USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 828 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 31 CYS SG : rot -97:sc= -2.1 USER MOD Set 1.2: A 54 SER OG : rot -161:sc= 1.14! USER MOD Single : A 1 GLY N :NH3+ -113:sc= 0.115 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc=-0.00806 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 14 ASN : amide:sc= -0.363 K(o=-0.36,f=-2.9!) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot 180:sc= -1.74! USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc=-0.000338 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= -0.0136 X(o=-0.014,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 180:sc= -0.421 USER MOD Single : A 47 HIS : no HD1:sc= -0.678 K(o=-0.68,f=-2) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 170:sc= -0.0133 USER MOD Single : A 64 GLN : amide:sc= -0.46 K(o=-0.46,f=-1.8) USER MOD Single : A 69 ASN : amide:sc= -6.65! C(o=-6.6!,f=-7.3!) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= -0.0131 X(o=-0.013,f=0) USER MOD Single : A 78 HIS : no HE2:sc= -0.897 K(o=-0.9,f=-2.1!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 ASN : amide:sc= -0.0384 X(o=-0.038,f=0) USER MOD Single : A 86 LYS NZ :NH3+ -130:sc= -0.006 (180deg=-0.577) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0.101 USER MOD Single : A 92 THR OG1 : rot -80:sc= 1 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 105 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 10.268 17.778 -25.939 1.00 0.00 N ATOM 2 CA GLY A 1 11.209 16.690 -25.737 1.00 0.00 C ATOM 3 C GLY A 1 12.594 17.057 -26.272 1.00 0.00 C ATOM 4 O GLY A 1 12.752 18.065 -26.958 1.00 0.00 O ATOM 0 H1 GLY A 1 9.988 18.170 -25.017 1.00 0.00 H new ATOM 0 H2 GLY A 1 10.716 18.523 -26.511 1.00 0.00 H new ATOM 0 H3 GLY A 1 9.426 17.421 -26.434 1.00 0.00 H new ATOM 0 HA2 GLY A 1 11.276 16.455 -24.675 1.00 0.00 H new ATOM 0 HA3 GLY A 1 10.847 15.793 -26.240 1.00 0.00 H new ATOM 8 N SER A 2 13.564 16.217 -25.938 1.00 0.00 N ATOM 9 CA SER A 2 14.931 16.441 -26.376 1.00 0.00 C ATOM 10 C SER A 2 15.285 15.467 -27.502 1.00 0.00 C ATOM 11 O SER A 2 15.639 15.887 -28.602 1.00 0.00 O ATOM 12 CB SER A 2 15.914 16.289 -25.214 1.00 0.00 C ATOM 13 OG SER A 2 17.259 16.160 -25.665 1.00 0.00 O ATOM 0 H SER A 2 13.430 15.381 -25.369 1.00 0.00 H new ATOM 0 HA SER A 2 15.008 17.462 -26.749 1.00 0.00 H new ATOM 0 HB2 SER A 2 15.834 17.154 -24.556 1.00 0.00 H new ATOM 0 HB3 SER A 2 15.644 15.413 -24.623 1.00 0.00 H new ATOM 0 HG SER A 2 17.855 16.067 -24.893 1.00 0.00 H new ATOM 19 N SER A 3 15.178 14.184 -27.187 1.00 0.00 N ATOM 20 CA SER A 3 15.482 13.147 -28.158 1.00 0.00 C ATOM 21 C SER A 3 15.167 11.771 -27.570 1.00 0.00 C ATOM 22 O SER A 3 15.041 11.625 -26.355 1.00 0.00 O ATOM 23 CB SER A 3 16.947 13.215 -28.595 1.00 0.00 C ATOM 24 OG SER A 3 17.224 12.328 -29.675 1.00 0.00 O ATOM 0 H SER A 3 14.885 13.839 -26.273 1.00 0.00 H new ATOM 0 HA SER A 3 14.860 13.309 -29.038 1.00 0.00 H new ATOM 0 HB2 SER A 3 17.189 14.235 -28.893 1.00 0.00 H new ATOM 0 HB3 SER A 3 17.589 12.968 -27.750 1.00 0.00 H new ATOM 0 HG SER A 3 18.169 12.402 -29.925 1.00 0.00 H new ATOM 30 N GLY A 4 15.049 10.795 -28.459 1.00 0.00 N ATOM 31 CA GLY A 4 14.750 9.436 -28.043 1.00 0.00 C ATOM 32 C GLY A 4 13.763 8.772 -29.005 1.00 0.00 C ATOM 33 O GLY A 4 12.553 8.957 -28.884 1.00 0.00 O ATOM 0 H GLY A 4 15.155 10.919 -29.466 1.00 0.00 H new ATOM 0 HA2 GLY A 4 15.671 8.854 -28.002 1.00 0.00 H new ATOM 0 HA3 GLY A 4 14.332 9.444 -27.036 1.00 0.00 H new ATOM 37 N SER A 5 14.317 8.012 -29.939 1.00 0.00 N ATOM 38 CA SER A 5 13.500 7.320 -30.922 1.00 0.00 C ATOM 39 C SER A 5 13.867 5.835 -30.954 1.00 0.00 C ATOM 40 O SER A 5 14.746 5.426 -31.711 1.00 0.00 O ATOM 41 CB SER A 5 13.667 7.939 -32.311 1.00 0.00 C ATOM 42 OG SER A 5 12.474 7.845 -33.084 1.00 0.00 O ATOM 0 H SER A 5 15.321 7.860 -30.036 1.00 0.00 H new ATOM 0 HA SER A 5 12.454 7.423 -30.632 1.00 0.00 H new ATOM 0 HB2 SER A 5 13.952 8.986 -32.209 1.00 0.00 H new ATOM 0 HB3 SER A 5 14.480 7.437 -32.836 1.00 0.00 H new ATOM 0 HG SER A 5 12.621 8.253 -33.963 1.00 0.00 H new ATOM 48 N SER A 6 13.176 5.069 -30.123 1.00 0.00 N ATOM 49 CA SER A 6 13.418 3.638 -30.047 1.00 0.00 C ATOM 50 C SER A 6 12.237 2.875 -30.649 1.00 0.00 C ATOM 51 O SER A 6 12.399 1.757 -31.136 1.00 0.00 O ATOM 52 CB SER A 6 13.655 3.196 -28.602 1.00 0.00 C ATOM 53 OG SER A 6 15.024 2.885 -28.357 1.00 0.00 O ATOM 0 H SER A 6 12.448 5.412 -29.496 1.00 0.00 H new ATOM 0 HA SER A 6 14.318 3.412 -30.620 1.00 0.00 H new ATOM 0 HB2 SER A 6 13.336 3.987 -27.924 1.00 0.00 H new ATOM 0 HB3 SER A 6 13.040 2.323 -28.384 1.00 0.00 H new ATOM 0 HG SER A 6 15.135 2.609 -27.423 1.00 0.00 H new ATOM 59 N GLY A 7 11.075 3.509 -30.596 1.00 0.00 N ATOM 60 CA GLY A 7 9.866 2.904 -31.130 1.00 0.00 C ATOM 61 C GLY A 7 9.237 1.948 -30.115 1.00 0.00 C ATOM 62 O GLY A 7 9.849 0.951 -29.734 1.00 0.00 O ATOM 0 H GLY A 7 10.945 4.436 -30.191 1.00 0.00 H new ATOM 0 HA2 GLY A 7 9.151 3.683 -31.393 1.00 0.00 H new ATOM 0 HA3 GLY A 7 10.100 2.364 -32.047 1.00 0.00 H new ATOM 66 N SER A 8 8.023 2.285 -29.705 1.00 0.00 N ATOM 67 CA SER A 8 7.305 1.469 -28.742 1.00 0.00 C ATOM 68 C SER A 8 6.483 0.403 -29.468 1.00 0.00 C ATOM 69 O SER A 8 5.893 0.673 -30.513 1.00 0.00 O ATOM 70 CB SER A 8 6.397 2.329 -27.860 1.00 0.00 C ATOM 71 OG SER A 8 7.140 3.092 -26.913 1.00 0.00 O ATOM 0 H SER A 8 7.519 3.113 -30.023 1.00 0.00 H new ATOM 0 HA SER A 8 8.035 0.979 -28.098 1.00 0.00 H new ATOM 0 HB2 SER A 8 5.812 3.001 -28.488 1.00 0.00 H new ATOM 0 HB3 SER A 8 5.690 1.688 -27.334 1.00 0.00 H new ATOM 0 HG SER A 8 6.525 3.629 -26.371 1.00 0.00 H new ATOM 77 N PRO A 9 6.471 -0.819 -28.871 1.00 0.00 N ATOM 78 CA PRO A 9 5.732 -1.928 -29.450 1.00 0.00 C ATOM 79 C PRO A 9 4.228 -1.763 -29.222 1.00 0.00 C ATOM 80 O PRO A 9 3.443 -1.817 -30.167 1.00 0.00 O ATOM 81 CB PRO A 9 6.301 -3.171 -28.785 1.00 0.00 C ATOM 82 CG PRO A 9 7.006 -2.685 -27.529 1.00 0.00 C ATOM 83 CD PRO A 9 7.159 -1.177 -27.634 1.00 0.00 C ATOM 0 HA PRO A 9 5.842 -1.987 -30.533 1.00 0.00 H new ATOM 0 HB2 PRO A 9 5.510 -3.880 -28.540 1.00 0.00 H new ATOM 0 HB3 PRO A 9 6.996 -3.686 -29.449 1.00 0.00 H new ATOM 0 HG2 PRO A 9 6.431 -2.949 -26.642 1.00 0.00 H new ATOM 0 HG3 PRO A 9 7.981 -3.162 -27.430 1.00 0.00 H new ATOM 0 HD2 PRO A 9 6.716 -0.673 -26.775 1.00 0.00 H new ATOM 0 HD3 PRO A 9 8.209 -0.887 -27.667 1.00 0.00 H new ATOM 91 N GLY A 10 3.872 -1.566 -27.961 1.00 0.00 N ATOM 92 CA GLY A 10 2.476 -1.393 -27.596 1.00 0.00 C ATOM 93 C GLY A 10 2.043 -2.442 -26.571 1.00 0.00 C ATOM 94 O GLY A 10 2.603 -3.536 -26.523 1.00 0.00 O ATOM 0 H GLY A 10 4.526 -1.522 -27.179 1.00 0.00 H new ATOM 0 HA2 GLY A 10 2.325 -0.395 -27.186 1.00 0.00 H new ATOM 0 HA3 GLY A 10 1.852 -1.470 -28.486 1.00 0.00 H new ATOM 98 N ASN A 11 1.050 -2.072 -25.775 1.00 0.00 N ATOM 99 CA ASN A 11 0.535 -2.968 -24.754 1.00 0.00 C ATOM 100 C ASN A 11 -0.851 -2.492 -24.315 1.00 0.00 C ATOM 101 O ASN A 11 -1.029 -1.327 -23.964 1.00 0.00 O ATOM 102 CB ASN A 11 1.443 -2.979 -23.523 1.00 0.00 C ATOM 103 CG ASN A 11 2.165 -4.321 -23.385 1.00 0.00 C ATOM 104 OD1 ASN A 11 1.558 -5.369 -23.235 1.00 0.00 O ATOM 105 ND2 ASN A 11 3.490 -4.231 -23.443 1.00 0.00 N ATOM 0 H ASN A 11 0.588 -1.163 -25.817 1.00 0.00 H new ATOM 0 HA ASN A 11 0.489 -3.971 -25.178 1.00 0.00 H new ATOM 0 HB2 ASN A 11 2.175 -2.175 -23.599 1.00 0.00 H new ATOM 0 HB3 ASN A 11 0.851 -2.787 -22.628 1.00 0.00 H new ATOM 0 HD21 ASN A 11 4.062 -5.071 -23.360 1.00 0.00 H new ATOM 0 HD22 ASN A 11 3.934 -3.322 -23.570 1.00 0.00 H new ATOM 112 N ARG A 12 -1.798 -3.418 -24.350 1.00 0.00 N ATOM 113 CA ARG A 12 -3.163 -3.108 -23.960 1.00 0.00 C ATOM 114 C ARG A 12 -3.643 -4.084 -22.884 1.00 0.00 C ATOM 115 O ARG A 12 -3.569 -5.299 -23.066 1.00 0.00 O ATOM 116 CB ARG A 12 -4.108 -3.178 -25.161 1.00 0.00 C ATOM 117 CG ARG A 12 -3.675 -2.202 -26.257 1.00 0.00 C ATOM 118 CD ARG A 12 -2.967 -2.937 -27.397 1.00 0.00 C ATOM 119 NE ARG A 12 -1.969 -2.047 -28.031 1.00 0.00 N ATOM 120 CZ ARG A 12 -1.192 -2.403 -29.063 1.00 0.00 C ATOM 121 NH1 ARG A 12 -1.293 -3.634 -29.584 1.00 0.00 N ATOM 122 NH2 ARG A 12 -0.315 -1.529 -29.575 1.00 0.00 N ATOM 0 H ARG A 12 -1.647 -4.383 -24.643 1.00 0.00 H new ATOM 0 HA ARG A 12 -3.172 -2.093 -23.564 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -4.123 -4.193 -25.558 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -5.124 -2.945 -24.843 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -4.547 -1.675 -26.645 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -3.009 -1.449 -25.836 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -2.477 -3.832 -27.014 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -3.696 -3.265 -28.138 1.00 0.00 H new ATOM 0 HE ARG A 12 -1.866 -1.103 -27.659 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -1.961 -4.299 -29.195 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -0.702 -3.905 -30.370 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -0.239 -0.592 -29.179 1.00 0.00 H new ATOM 0 HH22 ARG A 12 0.276 -1.801 -30.361 1.00 0.00 H new ATOM 136 N GLU A 13 -4.124 -3.517 -21.788 1.00 0.00 N ATOM 137 CA GLU A 13 -4.616 -4.322 -20.683 1.00 0.00 C ATOM 138 C GLU A 13 -5.444 -3.462 -19.726 1.00 0.00 C ATOM 139 O GLU A 13 -5.135 -2.290 -19.515 1.00 0.00 O ATOM 140 CB GLU A 13 -3.463 -5.007 -19.947 1.00 0.00 C ATOM 141 CG GLU A 13 -3.412 -6.500 -20.276 1.00 0.00 C ATOM 142 CD GLU A 13 -2.639 -7.271 -19.203 1.00 0.00 C ATOM 143 OE1 GLU A 13 -1.587 -6.749 -18.775 1.00 0.00 O ATOM 144 OE2 GLU A 13 -3.118 -8.366 -18.836 1.00 0.00 O ATOM 0 H GLU A 13 -4.184 -2.509 -21.641 1.00 0.00 H new ATOM 0 HA GLU A 13 -5.260 -5.103 -21.087 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -2.519 -4.537 -20.225 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -3.582 -4.872 -18.872 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -4.425 -6.894 -20.353 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -2.938 -6.646 -21.247 1.00 0.00 H new ATOM 151 N ASN A 14 -6.478 -4.077 -19.172 1.00 0.00 N ATOM 152 CA ASN A 14 -7.352 -3.382 -18.243 1.00 0.00 C ATOM 153 C ASN A 14 -6.942 -3.726 -16.810 1.00 0.00 C ATOM 154 O ASN A 14 -6.672 -2.835 -16.006 1.00 0.00 O ATOM 155 CB ASN A 14 -8.809 -3.807 -18.433 1.00 0.00 C ATOM 156 CG ASN A 14 -9.741 -2.594 -18.421 1.00 0.00 C ATOM 157 OD1 ASN A 14 -9.315 -1.452 -18.383 1.00 0.00 O ATOM 158 ND2 ASN A 14 -11.034 -2.905 -18.457 1.00 0.00 N ATOM 0 H ASN A 14 -6.730 -5.049 -19.349 1.00 0.00 H new ATOM 0 HA ASN A 14 -7.262 -2.312 -18.432 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -8.915 -4.342 -19.377 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -9.096 -4.498 -17.641 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -11.737 -2.166 -18.454 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -11.323 -3.883 -18.488 1.00 0.00 H new ATOM 165 N LYS A 15 -6.909 -5.021 -16.533 1.00 0.00 N ATOM 166 CA LYS A 15 -6.537 -5.494 -15.210 1.00 0.00 C ATOM 167 C LYS A 15 -5.085 -5.104 -14.924 1.00 0.00 C ATOM 168 O LYS A 15 -4.378 -4.632 -15.813 1.00 0.00 O ATOM 169 CB LYS A 15 -6.807 -6.995 -15.082 1.00 0.00 C ATOM 170 CG LYS A 15 -5.789 -7.806 -15.886 1.00 0.00 C ATOM 171 CD LYS A 15 -6.450 -8.475 -17.093 1.00 0.00 C ATOM 172 CE LYS A 15 -6.655 -9.970 -16.846 1.00 0.00 C ATOM 173 NZ LYS A 15 -6.202 -10.756 -18.016 1.00 0.00 N ATOM 0 H LYS A 15 -7.134 -5.758 -17.202 1.00 0.00 H new ATOM 0 HA LYS A 15 -7.152 -5.017 -14.447 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -6.763 -7.288 -14.033 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -7.814 -7.218 -15.434 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -4.984 -7.153 -16.223 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -5.338 -8.565 -15.247 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -7.410 -8.001 -17.295 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -5.830 -8.330 -17.978 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -6.102 -10.277 -15.958 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -7.708 -10.171 -16.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -6.348 -11.769 -17.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -6.748 -10.475 -18.