USER MOD reduce.3.24.130724 H: found=0, std=0, add=623, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 623 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 3 THR OG1 : rot 21:sc= 0.453 USER MOD Single : A 5 THR OG1 : rot -57:sc= 0.27 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= -0.184 K(o=-0.18,f=-3.6!) USER MOD Single : A 13 LYS NZ :NH3+ -171:sc= 1.08 (180deg=1.01) USER MOD Single : A 16 THR OG1 : rot 180:sc= -0.113 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 ASN : amide:sc= -0.315 K(o=-0.31,f=-3.5!) USER MOD Single : A 21 ASN : amide:sc= -0.21 K(o=-0.21,f=-2.3!) USER MOD Single : A 24 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 151:sc= 0.872 USER MOD Single : A 32 ASN : amide:sc= -0.142 X(o=-0.14,f=-0.0002) USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 38 LYS NZ :NH3+ -177:sc= 1.09 (180deg=1.07) USER MOD Single : A 39 GLN : amide:sc= 0.256 K(o=0.26,f=-5.1!) USER MOD Single : A 42 SER OG : rot -112:sc= 0.499 USER MOD Single : A 44 SER OG : rot 4:sc= 0.544 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 75:sc= 0.06 USER MOD Single : A 53 TYR OH : rot 31:sc= 0.812 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ -164:sc= -0.0626 (180deg=-0.287) USER MOD Single : A 63 THR OG1 : rot 180:sc= -0.0159 USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 ASN : amide:sc= -0.357 X(o=-0.36,f=0) USER MOD Single : A 74 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 78 GLN : amide:sc= 0.923 K(o=0.92,f=-1.2) USER MOD Single : A 79 ASN : amide:sc= -2.25 K(o=-2.2,f=-0.52) USER MOD Single : A 81 GLN : amide:sc= 1.13 K(o=1.1,f=-0.041) USER MOD ----------------------------------------------------------------- ATOM 35 N THR A 3 5.787 -18.559 -16.706 1.00 1.00 N ATOM 36 CA THR A 3 5.528 -18.040 -18.019 1.00 30.00 C ATOM 37 C THR A 3 4.687 -16.814 -17.797 1.00 53.00 C ATOM 38 O THR A 3 3.928 -16.765 -16.804 1.00 75.00 O ATOM 39 CB THR A 3 4.715 -19.085 -18.797 1.00 62.00 C ATOM 40 OG1 THR A 3 5.291 -20.386 -18.569 1.00 25.00 O ATOM 41 CG2 THR A 3 4.748 -18.802 -20.278 1.00 44.00 C ATOM 0 HA THR A 3 6.437 -17.813 -18.575 1.00 30.00 H new ATOM 0 HB THR A 3 3.682 -19.047 -18.452 1.00 62.00 H new ATOM 0 HG1 THR A 3 5.820 -20.370 -17.744 1.00 25.00 H new ATOM 0 HG21 THR A 3 4.165 -19.557 -20.806 1.00 44.00 H new ATOM 0 HG22 THR A 3 4.324 -17.816 -20.470 1.00 44.00 H new ATOM 0 HG23 THR A 3 5.779 -18.828 -20.631 1.00 44.00 H new ATOM 49 N ASP A 4 4.822 -15.818 -18.647 1.00 34.00 N ATOM 50 CA ASP A 4 4.022 -14.625 -18.476 1.00 42.00 C ATOM 51 C ASP A 4 2.577 -15.026 -18.703 1.00 64.00 C ATOM 52 O ASP A 4 2.298 -15.938 -19.490 1.00 74.00 O ATOM 53 CB ASP A 4 4.432 -13.502 -19.446 1.00 70.00 C ATOM 54 CG ASP A 4 5.850 -13.004 -19.286 1.00 41.00 C ATOM 55 OD1 ASP A 4 6.750 -13.559 -19.930 1.00 43.00 O ATOM 56 OD2 ASP A 4 6.080 -12.017 -18.555 1.00 64.00 O ATOM 0 H ASP A 4 5.460 -15.808 -19.443 1.00 34.00 H new ATOM 0 HA ASP A 4 4.171 -14.224 -17.474 1.00 42.00 H new ATOM 0 HB2 ASP A 4 4.302 -13.860 -20.467 1.00 70.00 H new ATOM 0 HB3 ASP A 4 3.751 -12.661 -19.313 1.00 70.00 H new ATOM 61 N THR A 5 1.680 -14.450 -18.001 1.00 43.00 N ATOM 62 CA THR A 5 0.303 -14.812 -18.129 1.00 52.00 C ATOM 63 C THR A 5 -0.537 -13.568 -18.022 1.00 15.00 C ATOM 64 O THR A 5 -0.197 -12.662 -17.290 1.00 32.00 O ATOM 65 CB THR A 5 -0.090 -15.902 -17.071 1.00 50.00 C ATOM 66 OG1 THR A 5 0.712 -17.076 -17.283 1.00 33.00 O ATOM 67 CG2 THR A 5 -1.559 -16.285 -17.159 1.00 65.00 C ATOM 0 H THR A 5 1.867 -13.714 -17.320 1.00 43.00 H new ATOM 0 HA THR A 5 0.122 -15.262 -19.105 1.00 52.00 H new ATOM 0 HB THR A 5 0.087 -15.481 -16.081 1.00 50.00 H new ATOM 0 HG1 THR A 5 0.591 -17.394 -18.202 1.00 33.00 H new ATOM 0 HG21 THR A 5 -1.783 -17.042 -16.407 1.00 65.00 H new ATOM 0 HG22 THR A 5 -2.176 -15.404 -16.982 1.00 65.00 H new ATOM 0 HG23 THR A 5 -1.772 -16.684 -18.151 1.00 65.00 H new ATOM 75 N LEU A 6 -1.602 -13.495 -18.786 1.00 1.00 N ATOM 76 CA LEU A 6 -2.404 -12.303 -18.795 1.00 51.00 C ATOM 77 C LEU A 6 -3.229 -12.145 -17.513 1.00 24.00 C ATOM 78 O LEU A 6 -2.903 -12.726 -16.488 1.00 53.00 O ATOM 79 CB LEU A 6 -3.228 -12.199 -20.079 1.00 41.00 C ATOM 80 CG LEU A 6 -2.404 -12.179 -21.388 1.00 21.00 C ATOM 81 CD1 LEU A 6 -3.240 -11.765 -22.574 1.00 32.00 C ATOM 82 CD2 LEU A 6 -1.159 -11.311 -21.282 1.00 2.00 C ATOM 0 H LEU A 6 -1.927 -14.240 -19.402 1.00 1.00 H new ATOM 0 HA LEU A 6 -1.729 -11.447 -18.799 1.00 51.00 H new ATOM 0 HB2 LEU A 6 -3.921 -13.040 -20.117 1.00 41.00 H new ATOM 0 HB3 LEU A 6 -3.830 -11.292 -20.033 1.00 41.00 H new ATOM 0 HG LEU A 6 -2.073 -13.205 -21.548 1.00 21.00 H new ATOM 0 HD11 LEU A 6 -2.622 -11.764 -23.472 1.00 32.00 H new ATOM 0 HD12 LEU A 6 -4.064 -12.467 -22.701 1.00 32.00 H new ATOM 0 HD13 LEU A 6 -3.638 -10.764 -22.407 1.00 32.00 H new ATOM 0 HD21 LEU A 6 -0.618 -11.333 -22.228 1.00 2.00 H new ATOM 0 HD22 LEU A 6 -1.449 -10.285 -21.054 1.00 2.00 H new ATOM 0 HD23 LEU A 6 -0.516 -11.692 -20.488 1.00 2.00 H new ATOM 94 N GLU A 7 -4.302 -11.393 -17.575 1.00 54.00 N ATOM 95 CA GLU A 7 -4.990 -10.991 -16.376 1.00 24.00 C ATOM 96 C GLU A 7 -5.701 -12.166 -15.759 1.00 24.00 C ATOM 97 O GLU A 7 -5.772 -12.298 -14.552 1.00 51.00 O ATOM 98 CB GLU A 7 -6.003 -9.904 -16.679 1.00 13.00 C ATOM 99 CG GLU A 7 -6.780 -9.519 -15.453 1.00 32.00 C ATOM 100 CD GLU A 7 -7.937 -8.640 -15.736 1.00 65.00 C ATOM 101 OE1 GLU A 7 -8.834 -9.082 -16.453 1.00 53.00 O ATOM 102 OE2 GLU A 7 -7.962 -7.498 -15.243 1.00 23.00 O ATOM 0 H GLU A 7 -4.715 -11.049 -18.442 1.00 54.00 H new ATOM 0 HA GLU A 7 -4.247 -10.606 -15.677 1.00 24.00 H new ATOM 0 HB2 GLU A 7 -5.490 -9.028 -17.076 1.00 13.00 H new ATOM 0 HB3 GLU A 7 -6.689 -10.250 -17.452 1.00 13.00 H new ATOM 0 HG2 GLU A 7 -7.134 -10.424 -14.959 1.00 32.00 H new ATOM 0 HG3 GLU A 7 -6.113 -9.014 -14.754 1.00 32.00 H new ATOM 109 N TYR A 8 -6.165 -13.030 -16.624 1.00 53.00 N ATOM 110 CA TYR A 8 -6.975 -14.186 -16.318 1.00 53.00 C ATOM 111 C TYR A 8 -8.236 -13.922 -15.442 1.00 50.00 C ATOM 112 O TYR A 8 -8.869 -14.868 -14.984 1.00 43.00 O ATOM 113 CB TYR A 8 -6.154 -15.415 -15.827 1.00 23.00 C ATOM 114 CG TYR A 8 -5.337 -15.259 -14.553 1.00 55.00 C ATOM 115 CD1 TYR A 8 -5.921 -15.388 -13.301 1.00 5.00 C ATOM 116 CD2 TYR A 8 -3.979 -14.992 -14.612 1.00 15.00 C ATOM 117 CE1 TYR A 8 -5.174 -15.246 -12.151 1.00 1.00 C ATOM 118 CE2 TYR A 8 -3.227 -14.849 -13.470 1.00 2.00 C ATOM 119 CZ TYR A 8 -3.828 -14.977 -12.243 1.00 50.00 C ATOM 120 OH TYR A 8 -3.080 -14.832 -11.096 1.00 10.00 O ATOM 0 H TYR A 8 -5.977 -12.942 -17.623 1.00 53.00 H new ATOM 0 HA TYR A 8 -7.383 -14.451 -17.293 1.00 53.00 H new ATOM 0 HB2 TYR A 8 -6.847 -16.244 -15.681 1.00 23.00 H new ATOM 0 HB3 TYR A 8 -5.474 -15.705 -16.628 1.00 23.00 H new ATOM 0 HD1 TYR A 8 -6.977 -15.603 -13.226 1.00 5.00 H new ATOM 0 HD2 TYR A 8 -3.501 -14.894 -15.575 1.00 15.00 H new ATOM 0 HE1 TYR A 8 -5.643 -15.345 -11.183 1.00 1.00 H new ATOM 0 HE2 TYR A 8 -2.170 -14.637 -13.538 1.00 2.00 H new ATOM 0 HH TYR A 8 -2.148 -14.646 -11.335 1.00 10.00 H new ATOM 130 N GLN A 9 -8.650 -12.661 -15.308 1.00 31.00 N ATOM 131 CA GLN A 9 -9.753 -12.290 -14.398 1.00 32.00 C ATOM 132 C GLN A 9 -10.702 -11.394 -15.110 1.00 21.00 C ATOM 133 O GLN A 9 -11.371 -10.560 -14.492 1.00 22.00 O ATOM 134 CB GLN A 9 -9.205 -11.515 -13.212 1.00 34.00 C ATOM 135 CG GLN A 9 -8.070 -12.183 -12.526 1.00 31.00 C ATOM 136 CD GLN A 9 -8.440 -13.398 -11.690 1.00 70.00 C ATOM 137 OE1 GLN A 9 -9.374 -14.140 -11.994 1.00 3.00 O ATOM 138 NE2 GLN A 9 -7.739 -13.582 -10.604 1.00 54.00 N ATOM 0 H GLN A 9 -8.243 -11.875 -15.814 1.00 31.00 H new ATOM 0 HA GLN A 9 -10.249 -13.202 -14.066 1.00 32.00 H new ATOM 0 HB2 GLN A 9 -8.882 -10.531 -13.552 1.00 34.00 H new ATOM 0 HB3 GLN A 9 -10.008 -11.356 -12.493 1.00 34.00 H new ATOM 0 HG2 GLN A 9 -7.341 -12.488 -13.277 1.00 31.00 H new ATOM 0 HG3 GLN A 9 -7.578 -11.455 -11.881 1.00 31.00 H new ATOM 0 HE21 GLN A 9 -6.971 -12.950 -10.380 1.00 54.00 H new ATOM 0 HE22 GLN A 9 -7.960 -14.358 -9.980 1.00 54.00 H new ATOM 147 N CYS A 10 -10.788 -11.579 -16.383 1.00 21.00 N ATOM 148 CA CYS A 10 -11.632 -10.735 -17.194 1.00 1.00 C ATOM 149 C CYS A 10 -13.073 -10.969 -16.814 1.00 42.00 C ATOM 150 O CYS A 10 -13.469 -12.107 -16.489 1.00 52.00 O ATOM 151 CB CYS A 10 -11.461 -11.009 -18.685 1.00 62.00 C ATOM 152 SG CYS A 10 -9.804 -10.776 -19.374 1.00 70.00 S ATOM 0 H CYS A 10 -10.288 -12.305 -16.896 1.00 21.00 H new ATOM 0 HA CYS A 10 -11.341 -9.701 -17.010 1.00 1.00 H new ATOM 0 HB2 CYS A 10 -11.768 -12.037 -18.879 1.00 62.00 H new ATOM 0 HB3 CYS A 10 -12.149 -10.363 -19.230 1.00 62.00 H new ATOM 157 N ASP A 11 -13.849 -9.914 -16.856 1.00 51.00 N ATOM 158 CA ASP A 11 -15.269 -9.946 -16.523 1.00 13.00 C ATOM 159 C ASP A 11 -16.032 -10.875 -17.450 1.00 72.00 C ATOM 160 O ASP A 11 -17.093 -11.391 -17.099 1.00 54.00 O ATOM 161 CB ASP A 11 -15.849 -8.525 -16.611 1.00 24.00 C ATOM 162 CG ASP A 11 -17.348 -8.463 -16.399 1.00 14.00 C ATOM 163 OD1 ASP A 11 -17.795 -8.318 -15.243 1.00 34.00 O ATOM 164 OD2 ASP A 11 -18.107 -8.538 -17.389 1.00 32.00 O ATOM 0 H ASP A 11 -13.515 -8.989 -17.126 1.00 51.00 H new ATOM 0 HA ASP A 11 -15.375 -10.325 -15.507 1.00 13.00 H new ATOM 0 HB2 ASP A 11 -15.360 -7.896 -15.867 1.00 24.00 H new ATOM 0 HB3 ASP A 11 -15.612 -8.106 -17.589 1.00 24.00 H new ATOM 169 N GLU A 12 -15.468 -11.116 -18.604 1.00 53.00 N ATOM 170 CA GLU A 12 -16.119 -11.870 -19.593 1.00 0.00 C ATOM 171 C GLU A 12 -15.640 -13.320 -19.646 