USER MOD reduce.3.24.130724 H: found=0, std=0, add=802, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 802 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 92 SER OG : rot -14:sc= 0.803 USER MOD Set 1.2: A 97 TYR OH : rot 120:sc= 0.84 USER MOD Set 2.1: A 84 THR OG1 : rot 17:sc= 1.68 USER MOD Set 2.2: A 101 TYR OH : rot 123:sc= 0.781 USER MOD Set 3.1: A 54 HIS : no HE2:sc= -4.5! C(o=-9.4!,f=-18!) USER MOD Set 3.2: A 80 HIS : no HD1:sc= -4.94! C(o=-9.4!,f=-14!) USER MOD Set 4.1: A 64 THR OG1 : rot -40:sc= -0.345 USER MOD Set 4.2: A 65 THR OG1 : rot 84:sc= 0.159 USER MOD Set 5.1: A 58 GLN : amide:sc= -1.57! C(o=-1.6!,f=-1.5!) USER MOD Set 5.2: A 62 MET CE :methyl -139:sc= 0 (180deg=0) USER MOD Set 6.1: A 2 SER OG : rot 180:sc= -0.0146 USER MOD Set 6.2: A 3 ASN : amide:sc= 0 X(o=-0.015,f=-0.015) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -160:sc= -0.0482 (180deg=-0.422) USER MOD Single : A 4 THR OG1 : rot 2:sc= 0.894 USER MOD Single : A 5 THR OG1 : rot 34:sc= 0.325 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0.161 USER MOD Single : A 22 GLN : amide:sc= -0.0977 X(o=-0.098,f=-0.37) USER MOD Single : A 25 ASN : amide:sc= -0.426 K(o=-0.43,f=-4!) USER MOD Single : A 26 GLN : amide:sc= -0.105 K(o=-0.11,f=-0.64) USER MOD Single : A 28 HIS : no HD1:sc= -0.644 K(o=-0.64,f=-1.3) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 160:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 CYS SG : rot 180:sc= -0.0843 USER MOD Single : A 47 LYS NZ :NH3+ -124:sc= -0.673 (180deg=-2.57!) USER MOD Single : A 57 SER OG : rot -26:sc= 0.567 USER MOD Single : A 61 SER OG : rot -16:sc= 1.11 USER MOD Single : A 69 ASN : amide:sc= -0.14 X(o=-0.14,f=-0.0091) USER MOD Single : A 72 HIS : no HD1:sc= -3.67! C(o=-3.7!,f=-5.8!) USER MOD Single : A 74 GLN :FLIP amide:sc= -1.7 F(o=-3.9!,f=-1.7) USER MOD Single : A 75 CYS SG : rot 180:sc= -0.352 USER MOD Single : A 77 THR OG1 : rot 31:sc= 0.816 USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 ASN : amide:sc= -0.813 X(o=-0.81,f=-1.3) USER MOD Single : A 85 CYS SG : rot 28:sc= 0.962 USER MOD Single : A 89 THR OG1 : rot -170:sc= 0 USER MOD Single : A 93 CYS SG : rot -4:sc= 0.158 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 GLN : amide:sc= -0.0754 X(o=-0.075,f=-0.15) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.492 1.396 -5.268 1.00 1.00 N ATOM 2 CA MET A 1 12.227 0.938 -5.910 1.00 1.00 C ATOM 3 C MET A 1 11.080 1.112 -4.914 1.00 1.00 C ATOM 4 O MET A 1 10.558 0.137 -4.372 1.00 1.00 O ATOM 5 CB MET A 1 12.367 -0.540 -6.313 1.00 1.00 C ATOM 6 CG MET A 1 13.452 -0.691 -7.389 1.00 1.00 C ATOM 7 SD MET A 1 13.619 -2.442 -7.847 1.00 1.00 S ATOM 8 CE MET A 1 12.363 -2.509 -9.156 1.00 1.00 C ATOM 0 H1 MET A 1 14.198 1.606 -6.002 1.00 1.00 H new ATOM 0 H2 MET A 1 13.307 2.254 -4.710 1.00 1.00 H new ATOM 0 H3 MET A 1 13.855 0.648 -4.643 1.00 1.00 H new ATOM 0 HA MET A 1 12.020 1.526 -6.804 1.00 1.00 H new ATOM 0 HB2 MET A 1 12.623 -1.141 -5.440 1.00 1.00 H new ATOM 0 HB3 MET A 1 11.415 -0.914 -6.690 1.00 1.00 H new ATOM 0 HG2 MET A 1 13.193 -0.099 -8.266 1.00 1.00 H new ATOM 0 HG3 MET A 1 14.403 -0.310 -7.017 1.00 1.00 H new ATOM 0 HE1 MET A 1 12.317 -3.518 -9.565 1.00 1.00 H new ATOM 0 HE2 MET A 1 11.391 -2.241 -8.742 1.00 1.00 H new ATOM 0 HE3 MET A 1 12.625 -1.808 -9.948 1.00 1.00 H new ATOM 20 N SER A 2 10.694 2.365 -4.678 1.00 1.00 N ATOM 21 CA SER A 2 9.610 2.663 -3.743 1.00 1.00 C ATOM 22 C SER A 2 8.301 2.037 -4.218 1.00 1.00 C ATOM 23 O SER A 2 7.529 1.509 -3.418 1.00 1.00 O ATOM 24 CB SER A 2 9.436 4.182 -3.621 1.00 1.00 C ATOM 25 OG SER A 2 9.132 4.723 -4.900 1.00 1.00 O ATOM 0 H SER A 2 11.112 3.185 -5.118 1.00 1.00 H new ATOM 0 HA SER A 2 9.866 2.243 -2.771 1.00 1.00 H new ATOM 0 HB2 SER A 2 8.637 4.413 -2.916 1.00 1.00 H new ATOM 0 HB3 SER A 2 10.347 4.634 -3.229 1.00 1.00 H new ATOM 0 HG SER A 2 9.018 5.694 -4.826 1.00 1.00 H new ATOM 31 N ASN A 3 8.054 2.105 -5.530 1.00 1.00 N ATOM 32 CA ASN A 3 6.829 1.549 -6.123 1.00 1.00 C ATOM 33 C ASN A 3 7.034 0.078 -6.491 1.00 1.00 C ATOM 34 O ASN A 3 6.780 -0.333 -7.625 1.00 1.00 O ATOM 35 CB ASN A 3 6.459 2.354 -7.378 1.00 1.00 C ATOM 36 CG ASN A 3 6.218 3.817 -7.016 1.00 1.00 C ATOM 37 OD1 ASN A 3 5.189 4.151 -6.428 1.00 1.00 O ATOM 38 ND2 ASN A 3 7.113 4.713 -7.329 1.00 1.00 N ATOM 0 H ASN A 3 8.685 2.539 -6.203 1.00 1.00 H new ATOM 0 HA ASN A 3 6.020 1.615 -5.395 1.00 1.00 H new ATOM 0 HB2 ASN A 3 7.260 2.281 -8.114 1.00 1.00 H new ATOM 0 HB3 ASN A 3 5.564 1.934 -7.837 1.00 1.00 H new ATOM 0 HD21 ASN A 3 6.961 5.692 -7.087 1.00 1.00 H new ATOM 0 HD22 ASN A 3 7.965 4.435 -7.816 1.00 1.00 H new ATOM 45 N THR A 4 7.525 -0.714 -5.535 1.00 1.00 N ATOM 46 CA THR A 4 7.783 -2.133 -5.793 1.00 1.00 C ATOM 47 C THR A 4 6.497 -2.837 -6.232 1.00 1.00 C ATOM 48 O THR A 4 5.723 -3.296 -5.392 1.00 1.00 O ATOM 49 CB THR A 4 8.321 -2.798 -4.508 1.00 1.00 C ATOM 50 OG1 THR A 4 9.441 -2.063 -4.038 1.00 1.00 O ATOM 51 CG2 THR A 4 8.756 -4.249 -4.789 1.00 1.00 C ATOM 0 H THR A 4 7.749 -0.404 -4.589 1.00 1.00 H new ATOM 0 HA THR A 4 8.521 -2.219 -6.591 1.00 1.00 H new ATOM 0 HB THR A 4 7.529 -2.805 -3.759 1.00 1.00 H new ATOM 0 HG1 THR A 4 9.588 -1.285 -4.616 1.00 1.00 H new ATOM 0 HG21 THR A 4 9.132 -4.700 -3.871 1.00 1.00 H new ATOM 0 HG22 THR A 4 7.902 -4.821 -5.151 1.00 1.00 H new ATOM 0 HG23 THR A 4 9.542 -4.253 -5.544 1.00 1.00 H new ATOM 59 N THR A 5 6.267 -2.904 -7.550 1.00 1.00 N ATOM 60 CA THR A 5 5.058 -3.541 -8.106 1.00 1.00 C ATOM 61 C THR A 5 5.415 -4.414 -9.312 1.00 1.00 C ATOM 62 O THR A 5 6.079 -3.962 -10.245 1.00 1.00 O ATOM 63 CB THR A 5 4.057 -2.458 -8.543 1.00 1.00 C ATOM 64 OG1 THR A 5 4.655 -1.639 -9.539 1.00 1.00 O ATOM 65 CG2 THR A 5 3.661 -1.593 -7.338 1.00 1.00 C ATOM 0 H THR A 5 6.901 -2.526 -8.254 1.00 1.00 H new ATOM 0 HA THR A 5 4.612 -4.169 -7.335 1.00 1.00 H new ATOM 0 HB THR A 5 3.164 -2.936 -8.947 1.00 1.00 H new ATOM 0 HG1 THR A 5 5.249 -2.183 -10.097 1.00 1.00 H new ATOM 0 HG21 THR A 5 2.952 -0.829 -7.656 1.00 1.00 H new ATOM 0 HG22 THR A 5 3.200 -2.221 -6.575 1.00 1.00 H new ATOM 0 HG23 THR A 5 4.549 -1.115 -6.926 1.00 1.00 H new ATOM 73 N TRP A 6 4.944 -5.661 -9.288 1.00 1.00 N ATOM 74 CA TRP A 6 5.176 -6.612 -10.376 1.00 1.00 C ATOM 75 C TRP A 6 4.161 -6.376 -11.493 1.00 1.00 C ATOM 76 O TRP A 6 3.059 -5.884 -11.254 1.00 1.00 O ATOM 77 CB TRP A 6 5.040 -8.057 -9.855 1.00 1.00 C ATOM 78 CG TRP A 6 5.856 -8.223 -8.603 1.00 1.00 C ATOM 79 CD1 TRP A 6 5.360 -8.251 -7.339 1.00 1.00 C ATOM 80 CD2 TRP A 6 7.299 -8.387 -8.474 1.00 1.00 C ATOM 81 NE1 TRP A 6 6.404 -8.425 -6.451 1.00 1.00 N ATOM 82 CE2 TRP A 6 7.619 -8.513 -7.101 1.00 1.00 C ATOM 83 CE3 TRP A 6 8.351 -8.440 -9.406 1.00 1.00 C ATOM 84 CZ2 TRP A 6 8.934 -8.683 -6.668 1.00 1.00 C ATOM 85 CZ3 TRP A 6 9.677 -8.611 -8.974 1.00 1.00 C ATOM 86 CH2 TRP A 6 9.967 -8.734 -7.608 1.00 1.00 C ATOM 0 H TRP A 6 4.393 -6.039 -8.517 1.00 1.00 H new ATOM 0 HA TRP A 6 6.184 -6.465 -10.763 1.00 1.00 H new ATOM 0 HB2 TRP A 6 3.993 -8.283 -9.651 1.00 1.00 H new ATOM 0 HB3 TRP A 6 5.376 -8.761 -10.616 1.00 1.00 H new ATOM 0 HD1 TRP A 6 4.318 -8.153 -7.071 1.00 1.00 H new ATOM 0 HE1 TRP A 6 6.291 -8.482 -5.439 1.00 1.00 H new ATOM 0 HE3 TRP A 6 8.138 -8.349 -10.461 1.00 1.00 H new ATOM 0 HZ2 TRP A 6 9.152 -8.775 -5.614 1.00 1.00 H new ATOM 0 HZ3 TRP A 6 10.477 -8.648 -9.698 1.00 1.00 H new ATOM 0 HH2 TRP A 6 10.988 -8.868 -7.282 1.00 1.00 H new ATOM 97 N GLY A 7 4.554 -6.728 -12.718 1.00 1.00 N ATOM 98 CA GLY A 7 3.697 -6.555 -13.893 1.00 1.00 C ATOM 99 C GLY A 7 3.912 -5.184 -14.513 1.00 1.00 C ATOM 100 O GLY A 7 4.686 -4.375 -13.998 1.00 1.00 O ATOM 0 H GLY A 7 5.466 -7.137 -12.923 1.00 1.00 H new ATOM 0 HA2 GLY A 7 3.916 -7.331 -14.627 1.00 1.00 H new ATOM 0 HA3 GLY A 7 2.651 -6.672 -13.608 1.00 1.00 H new ATOM 104 N LEU A 8 3.237 -4.928 -15.632 1.00 1.00 N ATOM 105 CA LEU A 8 3.375 -3.649 -16.330 1.00 1.00 C ATOM 106 C LEU A 8 2.934 -2.508 -15.399 1.00 1.00 C ATOM 107 O LEU A 8 1.991 -2.650 -14.620 1.00 1.00 O ATOM 108 CB LEU A 8 2.537 -3.670 -17.643 1.00 1.00 C ATOM 109 CG LEU A 8 3.293 -4.389 -18.789 1.00 1.00 C ATOM 110 CD1 LEU A 8 3.618 -5.842 -18.393 1.00 1.00 C ATOM 111 CD2 LEU A 8 2.420 -4.378 -20.057 1.00 1.00 C ATOM 0 H LEU A 8 2.593 -5.584 -16.073 1.00 1.00 H new ATOM 0 HA LEU A 8 4.418 -3.484 -16.602 1.00 1.00 H new ATOM 0 HB2 LEU A 8 1.587 -4.172 -17.461 1.00 1.00 H new ATOM 0 HB3 LEU A 8 2.305 -2.648 -17.944 1.00 1.00 H new ATOM 0 HG LEU A 8 4.229 -3.865 -18.981 1.00 1.00 H new ATOM 0 HD11 LEU A 8 4.149 -6.332 -19.209 1.00 1.00 H new ATOM 0 HD12 LEU A 8 4.244 -5.845 -17.500 1.00 1.00 H new ATOM 0 HD13 LEU A 8 2.692 -6.379 -18.189 1.00 1.00 H new ATOM 0 HD21 LEU A 8 2.948 -4.883 -20.866 1.00 1.00 H new ATOM 0 HD22 LEU A 8 1.482 -4.895 -19.857 1.00 1.00 H new ATOM 0 HD23 LEU A 8 2.212 -3.348 -20.346 1.00 1.00 H new ATOM 123 N GLN A 9 3.642 -1.378 -15.497 1.00 1.00 N ATOM 124 CA GLN A 9 3.354 -0.195 -14.678 1.00 1.00 C ATOM 125 C GLN A 9 2.310 0.676 -15.367 1.00 1.00 C ATOM 126 O GLN A 9 2.507 1.109 -16.502 1.00 1.00 O ATOM 127 CB GLN A 9 4.661 0.607 -14.442 1.00 1.00 C ATOM 128 CG GLN A 9 5.308 1.052 -15.777 1.00 1.00 C ATOM 129 CD GLN A 9 6.702 1.630 -15.530 1.00 1.00 C ATOM 130 OE1 GLN A 9 6.853 2.844 -15.387 1.00 1.00 O ATOM 131 NE2 GLN A 9 7.730 0.831 -15.478 1.00 1.00 N ATOM 0 H GLN A 9 4.424 -1.257 -16.140 1.00 1.00 H new ATOM 0 HA GLN A 9 2.957 -0.512 -13.714 1.00 1.00 H new ATOM 0 HB2 GLN A 9 4.445 1.484 -13.832 1.00 1.00 H new ATOM 0 HB3 GLN A 9 5.367 -0.005 -13.881 1.00 1.00 H new ATOM 0 HG2 GLN A 9 5.375 0.202 -16.456 1.00 1.00 H new ATOM 0 HG3 GLN A 9 4.679 1.799 -16.262 1.00 1.00 H new ATOM 0 HE21 GLN A 9 7.601 -0.174 -15.597 1.00 1.00 H new ATOM 0 HE22 GLN A 9 8.663 1.210 -15.318 1.00 1.00 H new ATOM 140 N ARG A 10 1.174 0.929 -14.696 1.00 1.00 N ATOM 141 CA ARG A 10 0.108 1.768 -15.281 1.00 1.00 C ATOM 142 C ARG A 10 -0.563 2.566 -14.154 1.00 1.00 C ATOM 143 O ARG A 10 -0.866 2.021 -13.093 1.00 1.00 O ATOM 144 CB ARG A 10 -0.940 0.910 -16.022 1.00 1.00 C ATOM 145 CG ARG A 10 -0.282 0.026 -17.098 1.00 1.00 C ATOM 146 CD ARG A 10 -1.352 -0.797 -17.832 1.00 1.00 C ATOM 147 NE ARG A 10 -0.718 -1.676 -18.824 1.00 1.00 N ATOM 148 CZ ARG A 10 -1.406 -2.613 -19.488 1.00 1.00 C ATOM 149 NH1 ARG A 10 -2.682 -2.775 -19.270 1.00 1.00 N ATOM 150 NH2 ARG A 10 -0.799 -3.374 -20.359 1.00 1.00 N ATOM 0 H ARG A 10 0.969 0.572 -13.763 1.00 1.00 H new ATOM 0 HA ARG A 10 0.551 2.446 -16.011 1.00 1.00 H new ATOM 0 HB2 ARG A 10 -1.470 0.281 -15.306 1.00 1.00 H new ATOM 0 HB3 ARG A 10 -1.682 1.560 -16.486 1.00 1.00 H new ATOM 0 HG2 ARG A 10 0.260 0.649 -17.809 1.00 1.00 H new ATOM 0 HG3 ARG A 10 0.447 -0.640 -16.637 1.00 1.00 H new ATOM 0 HD2 ARG A 10 -1.919 -1.392 -17.116 1.00 1.00 H new ATOM 0 HD3 ARG A 10 -2.060 -0.131 -18.324 1.00 1.00 H new ATOM 0 HE ARG A 10 0.279 -1.569 -19.013 1.00 1.00 H new ATOM 0 HH11 ARG A 10 -3.162 -2.186 -18.590 1.00 1.00 H new ATOM 0 HH12 ARG A 10 -3.200 -3.491 -19.780 1.00 1.00 H new ATOM 0 HH21 ARG A 10 0.199 -3.254 -20.533 1.00 1.00 H new ATOM 0 HH22 ARG A 10 -1.323 -4.088 -20.865 1.00 1.00 H new ATOM 164 N ASP A 11 -0.765 3.862 -14.385 1.00 1.00 N ATOM 165 CA ASP A 11 -1.367 4.736 -13.380 1.00 1.00 C ATOM 166 C ASP A 11 -2.781 4.269 -13.016 1.00 1.00 C ATOM 167 O ASP A 11 -3.205 4.345 -11.862 1.00 1.00 O ATOM 168 CB ASP A 11 -1.429 6.167 -13.951 1.00 1.00 C ATOM 169 CG ASP A 11 -1.979 7.146 -12.912 1.00 1.00 C ATOM 170 OD1 ASP A 11 -1.364 7.279 -11.867 1.00 1.00 O ATOM 171 OD2 ASP A 11 -3.007 7.749 -13.179 1.00 1.00 O ATOM 0 H ASP A 11 -0.521 4.330 -15.258 1.00 1.00 H new ATOM 0 HA ASP A 11 -0.760 4.708 -12.475 1.00 1.00 H new ATOM 0 HB2 ASP A 11 -0.433 6.482 -14.262 1.00 1.00 H new ATOM 0 HB3 ASP A 11 -2.060 6.181 -14.840 1.00 1.00 H new ATOM 176 N ILE A 12 -3.507 3.815 -14.041 1.00 1.00 N ATOM 177 CA ILE A 12 -4.900 3.361 -13.879 1.00 1.00 C ATOM 178 C ILE A 12 -4.959 1.965 -13.211 1.00 1.00 C ATOM 179 O ILE A 12 -4.317 1.015 -13.659 1.00 1.00 O ATOM 180 CB ILE A 12 -5.641 3.335 -15.282 1.00 1.00 C ATOM 181 CG1 ILE A 12 -4.632 3.002 -16.449 1.00 1.00 C ATOM 182 CG2 ILE A 12 -6.366 4.686 -15.553 1.00 1.00 C ATOM 183 CD1 ILE A 12 -3.861 4.245 -16.975 1.00 1.00 C ATOM 0 H ILE A 12 -3.156 3.750 -14.997 1.00 1.00 H new ATOM 0 HA ILE A 12 -5.411 4.069 -13.226 1.00 1.00 H new ATOM 0 HB ILE A 12 -6.392 2.546 -15.248 1.00 1.00 H new ATOM 0 HG12 ILE A 12 -3.914 2.261 -16.098 1.00 1.00 H new ATOM 0 HG13 ILE A 12 -5.180 2.548 -17.274 1.00 1.00 H new ATOM 0 HG21 ILE A 12 -6.866 4.643 -16.521 1.00 1.00 H new ATOM 0 HG22 ILE A 12 -7.104 4.866 -14.771 1.00 1.00 H new ATOM 0 HG23 ILE A 12 -5.637 5.496 -15.557 1.00 1.00 H new ATOM 0 HD11 ILE A 12 -3.186 3.942 -17.775 1.00 1.00 H new ATOM 0 HD12 ILE A 12 -4.571 4.979 -17.357 1.00 1.00 H new ATOM 0 HD13 ILE A 12 -3.285 4.687 -16.162 1.00 1.00 H new ATOM 195 N THR A 13 -5.792 1.866 -12.160 1.00 1.00 N ATOM 196 CA THR A 13 -6.024 0.613 -11.437 1.00 1.00 C ATOM 197 C THR A 13 -6.871 -0.342 -12.315 1.00 1.00 C ATOM 198 O THR A 13 -6.540 -1.525 -12.404 1.00 1.00 O ATOM 199 CB THR A 13 -6.737 0.920 -10.069 1.00 1.00 C ATOM 200 OG1 THR A 13 -7.048 2.304 -10.012 1.00 1.00 O ATOM 201 CG2 THR A 13 -5.833 0.574 -8.867 1.00 1.00 C ATOM 0 H THR A 13 -6.322 2.656 -11.791 1.00 1.00 H new ATOM 0 HA THR A 13 -5.074 0.123 -11.222 1.00 1.00 H new ATOM 0 HB THR A 13 -7.638 0.309 -10.013 1.00 1.00 H new ATOM 0 HG1 THR A 13 -7.495 2.504 -9.163 1.00 1.00 H new ATOM 0 HG21 THR A 13 -6.359 0.799 -7.939 1.00 1.00 H new ATOM 0 HG22 THR A 13 -5.582 -0.486 -8.894 1.00 1.00 H new ATOM 0 HG23 THR A 13 -4.918 1.164 -8.918 1.00 1.00 H new ATOM 209 N PRO A 14 -7.934 0.142 -12.978 1.00 1.00 N ATOM 210 CA PRO A 14 -8.798 -0.705 -13.879 1.00 1.00 C ATOM 211 C PRO A 14 -8.029 -1.792 -14.630 1.00 1.00 C ATOM 212 O PRO A 14 -8.540 -2.898 -14.822 1.00 1.00 O ATOM 213 CB PRO A 14 -9.327 0.356 -14.862 1.00 1.00 C ATOM 214 CG PRO A 14 -9.628 1.520 -13.968 1.00 1.00 C ATOM 215 CD PRO A 14 -8.462 1.542 -12.944 1.00 1.00 C ATOM 0 HA PRO A 14 -9.555 -1.263 -13.328 1.00 1.00 H new ATOM 0 HB2 PRO A 14 -8.586 0.610 -15.620 1.00 1.00 H new ATOM 0 HB3 PRO A 14 -10.216 0.011 -15.389 1.00 1.00 H new ATOM 0 HG2 PRO A 14 -9.677 2.451 -14.533 1.00 1.00 H new ATOM 0 HG3 PRO A 14 -10.590 1.399 -13.470 1.00 1.00 H new ATOM 0 HD2 PRO A 14 -7.697 2.266 -13.224 1.00 1.00 H new ATOM 0 HD3 PRO A 14 -8.809 1.815 -11.947 1.00 1.00 H new ATOM 223 N ARG A 15 -6.801 -1.464 -15.059 1.00 1.00 N ATOM 224 CA ARG A 15 -5.960 -2.416 -15.803 1.00 1.00 C ATOM 225 C ARG A 15 -5.001 -3.113 -14.839 1.00 1.00 C ATOM 226 O ARG A 15 -4.426 -2.470 -13.961 1.00 1.00 O ATOM 227 CB ARG A 15 -5.162 -1.670 -16.879 1.00 1.00 C ATOM 228 CG ARG A 15 -6.122 -0.932 -17.824 1.00 1.00 C ATOM 229 CD ARG A 15 -5.326 -0.174 -18.898 1.00 1.00 C ATOM 230 NE ARG A 15 -4.649 -1.124 -19.777 1.00 1.00 N ATOM 231 CZ ARG A 15 -3.865 -0.723 -20.780 1.00 1.00 C ATOM 232 NH1 ARG A 15 -3.650 0.549 -20.988 1.00 1.00 N ATOM 233 NH2 ARG A 15 -3.305 -1.611 -21.555 1.00 1.00 N ATOM 0 H ARG A 15 -6.369 -0.553 -14.905 1.00 1.00 H new ATOM 0 HA ARG A 15 -6.595 -3.162 -16.281 1.00 1.00 H new ATOM 0 HB2 ARG A 15 -4.480 -0.960 -16.411 1.00 1.00 H new ATOM 0 HB3 ARG A 15 -4.551 -2.374 -17.444 1.00 1.00 H new ATOM 0 HG2 ARG A 15 -6.799 -1.644 -18.296 1.00 1.00 H new ATOM 0 HG3 ARG A 15 -6.738 -0.234 -17.257 1.00 1.00 H new ATOM 0 HD2 ARG A 15 -5.995 0.460 -19.480 1.00 1.00 H new ATOM 0 HD3 ARG A 15 -4.595 0.483 -18.426 1.00 1.00 H new ATOM 0 HE ARG A 15 -4.779 -2.123 -19.620 1.00 1.00 H new ATOM 0 HH11 ARG A 15 -4.083 1.245 -20.381 1.00 1.00 H new ATOM 0 HH12 ARG A 15 -3.049 0.846 -21.757 1.00 1.00 H new ATOM 0 HH21 ARG A 15 -3.468 -2.605 -21.392 1.00 1.00 H new ATOM 0 HH22 ARG A 15 -2.705 -1.311 -22.323 1.00 1.00 H new ATOM 247 N LEU A 16 -4.836 -4.431 -15.010 1.00 1.00 N ATOM 248 CA LEU A 16 -3.943 -5.243 -14.160 1.00 1.00 C ATOM 249 C LEU A 16 -2.890 -5.930 -15.027 1.00 1.00 C ATOM 250 O LEU A 16 -3.210 -6.547 -16.043 1.00 1.00 O ATOM 251 CB LEU A 16 -4.780 -6.288 -13.386 1.00 1.00 C ATOM 252 CG LEU A 16 -3.869 -7.225 -12.488 1.00 1.00 C ATOM 253 CD1 LEU A 16 -4.530 -7.476 -11.114 1.00 1.00 