USER MOD reduce.3.24.130724 H: found=0, std=0, add=553, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 549 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 35 MET CE :methyl -179:sc= -0.182 (180deg=-0.184) USER MOD Set 1.2: A 55 LYS NZ :NH3+ -146:sc= 0.719 (180deg=0.11) USER MOD Single : A 2 SER OG : rot 180:sc= 0.028 USER MOD Single : A 4 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00451) USER MOD Single : A 5 ASN : amide:sc= 0.579 K(o=0.58,f=-4.5!) USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 LYS NZ :NH3+ -174:sc= 0.753 (180deg=0.734) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 20:sc= 0.982 USER MOD Single : A 25 SER OG : rot 47:sc= 1.09 USER MOD Single : A 28 SER OG : rot -27:sc= 0.0971 USER MOD Single : A 29 HIS : no HD1:sc= -0.101 X(o=-0.1,f=-0.0074) USER MOD Single : A 31 LYS NZ :NH3+ -169:sc= 1.51 (180deg=1.31) USER MOD Single : A 32 SER OG : rot 167:sc= 1.07 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= 0.814 K(o=0.81,f=-0.44) USER MOD Single : A 47 SER OG : rot 180:sc= 0.699 USER MOD Single : A 50 ASN : amide:sc= 0.513 K(o=0.51,f=-4.4!) USER MOD Single : A 51 LYS NZ :NH3+ -122:sc= 1.34 (180deg=0.145) USER MOD Single : A 52 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00421) USER MOD Single : A 60 GLN : amide:sc= 0.383 X(o=0.38,f=0) USER MOD Single : A 61 SER OG : rot -39:sc= 0.99 USER MOD Single : A 65 THR OG1 : rot 82:sc= 0.994 USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 HIS : no HE2:sc= 0.382 K(o=0.38,f=-1.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 -30.289 -2.876 -11.364 1.00 0.00 N ATOM 2 CA PRO A 1 -31.556 -3.658 -11.340 1.00 0.00 C ATOM 3 C PRO A 1 -32.814 -2.761 -11.350 1.00 0.00 C ATOM 4 O PRO A 1 -33.329 -2.466 -12.429 1.00 0.00 O ATOM 5 CB PRO A 1 -31.466 -4.651 -10.161 1.00 0.00 C ATOM 6 CG PRO A 1 -30.309 -4.123 -9.308 1.00 0.00 C ATOM 7 CD PRO A 1 -29.401 -3.542 -10.386 1.00 0.00 C ATOM 0 H2 PRO A 1 -30.453 -1.902 -11.109 1.00 0.00 H new ATOM 0 H3 PRO A 1 -29.875 -2.875 -12.296 1.00 0.00 H new ATOM 0 HA PRO A 1 -31.674 -4.232 -12.259 1.00 0.00 H new ATOM 0 HB2 PRO A 1 -32.397 -4.681 -9.594 1.00 0.00 H new ATOM 0 HB3 PRO A 1 -31.272 -5.666 -10.509 1.00 0.00 H new ATOM 0 HG2 PRO A 1 -30.635 -3.369 -8.591 1.00 0.00 H new ATOM 0 HG3 PRO A 1 -29.821 -4.914 -8.739 1.00 0.00 H new ATOM 0 HD2 PRO A 1 -28.694 -2.832 -9.957 1.00 0.00 H new ATOM 0 HD3 PRO A 1 -28.815 -4.326 -10.865 1.00 0.00 H new ATOM 15 N SER A 2 -33.296 -2.297 -10.185 1.00 0.00 N ATOM 16 CA SER A 2 -34.567 -1.549 -10.037 1.00 0.00 C ATOM 17 C SER A 2 -34.472 -0.400 -9.019 1.00 0.00 C ATOM 18 O SER A 2 -34.618 0.764 -9.394 1.00 0.00 O ATOM 19 CB SER A 2 -35.694 -2.517 -9.644 1.00 0.00 C ATOM 20 OG SER A 2 -35.340 -3.277 -8.494 1.00 0.00 O ATOM 0 H SER A 2 -32.808 -2.431 -9.300 1.00 0.00 H new ATOM 0 HA SER A 2 -34.786 -1.092 -11.002 1.00 0.00 H new ATOM 0 HB2 SER A 2 -36.607 -1.955 -9.446 1.00 0.00 H new ATOM 0 HB3 SER A 2 -35.907 -3.188 -10.476 1.00 0.00 H new ATOM 0 HG SER A 2 -36.075 -3.884 -8.264 1.00 0.00 H new ATOM 26 N GLY A 3 -34.128 -0.702 -7.759 1.00 0.00 N ATOM 27 CA GLY A 3 -33.767 0.282 -6.722 1.00 0.00 C ATOM 28 C GLY A 3 -32.469 1.054 -7.022 1.00 0.00 C ATOM 29 O GLY A 3 -32.234 2.127 -6.460 1.00 0.00 O ATOM 0 H GLY A 3 -34.091 -1.664 -7.421 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -34.585 0.994 -6.610 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -33.660 -0.233 -5.767 1.00 0.00 H new ATOM 33 N LYS A 4 -31.661 0.531 -7.957 1.00 0.00 N ATOM 34 CA LYS A 4 -30.519 1.181 -8.622 1.00 0.00 C ATOM 35 C LYS A 4 -30.638 0.940 -10.133 1.00 0.00 C ATOM 36 O LYS A 4 -30.289 -0.136 -10.624 1.00 0.00 O ATOM 37 CB LYS A 4 -29.180 0.662 -8.056 1.00 0.00 C ATOM 38 CG LYS A 4 -29.015 0.954 -6.553 1.00 0.00 C ATOM 39 CD LYS A 4 -27.621 0.583 -6.019 1.00 0.00 C ATOM 40 CE LYS A 4 -26.492 1.508 -6.508 1.00 0.00 C ATOM 41 NZ LYS A 4 -26.581 2.874 -5.921 1.00 0.00 N ATOM 0 H LYS A 4 -31.797 -0.423 -8.292 1.00 0.00 H new ATOM 0 HA LYS A 4 -30.536 2.254 -8.431 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -29.113 -0.413 -8.222 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -28.357 1.121 -8.603 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -29.197 2.013 -6.372 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -29.771 0.401 -5.996 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -27.645 0.602 -4.929 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -27.391 -0.440 -6.315 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -25.529 1.068 -6.251 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -26.530 1.580 -7.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -25.780 3.448 -6.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -27.473 3.321 -6.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -26.552 2.809 -4.883 1.00 0.00 H new ATOM 55 N ASN A 5 -31.225 1.895 -10.851 1.00 0.00 N ATOM 56 CA ASN A 5 -31.513 1.826 -12.291 1.00 0.00 C ATOM 57 C ASN A 5 -31.552 3.257 -12.868 1.00 0.00 C ATOM 58 O ASN A 5 -32.227 4.105 -12.279 1.00 0.00 O ATOM 59 CB ASN A 5 -32.871 1.110 -12.464 1.00 0.00 C ATOM 60 CG ASN A 5 -33.300 0.946 -13.914 1.00 0.00 C ATOM 61 OD1 ASN A 5 -33.405 1.902 -14.665 1.00 0.00 O ATOM 62 ND2 ASN A 5 -33.567 -0.257 -14.363 1.00 0.00 N ATOM 0 H ASN A 5 -31.527 2.775 -10.433 1.00 0.00 H new ATOM 0 HA ASN A 5 -30.743 1.271 -12.827 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -32.814 0.126 -11.999 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -33.637 1.671 -11.930 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -33.859 -0.387 -15.332 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -33.482 -1.063 -13.744 1.00 0.00 H new ATOM 69 N PRO A 6 -30.886 3.565 -13.998 1.00 0.00 N ATOM 70 CA PRO A 6 -30.815 4.940 -14.492 1.00 0.00 C ATOM 71 C PRO A 6 -32.163 5.495 -14.947 1.00 0.00 C ATOM 72 O PRO A 6 -32.436 6.673 -14.692 1.00 0.00 O ATOM 73 CB PRO A 6 -29.806 4.926 -15.651 1.00 0.00 C ATOM 74 CG PRO A 6 -29.877 3.483 -16.137 1.00 0.00 C ATOM 75 CD PRO A 6 -30.112 2.680 -14.858 1.00 0.00 C ATOM 0 HA PRO A 6 -30.504 5.602 -13.684 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -30.080 5.632 -16.435 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -28.803 5.193 -15.318 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -30.687 3.341 -16.853 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -28.955 3.182 -16.635 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -30.653 1.757 -15.065 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -29.169 2.398 -14.389 1.00 0.00 H new ATOM 83 N VAL A 7 -33.019 4.653 -15.553 1.00 0.00 N ATOM 84 CA VAL A 7 -34.384 5.050 -15.931 1.00 0.00 C ATOM 85 C VAL A 7 -35.087 5.604 -14.714 1.00 0.00 C ATOM 86 O VAL A 7 -35.584 6.714 -14.758 1.00 0.00 O ATOM 87 CB VAL A 7 -35.253 3.930 -16.543 1.00 0.00 C ATOM 88 CG1 VAL A 7 -36.700 4.369 -16.787 1.00 0.00 C ATOM 89 CG2 VAL A 7 -34.543 3.274 -17.710 1.00 0.00 C ATOM 0 H VAL A 7 -32.786 3.689 -15.792 1.00 0.00 H new ATOM 0 HA VAL A 7 -34.265 5.794 -16.719 1.00 0.00 H new ATOM 0 HB VAL A 7 -35.372 3.133 -15.809 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -37.264 3.541 -17.218 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -37.155 4.664 -15.842 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -36.713 5.214 -17.475 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -35.174 2.488 -18.125 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -34.340 4.020 -18.478 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -33.603 2.841 -17.367 1.00 0.00 H new ATOM 99 N MET A 8 -35.072 4.856 -13.616 1.00 0.00 N ATOM 100 CA MET A 8 -35.743 5.212 -12.374 1.00 0.00 C ATOM 101 C MET A 8 -35.344 6.590 -11.822 1.00 0.00 C ATOM 102 O MET A 8 -36.216 7.398 -11.508 1.00 0.00 O ATOM 103 CB MET A 8 -35.477 4.078 -11.386 1.00 0.00 C ATOM 104 CG MET A 8 -36.479 4.118 -10.234 1.00 0.00 C ATOM 105 SD MET A 8 -36.107 5.294 -8.899 1.00 0.00 S ATOM 106 CE MET A 8 -37.734 5.385 -8.100 1.00 0.00 C ATOM 0 H MET A 8 -34.580 3.964 -13.565 1.00 0.00 H new ATOM 0 HA MET A 8 -36.812 5.320 -12.557 1.00 0.00 H new ATOM 0 HB2 MET A 8 -35.544 3.119 -11.899 1.00 0.00 H new ATOM 0 HB3 MET A 8 -34.463 4.160 -10.995 1.00 0.00 H new ATOM 0 HG2 MET A 8 -37.461 4.359 -10.641 1.00 0.00 H new ATOM 0 HG3 MET A 8 -36.548 3.119 -9.803 1.00 0.00 H new ATOM 0 HE1 MET A 8 -37.686 6.069 -7.253 1.00 0.00 H new ATOM 0 HE2 MET A 8 -38.472 5.746 -8.817 1.00 0.00 H new ATOM 0 HE3 MET A 8 -38.023 4.394 -7.750 1.00 0.00 H new ATOM 116 N ILE A 9 -34.042 6.880 -11.727 1.00 0.00 N ATOM 117 CA ILE A 9 -33.512 8.200 -11.330 1.00 0.00 C ATOM 118 C ILE A 9 -34.055 9.312 -12.229 1.00 0.00 C ATOM 119 O ILE A 9 -34.692 10.249 -11.750 