1.00 24.00 C ATOM 172 O GLU A 12 -16.458 -14.233 -19.756 1.00 4.00 O ATOM 173 CB GLU A 12 -15.970 -11.153 -20.929 1.00 3.00 C ATOM 174 CG GLU A 12 -16.728 -11.763 -22.070 1.00 40.00 C ATOM 175 CD GLU A 12 -16.629 -10.929 -23.314 1.00 72.00 C ATOM 176 OE1 GLU A 12 -15.691 -11.136 -24.117 1.00 13.00 O ATOM 177 OE2 GLU A 12 -17.501 -10.051 -23.507 1.00 2.00 O ATOM 0 H GLU A 12 -14.540 -10.785 -18.867 1.00 53.00 H new ATOM 0 HA GLU A 12 -17.177 -11.941 -19.343 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -16.297 -10.120 -20.807 1.00 3.00 H new ATOM 0 HB3 GLU A 12 -14.912 -11.123 -21.191 1.00 3.00 H new ATOM 0 HG2 GLU A 12 -16.341 -12.762 -22.270 1.00 40.00 H new ATOM 0 HG3 GLU A 12 -17.776 -11.877 -21.791 1.00 40.00 H new ATOM 184 N LYS A 13 -14.344 -13.541 -19.502 1.00 44.00 N ATOM 185 CA LYS A 13 -13.757 -14.869 -19.722 1.00 25.00 C ATOM 186 C LYS A 13 -12.482 -14.926 -18.924 1.00 71.00 C ATOM 187 O LYS A 13 -11.975 -13.883 -18.536 1.00 2.00 O ATOM 188 CB LYS A 13 -13.349 -15.037 -21.217 1.00 42.00 C ATOM 189 CG LYS A 13 -14.441 -14.785 -22.251 1.00 11.00 C ATOM 190 CD LYS A 13 -15.511 -15.876 -22.302 1.00 1.00 C ATOM 191 CE LYS A 13 -14.963 -17.202 -22.814 1.00 40.00 C ATOM 192 NZ LYS A 13 -16.013 -18.233 -22.832 1.00 42.00 N ATOM 0 H LYS A 13 -13.671 -12.823 -19.234 1.00 44.00 H new ATOM 0 HA LYS A 13 -14.476 -15.638 -19.439 1.00 25.00 H new ATOM 0 HB2 LYS A 13 -12.521 -14.359 -21.423 1.00 42.00 H new ATOM 0 HB3 LYS A 13 -12.974 -16.051 -21.357 1.00 42.00 H new ATOM 0 HG2 LYS A 13 -14.920 -13.830 -22.034 1.00 11.00 H new ATOM 0 HG3 LYS A 13 -13.982 -14.694 -23.235 1.00 11.00 H new ATOM 0 HD2 LYS A 13 -15.928 -16.019 -21.305 1.00 1.00 H new ATOM 0 HD3 LYS A 13 -16.328 -15.550 -22.946 1.00 1.00 H new ATOM 0 HE2 LYS A 13 -14.560 -17.070 -23.818 1.00 40.00 H new ATOM 0 HE3 LYS A 13 -14.138 -17.528 -22.180 1.00 40.00 H new ATOM 0 HZ1 LYS A 13 -15.587 -19.159 -23.037 1.00 42.00 H new ATOM 0 HZ2 LYS A 13 -16.483 -18.266 -21.905 1.00 42.00 H new ATOM 0 HZ3 LYS A 13 -16.712 -18.004 -23.567 1.00 42.00 H new ATOM 206 N PRO A 14 -11.941 -16.091 -18.640 1.00 53.00 N ATOM 207 CA PRO A 14 -10.639 -16.165 -18.052 1.00 61.00 C ATOM 208 C PRO A 14 -9.584 -16.003 -19.156 1.00 61.00 C ATOM 209 O PRO A 14 -9.534 -16.783 -20.096 1.00 44.00 O ATOM 210 CB PRO A 14 -10.572 -17.569 -17.427 1.00 0.00 C ATOM 211 CG PRO A 14 -11.894 -18.221 -17.725 1.00 72.00 C ATOM 212 CD PRO A 14 -12.541 -17.418 -18.817 1.00 64.00 C ATOM 0 HA PRO A 14 -10.455 -15.389 -17.309 1.00 61.00 H new ATOM 0 HB2 PRO A 14 -9.749 -18.145 -17.850 1.00 0.00 H new ATOM 0 HB3 PRO A 14 -10.400 -17.510 -16.352 1.00 0.00 H new ATOM 0 HG2 PRO A 14 -11.752 -19.255 -18.039 1.00 72.00 H new ATOM 0 HG3 PRO A 14 -12.524 -18.241 -16.836 1.00 72.00 H new ATOM 0 HD2 PRO A 14 -12.328 -17.830 -19.803 1.00 64.00 H new ATOM 0 HD3 PRO A 14 -13.625 -17.390 -18.711 1.00 64.00 H new ATOM 220 N LEU A 15 -8.759 -14.995 -19.049 1.00 72.00 N ATOM 221 CA LEU A 15 -7.774 -14.728 -20.056 1.00 1.00 C ATOM 222 C LEU A 15 -6.469 -15.239 -19.570 1.00 12.00 C ATOM 223 O LEU A 15 -5.586 -14.476 -19.126 1.00 3.00 O ATOM 224 CB LEU A 15 -7.693 -13.235 -20.376 1.00 23.00 C ATOM 225 CG LEU A 15 -6.598 -12.796 -21.355 1.00 53.00 C ATOM 226 CD1 LEU A 15 -6.754 -13.472 -22.693 1.00 52.00 C ATOM 227 CD2 LEU A 15 -6.594 -11.295 -21.508 1.00 33.00 C ATOM 0 H LEU A 15 -8.753 -14.342 -18.266 1.00 72.00 H new ATOM 0 HA LEU A 15 -8.051 -15.231 -20.982 1.00 1.00 H new ATOM 0 HB2 LEU A 15 -8.656 -12.922 -20.780 1.00 23.00 H new ATOM 0 HB3 LEU A 15 -7.549 -12.694 -19.441 1.00 23.00 H new ATOM 0 HG LEU A 15 -5.637 -13.102 -20.942 1.00 53.00 H new ATOM 0 HD11 LEU A 15 -5.962 -13.139 -23.364 1.00 52.00 H new ATOM 0 HD12 LEU A 15 -6.690 -14.552 -22.564 1.00 52.00 H new ATOM 0 HD13 LEU A 15 -7.723 -13.214 -23.120 1.00 52.00 H new ATOM 0 HD21 LEU A 15 -5.810 -11.003 -22.207 1.00 33.00 H new ATOM 0 HD22 LEU A 15 -7.561 -10.965 -21.889 1.00 33.00 H new ATOM 0 HD23 LEU A 15 -6.408 -10.831 -20.539 1.00 33.00 H new ATOM 239 N THR A 16 -6.376 -16.504 -19.536 1.00 25.00 N ATOM 240 CA THR A 16 -5.220 -17.100 -19.046 1.00 30.00 C ATOM 241 C THR A 16 -4.368 -17.553 -20.225 1.00 73.00 C ATOM 242 O THR A 16 -4.815 -18.343 -21.060 1.00 3.00 O ATOM 243 CB THR A 16 -5.565 -18.269 -18.131 1.00 22.00 C ATOM 244 OG1 THR A 16 -6.801 -17.966 -17.437 1.00 20.00 O ATOM 245 CG2 THR A 16 -4.468 -18.418 -17.105 1.00 44.00 C ATOM 0 H THR A 16 -7.101 -17.151 -19.848 1.00 25.00 H new ATOM 0 HA THR A 16 -4.656 -16.381 -18.451 1.00 30.00 H new ATOM 0 HB THR A 16 -5.670 -19.184 -18.713 1.00 22.00 H new ATOM 0 HG1 THR A 16 -7.035 -18.712 -16.846 1.00 20.00 H new ATOM 0 HG21 THR A 16 -4.701 -19.251 -16.442 1.00 44.00 H new ATOM 0 HG22 THR A 16 -3.521 -18.609 -17.610 1.00 44.00 H new ATOM 0 HG23 THR A 16 -4.389 -17.501 -16.521 1.00 44.00 H new ATOM 253 N VAL A 17 -3.170 -17.031 -20.305 1.00 33.00 N ATOM 254 CA VAL A 17 -2.302 -17.260 -21.437 1.00 61.00 C ATOM 255 C VAL A 17 -0.917 -17.627 -20.958 1.00 61.00 C ATOM 256 O VAL A 17 -0.443 -17.048 -20.013 1.00 63.00 O ATOM 257 CB VAL A 17 -2.164 -15.954 -22.275 1.00 41.00 C ATOM 258 CG1 VAL A 17 -1.284 -16.167 -23.478 1.00 53.00 C ATOM 259 CG2 VAL A 17 -3.512 -15.417 -22.705 1.00 35.00 C ATOM 0 H VAL A 17 -2.766 -16.432 -19.585 1.00 33.00 H new ATOM 0 HA VAL A 17 -2.733 -18.062 -22.036 1.00 61.00 H new ATOM 0 HB VAL A 17 -1.695 -15.212 -21.628 1.00 41.00 H new ATOM 0 HG11 VAL A 17 -1.208 -15.237 -24.042 1.00 53.00 H new ATOM 0 HG12 VAL A 17 -0.291 -16.476 -23.152 1.00 53.00 H new ATOM 0 HG13 VAL A 17 -1.716 -16.942 -24.112 1.00 53.00 H new ATOM 0 HG21 VAL A 17 -3.372 -14.506 -23.287 1.00 35.00 H new ATOM 0 HG22 VAL A 17 -4.023 -16.162 -23.315 1.00 35.00 H new ATOM 0 HG23 VAL A 17 -4.113 -15.196 -21.823 1.00 35.00 H new ATOM 269 N LYS A 18 -0.275 -18.566 -21.608 1.00 73.00 N ATOM 270 CA LYS A 18 1.091 -18.851 -21.324 1.00 52.00 C ATOM 271 C LYS A 18 1.867 -18.122 -22.341 1.00 43.00 C ATOM 272 O LYS A 18 2.044 -18.598 -23.454 1.00 52.00 O ATOM 273 CB LYS A 18 1.442 -20.339 -21.397 1.00 53.00 C ATOM 274 CG LYS A 18 1.133 -21.164 -20.166 1.00 12.00 C ATOM 275 CD LYS A 18 -0.332 -21.222 -19.819 1.00 62.00 C ATOM 276 CE LYS A 18 -0.512 -22.090 -18.583 1.00 34.00 C ATOM 277 NZ LYS A 18 -1.909 -22.196 -18.138 1.00 54.00 N ATOM 0 H LYS A 18 -0.688 -19.144 -22.340 1.00 73.00 H new ATOM 0 HA LYS A 18 1.312 -18.549 -20.300 1.00 52.00 H new ATOM 0 HB2 LYS A 18 0.910 -20.775 -22.243 1.00 53.00 H new ATOM 0 HB3 LYS A 18 2.507 -20.429 -21.610 1.00 53.00 H new ATOM 0 HG2 LYS A 18 1.500 -22.179 -20.320 1.00 12.00 H new ATOM 0 HG3 LYS A 18 1.681 -20.752 -19.318 1.00 12.00 H new ATOM 0 HD2 LYS A 18 -0.715 -20.219 -19.634 1.00 62.00 H new ATOM 0 HD3 LYS A 18 -0.901 -21.632 -20.653 1.00 62.00 H new ATOM 0 HE2 LYS A 18 -0.129 -23.089 -18.792 1.00 34.00 H new ATOM 0 HE3 LYS A 18 0.089 -21.681 -17.771 1.00 34.00 H new ATOM 0 HZ1 LYS A 18 -1.959 -22.801 -17.293 1.00 54.00 H new ATOM 0 HZ2 LYS A 18 -2.273 -21.249 -17.908 1.00 54.00 H new ATOM 0 HZ3 LYS A 18 -2.484 -22.613 -18.897 1.00 54.00 H new ATOM 291 N LEU A 19 2.244 -16.962 -21.997 1.00 31.00 N ATOM 292 CA LEU A 19 2.907 -16.102 -22.834 1.00 41.00 C ATOM 293 C LEU A 19 4.360 -16.409 -22.783 1.00 51.00 C ATOM 294 O LEU A 19 5.069 -16.004 -21.855 1.00 22.00 O ATOM 295 CB LEU A 19 2.637 -14.719 -22.342 1.00 52.00 C ATOM 296 CG LEU A 19 3.338 -13.587 -23.047 1.00 12.00 C ATOM 297 CD1 LEU A 19 3.040 -13.586 -24.540 1.00 63.00 C ATOM 298 CD2 LEU A 19 2.972 -12.252 -22.426 1.00 63.00 C ATOM 0 H LEU A 19 2.081 -16.579 -21.066 1.00 31.00 H new ATOM 0 HA LEU A 19 2.575 -16.200 -23.867 1.00 41.00 H new ATOM 0 HB2 LEU A 19 1.563 -14.542 -22.404 1.00 52.00 H new ATOM 0 HB3 LEU A 19 2.906 -14.678 -21.287 1.00 52.00 H new ATOM 0 HG LEU A 19 4.410 -13.741 -22.924 1.00 12.00 H new ATOM 0 HD11 LEU A 19 3.563 -12.756 -25.015 1.00 63.00 H new ATOM 0 HD12 LEU A 19 3.377 -14.525 -24.979 1.00 63.00 H new ATOM 0 HD13 LEU A 19 1.967 -13.476 -24.697 1.00 63.00 H new ATOM 0 HD21 LEU A 19 3.491 -11.451 -22.953 1.00 63.00 H new ATOM 0 HD22 LEU A 19 1.896 -12.098 -22.502 1.00 63.00 H new ATOM 0 HD23 LEU A 19 3.266 -12.246 -21.376 1.00 63.00 H new ATOM 310 N ASN A 20 4.794 -17.179 -23.712 1.00 43.00 N ATOM 311 CA ASN A 20 6.186 -17.489 -23.786 1.00 63.00 C ATOM 312 C ASN A 20 6.817 -16.391 -24.603 1.00 22.00 C ATOM 313 O ASN A 20 6.955 -16.498 -25.827 1.00 73.00 O ATOM 314 CB ASN A 20 6.450 -18.892 -24.390 1.00 21.00 C ATOM 315 CG ASN A 20 7.907 -19.341 -24.290 1.00 24.00 C ATOM 316 OD1 ASN A 20 8.834 -18.543 -24.337 1.00 54.00 O ATOM 317 ND2 ASN A 20 8.111 -20.630 -24.150 1.00 43.00 N ATOM 0 H ASN A 20 4.213 -17.608 -24.433 1.00 43.00 H new ATOM 0 HA ASN A 20 6.623 -17.535 -22.789 1.00 63.00 H new ATOM 0 HB2 ASN A 20 5.819 -19.621 -23.882 1.00 21.00 H new ATOM 0 HB3 ASN A 20 6.152 -18.888 -25.438 1.00 21.00 H new ATOM 0 HD21 ASN A 20 9.062 -20.991 -24.077 1.00 43.00 H new ATOM 0 HD22 ASN A 20 7.318 -21.271 -24.114 1.00 43.00 H new ATOM 324 N ASN A 21 7.101 -15.308 -23.913 1.00 72.00 N ATOM 325 CA ASN A 21 7.595 -14.061 -24.490 1.00 13.00 C ATOM 326 C ASN A 21 8.793 -14.282 -25.441 1.00 74.00 C ATOM 327 O ASN A 21 8.700 -13.930 -26.625 1.00 34.00 O ATOM 328 CB ASN A 21 7.952 -13.071 -23.359 1.00 2.00 C ATOM 329 CG ASN A 21 8.241 -11.637 -23.815 1.00 53.00 C ATOM 330 OD1 ASN A 21 8.685 -11.384 -24.924 1.00 42.00 O ATOM 331 ND2 ASN A 21 8.006 -10.695 -22.943 1.00 62.00 N ATOM 0 H ASN A 21 6.993 -15.262 -22.900 1.00 72.00 H new ATOM 0 HA ASN A 21 6.798 -13.636 -25.101 1.00 13.00 H new ATOM 0 HB2 ASN A 21 7.130 -13.049 -22.644 1.00 2.00 H new ATOM 0 HB3 ASN A 21 8.826 -13.450 -22.829 1.00 2.00 H new ATOM 0 HD21 ASN A 21 8.193 -9.721 -23.181 1.00 62.00 H new ATOM 0 HD22 ASN A 21 7.635 -10.933 -22.023 1.00 62.00 H new ATOM 338 N PRO A 22 9.919 -14.920 -24.991 1.00 70.00 N ATOM 339 CA PRO A 22 11.085 -15.101 -25.845 1.00 72.00 C ATOM 340 C PRO A 22 10.845 -16.027 -27.037 1.00 41.00 C ATOM 341 O PRO A 22 11.556 -15.938 -28.038 1.00 31.00 O ATOM 342 CB PRO A 22 12.135 -15.703 -24.918 1.00 2.00 C ATOM 343 CG PRO A 22 11.353 -16.363 -23.865 1.00 31.00 C ATOM 344 CD PRO A 22 10.168 -15.489 -23.640 1.00 3.00 C ATOM 0 HA PRO A 22 11.376 -14.151 -26.294 1.00 72.00 H new ATOM 0 HB2 PRO A 22 12.771 -16.414 -25.446 1.00 2.00 H new ATOM 0 HB3 PRO A 22 12.789 -14.935 -24.506 1.00 2.00 H new ATOM 0 HG2 PRO A 22 11.049 -17.364 -24.171 1.00 31.00 H new ATOM 0 HG3 PRO A 22 11.938 -16.473 -22.952 1.00 31.00 H new ATOM 0 HD2 PRO A 22 9.311 -16.055 -23.275 1.00 3.00 H new ATOM 0 HD3 PRO A 22 10.373 -14.711 -22.905 1.00 3.00 H new ATOM 352 N ARG A 23 9.840 -16.884 -26.960 1.00 74.00 N ATOM 353 CA ARG A 23 9.641 -17.853 -28.034 1.00 64.00 C ATOM 354 C ARG A 23 8.391 -17.575 -28.914 1.00 64.00 C ATOM 355 O ARG A 23 8.152 -18.274 -29.890 1.00 72.00 O ATOM 356 CB ARG A 23 9.717 -19.298 -27.506 1.00 44.00 C ATOM 357 CG ARG A 23 9.768 -20.349 -28.600 1.00 50.00 C ATOM 358 CD ARG A 23 10.179 -21.705 -28.077 1.00 3.00 C ATOM 359 NE ARG A 23 9.206 -22.262 -27.157 1.00 13.00 N ATOM 360 CZ ARG A 23 9.482 -23.118 -26.179 1.00 35.00 C ATOM 361 NH1 ARG A 23 10.738 -23.446 -25.897 1.00 24.00 N ATOM 362 NH2 ARG A 23 8.498 -23.629 -25.471 1.00 11.00 N ATOM 0 H ARG A 23 9.168 -16.933 -26.194 1.00 74.00 H new ATOM 0 HA ARG A 23 10.475 -17.724 -28.724 1.00 64.00 H new ATOM 0 HB2 ARG A 23 10.601 -19.399 -26.877 1.00 44.00 H new ATOM 0 HB3 ARG A 23 8.851 -19.489 -26.872 1.00 44.00 H new ATOM 0 HG2 ARG A 23 8.788 -20.426 -29.072 1.00 50.00 H new ATOM 0 HG3 ARG A 23 10.470 -20.032 -29.372 1.00 50.00 H new ATOM 0 HD2 ARG A 23 10.315 -22.388 -28.915 1.00 3.00 H new ATOM 0 HD3 ARG A 23 11.143 -21.621 -27.575 1.00 3.00 H new ATOM 0 HE ARG A 23 8.234 -21.974 -27.270 1.00 13.00 H new ATOM 0 HH11 ARG A 23 11.504 -23.039 -26.434 1.00 24.00 H new ATOM 0 HH12 ARG A 23 10.936 -24.104 -25.144 1.00 24.00 H new ATOM 0 HH21 ARG A 23 7.533 -23.367 -25.675 1.00 11.00 H new ATOM 0 HH22 ARG A 23 8.700 -24.287 -24.718 1.00 11.00 H new ATOM 376 N GLN A 24 7.627 -16.537 -28.566 1.00 64.00 N ATOM 377 CA GLN A 24 6.489 -16.023 -29.368 1.00 31.00 C ATOM 378 C GLN A 24 5.206 -16.882 -29.320 1.00 70.00 C ATOM 379 O GLN A 24 4.239 -16.590 -30.043 1.00 43.00 O ATOM 380 CB GLN A 24 6.915 -15.801 -30.804 1.00 50.00 C ATOM 381 CG GLN A 24 7.961 -14.729 -31.009 1.00 53.00 C ATOM 382 CD GLN A 24 8.430 -14.674 -32.443 1.00 54.00 C ATOM 383 OE1 GLN A 24 7.874 -13.964 -33.259 1.00 33.00 O ATOM 384 NE2 GLN A 24 9.454 -15.422 -32.758 1.00 75.00 N ATOM 0 H GLN A 24 7.776 -16.013 -27.704 1.00 64.00 H new ATOM 0 HA GLN A 24 6.217 -15.078 -28.897 1.00 31.00 H new ATOM 0 HB2 GLN A 24 7.299 -16.741 -31.201 1.00 50.00 H new ATOM 0 HB3 GLN A 24 6.034 -15.543 -31.391 1.00 50.00 H new ATOM 0 HG2 GLN A 24 7.551 -13.761 -30.723 1.00 53.00 H new ATOM 0 HG3 GLN A 24 8.812 -14.921 -30.355 1.00 53.00 H new ATOM 0 HE21 GLN A 24 9.897 -16.006 -32.048 1.00 75.00 H new ATOM 0 HE22 GLN A 24 9.811 -15.422 -33.714 1.00 75.00 H new ATOM 393 N GLU A 25 5.175 -17.901 -28.489 1.00 11.00 N ATOM 394 CA GLU A 25 3.966 -18.708 -28.361 1.00 10.00 C ATOM 395 C GLU A 25 3.151 -18.316 -27.176 1.00 23.00 C ATOM 396 O GLU A 25 3.661 -17.800 -26.184 1.00 71.00 O ATOM 397 CB GLU A 25 4.206 -20.209 -28.249 1.00 53.00 C ATOM 398 CG GLU A 25 4.301 -20.979 -29.547 1.00 30.00 C ATOM 399 CD GLU A 25 5.609 -20.834 -30.249 1.00 1.00 C ATOM 400 OE1 GLU A 25 6.618 -21.379 -29.734 1.00 74.00 O ATOM 401 OE2 GLU A 25 5.647 -20.277 -31.361 1.00 4.00 O ATOM 0 H GLU A 25 5.954 -18.192 -27.899 1.00 11.00 H new ATOM 0 HA GLU A 25 3.441 -18.506 -29.295 1.00 10.00 H new ATOM 0 HB2 GLU A 25 5.130 -20.366 -27.692 1.00 53.00 H new ATOM 0 HB3 GLU A 25 3.399 -20.640 -27.656 1.00 53.00 H new ATOM 0 HG2 GLU A 25 4.126 -22.035 -29.344 1.00 30.00 H new ATOM 0 HG3 GLU A 25 3.505 -20.646 -30.213 1.00 30.00 H new ATOM 408 N VAL A 26 1.887 -18.559 -27.295 1.00 11.00 N ATOM 409 CA VAL A 26 0.943 -18.403 -26.222 1.00 21.00 C ATOM 410 C VAL A 26 0.065 -19.626 -26.135 1.00 2.00 C ATOM 411 O VAL A 26 -0.526 -20.055 -27.133 1.00 13.00 O ATOM 412 CB VAL A 26 0.053 -17.140 -26.394 1.00 51.00 C ATOM 413 CG1 VAL A 26 0.860 -15.867 -26.274 1.00 41.00 C ATOM 414 CG2 VAL A 26 -0.705 -17.143 -27.702 1.00 73.00 C ATOM 0 H VAL A 26 1.464 -18.882 -28.165 1.00 11.00 H new ATOM 0 HA VAL A 26 1.516 -18.280 -25.303 1.00 21.00 H new ATOM 0 HB VAL A 26 -0.674 -17.173 -25.582 1.00 51.00 H new ATOM 0 HG11 VAL A 26 0.203 -15.006 -26.400 1.00 41.00 H new ATOM 0 HG12 VAL A 26 1.329 -15.825 -25.291 1.00 41.00 H new ATOM 0 HG13 VAL A 26 1.631 -15.851 -27.045 1.00 41.00 H new ATOM 0 HG21 VAL A 26 -1.311 -16.240 -27.773 1.00 73.00 H new ATOM 0 HG22 VAL A 26 0.001 -17.172 -28.532 1.00 73.00 H new ATOM 0 HG23 VAL A 26 -1.352 -18.019 -27.745 1.00 73.00 H new ATOM 424 N SER A 27 0.023 -20.229 -24.990 1.00 72.00 N ATOM 425 CA SER A 27 -0.912 -21.276 -24.789 1.00 2.00 C ATOM 426 C SER A 27 -2.099 -20.613 -24.165 1.00 3.00 C ATOM 427 O SER A 27 -2.014 -20.079 -23.059 1.00 72.00 O ATOM 428 CB SER A 27 -0.355 -22.370 -23.897 1.00 25.00 C ATOM 429 OG SER A 27 0.944 -22.782 -24.339 1.00 45.00 O ATOM 0 H SER A 27 0.620 -20.014 -24.191 1.00 72.00 H new ATOM 0 HA SER A 27 -1.164 -21.775 -25.725 1.00 2.00 H new ATOM 0 HB2 SER A 27 -0.296 -22.011 -22.869 1.00 25.00 H new ATOM 0 HB3 SER A 27 -1.031 -23.225 -23.898 1.00 25.00 H new ATOM 0 HG SER A 27 1.283 -23.486 -23.748 1.00 45.00 H new ATOM 435 N PHE A 28 -3.153 -20.594 -24.867 1.00 13.00 N ATOM 436 CA PHE A 28 -4.283 -19.846 -24.496 1.00 44.00 C ATOM 437 C PHE A 28 -5.525 -20.693 -24.583 1.00 62.00 C ATOM 438 O PHE A 28 -5.572 -21.727 -25.255 1.00 33.00 O ATOM 439 CB PHE A 28 -4.327 -18.539 -25.337 1.00 60.00 C ATOM 440 CG PHE A 28 -5.551 -17.670 -25.225 1.00 13.00 C ATOM 441 CD1 PHE A 28 -6.067 -17.291 -24.004 1.00 2.00 C ATOM 442 CD2 PHE A 28 -6.184 -17.254 -26.359 1.00 14.00 C ATOM 443 CE1 PHE A 28 -7.194 -16.514 -23.934 1.00 43.00 C ATOM 444 CE2 PHE A 28 -7.309 -16.476 -26.302 1.00 51.00 C ATOM 445 CZ PHE A 28 -7.817 -16.106 -25.086 1.00 63.00 C ATOM 0 H PHE A 28 -3.261 -21.110 -25.740 1.00 13.00 H new ATOM 0 HA PHE A 28 -4.224 -19.538 -23.452 1.00 44.00 H new ATOM 0 HB2 PHE A 28 -3.462 -17.935 -25.062 1.00 60.00 H new ATOM 0 HB3 PHE A 28 -4.205 -18.812 -26.385 1.00 60.00 H new ATOM 0 HD1 PHE A 28 -5.579 -17.609 -23.095 1.00 2.00 H new ATOM 0 HD2 PHE A 28 -5.790 -17.544 -27.322 1.00 14.00 H new ATOM 0 HE1 PHE A 28 -7.591 -16.223 -22.973 1.00 43.00 H new ATOM 0 HE2 PHE A 28 -7.794 -16.156 -27.212 1.00 51.00 H new ATOM 0 HZ PHE A 28 -8.706 -15.495 -25.034 1.00 63.00 H new ATOM 455 N VAL A 29 -6.476 -20.259 -23.885 1.00 31.00 N ATOM 456 CA VAL A 29 -7.675 -20.896 -23.674 1.00 63.00 C ATOM 457 C VAL A 29 -8.710 -20.444 -24.697 1.00 33.00 C ATOM 458 O VAL A 29 -8.940 -19.259 -24.908 1.00 15.00 O ATOM 459 CB VAL A 29 -8.117 -20.618 -22.207 1.00 32.00 C ATOM 460 CG1 VAL A 29 -8.346 -19.129 -21.926 1.00 60.00 C ATOM 461 CG2 VAL A 29 -9.282 -21.482 -21.785 1.00 43.00 C ATOM 0 H VAL A 29 -6.423 -19.361 -23.403 1.00 31.00 H new ATOM 0 HA VAL A 29 -7.571 -21.973 -23.808 1.00 63.00 H new ATOM 0 HB VAL A 29 -7.278 -20.909 -21.575 1.00 32.00 H new ATOM 0 HG11 VAL A 29 -8.652 -18.997 -20.888 1.00 60.00 H new ATOM 0 HG12 VAL A 29 -7.422 -18.579 -22.104 1.00 60.00 H new ATOM 0 HG13 VAL A 29 -9.127 -18.750 -22.585 1.00 60.00 H new ATOM 0 HG21 VAL A 29 -9.552 -21.250 -20.755 1.00 43.00 H new ATOM 0 HG22 VAL A 29 -10.134 -21.287 -22.436 1.00 43.00 H new ATOM 0 HG23 VAL A 29 -9.001 -22.533 -21.859 1.00 43.00 H new ATOM 471 N TYR A 30 -9.220 -21.404 -25.394 1.00 40.00 N ATOM 472 CA TYR A 30 -10.331 -21.195 -26.324 1.00 73.00 C ATOM 473 C TYR A 30 -11.565 -20.841 -25.532 1.00 11.00 C ATOM 474 O TYR A 30 -12.285 -19.899 -25.849 1.00 32.00 O ATOM 475 CB TYR A 30 -10.599 -22.469 -27.172 1.00 31.00 C ATOM 476 CG TYR A 30 -11.888 -22.423 -27.997 1.00 4.00 C ATOM 477 CD1 TYR A 30 -11.951 -21.760 -29.211 1.00 73.00 C ATOM 478 CD2 TYR A 30 -13.049 -23.030 -27.533 1.00 61.00 C ATOM 479 CE1 TYR A 30 -13.123 -21.692 -29.934 1.00 75.00 C ATOM 480 CE2 TYR A 30 -14.220 -22.974 -28.251 1.00 51.00 C ATOM 481 CZ TYR A 30 -14.253 -22.301 -29.450 1.00 1.00 C ATOM 482 OH TYR A 30 -15.436 -22.218 -30.153 1.00 60.00 O ATOM 0 H TYR A 30 -8.891 -22.369 -25.350 1.00 40.00 H new ATOM 0 HA TYR A 30 -10.074 -20.386 -27.007 1.00 73.00 H new ATOM 0 HB2 TYR A 30 -9.757 -22.625 -27.846 1.00 31.00 H new ATOM 0 HB3 TYR A 30 -10.639 -23.331 -26.506 1.00 31.00 H new ATOM 0 HD1 TYR A 30 -11.062 -21.286 -29.600 1.00 73.00 H new ATOM 0 HD2 TYR A 30 -13.031 -23.556 -26.590 1.00 61.00 H new ATOM 0 HE1 TYR A 30 -13.151 -21.163 -30.875 1.00 75.00 H new ATOM 0 HE2 TYR A 30 -15.110 -23.456 -27.875 1.00 51.00 H new ATOM 0 HH TYR A 30 -15.980 -23.013 -29.973 1.00 60.00 H new ATOM 492 N ASP A 31 -11.781 -21.610 -24.496 1.00 75.00 N ATOM 493 CA ASP A 31 -12.932 -21.456 -23.636 1.00 74.00 C ATOM 494 C ASP A 31 -12.700 -22.240 -22.372 