C ATOM 254 CD2 LEU A 16 -3.639 -8.596 -13.176 1.00 1.00 C ATOM 0 H LEU A 16 -5.313 -4.966 -15.736 1.00 1.00 H new ATOM 0 HA LEU A 16 -3.433 -4.600 -13.442 1.00 1.00 H new ATOM 0 HB2 LEU A 16 -5.507 -5.776 -12.756 1.00 1.00 H new ATOM 0 HB3 LEU A 16 -5.343 -6.898 -14.092 1.00 1.00 H new ATOM 0 HG LEU A 16 -2.915 -6.716 -12.353 1.00 1.00 H new ATOM 0 HD11 LEU A 16 -3.888 -8.121 -10.514 1.00 1.00 H new ATOM 0 HD12 LEU A 16 -4.672 -6.526 -10.600 1.00 1.00 H new ATOM 0 HD13 LEU A 16 -5.497 -7.959 -11.258 1.00 1.00 H new ATOM 0 HD21 LEU A 16 -3.011 -9.221 -12.541 1.00 1.00 H new ATOM 0 HD22 LEU A 16 -4.598 -9.088 -13.336 1.00 1.00 H new ATOM 0 HD23 LEU A 16 -3.146 -8.443 -14.136 1.00 1.00 H new ATOM 266 N GLY A 17 -1.623 -5.819 -14.604 1.00 1.00 N ATOM 267 CA GLY A 17 -0.495 -6.426 -15.316 1.00 1.00 C ATOM 268 C GLY A 17 -0.174 -7.786 -14.725 1.00 1.00 C ATOM 269 O GLY A 17 -0.618 -8.117 -13.626 1.00 1.00 O ATOM 0 H GLY A 17 -1.354 -5.308 -13.763 1.00 1.00 H new ATOM 0 HA2 GLY A 17 -0.736 -6.529 -16.374 1.00 1.00 H new ATOM 0 HA3 GLY A 17 0.378 -5.777 -15.250 1.00 1.00 H new ATOM 273 N ALA A 18 0.596 -8.570 -15.465 1.00 1.00 N ATOM 274 CA ALA A 18 0.979 -9.908 -15.031 1.00 1.00 C ATOM 275 C ALA A 18 1.995 -10.477 -16.012 1.00 1.00 C ATOM 276 O ALA A 18 1.805 -10.358 -17.223 1.00 1.00 O ATOM 277 CB ALA A 18 -0.272 -10.807 -15.001 1.00 1.00 C ATOM 0 H ALA A 18 0.971 -8.301 -16.375 1.00 1.00 H new ATOM 0 HA ALA A 18 1.419 -9.865 -14.035 1.00 1.00 H new ATOM 0 HB1 ALA A 18 0.008 -11.809 -14.677 1.00 1.00 H new ATOM 0 HB2 ALA A 18 -1.002 -10.392 -14.306 1.00 1.00 H new ATOM 0 HB3 ALA A 18 -0.708 -10.857 -15.999 1.00 1.00 H new ATOM 283 N ARG A 19 3.070 -11.107 -15.500 1.00 1.00 N ATOM 284 CA ARG A 19 4.102 -11.709 -16.373 1.00 1.00 C ATOM 285 C ARG A 19 4.499 -13.080 -15.828 1.00 1.00 C ATOM 286 O ARG A 19 4.783 -13.229 -14.638 1.00 1.00 O ATOM 287 CB ARG A 19 5.350 -10.818 -16.443 1.00 1.00 C ATOM 288 CG ARG A 19 4.984 -9.418 -16.945 1.00 1.00 C ATOM 289 CD ARG A 19 6.246 -8.531 -16.964 1.00 1.00 C ATOM 290 NE ARG A 19 6.718 -8.305 -15.598 1.00 1.00 N ATOM 291 CZ ARG A 19 7.810 -7.582 -15.342 1.00 1.00 C ATOM 292 NH1 ARG A 19 8.486 -7.031 -16.318 1.00 1.00 N ATOM 293 NH2 ARG A 19 8.206 -7.421 -14.110 1.00 1.00 N ATOM 0 H ARG A 19 3.247 -11.213 -14.501 1.00 1.00 H new ATOM 0 HA ARG A 19 3.685 -11.809 -17.375 1.00 1.00 H new ATOM 0 HB2 ARG A 19 5.810 -10.748 -15.457 1.00 1.00 H new ATOM 0 HB3 ARG A 19 6.088 -11.267 -17.108 1.00 1.00 H new ATOM 0 HG2 ARG A 19 4.555 -9.480 -17.945 1.00 1.00 H new ATOM 0 HG3 ARG A 19 4.225 -8.976 -16.299 1.00 1.00 H new ATOM 0 HD2 ARG A 19 7.028 -9.009 -17.554 1.00 1.00 H new ATOM 0 HD3 ARG A 19 6.024 -7.578 -17.443 1.00 1.00 H new ATOM 0 HE ARG A 19 6.198 -8.711 -14.820 1.00 1.00 H new ATOM 0 HH11 ARG A 19 8.179 -7.153 -17.283 1.00 1.00 H new ATOM 0 HH12 ARG A 19 9.320 -6.480 -16.113 1.00 1.00 H new ATOM 0 HH21 ARG A 19 7.682 -7.847 -13.346 1.00 1.00 H new ATOM 0 HH22 ARG A 19 9.040 -6.869 -13.910 1.00 1.00 H new ATOM 307 N LEU A 20 4.502 -14.076 -16.716 1.00 1.00 N ATOM 308 CA LEU A 20 4.843 -15.460 -16.372 1.00 1.00 C ATOM 309 C LEU A 20 6.172 -15.838 -17.019 1.00 1.00 C ATOM 310 O LEU A 20 6.536 -15.305 -18.068 1.00 1.00 O ATOM 311 CB LEU A 20 3.723 -16.393 -16.879 1.00 1.00 C ATOM 312 CG LEU A 20 2.335 -15.898 -16.395 1.00 1.00 C ATOM 313 CD1 LEU A 20 1.251 -16.855 -16.920 1.00 1.00 C ATOM 314 CD2 LEU A 20 2.275 -15.827 -14.847 1.00 1.00 C ATOM 0 H LEU A 20 4.267 -13.946 -17.700 1.00 1.00 H new ATOM 0 HA LEU A 20 4.938 -15.560 -15.291 1.00 1.00 H new ATOM 0 HB2 LEU A 20 3.741 -16.432 -17.968 1.00 1.00 H new ATOM 0 HB3 LEU A 20 3.898 -17.407 -16.521 1.00 1.00 H new ATOM 0 HG LEU A 20 2.165 -14.893 -16.782 1.00 1.00 H new ATOM 0 HD11 LEU A 20 0.271 -16.514 -16.584 1.00 1.00 H new ATOM 0 HD12 LEU A 20 1.276 -16.870 -18.010 1.00 1.00 H new ATOM 0 HD13 LEU A 20 1.436 -17.859 -16.539 1.00 1.00 H new ATOM 0 HD21 LEU A 20 1.290 -15.477 -14.537 1.00 1.00 H new ATOM 0 HD22 LEU A 20 2.456 -16.818 -14.430 1.00 1.00 H new ATOM 0 HD23 LEU A 20 3.036 -15.136 -14.485 1.00 1.00 H new ATOM 326 N VAL A 21 6.874 -16.783 -16.386 1.00 1.00 N ATOM 327 CA VAL A 21 8.165 -17.287 -16.880 1.00 1.00 C ATOM 328 C VAL A 21 7.949 -18.696 -17.425 1.00 1.00 C ATOM 329 O VAL A 21 7.237 -19.502 -16.824 1.00 1.00 O ATOM 330 CB VAL A 21 9.206 -17.293 -15.742 1.00 1.00 C ATOM 331 CG1 VAL A 21 10.570 -17.805 -16.259 1.00 1.00 C ATOM 332 CG2 VAL A 21 9.356 -15.864 -15.190 1.00 1.00 C ATOM 0 H VAL A 21 6.566 -17.221 -15.518 1.00 1.00 H new ATOM 0 HA VAL A 21 8.545 -16.641 -17.672 1.00 1.00 H new ATOM 0 HB VAL A 21 8.868 -17.960 -14.950 1.00 1.00 H new ATOM 0 HG11 VAL A 21 11.293 -17.803 -15.443 1.00 1.00 H new ATOM 0 HG12 VAL A 21 10.457 -18.820 -16.641 1.00 1.00 H new ATOM 0 HG13 VAL A 21 10.924 -17.154 -17.059 1.00 1.00 H new ATOM 0 HG21 VAL A 21 10.091 -15.860 -14.385 1.00 1.00 H new ATOM 0 HG22 VAL A 21 9.688 -15.199 -15.987 1.00 1.00 H new ATOM 0 HG23 VAL A 21 8.396 -15.519 -14.807 1.00 1.00 H new ATOM 342 N GLN A 22 8.564 -18.984 -18.568 1.00 1.00 N ATOM 343 CA GLN A 22 8.440 -20.296 -19.205 1.00 1.00 C ATOM 344 C GLN A 22 9.251 -21.337 -18.424 1.00 1.00 C ATOM 345 O GLN A 22 10.370 -21.063 -17.989 1.00 1.00 O ATOM 346 CB GLN A 22 8.945 -20.206 -20.666 1.00 1.00 C ATOM 347 CG GLN A 22 8.628 -21.504 -21.449 1.00 1.00 C ATOM 348 CD GLN A 22 7.120 -21.661 -21.653 1.00 1.00 C ATOM 349 OE1 GLN A 22 6.443 -20.708 -22.042 1.00 1.00 O ATOM 350 NE2 GLN A 22 6.550 -22.806 -21.397 1.00 1.00 N ATOM 0 H GLN A 22 9.156 -18.326 -19.075 1.00 1.00 H new ATOM 0 HA GLN A 22 7.394 -20.603 -19.206 1.00 1.00 H new ATOM 0 HB2 GLN A 22 8.479 -19.355 -21.163 1.00 1.00 H new ATOM 0 HB3 GLN A 22 10.020 -20.028 -20.672 1.00 1.00 H new ATOM 0 HG2 GLN A 22 9.130 -21.482 -22.416 1.00 1.00 H new ATOM 0 HG3 GLN A 22 9.018 -22.365 -20.907 1.00 1.00 H new ATOM 0 HE21 GLN A 22 7.111 -23.594 -21.075 1.00 1.00 H new ATOM 0 HE22 GLN A 22 5.543 -22.913 -21.519 1.00 1.00 H new ATOM 359 N GLU A 23 8.680 -22.533 -18.262 1.00 1.00 N ATOM 360 CA GLU A 23 9.352 -23.620 -17.544 1.00 1.00 C ATOM 361 C GLU A 23 8.575 -24.924 -17.747 1.00 1.00 C ATOM 362 O GLU A 23 7.488 -25.098 -17.198 1.00 1.00 O ATOM 363 CB GLU A 23 9.445 -23.285 -16.041 1.00 1.00 C ATOM 364 CG GLU A 23 10.277 -24.349 -15.296 1.00 1.00 C ATOM 365 CD GLU A 23 10.416 -23.993 -13.814 1.00 1.00 C ATOM 366 OE1 GLU A 23 10.141 -22.857 -13.458 1.00 1.00 O ATOM 367 OE2 GLU A 23 10.800 -24.868 -13.054 1.00 1.00 O ATOM 0 H GLU A 23 7.755 -22.774 -18.618 1.00 1.00 H new ATOM 0 HA GLU A 23 10.362 -23.740 -17.936 1.00 1.00 H new ATOM 0 HB2 GLU A 23 9.900 -22.303 -15.910 1.00 1.00 H new ATOM 0 HB3 GLU A 23 8.444 -23.233 -15.612 1.00 1.00 H new ATOM 0 HG2 GLU A 23 9.802 -25.325 -15.397 1.00 1.00 H new ATOM 0 HG3 GLU A 23 11.265 -24.427 -15.750 1.00 1.00 H new ATOM 374 N GLY A 24 9.133 -25.834 -18.546 1.00 1.00 N ATOM 375 CA GLY A 24 8.483 -27.109 -18.820 1.00 1.00 C ATOM 376 C GLY A 24 7.257 -26.886 -19.683 1.00 1.00 C ATOM 377 O GLY A 24 7.049 -25.790 -20.204 1.00 1.00 O ATOM 0 H GLY A 24 10.032 -25.709 -19.012 1.00 1.00 H new ATOM 0 HA2 GLY A 24 9.177 -27.780 -19.325 1.00 1.00 H new ATOM 0 HA3 GLY A 24 8.198 -27.591 -17.885 1.00 1.00 H new ATOM 381 N ASN A 25 6.442 -27.928 -19.847 1.00 1.00 N ATOM 382 CA ASN A 25 5.233 -27.829 -20.669 1.00 1.00 C ATOM 383 C ASN A 25 4.077 -27.266 -19.846 1.00 1.00 C ATOM 384 O ASN A 25 2.911 -27.500 -20.163 1.00 1.00 O ATOM 385 CB ASN A 25 4.852 -29.215 -21.208 1.00 1.00 C ATOM 386 CG ASN A 25 5.977 -29.775 -22.076 1.00 1.00 C ATOM 387 OD1 ASN A 25 7.102 -29.275 -22.043 1.00 1.00 O ATOM 388 ND2 ASN A 25 5.735 -30.790 -22.858 1.00 1.00 N ATOM 0 H ASN A 25 6.594 -28.844 -19.426 1.00 1.00 H new ATOM 0 HA ASN A 25 5.434 -27.158 -21.504 1.00 1.00 H new ATOM 0 HB2 ASN A 25 4.652 -29.893 -20.378 1.00 1.00 H new ATOM 0 HB3 ASN A 25 3.934 -29.146 -21.791 1.00 1.00 H new ATOM 0 HD21 ASN A 25 6.478 -31.171 -23.444 1.00 1.00 H new ATOM 0 HD22 ASN A 25 4.803 -31.203 -22.884 1.00 1.00 H new ATOM 395 N GLN A 26 4.408 -26.527 -18.779 1.00 