1.00 0.00 O ATOM 120 CB ILE A 9 -31.968 8.247 -11.330 1.00 0.00 C ATOM 121 CG1 ILE A 9 -31.343 7.026 -10.639 1.00 0.00 C ATOM 122 CG2 ILE A 9 -31.482 9.543 -10.650 1.00 0.00 C ATOM 123 CD1 ILE A 9 -29.871 6.858 -11.022 1.00 0.00 C ATOM 0 H ILE A 9 -33.311 6.197 -11.926 1.00 0.00 H new ATOM 0 HA ILE A 9 -33.853 8.363 -10.308 1.00 0.00 H new ATOM 0 HB ILE A 9 -31.644 8.230 -12.371 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -31.429 7.135 -9.558 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -31.896 6.128 -10.914 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -30.392 9.569 -10.654 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -31.868 10.406 -11.193 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -31.842 9.571 -9.622 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -29.461 5.985 -10.515 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -29.789 6.724 -12.101 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -29.314 7.746 -10.724 1.00 0.00 H new ATOM 135 N LEU A 10 -33.811 9.194 -13.538 1.00 0.00 N ATOM 136 CA LEU A 10 -34.254 10.156 -14.556 1.00 0.00 C ATOM 137 C LEU A 10 -35.771 10.383 -14.498 1.00 0.00 C ATOM 138 O LEU A 10 -36.259 11.516 -14.479 1.00 0.00 O ATOM 139 CB LEU A 10 -33.679 9.636 -15.898 1.00 0.00 C ATOM 140 CG LEU A 10 -34.378 9.699 -17.259 1.00 0.00 C ATOM 141 CD1 LEU A 10 -35.415 8.597 -17.461 1.00 0.00 C ATOM 142 CD2 LEU A 10 -34.885 11.064 -17.650 1.00 0.00 C ATOM 0 H LEU A 10 -33.289 8.410 -13.929 1.00 0.00 H new ATOM 0 HA LEU A 10 -33.876 11.165 -14.394 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -32.728 10.152 -16.031 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -33.450 8.583 -15.733 1.00 0.00 H new ATOM 0 HG LEU A 10 -33.578 9.495 -17.971 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -35.871 8.702 -18.446 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -34.930 7.623 -17.388 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -36.185 8.677 -16.694 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -35.364 11.008 -18.628 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -35.608 11.409 -16.911 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -34.050 11.763 -17.695 1.00 0.00 H new ATOM 154 N ASN A 11 -36.492 9.275 -14.410 1.00 0.00 N ATOM 155 CA ASN A 11 -37.947 9.197 -14.295 1.00 0.00 C ATOM 156 C ASN A 11 -38.483 9.999 -13.105 1.00 0.00 C ATOM 157 O ASN A 11 -39.362 10.843 -13.245 1.00 0.00 O ATOM 158 CB ASN A 11 -38.307 7.713 -14.188 1.00 0.00 C ATOM 159 CG ASN A 11 -39.767 7.453 -13.860 1.00 0.00 C ATOM 160 OD1 ASN A 11 -40.634 7.456 -14.723 1.00 0.00 O ATOM 161 ND2 ASN A 11 -40.087 7.213 -12.607 1.00 0.00 N ATOM 0 H ASN A 11 -36.056 8.353 -14.417 1.00 0.00 H new ATOM 0 HA ASN A 11 -38.415 9.645 -15.171 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -38.064 7.222 -15.130 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -37.685 7.253 -13.420 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -41.058 7.029 -12.355 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -39.364 7.210 -11.887 1.00 0.00 H new ATOM 168 N GLU A 12 -37.990 9.664 -11.915 1.00 0.00 N ATOM 169 CA GLU A 12 -38.268 10.344 -10.658 1.00 0.00 C ATOM 170 C GLU A 12 -37.939 11.849 -10.697 1.00 0.00 C ATOM 171 O GLU A 12 -38.787 12.682 -10.370 1.00 0.00 O ATOM 172 CB GLU A 12 -37.527 9.571 -9.564 1.00 0.00 C ATOM 173 CG GLU A 12 -37.688 10.153 -8.154 1.00 0.00 C ATOM 174 CD GLU A 12 -39.158 10.101 -7.685 1.00 0.00 C ATOM 175 OE1 GLU A 12 -39.924 11.058 -7.960 1.00 0.00 O ATOM 176 OE2 GLU A 12 -39.565 9.091 -7.064 1.00 0.00 O ATOM 0 H GLU A 12 -37.356 8.873 -11.798 1.00 0.00 H new ATOM 0 HA GLU A 12 -39.338 10.338 -10.448 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -37.882 8.540 -9.561 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -36.466 9.542 -9.812 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -37.062 9.597 -7.456 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -37.338 11.185 -8.143 1.00 0.00 H new ATOM 183 N LEU A 13 -36.708 12.199 -11.094 1.00 0.00 N ATOM 184 CA LEU A 13 -36.229 13.580 -11.240 1.00 0.00 C ATOM 185 C LEU A 13 -37.103 14.437 -12.173 1.00 0.00 C ATOM 186 O LEU A 13 -37.260 15.634 -11.921 1.00 0.00 O ATOM 187 CB LEU A 13 -34.758 13.600 -11.702 1.00 0.00 C ATOM 188 CG LEU A 13 -33.665 13.149 -10.699 1.00 0.00 C ATOM 189 CD1 LEU A 13 -32.656 14.279 -10.473 1.00 0.00 C ATOM 190 CD2 LEU A 13 -34.118 12.698 -9.305 1.00 0.00 C ATOM 0 H LEU A 13 -35.996 11.507 -11.330 1.00 0.00 H new ATOM 0 HA LEU A 13 -36.303 14.034 -10.252 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -34.679 12.967 -12.586 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -34.522 14.617 -12.015 1.00 0.00 H new ATOM 0 HG LEU A 13 -33.255 12.267 -11.191 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -31.894 13.950 -9.767 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -32.185 14.541 -11.420 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -33.171 15.151 -10.071 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -33.248 12.412 -8.714 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -34.640 13.517 -8.809 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -34.789 11.844 -9.399 1.00 0.00 H new ATOM 202 N ARG A 14 -37.662 13.828 -13.236 1.00 0.00 N ATOM 203 CA ARG A 14 -38.552 14.438 -14.251 1.00 0.00 C ATOM 204 C ARG A 14 -38.221 15.907 -14.624 1.00 0.00 C ATOM 205 O ARG A 14 -39.100 16.765 -14.515 1.00 0.00 O ATOM 206 CB ARG A 14 -40.030 14.187 -13.858 1.00 0.00 C ATOM 207 CG ARG A 14 -40.525 14.879 -12.570 1.00 0.00 C ATOM 208 CD ARG A 14 -41.808 14.245 -12.018 1.00 0.00 C ATOM 209 NE ARG A 14 -41.515 13.087 -11.148 1.00 0.00 N ATOM 210 CZ ARG A 14 -42.355 12.150 -10.753 1.00 0.00 C ATOM 211 NH1 ARG A 14 -43.569 12.063 -11.225 1.00 0.00 N ATOM 212 NH2 ARG A 14 -42.001 11.280 -9.851 1.00 0.00 N ATOM 0 H ARG A 14 -37.497 12.839 -13.423 1.00 0.00 H new ATOM 0 HA ARG A 14 -38.363 13.932 -15.198 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -40.663 14.511 -14.684 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -40.176 13.113 -13.746 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -39.744 14.829 -11.812 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -40.704 15.935 -12.774 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -42.369 14.991 -11.455 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -42.442 13.927 -12.846 1.00 0.00 H new ATOM 0 HE ARG A 14 -40.554 13.003 -10.815 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -43.894 12.733 -11.922 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -44.192 11.325 -10.897 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -41.067 11.319 -9.443 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -42.658 10.559 -9.552 1.00 0.00 H new ATOM 226 N PRO A 15 -36.973 16.238 -15.034 1.00 0.00 N ATOM 227 CA PRO A 15 -36.472 17.620 -15.171 1.00 0.00 C ATOM 228 C PRO A 15 -37.033 18.410 -16.384 1.00 0.00 C ATOM 229 O PRO A 15 -36.293 18.865 -17.259 1.00 0.00 O ATOM 230 CB PRO A 15 -34.941 17.479 -15.164 1.00 0.00 C ATOM 231 CG PRO A 15 -34.714 16.115 -15.808 1.00 0.00 C ATOM 232 CD PRO A 15 -35.873 15.298 -15.251 1.00 0.00 C ATOM 0 HA PRO A 15 -36.826 18.243 -14.350 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -34.461 18.277 -15.730 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -34.538 17.519 -14.152 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -34.740 16.169 -16.896 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -33.748 15.691 -15.533 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -36.165 14.512 -15.948 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -35.591 14.808 -14.319 1.00 0.00 H new ATOM 240 N GLY A 16 -38.358 18.568 -16.463 1.00 0.00 N ATOM 241 CA GLY A 16 -39.068 19.324 -17.507 1.00 0.00 C ATOM 242 C GLY A 16 -39.099 18.647 -18.886 1.00 0.00 C ATOM 243 O GLY A 16 -39.318 19.322 -19.894 1.00 0.00 O ATOM 0 H GLY A 16 -38.992 18.158 -15.777 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -40.093 19.494 -17.179 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -38.599 20.303 -17.609 1.00 0.00 H new ATOM 247 N LEU A 17 -38.834 17.336 -18.951 1.00 0.00 N ATOM 248 CA LEU A 17 -38.662 16.582 -20.182 1.00 0.00 C ATOM 249 C LEU A 17 -39.967 16.136 -20.872 1.00 0.00 C ATOM 250 O LEU A 17 -41.070 16.241 -20.327 1.00 0.00 O ATOM 251 CB LEU A 17 -37.707 15.411 -19.900 1.00 0.00 C ATOM 252 CG LEU A 17 -37.995 14.550 -18.662 1.00 0.00 C ATOM 253 CD1 LEU A 17 -39.314 13.787 -18.719 1.00 0.00 C ATOM 254 CD2 LEU A 17 -36.859 13.555 -18.547 1.00 0.00 C ATOM 0 H LEU A 17 -38.732 16.759 -18.116 1.00 0.00 H new ATOM 0 HA LEU A 17 -38.227 17.256 -20.920 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -37.707 