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -5.191 -10.577 -18.184 1.00 0.00 H new ATOM 187 N GLU A 16 -4.684 -5.316 -13.679 1.00 0.00 N ATOM 188 CA GLU A 16 -3.329 -4.993 -13.264 1.00 0.00 C ATOM 189 C GLU A 16 -2.965 -3.572 -13.701 1.00 0.00 C ATOM 190 O GLU A 16 -2.465 -3.368 -14.806 1.00 0.00 O ATOM 191 CB GLU A 16 -2.329 -6.010 -13.817 1.00 0.00 C ATOM 192 CG GLU A 16 -2.268 -7.256 -12.932 1.00 0.00 C ATOM 193 CD GLU A 16 -1.604 -8.421 -13.670 1.00 0.00 C ATOM 194 OE1 GLU A 16 -0.508 -8.190 -14.225 1.00 0.00 O ATOM 195 OE2 GLU A 16 -2.208 -9.515 -13.662 1.00 0.00 O ATOM 0 H GLU A 16 -5.273 -5.707 -12.944 1.00 0.00 H new ATOM 0 HA GLU A 16 -3.281 -5.041 -12.176 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -2.615 -6.293 -14.830 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -1.340 -5.556 -13.880 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -1.711 -7.033 -12.022 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -3.275 -7.540 -12.628 1.00 0.00 H new ATOM 202 N LYS A 17 -3.230 -2.628 -12.810 1.00 0.00 N ATOM 203 CA LYS A 17 -2.937 -1.232 -13.090 1.00 0.00 C ATOM 204 C LYS A 17 -1.807 -0.760 -12.173 1.00 0.00 C ATOM 205 O LYS A 17 -1.728 -1.171 -11.017 1.00 0.00 O ATOM 206 CB LYS A 17 -4.208 -0.387 -12.986 1.00 0.00 C ATOM 207 CG LYS A 17 -4.627 -0.204 -11.526 1.00 0.00 C ATOM 208 CD LYS A 17 -5.422 1.090 -11.342 1.00 0.00 C ATOM 209 CE LYS A 17 -6.901 0.793 -11.083 1.00 0.00 C ATOM 210 NZ LYS A 17 -7.751 1.493 -12.072 1.00 0.00 N ATOM 0 H LYS A 17 -3.644 -2.802 -11.894 1.00 0.00 H new ATOM 0 HA LYS A 17 -2.587 -1.113 -14.115 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -4.040 0.587 -13.445 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -5.014 -0.866 -13.542 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -5.230 -1.054 -11.208 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -3.742 -0.185 -10.890 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -5.010 1.659 -10.508 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -5.323 1.712 -12.232 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -7.077 -0.281 -11.139 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -7.170 1.109 -10.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -8.751 1.281 -11.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -7.595 2.519 -12.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -7.505 1.172 -13.030 1.00 0.00 H new ATOM 224 N LYS A 18 -0.961 0.098 -12.724 1.00 0.00 N ATOM 225 CA LYS A 18 0.161 0.631 -11.970 1.00 0.00 C ATOM 226 C LYS A 18 -0.225 1.990 -11.382 1.00 0.00 C ATOM 227 O LYS A 18 -0.557 2.917 -12.118 1.00 0.00 O ATOM 228 CB LYS A 18 1.419 0.673 -12.840 1.00 0.00 C ATOM 229 CG LYS A 18 2.638 1.103 -12.020 1.00 0.00 C ATOM 230 CD LYS A 18 2.991 2.567 -12.291 1.00 0.00 C ATOM 231 CE LYS A 18 3.888 2.695 -13.524 1.00 0.00 C ATOM 232 NZ LYS A 18 3.397 3.773 -14.411 1.00 0.00 N ATOM 0 H LYS A 18 -1.030 0.437 -13.683 1.00 0.00 H new ATOM 0 HA LYS A 18 0.402 -0.023 -11.132 1.00 0.00 H new ATOM 0 HB2 LYS A 18 1.597 -0.310 -13.275 1.00 0.00 H new ATOM 0 HB3 LYS A 18 1.270 1.366 -13.668 1.00 0.00 H new ATOM 0 HG2 LYS A 18 2.434 0.965 -10.958 1.00 0.00 H new ATOM 0 HG3 LYS A 18 3.489 0.468 -12.266 1.00 0.00 H new ATOM 0 HD2 LYS A 18 2.078 3.144 -12.440 1.00 0.00 H new ATOM 0 HD3 LYS A 18 3.497 2.990 -11.423 1.00 0.00 H new ATOM 0 HE2 LYS A 18 4.912 2.907 -13.216 1.00 0.00 H new ATOM 0 HE3 LYS A 18 3.908 1.750 -14.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 4.016 3.847 -15.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 2.428 3.555 -14.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 3.401 4.676 -13.895 1.00 0.00 H new ATOM 246 N VAL A 19 -0.168 2.064 -10.060 1.00 0.00 N ATOM 247 CA VAL A 19 -0.508 3.294 -9.365 1.00 0.00 C ATOM 248 C VAL A 19 0.694 3.756 -8.539 1.00 0.00 C ATOM 249 O VAL A 19 1.340 2.950 -7.870 1.00 0.00 O ATOM 250 CB VAL A 19 -1.768 3.088 -8.522 1.00 0.00 C ATOM 251 CG1 VAL A 19 -3.029 3.347 -9.349 1.00 0.00 C ATOM 252 CG2 VAL A 19 -1.794 1.686 -7.908 1.00 0.00 C ATOM 0 H VAL A 19 0.108 1.293 -9.452 1.00 0.00 H new ATOM 0 HA VAL A 19 -0.737 4.085 -10.079 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.747 3.811 -7.706 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -3.910 3.194 -8.726 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -3.019 4.373 -9.717 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -3.058 2.659 -10.194 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -2.700 1.566 -7.314 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -1.780 0.940 -8.703 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -0.921 1.552 -7.269 1.00 0.00 H new ATOM 262 N PHE A 20 0.960 5.052 -8.613 1.00 0.00 N ATOM 263 CA PHE A 20 2.073 5.632 -7.881 1.00 0.00 C ATOM 264 C PHE A 20 1.576 6.492 -6.718 1.00 0.00 C ATOM 265 O PHE A 20 0.945 7.527 -6.932 1.00 0.00 O ATOM 266 CB PHE A 20 2.842 6.517 -8.863 1.00 0.00 C ATOM 267 CG PHE A 20 4.358 6.503 -8.659 1.00 0.00 C ATOM 268 CD1 PHE A 20 4.896 7.023 -7.523 1.00 0.00 C ATOM 269 CD2 PHE A 20 5.168 5.971 -9.612 1.00 0.00 C ATOM 270 CE1 PHE A 20 6.303 7.010 -7.333 1.00 0.00 C ATOM 271 CE2 PHE A 20 6.575 5.957 -9.422 1.00 0.00 C ATOM 272 CZ PHE A 20 7.113 6.478 -8.286 1.00 0.00 C ATOM 0 H PHE A 20 0.423 5.717 -9.169 1.00 0.00 H new ATOM 0 HA PHE A 20 2.700 4.841 -7.470 1.00 0.00 H new ATOM 0 HB2 PHE A 20 2.620 6.192 -9.879 1.00 0.00 H new ATOM 0 HB3 PHE A 20 2.483 7.542 -8.770 1.00 0.00 H new ATOM 0 HD1 PHE A 20 4.253 7.446 -6.765 1.00 0.00 H new ATOM 0 HD2 PHE A 20 4.741 5.559 -10.514 1.00 0.00 H new ATOM 0 HE1 PHE A 20 6.730 7.423 -6.431 1.00 0.00 H new ATOM 0 HE2 PHE A 20 7.218 5.533 -10.179 1.00 0.00 H new ATOM 0 HZ PHE A 20 8.183 6.469 -8.142 1.00 0.00 H new ATOM 282 N ILE A 21 1.878 6.033 -5.512 1.00 0.00 N ATOM 283 CA ILE A 21 1.470 6.748 -4.315 1.00 0.00 C ATOM 284 C ILE A 21 2.682 7.464 -3.716 1.00 0.00 C ATOM 285 O ILE A 21 3.516 6.840 -3.062 1.00 0.00 O ATOM 286 CB ILE A 21 0.770 5.802 -3.338 1.00 0.00 C ATOM 287 CG1 ILE A 21 -0.579 5.339 -3.894 1.00 0.00 C ATOM 288 CG2 ILE A 21 0.631 6.444 -1.957 1.00 0.00 C ATOM 289 CD1 ILE A 21 -1.598 6.480 -3.879 1.00 0.00 C ATOM 0 H ILE A 21 2.401 5.174 -5.338 1.00 0.00 H new ATOM 0 HA ILE A 21 0.736 7.515 -4.561 1.00 0.00 H new ATOM 0 HB ILE A 21 1.391 4.914 -3.219 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -0.451 4.974 -4.913 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -0.954 4.504 -3.302 1.00 0.00 H new ATOM 0 HG21 ILE A 21 0.130 5.750 -1.282 1.00 0.00 H new ATOM 0 HG22 ILE A 21 1.620 6.681 -1.565 1.00 0.00 H new ATOM 0 HG23 ILE A 21 0.044 7.359 -2.038 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -2.548 6.125 -4.279 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -1.742 6.826 -2.855 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -1.231 7.303 -4.492 1.00 0.00 H new ATOM 301 N SER A 22 2.741 8.765 -3.960 1.00 0.00 N ATOM 302 CA SER A 22 3.837 9.573 -3.453 1.00 0.00 C ATOM 303 C SER A 22 3.380 10.364 -2.225 1.00 0.00 C ATOM 304 O SER A 22 2.326 10.998 -2.248 1.00 0.00 O ATOM 305 CB SER A 22 4.365 10.524 -4.529 1.00 0.00 C ATOM 306 OG SER A 22 5.649 11.046 -4.197 1.00 0.00 O ATOM 0 H SER A 22 2.047 9.280 -4.502 1.00 0.00 H new ATOM 0 HA SER A 22 4.649 8.905 -3.166 1.00 0.00 H new ATOM 0 HB2 SER A 22 4.423 9.997 -5.482 1.00 0.00 H new ATOM 0 HB3 SER A 22 3.663 11.347 -4.662 1.00 0.00 H new ATOM 0 HG SER A 22 5.952 11.647 -4.909 1.00 0.00 H new ATOM 312 N LEU A 23 4.194 10.299 -1.182 1.00 0.00 N ATOM 313 CA LEU A 23 3.887 11.001 0.052 1.00 0.00 C ATOM 314 C LEU A 23 4.765 12.249 0.157 1.00 0.00 C ATOM 315 O LEU A 23 5.612 12.345 1.044 1.00 0.00 O ATOM 316 CB LEU A 23 4.014 10.058 1.250 1.00 0.00 C ATOM 317 CG LEU A 23 2.887 9.038 1.423 1.00 0.00 C ATOM 318 CD1 LEU A 23 1.599 9.718 1.892 1.00 0.00 C ATOM 319 CD2 LEU A 23 2.675 8.232 0.140 1.00 0.00 C ATOM 0 H LEU A 23 5.066 9.771 -1.166 1.00 0.00 H new ATOM 0 HA LEU A 23 2.851 11.340 0.049 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.956 9.517 1.163 1.00 0.00 H new ATOM 0 HB3 LEU A 23 4.074 10.660 2.156 1.00 0.00 H new ATOM 0 HG LEU A 23 3.181 8.333 2.201 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.814 8.971 2.007 1.00 0.00 H new ATOM 0 HD12 LEU A 23 1.775 10.210 2.849 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.289 10.459 1.155 1.00 0.00 H new ATOM 0 HD21 LEU A 23 1.868 7.514 0.290 1.00 0.00 H new ATOM 0 HD22 LEU A 23 2.413 8.907 -0.675 1.00 0.00 H new ATOM 0 HD23 LEU A 23 3.592 7.700 -0.111 1.00 0.00 H new ATOM 331 N VAL A 24 4.534 13.175 -0.763 1.00 0.00 N ATOM 332 CA VAL A 24 5.294 14.414 -0.785 1.00 0.00 C ATOM 333 C VAL A 24 4.510 15.501 -0.048 1.00 0.00 C ATOM 334 O VAL A 24 4.020 16.445 -0.666 1.00 0.00 O ATOM 335 CB VAL A 24 5.631 14.794 -2.228 1.00 0.00 C ATOM 336 CG1 VAL A 24 6.324 13.638 -2.952 1.00 0.00 C ATOM 337 CG2 VAL A 24 4.379 15.243 -2.984 1.00 0.00 C ATOM 0 H VAL A 24 3.832 13.092 -1.498 1.00 0.00 H new ATOM 0 HA VAL A 24 6.244 14.290 -0.265 1.00 0.00 H new ATOM 0 HB VAL A 24 6.324 15.635 -2.199 1.00 0.00 H new ATOM 0 HG11 VAL A 24 6.553 13.935 -3.976 1.00 0.00 H new ATOM 0 HG12 VAL A 24 7.248 13.385 -2.433 1.00 0.00 H new ATOM 0 HG13 VAL A 24 5.666 12.769 -2.964 1.00 0.00 H new ATOM 0 HG21 VAL A 24 4.647 15.507 -4.007 1.00 0.00 H new ATOM 0 HG22 VAL A 24 3.652 14.431 -2.998 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.945 16.111 -2.487 1.00 0.00 H new ATOM 347 N GLY A 25 4.416 15.333 1.263 1.00 0.00 N ATOM 348 CA GLY A 25 3.700 16.288 2.091 1.00 0.00 C ATOM 349 C GLY A 25 2.356 16.660 1.462 1.00 0.00 C ATOM 350 O GLY A 25 1.901 16.002 0.528 1.00 0.00 O ATOM 0 H GLY A 25 4.824 14.549 1.772 1.00 0.00 H new ATOM 0 HA2 GLY A 25 3.537 15.865 3.082 1.00 0.00 H new ATOM 0 HA3 GLY A 25 4.305 17.185 2.223 1.00 0.00 H new ATOM 354 N SER A 26 1.758 17.712 2.001 1.00 0.00 N ATOM 355 CA SER A 26 0.474 18.179 1.504 1.00 0.00 C ATOM 356 C SER A 26 -0.584 17.089 1.685 1.00 0.00 C ATOM 357 O SER A 26 -1.348 17.114 2.649 1.00 0.00 O ATOM 358 CB SER A 26 0.569 18.588 0.033 1.00 0.00 C ATOM 359 OG SER A 26 1.285 19.808 -0.137 1.00 0.00 O ATOM 0 H SER A 26 2.138 18.254 2.777 1.00 0.00 H new ATOM 0 HA SER A 26 0.183 19.058 2.079 1.00 0.00 H new ATOM 0 HB2 SER A 26 1.062 17.797 -0.532 1.00 0.00 H new ATOM 0 HB3 SER A 26 -0.434 18.696 -0.379 1.00 0.00 H new ATOM 0 HG SER A 26 1.325 20.034 -1.090 1.00 0.00 H new ATOM 365 N ARG A 27 -0.597 16.159 0.742 1.00 0.00 N ATOM 366 CA ARG A 27 -1.550 15.062 0.785 1.00 0.00 C ATOM 367 C ARG A 27 -0.998 13.913 1.630 1.00 0.00 C ATOM 368 O ARG A 27 0.213 13.799 1.815 1.00 0.00 O ATOM 369 CB ARG A 27 -1.862 14.548 -0.622 1.00 0.00 C ATOM 370 CG ARG A 27 -3.302 14.879 -1.020 1.00 0.00 C ATOM 371 CD ARG A 27 -3.349 15.570 -2.384 1.00 0.00 C ATOM 372 NE ARG A 27 -4.466 16.540 -2.421 1.00 0.00 N ATOM 373 CZ ARG A 27 -4.698 17.379 -3.440 1.00 0.00 C ATOM 374 NH1 ARG A 27 -3.892 17.372 -4.511 1.00 0.00 N ATOM 375 NH2 ARG A 27 -5.735 18.226 -3.387 1.00 0.00 N ATOM 0 H ARG A 27 0.037 16.142 -0.057 1.00 0.00 H new ATOM 0 HA ARG A 27 -2.469 15.438 1.234 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -1.171 14.994 -1.338 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -1.709 13.470 -0.661 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -3.894 13.964 -1.051 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -3.752 15.524 -0.266 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -2.406 16.082 -2.575 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -3.474 14.828 -3.173 1.00 0.00 H new ATOM 0 HE ARG A 27 -5.099 16.572 -1.621 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -3.102 16.728 -4.551 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -4.069 18.011 -5.286 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -6.347 18.232 -2.571 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -5.912 18.865 -4.162 1.00 0.00 H new ATOM 389 N GLY A 28 -1.912 13.089 2.121 1.00 0.00 N ATOM 390 CA GLY A 28 -1.532 11.952 2.942 1.00 0.00 C ATOM 391 C GLY A 28 -2.492 10.779 2.732 1.00 0.00 C ATOM 392 O GLY A 28 -3.709 10.959 2.741 1.00 0.00 O ATOM 0 H GLY A 28 -2.915 13.186 1.966 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -0.516 11.644 2.695 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -1.531 12.242 3.993 1.00 0.00 H new ATOM 396 N LEU A 29 -1.908 9.604 2.548 1.00 0.00 N ATOM 397 CA LEU A 29 -2.696 8.402 2.336 1.00 0.00 C ATOM 