1.00 N ATOM 396 CA GLN A 26 3.392 -25.930 -17.899 1.00 1.00 C ATOM 397 C GLN A 26 3.867 -24.556 -17.418 1.00 1.00 C ATOM 398 O GLN A 26 5.053 -24.356 -17.154 1.00 1.00 O ATOM 399 CB GLN A 26 3.155 -26.867 -16.689 1.00 1.00 C ATOM 400 CG GLN A 26 1.905 -26.435 -15.883 1.00 1.00 C ATOM 401 CD GLN A 26 0.629 -26.693 -16.688 1.00 1.00 C ATOM 402 OE1 GLN A 26 0.494 -27.743 -17.316 1.00 1.00 O ATOM 403 NE2 GLN A 26 -0.312 -25.789 -16.717 1.00 1.00 N ATOM 0 H GLN A 26 5.370 -26.328 -18.504 1.00 1.00 H new ATOM 0 HA GLN A 26 2.458 -25.805 -18.447 1.00 1.00 H new ATOM 0 HB2 GLN A 26 3.029 -27.892 -17.038 1.00 1.00 H new ATOM 0 HB3 GLN A 26 4.031 -26.856 -16.040 1.00 1.00 H new ATOM 0 HG2 GLN A 26 1.865 -26.984 -14.942 1.00 1.00 H new ATOM 0 HG3 GLN A 26 1.975 -25.377 -15.632 1.00 1.00 H new ATOM 0 HE21 GLN A 26 -0.200 -24.919 -16.196 1.00 1.00 H new ATOM 0 HE22 GLN A 26 -1.160 -25.952 -17.260 1.00 1.00 H new ATOM 412 N LEU A 27 2.927 -23.612 -17.303 1.00 1.00 N ATOM 413 CA LEU A 27 3.235 -22.248 -16.851 1.00 1.00 C ATOM 414 C LEU A 27 2.985 -22.137 -15.345 1.00 1.00 C ATOM 415 O LEU A 27 1.967 -22.606 -14.838 1.00 1.00 O ATOM 416 CB LEU A 27 2.340 -21.241 -17.604 1.00 1.00 C ATOM 417 CG LEU A 27 2.447 -21.445 -19.137 1.00 1.00 C ATOM 418 CD1 LEU A 27 1.525 -20.434 -19.844 1.00 1.00 C ATOM 419 CD2 LEU A 27 3.909 -21.262 -19.630 1.00 1.00 C ATOM 0 H LEU A 27 1.942 -23.767 -17.517 1.00 1.00 H new ATOM 0 HA LEU A 27 4.282 -22.025 -17.058 1.00 1.00 H new ATOM 0 HB2 LEU A 27 1.304 -21.362 -17.288 1.00 1.00 H new ATOM 0 HB3 LEU A 27 2.634 -20.223 -17.347 1.00 1.00 H new ATOM 0 HG LEU A 27 2.140 -22.463 -19.376 1.00 1.00 H new ATOM 0 HD11 LEU A 27 1.595 -20.571 -20.923 1.00 1.00 H new ATOM 0 HD12 LEU A 27 0.496 -20.594 -19.523 1.00 1.00 H new ATOM 0 HD13 LEU A 27 1.831 -19.420 -19.586 1.00 1.00 H new ATOM 0 HD21 LEU A 27 3.951 -21.411 -20.709 1.00 1.00 H new ATOM 0 HD22 LEU A 27 4.251 -20.255 -19.390 1.00 1.00 H new ATOM 0 HD23 LEU A 27 4.553 -21.991 -19.138 1.00 1.00 H new ATOM 431 N HIS A 28 3.932 -21.519 -14.637 1.00 1.00 N ATOM 432 CA HIS A 28 3.843 -21.341 -13.185 1.00 1.00 C ATOM 433 C HIS A 28 3.207 -19.994 -12.851 1.00 1.00 C ATOM 434 O HIS A 28 3.769 -18.946 -13.171 1.00 1.00 O ATOM 435 CB HIS A 28 5.270 -21.384 -12.604 1.00 1.00 C ATOM 436 CG HIS A 28 5.863 -22.751 -12.831 1.00 1.00 C ATOM 437 ND1 HIS A 28 6.191 -23.214 -14.095 1.00 1.00 N ATOM 438 CD2 HIS A 28 6.167 -23.774 -11.967 1.00 1.00 C ATOM 439 CE1 HIS A 28 6.664 -24.466 -13.956 1.00 1.00 C ATOM 440 NE2 HIS A 28 6.671 -24.856 -12.680 1.00 1.00 N ATOM 0 H HIS A 28 4.779 -21.129 -15.051 1.00 1.00 H new ATOM 0 HA HIS A 28 3.227 -22.133 -12.758 1.00 1.00 H new ATOM 0 HB2 HIS A 28 5.890 -20.623 -13.078 1.00 1.00 H new ATOM 0 HB3 HIS A 28 5.247 -21.158 -11.538 1.00 1.00 H new ATOM 0 HD2 HIS A 28 6.035 -23.743 -10.896 1.00 1.00 H new ATOM 0 HE1 HIS A 28 6.998 -25.081 -14.778 1.00 1.00 H new ATOM 0 HE2 HIS A 28 6.980 -25.754 -12.308 1.00 1.00 H new ATOM 449 N TYR A 29 2.046 -20.024 -12.176 1.00 1.00 N ATOM 450 CA TYR A 29 1.347 -18.794 -11.765 1.00 1.00 C ATOM 451 C TYR A 29 1.679 -18.504 -10.296 1.00 1.00 C ATOM 452 O TYR A 29 1.169 -19.159 -9.388 1.00 1.00 O ATOM 453 CB TYR A 29 -0.178 -18.950 -11.950 1.00 1.00 C ATOM 454 CG TYR A 29 -0.897 -17.701 -11.431 1.00 1.00 C ATOM 455 CD1 TYR A 29 -1.029 -16.569 -12.251 1.00 1.00 C ATOM 456 CD2 TYR A 29 -1.402 -17.667 -10.118 1.00 1.00 C ATOM 457 CE1 TYR A 29 -1.663 -15.416 -11.766 1.00 1.00 C ATOM 458 CE2 TYR A 29 -2.038 -16.516 -9.639 1.00 1.00 C ATOM 459 CZ TYR A 29 -2.167 -15.393 -10.462 1.00 1.00 C ATOM 460 OH TYR A 29 -2.789 -14.257 -9.984 1.00 1.00 O ATOM 0 H TYR A 29 1.572 -20.885 -11.903 1.00 1.00 H new ATOM 0 HA TYR A 29 1.677 -17.962 -12.387 1.00 1.00 H new ATOM 0 HB2 TYR A 29 -0.411 -19.103 -13.004 1.00 1.00 H new ATOM 0 HB3 TYR A 29 -0.530 -19.832 -11.414 1.00 1.00 H new ATOM 0 HD1 TYR A 29 -0.641 -16.586 -13.259 1.00 1.00 H new ATOM 0 HD2 TYR A 29 -1.299 -18.531 -9.478 1.00 1.00 H new ATOM 0 HE1 TYR A 29 -1.762 -14.547 -12.399 1.00 1.00 H new ATOM 0 HE2 TYR A 29 -2.430 -16.495 -8.633 1.00 1.00 H new ATOM 0 HH TYR A 29 -3.082 -14.408 -9.061 1.00 1.00 H new ATOM 470 N LEU A 30 2.544 -17.507 -10.085 1.00 1.00 N ATOM 471 CA LEU A 30 2.970 -17.094 -8.742 1.00 1.00 C ATOM 472 C LEU A 30 2.060 -15.964 -8.239 1.00 1.00 C ATOM 473 O LEU A 30 2.075 -14.854 -8.771 1.00 1.00 O ATOM 474 CB LEU A 30 4.449 -16.599 -8.813 1.00 1.00 C ATOM 475 CG LEU A 30 5.472 -17.776 -8.765 1.00 1.00 C ATOM 476 CD1 LEU A 30 5.452 -18.521 -7.390 1.00 1.00 C ATOM 477 CD2 LEU A 30 5.194 -18.763 -9.921 1.00 1.00 C ATOM 0 H LEU A 30 2.968 -16.964 -10.837 1.00 1.00 H new ATOM 0 HA LEU A 30 2.900 -17.935 -8.052 1.00 1.00 H new ATOM 0 HB2 LEU A 30 4.596 -16.031 -9.732 1.00 1.00 H new ATOM 0 HB3 LEU A 30 4.642 -15.919 -7.983 1.00 1.00 H new ATOM 0 HG LEU A 30 6.469 -17.352 -8.883 1.00 1.00 H new ATOM 0 HD11 LEU A 30 6.180 -19.332 -7.405 1.00 1.00 H new ATOM 0 HD12 LEU A 30 5.704 -17.821 -6.593 1.00 1.00 H new ATOM 0 HD13 LEU A 30 4.457 -18.930 -7.212 1.00 1.00 H new ATOM 0 HD21 LEU A 30 5.912 -19.582 -9.881 1.00 1.00 H new ATOM 0 HD22 LEU A 30 4.184 -19.161 -9.825 1.00 1.00 H new ATOM 0 HD23 LEU A 30 5.290 -18.243 -10.874 1.00 1.00 H new ATOM 489 N ALA A 31 1.275 -16.266 -7.211 1.00 1.00 N ATOM 490 CA ALA A 31 0.360 -15.296 -6.625 1.00 1.00 C ATOM 491 C ALA A 31 1.129 -14.097 -6.072 1.00 1.00 C ATOM 492 O ALA A 31 0.664 -12.959 -6.135 1.00 1.00 O ATOM 493 CB ALA A 31 -0.415 -15.973 -5.488 1.00 1.00 C ATOM 0 H ALA A 31 1.255 -17.183 -6.764 1.00 1.00 H new ATOM 0 HA ALA A 31 -0.327 -14.942 -7.394 1.00 1.00 H new ATOM 0 HB1 ALA A 31 -1.104 -15.257 -5.041 1.00 1.00 H new ATOM 0 HB2 ALA A 31 -0.977 -16.819 -5.884 1.00 1.00 H new ATOM 0 HB3 ALA A 31 0.285 -16.325 -4.730 1.00 1.00 H new ATOM 499 N ASP A 32 2.308 -14.376 -5.518 1.00 1.00 N ATOM 500 CA ASP A 32 3.153 -13.337 -4.935 1.00 1.00 C ATOM 501 C ASP A 32 3.712 -12.424 -6.026 1.00 1.00 C ATOM 502 O ASP A 32 4.273 -11.368 -5.728 1.00 1.00 O ATOM 503 CB ASP A 32 4.318 -13.997 -4.177 1.00 1.00 C ATOM 504 CG ASP A 32 3.786 -14.867 -3.040 1.00 1.00 C ATOM 505 OD1 ASP A 32 2.870 -14.430 -2.363 1.00 1.00 O ATOM 506 OD2 ASP A 32 4.306 -15.956 -2.862 1.00 1.00 O ATOM 0 H ASP A 32 2.700 -15.316 -5.461 1.00 1.00 H new ATOM 0 HA ASP A 32 2.552 -12.738 -4.251 1.00 1.00 H new ATOM 0 HB2 ASP A 32 4.909 -14.604 -4.863 1.00 1.00 H new ATOM 0 HB3 ASP A 32 4.982 -13.230 -3.777 1.00 1.00 H new ATOM 511 N ARG A 33 3.564 -12.847 -7.296 1.00 1.00 N ATOM 512 CA ARG A 33 4.068 -12.078 -8.458 1.00 1.00 C ATOM 513 C ARG A 33 2.915 -11.446 -9.243 1.00 1.00 C ATOM 514 O ARG A 33 2.809 -11.617 -10.458 1.00 1.00 O ATOM 515 CB ARG A 33 4.890 -13.013 -9.379 1.00 1.00 C ATOM 516 CG ARG A 33 5.655 -12.211 -10.509 1.00 1.00 C ATOM 517 CD ARG A 33 7.178 -12.450 -10.430 1.00 1.00 C ATOM 518 NE ARG A 33 7.881 -11.620 -11.409 1.00 1.00 N ATOM 519 CZ ARG A 33 9.213 -11.655 -11.524 1.00 1.00 C ATOM 520 NH1 ARG A 33 9.925 -12.437 -10.755 1.00 1.00 N ATOM 521 NH2 ARG A 33 9.809 -10.902 -12.408 1.00 1.00 N ATOM 0 H ARG A 33 3.099 -13.719 -7.547 1.00 1.00 H new ATOM 0 HA ARG A 33 4.705 -11.273 -8.092 1.00 1.00 H new ATOM 0 HB2 ARG A 33 5.610 -13.571 -8.780 1.00 1.00 H new ATOM 0 HB3 ARG A 33 4.225 -13.744 -9.840 1.00 1.00 H new ATOM 0 HG2 ARG A 33 5.287 -12.517 -11.488 1.00 1.00 H new ATOM 0 HG3 ARG A 33 5.446 -11.146 -10.408 1.00 1.00 H new ATOM 0 HD2 ARG A 33 7.536 -12.220 -9.426 1.00 1.00 H new ATOM 0 HD3 ARG A 33 7.396 -13.502 -10.613 1.00 1.00 H new ATOM 0 HE ARG A 33 7.344 -11.002 -12.017 1.00 1.00 H new ATOM 0 HH11 ARG A 33 9.465 -13.026 -10.061 1.00 1.00 H new ATOM 0 HH12 ARG A 33 10.940 -12.458 -10.849 1.00 1.00 H new ATOM 0 HH21 ARG A 33 9.259 -10.289 -13.009 1.00 1.00 H new ATOM 0 HH22 ARG A 33 10.825 -10.927 -12.497 1.00 1.00 H new ATOM 535 N ALA A 34 2.091 -10.668 -8.543 1.00 1.00 N ATOM 536 CA ALA A 34 0.982 -9.955 -9.182 1.00 1.00 C ATOM 537 C ALA A 34 0.324 -8.999 -8.185 1.00 1.00 C ATOM 538 O ALA A 34 -0.074 -9.404 -7.093 1.00 1.00 O ATOM 539 CB ALA A 34 -0.071 -10.963 -9.680 