14.758 -20.773 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -36.699 15.814 -19.804 1.00 0.00 H new ATOM 0 HG LEU A 17 -38.076 15.217 -17.804 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -39.438 13.205 -17.806 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -40.139 14.493 -18.814 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -39.310 13.116 -19.578 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -37.020 12.918 -17.677 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -36.822 12.940 -19.446 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -35.916 14.090 -18.435 1.00 0.00 H new ATOM 266 N LYS A 18 -39.793 15.554 -22.062 1.00 0.00 N ATOM 267 CA LYS A 18 -40.720 14.644 -22.748 1.00 0.00 C ATOM 268 C LYS A 18 -39.965 13.449 -23.315 1.00 0.00 C ATOM 269 O LYS A 18 -38.841 13.613 -23.803 1.00 0.00 O ATOM 270 CB LYS A 18 -41.567 15.314 -23.843 1.00 0.00 C ATOM 271 CG LYS A 18 -40.783 15.881 -25.040 1.00 0.00 C ATOM 272 CD LYS A 18 -41.745 16.365 -26.136 1.00 0.00 C ATOM 273 CE LYS A 18 -41.016 16.889 -27.383 1.00 0.00 C ATOM 274 NZ LYS A 18 -40.447 15.793 -28.213 1.00 0.00 N ATOM 0 H LYS A 18 -38.947 15.715 -22.609 1.00 0.00 H new ATOM 0 HA LYS A 18 -41.428 14.311 -21.989 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -42.287 14.586 -24.216 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -42.138 16.124 -23.390 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -40.153 16.707 -24.711 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -40.120 15.116 -25.443 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -42.402 15.544 -26.424 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -42.379 17.155 -25.733 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -41.710 17.475 -27.986 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -40.215 17.561 -27.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -39.881 16.200 -28.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -39.842 15.188 -27.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -41.220 15.224 -28.614 1.00 0.00 H new ATOM 288 N TYR A 19 -40.605 12.279 -23.259 1.00 0.00 N ATOM 289 CA TYR A 19 -40.107 11.057 -23.884 1.00 0.00 C ATOM 290 C TYR A 19 -40.906 10.770 -25.159 1.00 0.00 C ATOM 291 O TYR A 19 -42.139 10.745 -25.175 1.00 0.00 O ATOM 292 CB TYR A 19 -40.231 9.837 -22.958 1.00 0.00 C ATOM 293 CG TYR A 19 -39.666 9.982 -21.569 1.00 0.00 C ATOM 294 CD1 TYR A 19 -38.323 9.655 -21.328 1.00 0.00 C ATOM 295 CD2 TYR A 19 -40.498 10.391 -20.511 1.00 0.00 C ATOM 296 CE1 TYR A 19 -37.785 9.797 -20.041 1.00 0.00 C ATOM 297 CE2 TYR A 19 -39.971 10.509 -19.213 1.00 0.00 C ATOM 298 CZ TYR A 19 -38.610 10.234 -18.978 1.00 0.00 C ATOM 299 OH TYR A 19 -38.116 10.395 -17.727 1.00 0.00 O ATOM 0 H TYR A 19 -41.493 12.155 -22.773 1.00 0.00 H new ATOM 0 HA TYR A 19 -39.052 11.218 -24.106 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -41.287 9.582 -22.871 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -39.738 8.993 -23.440 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -37.703 9.293 -22.135 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -41.539 10.614 -20.695 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -36.744 9.573 -19.862 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -40.610 10.811 -18.396 1.00 0.00 H new ATOM 0 HH TYR A 19 -38.830 10.702 -17.130 1.00 0.00 H new ATOM 309 N ASP A 20 -40.158 10.536 -26.226 1.00 0.00 N ATOM 310 CA ASP A 20 -40.605 10.186 -27.568 1.00 0.00 C ATOM 311 C ASP A 20 -40.212 8.731 -27.847 1.00 0.00 C ATOM 312 O ASP A 20 -39.088 8.318 -27.543 1.00 0.00 O ATOM 313 CB ASP A 20 -39.938 11.119 -28.589 1.00 0.00 C ATOM 314 CG ASP A 20 -40.198 12.605 -28.301 1.00 0.00 C ATOM 315 OD1 ASP A 20 -41.313 13.103 -28.589 1.00 0.00 O ATOM 316 OD2 ASP A 20 -39.281 13.312 -27.819 1.00 0.00 O ATOM 0 H ASP A 20 -39.141 10.590 -26.173 1.00 0.00 H new ATOM 0 HA ASP A 20 -41.686 10.296 -27.648 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -38.863 10.937 -28.591 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -40.304 10.878 -29.587 1.00 0.00 H new ATOM 321 N PHE A 21 -41.133 7.949 -28.413 1.00 0.00 N ATOM 322 CA PHE A 21 -40.937 6.521 -28.666 1.00 0.00 C ATOM 323 C PHE A 21 -40.800 6.224 -30.165 1.00 0.00 C ATOM 324 O PHE A 21 -41.619 6.605 -31.006 1.00 0.00 O ATOM 325 CB PHE A 21 -42.058 5.730 -27.982 1.00 0.00 C ATOM 326 CG PHE A 21 -42.038 4.232 -28.236 1.00 0.00 C ATOM 327 CD1 PHE A 21 -40.829 3.508 -28.202 1.00 0.00 C ATOM 328 CD2 PHE A 21 -43.241 3.557 -28.511 1.00 0.00 C ATOM 329 CE1 PHE A 21 -40.821 2.132 -28.475 1.00 0.00 C ATOM 330 CE2 PHE A 21 -43.233 2.175 -28.776 1.00 0.00 C ATOM 331 CZ PHE A 21 -42.021 1.463 -28.771 1.00 0.00 C ATOM 0 H PHE A 21 -42.046 8.293 -28.712 1.00 0.00 H new ATOM 0 HA PHE A 21 -39.992 6.197 -28.230 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -41.999 5.901 -26.907 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -43.017 6.127 -28.316 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -39.905 4.015 -27.965 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -44.174 4.101 -28.519 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -39.890 1.585 -28.458 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -44.160 1.661 -28.984 1.00 0.00 H new ATOM 0 HZ PHE A 21 -42.012 0.406 -28.994 1.00 0.00 H new ATOM 341 N LEU A 22 -39.691 5.554 -30.456 1.00 0.00 N ATOM 342 CA LEU A 22 -39.104 5.182 -31.727 1.00 0.00 C ATOM 343 C LEU A 22 -38.678 3.706 -31.578 1.00 0.00 C ATOM 344 O LEU A 22 -38.545 3.177 -30.476 1.00 0.00 O ATOM 345 CB LEU A 22 -37.892 6.082 -32.080 1.00 0.00 C ATOM 346 CG LEU A 22 -38.014 7.618 -32.008 1.00 0.00 C ATOM 347 CD1 LEU A 22 -37.891 8.196 -30.602 1.00 0.00 C ATOM 348 CD2 LEU A 22 -36.863 8.269 -32.783 1.00 0.00 C ATOM 0 H LEU A 22 -39.105 5.214 -29.693 1.00 0.00 H new ATOM 0 HA LEU A 22 -39.816 5.312 -32.542 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -37.073 5.792 -31.422 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -37.588 5.830 -33.096 1.00 0.00 H new ATOM 0 HG LEU A 22 -39.005 7.827 -32.410 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -37.989 9.281 -30.645 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -38.678 7.785 -29.970 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -36.918 7.935 -30.185 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -36.955 9.354 -32.728 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -35.912 7.963 -32.347 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -36.902 7.954 -33.826 1.00 0.00 H new ATOM 360 N SER A 23 -38.542 2.972 -32.669 1.00 0.00 N ATOM 361 CA SER A 23 -37.933 1.633 -32.662 1.00 0.00 C ATOM 362 C SER A 23 -37.247 1.362 -33.994 1.00 0.00 C ATOM 363 O SER A 23 -37.934 1.042 -34.965 1.00 0.00 O ATOM 364 CB SER A 23 -38.994 0.563 -32.365 1.00 0.00 C ATOM 365 OG SER A 23 -39.362 0.572 -31.000 1.00 0.00 O ATOM 0 H SER A 23 -38.848 3.280 -33.592 1.00 0.00 H new ATOM 0 HA SER A 23 -37.181 1.592 -31.874 1.00 0.00 H new ATOM 0 HB2 SER A 23 -39.875 0.739 -32.983 1.00 0.00 H new ATOM 0 HB3 SER A 23 -38.608 -0.420 -32.634 1.00 0.00 H new ATOM 0 HG SER A 23 -39.117 1.433 -30.601 1.00 0.00 H new ATOM 371 N GLU A 24 -35.909 1.474 -34.054 1.00 0.00 N ATOM 372 CA GLU A 24 -35.198 1.334 -35.341 1.00 0.00 C ATOM 373 C GLU A 24 -33.669 1.105 -35.369 1.00 0.00 C ATOM 374 O GLU A 24 -33.136 0.687 -36.399 1.00 0.00 O ATOM 375 CB GLU A 24 -35.580 2.452 -36.348 1.00 0.00 C ATOM 376 CG GLU A 24 -34.680 3.699 -36.390 1.00 0.00 C ATOM 377 CD GLU A 24 -34.487 4.375 -35.021 1.00 0.00 C ATOM 378 OE1 GLU A 24 -35.497 4.691 -34.351 1.00 0.00 O ATOM 379 OE2 GLU A 24 -33.316 4.594 -34.625 1.00 0.00 O ATOM 0 H GLU A 24 -35.309 1.656 -33.250 1.00 0.00 H new ATOM 0 HA GLU A 24 -35.580 0.358 -35.640 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -35.599 2.015 -37.346 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -36.596 2.776 -36.123 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -33.704 3.418 -36.786 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -35.109 4.422 -37.084 1.00 0.00 H new ATOM 386 N SER A 25 -32.940 1.390 -34.287 1.00 0.00 N ATOM 387 CA SER A 25 -31.459 1.433 -34.237 1.00 0.00 C ATOM 388 C SER A 25 -30.734 0.061 -34.300 1.00 0.00 C ATOM 389 O SER A 25 -29.722 -0.139 -33.623 1.00 0.00 O ATOM 390 CB SER A 25 -31.055 2.248 -32.993 1.00 0.00 C ATOM 391 OG SER A 25 -31.065 3.639 -33.279 1.00 0.00 O ATOM 0 H SER A 25 -33.369 1.606 -33.387 1.00 0.00 H new ATOM 0 HA SER A 25 -31.121 1.913 -35.155 1.00 0.00 H new ATOM 0 HB2 SER A 25 -31.742 2.035 -32.174 1.00 0.00 H new ATOM 0 HB3 SER A 25 -30.061 1.947 -32.662 1.00 0.00 H new ATOM 0 HG SER A 25 -31.892 3.870 -33.751 1.00 0.00 