ATOM 1430 O VAL A 90 6.616 -26.109 -2.002 1.00 0.00 O ATOM 1431 CB VAL A 90 7.678 -24.274 0.058 1.00 0.00 C ATOM 1432 CG1 VAL A 90 9.047 -24.758 -0.425 1.00 0.00 C ATOM 1433 CG2 VAL A 90 7.824 -23.113 1.044 1.00 0.00 C ATOM 0 H VAL A 90 5.253 -23.937 0.304 1.00 0.00 H new ATOM 0 HA VAL A 90 7.196 -22.956 -1.527 1.00 0.00 H new ATOM 0 HB VAL A 90 7.196 -25.100 0.581 1.00 0.00 H new ATOM 0 HG11 VAL A 90 9.660 -25.031 0.434 1.00 0.00 H new ATOM 0 HG12 VAL A 90 8.919 -25.627 -1.070 1.00 0.00 H new ATOM 0 HG13 VAL A 90 9.538 -23.961 -0.983 1.00 0.00 H new ATOM 0 HG21 VAL A 90 8.462 -23.418 1.873 1.00 0.00 H new ATOM 0 HG22 VAL A 90 8.272 -22.259 0.537 1.00 0.00 H new ATOM 0 HG23 VAL A 90 6.842 -22.834 1.425 1.00 0.00 H new ATOM 1443 N LYS A 91 7.008 -24.425 -3.460 1.00 0.00 N ATOM 1444 CA LYS A 91 7.043 -25.293 -4.625 1.00 0.00 C ATOM 1445 C LYS A 91 7.028 -24.437 -5.893 1.00 0.00 C ATOM 1446 O LYS A 91 6.037 -23.770 -6.184 1.00 0.00 O ATOM 1447 CB LYS A 91 5.911 -26.320 -4.562 1.00 0.00 C ATOM 1448 CG LYS A 91 6.460 -27.727 -4.320 1.00 0.00 C ATOM 1449 CD LYS A 91 6.737 -28.443 -5.644 1.00 0.00 C ATOM 1450 CE LYS A 91 8.241 -28.543 -5.909 1.00 0.00 C ATOM 1451 NZ LYS A 91 8.737 -29.896 -5.573 1.00 0.00 N ATOM 0 H LYS A 91 7.157 -23.436 -3.660 1.00 0.00 H new ATOM 0 HA LYS A 91 7.966 -25.872 -4.642 1.00 0.00 H new ATOM 0 HB2 LYS A 91 5.218 -26.054 -3.764 1.00 0.00 H new ATOM 0 HB3 LYS A 91 5.346 -26.302 -5.494 1.00 0.00 H new ATOM 0 HG2 LYS A 91 7.378 -27.667 -3.736 1.00 0.00 H new ATOM 0 HG3 LYS A 91 5.745 -28.304 -3.733 1.00 0.00 H new ATOM 0 HD2 LYS A 91 6.301 -29.442 -5.620 1.00 0.00 H new ATOM 0 HD3 LYS A 91 6.255 -27.905 -6.460 1.00 0.00 H new ATOM 0 HE2 LYS A 91 8.447 -28.323 -6.957 1.00 0.00 H new ATOM 0 HE3 LYS A 91 8.771 -27.797 -5.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 9.759 -29.947 -5.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 8.557 -30.092 -4.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 8.244 -30.601 -6.157 1.00 0.00 H new ATOM 1465 N GLU A 92 8.139 -24.485 -6.614 1.00 0.00 N ATOM 1466 CA GLU A 92 8.266 -23.723 -7.845 1.00 0.00 C ATOM 1467 C GLU A 92 9.525 -24.148 -8.604 1.00 0.00 C ATOM 1468 O GLU A 92 10.552 -23.476 -8.534 1.00 0.00 O ATOM 1469 CB GLU A 92 8.278 -22.220 -7.560 1.00 0.00 C ATOM 1470 CG GLU A 92 7.409 -21.464 -8.568 1.00 0.00 C ATOM 1471 CD GLU A 92 6.665 -20.310 -7.893 1.00 0.00 C ATOM 1472 OE1 GLU A 92 6.140 -20.545 -6.783 1.00 0.00 O ATOM 1473 OE2 GLU A 92 6.639 -19.219 -8.502 1.00 0.00 O ATOM 0 H GLU A 92 8.959 -25.040 -6.369 1.00 0.00 H new ATOM 0 HA GLU A 92 7.399 -23.933 -8.472 1.00 0.00 H new ATOM 0 HB2 GLU A 92 7.914 -22.035 -6.549 1.00 0.00 H new ATOM 0 HB3 GLU A 92 9.301 -21.846 -7.604 1.00 0.00 H new ATOM 0 HG2 GLU A 92 8.033 -21.077 -9.374 1.00 0.00 H new ATOM 0 HG3 GLU A 92 6.692 -22.149 -9.021 1.00 0.00 H new ATOM 1480 N PRO A 93 9.399 -25.290 -9.332 1.00 0.00 N ATOM 1481 CA PRO A 93 10.514 -25.812 -10.104 1.00 0.00 C ATOM 1482 C PRO A 93 10.736 -24.987 -11.373 1.00 0.00 C ATOM 1483 O PRO A 93 11.496 -24.020 -11.364 1.00 0.00 O ATOM 1484 CB PRO A 93 10.150 -27.259 -10.392 1.00 0.00 C ATOM 1485 CG PRO A 93 8.649 -27.362 -10.175 1.00 0.00 C ATOM 1486 CD PRO A 93 8.197 -26.112 -9.438 1.00 0.00 C ATOM 0 HA PRO A 93 11.461 -25.753 -9.568 1.00 0.00 H new ATOM 0 HB2 PRO A 93 10.417 -27.533 -11.413 1.00 0.00 H new ATOM 0 HB3 PRO A 93 10.688 -27.937 -9.729 1.00 0.00 H new ATOM 0 HG2 PRO A 93 8.131 -27.450 -11.130 1.00 0.00 H new ATOM 0 HG3 PRO A 93 8.407 -28.254 -9.597 1.00 0.00 H new ATOM 0 HD2 PRO A 93 7.409 -25.593 -9.984 1.00 0.00 H new ATOM 0 HD3 PRO A 93 7.796 -26.355 -8.454 1.00 0.00 H new ATOM 1494 N SER A 94 10.059 -25.399 -12.434 1.00 0.00 N ATOM 1495 CA SER A 94 10.172 -24.711 -13.709 1.00 0.00 C ATOM 1496 C SER A 94 8.927 -24.974 -14.559 1.00 0.00 C ATOM 1497 O SER A 94 8.449 -26.105 -14.632 1.00 0.00 O ATOM 1498 CB SER A 94 11.431 -25.148 -14.461 1.00 0.00 C ATOM 1499 OG SER A 94 12.438 -24.140 -14.447 1.00 0.00 O ATOM 0 H SER A 94 9.429 -26.202 -12.437 1.00 0.00 H new ATOM 0 HA SER A 94 10.251 -23.641 -13.514 1.00 0.00 H new ATOM 0 HB2 SER A 94 11.824 -26.059 -14.011 1.00 0.00 H new ATOM 0 HB3 SER A 94 11.172 -25.388 -15.492 1.00 0.00 H new ATOM 0 HG SER A 94 13.226 -24.458 -14.936 1.00 0.00 H new ATOM 1505 N GLY A 95 8.438 -23.911 -15.180 1.00 0.00 N ATOM 1506 CA GLY A 95 7.258 -24.013 -16.022 1.00 0.00 C ATOM 1507 C GLY A 95 7.612 -23.781 -17.492 1.00 0.00 C ATOM 1508 O GLY A 95 7.724 -22.639 -17.935 1.00 0.00 O ATOM 0 H GLY A 95 8.837 -22.975 -15.117 1.00 0.00 H new ATOM 0 HA2 GLY A 95 6.807 -24.998 -15.904 1.00 0.00 H new ATOM 0 HA3 GLY A 95 6.515 -23.282 -15.703 1.00 0.00 H new ATOM 1512 N PRO A 96 7.784 -24.913 -18.227 1.00 0.00 N ATOM 1513 CA PRO A 96 