1.00 1.00 C ATOM 0 H ALA A 34 2.168 -10.515 -7.538 1.00 1.00 H new ATOM 0 HA ALA A 34 1.375 -9.386 -10.025 1.00 1.00 H new ATOM 0 HB1 ALA A 34 -0.893 -10.426 -10.154 1.00 1.00 H new ATOM 0 HB2 ALA A 34 0.386 -11.639 -10.403 1.00 1.00 H new ATOM 0 HB3 ALA A 34 -0.452 -11.538 -8.836 1.00 1.00 H new ATOM 545 N SER A 35 0.217 -7.723 -8.571 1.00 1.00 N ATOM 546 CA SER A 35 -0.389 -6.698 -7.716 1.00 1.00 C ATOM 547 C SER A 35 -1.907 -6.736 -7.843 1.00 1.00 C ATOM 548 O SER A 35 -2.429 -6.897 -8.946 1.00 1.00 O ATOM 549 CB SER A 35 0.121 -5.316 -8.146 1.00 1.00 C ATOM 550 OG SER A 35 -0.231 -4.362 -7.153 1.00 1.00 O ATOM 0 H SER A 35 0.543 -7.375 -9.473 1.00 1.00 H new ATOM 0 HA SER A 35 -0.115 -6.891 -6.679 1.00 1.00 H new ATOM 0 HB2 SER A 35 1.203 -5.339 -8.279 1.00 1.00 H new ATOM 0 HB3 SER A 35 -0.313 -5.037 -9.106 1.00 1.00 H new ATOM 0 HG SER A 35 0.093 -3.477 -7.420 1.00 1.00 H new ATOM 556 N ILE A 36 -2.623 -6.568 -6.733 1.00 1.00 N ATOM 557 CA ILE A 36 -4.092 -6.566 -6.772 1.00 1.00 C ATOM 558 C ILE A 36 -4.574 -5.151 -7.104 1.00 1.00 C ATOM 559 O ILE A 36 -4.003 -4.169 -6.630 1.00 1.00 O ATOM 560 CB ILE A 36 -4.666 -7.029 -5.413 1.00 1.00 C ATOM 561 CG1 ILE A 36 -4.113 -8.440 -5.074 1.00 1.00 C ATOM 562 CG2 ILE A 36 -6.211 -7.080 -5.494 1.00 1.00 C ATOM 563 CD1 ILE A 36 -4.524 -8.852 -3.654 1.00 1.00 C ATOM 0 H ILE A 36 -2.221 -6.433 -5.805 1.00 1.00 H new ATOM 0 HA ILE A 36 -4.441 -7.259 -7.538 1.00 1.00 H new ATOM 0 HB ILE A 36 -4.370 -6.327 -4.633 1.00 1.00 H new ATOM 0 HG12 ILE A 36 -4.490 -9.167 -5.793 1.00 1.00 H new ATOM 0 HG13 ILE A 36 -3.026 -8.441 -5.159 1.00 1.00 H new ATOM 0 HG21 ILE A 36 -6.615 -7.406 -4.536 1.00 1.00 H new ATOM 0 HG22 ILE A 36 -6.596 -6.088 -5.731 1.00 1.00 H new ATOM 0 HG23 ILE A 36 -6.512 -7.781 -6.272 1.00 1.00 H new ATOM 0 HD11 ILE A 36 -4.128 -9.843 -3.434 1.00 1.00 H new ATOM 0 HD12 ILE A 36 -4.125 -8.134 -2.937 1.00 1.00 H new ATOM 0 HD13 ILE A 36 -5.611 -8.872 -3.581 1.00 1.00 H new ATOM 575 N THR A 37 -5.633 -5.060 -7.923 1.00 1.00 N ATOM 576 CA THR A 37 -6.222 -3.769 -8.337 1.00 1.00 C ATOM 577 C THR A 37 -7.736 -3.808 -8.136 1.00 1.00 C ATOM 578 O THR A 37 -8.355 -4.864 -8.271 1.00 1.00 O ATOM 579 CB THR A 37 -5.903 -3.506 -9.817 1.00 1.00 C ATOM 580 OG1 THR A 37 -6.421 -4.567 -10.608 1.00 1.00 O ATOM 581 CG2 THR A 37 -4.385 -3.412 -10.016 1.00 1.00 C ATOM 0 H THR A 37 -6.106 -5.873 -8.318 1.00 1.00 H new ATOM 0 HA THR A 37 -5.799 -2.968 -7.730 1.00 1.00 H new ATOM 0 HB THR A 37 -6.362 -2.565 -10.121 1.00 1.00 H new ATOM 0 HG1 THR A 37 -6.512 -4.268 -11.537 1.00 1.00 H new ATOM 0 HG21 THR A 37 -4.167 -3.226 -11.068 1.00 1.00 H new ATOM 0 HG22 THR A 37 -3.989 -2.595 -9.413 1.00 1.00 H new ATOM 0 HG23 THR A 37 -3.919 -4.349 -9.709 1.00 1.00 H new ATOM 589 N GLY A 38 -8.333 -2.661 -7.812 1.00 1.00 N ATOM 590 CA GLY A 38 -9.780 -2.592 -7.595 1.00 1.00 C ATOM 591 C GLY A 38 -10.174 -3.339 -6.325 1.00 1.00 C ATOM 592 O GLY A 38 -9.395 -3.424 -5.376 1.00 1.00 O ATOM 0 H GLY A 38 -7.843 -1.774 -7.695 1.00 1.00 H new ATOM 0 HA2 GLY A 38 -10.092 -1.550 -7.521 1.00 1.00 H new ATOM 0 HA3 GLY A 38 -10.301 -3.021 -8.451 1.00 1.00 H new ATOM 596 N LYS A 39 -11.394 -3.878 -6.315 1.00 1.00 N ATOM 597 CA LYS A 39 -11.908 -4.624 -5.161 1.00 1.00 C ATOM 598 C LYS A 39 -13.047 -5.545 -5.613 1.00 1.00 C ATOM 599 O LYS A 39 -13.979 -5.111 -6.292 1.00 1.00 O ATOM 600 CB LYS A 39 -12.404 -3.637 -4.084 1.00 1.00 C ATOM 601 CG LYS A 39 -12.790 -4.386 -2.793 1.00 1.00 C ATOM 602 CD LYS A 39 -13.220 -3.378 -1.716 1.00 1.00 C ATOM 603 CE LYS A 39 -13.586 -4.116 -0.423 1.00 1.00 C ATOM 604 NZ LYS A 39 -13.992 -3.128 0.617 1.00 1.00 N ATOM 0 H LYS A 39 -12.048 -3.812 -7.095 1.00 1.00 H new ATOM 0 HA LYS A 39 -11.112 -5.234 -4.734 1.00 1.00 H new ATOM 0 HB2 LYS A 39 -11.625 -2.906 -3.867 1.00 1.00 H new ATOM 0 HB3 LYS A 39 -13.264 -3.083 -4.460 1.00 1.00 H new ATOM 0 HG2 LYS A 39 -13.602 -5.084 -2.996 1.00 1.00 H new ATOM 0 HG3 LYS A 39 -11.945 -4.975 -2.437 1.00 1.00 H new ATOM 0 HD2 LYS A 39 -12.413 -2.671 -1.525 1.00 1.00 H new ATOM 0 HD3 LYS A 39 -14.074 -2.799 -2.068 1.00 1.00 H new ATOM 0 HE2 LYS A 39 -14.399 -4.818 -0.610 1.00 1.00 H new ATOM 0 HE3 LYS A 39 -12.735 -4.700 -0.072 1.00 1.00 H new ATOM 0 HZ1 LYS A 39 -14.240 -3.629 1.494 1.00 1.00 H new ATOM 0 HZ2 LYS A 39 -13.204 -2.475 0.802 1.00 1.00 H new ATOM 0 HZ3 LYS A 39 -14.816 -2.589 0.281 1.00 1.00 H new ATOM 618 N PHE A 40 -12.963 -6.820 -5.218 1.00 1.00 N ATOM 619 CA PHE A 40 -13.966 -7.839 -5.545 1.00 1.00 C ATOM 620 C PHE A 40 -14.705 -8.248 -4.263 1.00 1.00 C ATOM 621 O PHE A 40 -14.083 -8.645 -3.279 1.00 1.00 O ATOM 622 CB PHE A 40 -13.262 -9.072 -6.158 1.00 1.00 C ATOM 623 CG PHE A 40 -12.300 -8.608 -7.250 1.00 1.00 C ATOM 624 CD1 PHE A 40 -12.779 -8.327 -8.540 1.00 1.00 C ATOM 625 CD2 PHE A 40 -10.929 -8.448 -6.969 1.00 1.00 C ATOM 626 CE1 PHE A 40 -11.896 -7.894 -9.537 1.00 1.00 C ATOM 627 CE2 PHE A 40 -10.051 -8.016 -7.967 1.00 1.00 C ATOM 628 CZ PHE A 40 -10.534 -7.738 -9.251 1.00 1.00 C ATOM 0 H PHE A 40 -12.189 -7.177 -4.657 1.00 1.00 H new ATOM 0 HA PHE A 40 -14.681 -7.438 -6.264 1.00 1.00 H new ATOM 0 HB2 PHE A 40 -12.719 -9.617 -5.386 1.00 1.00 H new ATOM 0 HB3 PHE A 40 -14.000 -9.758 -6.574 1.00 1.00 H new ATOM 0 HD1 PHE A 40 -13.829 -8.445 -8.763 1.00 1.00 H new ATOM 0 HD2 PHE A 40 -10.555 -8.660 -5.978 1.00 1.00 H new ATOM 0 HE1 PHE A 40 -12.266 -7.680 -10.529 1.00 1.00 H new ATOM 0 HE2 PHE A 40 -9.000 -7.897 -7.748 1.00 1.00 H new ATOM 0 HZ PHE A 40 -9.856 -7.403 -10.022 1.00 1.00 H new ATOM 638 N SER A 41 -16.034 -8.157 -4.291 1.00 1.00 N ATOM 639 CA SER A 41 -16.852 -8.525 -3.143 1.00 1.00 C ATOM 640 C SER A 41 -16.737 -10.022 -2.872 1.00 1.00 C ATOM 641 O SER A 41 -16.214 -10.774 -3.694 1.00 1.00 O ATOM 642 CB SER A 41 -18.315 -8.161 -3.420 1.00 1.00 C ATOM 643 OG SER A 41 -18.409 -6.766 -3.676 1.00 1.00 O ATOM 0 H SER A 41 -16.565 -7.831 -5.099 1.00 1.00 H new ATOM 0 HA SER A 41 -16.500 -7.981 -2.267 1.00 1.00 H new ATOM 0 HB2 SER A 41 -18.687 -8.726 -4.275 1.00 1.00 H new ATOM 0 HB3 SER A 41 -18.937 -8.429 -2.566 1.00 1.00 H new ATOM 0 HG SER A 41 -19.343 -6.529 -3.855 1.00 1.00 H new ATOM 649 N ASP A 42 -17.242 -10.445 -1.719 1.00 1.00 N ATOM 650 CA ASP A 42 -17.209 -11.854 -1.340 1.00 1.00 C ATOM 651 C ASP A 42 -18.024 -12.696 -2.321 1.00 1.00 C ATOM 652 O ASP A 42 -17.800 -13.897 -2.431 1.00 1.00 O ATOM 653 CB ASP A 42 -17.755 -12.027 0.089 1.00 1.00 C ATOM 654 CG ASP A 42 -17.600 -13.478 0.556 1.00 1.00 C ATOM 655 OD1 ASP A 42 -16.471 -13.928 0.659 1.00 1.00 O ATOM 656 OD2 ASP A 42 -18.613 -14.114 0.801 1.00 1.00 O ATOM 0 H ASP A 42 -17.679 -9.833 -1.030 1.00 1.00 H new ATOM 0 HA ASP A 42 -16.175 -12.197 -1.370 1.00 1.00 H new ATOM 0 HB2 ASP A 42 -17.224 -11.362 0.770 1.00 1.00 H new ATOM 0 HB3 ASP A 42 -18.806 -11.740 0.119 1.00 1.00 H new ATOM 661 N ALA A 43 -18.968 -12.070 -3.038 1.00 1.00 N ATOM 662 CA ALA A 43 -19.795 -12.792 -4.029 1.00 1.00 C ATOM 663 C ALA A 43 -19.159 -12.713 -5.423 1.00 1.00 C ATOM 664 O ALA A 43 -19.603 -13.383 -6.354 1.00 1.00 O ATOM 665 CB ALA A 43 -21.206 -12.201 -4.067 1.00 1.00 C ATOM 0 H ALA A 43 -19.180 -11.076 -2.956 1.00 1.00 H new ATOM 0 HA ALA A 43 -19.853 -13.839 -3.731 1.00 1.00 H new ATOM 0 HB1 ALA A 43 -21.807 -12.740 -4.800 1.00 1.00 H new ATOM 0 HB2 ALA A 43 -21.666 -12.293 -3.083 1.00 1.00 H new ATOM 0 HB3 ALA A 43 -21.152 -11.148 -4.345 1.00 1.00 H new ATOM 671 N GLU A 44 -18.122 -11.870 -5.559 1.00 1.00 N ATOM 672 CA GLU A 44 -17.414 -11.669 -6.843 1.00 1.00 C ATOM 673 C GLU A 44 -16.016 -12.301 -6.817 1.00 1.00 C ATOM 674 O GLU A 44 -15.484 -12.665 -7.865 1.00 1.00 O ATOM 675 CB GLU A 44 -17.294 -10.153 -7.117 1.00 1.00 C ATOM 676 CG GLU A 44 -18.697 -9.519 -7.270 1.00 1.00 C ATOM 677 CD GLU A 44 -19.403 -10.034 -8.529 1.00 1.00 C ATOM 678 OE1 GLU A 44 -18.718 -10.500 -9.425 1.00 1.00 O ATOM 679 OE2 GLU A 44 -20.619 -9.949 -8.577 1.00 1.00 O ATOM 0 H GLU A 44 -17.750 -11.311 -4.791 1.00 1.00 H new ATOM 0 HA GLU A 44 -17.985 -12.154 -7.635 1.00 1.00 H new ATOM 0 HB2 GLU A 44 -16.757 -9.671 -6.300 1.00 