H new ATOM 397 N GLY A 26 -31.254 -0.929 -35.043 1.00 0.00 N ATOM 398 CA GLY A 26 -30.693 -2.290 -35.030 1.00 0.00 C ATOM 399 C GLY A 26 -31.401 -3.375 -35.845 1.00 0.00 C ATOM 400 O GLY A 26 -31.324 -4.540 -35.462 1.00 0.00 O ATOM 0 H GLY A 26 -32.059 -0.813 -35.658 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -29.663 -2.228 -35.382 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -30.656 -2.624 -33.993 1.00 0.00 H new ATOM 404 N GLU A 27 -32.110 -3.046 -36.929 1.00 0.00 N ATOM 405 CA GLU A 27 -32.935 -4.024 -37.671 1.00 0.00 C ATOM 406 C GLU A 27 -32.142 -5.210 -38.256 1.00 0.00 C ATOM 407 O GLU A 27 -32.632 -6.340 -38.275 1.00 0.00 O ATOM 408 CB GLU A 27 -33.703 -3.340 -38.816 1.00 0.00 C ATOM 409 CG GLU A 27 -34.478 -2.079 -38.416 1.00 0.00 C ATOM 410 CD GLU A 27 -35.402 -2.315 -37.213 1.00 0.00 C ATOM 411 OE1 GLU A 27 -36.537 -2.817 -37.390 1.00 0.00 O ATOM 412 OE2 GLU A 27 -35.019 -1.973 -36.068 1.00 0.00 O ATOM 0 H GLU A 27 -32.133 -2.104 -37.320 1.00 0.00 H new ATOM 0 HA GLU A 27 -33.621 -4.427 -36.926 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -32.995 -3.079 -39.602 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -34.403 -4.058 -39.243 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -33.773 -1.283 -38.178 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -35.071 -1.736 -39.264 1.00 0.00 H new ATOM 419 N SER A 28 -30.901 -4.968 -38.696 1.00 0.00 N ATOM 420 CA SER A 28 -29.978 -5.992 -39.226 1.00 0.00 C ATOM 421 C SER A 28 -29.414 -6.939 -38.140 1.00 0.00 C ATOM 422 O SER A 28 -28.744 -7.925 -38.454 1.00 0.00 O ATOM 423 CB SER A 28 -28.855 -5.280 -39.997 1.00 0.00 C ATOM 424 OG SER A 28 -28.065 -6.177 -40.767 1.00 0.00 O ATOM 0 H SER A 28 -30.496 -4.032 -38.695 1.00 0.00 H new ATOM 0 HA SER A 28 -30.540 -6.643 -39.895 1.00 0.00 H new ATOM 0 HB2 SER A 28 -29.291 -4.529 -40.656 1.00 0.00 H new ATOM 0 HB3 SER A 28 -28.214 -4.751 -39.292 1.00 0.00 H new ATOM 0 HG SER A 28 -28.082 -7.065 -40.354 1.00 0.00 H new ATOM 430 N HIS A 29 -29.700 -6.661 -36.863 1.00 0.00 N ATOM 431 CA HIS A 29 -29.349 -7.458 -35.681 1.00 0.00 C ATOM 432 C HIS A 29 -30.494 -7.381 -34.647 1.00 0.00 C ATOM 433 O HIS A 29 -30.299 -6.969 -33.500 1.00 0.00 O ATOM 434 CB HIS A 29 -27.968 -7.023 -35.145 1.00 0.00 C ATOM 435 CG HIS A 29 -27.773 -5.539 -34.926 1.00 0.00 C ATOM 436 ND1 HIS A 29 -27.292 -4.633 -35.849 1.00 0.00 N ATOM 437 CD2 HIS A 29 -27.937 -4.856 -33.749 1.00 0.00 C ATOM 438 CE1 HIS A 29 -27.176 -3.437 -35.248 1.00 0.00 C ATOM 439 NE2 HIS A 29 -27.564 -3.521 -33.962 1.00 0.00 N ATOM 0 H HIS A 29 -30.217 -5.818 -36.611 1.00 0.00 H new ATOM 0 HA HIS A 29 -29.245 -8.513 -35.936 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -27.791 -7.535 -34.199 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -27.205 -7.369 -35.842 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -28.292 -5.274 -32.818 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -26.822 -2.537 -35.728 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -27.583 -2.764 -33.278 1.00 0.00 H new ATOM 447 N ALA A 30 -31.721 -7.681 -35.100 1.00 0.00 N ATOM 448 CA ALA A 30 -32.994 -7.323 -34.461 1.00 0.00 C ATOM 449 C ALA A 30 -33.087 -7.624 -32.941 1.00 0.00 C ATOM 450 O ALA A 30 -32.610 -8.663 -32.478 1.00 0.00 O ATOM 451 CB ALA A 30 -34.125 -8.015 -35.232 1.00 0.00 C ATOM 0 H ALA A 30 -31.858 -8.205 -35.964 1.00 0.00 H new ATOM 0 HA ALA A 30 -33.079 -6.237 -34.512 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -35.083 -7.764 -34.776 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -34.118 -7.678 -36.269 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -33.980 -9.095 -35.200 1.00 0.00 H new ATOM 457 N LYS A 31 -33.709 -6.766 -32.116 1.00 0.00 N ATOM 458 CA LYS A 31 -34.458 -5.527 -32.424 1.00 0.00 C ATOM 459 C LYS A 31 -34.077 -4.404 -31.452 1.00 0.00 C ATOM 460 O LYS A 31 -34.006 -4.629 -30.246 1.00 0.00 O ATOM 461 CB LYS A 31 -35.968 -5.843 -32.334 1.00 0.00 C ATOM 462 CG LYS A 31 -36.910 -4.632 -32.453 1.00 0.00 C ATOM 463 CD LYS A 31 -36.772 -3.868 -33.777 1.00 0.00 C ATOM 464 CE LYS A 31 -37.703 -2.654 -33.746 1.00 0.00 C ATOM 465 NZ LYS A 31 -37.523 -1.830 -34.962 1.00 0.00 N ATOM 0 H LYS A 31 -33.701 -6.937 -31.110 1.00 0.00 H new ATOM 0 HA LYS A 31 -34.210 -5.182 -33.428 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -36.219 -6.555 -33.121 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -36.161 -6.338 -31.382 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -37.940 -4.973 -32.346 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -36.714 -3.948 -31.627 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -35.740 -3.548 -33.922 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -37.026 -4.517 -34.615 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -38.739 -2.985 -33.674 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -37.498 -2.054 -32.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -38.017 -0.923 -34.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -36.509 -1.654 -35.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -37.915 -2.333 -35.783 1.00 0.00 H new ATOM 479 N SER A 32 -33.892 -3.190 -31.974 1.00 0.00 N ATOM 480 CA SER A 32 -33.615 -1.983 -31.183 1.00 0.00 C ATOM 481 C SER A 32 -34.845 -1.090 -31.096 1.00 0.00 C ATOM 482 O SER A 32 -35.381 -0.599 -32.097 1.00 0.00 O ATOM 483 CB SER A 32 -32.461 -1.184 -31.772 1.00 0.00 C ATOM 484 OG SER A 32 -31.254 -1.905 -31.592 1.00 0.00 O ATOM 0 H SER A 32 -33.931 -3.012 -32.978 1.00 0.00 H new ATOM 0 HA SER A 32 -33.340 -2.317 -30.183 1.00 0.00 H new ATOM 0 HB2 SER A 32 -32.634 -1.001 -32.832 1.00 0.00 H new ATOM 0 HB3 SER A 32 -32.393 -0.210 -31.287 1.00 0.00 H new ATOM 0 HG SER A 32 -30.548 -1.503 -32.140 1.00 0.00 H new ATOM 490 N PHE A 33 -35.198 -0.781 -29.857 1.00 0.00 N ATOM 491 CA PHE A 33 -36.258 0.132 -29.494 1.00 0.00 C ATOM 492 C PHE A 33 -35.542 1.392 -29.051 1.00 0.00 C ATOM 493 O PHE A 33 -34.523 1.356 -28.359 1.00 0.00 O ATOM 494 CB PHE A 33 -37.108 -0.389 -28.331 1.00 0.00 C ATOM 495 CG PHE A 33 -37.902 -1.657 -28.583 1.00 0.00 C ATOM 496 CD1 PHE A 33 -37.252 -2.889 -28.786 1.00 0.00 C ATOM 497 CD2 PHE A 33 -39.306 -1.617 -28.547 1.00 0.00 C ATOM 498 CE1 PHE A 33 -38.001 -4.061 -28.986 1.00 0.00 C ATOM 499 CE2 PHE A 33 -40.058 -2.786 -28.746 1.00 0.00 C ATOM 500 CZ PHE A 33 -39.406 -4.011 -28.981 1.00 0.00 C ATOM 0 H PHE A 33 -34.729 -1.181 -29.045 1.00 0.00 H new ATOM 0 HA PHE A 33 -36.939 0.279 -30.332 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -36.450 -0.563 -27.480 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -37.805 0.397 -28.040 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -36.173 -2.934 -28.788 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -39.811 -0.680 -28.365 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -37.496 -5.003 -29.144 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -41.137 -2.745 -28.719 1.00 0.00 H new ATOM 0 HZ PHE A 33 -39.982 -4.908 -29.157 1.00 0.00 H new ATOM 510 N VAL A 34 -36.025 2.511 -29.552 1.00 0.00 N ATOM 511 CA VAL A 34 -35.323 3.778 -29.439 1.00 0.00 C ATOM 512 C VAL A 34 -36.156 4.782 -28.660 1.00 0.00 C ATOM 513 O VAL A 34 -37.254 5.175 -29.037 1.00 0.00 O ATOM 514 CB VAL A 34 -34.905 4.218 -30.837 1.00 0.00 C ATOM 515 CG1 VAL A 34 -34.294 5.609 -30.873 1.00 0.00 C ATOM 516 CG2 VAL A 34 -33.804 3.285 -31.320 1.00 0.00 C ATOM 0 H VAL A 34 -36.914 2.570 -30.049 1.00 0.00 H new ATOM 0 HA VAL A 34 -34.407 3.684 -28.855 1.00 0.00 H new ATOM 0 HB VAL A 34 -35.808 4.204 -31.448 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -34.019 5.859 -31.898 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -35.019 6.335 -30.504 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -33.405 5.632 -30.243 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -33.489 3.581 -32.320 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -32.954 3.342 -30.640 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -34.179 2.262 -31.346 1.00 0.00 H new ATOM 526 N MET A 35 -35.605 5.200 -27.531 1.00 0.00 N ATOM 527 CA MET A 35 -36.224 6.229 -26.698 1.00 0.00 C ATOM 528 C MET A 35 -35.455 7.524 -26.872 1.00 0.00 C ATOM 529 O MET A 35 -34.243 7.565 -26.685 1.00 0.00 O ATOM 530 CB MET A 35 -36.272 5.802 -25.225 1.00 0.00 C ATOM 531 CG MET A 35 -37.306 4.695 -24.973 1.00 0.00 C ATOM 532 SD MET A 35 -39.010 5.000 -25.530 1.00 0.00 S ATOM 533 CE MET A 35 -39.349 6.627 -24.813 1.00 0.00 C ATOM 0 H MET A 35 -34.723 4.841 -27.165 1.00 0.00 H new ATOM 0 HA MET A 35 -37.257 6.376 -27.014 1.00 0.00 H new ATOM 0 HB2 MET A 35 -35.286 5.452 -24.918 1.00 0.00 H new ATOM 0 HB3 MET A 35 -36.510 6.667 -24.606 1.00 0.00 H new ATOM 0 HG2 MET A 35 -36.951 3.786 -25.458 1.00 0.00 H new ATOM 0 HG3 MET A 35 -37.332 4.496 -23.902 1.00 0.00 H new ATOM 0 HE1 MET A 35 -40.367 6.929 -25.061 1.00 0.00 H new ATOM 0 HE2 MET A 35 -39.239 6.577 -23.730 1.00 0.00 H new ATOM 0 HE3 MET A 35 -38.646 7.356 -25.216 1.00 0.00 H new ATOM 543 N SER A 36 -36.166 8.585 -27.220 1.00 0.00 N ATOM 544 CA SER A 36 -35.597 9.916 -27.399 1.00 0.00 C ATOM 545 C SER A 36 -36.192 10.882 -26.381 1.00 0.00 C ATOM 546 O SER A 36 -37.391 10.844 -26.121 1.00 0.00 O ATOM 547 CB SER A 36 -35.815 10.399 -28.823 1.00 0.00 C ATOM 548 OG SER A 36 -34.941 9.740 -29.723 1.00 0.00 O ATOM 0 H SER A 36 -37.171 8.547 -27.389 1.00 0.00 H new ATOM 0 HA SER A 36 -34.521 9.871 -27.228 1.00 0.00 H new ATOM 0 HB2 SER A 36 -36.849 10.219 -29.117 1.00 0.00 H new ATOM 0 HB3 SER A 36 -35.652 11.475 -28.875 1.00 0.00 H new ATOM 0 HG SER A 36 -35.102 10.066 -30.633 1.00 0.00 H new ATOM 554 N VAL A 37 -35.362 11.711 -25.750 1.00 0.00 N ATOM 555 CA VAL A 37 -35.795 12.713 -24.757 1.00 0.00 C ATOM 556 C VAL A 37 -35.445 14.124 -25.194 1.00 0.00 C ATOM 557 O VAL A 37 -34.319 14.381 -25.623 1.00 0.00 O ATOM 558 CB VAL A 37 -35.301 12.486 -23.314 1.00 0.00 C ATOM 559 CG1 VAL A 37 -36.147 11.483 -22.557 1.00 0.00 C ATOM 560 CG2 VAL A 37 -33.825 12.099 -23.205 1.00 0.00 C ATOM 0 H VAL A 37 -34.355 11.712 -25.911 1.00 0.00 H new ATOM 0 HA VAL A 37 -36.876 12.581 -24.725 1.00 0.00 H new ATOM 0 HB VAL A 37 -35.411 13.466 -22.849 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -35.753 11.363 -21.548 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -37.175 11.840 -22.505 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -36.122 10.523 -23.073 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -33.562 11.959 -22.157 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -33.651 11.171 -23.750 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -33.209 12.891 -23.631 1.00 0.00 H new ATOM 570 N VAL A 38 -36.401 15.040 -25.024 1.00 0.00 N ATOM 571 CA VAL A 38 -36.097 16.483 -25.002 1.00 0.00 C ATOM 572 C VAL A 38 -36.167 16.898 -23.539 1.00 0.00 C ATOM 573 O VAL A 38 -37.146 16.591 -22.862 1.00 0.00 O ATOM 574 CB VAL A 38 -37.104 17.337 -25.801 1.00 0.00 C ATOM 575 CG1 VAL A 38 -36.779 18.835 -25.688 1.00 0.00 C ATOM 576 CG2 VAL A 38 -37.123 17.002 -27.294 1.00 0.00 C ATOM 0 H VAL A 38 -37.388 14.816 -24.900 1.00 0.00 H new ATOM 0 HA VAL A 38 -35.123 16.647 -25.463 1.00 0.00 H new ATOM 0 HB VAL A 38 -38.075 17.106 -25.363 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -37.506 19.409 -26.262 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -36.821 19.138 -24.642 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -35.779 19.021 -26.080 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -37.851 17.636 -27.800 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -36.134 17.175 -27.718 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -37.398 15.956 -27.429 1.00 0.00 H new ATOM 586 N VAL A 39 -35.115 17.553 -23.047 1.00 0.00 N ATOM 587 CA VAL A 39 -34.927 17.950 -21.641 1.00 0.00 C ATOM 588 C VAL A 39 -34.114 19.245 -21.585 1.00 0.00 C ATOM 589 O VAL A 39 -33.234 19.434 -22.424 1.00 0.00 O ATOM 590 CB VAL A 39 -34.213 16.815 -20.872 1.00 0.00 C ATOM 591 CG1 VAL A 39 -32.805 16.508 -21.375 1.00 0.00 C ATOM 592 CG2 VAL A 39 -34.138 17.092 -19.372 1.00 0.00 C ATOM 0 H VAL A 39 -34.334 17.836 -23.639 1.00 0.00 H new ATOM 0 HA VAL A 39 -35.895 18.126 -21.171 1.00 0.00 H new ATOM 0 HB VAL A 39 -34.836 15.941 -21.062 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -32.375 15.701 -20.782 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -32.850 16.206 -22.421 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -32.183 17.398 -21.281 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -33.628 16.267 -18.875 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -33.586 18.016 -19.200 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -35.146 17.191 -18.969 1.00 0.00 H new ATOM 602 N ASP A 40 -34.369 20.117 -20.599 1.00 0.00 N ATOM 603 CA ASP A 40 -33.717 21.429 -20.380 1.00 0.00 C ATOM 604 C ASP A 40 -33.860 22.429 -21.560 1.00 0.00 C ATOM 605 O ASP A 40 -34.564 23.436 -21.457 1.00 0.00 O ATOM 606 CB ASP A 40 -32.248 21.194 -19.965 1.00 0.00 C ATOM 607 CG ASP A 40 -31.394 22.466 -20.041 1.00 0.00 C ATOM 608 OD1 ASP A 40 -31.707 23.451 -19.332 1.00 0.00 O ATOM 609 OD2 ASP A 40 -30.423 22.469 -20.836 1.00 0.00 O ATOM 0 H ASP A 40 -35.075 19.920 -19.889 1.00 0.00 H new ATOM 0 HA ASP A 40 -34.248 21.929 -19.570 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -32.221 20.805 -18.947 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -31.812 20.431 -20.609 1.00 0.00 H new ATOM 614 N GLY A 41 -33.231 22.113 -22.688 1.00 0.00 N ATOM 615 CA GLY A 41 -33.351 22.742 -24.009 1.00 0.00 C ATOM 616 C GLY A 41 -32.619 21.955 -25.114 1.00 0.00 C ATOM 617 O GLY A 41 -32.264 22.524 -26.149 1.00 0.00 O ATOM 0 H GLY A 41 -32.564 21.342 -22.708 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -34.406 22.830 -24.270 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -32.948 23.754 -23.962 1.00 0.00 H new ATOM 621 N GLN A 42 -32.331 20.669 -24.872 1.00 0.00 N ATOM 622 CA GLN A 42 -31.465 19.782 -25.653 1.00 0.00 C ATOM 623 C GLN A 42 -32.111 18.397 -25.865 1.00 0.00 C ATOM 624 O GLN A 42 -33.089 18.048 -25.199 1.00 0.00 O ATOM 625 CB GLN A 42 -30.068 19.717 -24.998 1.00 0.00 C ATOM 626 CG GLN A 42 -30.017 19.755 -23.453 1.00 0.00 C ATOM 627 CD GLN A 42 -28.592 19.936 -22.934 1.00 0.00 C ATOM 628 OE1 GLN A 42 -27.628 19.406 -23.469 1.00 0.00 O ATOM 629 NE2 GLN A 42 -28.389 20.719 -21.895 1.00 0.00 N ATOM 0 H GLN A 42 -32.728 20.188 -24.065 1.00 0.00 H new ATOM 0 HA GLN A 42 -31.336 20.191 -26.655 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -29.580 18.801 -25.331 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -29.476 20.550 -25.378 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -30.642 20.570 -23.089 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -30.434 18.831 -23.053 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -29.179 21.171 -21.435 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -27.441 20.874 -21.551 1.00 0.00 H new ATOM 638 N PHE A 43 -31.575 17.610 -26.805 1.00 0.00 N ATOM 639 CA PHE A 43 -32.204 16.388 -27.327 1.00 0.00 C ATOM 640 C PHE A 43 -31.227 15.206 -27.412 1.00 0.00 C ATOM 641 O PHE A 43 -30.081 15.359 -27.848 1.00 0.00 O ATOM 642 CB PHE A 43 -32.795 16.696 -28.709 1.00 0.00 C ATOM 643 CG PHE A 43 -33.410 15.504 -29.423 1.00 0.00 C ATOM 644 CD1 PHE A 43 -34.640 14.981 -28.987 1.00 0.00 C ATOM 645 CD2 PHE A 43 -32.766 14.922 -30.533 1.00 0.00 C ATOM 646 CE1 PHE A 43 -35.252 13.924 -29.681 1.00 0.00 C ATOM 647 CE2 PHE A 43 -33.361 13.841 -31.209 1.00 0.00 C ATOM 648 CZ PHE A 43 -34.610 13.348 -30.791 1.00 0.00 C ATOM 0 H PHE A 43 -30.671 17.808 -27.235 1.00 0.00 H new ATOM 0 HA PHE A 43 -32.988 16.085 -26.633 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -33.557 17.467 -28.598 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -32.009 17.113 -29.339 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -35.118 15.395 -28.112 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -31.813 15.307 -30.866 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -36.215 13.554 -29.362 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -32.857 13.389 -32.051 1.00 0.00 H new ATOM 0 HZ PHE A 43 -35.074 12.530 -31.321 1.00 0.00 H new ATOM 658 N PHE A 44 -31.703 14.024 -27.007 1.00 0.00 N ATOM 659 CA PHE A 44 -30.930 12.781 -26.920 1.00 0.00 C ATOM 660 C PHE A 44 -31.702 11.587 -27.501 1.00 0.00 C ATOM 661 O PHE A 44 -32.935 11.586 -27.515 1.00 0.00 O ATOM 662 CB PHE A 44 -30.555 12.503 -25.453 1.00 0.00 C ATOM 663 CG PHE A 44 -29.952 13.680 -24.705 1.00 0.00 C ATOM 664 CD1 PHE A 44 -30.791 14.677 -24.172 1.00 0.00 C ATOM 665 CD2 PHE A 44 -28.555 13.809 -24.582 1.00 0.00 C ATOM 666 CE1 PHE A 44 -30.241 15.814 -23.561 1.00 0.00 C ATOM 667 CE2 PHE A 44 -28.005 14.941 -23.953 1.00 0.00 C ATOM 668 CZ PHE A 44 -28.850 15.947 -23.452 1.00 0.00 C ATOM 0 H PHE A 44 -32.674 13.902 -26.720 1.00 0.00 H new ATOM 0 HA PHE A 44 -30.025 12.908 -27.513 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -31.449 12.175 -24.922 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -29.847 11.675 -25.426 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -31.864 14.566 -24.234 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -27.906 13.039 -24.971 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -30.889 16.587 -23.175 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -26.934 15.037 -23.855 1.00 0.00 H new ATOM 0 HZ PHE A 44 -28.427 16.823 -22.983 1.00 0.00 