398 C LEU A 29 -3.917 8.428 3.259 1.00 0.00 C ATOM 399 O LEU A 29 -3.795 8.721 4.447 1.00 0.00 O ATOM 400 CB LEU A 29 -1.826 7.154 2.504 1.00 0.00 C ATOM 401 CG LEU A 29 -2.474 5.826 2.107 1.00 0.00 C ATOM 402 CD1 LEU A 29 -1.867 5.286 0.811 1.00 0.00 C ATOM 403 CD2 LEU A 29 -2.387 4.811 3.248 1.00 0.00 C ATOM 0 H LEU A 29 -0.898 9.459 2.541 1.00 0.00 H new ATOM 0 HA LEU A 29 -3.069 8.367 1.313 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -0.920 7.285 1.912 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.518 7.088 3.548 1.00 0.00 H new ATOM 0 HG LEU A 29 -3.532 6.005 1.916 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -2.345 4.342 0.551 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -2.025 6.006 0.008 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -0.798 5.125 0.949 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -2.855 3.876 2.940 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.341 4.629 3.494 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -2.903 5.203 4.124 1.00 0.00 H new ATOM 415 N GLY A 30 -5.065 8.118 2.676 1.00 0.00 N ATOM 416 CA GLY A 30 -6.307 8.103 3.431 1.00 0.00 C ATOM 417 C GLY A 30 -7.101 6.824 3.155 1.00 0.00 C ATOM 418 O GLY A 30 -8.328 6.823 3.228 1.00 0.00 O ATOM 0 H GLY A 30 -5.162 7.875 1.690 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -6.090 8.178 4.497 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.908 8.973 3.166 1.00 0.00 H new ATOM 422 N CYS A 31 -6.367 5.766 2.842 1.00 0.00 N ATOM 423 CA CYS A 31 -6.987 4.484 2.555 1.00 0.00 C ATOM 424 C CYS A 31 -6.547 3.486 3.628 1.00 0.00 C ATOM 425 O CYS A 31 -5.429 3.566 4.134 1.00 0.00 O ATOM 426 CB CYS A 31 -6.645 3.993 1.146 1.00 0.00 C ATOM 427 SG CYS A 31 -4.831 3.850 0.956 1.00 0.00 S ATOM 0 H CYS A 31 -5.349 5.771 2.781 1.00 0.00 H new ATOM 0 HA CYS A 31 -8.072 4.589 2.580 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -7.115 3.026 0.965 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -7.043 4.685 0.404 1.00 0.00 H new ATOM 0 HG CYS A 31 -4.370 4.919 0.377 1.00 0.00 H new ATOM 433 N SER A 32 -7.450 2.570 3.944 1.00 0.00 N ATOM 434 CA SER A 32 -7.170 1.558 4.949 1.00 0.00 C ATOM 435 C SER A 32 -6.981 0.195 4.280 1.00 0.00 C ATOM 436 O SER A 32 -7.741 -0.172 3.385 1.00 0.00 O ATOM 437 CB SER A 32 -8.291 1.488 5.988 1.00 0.00 C ATOM 438 OG SER A 32 -7.820 1.778 7.301 1.00 0.00 O ATOM 0 H SER A 32 -8.376 2.507 3.522 1.00 0.00 H new ATOM 0 HA SER A 32 -6.250 1.834 5.465 1.00 0.00 H new ATOM 0 HB2 SER A 32 -9.078 2.194 5.721 1.00 0.00 H new ATOM 0 HB3 SER A 32 -8.737 0.493 5.974 1.00 0.00 H new ATOM 0 HG SER A 32 -8.565 1.725 7.935 1.00 0.00 H new ATOM 444 N ILE A 33 -5.963 -0.518 4.739 1.00 0.00 N ATOM 445 CA ILE A 33 -5.665 -1.833 4.197 1.00 0.00 C ATOM 446 C ILE A 33 -6.058 -2.902 5.217 1.00 0.00 C ATOM 447 O ILE A 33 -5.926 -2.694 6.422 1.00 0.00 O ATOM 448 CB ILE A 33 -4.202 -1.911 3.756 1.00 0.00 C ATOM 449 CG1 ILE A 33 -3.261 -1.606 4.924 1.00 0.00 C ATOM 450 CG2 ILE A 33 -3.940 -0.998 2.557 1.00 0.00 C ATOM 451 CD1 ILE A 33 -1.877 -2.215 4.686 1.00 0.00 C ATOM 0 H ILE A 33 -5.334 -0.210 5.480 1.00 0.00 H new ATOM 0 HA ILE A 33 -6.255 -2.018 3.299 1.00 0.00 H new ATOM 0 HB ILE A 33 -3.997 -2.932 3.434 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -3.171 -0.527 5.051 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -3.682 -2.002 5.848 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -2.893 -1.073 2.265 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -4.572 -1.302 1.723 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -4.168 0.033 2.828 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -1.228 -1.984 5.530 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -1.968 -3.296 4.584 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -1.448 -1.799 3.774 1.00 0.00 H new ATOM 463 N SER A 34 -6.533 -4.025 4.697 1.00 0.00 N ATOM 464 CA SER A 34 -6.946 -5.128 5.548 1.00 0.00 C ATOM 465 C SER A 34 -6.266 -6.421 5.096 1.00 0.00 C ATOM 466 O SER A 34 -5.920 -6.568 3.924 1.00 0.00 O ATOM 467 CB SER A 34 -8.467 -5.295 5.534 1.00 0.00 C ATOM 468 OG SER A 34 -9.122 -4.282 6.292 1.00 0.00 O ATOM 0 H SER A 34 -6.641 -4.194 3.697 1.00 0.00 H new ATOM 0 HA SER A 34 -6.642 -4.903 6.570 1.00 0.00 H new ATOM 0 HB2 SER A 34 -8.825 -5.267 4.505 1.00 0.00 H new ATOM 0 HB3 SER A 34 -8.728 -6.274 5.936 1.00 0.00 H new ATOM 0 HG SER A 34 -10.091 -4.422 6.257 1.00 0.00 H new ATOM 474 N SER A 35 -6.094 -7.326 6.048 1.00 0.00 N ATOM 475 CA SER A 35 -5.461 -8.603 5.762 1.00 0.00 C ATOM 476 C SER A 35 -6.493 -9.585 5.205 1.00 0.00 C ATOM 477 O SER A 35 -7.629 -9.630 5.675 1.00 0.00 O ATOM 478 CB SER A 35 -4.798 -9.182 7.013 1.00 0.00 C ATOM 479 OG SER A 35 -5.756 -9.554 8.001 1.00 0.00 O ATOM 0 H SER A 35 -6.382 -7.201 7.018 1.00 0.00 H new ATOM 0 HA SER A 35 -4.684 -8.440 5.015 1.00 0.00 H new ATOM 0 HB2 SER A 35 -4.204 -10.053 6.738 1.00 0.00 H new ATOM 0 HB3 SER A 35 -4.111 -8.447 7.433 1.00 0.00 H new ATOM 0 HG SER A 35 -5.294 -9.921 8.783 1.00 0.00 H new ATOM 485 N GLY A 36 -6.061 -10.348 4.211 1.00 0.00 N ATOM 486 CA GLY A 36 -6.933 -11.327 3.586 1.00 0.00 C ATOM 487 C GLY A 36 -6.817 -12.687 4.278 1.00 0.00 C ATOM 488 O GLY A 36 -5.851 -12.942 4.995 1.00 0.00 O ATOM 0 H GLY A 36 -5.118 -10.307 3.823 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.965 -10.980 3.630 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -6.675 -11.428 2.532 1.00 0.00 H new ATOM 492 N PRO A 37 -7.842 -13.546 4.032 1.00 0.00 N ATOM 493 CA PRO A 37 -7.865 -14.873 4.623 1.00 0.00 C ATOM 494 C PRO A 37 -6.872 -15.802 3.922 1.00 0.00 C ATOM 495 O PRO A 37 -6.060 -15.354 3.114 1.00 0.00 O ATOM 496 CB PRO A 37 -9.306 -15.337 4.493 1.00 0.00 C ATOM 497 CG PRO A 37 -9.933 -14.456 3.425 1.00 0.00 C ATOM 498 CD PRO A 37 -9.003 -13.278 3.188 1.00 0.00 C ATOM 0 HA PRO A 37 -7.553 -14.874 5.668 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -9.354 -16.388 4.209 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -9.835 -15.238 5.441 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -10.079 -15.019 2.503 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -10.915 -14.109 3.745 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -8.720 -13.202 2.138 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -9.480 -12.336 3.459 1.00 0.00 H new ATOM 506 N ILE A 38 -6.969 -17.080 4.257 1.00 0.00 N ATOM 507 CA ILE A 38 -6.089 -18.077 3.670 1.00 0.00 C ATOM 508 C ILE A 38 -6.515 -18.338 2.224 1.00 0.00 C ATOM 509 O ILE A 38 -5.687 -18.681 1.381 1.00 0.00 O ATOM 510 CB ILE A 38 -6.052 -19.337 4.537 1.00 0.00 C ATOM 511 CG1 ILE A 38 -5.247 -20.446 3.858 1.00 0.00 C ATOM 512 CG2 ILE A 38 -7.466 -19.794 4.901 1.00 0.00 C ATOM 513 CD1 ILE A 38 -4.663 -21.412 4.892 1.00 0.00 C ATOM 0 H ILE A 38 -7.644 -17.448 4.928 1.00 0.00 H new ATOM 0 HA ILE A 38 -5.063 -17.709 3.640 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.543 -19.095 5.470 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -5.887 -20.993 3.165 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -4.441 -20.007 3.269 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -7.411 -20.691 5.517 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -7.973 -19.004 5.455 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -8.023 -20.013 3.990 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -4.095 -22.191 4.383 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -4.005 -20.867 5.568 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -5.473 -21.867 5.462 1.00 0.00 H new ATOM 525 N GLN A 39 -7.806 -18.166 1.981 1.00 0.00 N ATOM 526 CA GLN A 39 -8.353 -18.379 0.652 1.00 0.00 C ATOM 527 C GLN A 39 -8.078 -17.164 -0.236 1.00 0.00 C ATOM 528 O GLN A 39 -7.966 -17.293 -1.454 1.00 0.00 O ATOM 529 CB GLN A 39 -9.850 -18.684 0.717 1.00 0.00 C ATOM 530 CG GLN A 39 -10.636 -17.470 1.215 1.00 0.00 C ATOM 531 CD GLN A 39 -12.021 -17.881 1.719 1.00 0.00 C ATOM 532 OE1 GLN A 39 -12.870 -18.339 0.973 1.00 0.00 O ATOM 533 NE2 GLN A 39 -12.200 -17.694 3.024 1.00 0.00 N ATOM 0 H GLN A 39 -8.489 -17.881 2.683 1.00 0.00 H new ATOM 0 HA GLN A 39 -7.859 -19.245 0.212 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -10.209 -18.974 -0.271 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -10.024 -19.531 1.380 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -10.084 -16.979 2.017 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -10.739 -16.744 0.409 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -11.447 -17.306 3.592 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -13.091 -17.939 3.457 1.00 0.00 H new ATOM 542 N LYS A 40 -7.979 -16.011 0.409 1.00 0.00 N ATOM 543 CA LYS A 40 -7.720 -14.773 -0.307 1.00 0.00 C ATOM 544 C LYS A 40 -6.678 -13.955 0.458 1.00 0.00 C ATOM 545 O LYS A 40 -6.961 -12.843 0.902 1.00 0.00 O ATOM 546 CB LYS A 40 -9.027 -14.019 -0.564 1.00 0.00 C ATOM 547 CG LYS A 40 -8.757 -12.658 -1.209 1.00 0.00 C ATOM 548 CD LYS A 40 -9.638 -12.452 -2.442 1.00 0.00 C ATOM 549 CE LYS A 40 -8.809 -12.523 -3.726 1.00 0.00 C ATOM 550 NZ LYS A 40 -9.567 -13.214 -4.794 1.00 0.00 N ATOM 0 H LYS A 40 -8.073 -15.908 1.419 1.00 0.00 H new ATOM 0 HA LYS A 40 -7.301 -14.982 -1.291 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -9.671 -14.612 -1.213 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -9.562 -13.880 0.376 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -8.946 -11.865 -0.486 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -7.707 -12.588 -1.492 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -10.419 -13.212 -2.467 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -10.137 -11.485 -2.380 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -8.545 -11.517 -4.052 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -7.875 -13.051 -3.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -8.991 -13.254 -5.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -9.797 -14.180 -4.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -10.446 -12.694 -4.988 1.00 0.00 H new ATOM 564 N PRO A 41 -5.464 -14.552 0.593 1.00 0.00 N ATOM 565 CA PRO A 41 -4.378 -13.891 1.296 1.00 0.00 C ATOM 566 C PRO A 41 -3.773 -12.773 0.445 1.00 0.00 C ATOM 567 O PRO A 41 -3.714 -12.883 -0.779 1.00 0.00 O ATOM 568 CB PRO A 41 -3.386 -14.996 1.617 1.00 0.00 C ATOM 569 CG PRO A 41 -3.726 -16.145 0.682 1.00 0.00 C ATOM 570 CD PRO A 41 -5.093 -15.868 0.080 1.00 0.00 C ATOM 0 HA PRO A 41 -4.709 -13.394 2.208 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -2.361 -14.658 1.464 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -3.468 -15.303 2.660 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -2.974 -16.234 -0.103 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -3.733 -17.090 1.225 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -5.054 -15.872 -1.009 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -5.817 -16.627 0.376 1.00 0.00 H new ATOM 578 N GLY A 42 -3.338 -11.723 1.126 1.00 0.00 N ATOM 579 CA GLY A 42 -2.739 -10.586 0.447 1.00 0.00 C ATOM 580 C GLY A 42 -3.147 -9.272 1.115 1.00 0.00 C ATOM 581 O GLY A 42 -3.572 -9.263 2.269 1.00 0.00 O ATOM 0 H GLY A 42 -3.388 -11.636 2.141 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -1.653 -10.682 0.458 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -3.048 -10.578 -0.598 1.00 0.00 H new ATOM 585 N ILE A 43 -3.003 -8.192 0.360 1.00 0.00 N ATOM 586 CA ILE A 43 -3.350 -6.875 0.865 1.00 0.00 C ATOM 587 C ILE A 43 -4.446 -6.269 -0.015 1.00 0.00 C ATOM 588 O ILE A 43 -4.294 -6.184 -1.232 1.00 0.00 O ATOM 589 CB ILE A 43 -2.102 -5.999 0.982 1.00 0.00 C ATOM 590 CG1 ILE A 43 -1.026 -6.686 1.825 1.00 0.00 C ATOM 591 CG2 ILE A 43 -2.453 -4.611 1.522 1.00 0.00 C ATOM 592 CD1 ILE A 43 -1.397 -6.666 3.309 1.00 0.00 C ATOM 0 H ILE A 43 -2.651 -8.203 -0.597 1.00 0.00 H new ATOM 0 HA ILE A 43 -3.754 -6.949 1.874 1.00 0.00 H new ATOM 0 HB ILE A 43 -1.689 -5.860 -0.017 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -0.900 -7.716 1.492 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -0.069 -6.185 1.679 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -1.547 -4.009 1.595 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -3.158 -4.125 0.847 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -2.905 -4.708 2.509 