1.00 1.00 C ATOM 495 O ASP A 31 -12.739 -21.697 -21.269 1.00 33.00 O ATOM 496 CB ASP A 31 -14.200 -21.947 -24.342 1.00 34.00 C ATOM 497 CG ASP A 31 -15.442 -21.851 -23.488 1.00 4.00 C ATOM 498 OD1 ASP A 31 -16.076 -20.778 -23.464 1.00 51.00 O ATOM 499 OD2 ASP A 31 -15.836 -22.870 -22.882 1.00 12.00 O ATOM 0 H ASP A 31 -11.158 -22.369 -24.221 1.00 75.00 H new ATOM 0 HA ASP A 31 -13.069 -20.402 -23.395 1.00 74.00 H new ATOM 0 HB2 ASP A 31 -14.348 -21.365 -25.251 1.00 34.00 H new ATOM 0 HB3 ASP A 31 -14.058 -22.984 -24.647 1.00 34.00 H new ATOM 504 N ASN A 32 -12.422 -23.523 -22.538 1.00 24.00 N ATOM 505 CA ASN A 32 -12.121 -24.394 -21.410 1.00 43.00 C ATOM 506 C ASN A 32 -11.130 -25.474 -21.887 1.00 13.00 C ATOM 507 O ASN A 32 -11.047 -26.568 -21.344 1.00 71.00 O ATOM 508 CB ASN A 32 -13.435 -25.019 -20.869 1.00 53.00 C ATOM 509 CG ASN A 32 -13.308 -25.613 -19.458 1.00 33.00 C ATOM 510 OD1 ASN A 32 -13.486 -24.909 -18.457 1.00 10.00 O ATOM 511 ND2 ASN A 32 -13.040 -26.890 -19.362 1.00 40.00 N ATOM 0 H ASN A 32 -12.398 -23.987 -23.446 1.00 24.00 H new ATOM 0 HA ASN A 32 -11.666 -23.833 -20.594 1.00 43.00 H new ATOM 0 HB2 ASN A 32 -14.213 -24.255 -20.862 1.00 53.00 H new ATOM 0 HB3 ASN A 32 -13.762 -25.801 -21.554 1.00 53.00 H new ATOM 0 HD21 ASN A 32 -12.973 -27.329 -18.444 1.00 40.00 H new ATOM 0 HD22 ASN A 32 -12.898 -27.446 -20.205 1.00 40.00 H new ATOM 518 N GLN A 33 -10.332 -25.115 -22.881 1.00 55.00 N ATOM 519 CA GLN A 33 -9.343 -25.987 -23.469 1.00 51.00 C ATOM 520 C GLN A 33 -8.216 -25.093 -23.845 1.00 41.00 C ATOM 521 O GLN A 33 -8.441 -23.887 -24.069 1.00 21.00 O ATOM 522 CB GLN A 33 -9.873 -26.716 -24.720 1.00 42.00 C ATOM 523 CG GLN A 33 -10.139 -25.785 -25.882 1.00 63.00 C ATOM 524 CD GLN A 33 -10.643 -26.477 -27.124 1.00 52.00 C ATOM 525 OE1 GLN A 33 -9.866 -26.903 -27.974 1.00 62.00 O ATOM 526 NE2 GLN A 33 -11.935 -26.567 -27.257 1.00 64.00 N ATOM 0 H GLN A 33 -10.359 -24.188 -23.306 1.00 55.00 H new ATOM 0 HA GLN A 33 -9.054 -26.769 -22.767 1.00 51.00 H new ATOM 0 HB2 GLN A 33 -9.150 -27.472 -25.026 1.00 42.00 H new ATOM 0 HB3 GLN A 33 -10.794 -27.241 -24.465 1.00 42.00 H new ATOM 0 HG2 GLN A 33 -10.870 -25.037 -25.574 1.00 63.00 H new ATOM 0 HG3 GLN A 33 -9.220 -25.252 -26.124 1.00 63.00 H new ATOM 0 HE21 GLN A 33 -12.549 -26.202 -26.529 1.00 64.00 H new ATOM 0 HE22 GLN A 33 -12.333 -27.003 -28.089 1.00 64.00 H new ATOM 535 N LEU A 34 -7.053 -25.617 -23.912 1.00 25.00 N ATOM 536 CA LEU A 34 -5.911 -24.810 -24.156 1.00 21.00 C ATOM 537 C LEU A 34 -5.246 -25.217 -25.460 1.00 53.00 C ATOM 538 O LEU A 34 -5.080 -26.414 -25.735 1.00 65.00 O ATOM 539 CB LEU A 34 -4.889 -24.933 -22.998 1.00 14.00 C ATOM 540 CG LEU A 34 -5.252 -24.358 -21.597 1.00 55.00 C ATOM 541 CD1 LEU A 34 -5.598 -22.903 -21.659 1.00 71.00 C ATOM 542 CD2 LEU A 34 -6.334 -25.163 -20.880 1.00 33.00 C ATOM 0 H LEU A 34 -6.860 -26.612 -23.801 1.00 25.00 H new ATOM 0 HA LEU A 34 -6.242 -23.774 -24.225 1.00 21.00 H new ATOM 0 HB2 LEU A 34 -4.665 -25.992 -22.870 1.00 14.00 H new ATOM 0 HB3 LEU A 34 -3.967 -24.450 -23.322 1.00 14.00 H new ATOM 0 HG LEU A 34 -4.349 -24.455 -20.994 1.00 55.00 H new ATOM 0 HD11 LEU A 34 -5.844 -22.545 -20.659 1.00 71.00 H new ATOM 0 HD12 LEU A 34 -4.747 -22.343 -22.046 1.00 71.00 H new ATOM 0 HD13 LEU A 34 -6.455 -22.761 -22.317 1.00 71.00 H new ATOM 0 HD21 LEU A 34 -6.541 -24.711 -19.910 1.00 33.00 H new ATOM 0 HD22 LEU A 34 -7.244 -25.166 -21.481 1.00 33.00 H new ATOM 0 HD23 LEU A 34 -5.990 -26.187 -20.737 1.00 33.00 H new ATOM 554 N LEU A 35 -4.908 -24.251 -26.262 1.00 42.00 N ATOM 555 CA LEU A 35 -4.143 -24.474 -27.472 1.00 25.00 C ATOM 556 C LEU A 35 -3.085 -23.407 -27.624 1.00 52.00 C ATOM 557 O LEU A 35 -3.065 -22.448 -26.861 1.00 44.00 O ATOM 558 CB LEU A 35 -5.017 -24.680 -28.755 1.00 2.00 C ATOM 559 CG LEU A 35 -6.008 -23.588 -29.253 1.00 42.00 C ATOM 560 CD1 LEU A 35 -7.105 -23.279 -28.254 1.00 33.00 C ATOM 561 CD2 LEU A 35 -5.310 -22.322 -29.731 1.00 53.00 C ATOM 0 H LEU A 35 -5.154 -23.274 -26.101 1.00 42.00 H new ATOM 0 HA LEU A 35 -3.636 -25.432 -27.361 1.00 25.00 H new ATOM 0 HB2 LEU A 35 -4.330 -24.881 -29.577 1.00 2.00 H new ATOM 0 HB3 LEU A 35 -5.600 -25.588 -28.598 1.00 2.00 H new ATOM 0 HG LEU A 35 -6.495 -24.025 -30.125 1.00 42.00 H new ATOM 0 HD11 LEU A 35 -7.762 -22.510 -28.661 1.00 33.00 H new ATOM 0 HD12 LEU A 35 -7.682 -24.182 -28.056 1.00 33.00 H new ATOM 0 HD13 LEU A 35 -6.661 -22.922 -27.325 1.00 33.00 H new ATOM 0 HD21 LEU A 35 -6.055 -21.600 -30.065 1.00 53.00 H new ATOM 0 HD22 LEU A 35 -4.732 -21.894 -28.912 1.00 53.00 H new ATOM 0 HD23 LEU A 35 -4.643 -22.564 -30.558 1.00 53.00 H new ATOM 573 N HIS A 36 -2.229 -23.553 -28.589 1.00 14.00 N ATOM 574 CA HIS A 36 -1.113 -22.639 -28.726 1.00 1.00 C ATOM 575 C HIS A 36 -1.153 -21.823 -30.013 1.00 72.00 C ATOM 576 O HIS A 36 -1.282 -22.360 -31.129 1.00 33.00 O ATOM 577 CB HIS A 36 0.258 -23.344 -28.508 1.00 64.00 C ATOM 578 CG HIS A 36 0.545 -24.517 -29.415 1.00 70.00 C ATOM 579 ND1 HIS A 36 0.238 -25.809 -29.041 1.00 32.00 N ATOM 580 CD2 HIS A 36 1.106 -24.537 -30.641 1.00 12.00 C ATOM 581 CE1 HIS A 36 0.618 -26.575 -30.056 1.00 3.00 C ATOM 582 NE2 HIS A 36 1.146 -25.847 -31.036 1.00 21.00 N ATOM 0 H HIS A 36 -2.272 -24.289 -29.294 1.00 14.00 H new ATOM 0 HA HIS A 36 -1.224 -21.914 -27.920 1.00 1.00 H new ATOM 0 HB2 HIS A 36 1.050 -22.606 -28.638 1.00 64.00 H new ATOM 0 HB3 HIS A 36 0.309 -23.687 -27.475 1.00 64.00 H new ATOM 0 HD2 HIS A 36 1.456 -23.684 -31.203 1.00 12.00 H new ATOM 0 HE1 HIS A 36 0.512 -27.649 -30.083 1.00 3.00 H new ATOM 0 HE2 HIS A 36 1.513 -26.200 -31.920 1.00 21.00 H new ATOM 590 N LEU A 37 -1.043 -20.536 -29.843 1.00 72.00 N ATOM 591 CA LEU A 37 -1.024 -19.588 -30.932 1.00 1.00 C ATOM 592 C LEU A 37 0.308 -18.974 -30.950 1.00 24.00 C ATOM 593 O LEU A 37 1.040 -19.044 -29.956 1.00 13.00 O ATOM 594 CB LEU A 37 -2.076 -18.472 -30.784 1.00 50.00 C ATOM 595 CG LEU A 37 -3.506 -18.939 -30.537 1.00 54.00 C ATOM 596 CD1 LEU A 37 -3.797 -19.108 -29.052 1.00 3.00 C ATOM 597 CD2 LEU A 37 -4.507 -18.041 -31.206 1.00 12.00 C ATOM 0 H LEU A 37 -0.962 -20.102 -28.924 1.00 72.00 H new ATOM 0 HA LEU A 37 -1.257 -20.122 -31.853 1.00 1.00 H new ATOM 0 HB2 LEU A 37 -1.778 -17.824 -29.960 1.00 50.00 H new ATOM 0 HB3 LEU A 37 -2.063 -17.864 -31.688 1.00 50.00 H new ATOM 0 HG LEU A 37 -3.606 -19.924 -30.994 1.00 54.00 H new ATOM 0 HD11 LEU A 37 -4.826 -19.442 -28.919 1.00 3.00 H new ATOM 0 HD12 LEU A 37 -3.118 -19.849 -28.630 1.00 3.00 H new ATOM 0 HD13 LEU A 37 -3.656 -18.155 -28.543 1.00 3.00 H new ATOM 0 HD21 LEU A 37 -5.514 -18.407 -31.007 1.00 12.00 H new ATOM 0 HD22 LEU A 37 -4.405 -17.028 -30.816 1.00 12.00 H new ATOM 0 HD23 LEU A 37 -4.329 -18.035 -32.281 1.00 12.00 H new ATOM 609 N LYS A 38 0.641 -18.379 -32.026 1.00 52.00 N ATOM 610 CA LYS A 38 1.900 -17.772 -32.134 1.00 2.00 C ATOM 611 C LYS A 38 1.796 -16.428 -32.737 1.00 0.00 C ATOM 612 O LYS A 38 0.856 -16.145 -33.488 1.00 5.00 O ATOM 613 CB LYS A 38 2.822 -18.606 -32.962 1.00 32.00 C ATOM 614 CG LYS A 38 2.334 -18.896 -34.372 1.00 12.00 C ATOM 615 CD LYS A 38 3.467 -19.415 -35.214 1.00 13.00 C ATOM 616 CE LYS A 38 3.004 -19.807 -36.612 1.00 42.00 C ATOM 617 NZ LYS A 38 2.136 -21.015 -36.612 1.00 24.00 N ATOM 0 H LYS A 38 0.050 -18.300 -32.853 1.00 52.00 H new ATOM 0 HA LYS A 38 2.300 -17.679 -31.124 1.00 2.00 H new ATOM 0 HB2 LYS A 38 3.787 -18.102 -33.024 1.00 32.00 H new ATOM 0 HB3 LYS A 38 2.990 -19.553 -32.450 1.00 32.00 H new ATOM 0 HG2 LYS A 38 1.527 -19.628 -34.343 1.00 12.00 H new ATOM 0 HG3 LYS A 38 1.925 -17.989 -34.818 1.00 12.00 H new ATOM 0 HD2 LYS A 38 4.242 -18.652 -35.289 1.00 13.00 H new ATOM 0 HD3 LYS A 38 3.916 -20.279 -34.725 1.00 13.00 H new ATOM 0 HE2 LYS A 38 2.460 -18.974 -37.057 1.00 42.00 H new ATOM 0 HE3 LYS A 38 3.875 -19.991 -37.241 1.00 42.00 H new ATOM 0 HZ1 LYS A 38 1.892 -21.267 -37.591 1.00 24.00 H new ATOM 0 HZ2 LYS A 38 2.643 -21.807 -36.167 1.00 24.00 H new ATOM 0 HZ3 LYS A 38 1.266 -20.817 -36.078 1.00 24.00 H new ATOM 631 N GLN A 39 2.737 -15.616 -32.398 1.00 34.00 N ATOM 632 CA GLN A 39 2.882 -14.303 -32.957 1.00 14.00 C ATOM 633 C GLN A 39 3.366 -14.467 -34.373 1.00 43.00 C ATOM 634 O GLN A 39 4.503 -14.890 -34.622 1.00 1.00 O ATOM 635 CB GLN A 39 3.854 -13.488 -32.111 1.00 63.00 C ATOM 636 CG GLN A 39 4.297 -12.131 -32.664 1.00 23.00 C ATOM 637 CD GLN A 39 3.288 -11.029 -32.523 1.00 14.00 C ATOM 638 OE1 GLN A 39 2.465 -10.804 -33.393 1.00 63.00 O ATOM 639 NE2 GLN A 39 3.364 -10.302 -31.442 1.00 30.00 N ATOM 0 H GLN A 39 3.450 -15.847 -31.706 1.00 34.00 H new ATOM 0 HA GLN A 39 1.935 -13.763 -32.961 1.00 14.00 H new ATOM 0 HB2 GLN A 39 3.396 -13.322 -31.136 1.00 63.00 H new ATOM 0 HB3 GLN A 39 4.746 -14.092 -31.945 1.00 63.00 H new ATOM 0 HG2 GLN A 39 5.214 -11.831 -32.157 1.00 23.00 H new ATOM 0 HG3 GLN A 39 4.540 -12.248 -33.720 1.00 23.00 H new ATOM 0 HE21 GLN A 39 4.064 -10.516 -30.732 1.00 30.00 H new ATOM 0 HE22 GLN A 39 2.723 -9.520 -31.307 1.00 30.00 H new ATOM 648 N GLY A 40 2.497 -14.207 -35.270 1.00 12.00 N ATOM 649 CA GLY A 40 2.785 -14.404 -36.662 1.00 40.00 C ATOM 650 C GLY A 40 2.516 -13.189 -37.490 1.00 52.00 C ATOM 651 O GLY A 40 3.051 -12.115 -37.212 1.00 13.00 O ATOM 0 H GLY A 40 1.561 -13.851 -35.076 1.00 12.00 H new ATOM 0 HA2 GLY A 40 3.831 -14.690 -36.774 1.00 40.00 H new ATOM 0 HA3 GLY A 40 2.186 -15.233 -37.038 1.00 40.00 H new ATOM 655 N ILE A 41 1.681 -13.355 -38.497 1.00 60.00 N ATOM 656 CA ILE A 41 