H new ATOM 678 N GLU A 45 -30.976 10.541 -27.902 1.00 0.00 N ATOM 679 CA GLU A 45 -31.489 9.283 -28.466 1.00 0.00 C ATOM 680 C GLU A 45 -30.801 8.098 -27.771 1.00 0.00 C ATOM 681 O GLU A 45 -29.577 8.083 -27.603 1.00 0.00 O ATOM 682 CB GLU A 45 -31.258 9.192 -29.994 1.00 0.00 C ATOM 683 CG GLU A 45 -31.610 10.444 -30.826 1.00 0.00 C ATOM 684 CD GLU A 45 -30.417 11.399 -31.092 1.00 0.00 C ATOM 685 OE1 GLU A 45 -29.483 11.518 -30.262 1.00 0.00 O ATOM 686 OE2 GLU A 45 -30.400 12.045 -32.170 1.00 0.00 O ATOM 0 H GLU A 45 -29.958 10.546 -27.840 1.00 0.00 H new ATOM 0 HA GLU A 45 -32.565 9.254 -28.294 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -30.208 8.954 -30.165 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -31.841 8.355 -30.377 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -32.023 10.124 -31.783 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -32.394 10.998 -30.310 1.00 0.00 H new ATOM 693 N GLY A 46 -31.588 7.100 -27.373 1.00 0.00 N ATOM 694 CA GLY A 46 -31.142 5.928 -26.610 1.00 0.00 C ATOM 695 C GLY A 46 -31.645 4.625 -27.216 1.00 0.00 C ATOM 696 O GLY A 46 -32.849 4.372 -27.211 1.00 0.00 O ATOM 0 H GLY A 46 -32.587 7.081 -27.578 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -30.053 5.913 -26.573 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -31.495 6.009 -25.582 1.00 0.00 H new ATOM 700 N SER A 47 -30.738 3.793 -27.734 1.00 0.00 N ATOM 701 CA SER A 47 -31.067 2.569 -28.480 1.00 0.00 C ATOM 702 C SER A 47 -30.827 1.305 -27.649 1.00 0.00 C ATOM 703 O SER A 47 -29.694 0.960 -27.305 1.00 0.00 O ATOM 704 CB SER A 47 -30.290 2.537 -29.797 1.00 0.00 C ATOM 705 OG SER A 47 -28.897 2.723 -29.609 1.00 0.00 O ATOM 0 H SER A 47 -29.734 3.952 -27.647 1.00 0.00 H new ATOM 0 HA SER A 47 -32.133 2.586 -28.706 1.00 0.00 H new ATOM 0 HB2 SER A 47 -30.462 1.582 -30.294 1.00 0.00 H new ATOM 0 HB3 SER A 47 -30.671 3.314 -30.459 1.00 0.00 H new ATOM 0 HG SER A 47 -28.443 2.693 -30.477 1.00 0.00 H new ATOM 711 N GLY A 48 -31.927 0.666 -27.253 1.00 0.00 N ATOM 712 CA GLY A 48 -31.975 -0.476 -26.335 1.00 0.00 C ATOM 713 C GLY A 48 -32.903 -1.605 -26.778 1.00 0.00 C ATOM 714 O GLY A 48 -33.951 -1.352 -27.364 1.00 0.00 O ATOM 0 H GLY A 48 -32.854 0.942 -27.578 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -30.967 -0.875 -26.219 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -32.294 -0.124 -25.354 1.00 0.00 H new ATOM 718 N ARG A 49 -32.531 -2.865 -26.532 1.00 0.00 N ATOM 719 CA ARG A 49 -33.366 -4.043 -26.856 1.00 0.00 C ATOM 720 C ARG A 49 -34.822 -4.031 -26.320 1.00 0.00 C ATOM 721 O ARG A 49 -35.650 -4.765 -26.855 1.00 0.00 O ATOM 722 CB ARG A 49 -32.618 -5.350 -26.515 1.00 0.00 C ATOM 723 CG ARG A 49 -31.824 -5.938 -27.697 1.00 0.00 C ATOM 724 CD ARG A 49 -30.647 -5.080 -28.204 1.00 0.00 C ATOM 725 NE ARG A 49 -30.847 -4.574 -29.581 1.00 0.00 N ATOM 726 CZ ARG A 49 -30.739 -5.273 -30.697 1.00 0.00 C ATOM 727 NH1 ARG A 49 -30.504 -6.553 -30.711 1.00 0.00 N ATOM 728 NH2 ARG A 49 -30.861 -4.700 -31.853 1.00 0.00 N ATOM 0 H ARG A 49 -31.639 -3.106 -26.100 1.00 0.00 H new ATOM 0 HA ARG A 49 -33.517 -3.984 -27.934 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -31.934 -5.161 -25.688 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -33.339 -6.091 -26.169 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -31.438 -6.914 -27.402 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -32.512 -6.105 -28.526 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -30.505 -4.235 -27.530 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -29.733 -5.672 -28.170 1.00 0.00 H new ATOM 0 HE ARG A 49 -31.092 -3.589 -29.678 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -30.395 -7.061 -29.833 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -30.429 -7.048 -31.600 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -31.043 -3.698 -31.909 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -30.775 -5.251 -32.707 1.00 0.00 H new ATOM 742 N ASN A 50 -35.157 -3.193 -25.326 1.00 0.00 N ATOM 743 CA ASN A 50 -36.507 -2.637 -25.057 1.00 0.00 C ATOM 744 C ASN A 50 -36.402 -1.383 -24.144 1.00 0.00 C ATOM 745 O ASN A 50 -35.291 -1.057 -23.727 1.00 0.00 O ATOM 746 CB ASN A 50 -37.440 -3.718 -24.463 1.00 0.00 C ATOM 747 CG ASN A 50 -38.886 -3.507 -24.885 1.00 0.00 C ATOM 748 OD1 ASN A 50 -39.542 -2.561 -24.474 1.00 0.00 O ATOM 749 ND2 ASN A 50 -39.417 -4.356 -25.731 1.00 0.00 N ATOM 0 H ASN A 50 -34.466 -2.865 -24.652 1.00 0.00 H new ATOM 0 HA ASN A 50 -36.953 -2.319 -25.999 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -37.107 -4.704 -24.787 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -37.372 -3.700 -23.375 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -40.378 -4.227 -26.047 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -38.869 -5.145 -26.073 1.00 0.00 H new ATOM 756 N LYS A 51 -37.499 -0.697 -23.769 1.00 0.00 N ATOM 757 CA LYS A 51 -37.532 0.506 -22.880 1.00 0.00 C ATOM 758 C LYS A 51 -36.680 0.419 -21.610 1.00 0.00 C ATOM 759 O LYS A 51 -35.995 1.393 -21.310 1.00 0.00 O ATOM 760 CB LYS A 51 -38.979 0.865 -22.503 1.00 0.00 C ATOM 761 CG LYS A 51 -39.674 1.640 -23.634 1.00 0.00 C ATOM 762 CD LYS A 51 -41.137 1.936 -23.268 1.00 0.00 C ATOM 763 CE LYS A 51 -41.860 2.752 -24.349 1.00 0.00 C ATOM 764 NZ LYS A 51 -42.122 1.950 -25.572 1.00 0.00 N ATOM 0 H LYS A 51 -38.431 -0.968 -24.084 1.00 0.00 H new ATOM 0 HA LYS A 51 -37.077 1.293 -23.482 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -39.537 -0.046 -22.287 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -38.982 1.465 -21.593 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -39.144 2.574 -23.821 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -39.634 1.061 -24.557 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -41.666 0.996 -23.112 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -41.169 2.480 -22.324 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -42.804 3.124 -23.951 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -41.258 3.623 -24.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -41.677 2.411 -26.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -41.725 0.996 -25.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -43.148 1.881 -25.729 1.00 0.00 H new ATOM 778 N LYS A 52 -36.634 -0.723 -20.911 1.00 0.00 N ATOM 779 CA LYS A 52 -35.751 -0.939 -19.733 1.00 0.00 C ATOM 780 C LYS A 52 -34.252 -0.702 -19.992 1.00 0.00 C ATOM 781 O LYS A 52 -33.488 -0.512 -19.048 1.00 0.00 O ATOM 782 CB LYS A 52 -36.014 -2.313 -19.080 1.00 0.00 C ATOM 783 CG LYS A 52 -35.303 -3.532 -19.703 1.00 0.00 C ATOM 784 CD LYS A 52 -35.769 -3.872 -21.127 1.00 0.00 C ATOM 785 CE LYS A 52 -35.052 -5.091 -21.727 1.00 0.00 C ATOM 786 NZ LYS A 52 -35.392 -6.358 -21.023 1.00 0.00 N ATOM 0 H LYS A 52 -37.208 -1.534 -21.140 1.00 0.00 H new ATOM 0 HA LYS A 52 -36.028 -0.159 -19.024 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -35.723 -2.251 -18.031 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -37.088 -2.499 -19.103 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -34.230 -3.343 -19.719 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -35.465 -4.399 -19.063 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -36.843 -4.060 -21.115 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -35.604 -3.009 -21.772 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -35.318 -5.182 -22.780 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -33.974 -4.933 -21.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -34.909 -7.154 -21.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -35.084 -6.298 -20.