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -0.616 -7.161 3.886 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -1.498 -5.634 3.645 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -2.342 -7.189 3.455 1.00 0.00 H new ATOM 604 N PHE A 44 -5.527 -5.864 0.636 1.00 0.00 N ATOM 605 CA PHE A 44 -6.648 -5.269 -0.071 1.00 0.00 C ATOM 606 C PHE A 44 -7.184 -4.048 0.679 1.00 0.00 C ATOM 607 O PHE A 44 -7.257 -4.052 1.907 1.00 0.00 O ATOM 608 CB PHE A 44 -7.746 -6.332 -0.143 1.00 0.00 C ATOM 609 CG PHE A 44 -7.234 -7.734 -0.478 1.00 0.00 C ATOM 610 CD1 PHE A 44 -6.446 -8.400 0.409 1.00 0.00 C ATOM 611 CD2 PHE A 44 -7.567 -8.316 -1.661 1.00 0.00 C ATOM 612 CE1 PHE A 44 -5.971 -9.702 0.098 1.00 0.00 C ATOM 613 CE2 PHE A 44 -7.092 -9.617 -1.972 1.00 0.00 C ATOM 614 CZ PHE A 44 -6.304 -10.283 -1.085 1.00 0.00 C ATOM 0 H PHE A 44 -5.650 -5.936 1.646 1.00 0.00 H new ATOM 0 HA PHE A 44 -6.332 -4.943 -1.062 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -8.268 -6.366 0.813 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -8.477 -6.034 -0.895 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -6.182 -7.939 1.349 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -8.193 -7.788 -2.365 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -5.345 -10.231 0.802 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -7.356 -10.078 -2.912 1.00 0.00 H new ATOM 0 HZ PHE A 44 -5.943 -11.273 -1.321 1.00 0.00 H new ATOM 624 N ILE A 45 -7.546 -3.033 -0.091 1.00 0.00 N ATOM 625 CA ILE A 45 -8.073 -1.808 0.485 1.00 0.00 C ATOM 626 C ILE A 45 -9.407 -2.106 1.173 1.00 0.00 C ATOM 627 O ILE A 45 -10.199 -2.907 0.679 1.00 0.00 O ATOM 628 CB ILE A 45 -8.161 -0.710 -0.578 1.00 0.00 C ATOM 629 CG1 ILE A 45 -6.770 -0.185 -0.939 1.00 0.00 C ATOM 630 CG2 ILE A 45 -9.100 0.412 -0.130 1.00 0.00 C ATOM 631 CD1 ILE A 45 -6.865 0.993 -1.911 1.00 0.00 C ATOM 0 H ILE A 45 -7.485 -3.034 -1.109 1.00 0.00 H new ATOM 0 HA ILE A 45 -7.397 -1.425 1.250 1.00 0.00 H new ATOM 0 HB ILE A 45 -8.586 -1.143 -1.483 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -6.249 0.127 -0.034 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -6.180 -0.985 -1.387 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -9.145 1.179 -0.903 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -10.098 0.006 0.037 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -8.727 0.851 0.796 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -5.863 1.348 -2.152 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -7.365 0.672 -2.824 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -7.435 1.800 -1.450 1.00 0.00 H new ATOM 643 N SER A 46 -9.615 -1.444 2.302 1.00 0.00 N ATOM 644 CA SER A 46 -10.839 -1.629 3.063 1.00 0.00 C ATOM 645 C SER A 46 -11.698 -0.365 2.986 1.00 0.00 C ATOM 646 O SER A 46 -12.924 -0.445 2.942 1.00 0.00 O ATOM 647 CB SER A 46 -10.534 -1.976 4.521 1.00 0.00 C ATOM 648 OG SER A 46 -10.590 -0.830 5.366 1.00 0.00 O ATOM 0 H SER A 46 -8.957 -0.779 2.708 1.00 0.00 H new ATOM 0 HA SER A 46 -11.390 -2.463 2.628 1.00 0.00 H new ATOM 0 HB2 SER A 46 -11.247 -2.721 4.873 1.00 0.00 H new ATOM 0 HB3 SER A 46 -9.544 -2.427 4.587 1.00 0.00 H new ATOM 0 HG SER A 46 -10.391 -1.094 6.289 1.00 0.00 H new ATOM 654 N HIS A 47 -11.019 0.773 2.973 1.00 0.00 N ATOM 655 CA HIS A 47 -11.704 2.053 2.903 1.00 0.00 C ATOM 656 C HIS A 47 -10.742 3.123 2.385 1.00 0.00 C ATOM 657 O HIS A 47 -9.540 3.058 2.640 1.00 0.00 O ATOM 658 CB HIS A 47 -12.320 2.414 4.256 1.00 0.00 C ATOM 659 CG HIS A 47 -13.233 3.616 4.214 1.00 0.00 C ATOM 660 ND1 HIS A 47 -12.770 4.902 3.996 1.00 0.00 N ATOM 661 CD2 HIS A 47 -14.586 3.714 4.363 1.00 0.00 C ATOM 662 CE1 HIS A 47 -13.806 5.728 4.016 1.00 0.00 C ATOM 663 NE2 HIS A 47 -14.930 4.990 4.244 1.00 0.00 N ATOM 0 H HIS A 47 -10.002 0.835 3.010 1.00 0.00 H new ATOM 0 HA HIS A 47 -12.533 1.988 2.198 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -12.881 1.557 4.628 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -11.518 2.604 4.970 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -15.262 2.892 4.547 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -13.767 6.798 3.876 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -15.879 5.358 4.312 1.00 0.00 H new ATOM 671 N VAL A 48 -11.306 4.083 1.667 1.00 0.00 N ATOM 672 CA VAL A 48 -10.512 5.166 1.110 1.00 0.00 C ATOM 673 C VAL A 48 -11.379 6.422 0.998 1.00 0.00 C ATOM 674 O VAL A 48 -12.496 6.366 0.487 1.00 0.00 O ATOM 675 CB VAL A 48 -9.906 4.736 -0.227 1.00 0.00 C ATOM 676 CG1 VAL A 48 -10.968 4.114 -1.136 1.00 0.00 C ATOM 677 CG2 VAL A 48 -9.214 5.913 -0.919 1.00 0.00 C ATOM 0 H VAL A 48 -12.303 4.134 1.458 1.00 0.00 H new ATOM 0 HA VAL A 48 -9.676 5.405 1.768 1.00 0.00 H new ATOM 0 HB VAL A 48 -9.152 3.976 -0.024 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -10.511 3.817 -2.080 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -11.396 3.238 -0.649 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -11.755 4.843 -1.328 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -8.792 5.580 -1.867 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -9.940 6.705 -1.103 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -8.417 6.293 -0.280 1.00 0.00 H new ATOM 687 N LYS A 49 -10.831 7.525 1.486 1.00 0.00 N ATOM 688 CA LYS A 49 -11.540 8.793 1.447 1.00 0.00 C ATOM 689 C LYS A 49 -11.688 9.245 -0.007 1.00 0.00 C ATOM 690 O LYS A 49 -10.779 9.059 -0.815 1.00 0.00 O ATOM 691 CB LYS A 49 -10.847 9.822 2.343 1.00 0.00 C ATOM 692 CG LYS A 49 -11.700 10.139 3.573 1.00 0.00 C ATOM 693 CD LYS A 49 -10.833 10.660 4.721 1.00 0.00 C ATOM 694 CE LYS A 49 -11.155 9.929 6.026 1.00 0.00 C ATOM 695 NZ LYS A 49 -11.129 10.870 7.168 1.00 0.00 N ATOM 0 H LYS A 49 -9.904 7.567 1.910 1.00 0.00 H new ATOM 0 HA LYS A 49 -12.546 8.679 1.850 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -9.876 9.440 2.658 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -10.662 10.736 1.778 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -12.454 10.883 3.315 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -12.232 9.243 3.892 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -9.779 10.526 4.475 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -10.997 11.730 4.849 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -12.137 9.461 5.955 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -10.432 9.129 6.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -11.350 10.357 8.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -10.184 11.297 7.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -11.835 11.618 7.017 1.00 0.00 H new ATOM 709 N PRO A 50 -12.871 9.846 -0.305 1.00 0.00 N ATOM 710 CA PRO A 50 -13.150 10.326 -1.647 1.00 0.00 C ATOM 711 C PRO A 50 -12.382 11.617 -1.939 1.00 0.00 C ATOM 712 O PRO A 50 -12.984 12.672 -2.130 1.00 0.00 O ATOM 713 CB PRO A 50 -14.659 10.509 -1.694 1.00 0.00 C ATOM 714 CG PRO A 50 -15.116 10.572 -0.246 1.00 0.00 C ATOM 715 CD PRO A 50 -13.971 10.083 0.626 1.00 0.00 C ATOM 0 HA PRO A 50 -12.822 9.630 -2.419 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -14.925 11.421 -2.228 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -15.137 9.682 -2.219 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -15.392 11.592 0.023 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -16.000 9.952 -0.098 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -13.701 10.825 1.378 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -14.241 9.172 1.160 1.00 0.00 H new ATOM 723 N GLY A 51 -11.064 11.490 -1.964 1.00 0.00 N ATOM 724 CA GLY A 51 -10.207 12.633 -2.229 1.00 0.00 C ATOM 725 C GLY A 51 -8.906 12.541 -1.428 1.00 0.00 C ATOM 726 O GLY A 51 -8.465 13.526 -0.839 1.00 0.00 O ATOM 0 H GLY A 51 -10.568 10.613 -1.805 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -9.980 12.682 -3.294 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -10.732 13.553 -1.972 1.00 0.00 H new ATOM 730 N SER A 52 -8.329 11.348 -1.433 1.00 0.00 N ATOM 731 CA SER A 52 -7.088 11.114 -0.714 1.00 0.00 C ATOM 732 C SER A 52 -5.940 10.913 -1.705 1.00 0.00 C ATOM 733 O SER A 52 -5.942 11.492 -2.790 1.00 0.00 O ATOM 734 CB SER A 52 -7.208 9.903 0.213 1.00 0.00 C ATOM 735 OG SER A 52 -7.010 8.676 -0.484 1.00 0.00 O ATOM 0 H SER A 52 -8.698 10.533 -1.923 1.00 0.00 H new ATOM 0 HA SER A 52 -6.879 11.989 -0.098 1.00 0.00 H new ATOM 0 HB2 SER A 52 -6.475 9.987 1.015 1.00 0.00 H new ATOM 0 HB3 SER A 52 -8.193 9.900 0.680 1.00 0.00 H new ATOM 0 HG SER A 52 -6.934 7.942 0.161 1.00 0.00 H new ATOM 741 N LEU A 53 -4.986 10.089 -1.296 1.00 0.00 N ATOM 742 CA LEU A 53 -3.834 9.804 -2.134 1.00 0.00 C ATOM 743 C LEU A 53 -4.153 8.617 -3.046 1.00 0.00 C ATOM 744 O LEU A 53 -3.520 8.441 -4.086 1.00 0.00 O ATOM 745 CB LEU A 53 -2.584 9.601 -1.276 1.00 0.00 C ATOM 746 CG LEU A 53 -1.409 10.536 -1.570 1.00 0.00 C ATOM 747 CD1 LEU A 53 -0.205 10.200 -0.688 1.00 0.00 C ATOM 748 CD2 LEU A 53 -1.052 10.516 -3.058 1.00 0.00 C ATOM 0 H LEU A 53 -4.988 9.610 -0.396 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.614 10.654 -2.780 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -2.863 9.719 -0.229 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -2.245 8.573 -1.401 1.00 0.00 H new ATOM 0 HG LEU A 53 -1.713 11.553 -1.324 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.615 10.880 -0.918 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -0.481 10.307 0.361 1.00 0.00 H new ATOM 0 HD13 LEU A 53 0.110 9.174 -0.878 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -0.214 11.189 -3.240 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -0.775 9.504 -3.352 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -1.912 10.841 -3.643 1.00 0.00 H new ATOM 760 N SER A 54 -5.134 7.834 -2.622 1.00 0.00 N ATOM 761 CA SER A 54 -5.544 6.668 -3.387 1.00 0.00 C ATOM 762 C SER A 54 -6.740 7.020 -4.274 1.00 0.00 C ATOM 763 O SER A 54 -6.916 6.439 -5.344 1.00 0.00 O ATOM 764 CB SER A 54 -5.893 5.499 -2.465 1.00 0.00 C ATOM 765 OG SER A 54 -5.073 5.476 -1.299 1.00 0.00 O ATOM 0 H SER A 54 -5.657 7.984 -1.759 1.00 0.00 H new ATOM 0 HA SER A 54 -4.709 6.361 -4.017 1.00 0.00 H new ATOM 0 HB2 SER A 54 -6.940 5.569 -2.171 1.00 0.00 H new ATOM 0 HB3 SER A 54 -5.777 4.561 -3.008 1.00 0.00 H new ATOM 0 HG SER A 54 -5.110 4.586 -0.891 1.00 0.00 H new ATOM 771 N ALA A 55 -7.532 7.968 -3.796 1.00 0.00 N ATOM 772 CA ALA A 55 -8.707 8.404 -4.533 1.00 0.00 C ATOM 773 C ALA A 55 -8.269 9.247 -5.731 1.00 0.00 C ATOM 774 O ALA A 55 -9.007 9.377 -6.707 1.00 0.00 O ATOM 775 CB ALA A 55 -9.644 9.167 -3.594 1.00 0.00 C ATOM 0 H ALA A 55 -7.384 8.447 -2.908 1.00 0.00 H new ATOM 0 HA ALA A 55 -9.258 7.546 -4.918 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -10.525 9.494 -4.146 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -9.950 8.515 -2.776 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -9.125 10.037 -3.190 1.00 0.00 H new ATOM 781 N GLU A 56 -7.069 9.799 -5.619 1.00 0.00 N ATOM 782 CA GLU A 56 -6.524 10.627 -6.682 1.00 0.00 C ATOM 783 C GLU A 56 -6.112 9.759 -7.872 1.00 0.00 C ATOM 784 O GLU A 56 -6.291 10.153 -9.024 1.00 0.00 O ATOM 785 CB GLU A 56 -5.344 11.460 -6.177 1.00 0.00 C ATOM 786 CG GLU A 56 -4.383 10.604 -5.349 1.00 0.00 C ATOM 787 CD GLU A 56 -2.997 11.250 -5.277 1.00 0.00 C ATOM 788 OE1 GLU A 56 -2.933 12.403 -4.799 1.00 0.00 O ATOM 789 OE2 GLU A 56 -2.035 10.576 -5.703 1.00 0.00 O ATOM 0 H GLU A 56 -6.459 9.689 -4.809 1.00 0.00 H new ATOM 0 HA GLU A 56 -7.300 11.318 -7.012 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -4.812 11.895 -7.024 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -5.712 12.289 -5.572 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -4.781 10.475 -4.342 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -4.303 9.611 -5.790 1.00 0.00 H new ATOM 796 N VAL A 57 -5.569 8.593 -7.554 1.00 0.00 N ATOM 797 CA VAL A 57 -5.131 7.665 -8.583 1.00 0.00 C ATOM 798 C VAL A 57 -6.341 6.902 -9.124 1.00 0.00 C ATOM 799 O VAL A 57 -6.335 6.453 -10.270 1.00 0.00 O ATOM 800 CB VAL A 57 -4.042 6.745 -8.029 1.00 0.00 C ATOM 801 CG1 VAL A 57 -3.206 7.462 -6.967 1.00 0.00 C ATOM 802 CG2 VAL A 57 -4.646 5.454 -7.472 1.00 0.00 C ATOM 0 H VAL A 57 -5.422 8.270 -6.598 1.00 0.00 H new ATOM 0 HA VAL A 57 -4.687 8.204 -9.420 1.00 0.00 H new ATOM 0 HB VAL A 57 -3.379 6.477 -8.852 