1.348 -12.294 -39.431 1.00 65.00 C ATOM 657 C ILE A 41 0.466 -11.268 -38.737 1.00 12.00 C ATOM 658 O ILE A 41 -0.700 -11.528 -38.446 1.00 15.00 O ATOM 659 CB ILE A 41 0.627 -12.817 -40.739 1.00 75.00 C ATOM 660 CG1 ILE A 41 1.511 -13.788 -41.575 1.00 23.00 C ATOM 661 CG2 ILE A 41 0.187 -11.651 -41.616 1.00 2.00 C ATOM 662 CD1 ILE A 41 1.728 -15.170 -40.977 1.00 42.00 C ATOM 0 H ILE A 41 1.209 -14.238 -38.693 1.00 60.00 H new ATOM 0 HA ILE A 41 2.288 -11.844 -39.749 1.00 65.00 H new ATOM 0 HB ILE A 41 -0.245 -13.377 -40.400 1.00 75.00 H new ATOM 0 HG12 ILE A 41 1.057 -13.906 -42.559 1.00 23.00 H new ATOM 0 HG13 ILE A 41 2.485 -13.322 -41.727 1.00 23.00 H new ATOM 0 HG21 ILE A 41 -0.306 -12.034 -42.510 1.00 2.00 H new ATOM 0 HG22 ILE A 41 -0.507 -11.020 -41.061 1.00 2.00 H new ATOM 0 HG23 ILE A 41 1.059 -11.064 -41.906 1.00 2.00 H new ATOM 0 HD11 ILE A 41 2.357 -15.760 -41.643 1.00 42.00 H new ATOM 0 HD12 ILE A 41 2.216 -15.074 -40.007 1.00 42.00 H new ATOM 0 HD13 ILE A 41 0.766 -15.667 -40.852 1.00 42.00 H new ATOM 674 N SER A 42 1.026 -10.133 -38.457 1.00 14.00 N ATOM 675 CA SER A 42 0.334 -9.117 -37.746 1.00 75.00 C ATOM 676 C SER A 42 -0.061 -7.978 -38.695 1.00 41.00 C ATOM 677 O SER A 42 -0.016 -8.130 -39.921 1.00 14.00 O ATOM 678 CB SER A 42 1.233 -8.624 -36.603 1.00 45.00 C ATOM 679 OG SER A 42 0.551 -7.728 -35.720 1.00 41.00 O ATOM 0 H SER A 42 1.981 -9.889 -38.719 1.00 14.00 H new ATOM 0 HA SER A 42 -0.589 -9.511 -37.322 1.00 75.00 H new ATOM 0 HB2 SER A 42 1.598 -9.481 -36.036 1.00 45.00 H new ATOM 0 HB3 SER A 42 2.106 -8.123 -37.021 1.00 45.00 H new ATOM 0 HG SER A 42 0.932 -6.829 -35.808 1.00 41.00 H new ATOM 685 N ALA A 43 -0.434 -6.867 -38.107 1.00 53.00 N ATOM 686 CA ALA A 43 -0.875 -5.688 -38.771 1.00 13.00 C ATOM 687 C ALA A 43 -0.819 -4.544 -37.770 1.00 13.00 C ATOM 688 O ALA A 43 -0.414 -3.427 -38.091 1.00 73.00 O ATOM 689 CB ALA A 43 -2.279 -5.849 -39.349 1.00 60.00 C ATOM 0 H ALA A 43 -0.434 -6.767 -37.092 1.00 53.00 H new ATOM 0 HA ALA A 43 -0.223 -5.481 -39.620 1.00 13.00 H new ATOM 0 HB1 ALA A 43 -2.576 -4.926 -39.847 1.00 60.00 H new ATOM 0 HB2 ALA A 43 -2.284 -6.667 -40.069 1.00 60.00 H new ATOM 0 HB3 ALA A 43 -2.981 -6.069 -38.544 1.00 60.00 H new ATOM 695 N SER A 44 -1.233 -4.850 -36.553 1.00 73.00 N ATOM 696 CA SER A 44 -1.190 -3.954 -35.420 1.00 54.00 C ATOM 697 C SER A 44 -1.288 -4.812 -34.160 1.00 63.00 C ATOM 698 O SER A 44 -1.720 -5.968 -34.254 1.00 34.00 O ATOM 699 CB SER A 44 -2.363 -2.948 -35.466 1.00 74.00 C ATOM 700 OG SER A 44 -2.295 -2.109 -36.624 1.00 75.00 O ATOM 0 H SER A 44 -1.622 -5.764 -36.322 1.00 73.00 H new ATOM 0 HA SER A 44 -0.265 -3.378 -35.432 1.00 54.00 H new ATOM 0 HB2 SER A 44 -3.308 -3.491 -35.465 1.00 74.00 H new ATOM 0 HB3 SER A 44 -2.349 -2.331 -34.568 1.00 74.00 H new ATOM 0 HG SER A 44 -1.542 -2.387 -37.186 1.00 75.00 H new ATOM 706 N GLY A 45 -0.865 -4.291 -33.032 1.00 74.00 N ATOM 707 CA GLY A 45 -0.998 -4.983 -31.767 1.00 71.00 C ATOM 708 C GLY A 45 0.061 -6.028 -31.546 1.00 21.00 C ATOM 709 O GLY A 45 1.243 -5.718 -31.357 1.00 72.00 O ATOM 0 H GLY A 45 -0.419 -3.376 -32.963 1.00 74.00 H new ATOM 0 HA2 GLY A 45 -0.955 -4.255 -30.957 1.00 71.00 H new ATOM 0 HA3 GLY A 45 -1.979 -5.455 -31.720 1.00 71.00 H new ATOM 713 N ALA A 46 -0.382 -7.246 -31.558 1.00 51.00 N ATOM 714 CA ALA A 46 0.385 -8.415 -31.362 1.00 55.00 C ATOM 715 C ALA A 46 -0.534 -9.486 -31.810 1.00 62.00 C ATOM 716 O ALA A 46 -1.704 -9.515 -31.391 1.00 2.00 O ATOM 717 CB ALA A 46 0.763 -8.586 -29.895 1.00 62.00 C ATOM 0 H ALA A 46 -1.368 -7.454 -31.718 1.00 51.00 H new ATOM 0 HA ALA A 46 1.333 -8.407 -31.901 1.00 55.00 H new ATOM 0 HB1 ALA A 46 1.353 -9.495 -29.775 1.00 62.00 H new ATOM 0 HB2 ALA A 46 1.349 -7.727 -29.568 1.00 62.00 H new ATOM 0 HB3 ALA A 46 -0.142 -8.659 -29.292 1.00 62.00 H new ATOM 723 N ARG A 47 -0.081 -10.318 -32.666 1.00 53.00 N ATOM 724 CA ARG A 47 -0.961 -11.211 -33.306 1.00 20.00 C ATOM 725 C ARG A 47 -0.598 -12.649 -33.014 1.00 31.00 C ATOM 726 O ARG A 47 0.248 -13.221 -33.691 1.00 34.00 O ATOM 727 CB ARG A 47 -0.901 -10.972 -34.808 1.00 43.00 C ATOM 728 CG ARG A 47 -1.855 -11.798 -35.636 1.00 61.00 C ATOM 729 CD ARG A 47 -3.274 -11.307 -35.513 1.00 14.00 C ATOM 730 NE ARG A 47 -4.168 -12.055 -36.392 1.00 44.00 N ATOM 731 CZ ARG A 47 -4.513 -11.669 -37.639 1.00 74.00 C ATOM 732 NH1 ARG A 47 -3.864 -10.669 -38.234 1.00 22.00 N ATOM 733 NH2 ARG A 47 -5.440 -12.328 -38.311 1.00 70.00 N ATOM 0 H ARG A 47 0.898 -10.399 -32.940 1.00 53.00 H new ATOM 0 HA ARG A 47 -1.968 -11.033 -32.929 1.00 20.00 H new ATOM 0 HB2 ARG A 47 -1.101 -9.918 -34.999 1.00 43.00 H new ATOM 0 HB3 ARG A 47 0.115 -11.171 -35.150 1.00 43.00 H new ATOM 0 HG2 ARG A 47 -1.549 -11.767 -36.682 1.00 61.00 H new ATOM 0 HG3 ARG A 47 -1.802 -12.840 -35.320 1.00 61.00 H new ATOM 0 HD2 ARG A 47 -3.608 -11.406 -34.480 1.00 14.00 H new ATOM 0 HD3 ARG A 47 -3.318 -10.247 -35.762 1.00 14.00 H new ATOM 0 HE ARG A 47 -4.559 -12.929 -36.040 1.00 44.00 H new ATOM 0 HH11 ARG A 47 -3.104 -10.193 -37.747 1.00 22.00 H new ATOM 0 HH12 ARG A 47 -4.127 -10.380 -39.176 1.00 22.00 H new ATOM 0 HH21 ARG A 47 -5.900 -13.134 -37.888 1.00 70.00 H new ATOM 0 HH22 ARG A 47 -5.696 -12.031 -39.253 1.00 70.00 H new ATOM 747 N TYR A 48 -1.191 -13.211 -32.008 1.00 72.00 N ATOM 748 CA TYR A 48 -1.020 -14.576 -31.717 1.00 34.00 C ATOM 749 C TYR A 48 -2.193 -15.259 -32.340 1.00 32.00 C ATOM 750 O TYR A 48 -3.323 -15.067 -31.933 1.00 32.00 O ATOM 751 CB TYR A 48 -0.976 -14.790 -30.214 1.00 74.00 C ATOM 752 CG TYR A 48 0.110 -13.991 -29.518 1.00 73.00 C ATOM 753 CD1 TYR A 48 1.424 -14.428 -29.522 1.00 25.00 C ATOM 754 CD2 TYR A 48 -0.183 -12.802 -28.860 1.00 70.00 C ATOM 755 CE1 TYR A 48 2.420 -13.706 -28.895 1.00 13.00 C ATOM 756 CE2 TYR A 48 0.808 -12.074 -28.230 1.00 42.00 C ATOM 757 CZ TYR A 48 2.108 -12.531 -28.253 1.00 61.00 C ATOM 758 OH TYR A 48 3.102 -11.806 -27.625 1.00 2.00 O ATOM 0 H TYR A 48 -1.812 -12.718 -31.366 1.00 72.00 H new ATOM 0 HA TYR A 48 -0.083 -14.974 -32.107 1.00 34.00 H new ATOM 0 HB2 TYR A 48 -1.943 -14.521 -29.789 1.00 74.00 H new ATOM 0 HB3 TYR A 48 -0.823 -15.850 -30.011 1.00 74.00 H new ATOM 0 HD1 TYR A 48 1.674 -15.350 -30.025 1.00 25.00 H new ATOM 0 HD2 TYR A 48 -1.201 -12.442 -28.841 1.00 70.00 H new ATOM 0 HE1 TYR A 48 3.439 -14.063 -28.909 1.00 13.00 H new ATOM 0 HE2 TYR A 48 0.565 -11.152 -27.722 1.00 42.00 H new ATOM 0 HH TYR A 48 2.715 -11.002 -27.221 1.00 2.00 H new ATOM 768 N THR A 49 -1.964 -15.971 -33.373 1.00 15.00 N ATOM 769 CA THR A 49 -3.051 -16.547 -34.105 1.00 42.00 C ATOM 770 C THR A 49 -2.594 -17.818 -34.743 1.00 22.00 C ATOM 771 O THR A 49 -1.477 -17.880 -35.248 1.00 24.00 O ATOM 772 CB THR A 49 -3.594 -15.556 -35.182 1.00 41.00 C ATOM 773 OG1 THR A 49 -4.079 -14.359 -34.540 1.00 52.00 O ATOM 774 CG2 THR A 49 -4.725 -16.168 -36.011 1.00 42.00 C ATOM 0 H THR A 49 -1.036 -16.177 -33.742 1.00 15.00 H new ATOM 0 HA THR A 49 -3.868 -16.759 -33.415 1.00 42.00 H new ATOM 0 HB THR A 49 -2.769 -15.324 -35.855 1.00 41.00 H new ATOM 0 HG1 THR A 49 -3.319 -13.812 -34.251 1.00 52.00 H new ATOM 0 HG21 THR A 49 -5.071 -15.442 -36.747 1.00 42.00 H new ATOM 0 HG22 THR A 49 -4.360 -17.058 -36.523 1.00 42.00 H new ATOM 0 HG23 THR A 49 -5.551 -16.440 -35.354 1.00 42.00 H new ATOM 782 N ASP A 50 -3.411 -18.844 -34.682 1.00 5.00 N ATOM 783 CA ASP A 50 -3.031 -20.089 -35.285 1.00 14.00 C ATOM 784 C ASP A 50 -4.266 -20.893 -35.687 1.00 25.00 C ATOM 785 O ASP A 50 -4.656 -21.833 -35.007 1.00 34.00 O ATOM 786 CB ASP A 50 -2.122 -20.893 -34.349 1.00 12.00 C ATOM 787 CG ASP A 50 -1.247 -21.890 -35.068 1.00 21.00 C ATOM 788 OD1 ASP A 50 -1.711 -22.994 -35.408 1.00 75.00 O ATOM 789 OD2 ASP A 50 -0.049 -21.594 -35.255 1.00 5.00 O ATOM 0 H ASP A 50 -4.325 -18.838 -34.229 1.00 5.00 H new ATOM 0 HA ASP A 50 -2.464 -19.873 -36.191 1.00 14.00 H new ATOM 0 HB2 ASP A 50 -1.489 -20.204 -33.790 1.00 12.00 H new ATOM 0 HB3 ASP A 50 -2.739 -21.421 -33.622 1.00 12.00 H new ATOM 794 N GLY A 51 -4.984 -20.368 -36.678 1.00 51.00 N ATOM 795 CA GLY A 51 -6.078 -21.089 -37.338 1.00 73.00 C ATOM 796 C GLY A 51 -7.412 -21.103 -36.596 1.00 54.00 C ATOM 797 O GLY A 51 -8.474 -20.919 -37.206 1.00 63.00 O ATOM 0 H GLY A 51 -4.826 -19.431 -37.048 1.00 51.00 H new ATOM 0 HA2 GLY A 51 -6.236 -20.647 -38.322 1.00 73.00 H new ATOM 0 HA3 GLY A 51 -5.763 -22.120 -37.498 1.00 73.00 H new ATOM 801 N ILE A 52 -7.362 -21.291 -35.307 1.00 54.00 N ATOM 802 CA ILE A 52 -8.549 -21.463 -34.504 1.00 5.00 C ATOM 803 C ILE A 52 -9.254 -20.128 -34.352 1.00 5.00 C ATOM 804 O ILE A 52 -10.351 -19.956 -34.797 1.00 74.00 O ATOM 805 CB ILE A 52 -8.205 -22.056 -33.099 1.00 72.00 C ATOM 806 CG1 ILE A 52 -7.320 -23.318 -33.231 1.00 0.00 C ATOM 807 CG2 ILE A 52 -9.481 -22.399 -32.334 1.00 73.00 C ATOM 808 CD1 ILE A 52 -7.947 -24.461 -34.018 1.00 75.00 C ATOM 0 H ILE A 52 -6.492 -21.330 -34.776 1.00 54.00 H new ATOM 0 HA ILE A 52 -9.208 -22.170 -35.009 1.00 5.00 H new ATOM 0 HB ILE A 52 -7.651 -21.298 -32.545 1.00 72.00 H new ATOM 0 HG12 ILE A 52 -6.382 -23.038 -33.710 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -7.073 -23.677 -32.232 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -9.221 -22.810 -31.359 1.00 73.00 H new ATOM 0 HG22 ILE A 52 -10.078 -21.497 -32.200 1.00 73.00 H new ATOM 0 HG23 ILE A 52 -10.056 -23.135 -32.897 1.00 73.00 H new ATOM 0 HD11 ILE A 52 -7.253 -25.300 -34.056 1.00 75.00 H new ATOM 0 HD12 ILE A 52 -8.870 -24.775 -33.530 1.00 75.00 