1.00 H new ATOM 0 HB3 GLU A 44 -16.712 -9.986 -8.023 1.00 1.00 H new ATOM 0 HG2 GLU A 44 -19.300 -9.748 -6.392 1.00 1.00 H new ATOM 0 HG3 GLU A 44 -18.605 -8.434 -7.319 1.00 1.00 H new ATOM 686 N CYS A 45 -15.421 -12.434 -5.630 1.00 1.00 N ATOM 687 CA CYS A 45 -14.078 -13.032 -5.515 1.00 1.00 C ATOM 688 C CYS A 45 -14.130 -14.538 -5.882 1.00 1.00 C ATOM 689 O CYS A 45 -13.265 -15.021 -6.614 1.00 1.00 O ATOM 690 CB CYS A 45 -13.506 -12.808 -4.065 1.00 1.00 C ATOM 691 SG CYS A 45 -11.850 -12.051 -4.117 1.00 1.00 S ATOM 0 H CYS A 45 -15.835 -12.143 -4.744 1.00 1.00 H new ATOM 0 HA CYS A 45 -13.404 -12.541 -6.218 1.00 1.00 H new ATOM 0 HB2 CYS A 45 -14.183 -12.168 -3.499 1.00 1.00 H new ATOM 0 HB3 CYS A 45 -13.456 -13.762 -3.540 1.00 1.00 H new ATOM 0 HG CYS A 45 -11.413 -11.880 -2.905 1.00 1.00 H new ATOM 697 N PRO A 46 -15.109 -15.287 -5.393 1.00 1.00 N ATOM 698 CA PRO A 46 -15.225 -16.754 -5.699 1.00 1.00 C ATOM 699 C PRO A 46 -15.361 -17.024 -7.202 1.00 1.00 C ATOM 700 O PRO A 46 -14.645 -17.850 -7.765 1.00 1.00 O ATOM 701 CB PRO A 46 -16.504 -17.193 -4.923 1.00 1.00 C ATOM 702 CG PRO A 46 -16.654 -16.156 -3.848 1.00 1.00 C ATOM 703 CD PRO A 46 -16.204 -14.846 -4.509 1.00 1.00 C ATOM 0 HA PRO A 46 -14.335 -17.308 -5.401 1.00 1.00 H new ATOM 0 HB2 PRO A 46 -17.377 -17.220 -5.576 1.00 1.00 H new ATOM 0 HB3 PRO A 46 -16.391 -18.192 -4.501 1.00 1.00 H new ATOM 0 HG2 PRO A 46 -17.685 -16.091 -3.501 1.00 1.00 H new ATOM 0 HG3 PRO A 46 -16.040 -16.393 -2.980 1.00 1.00 H new ATOM 0 HD2 PRO A 46 -17.013 -14.377 -5.069 1.00 1.00 H new ATOM 0 HD3 PRO A 46 -15.862 -14.118 -3.773 1.00 1.00 H new ATOM 711 N LYS A 47 -16.305 -16.322 -7.829 1.00 1.00 N ATOM 712 CA LYS A 47 -16.569 -16.488 -9.257 1.00 1.00 C ATOM 713 C LYS A 47 -15.301 -16.256 -10.076 1.00 1.00 C ATOM 714 O LYS A 47 -15.164 -16.779 -11.178 1.00 1.00 O ATOM 715 CB LYS A 47 -17.660 -15.501 -9.710 1.00 1.00 C ATOM 716 CG LYS A 47 -18.971 -15.768 -8.948 1.00 1.00 C ATOM 717 CD LYS A 47 -20.036 -14.702 -9.318 1.00 1.00 C ATOM 718 CE LYS A 47 -20.439 -14.787 -10.819 1.00 1.00 C ATOM 719 NZ LYS A 47 -19.492 -13.969 -11.631 1.00 1.00 N ATOM 0 H LYS A 47 -16.900 -15.633 -7.369 1.00 1.00 H new ATOM 0 HA LYS A 47 -16.910 -17.510 -9.422 1.00 1.00 H new ATOM 0 HB2 LYS A 47 -17.330 -14.477 -9.533 1.00 1.00 H new ATOM 0 HB3 LYS A 47 -17.828 -15.601 -10.782 1.00 1.00 H new ATOM 0 HG2 LYS A 47 -19.344 -16.763 -9.190 1.00 1.00 H new ATOM 0 HG3 LYS A 47 -18.786 -15.749 -7.874 1.00 1.00 H new ATOM 0 HD2 LYS A 47 -20.920 -14.840 -8.696 1.00 1.00 H new ATOM 0 HD3 LYS A 47 -19.646 -13.707 -9.102 1.00 1.00 H new ATOM 0 HE2 LYS A 47 -20.421 -15.824 -11.154 1.00 1.00 H new ATOM 0 HE3 LYS A 47 -21.458 -14.426 -10.955 1.00 1.00 H new ATOM 0 HZ1 LYS A 47 -20.025 -13.267 -12.183 1.00 1.00 H new ATOM 0 HZ2 LYS A 47 -18.826 -13.480 -10.999 1.00 1.00 H new ATOM 0 HZ3 LYS A 47 -18.964 -14.589 -12.277 1.00 1.00 H new ATOM 733 N LEU A 48 -14.383 -15.445 -9.557 1.00 1.00 N ATOM 734 CA LEU A 48 -13.146 -15.148 -10.287 1.00 1.00 C ATOM 735 C LEU A 48 -12.303 -16.436 -10.418 1.00 1.00 C ATOM 736 O LEU A 48 -11.701 -16.702 -11.459 1.00 1.00 O ATOM 737 CB LEU A 48 -12.366 -14.020 -9.542 1.00 1.00 C ATOM 738 CG LEU A 48 -11.581 -13.096 -10.528 1.00 1.00 C ATOM 739 CD1 LEU A 48 -10.631 -13.933 -11.423 1.00 1.00 C ATOM 740 CD2 LEU A 48 -12.563 -12.243 -11.410 1.00 1.00 C ATOM 0 H LEU A 48 -14.466 -14.987 -8.650 1.00 1.00 H new ATOM 0 HA LEU A 48 -13.374 -14.794 -11.292 1.00 1.00 H new ATOM 0 HB2 LEU A 48 -13.066 -13.418 -8.962 1.00 1.00 H new ATOM 0 HB3 LEU A 48 -11.669 -14.469 -8.834 1.00 1.00 H new ATOM 0 HG LEU A 48 -10.979 -12.408 -9.934 1.00 1.00 H new ATOM 0 HD11 LEU A 48 -10.094 -13.271 -12.102 1.00 1.00 H new ATOM 0 HD12 LEU A 48 -9.917 -14.467 -10.796 1.00 1.00 H new ATOM 0 HD13 LEU A 48 -11.214 -14.650 -12.001 1.00 1.00 H new ATOM 0 HD21 LEU A 48 -11.988 -11.610 -12.086 1.00 1.00 H new ATOM 0 HD22 LEU A 48 -13.202 -12.908 -11.991 1.00 1.00 H new ATOM 0 HD23 LEU A 48 -13.181 -11.618 -10.766 1.00 1.00 H new ATOM 752 N ASP A 49 -12.278 -17.233 -9.339 1.00 1.00 N ATOM 753 CA ASP A 49 -11.519 -18.492 -9.316 1.00 1.00 C ATOM 754 C ASP A 49 -12.137 -19.523 -10.260 1.00 1.00 C ATOM 755 O ASP A 49 -11.449 -20.424 -10.731 1.00 1.00 O ATOM 756 CB ASP A 49 -11.475 -19.054 -7.888 1.00 1.00 C ATOM 757 CG ASP A 49 -10.884 -18.019 -6.936 1.00 1.00 C ATOM 758 OD1 ASP A 49 -9.825 -17.496 -7.244 1.00 1.00 O ATOM 759 OD2 ASP A 49 -11.496 -17.765 -5.910 1.00 1.00 O ATOM 0 H ASP A 49 -12.774 -17.028 -8.472 1.00 1.00 H new ATOM 0 HA ASP A 49 -10.504 -18.282 -9.654 1.00 1.00 H new ATOM 0 HB2 ASP A 49 -12.480 -19.325 -7.564 1.00 1.00 H new ATOM 0 HB3 ASP A 49 -10.876 -19.964 -7.865 1.00 1.00 H new ATOM 764 N VAL A 50 -13.433 -19.381 -10.528 1.00 1.00 N ATOM 765 CA VAL A 50 -14.144 -20.291 -11.430 1.00 1.00 C ATOM 766 C VAL A 50 -13.660 -20.099 -12.867 1.00 1.00 C ATOM 767 O VAL A 50 -13.443 -21.072 -13.590 1.00 1.00 O ATOM 768 CB VAL A 50 -15.669 -20.015 -11.355 1.00 1.00 C ATOM 769 CG1 VAL A 50 -16.452 -20.973 -12.289 1.00 1.00 C ATOM 770 CG2 VAL A 50 -16.146 -20.216 -9.905 1.00 1.00 C ATOM 0 H VAL A 50 -14.016 -18.643 -10.133 1.00 1.00 H new ATOM 0 HA VAL A 50 -13.943 -21.317 -11.123 1.00 1.00 H new ATOM 0 HB VAL A 50 -15.855 -18.990 -11.677 1.00 1.00 H new ATOM 0 HG11 VAL A 50 -17.518 -20.759 -12.218 1.00 1.00 H new ATOM 0 HG12 VAL A 50 -16.121 -20.830 -13.318 1.00 1.00 H new ATOM 0 HG13 VAL A 50 -16.268 -22.005 -11.989 1.00 1.00 H new ATOM 0 HG21 VAL A 50 -17.217 -20.024 -9.844 1.00 1.00 H new ATOM 0 HG22 VAL A 50 -15.943 -21.241 -9.594 1.00 1.00 H new ATOM 0 HG23 VAL A 50 -15.616 -19.526 -9.249 1.00 1.00 H new ATOM 780 N VAL A 51 -13.521 -18.833 -13.294 1.00 1.00 N ATOM 781 CA VAL A 51 -13.090 -18.523 -14.670 1.00 1.00 C ATOM 782 C VAL A 51 -11.554 -18.558 -14.775 1.00 1.00 C ATOM 783 O VAL A 51 -10.992 -18.590 -15.865 1.00 1.00 O ATOM 784 CB VAL A 51 -13.645 -17.130 -15.098 1.00 1.00 C ATOM 785 CG1 VAL A 51 -13.515 -16.941 -16.626 1.00 1.00 C ATOM 786 CG2 VAL A 51 -15.138 -17.026 -14.709 1.00 1.00 C ATOM 0 H VAL A 51 -13.699 -18.013 -12.713 1.00 1.00 H new ATOM 0 HA VAL A 51 -13.490 -19.279 -15.346 1.00 1.00 H new ATOM 0 HB VAL A 51 -13.068 -16.357 -14.590 1.00 1.00 H new ATOM 0 HG11 VAL A 51 -13.907 -15.963 -16.906 1.00 1.00 H new ATOM 0 HG12 VAL A 51 -12.465 -17.007 -16.913 1.00 1.00 H new ATOM 0 HG13 VAL A 51 -14.080 -17.719 -17.138 1.00 1.00 H new ATOM 0 HG21 VAL A 51 -15.525 -16.052 -15.009 1.00 1.00 H new ATOM 0 HG22 VAL A 51 -15.701 -17.811 -15.214 1.00 1.00 H new ATOM 0 HG23 VAL A 51 -15.242 -17.141 -13.630 1.00 1.00 H new ATOM 796 N PHE A 52 -10.869 -18.538 -13.629 1.00 1.00 N ATOM 797 CA PHE A 52 -9.401 -18.561 -13.629 1.00 1.00 C ATOM 798 C PHE A 52 -8.843 -19.786 -14.405 1.00 1.00 C ATOM 799 O PHE A 52 -8.038 -19.591 -15.317 1.00 1.00 O ATOM 800 CB PHE A 52 -8.859 -18.475 -12.180 1.00 1.00 C ATOM 801 CG PHE A 52 -7.329 -18.523 -12.176 1.00 1.00 C ATOM 802 CD1 PHE A 52 -6.578 -17.341 -12.340 1.00 1.00 C ATOM 803 CD2 PHE A 52 -6.658 -19.747 -12.009 1.00 1.00 C ATOM 804 CE1 PHE A 52 -5.178 -17.390 -12.334 1.00 1.00 C ATOM 805 CE2 PHE A 52 -5.260 -19.789 -12.003 1.00 1.00 C ATOM 806 CZ PHE A 52 -4.520 -18.613 -12.166 1.00 1.00 C ATOM 0 H PHE A 52 -11.296 -18.506 -12.703 1.00 1.00 H new ATOM 0 HA PHE A 52 -9.044 -17.681 -14.164 1.00 1.00 H new ATOM 0 HB2 PHE A 52 -9.201 -17.552 -11.712 1.00 1.00 H new ATOM 0 HB3 PHE A 52 -9.256 -19.299 -11.587 1.00 1.00 H new ATOM 0 HD1 PHE A 52 -7.083 -16.395 -12.471 1.00 1.00 H new ATOM 0 HD2 PHE A 52 -7.224 -20.658 -11.885 1.00 1.00 H new ATOM 0 HE1 PHE A 52 -4.606 -16.483 -12.459 1.00 1.00 H new ATOM 0 HE2 PHE A 52 -4.750 -20.732 -11.872 1.00 1.00 H new ATOM 0 HZ PHE A 52 -3.441 -18.649 -12.162 1.00 1.00 H new ATOM 816 N PRO A 53 -9.238 -21.029 -14.121 1.00 1.00 N ATOM 817 CA PRO A 53 -8.721 -22.214 -14.895 1.00 1.00 C ATOM 818 C PRO A 53 -9.234 -22.206 -16.342 1.00 1.00 C ATOM 819 O PRO A 53 -8.645 -22.842 -17.211 1.00 1.00 O ATOM 820 CB PRO A 53 -9.281 -23.426 -14.107 1.00 1.00 C ATOM 821 CG PRO A 53 -10.557 -22.894 -13.543 1.00 1.00 C ATOM 822 CD PRO A 53 -10.187 -21.478 -13.075 1.00 1.00 C ATOM 0 HA PRO A 53 -7.634 -22.224 -14.978 1.00 1.00 H new ATOM 0 HB2 PRO A 53 -9.453 -24.285 -14.755 1.00 1.00 H new ATOM 0 HB3 PRO A 53 -8.596 -23.750 -13.323 1.00 1.00 H new ATOM 0 HG2 PRO A 53 -11.348 -22.874 -14.292 1.00 1.00 H new ATOM 0 HG3 PRO A 53 -10.916 -23.508 -12.717 1.00 1.00 H new ATOM 0 HD2 PRO A 53 -11.061 -20.830 -13.015 1.00 1.00 H new ATOM 0 HD3 PRO A 53 -9.727 -21.485 -12.087 1.00 1.00 H new ATOM 830 N HIS A 54 -10.348 -21.505 -16.592 1.00 1.00 N ATOM 831 CA HIS A 54 -10.928 -21.465 -17.942 1.00 1.00 C ATOM 832 C HIS A 54 -9.920 -20.895 -18.942 1.00 1.00 C ATOM 833 O HIS A 54 -9.716 -21.459 -20.016 1.00 1.00 O ATOM 834 CB HIS A 54 -12.217 -20.615 -17.954 1.00 1.00 C ATOM 835 CG HIS A 54 -12.894 -20.707 -19.297 1.00 1.00 C ATOM 836 ND1 HIS A 54 -12.405 -20.050 -20.415 1.00 1.00 N ATOM 837 CD2 HIS A 54 -14.020 -21.371 -19.714 1.00 1.00 C ATOM 838 CE1 HIS A 54 -13.226 -20.332 -21.442 1.00 1.00 C ATOM 839 NE2 HIS A 54 -14.227 -21.133 -21.070 1.00 1.00 N ATOM 0 H HIS A 54 -10.858 -20.967 -15.892 1.00 1.00 H new ATOM 0 HA HIS A 54 -11.177 -22.485 -18.235 1.00 1.00 H new ATOM 0 HB2 HIS A 54 -12.895 -20.960 -17.173 1.00 1.00 H new ATOM 0 HB3 HIS A 54 -11.977 -19.575 -17.731 1.00 1.00 H new ATOM 0 HD1 HIS A 54 -11.574 -19.460 -20.452 1.00 1.00 H new ATOM 0 HD2 HIS A 54 -14.649 -21.984 -19.086 1.00 1.00 H new ATOM 0 HE1 HIS A 54 -13.092 -19.956 -22.446 1.00 1.00 H new ATOM 848 N PHE A 55 -9.283 -19.784 -18.578 1.00 1.00 N ATOM 849 CA PHE A 55 -8.292 -19.169 -19.453 1.00 1.00 C ATOM 850 C PHE A 55 -7.081 -20.086 -19.619 1.00 1.00 C ATOM 851 O PHE A 55 -6.570 -20.237 -20.722 1.00 1.00 O ATOM 852 CB PHE A 55 -7.820 -17.824 -18.844 1.00 1.00 C ATOM 853 CG PHE A 55 -8.921 -16.769 -18.953 1.00 1.00 C ATOM 854 CD1 PHE A 55 -9.249 -16.250 -20.217 1.00 1.00 C ATOM 855 CD2 PHE A 55 -9.597 -16.294 -17.811 1.00 1.00 C ATOM 856 CE1 PHE A 55 -10.240 -15.273 -20.339 1.00 1.00 C ATOM 857 CE2 PHE A 55 -10.585 -15.313 -17.941 1.00 1.00 C ATOM 858 CZ PHE A 55 -10.906 -14.804 -19.203 1.00 1.00 C ATOM 0 H PHE A 55 -9.434 -19.297 -17.694 1.00 1.00 H new ATOM 0 HA PHE A 55 -8.752 -18.999 -20.427 1.00 1.00 H new ATOM 0 HB2 PHE A 55 -7.548 -17.967 -17.798 1.00 1.00 H new ATOM 0 HB3 PHE A 55 -6.925 -17.478 -19.361 1.00 1.00 H new ATOM 0 HD1 PHE A 55 -8.734 -16.607 -21.096 1.00 1.00 H new ATOM 0 HD2 PHE A 55 -9.352 -16.688 -16.836 1.00 1.00 H new ATOM 0 HE1 PHE A 55 -10.492 -14.879 -21.313 1.00 1.00 H new ATOM 0 HE2 PHE A 55 -11.101 -14.948 -17.065 1.00 1.00 H new ATOM 0 HZ PHE A 55 -11.670 -14.047 -19.300 1.00 1.00 H new ATOM 868 N ILE A 56 -6.618 -20.700 -18.532 1.00 1.00 N ATOM 869 CA ILE A 56 -5.451 -21.591 -18.612 1.00 1.00 C ATOM 870 C ILE A 56 -5.827 -22.883 -19.330 1.00 1.00 C ATOM 871 O ILE A 56 -5.061 -23.384 -20.149 1.00 1.00 O ATOM 872 CB ILE A 56 -4.881 -21.882 -17.205 1.00 1.00 C ATOM 873 CG1 ILE A 56 -4.563 -20.541 -16.486 1.00 1.00 C ATOM 874 CG2 ILE A 56 -3.589 -22.728 -17.323 1.00 1.00 C ATOM 875 CD1 ILE A 56 -4.204 -20.792 -15.014 1.00 1.00 C ATOM 0 H ILE A 56 -7.020 -20.603 -17.600 1.00 1.00 H new ATOM 0 HA ILE A 56 -4.670 -21.092 -19.186 1.00 1.00 H new ATOM 0 HB ILE A 56 -5.619 -22.438 -16.628 1.00 1.00 H new ATOM 0 HG12 ILE A 56 -3.735 -20.040 -16.988 1.00 1.00 H new ATOM 0 HG13 ILE A 56 -5.424 -19.875 -16.548 1.00 1.00 H new ATOM 0 HG21 ILE A 56 -3.193 -22.929 -16.327 1.00 1.00 H new ATOM 0 HG22 ILE A 56 -3.816 -23.671 -17.820 1.00 1.00 H new ATOM 0 HG23 ILE A 56 -2.847 -22.180 -17.904 1.00 1.00 H new ATOM 0 HD11 ILE A 56 -3.984 -19.842 -14.526 1.00 1.00 H new ATOM 0 HD12 ILE A 56 -5.044 -21.272 -14.512 1.00 1.00 H new ATOM 0 HD13 ILE A 56 -3.329 -21.440 -14.958 1.00 1.00 H new ATOM 887 N SER A 57 -6.996 -23.436 -19.017 1.00 1.00 N ATOM 888 CA SER A 57 -7.422 -24.692 -19.637 1.00 1.00 C ATOM 889 C SER A 57 -7.468 -24.571 -21.164 1.00 1.00 C ATOM 890 O SER A 57 -7.083 -25.499 -21.875 1.00 1.00 O ATOM 891 CB SER A 57 -8.793 -25.105 -19.095 1.00 1.00 C ATOM 892 OG SER A 57 -9.754 -24.118 -19.450 1.00 1.00 O ATOM 0 H SER A 57 -7.658 -23.043 -18.348 1.00 1.00 H new ATOM 0 HA SER A 57 -6.691 -25.460 -19.385 1.00 1.00 H new ATOM 0 HB2 SER A 57 -9.082 -26.074 -19.503 1.00 1.00 H new ATOM 0 HB3 SER A 57 -8.751 -25.215 -18.011 1.00 1.00 H new ATOM 0 HG SER A 57 -9.307 -23.254 -19.568 1.00 1.00 H new ATOM 898 N GLN A 58 -7.926 -23.417 -21.669 1.00 1.00 N ATOM 899 CA GLN A 58 -7.998 -23.181 -23.125 1.00 1.00 C ATOM 900 C GLN A 58 -6.626 -22.735 -23.670 1.00 1.00 C ATOM 901 O GLN A 58 -6.169 -23.256 -24.687 1.00 1.00 O ATOM 902 CB GLN A 58 -9.103 -22.125 -23.423 1.00 1.00 C ATOM 903 CG GLN A 58 -9.645 -22.256 -24.862 1.00 1.00 C ATOM 904 CD GLN A 58 -8.527 -22.055 -25.879 1.00 1.00 C ATOM 905 OE1 GLN A 58 -8.239 -22.951 -26.672 1.00 1.00 O ATOM 906 NE2 GLN A 58 -7.876 -20.924 -25.905 1.00 1.00 N ATOM 0 H GLN A 58 -8.251 -22.636 -21.099 1.00 1.00 H new ATOM 0 HA GLN A 58 -8.261 -24.109 -23.632 1.00 1.00 H new ATOM 0 HB2 GLN A 58 -9.922 -22.245 -22.714 1.00 1.00 H new ATOM 0 HB3 GLN A 58 -8.698 -21.124 -23.276 1.00 1.00 H new ATOM 0 HG2 GLN A 58 -10.095 -23.239 -24.998 1.00 1.00 H new ATOM 0 HG3 GLN A 58 -10.431 -21.520 -25.028 1.00 1.00 H new ATOM 0 HE21 GLN A 58 -8.116 -20.182 -25.247 1.00 1.00 H new ATOM 0 HE22 GLN A 58 -7.127 -20.782 -26.583 1.00 1.00 H new ATOM 915 N ILE A 59 -5.969 -21.786 -22.998 1.00 1.00 N ATOM 916 CA ILE A 59 -4.650 -21.314 -23.454 1.00 1.00 C ATOM 917 C ILE A 59 -3.639 -22.467 -23.401 1.00 1.00 C ATOM 918 O ILE A 59 -2.855 -22.646 -24.326 1.00 1.00 O ATOM 919 CB ILE A 59 -4.181 -20.113 -22.575 1.00 1.00 C ATOM 920 CG1 ILE A 59 -5.100 -18.877 -22.845 1.00 1.00 C ATOM 921 CG2 ILE A 59 -2.699 -19.735 -22.884 1.00 1.00 C ATOM 922 CD1 ILE A 59 -4.882 -17.807 -21.765 1.00 1.00 C ATOM 0 H ILE A 59 -6.316 -21.334 -22.152 1.00 1.00 H new ATOM 0 HA ILE A 59 -4.723 -20.970 -24.486 1.00 1.00 H new ATOM 0 HB ILE A 59 -4.250 -20.408 -21.528 1.00 1.00 H new ATOM 0 HG12 ILE A 59 -4.882 -18.461 -23.829 1.00 1.00 H new ATOM 0 HG13 ILE A 59 -6.145 -19.187 -22.854 1.00 1.00 H new ATOM 0 HG21 ILE A 59 -2.399 -18.895 -22.257 1.00 1.00 H new ATOM 0 HG22 ILE A 59 -2.055 -20.590 -22.678 1.00 1.00 H new ATOM 0 HG23 ILE A 59 -2.606 -19.456 -23.933 1.00 1.00 H new ATOM 0 HD11 ILE A 59 -5.528 -16.952 -21.965 1.00 1.00 H new ATOM 0 HD12 ILE A 59 -5.123 -18.223 -20.787 1.00 1.00 H new ATOM 0 HD13 ILE A 59 -3.840 -17.486 -21.776 1.00 1.00 H new ATOM 934 N GLU A 60 -3.649 -23.244 -22.317 1.00 1.00 N ATOM 935 CA GLU A 60 -2.706 -24.360 -22.187 1.00 1.00 C ATOM 936 C GLU A 60 -2.875 -25.342 -23.353 1.00 1.00 C ATOM 937 O GLU A 60 -1.890 -25.835 -23.901 1.00 1.00 O ATOM 938 CB GLU A 60 -2.932 -25.076 -20.837 1.00 1.00 C ATOM 939 CG GLU A 60 -1.895 -26.202 -20.606 1.00 1.00 C ATOM 940 CD GLU A 60 -0.485 -25.628 -20.459 1.00 1.00 C ATOM 941 OE1 GLU A 60 -0.370 -24.472 -20.081 1.00 1.00 O ATOM 942 OE2 GLU A 60 0.459 -26.352 -20.732 1.00 1.00 O ATOM 0 H GLU A 60 -4.286 -23.127 -21.529 1.00 1.00 H new ATOM 0 HA GLU A 60 -1.688 -23.972 -22.215 1.00 1.00 H new ATOM 0 HB2 GLU A 60 -2.869 -24.351 -20.025 1.00 1.00 H new ATOM 0 HB3 GLU A 60 -3.937 -25.496 -20.812 1.00 1.00 H new ATOM 0 HG2 GLU A 60 -2.158 -26.765 -19.710 1.00 1.00 H new ATOM 0 HG3 GLU A 60 -1.921 -26.902 -21.441 1.00 1.00 H new ATOM 949 N SER A 61 -4.128 -25.620 -23.731 1.00 1.00 N ATOM 950 CA SER A 61 -4.397 -26.548 -24.841 1.00 1.00 C ATOM 951 C SER A 61 -3.958 -25.928 -26.173 1.00 1.00 C ATOM 952 O SER A 61 -3.530 -26.640 -27.076 1.00 1.00 O ATOM 953 CB SER A 61 -5.880 -26.927 -24.888 1.00 1.00 C ATOM 954 OG SER A 61 -6.659 -25.750 -25.062 1.00 1.00 O ATOM 0 H SER A 61 -4.961 -25.224 -23.295 1.00 1.00 H new ATOM 0 HA SER A 61 -3.820 -27.458 -24.673 1.00 1.00 H new ATOM 0 HB2 SER A 61 -6.064 -27.623 -25.706 1.00 1.00 H new ATOM 0 HB3 SER A 61 -6.167 -27.435 -23.967 1.00 1.00 H new ATOM 0 HG SER A 61 -6.112 -24.963 -24.858 1.00 1.00 H new ATOM 960 N MET A 62 -4.050 -24.604 -26.284 1.00 1.00 N ATOM 961 CA MET A 62 -3.638 -23.907 -27.511 