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -2.439 6.785 -6.590 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -2.731 8.339 -7.408 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -3.851 7.774 -6.145 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -3.850 4.818 -7.084 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -5.342 5.695 -6.668 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -5.177 4.928 -8.266 1.00 0.00 H new ATOM 812 N GLY A 58 -7.350 6.777 -8.275 1.00 0.00 N ATOM 813 CA GLY A 58 -8.565 6.075 -8.653 1.00 0.00 C ATOM 814 C GLY A 58 -8.628 4.695 -7.996 1.00 0.00 C ATOM 815 O GLY A 58 -8.981 3.710 -8.644 1.00 0.00 O ATOM 0 H GLY A 58 -7.351 7.150 -7.326 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -9.435 6.662 -8.358 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -8.605 5.968 -9.737 1.00 0.00 H new ATOM 819 N LEU A 59 -8.280 4.667 -6.718 1.00 0.00 N ATOM 820 CA LEU A 59 -8.293 3.424 -5.966 1.00 0.00 C ATOM 821 C LEU A 59 -9.662 3.248 -5.304 1.00 0.00 C ATOM 822 O LEU A 59 -10.301 4.226 -4.921 1.00 0.00 O ATOM 823 CB LEU A 59 -7.124 3.382 -4.980 1.00 0.00 C ATOM 824 CG LEU A 59 -5.783 2.914 -5.551 1.00 0.00 C ATOM 825 CD1 LEU A 59 -4.666 3.060 -4.516 1.00 0.00 C ATOM 826 CD2 LEU A 59 -5.884 1.484 -6.086 1.00 0.00 C ATOM 0 H LEU A 59 -7.987 5.485 -6.184 1.00 0.00 H new ATOM 0 HA LEU A 59 -8.148 2.574 -6.633 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -6.990 4.380 -4.562 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -7.394 2.724 -4.154 1.00 0.00 H new ATOM 0 HG LEU A 59 -5.528 3.556 -6.394 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.724 2.721 -4.947 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.575 4.106 -4.224 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.902 2.457 -3.639 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -4.918 1.176 -6.486 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -6.173 0.813 -5.277 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -6.633 1.443 -6.876 1.00 0.00 H new ATOM 838 N GLU A 60 -10.070 1.992 -5.188 1.00 0.00 N ATOM 839 CA GLU A 60 -11.351 1.675 -4.579 1.00 0.00 C ATOM 840 C GLU A 60 -11.248 0.379 -3.773 1.00 0.00 C ATOM 841 O GLU A 60 -10.309 -0.395 -3.952 1.00 0.00 O ATOM 842 CB GLU A 60 -12.452 1.578 -5.637 1.00 0.00 C ATOM 843 CG GLU A 60 -12.501 2.843 -6.496 1.00 0.00 C ATOM 844 CD GLU A 60 -13.565 2.724 -7.588 1.00 0.00 C ATOM 845 OE1 GLU A 60 -14.754 2.897 -7.244 1.00 0.00 O ATOM 846 OE2 GLU A 60 -13.165 2.462 -8.743 1.00 0.00 O ATOM 0 H GLU A 60 -9.536 1.183 -5.505 1.00 0.00 H new ATOM 0 HA GLU A 60 -11.618 2.483 -3.898 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -12.275 0.710 -6.272 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -13.416 1.427 -5.151 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -12.716 3.706 -5.866 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -11.526 3.016 -6.951 1.00 0.00 H new ATOM 853 N ILE A 61 -12.228 0.181 -2.904 1.00 0.00 N ATOM 854 CA ILE A 61 -12.260 -1.008 -2.070 1.00 0.00 C ATOM 855 C ILE A 61 -12.192 -2.251 -2.959 1.00 0.00 C ATOM 856 O ILE A 61 -13.009 -2.418 -3.863 1.00 0.00 O ATOM 857 CB ILE A 61 -13.478 -0.981 -1.144 1.00 0.00 C ATOM 858 CG1 ILE A 61 -13.409 0.207 -0.182 1.00 0.00 C ATOM 859 CG2 ILE A 61 -13.634 -2.310 -0.403 1.00 0.00 C ATOM 860 CD1 ILE A 61 -14.809 0.633 0.265 1.00 0.00 C ATOM 0 H ILE A 61 -13.006 0.824 -2.759 1.00 0.00 H new ATOM 0 HA ILE A 61 -11.390 -1.036 -1.414 1.00 0.00 H new ATOM 0 HB ILE A 61 -14.370 -0.848 -1.757 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -12.811 -0.060 0.689 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -12.908 1.044 -0.668 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -14.507 -2.263 0.248 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -13.763 -3.116 -1.125 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -12.744 -2.499 0.197 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -14.731 1.479 0.948 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -15.397 0.923 -0.606 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -15.298 -0.199 0.772 1.00 0.00 H new ATOM 872 N GLY A 62 -11.210 -3.092 -2.671 1.00 0.00 N ATOM 873 CA GLY A 62 -11.024 -4.315 -3.434 1.00 0.00 C ATOM 874 C GLY A 62 -9.637 -4.354 -4.078 1.00 0.00 C ATOM 875 O GLY A 62 -9.037 -5.421 -4.205 1.00 0.00 O ATOM 0 H GLY A 62 -10.535 -2.951 -1.920 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -11.150 -5.178 -2.780 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -11.790 -4.386 -4.207 1.00 0.00 H new ATOM 879 N ASP A 63 -9.167 -3.178 -4.468 1.00 0.00 N ATOM 880 CA ASP A 63 -7.862 -3.065 -5.096 1.00 0.00 C ATOM 881 C ASP A 63 -6.819 -3.767 -4.225 1.00 0.00 C ATOM 882 O ASP A 63 -6.351 -3.205 -3.235 1.00 0.00 O ATOM 883 CB ASP A 63 -7.447 -1.599 -5.243 1.00 0.00 C ATOM 884 CG ASP A 63 -8.304 -0.778 -6.208 1.00 0.00 C ATOM 885 OD1 ASP A 63 -8.944 -1.409 -7.077 1.00 0.00 O ATOM 886 OD2 ASP A 63 -8.300 0.462 -6.056 1.00 0.00 O ATOM 0 H ASP A 63 -9.667 -2.295 -4.361 1.00 0.00 H new ATOM 0 HA ASP A 63 -7.922 -3.524 -6.083 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -7.480 -1.128 -4.261 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -6.411 -1.562 -5.580 1.00 0.00 H new ATOM 891 N GLN A 64 -6.483 -4.985 -4.624 1.00 0.00 N ATOM 892 CA GLN A 64 -5.504 -5.769 -3.892 1.00 0.00 C ATOM 893 C GLN A 64 -4.087 -5.380 -4.317 1.00 0.00 C ATOM 894 O GLN A 64 -3.815 -5.216 -5.506 1.00 0.00 O ATOM 895 CB GLN A 64 -5.744 -7.267 -4.088 1.00 0.00 C ATOM 896 CG GLN A 64 -4.664 -8.092 -3.385 1.00 0.00 C ATOM 897 CD GLN A 64 -4.552 -9.488 -4.001 1.00 0.00 C ATOM 898 OE1 GLN A 64 -5.334 -9.885 -4.849 1.00 0.00 O ATOM 899 NE2 GLN A 64 -3.539 -10.209 -3.528 1.00 0.00 N ATOM 0 H GLN A 64 -6.872 -5.448 -5.445 1.00 0.00 H new ATOM 0 HA GLN A 64 -5.615 -5.553 -2.829 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -6.725 -7.536 -3.696 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -5.751 -7.502 -5.152 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -3.705 -7.580 -3.459 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -4.899 -8.177 -2.324 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -2.921 -9.816 -2.818 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -3.380 -11.155 -3.875 1.00 0.00 H new ATOM 908 N ILE A 65 -3.221 -5.244 -3.324 1.00 0.00 N ATOM 909 CA ILE A 65 -1.839 -4.878 -3.581 1.00 0.00 C ATOM 910 C ILE A 65 -1.010 -6.146 -3.795 1.00 0.00 C ATOM 911 O ILE A 65 -0.774 -6.904 -2.855 1.00 0.00 O ATOM 912 CB ILE A 65 -1.307 -3.978 -2.463 1.00 0.00 C ATOM 913 CG1 ILE A 65 -2.124 -2.688 -2.362 1.00 0.00 C ATOM 914 CG2 ILE A 65 0.186 -3.697 -2.649 1.00 0.00 C ATOM 915 CD1 ILE A 65 -2.081 -2.122 -0.941 1.00 0.00 C ATOM 0 H ILE A 65 -3.450 -5.381 -2.339 1.00 0.00 H new ATOM 0 HA ILE A 65 -1.765 -4.290 -4.496 1.00 0.00 H new ATOM 0 HB ILE A 65 -1.420 -4.506 -1.516 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -1.734 -1.950 -3.063 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -3.157 -2.884 -2.648 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.539 -3.055 -1.842 1.00 0.00 H new ATOM 0 HG22 ILE A 65 0.738 -4.637 -2.633 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.346 -3.198 -3.605 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -2.669 -1.206 -0.896 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -2.494 -2.853 -0.246 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -1.049 -1.904 -0.667 1.00 0.00 H new ATOM 927 N VAL A 66 -0.593 -6.339 -5.038 1.00 0.00 N ATOM 928 CA VAL A 66 0.204 -7.502 -5.387 1.00 0.00 C ATOM 929 C VAL A 66 1.677 -7.099 -5.476 1.00 0.00 C ATOM 930 O VAL A 66 2.564 -7.944 -5.369 1.00 0.00 O ATOM 931 CB VAL A 66 -0.323 -8.128 -6.680 1.00 0.00 C ATOM 932 CG1 VAL A 66 -1.809 -8.472 -6.556 1.00 0.00 C ATOM 933 CG2 VAL A 66 -0.070 -7.210 -7.877 1.00 0.00 C ATOM 0 H VAL A 66 -0.792 -5.709 -5.815 1.00 0.00 H new ATOM 0 HA VAL A 66 0.123 -8.266 -4.614 1.00 0.00 H new ATOM 0 HB VAL A 66 0.223 -9.056 -6.850 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -2.159 -8.915 -7.488 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -1.951 -9.181 -5.741 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.377 -7.564 -6.350 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.454 -7.679 -8.783 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.576 -6.258 -7.719 1.00 0.00 H new ATOM 0 HG23 VAL A 66 1.001 -7.038 -7.984 1.00 0.00 H new ATOM 943 N GLU A 67 1.893 -5.806 -5.672 1.00 0.00 N ATOM 944 CA GLU A 67 3.243 -5.280 -5.776 1.00 0.00 C ATOM 945 C GLU A 67 3.282 -3.822 -5.313 1.00 0.00 C ATOM 946 O GLU A 67 2.288 -3.106 -5.420 1.00 0.00 O ATOM 947 CB GLU A 67 3.775 -5.416 -7.204 1.00 0.00 C ATOM 948 CG GLU A 67 5.103 -4.673 -7.368 1.00 0.00 C ATOM 949 CD GLU A 67 5.557 -4.677 -8.829 1.00 0.00 C ATOM 950 OE1 GLU A 67 5.932 -5.771 -9.303 1.00 0.00 O ATOM 951 OE2 GLU A 67 5.520 -3.587 -9.438 1.00 0.00 O ATOM 0 H GLU A 67 1.155 -5.107 -5.761 1.00 0.00 H new ATOM 0 HA GLU A 67 3.892 -5.865 -5.124 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.912 -6.470 -7.446 1.00 0.00 H new ATOM 0 HB3 GLU A 67 3.043 -5.020 -7.908 1.00 0.00 H new ATOM 0 HG2 GLU A 67 4.994 -3.646 -7.020 1.00 0.00 H new ATOM 0 HG3 GLU A 67 5.865 -5.142 -6.745 1.00 0.00 H new ATOM 958 N VAL A 68 4.441 -3.426 -4.808 1.00 0.00 N ATOM 959 CA VAL A 68 4.623 -2.067 -4.328 1.00 0.00 C ATOM 960 C VAL A 68 6.092 -1.668 -4.483 1.00 0.00 C ATOM 961 O VAL A 68 6.964 -2.229 -3.822 1.00 0.00 O ATOM 962 CB VAL A 68 4.120 -1.949 -2.887 1.00 0.00 C ATOM 963 CG1 VAL A 68 4.361 -0.543 -2.336 1.00 0.00 C ATOM 964 CG2 VAL A 68 2.642 -2.331 -2.789 1.00 0.00 C ATOM 0 H VAL A 68 5.264 -4.023 -4.721 1.00 0.00 H new ATOM 0 HA VAL A 68 4.032 -1.370 -4.922 1.00 0.00 H new ATOM 0 HB VAL A 68 4.688 -2.650 -2.275 1.00 0.00 H new ATOM 0 HG11 VAL A 68 3.995 -0.486 -1.311 1.00 0.00 H new ATOM 0 HG12 VAL A 68 5.429 -0.324 -2.352 1.00 0.00 H new ATOM 0 HG13 VAL A 68 3.832 0.185 -2.951 1.00 0.00 H new ATOM 0 HG21 VAL A 68 2.310 -2.238 -1.755 1.00 0.00 H new ATOM 0 HG22 VAL A 68 2.052 -1.667 -3.420 1.00 0.00 H new ATOM 0 HG23 VAL A 68 2.509 -3.360 -3.122 1.00 0.00 H new ATOM 974 N ASN A 69 6.320 -0.702 -5.361 1.00 0.00 N ATOM 975 CA ASN A 69 7.668 -0.222 -5.611 1.00 0.00 C ATOM 976 C ASN A 69 8.540 -1.386 -6.084 1.00 0.00 C ATOM 977 O ASN A 69 9.766 -1.325 -5.994 1.00 0.00 O ATOM 978 CB ASN A 69 8.294 0.352 -4.338 1.00 0.00 C ATOM 979 CG ASN A 69 8.813 1.771 -4.574 1.00 0.00 C ATOM 980 OD1 ASN A 69 8.777 2.299 -5.673 1.00 0.00 O ATOM 981 ND2 ASN A 69 9.297 2.358 -3.483 1.00 0.00 N ATOM 0 H ASN A 69 5.594 -0.239 -5.908 1.00 0.00 H new ATOM 0 HA ASN A 69 7.612 0.560 -6.369 1.00 0.00 H new ATOM 0 HB2 ASN A 69 7.555 0.360 -3.537 1.00 0.00 H new ATOM 0 HB3 ASN A 69 9.113 -0.289 -4.010 1.00 0.00 H new ATOM 0 HD21 ASN A 69 9.668 3.307 -3.536 1.00 0.00 H new ATOM 0 HD22 ASN A 69 9.297 1.859 -2.593 1.00 0.00 H new ATOM 988 N GLY A 70 7.875 -2.420 -6.577 1.00 0.00 N ATOM 989 CA GLY A 70 8.574 -3.597 -7.064 1.00 0.00 C ATOM 990 C GLY A 70 8.656 -4.674 -5.980 1.00 0.00 C ATOM 991 O GLY A 70 9.348 -5.677 -6.147 1.00 0.00 O ATOM 0 H GLY A 70 6.859 -2.467 -6.650 1.00 0.00 H new ATOM 0 HA2 GLY A 70 8.059 -3.995 -7.938 1.00 0.00 H new ATOM 0 HA3 GLY A 70 9.579 -3.321 -7.384 1.00 0.00 H new ATOM 995 N VAL A 71 7.938 -4.430 -4.893 1.00 0.00 N ATOM 996 CA VAL A 71 7.921 -5.366 -3.782 1.00 0.00 C ATOM 997 C VAL A 71 6.896 -6.467 -4.065 1.00 0.00 C ATOM 998 O VAL A 71 5.988 -6.282 -4.874 1.00 0.00 O ATOM 999 CB VAL A 71 7.652 -4.621 -2.474 1.00 0.00 C ATOM 1000 CG1 VAL A 71 7.609 -5.589 -1.290 1.00 0.00 C ATOM 1001 CG2 VAL A 71 8.691 -3.521 -2.246 1.00 0.00 C ATOM 0 H VAL A 71 7.364 -3.598 -4.758 1.00 0.00 H new ATOM 0 HA VAL A 71 8.893 -5.847 -3.672 1.00 0.00 H new ATOM 0 HB VAL A 71 6.674 -4.147 -2.554 1.00 0.00 H new ATOM 0 HG11 VAL A 71 7.416 -5.033 -0.372 1.00 0.00 H new ATOM 0 HG12 VAL A 71 6.815 -6.319 -1.446 1.00 0.00 H new ATOM 0 HG13 VAL A 71 8.565 -6.105 -1.207 1.00 0.00 H new ATOM 0 HG21 VAL A 71 8.477 -3.007 -1.309 1.00 0.00 H new ATOM 0 HG22 VAL A 71 9.686 -3.964 -2.197 1.00 0.00 H new ATOM 0 HG23 VAL A 71 8.652 -2.807 -3.069 1.00 0.00 H new ATOM 1011 N ASP A 72 7.076 -7.588 -3.382 1.00 0.00 N ATOM 1012 CA ASP A 72 6.178 -8.718 -3.549 1.00 0.00 C ATOM 1013 C ASP