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -36.420 -6.509 -21.058 1.00 0.00 H new ATOM 800 N LEU A 53 -33.858 -0.679 -21.267 1.00 0.00 N ATOM 801 CA LEU A 53 -32.514 -0.399 -21.764 1.00 0.00 C ATOM 802 C LEU A 53 -32.496 0.857 -22.660 1.00 0.00 C ATOM 803 O LEU A 53 -31.639 1.708 -22.485 1.00 0.00 O ATOM 804 CB LEU A 53 -32.022 -1.678 -22.470 1.00 0.00 C ATOM 805 CG LEU A 53 -30.621 -1.615 -23.103 1.00 0.00 C ATOM 806 CD1 LEU A 53 -29.549 -1.123 -22.131 1.00 0.00 C ATOM 807 CD2 LEU A 53 -30.217 -3.008 -23.583 1.00 0.00 C ATOM 0 H LEU A 53 -34.513 -0.868 -22.026 1.00 0.00 H new ATOM 0 HA LEU A 53 -31.828 -0.158 -20.952 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -32.034 -2.493 -21.747 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -32.738 -1.934 -23.251 1.00 0.00 H new ATOM 0 HG LEU A 53 -30.683 -0.905 -23.928 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -28.583 -1.100 -22.636 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -29.802 -0.120 -21.787 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -29.496 -1.797 -21.276 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -29.225 -2.965 -24.032 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -30.203 -3.695 -22.737 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -30.935 -3.360 -24.324 1.00 0.00 H new ATOM 819 N ALA A 54 -33.448 1.031 -23.579 1.00 0.00 N ATOM 820 CA ALA A 54 -33.594 2.227 -24.417 1.00 0.00 C ATOM 821 C ALA A 54 -33.703 3.525 -23.591 1.00 0.00 C ATOM 822 O ALA A 54 -32.909 4.456 -23.767 1.00 0.00 O ATOM 823 CB ALA A 54 -34.786 2.003 -25.355 1.00 0.00 C ATOM 0 H ALA A 54 -34.160 0.325 -23.767 1.00 0.00 H new ATOM 0 HA ALA A 54 -32.693 2.371 -25.013 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -34.918 2.878 -25.991 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -34.600 1.127 -25.977 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -35.688 1.844 -24.765 1.00 0.00 H new ATOM 829 N LYS A 55 -34.646 3.557 -22.633 1.00 0.00 N ATOM 830 CA LYS A 55 -34.705 4.587 -21.586 1.00 0.00 C ATOM 831 C LYS A 55 -33.391 4.662 -20.821 1.00 0.00 C ATOM 832 O LYS A 55 -32.933 5.768 -20.640 1.00 0.00 O ATOM 833 CB LYS A 55 -35.908 4.403 -20.637 1.00 0.00 C ATOM 834 CG LYS A 55 -36.210 5.711 -19.892 1.00 0.00 C ATOM 835 CD LYS A 55 -37.696 6.059 -19.750 1.00 0.00 C ATOM 836 CE LYS A 55 -38.452 6.132 -21.083 1.00 0.00 C ATOM 837 NZ LYS A 55 -39.828 6.667 -20.871 1.00 0.00 N ATOM 0 H LYS A 55 -35.392 2.864 -22.565 1.00 0.00 H new ATOM 0 HA LYS A 55 -34.858 5.542 -22.088 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -36.784 4.091 -21.206 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -35.695 3.610 -19.920 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -35.771 5.651 -18.896 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -35.711 6.529 -20.412 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -38.174 5.314 -19.114 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -37.786 7.018 -19.240 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -37.910 6.770 -21.781 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -38.506 5.141 -21.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -40.483 6.215 -21.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -40.133 6.465 -19.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -39.829 7.695 -21.027 1.00 0.00 H new ATOM 851 N ALA A 56 -32.765 3.566 -20.380 1.00 0.00 N ATOM 852 CA ALA A 56 -31.498 3.600 -19.645 1.00 0.00 C ATOM 853 C ALA A 56 -30.395 4.345 -20.407 1.00 0.00 C ATOM 854 O ALA A 56 -29.735 5.201 -19.836 1.00 0.00 O ATOM 855 CB ALA A 56 -31.072 2.176 -19.264 1.00 0.00 C ATOM 0 H ALA A 56 -33.127 2.623 -20.525 1.00 0.00 H new ATOM 0 HA ALA A 56 -31.659 4.168 -18.729 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -30.129 2.212 -18.718 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -31.838 1.723 -18.635 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -30.945 1.580 -20.168 1.00 0.00 H new ATOM 861 N ARG A 57 -30.207 4.036 -21.692 1.00 0.00 N ATOM 862 CA ARG A 57 -29.300 4.717 -22.635 1.00 0.00 C ATOM 863 C ARG A 57 -29.582 6.225 -22.724 1.00 0.00 C ATOM 864 O ARG A 57 -28.717 7.049 -22.406 1.00 0.00 O ATOM 865 CB ARG A 57 -29.403 4.016 -24.009 1.00 0.00 C ATOM 866 CG ARG A 57 -29.126 2.497 -23.974 1.00 0.00 C ATOM 867 CD ARG A 57 -27.725 2.108 -24.418 1.00 0.00 C ATOM 868 NE ARG A 57 -27.565 2.282 -25.876 1.00 0.00 N ATOM 869 CZ ARG A 57 -26.628 2.950 -26.522 1.00 0.00 C ATOM 870 NH1 ARG A 57 -25.610 3.498 -25.920 1.00 0.00 N ATOM 871 NH2 ARG A 57 -26.706 3.093 -27.810 1.00 0.00 N ATOM 0 H ARG A 57 -30.707 3.264 -22.132 1.00 0.00 H new ATOM 0 HA ARG A 57 -28.276 4.639 -22.271 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -30.402 4.181 -24.413 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -28.699 4.485 -24.696 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -29.287 2.133 -22.959 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -29.851 1.992 -24.613 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -26.990 2.718 -23.892 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -27.529 1.070 -24.148 1.00 0.00 H new ATOM 0 HE ARG A 57 -28.269 1.828 -26.458 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -25.514 3.420 -24.908 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -24.910 4.005 -26.461 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -27.491 2.689 -28.321 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -25.982 3.609 -28.311 1.00 0.00 H new ATOM 885 N ALA A 58 -30.808 6.571 -23.136 1.00 0.00 N ATOM 886 CA ALA A 58 -31.288 7.954 -23.243 1.00 0.00 C ATOM 887 C ALA A 58 -31.145 8.723 -21.926 1.00 0.00 C ATOM 888 O ALA A 58 -30.544 9.794 -21.889 1.00 0.00 O ATOM 889 CB ALA A 58 -32.744 7.940 -23.709 1.00 0.00 C ATOM 0 H ALA A 58 -31.509 5.882 -23.410 1.00 0.00 H new ATOM 0 HA ALA A 58 -30.670 8.476 -23.973 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -33.109 8.964 -23.791 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -32.810 7.452 -24.681 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -33.352 7.395 -22.987 1.00 0.00 H new ATOM 895 N ALA A 59 -31.640 8.126 -20.844 1.00 0.00 N ATOM 896 CA ALA A 59 -31.463 8.559 -19.465 1.00 0.00 C ATOM 897 C ALA A 59 -30.003 8.835 -19.148 1.00 0.00 C ATOM 898 O ALA A 59 -29.691 9.965 -18.822 1.00 0.00 O ATOM 899 CB ALA A 59 -32.030 7.518 -18.486 1.00 0.00 C ATOM 0 H ALA A 59 -32.206 7.280 -20.913 1.00 0.00 H new ATOM 0 HA ALA A 59 -32.016 9.491 -19.346 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -31.886 7.864 -17.463 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -33.095 7.382 -18.676 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -31.512 6.569 -18.624 1.00 0.00 H new ATOM 905 N GLN A 60 -29.096 7.864 -19.272 1.00 0.00 N ATOM 906 CA GLN A 60 -27.693 8.055 -18.907 1.00 0.00 C ATOM 907 C GLN A 60 -27.102 9.265 -19.641 1.00 0.00 C ATOM 908 O GLN A 60 -26.520 10.130 -18.981 1.00 0.00 O ATOM 909 CB GLN A 60 -26.900 6.751 -19.137 1.00 0.00 C ATOM 910 CG GLN A 60 -25.807 6.481 -18.093 1.00 0.00 C ATOM 911 CD GLN A 60 -24.440 7.099 -18.409 1.00 0.00 C ATOM 912 OE1 GLN A 60 -23.465 6.403 -18.660 1.00 0.00 O ATOM 913 NE2 GLN A 60 -24.287 8.406 -18.418 1.00 0.00 N ATOM 0 H GLN A 60 -29.311 6.932 -19.625 1.00 0.00 H new ATOM 0 HA GLN A 60 -27.620 8.281 -17.843 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -27.596 5.913 -19.141 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -26.441 6.789 -20.125 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -26.146 6.860 -17.129 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -25.686 5.403 -17.987 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -25.080 9.014 -18.213 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -23.375 8.811 -18.630 1.00 0.00 H new ATOM 922 N SER A 61 -27.305 9.364 -20.964 1.00 0.00 N ATOM 923 CA SER A 61 -26.907 10.547 -21.746 1.00 0.00 C ATOM 924 C SER A 61 -27.490 11.881 -21.223 1.00 0.00 C ATOM 925 O SER A 61 -26.735 12.773 -20.820 1.00 0.00 O ATOM 926 CB SER A 61 -27.144 10.308 -23.248 1.00 0.00 C ATOM 927 OG SER A 61 -28.490 10.430 -23.654 1.00 0.00 O ATOM 0 H SER A 61 -27.747 8.632 -21.520 1.00 0.00 H new ATOM 0 HA SER A 61 -25.834 10.676 -21.603 1.00 0.00 H new ATOM 0 HB2 SER A 61 -26.541 11.017 -23.816 1.00 0.00 H new ATOM 0 HB3 SER A 61 -26.789 9.310 -23.505 1.00 0.00 H new ATOM 0 HG SER A 61 -29.075 10.048 -22.967 1.00 0.00 H new ATOM 933 N ALA A 62 -28.822 12.008 -21.186 1.00 0.00 N ATOM 934 CA ALA A 62 -29.571 13.162 -20.697 1.00 0.00 C ATOM 935 C ALA A 62 -29.194 13.533 -19.266 1.00 0.00 C ATOM 936 O ALA A 62 -28.680 14.621 -19.030 1.00 0.00 O ATOM 937 CB ALA A 62 -31.063 12.844 -20.841 1.00 0.00 C ATOM 0 H ALA A 62 -29.437 11.264 -21.516 1.00 0.00 H new ATOM 0 HA ALA A 62 -29.322 14.042 -21.290 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -31.651 13.689 -20.483 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -31.296 12.658 -21.889 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -31.305 11.959 -20.253 1.00 0.00 H new ATOM 943 N LEU A 63 -29.419 12.616 -18.328 1.00 0.00 N ATOM 944 CA LEU A 63 -29.198 12.737 -16.900 1.00 0.00 C ATOM 945 C LEU A 63 -27.767 13.185 -16.578 1.00 0.00 C ATOM 946 O LEU A 63 -27.601 14.199 -15.906 1.00 0.00 O ATOM 947 CB LEU A 63 -29.558 11.388 -16.252 1.00 0.00 C ATOM 948 CG LEU A 63 -29.963 11.502 -14.786 1.00 0.00 C ATOM 949 CD1 LEU A 63 -31.288 12.271 -14.683 1.00 0.00 C ATOM 950 CD2 LEU A 63 -30.126 10.101 -14.199 1.00 0.00 C ATOM 0 H LEU A 63 -29.790 11.698 -18.573 1.00 0.00 H new ATOM 0 HA LEU A 63 -29.837 13.517 -16.486 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -30.375 10.933 -16.811 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -28.703 10.716 -16.333 1.00 0.00 H new ATOM 0 HG LEU A 63 -29.194 