H new ATOM 0 HD13 ILE A 52 -8.168 -24.127 -35.032 1.00 75.00 H new ATOM 820 N TYR A 53 -8.574 -19.186 -33.788 1.00 70.00 N ATOM 821 CA TYR A 53 -9.104 -17.869 -33.578 1.00 3.00 C ATOM 822 C TYR A 53 -8.003 -16.872 -33.673 1.00 33.00 C ATOM 823 O TYR A 53 -6.814 -17.239 -33.643 1.00 43.00 O ATOM 824 CB TYR A 53 -9.824 -17.738 -32.225 1.00 3.00 C ATOM 825 CG TYR A 53 -9.105 -18.330 -31.036 1.00 21.00 C ATOM 826 CD1 TYR A 53 -7.989 -17.734 -30.492 1.00 24.00 C ATOM 827 CD2 TYR A 53 -9.561 -19.487 -30.459 1.00 54.00 C ATOM 828 CE1 TYR A 53 -7.356 -18.279 -29.410 1.00 53.00 C ATOM 829 CE2 TYR A 53 -8.929 -20.039 -29.372 1.00 11.00 C ATOM 830 CZ TYR A 53 -7.832 -19.435 -28.853 1.00 5.00 C ATOM 831 OH TYR A 53 -7.210 -19.984 -27.762 1.00 25.00 O ATOM 0 H TYR A 53 -7.618 -19.306 -33.453 1.00 70.00 H new ATOM 0 HA TYR A 53 -9.846 -17.681 -34.353 1.00 3.00 H new ATOM 0 HB2 TYR A 53 -9.999 -16.680 -32.029 1.00 3.00 H new ATOM 0 HB3 TYR A 53 -10.801 -18.213 -32.308 1.00 3.00 H new ATOM 0 HD1 TYR A 53 -7.608 -16.822 -30.927 1.00 24.00 H new ATOM 0 HD2 TYR A 53 -10.434 -19.974 -30.867 1.00 54.00 H new ATOM 0 HE1 TYR A 53 -6.482 -17.798 -28.996 1.00 53.00 H new ATOM 0 HE2 TYR A 53 -9.305 -20.951 -28.932 1.00 11.00 H new ATOM 0 HH TYR A 53 -6.815 -19.271 -27.218 1.00 25.00 H new ATOM 841 N VAL A 54 -8.375 -15.657 -33.812 1.00 45.00 N ATOM 842 CA VAL A 54 -7.466 -14.562 -33.866 1.00 23.00 C ATOM 843 C VAL A 54 -7.350 -13.956 -32.475 1.00 42.00 C ATOM 844 O VAL A 54 -8.279 -13.315 -31.999 1.00 10.00 O ATOM 845 CB VAL A 54 -8.012 -13.509 -34.851 1.00 64.00 C ATOM 846 CG1 VAL A 54 -7.223 -12.199 -34.793 1.00 75.00 C ATOM 847 CG2 VAL A 54 -7.997 -14.055 -36.276 1.00 64.00 C ATOM 0 H VAL A 54 -9.353 -15.380 -33.895 1.00 45.00 H new ATOM 0 HA VAL A 54 -6.484 -14.897 -34.202 1.00 23.00 H new ATOM 0 HB VAL A 54 -9.038 -13.294 -34.551 1.00 64.00 H new ATOM 0 HG11 VAL A 54 -7.645 -11.489 -35.504 1.00 75.00 H new ATOM 0 HG12 VAL A 54 -7.281 -11.783 -33.787 1.00 75.00 H new ATOM 0 HG13 VAL A 54 -6.180 -12.391 -35.047 1.00 75.00 H new ATOM 0 HG21 VAL A 54 -8.385 -13.300 -36.959 1.00 64.00 H new ATOM 0 HG22 VAL A 54 -6.975 -14.308 -36.558 1.00 64.00 H new ATOM 0 HG23 VAL A 54 -8.620 -14.948 -36.330 1.00 64.00 H new ATOM 857 N PHE A 55 -6.264 -14.233 -31.808 1.00 33.00 N ATOM 858 CA PHE A 55 -6.003 -13.652 -30.514 1.00 1.00 C ATOM 859 C PHE A 55 -5.196 -12.387 -30.723 1.00 5.00 C ATOM 860 O PHE A 55 -3.985 -12.419 -30.994 1.00 34.00 O ATOM 861 CB PHE A 55 -5.297 -14.671 -29.596 1.00 63.00 C ATOM 862 CG PHE A 55 -4.842 -14.166 -28.245 1.00 62.00 C ATOM 863 CD1 PHE A 55 -5.577 -13.236 -27.524 1.00 1.00 C ATOM 864 CD2 PHE A 55 -3.664 -14.636 -27.703 1.00 70.00 C ATOM 865 CE1 PHE A 55 -5.141 -12.795 -26.294 1.00 64.00 C ATOM 866 CE2 PHE A 55 -3.225 -14.200 -26.475 1.00 3.00 C ATOM 867 CZ PHE A 55 -3.965 -13.280 -25.771 1.00 11.00 C ATOM 0 H PHE A 55 -5.536 -14.865 -32.141 1.00 33.00 H new ATOM 0 HA PHE A 55 -6.932 -13.390 -30.009 1.00 1.00 H new ATOM 0 HB2 PHE A 55 -5.974 -15.510 -29.435 1.00 63.00 H new ATOM 0 HB3 PHE A 55 -4.427 -15.060 -30.125 1.00 63.00 H new ATOM 0 HD1 PHE A 55 -6.501 -12.854 -27.932 1.00 1.00 H new ATOM 0 HD2 PHE A 55 -3.077 -15.358 -28.252 1.00 70.00 H new ATOM 0 HE1 PHE A 55 -5.721 -12.070 -25.742 1.00 64.00 H new ATOM 0 HE2 PHE A 55 -2.301 -14.580 -26.065 1.00 3.00 H new ATOM 0 HZ PHE A 55 -3.622 -12.937 -24.806 1.00 11.00 H new ATOM 877 N TRP A 56 -5.872 -11.290 -30.647 1.00 1.00 N ATOM 878 CA TRP A 56 -5.308 -10.053 -30.915 1.00 41.00 C ATOM 879 C TRP A 56 -5.101 -9.334 -29.624 1.00 42.00 C ATOM 880 O TRP A 56 -6.022 -9.132 -28.821 1.00 12.00 O ATOM 881 CB TRP A 56 -6.195 -9.272 -31.863 1.00 3.00 C ATOM 882 CG TRP A 56 -5.578 -8.022 -32.360 1.00 31.00 C ATOM 883 CD1 TRP A 56 -4.356 -7.903 -32.936 1.00 2.00 C ATOM 884 CD2 TRP A 56 -6.158 -6.717 -32.367 1.00 64.00 C ATOM 885 NE1 TRP A 56 -4.125 -6.610 -33.274 1.00 41.00 N ATOM 886 CE2 TRP A 56 -5.216 -5.855 -32.946 1.00 13.00 C ATOM 887 CE3 TRP A 56 -7.380 -6.193 -31.937 1.00 44.00 C ATOM 888 CZ2 TRP A 56 -5.448 -4.499 -33.107 1.00 74.00 C ATOM 889 CZ3 TRP A 56 -7.612 -4.844 -32.098 1.00 42.00 C ATOM 890 CH2 TRP A 56 -6.651 -4.012 -32.682 1.00 42.00 C ATOM 0 H TRP A 56 -6.858 -11.251 -30.388 1.00 1.00 H new ATOM 0 HA TRP A 56 -4.342 -10.171 -31.405 1.00 41.00 H new ATOM 0 HB2 TRP A 56 -6.449 -9.905 -32.713 1.00 3.00 H new ATOM 0 HB3 TRP A 56 -7.129 -9.029 -31.356 1.00 3.00 H new ATOM 0 HD1 TRP A 56 -3.668 -8.719 -33.101 1.00 2.00 H new ATOM 0 HE1 TRP A 56 -3.271 -6.256 -33.705 1.00 41.00 H new ATOM 0 HE3 TRP A 56 -8.127 -6.831 -31.488 1.00 44.00 H new ATOM 0 HZ2 TRP A 56 -4.706 -3.852 -33.551 1.00 74.00 H new ATOM 0 HZ3 TRP A 56 -8.550 -4.423 -31.768 1.00 42.00 H new ATOM 0 HH2 TRP A 56 -6.865 -2.960 -32.800 1.00 42.00 H new ATOM 901 N SER A 57 -3.910 -9.008 -29.421 1.00 22.00 N ATOM 902 CA SER A 57 -3.463 -8.362 -28.239 1.00 43.00 C ATOM 903 C SER A 57 -3.012 -6.954 -28.594 1.00 54.00 C ATOM 904 O SER A 57 -2.005 -6.773 -29.246 1.00 41.00 O ATOM 905 CB SER A 57 -2.324 -9.191 -27.653 1.00 40.00 C ATOM 906 OG SER A 57 -2.765 -10.508 -27.386 1.00 55.00 O ATOM 0 H SER A 57 -3.165 -9.183 -30.095 1.00 22.00 H new ATOM 0 HA SER A 57 -4.256 -8.283 -27.496 1.00 43.00 H new ATOM 0 HB2 SER A 57 -1.486 -9.215 -28.350 1.00 40.00 H new ATOM 0 HB3 SER A 57 -1.962 -8.728 -26.735 1.00 40.00 H new ATOM 0 HG SER A 57 -2.026 -11.031 -27.012 1.00 55.00 H new ATOM 912 N LYS A 58 -3.786 -5.970 -28.205 1.00 43.00 N ATOM 913 CA LYS A 58 -3.485 -4.591 -28.543 1.00 20.00 C ATOM 914 C LYS A 58 -2.405 -4.052 -27.603 1.00 53.00 C ATOM 915 O LYS A 58 -1.549 -3.244 -27.997 1.00 55.00 O ATOM 916 CB LYS A 58 -4.759 -3.758 -28.421 1.00 50.00 C ATOM 917 CG LYS A 58 -4.664 -2.334 -28.943 1.00 10.00 C ATOM 918 CD LYS A 58 -4.407 -2.322 -30.434 1.00 71.00 C ATOM 919 CE LYS A 58 -4.462 -0.916 -31.005 1.00 21.00 C ATOM 920 NZ LYS A 58 -5.798 -0.297 -30.855 1.00 25.00 N ATOM 0 H LYS A 58 -4.634 -6.095 -27.652 1.00 43.00 H new ATOM 0 HA LYS A 58 -3.114 -4.533 -29.566 1.00 20.00 H new ATOM 0 HB2 LYS A 58 -5.559 -4.270 -28.956 1.00 50.00 H new ATOM 0 HB3 LYS A 58 -5.050 -3.723 -27.371 1.00 50.00 H new ATOM 0 HG2 LYS A 58 -5.589 -1.800 -28.725 1.00 10.00 H new ATOM 0 HG3 LYS A 58 -3.862 -1.806 -28.427 1.00 10.00 H new ATOM 0 HD2 LYS A 58 -3.429 -2.759 -30.638 1.00 71.00 H new ATOM 0 HD3 LYS A 58 -5.146 -2.947 -30.935 1.00 71.00 H new ATOM 0 HE2 LYS A 58 -3.719 -0.295 -30.505 1.00 21.00 H new ATOM 0 HE3 LYS A 58 -4.195 -0.945 -32.061 1.00 21.00 H new ATOM 0 HZ1 LYS A 58 -5.870 0.529 -31.483 1.00 25.00 H new ATOM 0 HZ2 LYS A 58 -6.532 -0.989 -31.108 1.00 25.00 H new ATOM 0 HZ3 LYS A 58 -5.932 0.005 -29.869 1.00 25.00 H new ATOM 934 N GLY A 59 -2.444 -4.533 -26.382 1.00 33.00 N ATOM 935 CA GLY A 59 -1.509 -4.122 -25.370 1.00 24.00 C ATOM 936 C GLY A 59 -2.118 -4.280 -24.006 1.00 30.00 C ATOM 937 O GLY A 59 -1.819 -5.224 -23.291 1.00 70.00 O ATOM 0 H GLY A 59 -3.127 -5.221 -26.066 1.00 33.00 H new ATOM 0 HA2 GLY A 59 -0.599 -4.718 -25.441 1.00 24.00 H new ATOM 0 HA3 GLY A 59 -1.222 -3.083 -25.530 1.00 24.00 H new ATOM 941 N ASP A 60 -3.033 -3.401 -23.686 1.00 10.00 N ATOM 942 CA ASP A 60 -3.725 -3.430 -22.404 1.00 23.00 C ATOM 943 C ASP A 60 -5.110 -3.976 -22.585 1.00 61.00 C ATOM 944 O ASP A 60 -5.904 -4.008 -21.657 1.00 42.00 O ATOM 945 CB ASP A 60 -3.816 -2.043 -21.759 1.00 42.00 C ATOM 946 CG ASP A 60 -2.509 -1.525 -21.211 1.00 4.00 C ATOM 947 OD1 ASP A 60 -2.201 -1.779 -20.016 1.00 12.00 O ATOM 948 OD2 ASP A 60 -1.775 -0.832 -21.941 1.00 14.00 O ATOM 0 H ASP A 60 -3.326 -2.641 -24.300 1.00 10.00 H new ATOM 0 HA ASP A 60 -3.144 -4.071 -21.741 1.00 23.00 H new ATOM 0 HB2 ASP A 60 -4.192 -1.336 -22.498 1.00 42.00 H new ATOM 0 HB3 ASP A 60 -4.547 -2.078 -20.951 1.00 42.00 H new ATOM 953 N GLU A 61 -5.405 -4.388 -23.780 1.00 42.00 N ATOM 954 CA GLU A 61 -6.664 -4.963 -24.114 1.00 54.00 C ATOM 955 C GLU A 61 -6.434 -6.111 -25.057 1.00 54.00 C ATOM 956 O GLU A 61 -5.394 -6.159 -25.760 1.00 25.00 O ATOM 957 CB GLU A 61 -7.602 -3.911 -24.701 1.00 24.00 C ATOM 958 CG GLU A 61 -7.019 -3.172 -25.870 1.00 14.00 C ATOM 959 CD GLU A 61 -7.859 -2.014 -26.329 1.00 11.00 C ATOM 960 OE1 GLU A 61 -8.267 -1.187 -25.487 1.00 65.00 O ATOM 961 OE2 GLU A 61 -8.036 -1.841 -27.534 1.00 31.00 O ATOM 0 H GLU A 61 -4.758 -4.330 -24.567 1.00 42.00 H new ATOM 0 HA GLU A 61 -7.152 -5.343 -23.217 1.00 54.00 H new ATOM 0 HB2 GLU A 61 -8.528 -4.395 -25.013 1.00 24.00 H new ATOM 0 HB3 GLU A 61 -7.863 -3.194 -23.922 1.00 24.00 H new ATOM 0 HG2 GLU A 61 -6.028 -2.807 -25.601 1.00 14.00 H new ATOM 0 HG3 GLU A 61 -6.888 -3.867 -26.700 1.00 14.00 H new ATOM 968 N ALA A 62 -7.351 -7.026 -25.067 1.00 32.00 N ATOM 969 CA ALA A 62 -7.243 -8.203 -25.833 1.00 40.00 C ATOM 970 C ALA A 62 -8.594 -8.516 -26.405 1.00 32.00 C ATOM 971 O ALA A 62 -9.624 -8.312 -25.747 1.00 33.00 O ATOM 972 CB ALA A 62 -6.776 -9.350 -24.959 1.00 54.00 C ATOM 0 H ALA A 62 -8.213 -6.963 -24.525 1.00 32.00 H new ATOM 0 HA ALA A 62 -6.518 -8.062 -26.634 1.00 40.00 H new ATOM 0 HB1 ALA A 62 -6.695 -10.256 -25.560 1.00 54.00 H new ATOM 0 HB2 ALA A 62 -5.802 -9.109 -24.533 1.00 54.00 H new ATOM 0 HB3 ALA A 62 -7.494 -9.511 -24.155 1.00 54.00 H new ATOM 978 N THR A 63 -8.602 -8.941 -27.609 1.00 24.00 N ATOM 979 CA THR A 63 -9.805 -9.306 -28.299 1.00 12.00 C ATOM 980 C THR A 63 -9.519 -10.545 -29.158 1.00 62.00 C ATOM 981 O THR A 63 -8.486 -10.629 -29.813 1.00 24.00 O ATOM 982 CB THR A 63 -10.290 -8.126 -29.174 1.00 42.00 C ATOM 983 OG1 THR A 63 -10.327 -6.945 -28.358 1.00 61.00 O ATOM 984 CG2 THR A 63 -11.693 -8.386 -29.696 1.00 21.00 C ATOM 0 H THR A 63 -7.757 -9.053 -28.169 1.00 24.00 H new ATOM 0 HA THR A 63 -10.594 -9.539 -27.584 1.00 12.00 H new ATOM 0 HB THR A 63 -9.611 -8.007 -30.018 1.00 42.00 H new ATOM 0 HG1 THR A 63 -10.631 -6.185 -28.896 1.00 61.00 H new ATOM 0 HG21 THR A 63 -12.015 -7.544 -30.309 1.00 21.00 H new ATOM 0 HG22 THR A 63 -11.695 -9.295 -30.298 1.00 21.00 H new ATOM 0 HG23 THR A 63 -12.377 -8.506 -28.856 1.00 21.00 H new ATOM 992 N VAL A 64 -10.399 -11.509 -29.107 1.00 21.00 N ATOM 993 CA VAL A 64 -10.219 -12.753 -29.808 1.00 14.00 C ATOM 994 C VAL A 64 -11.386 -12.987 -30.754 1.00 51.00 C ATOM 995 O VAL A 64 -12.513 -13.175 -30.303 1.00 1.00 O ATOM 996 CB VAL A 64 -10.155 -13.930 -28.832 1.00 14.00 C ATOM 997 CG1 VAL A 64 -9.857 -15.187 -29.582 1.00 74.00 C ATOM 998 CG2 VAL A 64 -9.127 -13.708 -27.752 1.00 24.00 C ATOM 0 H VAL A 64 -11.267 -11.453 -28.574 1.00 21.00 H new ATOM 0 HA VAL A 64 -9.282 -12.688 -30.361 1.00 14.00 H new ATOM 0 HB VAL A 64 -11.125 -14.017 -28.343 1.00 14.00 H new ATOM 0 HG11 VAL A 64 -9.812 -16.024 -28.885 1.00 74.00 H new ATOM 0 HG12 VAL A 64 -10.642 -15.368 -30.316 1.00 74.00 H new ATOM 0 HG13 VAL A 64 -8.899 -15.088 -30.093 1.00 74.00 H new ATOM 0 HG21 VAL A 64 -9.114 -14.566 -27.080 1.00 24.00 H new ATOM 0 HG22 VAL A 64 -8.143 -13.587 -28.205 1.00 24.00 H new ATOM 0 HG23 VAL A 64 -9.380 -12.810 -27.188 1.00 24.00 H new ATOM 1008 N TYR A 65 -11.110 -13.028 -32.033 1.00 45.00 N ATOM 1009 CA TYR A 65 -12.146 -13.135 -33.044 1.00 44.00 C ATOM 1010 C TYR A 65 -11.784 -14.085 -34.174 1.00 35.00 C ATOM 1011 O TYR A 65 -10.899 -13.833 -34.944 1.00 63.00 O ATOM 1012 CB TYR A 65 -12.442 -11.722 -33.605 1.00 73.00 C ATOM 1013 CG TYR A 65 -13.259 -11.649 -34.905 1.00 15.00 C ATOM 1014 CD1 TYR A 65 -14.625 -11.867 -34.917 1.00 2.00 C ATOM 1015 CD2 TYR A 65 -12.642 -11.341 -36.118 1.00 12.00 C ATOM 1016 CE1 TYR A 65 -15.355 -11.792 -36.081 1.00 40.00 C ATOM 1017 CE2 TYR A 65 -13.370 -11.264 -37.290 1.00 53.00 C ATOM 1018 CZ TYR A 65 -14.727 -11.492 -37.263 1.00 3.00 C ATOM 1019 OH TYR A 65 -15.465 -11.418 -38.428 1.00 61.00 O ATOM 0 H TYR A 65 -10.163 -12.989 -32.409 1.00 45.00 H new ATOM 0 HA TYR A 65 -13.032 -13.555 -32.568 1.00 44.00 H new ATOM 0 HB2 TYR A 65 -12.972 -11.157 -32.839 1.00 73.00 H new ATOM 0 HB3 TYR A 65 -11.491 -11.217 -33.773 1.00 73.00 H new ATOM 0 HD1 TYR A 65 -15.130 -12.101 -33.992 1.00 2.00 H new ATOM 0 HD2 TYR A 65 -11.578 -11.160 -36.141 1.00 12.00 H new ATOM 0 HE1 TYR A 65 -16.420 -11.969 -36.064 1.00 40.00 H new ATOM 0 HE2 TYR A 65 -12.877 -11.026 -38.221 1.00 53.00 H new ATOM 0 HH TYR A 65 -14.873 -11.195 -39.177 1.00 61.00 H new ATOM 1029 N LYS A 66 -12.437 -15.195 -34.205 1.00 12.00 N ATOM 1030 CA LYS A 66 -12.482 -16.015 -35.335 1.00 53.00 C ATOM 1031 C LYS A 66 -13.644 -15.420 -36.074 1.00 13.00 C ATOM 1032 O LYS A 66 -14.554 -14.891 -35.435 1.00 12.00 O ATOM 1033 CB LYS A 66 -12.848 -17.475 -34.976 1.00 41.00 C ATOM 1034 CG LYS A 66 -12.870 -18.388 -36.194 1.00 54.00 C ATOM 1035 CD LYS A 66 -13.676 -19.674 -36.017 1.00 75.00 C ATOM 1036 CE LYS A 66 -13.183 -20.549 -34.880 1.00 4.00 C ATOM 1037 NZ LYS A 66 -13.722 -21.912 -34.965 1.00 23.00 N ATOM 0 H LYS A 66 -12.967 -15.556 -33.412 1.00 12.00 H new ATOM 0 HA LYS A 66 -11.532 -16.054 -35.867 1.00 53.00 H new ATOM 0 HB2 LYS A 66 -12.129 -17.858 -34.252 1.00 41.00 H new ATOM 0 HB3 LYS A 66 -13.826 -17.493 -34.495 1.00 41.00 H new ATOM 0 HG2 LYS A 66 -13.278 -17.833 -37.039 1.00 54.00 H new ATOM 0 HG3 LYS A 66 -11.844 -18.651 -36.452 1.00 54.00 H new ATOM 0 HD2 LYS A 66 -14.720 -19.417 -35.840 1.00 75.00 H new ATOM 0 HD3 LYS A 66 -13.642 -20.245 -36.945 1.00 75.00 H new ATOM 0 HE2 LYS A 66 -12.094 -20.588 -34.898 1.00 4.00 H new ATOM 0 HE3 LYS A 66 -13.471 -20.103 -33.928 1.00 4.00 H new ATOM 0 HZ1 LYS A 66 -13.362 -22.478 -34.170 1.00 23.00 H new ATOM 0 HZ2 LYS A 66 -14.761 -21.878 -34.923 1.00 23.00 H new ATOM 0 HZ3 LYS A 66 -13.426 -22.347 -35.862 1.00 23.00 H new ATOM 1051 N ARG A 67 -13.669 -15.552 -37.332 1.00 24.00 N ATOM 1052 CA ARG A 67 -14.712 -14.943 -38.162 1.00 54.00 C ATOM 1053 C ARG A 67 -16.101 -15.504 -37.816 1.00 45.00 C ATOM 1054 O ARG A 67 -17.127 -14.853 -38.020 1.00 25.00 O ATOM 1055 CB ARG A 67 -14.338 -15.040 -39.672 1.00 40.00 C ATOM 1056 CG ARG A 67 -15.404 -14.587 -40.665 1.00 4.00 C ATOM 1057 CD ARG A 67 -16.298 -15.749 -41.073 1.00 22.00 C ATOM 1058 NE ARG A 67 -15.559 -16.752 -41.855 1.00 12.00 N ATOM 1059 CZ ARG A 67 -16.036 -17.932 -42.276 1.00 73.00 C ATOM 1060 NH1 ARG A 67 -17.251 -18.329 -41.940 1.00 75.00 N ATOM 1061 NH2 ARG A 67 -15.274 -18.718 -43.021 1.00 20.00 N ATOM 0 H ARG A 67 -12.976 -16.084 -37.858 1.00 24.00 H new ATOM 0 HA ARG A 67 -14.773 -13.878 -37.938 1.00 54.00 H new ATOM 0 HB2 ARG A 67 -13.440 -14.446 -39.840 1.00 40.00 H new ATOM 0 HB3 ARG A 67 -14.082 -16.076 -39.895 1.00 40.00 H new ATOM 0 HG2 ARG A 67 -16.009 -13.797 -40.220 1.00 4.00 H new ATOM 0 HG3 ARG A 67 -14.927 -14.163 -41.548 1.00 4.00 H new ATOM 0 HD2 ARG A 67 -16.716 -16.217 -40.182 1.00 22.00 H new ATOM 0 HD3 ARG A 67 -17.137 -15.375 -41.660 1.00 22.00 H new ATOM 0 HE ARG A 67 -14.594 -16.529 -42.100 1.00 12.00 H new ATOM 0 HH11 ARG A 67 -17.838 -17.735 -41.354 1.00 75.00 H new ATOM 0 HH12 ARG A 67 -17.602 -19.229 -42.267 1.00 75.00 H new ATOM 0 HH21 ARG A 67 -14.330 -18.424 -43.271 1.00 20.00 H new ATOM 0 HH22 ARG A 67 -15.631 -19.617 -43.344 1.00 20.00 H new ATOM 1075 N ASP A 68 -16.113 -16.679 -37.224 1.00 33.00 N ATOM 1076 CA ASP A 68 -17.343 -17.301 -36.808 1.00 23.00 C ATOM 1077 C ASP A 68 -17.571 -17.128 -35.336 1.00 40.00 C ATOM 1078 O ASP A 68 -18.716 -17.168 -34.871 1.00 62.00 O ATOM 1079 CB ASP A 68 -17.416 -18.787 -37.156 1.00 42.00 C ATOM 1080 CG ASP A 68 -17.570 -19.072 -38.621 1.00 23.00 C ATOM 1081 OD1 ASP A 68 -18.491 -18.511 -39.254 1.00 0.00 O ATOM 1082 OD2 ASP A 68 -16.798 -19.901 -39.163 1.00 75.00 O ATOM 0 H ASP A 68 -15.275 -17.223 -37.020 1.00 33.00 H new ATOM 0 HA ASP A 68 -18.128 -16.791 -37.366 1.00 23.00 H new ATOM 0 HB2 ASP A 68 -16.512 -19.277 -36.796 1.00 42.00 H new ATOM 0 HB3 ASP A 68 -18.255 -19.233 -36.621 1.00 42.00 H new ATOM 1087 N ARG A 69 -16.517 -16.876 -34.589 1.00 24.00 N ATOM 1088 CA ARG A 69 -16.664 -16.804 -33.173 1.00 74.00 C ATOM 1089 C ARG A 69 -15.577 -16.019 -32.459 1.00 63.00 C ATOM 1090 O ARG A 69 -14.386 -16.314 -32.529 1.00 21.00 O ATOM 1091 CB ARG A 69 -16.835 -18.170 -32.492 1.00 63.00 C ATOM 1092 CG ARG A 69 -17.192 -18.021 -31.011 1.00 24.00 C ATOM 1093 CD ARG A 69 -17.239 -19.331 -30.288 1.00 42.00 C ATOM 1094 NE ARG A 69 -17.660 -19.154 -28.880 1.00 64.00 N ATOM 1095 CZ ARG A 69 -17.577 -20.073 -27.893 1.00 13.00 C ATOM 1096 NH1 ARG A 69 -17.077 -21.285 -28.126 1.00 42.00 N ATOM 1097 NH2 ARG A 69 -17.984 -19.756 -26.657 1.00 35.00 N ATOM 0 H ARG A 69 -15.572 -16.722 -34.941 1.00 24.00 H new ATOM 0 HA ARG A 69 -17.595 -16.247 -33.068 1.00 74.00 H new ATOM 0 HB2 ARG A 69 -17.616 -18.735 -33.000 1.00 63.00 H new ATOM 0 HB3 ARG A 69 -15.913 -18.743 -32.589 1.00 63.00 H new ATOM 0 HG2 ARG A 69 -16.460 -17.372 -30.530 1.00 24.00 H new ATOM 0 HG3 ARG A 69 -18.161 -17.529 -30.924 1.00 24.00 H new ATOM 0 HD2 ARG A 69 -17.931 -20.004 -30.795 1.00 42.00 H new ATOM 0 HD3 ARG A 69 -16.256 -19.802 -30.319 1.00 42.00 H new ATOM 0 HE ARG A 69 -18.052 -18.246 -28.630 1.00 64.00 H new ATOM 0 HH11 ARG A 69 -16.750 -21.531 -29.060 1.00 42.00 H new ATOM 0 HH12 ARG A 69 -17.021 -21.968 -27.370 1.00 42.00 H new ATOM 0 HH21 ARG A 69 -18.354 -18.825 -26.465 1.00 35.00 H new ATOM 0 HH22 ARG A 69 -17.924 -20.445 -25.908 1.00 35.00 H new ATOM 1111 N ILE A 70 -16.038 -15.049 -31.798 1.00 25.00 N ATOM 1112 CA ILE A 70 -15.314 -14.267 -30.830 1.00 52.00 C ATOM 1113 C ILE A 70 -15.440 -15.011 -29.551 1.00 1.00 C ATOM 1114 O ILE A 70 -16.542 -15.428 -29.171 1.00 50.00 O ATOM 1115 CB ILE A 70 -15.982 -12.894 -30.590 1.00 20.00 C ATOM 1116 CG1 ILE A 70 -16.080 -12.093 -31.859 1.00 1.00 C ATOM 1117 CG2 ILE A 70 -15.276 -12.095 -29.489 1.00 54.00 C ATOM 1118 CD1 ILE A 70 -16.849 -10.793 -31.729 1.00 52.00 C ATOM 0 H ILE A 70 -17.002 -14.735 -31.908 1.00 25.00 H new ATOM 0 HA ILE A 70 -14.292 -14.111 -31.175 1.00 52.00 H new ATOM 0 HB ILE A 70 -16.996 -13.097 -30.246 1.00 20.00 H new ATOM 0 HG12 ILE A 70 -15.073 -11.870 -32.211 1.00 1.00 H new ATOM 0 HG13 ILE A 70 -16.556 -12.706 -32.624 1.00 1.00 H new ATOM 0 HG21 ILE A 70 -15.779 -11.138 -29.355 1.00 54.00 H new ATOM 0 HG22 ILE A 70 -15.308 -12.656 -28.555 1.00 54.00 H new ATOM 0 HG23 ILE A 70 -14.238 -11.922 -29.773 1.00 54.00 H new ATOM 0 HD11 ILE A 70 -16.868 -10.283 -32.692 1.00 52.00 H new ATOM 0 HD12 ILE A 70 -17.870 -11.004 -31.410 1.00 52.00 H new ATOM 0 HD13 ILE A 70 -16.363 -10.155 -30.991 1.00 52.00 H new ATOM 1130 N VAL A 71 -14.379 -15.188 -28.912 1.00 51.00 N ATOM 1131 CA VAL A 71 -14.400 -15.867 -27.649 1.00 62.00 C ATOM 1132 C VAL A 71 -14.121 -14.904 -26.516 1.00 14.00 C ATOM 1133 O VAL A 71 -14.591 -15.097 -25.408 1.00 41.00 O ATOM 1134 CB VAL A 71 -13.530 -17.174 -27.590 1.00 42.00 C ATOM 1135 CG1 VAL A 71 -14.077 -18.224 -28.544 1.00 23.00 C ATOM 1136 CG2 VAL A 71 -12.091 -16.913 -27.931 1.00 34.00 C ATOM 0 H VAL A 71 -13.457 -14.879 -29.221 1.00 51.00 H new ATOM 0 HA VAL A 71 -15.415 -16.242 -27.522 1.00 62.00 H new ATOM 0 HB VAL A 71 -13.582 -17.537 -26.563 1.00 