A 72 5.092 -8.665 -2.473 1.00 0.00 C ATOM 1014 O ASP A 72 5.245 -9.251 -1.402 1.00 0.00 O ATOM 1015 CB ASP A 72 6.928 -10.044 -3.399 1.00 0.00 C ATOM 1016 CG ASP A 72 6.422 -11.177 -4.294 1.00 0.00 C ATOM 1017 OD1 ASP A 72 5.633 -10.867 -5.212 1.00 0.00 O ATOM 1018 OD2 ASP A 72 6.836 -12.329 -4.039 1.00 0.00 O ATOM 0 H ASP A 72 7.830 -7.738 -2.712 1.00 0.00 H new ATOM 0 HA ASP A 72 5.744 -8.659 -4.547 1.00 0.00 H new ATOM 0 HB2 ASP A 72 7.983 -9.874 -3.615 1.00 0.00 H new ATOM 0 HB3 ASP A 72 6.863 -10.365 -2.360 1.00 0.00 H new ATOM 1023 N PHE A 73 4.019 -7.957 -2.794 1.00 0.00 N ATOM 1024 CA PHE A 73 2.908 -7.820 -1.868 1.00 0.00 C ATOM 1025 C PHE A 73 1.861 -8.911 -2.103 1.00 0.00 C ATOM 1026 O PHE A 73 0.723 -8.791 -1.652 1.00 0.00 O ATOM 1027 CB PHE A 73 2.272 -6.454 -2.132 1.00 0.00 C ATOM 1028 CG PHE A 73 2.823 -5.331 -1.251 1.00 0.00 C ATOM 1029 CD1 PHE A 73 4.161 -5.087 -1.217 1.00 0.00 C ATOM 1030 CD2 PHE A 73 1.975 -4.575 -0.503 1.00 0.00 C ATOM 1031 CE1 PHE A 73 4.672 -4.044 -0.400 1.00 0.00 C ATOM 1032 CE2 PHE A 73 2.486 -3.533 0.314 1.00 0.00 C ATOM 1033 CZ PHE A 73 3.824 -3.289 0.348 1.00 0.00 C ATOM 0 H PHE A 73 3.896 -7.472 -3.683 1.00 0.00 H new ATOM 0 HA PHE A 73 3.265 -7.911 -0.842 1.00 0.00 H new ATOM 0 HB2 PHE A 73 2.425 -6.189 -3.178 1.00 0.00 H new ATOM 0 HB3 PHE A 73 1.196 -6.529 -1.976 1.00 0.00 H new ATOM 0 HD1 PHE A 73 4.835 -5.687 -1.811 1.00 0.00 H new ATOM 0 HD2 PHE A 73 0.913 -4.768 -0.531 1.00 0.00 H new ATOM 0 HE1 PHE A 73 5.734 -3.850 -0.373 1.00 0.00 H new ATOM 0 HE2 PHE A 73 1.813 -2.934 0.909 1.00 0.00 H new ATOM 0 HZ PHE A 73 4.213 -2.496 0.969 1.00 0.00 H new ATOM 1043 N SER A 74 2.283 -9.950 -2.808 1.00 0.00 N ATOM 1044 CA SER A 74 1.396 -11.061 -3.108 1.00 0.00 C ATOM 1045 C SER A 74 1.043 -11.811 -1.821 1.00 0.00 C ATOM 1046 O SER A 74 -0.092 -12.252 -1.648 1.00 0.00 O ATOM 1047 CB SER A 74 2.032 -12.015 -4.121 1.00 0.00 C ATOM 1048 OG SER A 74 1.085 -12.489 -5.074 1.00 0.00 O ATOM 0 H SER A 74 3.228 -10.046 -3.180 1.00 0.00 H new ATOM 0 HA SER A 74 0.483 -10.661 -3.550 1.00 0.00 H new ATOM 0 HB2 SER A 74 2.844 -11.505 -4.639 1.00 0.00 H new ATOM 0 HB3 SER A 74 2.472 -12.862 -3.595 1.00 0.00 H new ATOM 0 HG SER A 74 1.530 -13.094 -5.704 1.00 0.00 H new ATOM 1054 N ASN A 75 2.037 -11.932 -0.953 1.00 0.00 N ATOM 1055 CA ASN A 75 1.845 -12.620 0.312 1.00 0.00 C ATOM 1056 C ASN A 75 2.586 -11.864 1.417 1.00 0.00 C ATOM 1057 O ASN A 75 3.404 -12.443 2.129 1.00 0.00 O ATOM 1058 CB ASN A 75 2.405 -14.043 0.255 1.00 0.00 C ATOM 1059 CG ASN A 75 1.489 -14.961 -0.555 1.00 0.00 C ATOM 1060 OD1 ASN A 75 0.352 -15.221 -0.196 1.00 0.00 O ATOM 1061 ND2 ASN A 75 2.044 -15.436 -1.666 1.00 0.00 N ATOM 0 H ASN A 75 2.977 -11.565 -1.101 1.00 0.00 H new ATOM 0 HA ASN A 75 0.775 -12.661 0.515 1.00 0.00 H new ATOM 0 HB2 ASN A 75 3.399 -14.029 -0.192 1.00 0.00 H new ATOM 0 HB3 ASN A 75 2.516 -14.435 1.266 1.00 0.00 H new ATOM 0 HD21 ASN A 75 1.513 -16.058 -2.276 1.00 0.00 H new ATOM 0 HD22 ASN A 75 3.001 -15.179 -1.908 1.00 0.00 H new ATOM 1068 N LEU A 76 2.273 -10.581 1.524 1.00 0.00 N ATOM 1069 CA LEU A 76 2.898 -9.740 2.530 1.00 0.00 C ATOM 1070 C LEU A 76 2.076 -9.795 3.819 1.00 0.00 C ATOM 1071 O LEU A 76 1.208 -10.654 3.969 1.00 0.00 O ATOM 1072 CB LEU A 76 3.102 -8.322 1.991 1.00 0.00 C ATOM 1073 CG LEU A 76 4.514 -7.985 1.509 1.00 0.00 C ATOM 1074 CD1 LEU A 76 4.632 -6.501 1.153 1.00 0.00 C ATOM 1075 CD2 LEU A 76 5.563 -8.413 2.538 1.00 0.00 C ATOM 0 H LEU A 76 1.595 -10.104 0.930 1.00 0.00 H new ATOM 0 HA LEU A 76 3.894 -10.112 2.771 1.00 0.00 H new ATOM 0 HB2 LEU A 76 2.410 -8.166 1.163 1.00 0.00 H new ATOM 0 HB3 LEU A 76 2.828 -7.614 2.773 1.00 0.00 H new ATOM 0 HG LEU A 76 4.708 -8.552 0.598 1.00 0.00 H new ATOM 0 HD11 LEU A 76 5.646 -6.288 0.813 1.00 0.00 H new ATOM 0 HD12 LEU A 76 3.925 -6.260 0.359 1.00 0.00 H new ATOM 0 HD13 LEU A 76 4.410 -5.897 2.033 1.00 0.00 H new ATOM 0 HD21 LEU A 76 6.558 -8.162 2.170 1.00 0.00 H new ATOM 0 HD22 LEU A 76 5.383 -7.894 3.479 1.00 0.00 H new ATOM 0 HD23 LEU A 76 5.497 -9.489 2.699 1.00 0.00 H new ATOM 1087 N ASP A 77 2.379 -8.869 4.717 1.00 0.00 N ATOM 1088 CA ASP A 77 1.678 -8.802 5.988 1.00 0.00 C ATOM 1089 C ASP A 77 1.212 -7.365 6.233 1.00 0.00 C ATOM 1090 O ASP A 77 1.609 -6.449 5.515 1.00 0.00 O ATOM 1091 CB ASP A 77 2.595 -9.205 7.144 1.00 0.00 C ATOM 1092 CG ASP A 77 1.946 -9.166 8.529 1.00 0.00 C ATOM 1093 OD1 ASP A 77 1.093 -10.044 8.781 1.00 0.00 O ATOM 1094 OD2 ASP A 77 2.317 -8.258 9.304 1.00 0.00 O ATOM 0 H ASP A 77 3.100 -8.159 4.590 1.00 0.00 H new ATOM 0 HA ASP A 77 0.832 -9.487 5.943 1.00 0.00 H new ATOM 0 HB2 ASP A 77 2.964 -10.214 6.960 1.00 0.00 H new ATOM 0 HB3 ASP A 77 3.462 -8.545 7.147 1.00 0.00 H new ATOM 1099 N HIS A 78 0.376 -7.214 7.250 1.00 0.00 N ATOM 1100 CA HIS A 78 -0.148 -5.904 7.599 1.00 0.00 C ATOM 1101 C HIS A 78 0.970 -5.047 8.197 1.00 0.00 C ATOM 1102 O HIS A 78 0.779 -3.857 8.444 1.00 0.00 O ATOM 1103 CB HIS A 78 -1.357 -6.033 8.528 1.00 0.00 C ATOM 1104 CG HIS A 78 -2.033 -4.719 8.841 1.00 0.00 C ATOM 1105 ND1 HIS A 78 -1.534 -3.822 9.769 1.00 0.00 N ATOM 1106 CD2 HIS A 78 -3.173 -4.162 8.340 1.00 0.00 C ATOM 1107 CE1 HIS A 78 -2.345 -2.775 9.816 1.00 0.00 C ATOM 1108 NE2 HIS A 78 -3.360 -2.988 8.930 1.00 0.00 N ATOM 0 H HIS A 78 0.049 -7.977 7.843 1.00 0.00 H new ATOM 0 HA HIS A 78 -0.505 -5.400 6.701 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -2.084 -6.704 8.071 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -1.038 -6.497 9.461 1.00 0.00 H new ATOM 0 HD1 HIS A 78 -0.686 -3.946 10.323 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -3.814 -4.602 7.591 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -2.224 -1.906 10.445 1.00 0.00 H new ATOM 1116 N LYS A 79 2.111 -5.684 8.411 1.00 0.00 N ATOM 1117 CA LYS A 79 3.259 -4.995 8.975 1.00 0.00 C ATOM 1118 C LYS A 79 4.327 -4.823 7.893 1.00 0.00 C ATOM 1119 O LYS A 79 4.995 -3.791 7.834 1.00 0.00 O ATOM 1120 CB LYS A 79 3.761 -5.722 10.224 1.00 0.00 C ATOM 1121 CG LYS A 79 2.681 -5.760 11.308 1.00 0.00 C ATOM 1122 CD LYS A 79 3.261 -5.385 12.673 1.00 0.00 C ATOM 1123 CE LYS A 79 2.674 -4.065 13.174 1.00 0.00 C ATOM 1124 NZ LYS A 79 2.711 -4.009 14.653 1.00 0.00 N ATOM 0 H LYS A 79 2.265 -6.671 8.204 1.00 0.00 H new ATOM 0 HA LYS A 79 2.977 -3.996 9.308 1.00 0.00 H new ATOM 0 HB2 LYS A 79 4.056 -6.739 9.964 1.00 0.00 H new ATOM 0 HB3 LYS A 79 4.650 -5.221 10.608 1.00 0.00 H new ATOM 0 HG2 LYS A 79 1.877 -5.072 11.049 1.00 0.00 H new ATOM 0 HG3 LYS A 79 2.244 -6.757 11.356 1.00 0.00 H new ATOM 0 HD2 LYS A 79 3.050 -6.177 13.392 1.00 0.00 H new ATOM 0 HD3 LYS A 79 4.345 -5.301 12.601 1.00 0.00 H new ATOM 0 HE2 LYS A 79 3.237 -3.229 12.758 1.00 0.00 H new ATOM 0 HE3 LYS A 79 1.646 -3.962 12.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 2.309 -3.106 14.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 2.155 -4.796 15.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 3.696 -4.086 14.979 1.00 0.00 H new ATOM 1138 N GLU A 80 4.454 -5.848 7.064 1.00 0.00 N ATOM 1139 CA GLU A 80 5.430 -5.823 5.987 1.00 0.00 C ATOM 1140 C GLU A 80 4.924 -4.955 4.833 1.00 0.00 C ATOM 1141 O GLU A 80 5.701 -4.237 4.206 1.00 0.00 O ATOM 1142 CB GLU A 80 5.753 -7.239 5.507 1.00 0.00 C ATOM 1143 CG GLU A 80 6.370 -8.072 6.632 1.00 0.00 C ATOM 1144 CD GLU A 80 7.501 -8.957 6.102 1.00 0.00 C ATOM 1145 OE1 GLU A 80 8.370 -8.404 5.394 1.00 0.00 O ATOM 1146 OE2 GLU A 80 7.471 -10.166 6.418 1.00 0.00 O ATOM 0 H GLU A 80 3.898 -6.701 7.116 1.00 0.00 H new ATOM 0 HA GLU A 80 6.352 -5.385 6.368 1.00 0.00 H new ATOM 0 HB2 GLU A 80 4.844 -7.722 5.149 1.00 0.00 H new ATOM 0 HB3 GLU A 80 6.442 -7.193 4.664 1.00 0.00 H new ATOM 0 HG2 GLU A 80 6.754 -7.412 7.410 1.00 0.00 H new ATOM 0 HG3 GLU A 80 5.602 -8.694 7.092 1.00 0.00 H new ATOM 1153 N ALA A 81 3.626 -5.049 4.589 1.00 0.00 N ATOM 1154 CA ALA A 81 3.008 -4.281 3.521 1.00 0.00 C ATOM 1155 C ALA A 81 3.004 -2.799 3.902 1.00 0.00 C ATOM 1156 O ALA A 81 3.132 -1.933 3.038 1.00 0.00 O ATOM 1157 CB ALA A 81 1.600 -4.818 3.255 1.00 0.00 C ATOM 0 H ALA A 81 2.985 -5.645 5.112 1.00 0.00 H new ATOM 0 HA ALA A 81 3.576 -4.383 2.596 1.00 0.00 H new ATOM 0 HB1 ALA A 81 1.136 -4.242 2.454 1.00 0.00 H new ATOM 0 HB2 ALA A 81 1.660 -5.866 2.961 1.00 0.00 H new ATOM 0 HB3 ALA A 81 1.000 -4.729 4.160 1.00 0.00 H new ATOM 1163 N VAL A 82 2.855 -2.553 5.195 1.00 0.00 N ATOM 1164 CA VAL A 82 2.832 -1.191 5.700 1.00 0.00 C ATOM 1165 C VAL A 82 4.262 -0.648 5.754 1.00 0.00 C ATOM 1166 O VAL A 82 4.564 0.378 5.146 1.00 0.00 O ATOM 1167 CB VAL A 82 2.124 -1.147 7.056 1.00 0.00 C ATOM 1168 CG1 VAL A 82 2.306 0.217 7.725 1.00 0.00 C ATOM 1169 CG2 VAL A 82 0.641 -1.493 6.911 1.00 0.00 C ATOM 0 H VAL A 82 2.749 -3.274 5.908 1.00 0.00 H new ATOM 0 HA VAL A 82 2.264 -0.545 5.031 1.00 0.00 H new ATOM 0 HB VAL A 82 2.582 -1.899 7.698 1.00 0.00 H new ATOM 0 HG11 VAL A 82 1.793 0.222 8.687 1.00 0.00 H new ATOM 0 HG12 VAL A 82 3.368 0.408 7.879 1.00 0.00 H new ATOM 0 HG13 VAL A 82 1.886 0.994 7.086 1.00 0.00 H new ATOM 0 HG21 VAL A 82 0.161 -1.455 7.889 1.00 0.00 H new ATOM 0 HG22 VAL A 82 0.163 -0.775 6.244 1.00 0.00 H new ATOM 0 HG23 VAL A 82 0.540 -2.496 6.497 1.00 0.00 H new ATOM 1179 N ASN A 83 5.104 -1.361 6.488 1.00 0.00 N ATOM 1180 CA ASN A 83 6.494 -0.964 6.629 1.00 0.00 C ATOM 1181 C ASN A 83 7.061 -0.609 5.253 1.00 0.00 C ATOM 1182 O ASN A 83 7.747 0.401 5.102 1.00 0.00 O ATOM 1183 CB ASN A 83 7.336 -2.102 7.208 1.00 0.00 C ATOM 1184 CG ASN A 83 8.733 -1.611 7.592 1.00 0.00 C ATOM 1185 OD1 ASN A 83 8.967 -1.111 8.680 1.00 0.00 O ATOM 1186 ND2 ASN A 83 9.647 -1.780 6.641 1.00 0.00 N ATOM 0 H ASN A 83 4.850 -2.211 6.991 1.00 0.00 H new ATOM 0 HA ASN A 83 6.533 -0.108 7.303 1.00 0.00 H new ATOM 0 HB2 ASN A 83 6.839 -2.517 8.085 1.00 0.00 H new ATOM 0 HB3 ASN A 83 7.418 -2.907 6.477 1.00 0.00 H new ATOM 0 HD21 ASN A 83 10.610 -1.484 6.801 1.00 0.00 H new ATOM 0 HD22 ASN A 83 9.385 -2.206 5.752 1.00 0.00 H new ATOM 1193 N VAL A 84 6.754 -1.459 4.285 1.00 0.00 N ATOM 1194 CA VAL A 84 7.224 -1.247 2.926 1.00 0.00 C ATOM 1195 C VAL A 84 6.635 0.056 2.384 1.00 0.00 C ATOM 1196 O VAL A 84 7.276 0.752 1.599 1.00 0.00 O ATOM 1197 CB VAL A 84 6.886 -2.462 2.060 1.00 0.00 C ATOM 1198 CG1 VAL A 84 7.183 -2.184 0.586 1.00 0.00 C ATOM 1199 CG2 VAL A 84 7.633 -3.706 2.545 1.00 0.00 C ATOM 0 H VAL A 84 6.186 -2.296 4.414 1.00 0.00 H new ATOM 0 HA VAL A 84 8.309 -1.144 2.909 1.00 0.00 H new ATOM 0 HB VAL A 84 5.817 -2.655 2.156 1.00 0.00 H new ATOM 0 HG11 VAL A 84 6.934 -3.064 -0.008 1.00 0.00 H new ATOM 0 HG12 VAL A 84 6.586 -1.337 0.248 1.00 0.00 H new ATOM 0 HG13 VAL A 84 8.241 -1.953 0.465 1.00 0.00 H new ATOM 0 HG21 VAL A 84 7.375 -4.555 1.912 1.00 0.00 H new ATOM 0 HG22 VAL A 84 8.707 -3.528 2.494 1.00 0.00 H new ATOM 0 HG23 VAL A 84 7.350 -3.922 3.575 1.00 0.00 H new ATOM 1209 N LEU A 85 5.419 0.347 2.825 1.00 0.00 N ATOM 1210 CA LEU A 85 4.736 1.554 2.393 1.00 0.00 C ATOM 1211 C LEU A 85 5.342 2.762 3.110 1.00 0.00 C ATOM 1212 O LEU A 85 5.436 3.847 2.537 1.00 0.00 O ATOM 1213 CB LEU A 85 3.225 1.415 2.593 1.00 0.00 C ATOM 1214 CG LEU A 85 2.484 0.582 1.546 1.00 0.00 C ATOM 1215 CD1 LEU A 85 1.067 0.247 2.015 1.00 0.00 C ATOM 1216 CD2 LEU A 85 2.488 1.281 0.185 1.00 0.00 C ATOM 0 H LEU A 85 4.890 -0.233 3.477 1.00 0.00 H new ATOM 0 HA LEU A 85 4.880 1.712 1.324 1.00 0.00 H new ATOM 0 HB2 LEU A 85 3.047 0.972 3.573 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.787 2.413 2.610 1.00 0.00 H new ATOM 0 HG LEU A 85 3.014 -0.362 1.423 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.562 -0.346 1.252 1.00 0.00 H new ATOM 0 HD12 LEU A 85 1.116 -0.322 2.943 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.512 1.170 2.184 1.00 0.00 H new ATOM 0 HD21 LEU A 85 1.955 0.667 -0.541 1.00 0.00 H new ATOM 0 HD22 LEU A 85 1.996 2.250 0.272 1.00 0.00 H new ATOM 0 HD23 LEU A 85 3.516 1.425 -0.147 1.00 0.00 H new ATOM 1228 N LYS A 86 5.739 2.535 4.354 1.00 0.00 N ATOM 1229 CA LYS A 86 6.334 3.591 5.155 1.00 0.00 C ATOM 1230 C LYS A 86 7.787 3.796 4.722 1.00 0.00 C ATOM 1231 O LYS A 86 8.322 4.898 4.835 1.00 0.00 O ATOM 1232 CB LYS A 86 6.173 3.287 6.646 1.00 0.00 C ATOM 1233 CG LYS A 86 4.935 2.424 6.900 1.00 0.00 C ATOM 1234 CD LYS A 86 4.239 2.833 8.199 1.00 0.00 C ATOM 1235 CE LYS A 86 4.622 1.895 9.345 1.00 0.00 C ATOM 1236 NZ LYS A 86 3.532 1.824 10.344 1.00 0.00 N ATOM 0 H LYS A 86 5.660 1.635 4.827 1.00 0.00 H new ATOM 0 HA LYS A 86 5.815 4.535 4.988 1.00 0.00 H new ATOM 0 HB2 LYS A 86 7.061 2.773 7.014 1.00 0.00 H new ATOM 0 HB3 LYS A 86 6.091 4.220 7.204 1.00 0.00 H new ATOM 0 HG2 LYS A 86 4.241 2.522 6.065 1.00 0.00 H new ATOM 0 HG3 LYS A 86 5.224 1.374 6.953 1.00 0.00 H new ATOM 0 HD2 LYS A 86 4.512 3.857 8.455 1.00 0.00 H new ATOM 0 HD3 LYS A 86 3.158 2.817 8.057 1.00 0.00 H new ATOM 0 HE2 LYS A 86 4.830 0.899 8.954 1.00 0.00 H new ATOM 0 HE3 LYS A 86 5.537 2.248 9.