12.038 -14.229 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -31.580 12.354 -13.636 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -31.164 13.268 -15.105 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -32.062 11.737 -15.234 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -30.416 10.177 -13.151 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -30.897 9.563 -14.750 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -29.182 9.562 -14.276 1.00 0.00 H new ATOM 962 N ALA A 64 -26.737 12.496 -17.093 1.00 0.00 N ATOM 963 CA ALA A 64 -25.350 12.958 -16.969 1.00 0.00 C ATOM 964 C ALA A 64 -25.145 14.385 -17.513 1.00 0.00 C ATOM 965 O ALA A 64 -24.548 15.220 -16.830 1.00 0.00 O ATOM 966 CB ALA A 64 -24.400 11.959 -17.634 1.00 0.00 C ATOM 0 H ALA A 64 -26.841 11.617 -17.599 1.00 0.00 H new ATOM 0 HA ALA A 64 -25.116 13.009 -15.906 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -23.374 12.312 -17.536 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -24.497 10.987 -17.150 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -24.652 11.865 -18.690 1.00 0.00 H new ATOM 972 N THR A 65 -25.642 14.677 -18.724 1.00 0.00 N ATOM 973 CA THR A 65 -25.592 16.024 -19.324 1.00 0.00 C ATOM 974 C THR A 65 -26.220 17.099 -18.433 1.00 0.00 C ATOM 975 O THR A 65 -25.523 18.025 -18.010 1.00 0.00 O ATOM 976 CB THR A 65 -26.202 16.042 -20.738 1.00 0.00 C ATOM 977 OG1 THR A 65 -25.480 15.163 -21.573 1.00 0.00 O ATOM 978 CG2 THR A 65 -26.151 17.430 -21.380 1.00 0.00 C ATOM 0 H THR A 65 -26.093 13.983 -19.320 1.00 0.00 H new ATOM 0 HA THR A 65 -24.535 16.275 -19.413 1.00 0.00 H new ATOM 0 HB THR A 65 -27.244 15.740 -20.635 1.00 0.00 H new ATOM 0 HG1 THR A 65 -25.798 14.246 -21.435 1.00 0.00 H new ATOM 0 HG21 THR A 65 -26.594 17.387 -22.375 1.00 0.00 H new ATOM 0 HG22 THR A 65 -26.709 18.136 -20.765 1.00 0.00 H new ATOM 0 HG23 THR A 65 -25.114 17.757 -21.458 1.00 0.00 H new ATOM 986 N VAL A 66 -27.523 17.008 -18.137 1.00 0.00 N ATOM 987 CA VAL A 66 -28.209 17.963 -17.256 1.00 0.00 C ATOM 988 C VAL A 66 -27.562 18.098 -15.873 1.00 0.00 C ATOM 989 O VAL A 66 -27.351 19.217 -15.411 1.00 0.00 O ATOM 990 CB VAL A 66 -29.739 17.786 -17.174 1.00 0.00 C ATOM 991 CG1 VAL A 66 -30.392 18.120 -18.518 1.00 0.00 C ATOM 992 CG2 VAL A 66 -30.259 16.401 -16.769 1.00 0.00 C ATOM 0 H VAL A 66 -28.130 16.273 -18.500 1.00 0.00 H new ATOM 0 HA VAL A 66 -28.063 18.919 -17.759 1.00 0.00 H new ATOM 0 HB VAL A 66 -30.011 18.472 -16.372 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -31.471 17.989 -18.441 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -30.170 19.154 -18.784 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -30.000 17.455 -19.288 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -31.349 16.413 -16.750 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -29.917 15.659 -17.490 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -29.881 16.146 -15.779 1.00 0.00 H new ATOM 1002 N PHE A 67 -27.218 16.998 -15.203 1.00 0.00 N ATOM 1003 CA PHE A 67 -26.467 17.016 -13.940 1.00 0.00 C ATOM 1004 C PHE A 67 -25.119 17.758 -14.005 1.00 0.00 C ATOM 1005 O PHE A 67 -24.814 18.532 -13.102 1.00 0.00 O ATOM 1006 CB PHE A 67 -26.298 15.613 -13.354 1.00 0.00 C ATOM 1007 CG PHE A 67 -27.536 14.860 -12.875 1.00 0.00 C ATOM 1008 CD1 PHE A 67 -28.839 15.293 -13.183 1.00 0.00 C ATOM 1009 CD2 PHE A 67 -27.377 13.670 -12.133 1.00 0.00 C ATOM 1010 CE1 PHE A 67 -29.954 14.545 -12.803 1.00 0.00 C ATOM 1011 CE2 PHE A 67 -28.502 12.928 -11.721 1.00 0.00 C ATOM 1012 CZ PHE A 67 -29.794 13.364 -12.060 1.00 0.00 C ATOM 0 H PHE A 67 -27.454 16.058 -15.522 1.00 0.00 H new ATOM 0 HA PHE A 67 -27.088 17.601 -13.262 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -25.809 14.997 -14.109 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -25.611 15.688 -12.511 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -28.978 16.219 -13.722 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -26.385 13.325 -11.879 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -30.944 14.876 -13.081 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -28.371 12.024 -11.145 1.00 0.00 H new ATOM 0 HZ PHE A 67 -30.658 12.795 -11.751 1.00 0.00 H new ATOM 1022 N ASN A 68 -24.278 17.506 -15.018 1.00 0.00 N ATOM 1023 CA ASN A 68 -23.066 18.290 -15.318 1.00 0.00 C ATOM 1024 C ASN A 68 -23.321 19.796 -15.523 1.00 0.00 C ATOM 1025 O ASN A 68 -22.534 20.631 -15.076 1.00 0.00 O ATOM 1026 CB ASN A 68 -22.339 17.645 -16.510 1.00 0.00 C ATOM 1027 CG ASN A 68 -21.055 18.374 -16.869 1.00 0.00 C ATOM 1028 OD1 ASN A 68 -20.967 19.077 -17.867 1.00 0.00 O ATOM 1029 ND2 ASN A 68 -20.023 18.241 -16.065 1.00 0.00 N ATOM 0 H ASN A 68 -24.423 16.734 -15.668 1.00 0.00 H new ATOM 0 HA ASN A 68 -22.423 18.257 -14.438 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -22.110 16.606 -16.273 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -23.002 17.636 -17.375 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -19.149 18.724 -16.273 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -20.097 17.655 -15.233 1.00 0.00 H new ATOM 1036 N LEU A 69 -24.429 20.140 -16.183 1.00 0.00 N ATOM 1037 CA LEU A 69 -24.981 21.499 -16.251 1.00 0.00 C ATOM 1038 C LEU A 69 -25.369 22.034 -14.848 1.00 0.00 C ATOM 1039 O LEU A 69 -25.139 23.207 -14.550 1.00 0.00 O ATOM 1040 CB LEU A 69 -26.142 21.452 -17.275 1.00 0.00 C ATOM 1041 CG LEU A 69 -27.429 22.216 -16.926 1.00 0.00 C ATOM 1042 CD1 LEU A 69 -27.243 23.725 -17.113 1.00 0.00 C ATOM 1043 CD2 LEU A 69 -28.565 21.808 -17.864 1.00 0.00 C ATOM 0 H LEU A 69 -24.986 19.461 -16.702 1.00 0.00 H new ATOM 0 HA LEU A 69 -24.242 22.223 -16.594 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -25.769 21.838 -18.224 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -26.405 20.407 -17.437 1.00 0.00 H new ATOM 0 HG LEU A 69 -27.662 21.978 -15.888 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -28.169 24.240 -16.859 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -26.442 24.076 -16.462 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -26.985 23.934 -18.151 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -29.468 22.359 -17.602 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -28.287 22.035 -18.893 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -28.751 20.738 -17.766 1.00 0.00 H new ATOM 1055 N HIS A 70 -25.931 21.155 -14.009 1.00 0.00 N ATOM 1056 CA HIS A 70 -26.351 21.288 -12.602 1.00 0.00 C ATOM 1057 C HIS A 70 -27.871 21.527 -12.437 1.00 0.00 C ATOM 1058 O HIS A 70 -28.296 22.304 -11.575 1.00 0.00 O ATOM 1059 CB HIS A 70 -25.437 22.207 -11.761 1.00 0.00 C ATOM 1060 CG HIS A 70 -23.966 21.840 -11.806 1.00 0.00 C ATOM 1061 ND1 HIS A 70 -23.432 20.570 -11.780 1.00 0.00 N ATOM 1062 CD2 HIS A 70 -22.909 22.706 -11.894 1.00 0.00 C ATOM 1063 CE1 HIS A 70 -22.095 20.667 -11.859 1.00 0.00 C ATOM 1064 NE2 HIS A 70 -21.722 21.958 -11.914 1.00 0.00 N ATOM 0 H HIS A 70 -26.128 20.211 -14.341 1.00 0.00 H new ATOM 0 HA HIS A 70 -26.194 20.308 -12.151 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -25.554 23.233 -12.110 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -25.773 22.183 -10.724 1.00 0.00 H new ATOM 0 HD1 HIS A 70 -23.963 19.702 -11.712 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -22.977 23.783 -11.940 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -21.416 19.828 -11.876 1.00 0.00 H new ATOM 1072 N LEU A 71 -28.693 20.835 -13.249 1.00 0.00 N ATOM 1073 CA LEU A 71 -30.172 20.796 -13.194 1.00 0.00 C ATOM 1074 C LEU A 71 -30.743 19.363 -13.225 1.00 0.00 C ATOM 1075 O LEU A 71 -30.087 18.458 -13.780 1.00 0.00 O ATOM 1076 CB LEU A 71 -30.765 21.647 -14.342 1.00 0.00 C ATOM 1077 CG LEU A 71 -30.547 23.166 -14.240 1.00 0.00 C ATOM 1078 CD1 LEU A 71 -31.228 23.851 -15.424 1.00 0.00 C ATOM 1079 CD2 LEU A 71 -31.156 23.758 -12.967 1.00 0.00 C ATOM 1080 OXT LEU A 71 -31.856 19.166 -12.681 1.00 0.00 O ATOM 0 H LEU A 71 -28.325 20.255 -14.003 1.00 0.00 H new ATOM 0 HA LEU A 71 -30.467 21.219 -12.234 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -30.336 21.301 -15.282 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -31.837 21.457 -14.392 1.00 0.00 H new ATOM 0 HG LEU A 71 -29.470 23.333 -14.230 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -31.077 24.928 -15.357 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -30.798 23.481 -16.355 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -32.296 23.633 -15.406 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -30.975 24.833 -12.943 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -32.230 23.571 -12.956 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -30.698 23.293 -12.094 1.00 0.00 H new TER 1092 LEU A 71