42.00 H new ATOM 0 HG11 VAL A 71 -13.461 -19.122 -28.489 1.00 23.00 H new ATOM 0 HG12 VAL A 71 -15.102 -18.469 -28.266 1.00 23.00 H new ATOM 0 HG13 VAL A 71 -14.060 -17.835 -29.562 1.00 23.00 H new ATOM 0 HG21 VAL A 71 -11.529 -17.846 -27.877 1.00 34.00 H new ATOM 0 HG22 VAL A 71 -12.024 -16.507 -28.940 1.00 34.00 H new ATOM 0 HG23 VAL A 71 -11.674 -16.196 -27.224 1.00 34.00 H new ATOM 1146 N LEU A 72 -13.447 -13.803 -26.833 1.00 34.00 N ATOM 1147 CA LEU A 72 -13.112 -12.761 -25.840 1.00 32.00 C ATOM 1148 C LEU A 72 -13.132 -11.401 -26.508 1.00 14.00 C ATOM 1149 O LEU A 72 -12.568 -11.248 -27.582 1.00 64.00 O ATOM 1150 CB LEU A 72 -11.699 -12.938 -25.200 1.00 30.00 C ATOM 1151 CG LEU A 72 -11.466 -14.024 -24.125 1.00 60.00 C ATOM 1152 CD1 LEU A 72 -11.463 -15.434 -24.679 1.00 21.00 C ATOM 1153 CD2 LEU A 72 -10.184 -13.754 -23.392 1.00 24.00 C ATOM 0 H LEU A 72 -13.115 -13.599 -27.776 1.00 34.00 H new ATOM 0 HA LEU A 72 -13.859 -12.850 -25.051 1.00 32.00 H new ATOM 0 HB2 LEU A 72 -10.998 -13.130 -26.012 1.00 30.00 H new ATOM 0 HB3 LEU A 72 -11.421 -11.981 -24.759 1.00 30.00 H new ATOM 0 HG LEU A 72 -12.311 -13.966 -23.439 1.00 60.00 H new ATOM 0 HD11 LEU A 72 -11.294 -16.143 -23.869 1.00 21.00 H new ATOM 0 HD12 LEU A 72 -12.424 -15.642 -25.149 1.00 21.00 H new ATOM 0 HD13 LEU A 72 -10.668 -15.533 -25.419 1.00 21.00 H new ATOM 0 HD21 LEU A 72 -10.028 -14.524 -22.636 1.00 24.00 H new ATOM 0 HD22 LEU A 72 -9.353 -13.763 -24.097 1.00 24.00 H new ATOM 0 HD23 LEU A 72 -10.239 -12.778 -22.909 1.00 24.00 H new ATOM 1165 N ASN A 73 -13.807 -10.436 -25.925 1.00 30.00 N ATOM 1166 CA ASN A 73 -13.762 -9.058 -26.452 1.00 3.00 C ATOM 1167 C ASN A 73 -13.832 -8.041 -25.328 1.00 44.00 C ATOM 1168 O ASN A 73 -14.065 -6.848 -25.548 1.00 74.00 O ATOM 1169 CB ASN A 73 -14.849 -8.794 -27.523 1.00 5.00 C ATOM 1170 CG ASN A 73 -16.273 -8.910 -27.013 1.00 42.00 C ATOM 1171 OD1 ASN A 73 -16.878 -7.928 -26.569 1.00 63.00 O ATOM 1172 ND2 ASN A 73 -16.823 -10.097 -27.085 1.00 12.00 N ATOM 0 H ASN A 73 -14.390 -10.559 -25.097 1.00 30.00 H new ATOM 0 HA ASN A 73 -12.801 -8.943 -26.953 1.00 3.00 H new ATOM 0 HB2 ASN A 73 -14.703 -7.794 -27.932 1.00 5.00 H new ATOM 0 HB3 ASN A 73 -14.712 -9.498 -28.344 1.00 5.00 H new ATOM 0 HD21 ASN A 73 -17.783 -10.234 -26.768 1.00 12.00 H new ATOM 0 HD22 ASN A 73 -16.291 -10.884 -27.458 1.00 12.00 H new ATOM 1179 N ASN A 74 -13.529 -8.502 -24.143 1.00 23.00 N ATOM 1180 CA ASN A 74 -13.565 -7.685 -22.964 1.00 40.00 C ATOM 1181 C ASN A 74 -12.505 -8.156 -22.014 1.00 23.00 C ATOM 1182 O ASN A 74 -12.763 -8.948 -21.104 1.00 73.00 O ATOM 1183 CB ASN A 74 -14.948 -7.684 -22.282 1.00 10.00 C ATOM 1184 CG ASN A 74 -15.000 -6.788 -21.040 1.00 40.00 C ATOM 1185 OD1 ASN A 74 -14.283 -5.791 -20.944 1.00 32.00 O ATOM 1186 ND2 ASN A 74 -15.856 -7.119 -20.103 1.00 2.00 N ATOM 0 H ASN A 74 -13.247 -9.467 -23.970 1.00 23.00 H new ATOM 0 HA ASN A 74 -13.373 -6.654 -23.261 1.00 40.00 H new ATOM 0 HB2 ASN A 74 -15.700 -7.349 -22.997 1.00 10.00 H new ATOM 0 HB3 ASN A 74 -15.209 -8.704 -21.999 1.00 10.00 H new ATOM 0 HD21 ASN A 74 -15.942 -6.544 -19.265 1.00 2.00 H new ATOM 0 HD22 ASN A 74 -16.436 -7.951 -20.213 1.00 2.00 H new ATOM 1193 N CYS A 75 -11.304 -7.762 -22.306 1.00 14.00 N ATOM 1194 CA CYS A 75 -10.171 -8.066 -21.491 1.00 53.00 C ATOM 1195 C CYS A 75 -9.265 -6.904 -21.460 1.00 34.00 C ATOM 1196 O CYS A 75 -8.995 -6.293 -22.502 1.00 55.00 O ATOM 1197 CB CYS A 75 -9.435 -9.298 -21.967 1.00 15.00 C ATOM 1198 SG CYS A 75 -10.148 -10.854 -21.382 1.00 61.00 S ATOM 0 H CYS A 75 -11.081 -7.209 -23.134 1.00 14.00 H new ATOM 0 HA CYS A 75 -10.530 -8.283 -20.485 1.00 53.00 H new ATOM 0 HB2 CYS A 75 -9.423 -9.303 -23.057 1.00 15.00 H new ATOM 0 HB3 CYS A 75 -8.398 -9.239 -21.637 1.00 15.00 H new ATOM 1203 N GLN A 76 -8.789 -6.602 -20.292 1.00 32.00 N ATOM 1204 CA GLN A 76 -7.991 -5.477 -20.042 1.00 72.00 C ATOM 1205 C GLN A 76 -6.923 -5.917 -19.131 1.00 75.00 C ATOM 1206 O GLN A 76 -7.162 -6.276 -17.990 1.00 74.00 O ATOM 1207 CB GLN A 76 -8.824 -4.355 -19.463 1.00 44.00 C ATOM 1208 CG GLN A 76 -9.768 -3.756 -20.481 1.00 25.00 C ATOM 1209 CD GLN A 76 -10.728 -2.757 -19.871 1.00 74.00 C ATOM 1210 OE1 GLN A 76 -10.428 -2.124 -18.851 1.00 63.00 O ATOM 1211 NE2 GLN A 76 -11.856 -2.577 -20.493 1.00 3.00 N ATOM 0 H GLN A 76 -8.963 -7.168 -19.461 1.00 32.00 H new ATOM 0 HA GLN A 76 -7.553 -5.077 -20.957 1.00 72.00 H new ATOM 0 HB2 GLN A 76 -9.398 -4.731 -18.616 1.00 44.00 H new ATOM 0 HB3 GLN A 76 -8.164 -3.576 -19.080 1.00 44.00 H new ATOM 0 HG2 GLN A 76 -9.189 -3.266 -21.263 1.00 25.00 H new ATOM 0 HG3 GLN A 76 -10.336 -4.555 -20.958 1.00 25.00 H new ATOM 0 HE21 GLN A 76 -12.068 -3.118 -21.331 1.00 3.00 H new ATOM 0 HE22 GLN A 76 -12.529 -1.895 -20.142 1.00 3.00 H new ATOM 1220 N LEU A 77 -5.768 -5.923 -19.647 1.00 72.00 N ATOM 1221 CA LEU A 77 -4.658 -6.534 -18.999 1.00 41.00 C ATOM 1222 C LEU A 77 -4.139 -5.688 -17.842 1.00 1.00 C ATOM 1223 O LEU A 77 -4.132 -4.463 -17.915 1.00 23.00 O ATOM 1224 CB LEU A 77 -3.552 -6.823 -20.019 1.00 40.00 C ATOM 1225 CG LEU A 77 -2.252 -7.454 -19.499 1.00 11.00 C ATOM 1226 CD1 LEU A 77 -2.517 -8.793 -18.854 1.00 23.00 C ATOM 1227 CD2 LEU A 77 -1.256 -7.591 -20.637 1.00 23.00 C ATOM 0 H LEU A 77 -5.547 -5.500 -20.548 1.00 72.00 H new ATOM 0 HA LEU A 77 -4.993 -7.478 -18.569 1.00 41.00 H new ATOM 0 HB2 LEU A 77 -3.964 -7.483 -20.783 1.00 40.00 H new ATOM 0 HB3 LEU A 77 -3.296 -5.885 -20.512 1.00 40.00 H new ATOM 0 HG LEU A 77 -1.829 -6.800 -18.736 1.00 11.00 H new ATOM 0 HD11 LEU A 77 -1.579 -9.216 -18.495 1.00 23.00 H new ATOM 0 HD12 LEU A 77 -3.201 -8.664 -18.015 1.00 23.00 H new ATOM 0 HD13 LEU A 77 -2.963 -9.467 -19.585 1.00 23.00 H new ATOM 0 HD21 LEU A 77 -0.335 -8.039 -20.263 1.00 23.00 H new ATOM 0 HD22 LEU A 77 -1.678 -8.226 -21.416 1.00 23.00 H new ATOM 0 HD23 LEU A 77 -1.038 -6.606 -21.050 1.00 23.00 H new ATOM 1239 N GLN A 78 -3.754 -6.343 -16.769 1.00 40.00 N ATOM 1240 CA GLN A 78 -3.163 -5.651 -15.646 1.00 32.00 C ATOM 1241 C GLN A 78 -1.670 -5.518 -15.876 1.00 13.00 C ATOM 1242 O GLN A 78 -1.152 -4.422 -16.023 1.00 74.00 O ATOM 1243 CB GLN A 78 -3.459 -6.395 -14.344 1.00 55.00 C ATOM 1244 CG GLN A 78 -4.946 -6.544 -14.081 1.00 71.00 C ATOM 1245 CD GLN A 78 -5.657 -5.208 -14.029 1.00 64.00 C ATOM 1246 OE1 GLN A 78 -5.083 -4.201 -13.629 1.00 42.00 O ATOM 1247 NE2 GLN A 78 -6.881 -5.177 -14.453 1.00 23.00 N ATOM 0 H GLN A 78 -3.840 -7.353 -16.651 1.00 40.00 H new ATOM 0 HA GLN A 78 -3.597 -4.655 -15.559 1.00 32.00 H new ATOM 0 HB2 GLN A 78 -3.000 -7.383 -14.382 1.00 55.00 H new ATOM 0 HB3 GLN A 78 -2.999 -5.861 -13.512 1.00 55.00 H new ATOM 0 HG2 GLN A 78 -5.391 -7.160 -14.863 1.00 71.00 H new ATOM 0 HG3 GLN A 78 -5.095 -7.069 -13.138 1.00 71.00 H new ATOM 0 HE21 GLN A 78 -7.330 -6.033 -14.779 1.00 23.00 H new ATOM 0 HE22 GLN A 78 -7.396 -4.297 -14.461 1.00 23.00 H new ATOM 1256 N ASN A 79 -1.009 -6.650 -15.961 1.00 50.00 N ATOM 1257 CA ASN A 79 0.407 -6.745 -16.223 1.00 31.00 C ATOM 1258 C ASN A 79 0.642 -8.216 -16.398 1.00 42.00 C ATOM 1259 O ASN A 79 0.221 -8.989 -15.540 1.00 34.00 O ATOM 1260 CB ASN A 79 1.239 -6.228 -15.031 1.00 41.00 C ATOM 1261 CG ASN A 79 2.731 -6.123 -15.334 1.00 31.00 C ATOM 1262 OD1 ASN A 79 3.568 -6.389 -14.476 1.00 12.00 O ATOM 1263 ND2 ASN A 79 3.078 -5.660 -16.518 1.00 32.00 N ATOM 0 H ASN A 79 -1.458 -7.559 -15.846 1.00 50.00 H new ATOM 0 HA ASN A 79 0.701 -6.148 -17.086 1.00 31.00 H new ATOM 0 HB2 ASN A 79 0.866 -5.248 -14.735 1.00 41.00 H new ATOM 0 HB3 ASN A 79 1.094 -6.894 -14.180 1.00 41.00 H new ATOM 0 HD21 ASN A 79 4.063 -5.514 -16.740 1.00 32.00 H new ATOM 0 HD22 ASN A 79 2.362 -5.447 -17.212 1.00 32.00 H new ATOM 1270 N PRO A 80 1.241 -8.662 -17.499 1.00 54.00 N ATOM 1271 CA PRO A 80 1.361 -10.080 -17.756 1.00 14.00 C ATOM 1272 C PRO A 80 2.410 -10.789 -16.887 1.00 35.00 C ATOM 1273 O PRO A 80 2.363 -12.011 -16.701 1.00 11.00 O ATOM 1274 CB PRO A 80 1.702 -10.172 -19.236 1.00 71.00 C ATOM 1275 CG PRO A 80 2.351 -8.869 -19.570 1.00 44.00 C ATOM 1276 CD PRO A 80 1.829 -7.848 -18.583 1.00 62.00 C ATOM 0 HA PRO A 80 0.435 -10.595 -17.499 1.00 14.00 H new ATOM 0 HB2 PRO A 80 2.373 -11.008 -19.434 1.00 71.00 H new ATOM 0 HB3 PRO A 80 0.807 -10.332 -19.837 1.00 71.00 H new ATOM 0 HG2 PRO A 80 3.436 -8.950 -19.503 1.00 44.00 H new ATOM 0 HG3 PRO A 80 2.116 -8.572 -20.592 1.00 44.00 H new ATOM 0 HD2 PRO A 80 2.629 -7.208 -18.211 1.00 62.00 H new ATOM 0 HD3 PRO A 80 1.085 -7.196 -19.040 1.00 62.00 H new ATOM 1284 N GLN A 81 3.352 -10.061 -16.355 1.00 25.00 N ATOM 1285 CA GLN A 81 4.295 -10.674 -15.543 1.00 13.00 C ATOM 1286 C GLN A 81 3.857 -10.603 -14.101 1.00 65.00 C ATOM 1287 O GLN A 81 4.119 -9.627 -13.379 1.00 73.00 O ATOM 1288 CB GLN A 81 5.653 -10.111 -15.769 1.00 33.00 C ATOM 1289 CG GLN A 81 6.725 -11.053 -15.359 1.00 61.00 C ATOM 1290 CD GLN A 81 8.057 -10.697 -15.959 1.00 21.00 C ATOM 1291 OE1 GLN A 81 8.869 -9.971 -15.369 1.00 74.00 O ATOM 1292 NE2 GLN A 81 8.271 -11.146 -17.162 1.00 53.00 N ATOM 0 H GLN A 81 3.464 -9.055 -16.483 1.00 25.00 H new ATOM 0 HA GLN A 81 4.364 -11.729 -15.809 1.00 13.00 H new ATOM 0 HB2 GLN A 81 5.772 -9.865 -16.824 1.00 33.00 H new ATOM 0 HB3 GLN A 81 5.756 -9.180 -15.211 1.00 33.00 H new ATOM 0 HG2 GLN A 81 6.807 -11.055 -14.272 1.00 61.00 H new ATOM 0 HG3 GLN A 81 6.452 -12.064 -15.660 1.00 61.00 H new ATOM 0 HE21 GLN A 81 7.578 -11.742 -17.615 1.00 53.00 H new ATOM 0 HE22 GLN A 81 9.132 -10.902 -17.652 1.00 53.00 H new