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 3.922 1.984 11.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 2.821 2.553 10.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 3.087 0.885 10.306 1.00 0.00 H new ATOM 1250 N SER A 87 8.384 2.718 4.237 1.00 0.00 N ATOM 1251 CA SER A 87 9.765 2.766 3.787 1.00 0.00 C ATOM 1252 C SER A 87 10.069 4.135 3.176 1.00 0.00 C ATOM 1253 O SER A 87 10.805 4.929 3.759 1.00 0.00 O ATOM 1254 CB SER A 87 10.053 1.657 2.772 1.00 0.00 C ATOM 1255 OG SER A 87 11.411 1.667 2.342 1.00 0.00 O ATOM 0 H SER A 87 7.937 1.806 4.146 1.00 0.00 H new ATOM 0 HA SER A 87 10.411 2.608 4.651 1.00 0.00 H new ATOM 0 HB2 SER A 87 9.821 0.689 3.217 1.00 0.00 H new ATOM 0 HB3 SER A 87 9.398 1.777 1.909 1.00 0.00 H new ATOM 0 HG SER A 87 11.555 0.944 1.697 1.00 0.00 H new ATOM 1261 N SER A 88 9.486 4.370 2.009 1.00 0.00 N ATOM 1262 CA SER A 88 9.686 5.630 1.313 1.00 0.00 C ATOM 1263 C SER A 88 8.334 6.273 0.998 1.00 0.00 C ATOM 1264 O SER A 88 7.286 5.694 1.281 1.00 0.00 O ATOM 1265 CB SER A 88 10.490 5.427 0.027 1.00 0.00 C ATOM 1266 OG SER A 88 11.384 6.509 -0.219 1.00 0.00 O ATOM 0 H SER A 88 8.875 3.709 1.528 1.00 0.00 H new ATOM 0 HA SER A 88 10.255 6.294 1.964 1.00 0.00 H new ATOM 0 HB2 SER A 88 11.056 4.498 0.096 1.00 0.00 H new ATOM 0 HB3 SER A 88 9.806 5.323 -0.816 1.00 0.00 H new ATOM 0 HG SER A 88 11.880 6.342 -1.047 1.00 0.00 H new ATOM 1272 N ARG A 89 8.402 7.462 0.418 1.00 0.00 N ATOM 1273 CA ARG A 89 7.196 8.191 0.061 1.00 0.00 C ATOM 1274 C ARG A 89 6.713 7.770 -1.328 1.00 0.00 C ATOM 1275 O ARG A 89 5.579 7.319 -1.485 1.00 0.00 O ATOM 1276 CB ARG A 89 7.441 9.701 0.073 1.00 0.00 C ATOM 1277 CG ARG A 89 8.242 10.117 1.309 1.00 0.00 C ATOM 1278 CD ARG A 89 7.339 10.216 2.540 1.00 0.00 C ATOM 1279 NE ARG A 89 8.162 10.240 3.770 1.00 0.00 N ATOM 1280 CZ ARG A 89 8.827 9.181 4.250 1.00 0.00 C ATOM 1281 NH1 ARG A 89 8.770 8.007 3.607 1.00 0.00 N ATOM 1282 NH2 ARG A 89 9.548 9.296 5.374 1.00 0.00 N ATOM 0 H ARG A 89 9.273 7.939 0.186 1.00 0.00 H new ATOM 0 HA ARG A 89 6.433 7.953 0.802 1.00 0.00 H new ATOM 0 HB2 ARG A 89 7.979 9.993 -0.829 1.00 0.00 H new ATOM 0 HB3 ARG A 89 6.487 10.228 0.059 1.00 0.00 H new ATOM 0 HG2 ARG A 89 9.036 9.393 1.493 1.00 0.00 H new ATOM 0 HG3 ARG A 89 8.723 11.078 1.128 1.00 0.00 H new ATOM 0 HD2 ARG A 89 6.729 11.118 2.483 1.00 0.00 H new ATOM 0 HD3 ARG A 89 6.653 9.369 2.568 1.00 0.00 H new ATOM 0 HE ARG A 89 8.227 11.118 4.285 1.00 0.00 H new ATOM 0 HH11 ARG A 89 8.220 7.920 2.752 1.00 0.00 H new ATOM 0 HH12 ARG A 89 9.276 7.200 3.972 1.00 0.00 H new ATOM 0 HH21 ARG A 89 9.590 10.190 5.864 1.00 0.00 H new ATOM 0 HH22 ARG A 89 10.054 8.490 5.740 1.00 0.00 H new ATOM 1296 N SER A 90 7.597 7.933 -2.301 1.00 0.00 N ATOM 1297 CA SER A 90 7.275 7.576 -3.672 1.00 0.00 C ATOM 1298 C SER A 90 7.341 6.057 -3.847 1.00 0.00 C ATOM 1299 O SER A 90 8.427 5.481 -3.886 1.00 0.00 O ATOM 1300 CB SER A 90 8.220 8.266 -4.658 1.00 0.00 C ATOM 1301 OG SER A 90 9.320 8.886 -3.998 1.00 0.00 O ATOM 0 H SER A 90 8.536 8.308 -2.167 1.00 0.00 H new ATOM 0 HA SER A 90 6.261 7.916 -3.884 1.00 0.00 H new ATOM 0 HB2 SER A 90 8.593 7.535 -5.375 1.00 0.00 H new ATOM 0 HB3 SER A 90 7.668 9.016 -5.225 1.00 0.00 H new ATOM 0 HG SER A 90 9.901 9.314 -4.661 1.00 0.00 H new ATOM 1307 N LEU A 91 6.166 5.453 -3.948 1.00 0.00 N ATOM 1308 CA LEU A 91 6.078 4.013 -4.118 1.00 0.00 C ATOM 1309 C LEU A 91 5.126 3.698 -5.274 1.00 0.00 C ATOM 1310 O LEU A 91 4.155 4.419 -5.497 1.00 0.00 O ATOM 1311 CB LEU A 91 5.687 3.341 -2.800 1.00 0.00 C ATOM 1312 CG LEU A 91 6.599 3.629 -1.605 1.00 0.00 C ATOM 1313 CD1 LEU A 91 5.799 4.191 -0.428 1.00 0.00 C ATOM 1314 CD2 LEU A 91 7.398 2.385 -1.212 1.00 0.00 C ATOM 0 H LEU A 91 5.267 5.935 -3.915 1.00 0.00 H new ATOM 0 HA LEU A 91 7.051 3.600 -4.384 1.00 0.00 H new ATOM 0 HB2 LEU A 91 4.675 3.652 -2.543 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.659 2.263 -2.959 1.00 0.00 H new ATOM 0 HG LEU A 91 7.318 4.393 -1.901 1.00 0.00 H new ATOM 0 HD11 LEU A 91 6.471 4.387 0.408 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.313 5.119 -0.728 1.00 0.00 H new ATOM 0 HD13 LEU A 91 5.043 3.468 -0.124 1.00 0.00 H new ATOM 0 HD21 LEU A 91 8.038 2.617 -0.361 1.00 0.00 H new ATOM 0 HD22 LEU A 91 6.712 1.582 -0.942 1.00 0.00 H new ATOM 0 HD23 LEU A 91 8.015 2.068 -2.053 1.00 0.00 H new ATOM 1326 N THR A 92 5.439 2.620 -5.978 1.00 0.00 N ATOM 1327 CA THR A 92 4.624 2.200 -7.106 1.00 0.00 C ATOM 1328 C THR A 92 3.796 0.968 -6.736 1.00 0.00 C ATOM 1329 O THR A 92 4.310 -0.149 -6.723 1.00 0.00 O ATOM 1330 CB THR A 92 5.551 1.973 -8.301 1.00 0.00 C ATOM 1331 OG1 THR A 92 6.309 3.177 -8.387 1.00 0.00 O ATOM 1332 CG2 THR A 92 4.793 1.915 -9.628 1.00 0.00 C ATOM 0 H THR A 92 6.246 2.025 -5.789 1.00 0.00 H new ATOM 0 HA THR A 92 3.901 2.968 -7.379 1.00 0.00 H new ATOM 0 HB THR A 92 6.105 1.045 -8.159 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.780 3.865 -8.842 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.498 1.752 -10.443 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.074 1.096 -9.601 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.265 2.855 -9.787 1.00 0.00 H new ATOM 1340 N ILE A 93 2.527 1.213 -6.444 1.00 0.00 N ATOM 1341 CA ILE A 93 1.623 0.137 -6.075 1.00 0.00 C ATOM 1342 C ILE A 93 0.967 -0.427 -7.336 1.00 0.00 C ATOM 1343 O ILE A 93 0.500 0.327 -8.188 1.00 0.00 O ATOM 1344 CB ILE A 93 0.621 0.617 -5.023 1.00 0.00 C ATOM 1345 CG1 ILE A 93 1.340 1.212 -3.811 1.00 0.00 C ATOM 1346 CG2 ILE A 93 -0.337 -0.508 -4.625 1.00 0.00 C ATOM 1347 CD1 ILE A 93 0.492 2.301 -3.150 1.00 0.00 C ATOM 0 H ILE A 93 2.104 2.141 -6.455 1.00 0.00 H new ATOM 0 HA ILE A 93 2.173 -0.680 -5.609 1.00 0.00 H new ATOM 0 HB ILE A 93 0.020 1.413 -5.463 1.00 0.00 H new ATOM 0 HG12 ILE A 93 1.555 0.425 -3.088 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.298 1.630 -4.121 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -1.039 -0.140 -3.876 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.887 -0.845 -5.503 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.232 -1.341 -4.211 1.00 0.00 H new ATOM 0 HD11 ILE A 93 1.026 2.707 -2.291 1.00 0.00 H new ATOM 0 HD12 ILE A 93 0.300 3.098 -3.868 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -0.455 1.874 -2.819 1.00 0.00 H new ATOM 1359 N SER A 94 0.953 -1.750 -7.416 1.00 0.00 N ATOM 1360 CA SER A 94 0.362 -2.424 -8.560 1.00 0.00 C ATOM 1361 C SER A 94 -0.859 -3.233 -8.117 1.00 0.00 C ATOM 1362 O SER A 94 -0.718 -4.310 -7.540 1.00 0.00 O ATOM 1363 CB SER A 94 1.381 -3.335 -9.249 1.00 0.00 C ATOM 1364 OG SER A 94 1.655 -2.915 -10.583 1.00 0.00 O ATOM 0 H SER A 94 1.341 -2.373 -6.708 1.00 0.00 H new ATOM 0 HA SER A 94 0.047 -1.667 -9.278 1.00 0.00 H new ATOM 0 HB2 SER A 94 2.307 -3.344 -8.674 1.00 0.00 H new ATOM 0 HB3 SER A 94 1.004 -4.358 -9.261 1.00 0.00 H new ATOM 0 HG SER A 94 2.311 -3.520 -10.988 1.00 0.00 H new ATOM 1370 N ILE A 95 -2.029 -2.683 -8.404 1.00 0.00 N ATOM 1371 CA ILE A 95 -3.274 -3.340 -8.042 1.00 0.00 C ATOM 1372 C ILE A 95 -3.855 -4.035 -9.275 1.00 0.00 C ATOM 1373 O ILE A 95 -3.425 -3.777 -10.398 1.00 0.00 O ATOM 1374 CB ILE A 95 -4.234 -2.345 -7.387 1.00 0.00 C ATOM 1375 CG1 ILE A 95 -4.455 -1.125 -8.283 1.00 0.00 C ATOM 1376 CG2 ILE A 95 -3.747 -1.950 -5.991 1.00 0.00 C ATOM 1377 CD1 ILE A 95 -5.948 -0.869 -8.502 1.00 0.00 C ATOM 0 H ILE A 95 -2.142 -1.790 -8.883 1.00 0.00 H new ATOM 0 HA ILE A 95 -3.094 -4.113 -7.295 1.00 0.00 H new ATOM 0 HB ILE A 95 -5.200 -2.834 -7.264 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -3.995 -0.248 -7.829 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -3.964 -1.281 -9.244 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -4.448 -1.242 -5.548 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -3.683 -2.839 -5.363 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -2.763 -1.488 -6.066 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -6.077 0.004 -9.142 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -6.400 -1.739 -8.978 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -6.431 -0.689 -7.542 1.00 0.00 H new ATOM 1389 N VAL A 96 -4.824 -4.903 -9.023 1.00 0.00 N ATOM 1390 CA VAL A 96 -5.469 -5.637 -10.098 1.00 0.00 C ATOM 1391 C VAL A 96 -6.897 -5.119 -10.279 1.00 0.00 C ATOM 1392 O VAL A 96 -7.799 -5.881 -10.621 1.00 0.00 O ATOM 1393 CB VAL A 96 -5.410 -7.140 -9.815 1.00 0.00 C ATOM 1394 CG1 VAL A 96 -6.210 -7.926 -10.856 1.00 0.00 C ATOM 1395 CG2 VAL A 96 -3.962 -7.629 -9.752 1.00 0.00 C ATOM 0 H VAL A 96 -5.178 -5.114 -8.090 1.00 0.00 H new ATOM 0 HA VAL A 96 -4.943 -5.476 -11.039 1.00 0.00 H new ATOM 0 HB VAL A 96 -5.866 -7.316 -8.841 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -6.151 -8.991 -10.632 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -7.252 -7.607 -10.831 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -5.797 -7.741 -11.848 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -3.948 -8.700 -9.550 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -3.470 -7.433 -10.705 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -3.435 -7.103 -8.956 1.00 0.00 H new ATOM 1405 N ALA A 97 -7.057 -3.825 -10.042 1.00 0.00 N ATOM 1406 CA ALA A 97 -8.360 -3.196 -10.175 1.00 0.00 C ATOM 1407 C ALA A 97 -9.417 -4.074 -9.501 1.00 0.00 C ATOM 1408 O ALA A 97 -9.959 -4.986 -10.123 1.00 0.00 O ATOM 1409 CB ALA A 97 -8.661 -2.953 -11.655 1.00 0.00 C ATOM 0 H ALA A 97 -6.306 -3.195 -9.759 1.00 0.00 H new ATOM 0 HA ALA A 97 -8.371 -2.227 -9.677 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -9.639 -2.481 -11.755 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -7.898 -2.300 -12.079 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -8.661 -3.904 -12.187 1.00 0.00 H new ATOM 1415 N ALA A 98 -9.677 -3.768 -8.239 1.00 0.00 N ATOM 1416 CA ALA A 98 -10.659 -4.517 -7.474 1.00 0.00 C ATOM 1417 C ALA A 98 -10.407 -6.015 -7.658 1.00 0.00 C ATOM 1418 O ALA A 98 -11.285 -6.744 -8.118 1.00 0.00 O ATOM 1419 CB ALA A 98 -12.067 -4.106 -7.908 1.00 0.00 C ATOM 0 H ALA A 98 -9.224 -3.011 -7.727 1.00 0.00 H new ATOM 0 HA ALA A 98 -10.568 -4.295 -6.411 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -12.803 -4.668 -7.334 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -12.206 -3.040 -7.730 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -12.197 -4.317 -8.970 1.00 0.00 H new ATOM 1425 N ALA A 99 -9.204 -6.430 -7.290 1.00 0.00 N ATOM 1426 CA ALA A 99 -8.825 -7.828 -7.409 1.00 0.00 C ATOM 1427 C ALA A 99 -9.736 -8.676 -6.519 1.00 0.00 C ATOM 1428 O ALA A 99 -10.505 -9.497 -7.016 1.00 0.00 O ATOM 1429 CB ALA A 99 -7.346 -7.988 -7.051 1.00 0.00 C ATOM 0 H ALA A 99 -8.479 -5.823 -6.909 1.00 0.00 H new ATOM 0 HA ALA A 99 -8.951 -8.174 -8.435 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -7.061 -9.036 -7.140 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -6.740 -7.389 -7.731 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -7.181 -7.653 -6.027 1.00 0.00 H new ATOM 1435 N GLY A 100 -9.619 -8.448 -5.219 1.00 0.00 N ATOM 1436 CA GLY A 100 -10.422 -9.181 -4.256 1.00 0.00 C ATOM 1437 C GLY A 100 -11.542 -8.302 -3.694 1.00 0.00 C ATOM 1438 O GLY A 100 -11.635 -8.107 -2.483 1.00 0.00 O ATOM 0 H GLY A 100 -8.980 -7.766 -4.810 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -10.851 -10.063 -4.731 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.788 -9.534 -3.442 1.00 0.00 H new ATOM 1442 N ARG A 101 -12.364 -7.795 -4.601 1.00 0.00 N ATOM 1443 CA ARG A 101 -13.474 -6.942 -4.211 1.00 0.00 C ATOM 1444 C ARG A 101 -14.518 -7.749 -3.437 1.00 0.00 C ATOM 1445 O ARG A 101 -15.250 -7.198 -2.617 1.00 0.00 O ATOM 1446 CB ARG A 101 -14.136 -6.307 -5.435 1.00 0.00 C ATOM 1447 CG ARG A 101 -14.104 -4.780 -5.345 