8.123 -24.844 -19.638 1.00 0.00 C ATOM 1514 C PRO A 96 6.907 -24.443 -20.476 1.00 0.00 C ATOM 1515 O PRO A 96 5.822 -24.227 -19.937 1.00 0.00 O ATOM 1516 CB PRO A 96 8.652 -26.226 -19.984 1.00 0.00 C ATOM 1517 CG PRO A 96 8.158 -27.149 -18.881 1.00 0.00 C ATOM 1518 CD PRO A 96 7.660 -26.282 -17.736 1.00 0.00 C ATOM 0 HA PRO A 96 8.870 -24.080 -19.853 1.00 0.00 H new ATOM 0 HB2 PRO A 96 8.287 -26.551 -20.958 1.00 0.00 H new ATOM 0 HB3 PRO A 96 9.741 -26.226 -20.035 1.00 0.00 H new ATOM 0 HG2 PRO A 96 7.358 -27.791 -19.250 1.00 0.00 H new ATOM 0 HG3 PRO A 96 8.961 -27.804 -18.543 1.00 0.00 H new ATOM 0 HD2 PRO A 96 6.627 -26.519 -17.480 1.00 0.00 H new ATOM 0 HD3 PRO A 96 8.255 -26.435 -16.836 1.00 0.00 H new ATOM 1526 N SER A 97 7.128 -24.355 -21.779 1.00 0.00 N ATOM 1527 CA SER A 97 6.064 -23.984 -22.696 1.00 0.00 C ATOM 1528 C SER A 97 6.336 -24.575 -24.080 1.00 0.00 C ATOM 1529 O SER A 97 7.461 -24.514 -24.575 1.00 0.00 O ATOM 1530 CB SER A 97 5.920 -22.463 -22.786 1.00 0.00 C ATOM 1531 OG SER A 97 5.144 -21.936 -21.714 1.00 0.00 O ATOM 0 H SER A 97 8.029 -24.534 -22.222 1.00 0.00 H new ATOM 0 HA SER A 97 5.127 -24.388 -22.314 1.00 0.00 H new ATOM 0 HB2 SER A 97 6.909 -22.004 -22.778 1.00 0.00 H new ATOM 0 HB3 SER A 97 5.454 -22.199 -23.735 1.00 0.00 H new ATOM 0 HG SER A 97 5.195 -22.541 -20.945 1.00 0.00 H new ATOM 1537 N SER A 98 5.288 -25.134 -24.667 1.00 0.00 N ATOM 1538 CA SER A 98 5.400 -25.735 -25.985 1.00 0.00 C ATOM 1539 C SER A 98 4.046 -26.302 -26.418 1.00 0.00 C ATOM 1540 O SER A 98 3.352 -26.935 -25.624 1.00 0.00 O ATOM 1541 CB SER A 98 6.465 -26.833 -26.001 1.00 0.00 C ATOM 1542 OG SER A 98 6.117 -27.927 -25.157 1.00 0.00 O ATOM 0 H SER A 98 4.357 -25.183 -24.254 1.00 0.00 H new ATOM 0 HA SER A 98 5.705 -24.961 -26.689 1.00 0.00 H new ATOM 0 HB2 SER A 98 6.601 -27.191 -27.021 1.00 0.00 H new ATOM 0 HB3 SER A 98 7.420 -26.417 -25.680 1.00 0.00 H new ATOM 0 HG SER A 98 6.821 -28.607 -25.196 1.00 0.00 H new ATOM 1548 N GLY A 99 3.713 -26.055 -27.676 1.00 0.00 N ATOM 1549 CA GLY A 99 2.455 -26.534 -28.224 1.00 0.00 C ATOM 1550 C GLY A 99 2.399 -26.318 -29.738 1.00 0.00 C ATOM 1551 O GLY A 99 2.586 -25.200 -30.217 1.00 0.00 O ATOM 0 H GLY A 99 4.292 -25.530 -28.331 1.00 0.00 H new ATOM 0 HA2 GLY A 99 2.337 -27.594 -28.000 1.00 0.00 H new ATOM 0 HA3 GLY A 99 1.625 -26.013 -27.748 1.00 0.00 H new TER 1555 GLY A 99