1.00 0.00 C ATOM 1448 CD ARG A 101 -15.341 -4.165 -6.005 1.00 0.00 C ATOM 1449 NE ARG A 101 -14.962 -2.945 -6.752 1.00 0.00 N ATOM 1450 CZ ARG A 101 -15.748 -2.343 -7.655 1.00 0.00 C ATOM 1451 NH1 ARG A 101 -16.960 -2.845 -7.929 1.00 0.00 N ATOM 1452 NH2 ARG A 101 -15.322 -1.240 -8.284 1.00 0.00 N ATOM 0 H ARG A 101 -12.284 -7.958 -5.605 1.00 0.00 H new ATOM 0 HA ARG A 101 -13.077 -6.151 -3.575 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -13.623 -6.632 -6.340 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -15.168 -6.649 -5.513 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -14.056 -4.475 -4.300 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -13.203 -4.402 -5.829 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -15.800 -4.887 -6.680 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -16.085 -3.921 -5.246 1.00 0.00 H new ATOM 0 HE ARG A 101 -14.045 -2.537 -6.568 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -17.284 -3.685 -7.450 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -17.558 -2.387 -8.616 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -14.399 -0.858 -8.076 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -15.920 -0.782 -8.971 1.00 0.00 H new ATOM 1466 N GLU A 102 -14.552 -9.042 -3.724 1.00 0.00 N ATOM 1467 CA GLU A 102 -15.494 -9.931 -3.065 1.00 0.00 C ATOM 1468 C GLU A 102 -15.419 -9.752 -1.547 1.00 0.00 C ATOM 1469 O GLU A 102 -16.446 -9.636 -0.881 1.00 0.00 O ATOM 1470 CB GLU A 102 -15.241 -11.387 -3.459 1.00 0.00 C ATOM 1471 CG GLU A 102 -16.096 -12.339 -2.619 1.00 0.00 C ATOM 1472 CD GLU A 102 -17.477 -12.534 -3.248 1.00 0.00 C ATOM 1473 OE1 GLU A 102 -17.529 -13.187 -4.312 1.00 0.00 O ATOM 1474 OE2 GLU A 102 -18.450 -12.026 -2.649 1.00 0.00 O ATOM 0 H GLU A 102 -13.942 -9.496 -4.404 1.00 0.00 H new ATOM 0 HA GLU A 102 -16.500 -9.670 -3.393 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -15.467 -11.526 -4.516 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -14.186 -11.626 -3.325 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -15.594 -13.302 -2.530 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -16.205 -11.942 -1.610 1.00 0.00 H new ATOM 1481 N LEU A 103 -14.192 -9.736 -1.045 1.00 0.00 N ATOM 1482 CA LEU A 103 -13.970 -9.573 0.381 1.00 0.00 C ATOM 1483 C LEU A 103 -14.901 -8.484 0.918 1.00 0.00 C ATOM 1484 O LEU A 103 -15.576 -8.682 1.927 1.00 0.00 O ATOM 1485 CB LEU A 103 -12.489 -9.312 0.666 1.00 0.00 C ATOM 1486 CG LEU A 103 -11.510 -10.367 0.149 1.00 0.00 C ATOM 1487 CD1 LEU A 103 -10.063 -9.898 0.311 1.00 0.00 C ATOM 1488 CD2 LEU A 103 -11.754 -11.719 0.824 1.00 0.00 C ATOM 0 H LEU A 103 -13.342 -9.833 -1.601 1.00 0.00 H new ATOM 0 HA LEU A 103 -14.216 -10.492 0.912 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -12.220 -8.350 0.229 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -12.358 -9.221 1.744 1.00 0.00 H new ATOM 0 HG LEU A 103 -11.686 -10.503 -0.918 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -9.387 -10.667 -0.064 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -9.914 -8.977 -0.253 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -9.855 -9.716 1.365 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -11.045 -12.451 0.439 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -11.621 -11.617 1.901 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -12.770 -12.053 0.614 1.00 0.00 H new ATOM 1500 N PHE A 104 -14.907 -7.359 0.219 1.00 0.00 N ATOM 1501 CA PHE A 104 -15.744 -6.238 0.612 1.00 0.00 C ATOM 1502 C PHE A 104 -16.962 -6.114 -0.307 1.00 0.00 C ATOM 1503 O PHE A 104 -17.111 -5.119 -1.014 1.00 0.00 O ATOM 1504 CB PHE A 104 -14.891 -4.975 0.482 1.00 0.00 C ATOM 1505 CG PHE A 104 -13.445 -5.150 0.948 1.00 0.00 C ATOM 1506 CD1 PHE A 104 -13.126 -4.976 2.258 1.00 0.00 C ATOM 1507 CD2 PHE A 104 -12.477 -5.480 0.051 1.00 0.00 C ATOM 1508 CE1 PHE A 104 -11.784 -5.139 2.691 1.00 0.00 C ATOM 1509 CE2 PHE A 104 -11.134 -5.643 0.483 1.00 0.00 C ATOM 1510 CZ PHE A 104 -10.816 -5.469 1.794 1.00 0.00 C ATOM 0 H PHE A 104 -14.346 -7.199 -0.617 1.00 0.00 H new ATOM 0 HA PHE A 104 -16.104 -6.382 1.631 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -14.890 -4.655 -0.560 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -15.354 -4.175 1.060 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -13.894 -4.713 2.970 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -12.730 -5.618 -0.990 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -11.532 -5.001 3.732 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -10.365 -5.905 -0.229 1.00 0.00 H new ATOM 0 HZ PHE A 104 -9.795 -5.593 2.123 1.00 0.00 H new ATOM 1520 N MET A 105 -17.800 -7.139 -0.266 1.00 0.00 N ATOM 1521 CA MET A 105 -19.000 -7.157 -1.086 1.00 0.00 C ATOM 1522 C MET A 105 -20.254 -6.981 -0.227 1.00 0.00 C ATOM 1523 O MET A 105 -20.453 -7.709 0.743 1.00 0.00 O ATOM 1524 CB MET A 105 -19.081 -8.485 -1.842 1.00 0.00 C ATOM 1525 CG MET A 105 -19.265 -9.656 -0.875 1.00 0.00 C ATOM 1526 SD MET A 105 -20.938 -10.270 -0.970 1.00 0.00 S ATOM 1527 CE MET A 105 -20.834 -11.634 0.176 1.00 0.00 C ATOM 0 H MET A 105 -17.672 -7.963 0.322 1.00 0.00 H new ATOM 0 HA MET A 105 -18.948 -6.329 -1.793 1.00 0.00 H new ATOM 0 HB2 MET A 105 -19.912 -8.456 -2.546 1.00 0.00 H new ATOM 0 HB3 MET A 105 -18.173 -8.631 -2.427 1.00 0.00 H new ATOM 0 HG2 MET A 105 -18.562 -10.453 -1.118 1.00 0.00 H new ATOM 0 HG3 MET A 105 -19.044 -9.336 0.143 1.00 0.00 H new ATOM 0 HE1 MET A 105 -21.802 -12.132 0.237 1.00 0.00 H new ATOM 0 HE2 MET A 105 -20.082 -12.343 -0.170 1.00 0.00 H new ATOM 0 HE3 MET A 105 -20.555 -11.261 1.161 1.00 0.00 H new ATOM 1537 N THR A 106 -21.066 -6.009 -0.616 1.00 0.00 N ATOM 1538 CA THR A 106 -22.295 -5.728 0.106 1.00 0.00 C ATOM 1539 C THR A 106 -21.984 -5.296 1.540 1.00 0.00 C ATOM 1540 O THR A 106 -21.434 -6.072 2.320 1.00 0.00 O ATOM 1541 CB THR A 106 -23.187 -6.968 0.024 1.00 0.00 C ATOM 1542 OG1 THR A 106 -23.729 -6.920 -1.293 1.00 0.00 O ATOM 1543 CG2 THR A 106 -24.412 -6.871 0.935 1.00 0.00 C ATOM 0 H THR A 106 -20.897 -5.407 -1.421 1.00 0.00 H new ATOM 0 HA THR A 106 -22.834 -4.893 -0.342 1.00 0.00 H new ATOM 0 HB THR A 106 -22.606 -7.850 0.291 1.00 0.00 H new ATOM 0 HG1 THR A 106 -24.319 -7.690 -1.432 1.00 0.00 H new ATOM 0 HG21 THR A 106 -25.010 -7.777 0.838 1.00 0.00 H new ATOM 0 HG22 THR A 106 -24.088 -6.759 1.970 1.00 0.00 H new ATOM 0 HG23 THR A 106 -25.012 -6.007 0.647 1.00 0.00 H new ATOM 1551 N ASP A 107 -22.351 -4.060 1.845 1.00 0.00 N ATOM 1552 CA ASP A 107 -22.117 -3.517 3.172 1.00 0.00 C ATOM 1553 C ASP A 107 -23.006 -2.288 3.379 1.00 0.00 C ATOM 1554 O ASP A 107 -23.239 -1.522 2.445 1.00 0.00 O ATOM 1555 CB ASP A 107 -20.661 -3.080 3.341 1.00 0.00 C ATOM 1556 CG ASP A 107 -19.873 -3.851 4.402 1.00 0.00 C ATOM 1557 OD1 ASP A 107 -20.344 -3.865 5.559 1.00 0.00 O ATOM 1558 OD2 ASP A 107 -18.817 -4.408 4.031 1.00 0.00 O ATOM 0 H ASP A 107 -22.808 -3.420 1.196 1.00 0.00 H new ATOM 0 HA ASP A 107 -22.346 -4.296 3.900 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -20.152 -3.187 2.383 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -20.643 -2.020 3.595 1.00 0.00 H new ATOM 1563 N ARG A 108 -23.478 -2.139 4.608 1.00 0.00 N ATOM 1564 CA ARG A 108 -24.336 -1.017 4.949 1.00 0.00 C ATOM 1565 C ARG A 108 -23.823 -0.321 6.211 1.00 0.00 C ATOM 1566 O ARG A 108 -23.852 -0.896 7.298 1.00 0.00 O ATOM 1567 CB ARG A 108 -25.777 -1.476 5.179 1.00 0.00 C ATOM 1568 CG ARG A 108 -26.768 -0.358 4.847 1.00 0.00 C ATOM 1569 CD ARG A 108 -28.092 -0.562 5.586 1.00 0.00 C ATOM 1570 NE ARG A 108 -29.115 -1.092 4.657 1.00 0.00 N ATOM 1571 CZ ARG A 108 -29.282 -2.394 4.388 1.00 0.00 C ATOM 1572 NH1 ARG A 108 -28.494 -3.306 4.974 1.00 0.00 N ATOM 1573 NH2 ARG A 108 -30.236 -2.784 3.531 1.00 0.00 N ATOM 0 H ARG A 108 -23.283 -2.777 5.380 1.00 0.00 H new ATOM 0 HA ARG A 108 -24.318 -0.319 4.112 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -25.987 -2.349 4.561 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -25.904 -1.783 6.217 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -26.339 0.606 5.121 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -26.947 -0.333 3.772 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -27.951 -1.253 6.417 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -28.430 0.383 6.011 1.00 0.00 H new ATOM 0 HE ARG A 108 -29.731 -0.425 4.193 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -27.767 -3.009 5.625 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -28.621 -4.297 4.769 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -30.835 -2.090 3.084 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -30.363 -3.775 3.326 1.00 0.00 H new ATOM 1587 N SER A 109 -23.364 0.909 6.025 1.00 0.00 N ATOM 1588 CA SER A 109 -22.845 1.690 7.135 1.00 0.00 C ATOM 1589 C SER A 109 -23.740 2.905 7.383 1.00 0.00 C ATOM 1590 O SER A 109 -24.286 3.066 8.474 1.00 0.00 O ATOM 1591 CB SER A 109 -21.406 2.136 6.868 1.00 0.00 C ATOM 1592 OG SER A 109 -20.583 2.000 8.023 1.00 0.00 O ATOM 0 H SER A 109 -23.341 1.383 5.122 1.00 0.00 H new ATOM 0 HA SER A 109 -22.843 1.061 8.025 1.00 0.00 H new ATOM 0 HB2 SER A 109 -20.988 1.545 6.053 1.00 0.00 H new ATOM 0 HB3 SER A 109 -21.403 3.176 6.541 1.00 0.00 H new ATOM 0 HG SER A 109 -19.672 2.293 7.812 1.00 0.00 H new ATOM 1598 N GLY A 110 -23.865 3.729 6.353 1.00 0.00 N ATOM 1599 CA GLY A 110 -24.685 4.925 6.446 1.00 0.00 C ATOM 1600 C GLY A 110 -23.822 6.187 6.379 1.00 0.00 C ATOM 1601 O GLY A 110 -22.665 6.132 5.968 1.00 0.00 O ATOM 0 H GLY A 110 -23.412 3.592 5.449 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -25.414 4.935 5.635 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -25.247 4.913 7.380 1.00 0.00 H new ATOM 1605 N PRO A 111 -24.436 7.326 6.801 1.00 0.00 N ATOM 1606 CA PRO A 111 -23.738 8.600 6.793 1.00 0.00 C ATOM 1607 C PRO A 111 -22.728 8.678 7.939 1.00 0.00 C ATOM 1608 O PRO A 111 -22.651 7.772 8.767 1.00 0.00 O ATOM 1609 CB PRO A 111 -24.833 9.649 6.892 1.00 0.00 C ATOM 1610 CG PRO A 111 -26.060 8.923 7.419 1.00 0.00 C ATOM 1611 CD PRO A 111 -25.806 7.429 7.294 1.00 0.00 C ATOM 0 HA PRO A 111 -23.144 8.749 5.892 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -24.540 10.457 7.562 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -25.033 10.098 5.919 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -26.246 9.193 8.458 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -26.946 9.209 6.852 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -25.920 6.926 8.254 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -26.511 6.964 6.605 1.00 0.00 H new ATOM 1619 N SER A 112 -21.978 9.771 7.951 1.00 0.00 N ATOM 1620 CA SER A 112 -20.977 9.980 8.983 1.00 0.00 C ATOM 1621 C SER A 112 -20.670 11.473 9.120 1.00 0.00 C ATOM 1622 O SER A 112 -20.434 12.156 8.124 1.00 0.00 O ATOM 1623 CB SER A 112 -19.696 9.202 8.673 1.00 0.00 C ATOM 1624 OG SER A 112 -18.724 9.341 9.705 1.00 0.00 O ATOM 0 H SER A 112 -22.044 10.521 7.262 1.00 0.00 H new ATOM 0 HA SER A 112 -21.377 9.609 9.927 1.00 0.00 H new ATOM 0 HB2 SER A 112 -19.936 8.147 8.541 1.00 0.00 H new ATOM 0 HB3 SER A 112 -19.277 9.554 7.730 1.00 0.00 H new ATOM 0 HG SER A 112 -17.922 8.829 9.470 1.00 0.00 H new ATOM 1630 N SER A 113 -20.684 11.935 10.361 1.00 0.00 N ATOM 1631 CA SER A 113 -20.411 13.335 10.642 1.00 0.00 C ATOM 1632 C SER A 113 -19.034 13.718 10.097 1.00 0.00 C ATOM 1633 O SER A 113 -18.266 12.854 9.676 1.00 0.00 O ATOM 1634 CB SER A 113 -20.486 13.621 12.143 1.00 0.00 C ATOM 1635 OG SER A 113 -20.974 14.932 12.413 1.00 0.00 O ATOM 0 H SER A 113 -20.880 11.365 11.184 1.00 0.00 H new ATOM 0 HA SER A 113 -21.172 13.938 10.147 1.00 0.00 H new ATOM 0 HB2 SER A 113 -21.136 12.887 12.620 1.00 0.00 H new ATOM 0 HB3 SER A 113 -19.496 13.505 12.584 1.00 0.00 H new ATOM 0 HG SER A 113 -21.009 15.075 13.382 1.00 0.00 H new ATOM 1641 N GLY A 114 -18.763 15.015 10.122 1.00 0.00 N ATOM 1642 CA GLY A 114 -17.492 15.524 9.636 1.00 0.00 C ATOM 1643 C GLY A 114 -16.359 15.189 10.608 1.00 0.00 C ATOM 1644 O GLY A 114 -15.247 14.875 10.187 1.00 0.00 O ATOM 0 H GLY A 114 -19.402 15.729 10.471 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -17.275 15.096 8.657 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -17.555 16.604 9.504 1.00 0.00 H new TER 1648 GLY A 114