1.00 1.00 C ATOM 962 C MET A 62 -2.151 -24.157 -27.777 1.00 1.00 C ATOM 963 O MET A 62 -1.746 -24.369 -28.914 1.00 1.00 O ATOM 964 CB MET A 62 -3.899 -22.390 -27.363 1.00 1.00 C ATOM 965 CG MET A 62 -3.699 -21.646 -28.707 1.00 1.00 C ATOM 966 SD MET A 62 -5.060 -22.061 -29.838 1.00 1.00 S ATOM 967 CE MET A 62 -6.225 -20.767 -29.331 1.00 1.00 C ATOM 0 H MET A 62 -4.403 -23.992 -25.548 1.00 1.00 H new ATOM 0 HA MET A 62 -4.218 -24.289 -28.351 1.00 1.00 H new ATOM 0 HB2 MET A 62 -4.915 -22.228 -27.004 1.00 1.00 H new ATOM 0 HB3 MET A 62 -3.226 -21.975 -26.613 1.00 1.00 H new ATOM 0 HG2 MET A 62 -3.668 -20.570 -28.538 1.00 1.00 H new ATOM 0 HG3 MET A 62 -2.744 -21.927 -29.152 1.00 1.00 H new ATOM 0 HE1 MET A 62 -7.232 -21.182 -29.285 1.00 1.00 H new ATOM 0 HE2 MET A 62 -5.943 -20.388 -28.349 1.00 1.00 H new ATOM 0 HE3 MET A 62 -6.201 -19.952 -30.055 1.00 1.00 H new ATOM 977 N LEU A 63 -1.352 -24.129 -26.723 1.00 1.00 N ATOM 978 CA LEU A 63 0.093 -24.355 -26.853 1.00 1.00 C ATOM 979 C LEU A 63 0.357 -25.762 -27.408 1.00 1.00 C ATOM 980 O LEU A 63 1.292 -25.970 -28.173 1.00 1.00 O ATOM 981 CB LEU A 63 0.773 -24.196 -25.480 1.00 1.00 C ATOM 982 CG LEU A 63 0.582 -22.756 -24.925 1.00 1.00 C ATOM 983 CD1 LEU A 63 1.143 -22.688 -23.490 1.00 1.00 C ATOM 984 CD2 LEU A 63 1.292 -21.691 -25.818 1.00 1.00 C ATOM 0 H LEU A 63 -1.669 -23.954 -25.770 1.00 1.00 H new ATOM 0 HA LEU A 63 0.507 -23.619 -27.543 1.00 1.00 H new ATOM 0 HB2 LEU A 63 0.356 -24.918 -24.778 1.00 1.00 H new ATOM 0 HB3 LEU A 63 1.837 -24.417 -25.570 1.00 1.00 H new ATOM 0 HG LEU A 63 -0.484 -22.530 -24.927 1.00 1.00 H new ATOM 0 HD11 LEU A 63 1.012 -21.680 -23.095 1.00 1.00 H new ATOM 0 HD12 LEU A 63 0.610 -23.398 -22.857 1.00 1.00 H new ATOM 0 HD13 LEU A 63 2.204 -22.938 -23.502 1.00 1.00 H new ATOM 0 HD21 LEU A 63 1.134 -20.699 -25.396 1.00 1.00 H new ATOM 0 HD22 LEU A 63 2.360 -21.903 -25.857 1.00 1.00 H new ATOM 0 HD23 LEU A 63 0.878 -21.727 -26.826 1.00 1.00 H new ATOM 996 N THR A 64 -0.474 -26.724 -27.012 1.00 1.00 N ATOM 997 CA THR A 64 -0.339 -28.114 -27.470 1.00 1.00 C ATOM 998 C THR A 64 -1.067 -28.320 -28.788 1.00 1.00 C ATOM 999 O THR A 64 -0.463 -28.716 -29.784 1.00 1.00 O ATOM 1000 CB THR A 64 -0.926 -29.059 -26.413 1.00 1.00 C ATOM 1001 OG1 THR A 64 -2.313 -28.791 -26.256 1.00 1.00 O ATOM 1002 CG2 THR A 64 -0.207 -28.836 -25.080 1.00 1.00 C ATOM 0 H THR A 64 -1.253 -26.570 -26.372 1.00 1.00 H new ATOM 0 HA THR A 64 0.719 -28.330 -27.618 1.00 1.00 H new ATOM 0 HB THR A 64 -0.791 -30.093 -26.731 1.00 1.00 H new ATOM 0 HG1 THR A 64 -2.464 -27.823 -26.280 1.00 1.00 H new ATOM 0 HG21 THR A 64 -0.621 -29.506 -24.327 1.00 1.00 H new ATOM 0 HG22 THR A 64 0.857 -29.041 -25.202 1.00 1.00 H new ATOM 0 HG23 THR A 64 -0.344 -27.803 -24.761 1.00 1.00 H new ATOM 1010 N THR A 65 -2.365 -28.059 -28.790 1.00 1.00 N ATOM 1011 CA THR A 65 -3.168 -28.228 -29.995 1.00 1.00 C ATOM 1012 C THR A 65 -2.705 -27.271 -31.094 1.00 1.00 C ATOM 1013 O THR A 65 -2.639 -27.650 -32.263 1.00 1.00 O ATOM 1014 CB THR A 65 -4.646 -27.988 -29.653 1.00 1.00 C ATOM 1015 OG1 THR A 65 -5.005 -28.792 -28.538 1.00 1.00 O ATOM 1016 CG2 THR A 65 -5.538 -28.342 -30.840 1.00 1.00 C ATOM 0 H THR A 65 -2.885 -27.731 -27.976 1.00 1.00 H new ATOM 0 HA THR A 65 -3.045 -29.244 -30.369 1.00 1.00 H new ATOM 0 HB THR A 65 -4.784 -26.933 -29.415 1.00 1.00 H new ATOM 0 HG1 THR A 65 -4.759 -28.330 -27.709 1.00 1.00 H new ATOM 0 HG21 THR A 65 -6.581 -28.165 -30.577 1.00 1.00 H new ATOM 0 HG22 THR A 65 -5.269 -27.722 -31.695 1.00 1.00 H new ATOM 0 HG23 THR A 65 -5.402 -29.393 -31.097 1.00 1.00 H new ATOM 1024 N GLY A 66 -2.396 -26.028 -30.708 1.00 1.00 N ATOM 1025 CA GLY A 66 -1.945 -24.987 -31.652 1.00 1.00 C ATOM 1026 C GLY A 66 -0.527 -24.528 -31.339 1.00 1.00 C ATOM 1027 O GLY A 66 -0.335 -23.410 -30.869 1.00 1.00 O ATOM 0 H GLY A 66 -2.449 -25.712 -29.740 1.00 1.00 H new ATOM 0 HA2 GLY A 66 -1.987 -25.374 -32.670 1.00 1.00 H new ATOM 0 HA3 GLY A 66 -2.623 -24.135 -31.607 1.00 1.00 H new ATOM 1031 N GLU A 67 0.464 -25.394 -31.596 1.00 1.00 N ATOM 1032 CA GLU A 67 1.876 -25.060 -31.335 1.00 1.00 C ATOM 1033 C GLU A 67 2.227 -23.670 -31.882 1.00 1.00 C ATOM 1034 O GLU A 67 2.705 -23.537 -33.008 1.00 1.00 O ATOM 1035 CB GLU A 67 2.797 -26.123 -31.977 1.00 1.00 C ATOM 1036 CG GLU A 67 4.271 -25.876 -31.586 1.00 1.00 C ATOM 1037 CD GLU A 67 5.184 -26.945 -32.194 1.00 1.00 C ATOM 1038 OE1 GLU A 67 4.675 -27.968 -32.628 1.00 1.00 O ATOM 1039 OE2 GLU A 67 6.383 -26.722 -32.214 1.00 1.00 O ATOM 0 H GLU A 67 0.318 -26.327 -31.982 1.00 1.00 H new ATOM 0 HA GLU A 67 2.028 -25.051 -30.256 1.00 1.00 H new ATOM 0 HB2 GLU A 67 2.492 -27.118 -31.654 1.00 1.00 H new ATOM 0 HB3 GLU A 67 2.693 -26.094 -33.062 1.00 1.00 H new ATOM 0 HG2 GLU A 67 4.582 -24.889 -31.928 1.00 1.00 H new ATOM 0 HG3 GLU A 67 4.370 -25.882 -30.500 1.00 1.00 H new ATOM 1046 N LEU A 68 1.991 -22.638 -31.065 1.00 1.00 N ATOM 1047 CA LEU A 68 2.286 -21.258 -31.457 1.00 1.00 C ATOM 1048 C LEU A 68 3.765 -20.992 -31.218 1.00 1.00 C ATOM 1049 O LEU A 68 4.335 -21.518 -30.261 1.00 1.00 O ATOM 1050 CB LEU A 68 1.436 -20.264 -30.609 1.00 1.00 C ATOM 1051 CG LEU A 68 1.455 -18.819 -31.249 1.00 1.00 C ATOM 1052 CD1 LEU A 68 0.274 -18.648 -32.226 1.00 1.00 C ATOM 1053 CD2 LEU A 68 1.377 -17.728 -30.156 1.00 1.00 C ATOM 0 H LEU A 68 1.597 -22.733 -30.129 1.00 1.00 H new ATOM 0 HA LEU A 68 2.041 -21.117 -32.510 1.00 1.00 H new ATOM 0 HB2 LEU A 68 0.409 -20.623 -30.542 1.00 1.00 H new ATOM 0 HB3 LEU A 68 1.826 -20.221 -29.592 1.00 1.00 H new ATOM 0 HG LEU A 68 2.394 -18.708 -31.791 1.00 1.00 H new ATOM 0 HD11 LEU A 68 0.301 -17.648 -32.658 1.00 1.00 H new ATOM 0 HD12 LEU A 68 0.350 -19.389 -33.022 1.00 1.00 H new ATOM 0 HD13 LEU A 68 -0.665 -18.786 -31.690 1.00 1.00 H new ATOM 0 HD21 LEU A 68 1.392 -16.743 -30.623 1.00 1.00 H new ATOM 0 HD22 LEU A 68 0.454 -17.847 -29.589 1.00 1.00 H new ATOM 0 HD23 LEU A 68 2.230 -17.824 -29.485 1.00 1.00 H new ATOM 1065 N ASN A 69 4.384 -20.172 -32.073 1.00 1.00 N ATOM 1066 CA ASN A 69 5.808 -19.829 -31.940 1.00 1.00 C ATOM 1067 C ASN A 69 5.986 -18.307 -32.131 1.00 1.00 C ATOM 1068 O ASN A 69 5.281 -17.725 -32.956 1.00 1.00 O ATOM 1069 CB ASN A 69 6.612 -20.571 -33.018 1.00 1.00 C ATOM 1070 CG ASN A 69 6.529 -22.082 -32.794 1.00 1.00 C ATOM 1071 OD1 ASN A 69 7.277 -22.630 -31.983 1.00 1.00 O ATOM 1072 ND2 ASN A 69 5.662 -22.789 -33.464 1.00 1.00 N ATOM 0 H ASN A 69 3.922 -19.731 -32.868 1.00 1.00 H new ATOM 0 HA ASN A 69 6.164 -20.120 -30.951 1.00 1.00 H new ATOM 0 HB2 ASN A 69 6.226 -20.321 -34.006 1.00 1.00 H new ATOM 0 HB3 ASN A 69 7.653 -20.249 -32.992 1.00 1.00 H new ATOM 0 HD21 ASN A 69 5.603 -23.797 -33.317 1.00 1.00 H new ATOM 0 HD22 ASN A 69 5.043 -22.334 -34.135 1.00 1.00 H new ATOM 1079 N PRO A 70 6.901 -17.646 -31.415 1.00 1.00 N ATOM 1080 CA PRO A 70 7.138 -16.166 -31.573 1.00 1.00 C ATOM 1081 C PRO A 70 7.041 -15.689 -33.046 1.00 1.00 C ATOM 1082 O PRO A 70 5.959 -15.318 -33.489 1.00 1.00 O ATOM 1083 CB PRO A 70 8.558 -15.977 -30.971 1.00 1.00 C ATOM 1084 CG PRO A 70 8.655 -17.027 -29.899 1.00 1.00 C ATOM 1085 CD PRO A 70 7.797 -18.217 -30.379 1.00 1.00 C ATOM 0 HA PRO A 70 6.380 -15.562 -31.074 1.00 1.00 H new ATOM 0 HB2 PRO A 70 9.331 -16.110 -31.728 1.00 1.00 H new ATOM 0 HB3 PRO A 70 8.684 -14.976 -30.559 1.00 1.00 H new ATOM 0 HG2 PRO A 70 9.690 -17.331 -29.745 1.00 1.00 H new ATOM 0 HG3 PRO A 70 8.290 -16.644 -28.946 1.00 1.00 H new ATOM 0 HD2 PRO A 70 8.419 -19.013 -30.789 1.00 1.00 H new ATOM 0 HD3 PRO A 70 7.226 -18.650 -29.557 1.00 1.00 H new ATOM 1093 N ARG A 71 8.168 -15.749 -33.780 1.00 1.00 N ATOM 1094 CA ARG A 71 8.241 -15.365 -35.193 1.00 1.00 C ATOM 1095 C ARG A 71 7.818 -13.914 -35.433 1.00 1.00 C ATOM 1096 O ARG A 71 8.572 -13.124 -36.000 1.00 1.00 O ATOM 1097 CB ARG A 71 7.360 -16.304 -36.042 1.00 1.00 C ATOM 1098 CG ARG A 71 7.850 -17.754 -35.887 1.00 1.00 C ATOM 1099 CD ARG A 71 6.986 -18.694 -36.742 1.00 1.00 C ATOM 1100 NE ARG A 71 7.168 -18.382 -38.159 1.00 1.00 N ATOM 1101 CZ ARG A 71 6.485 -19.015 -39.115 1.00 1.00 C ATOM 1102 NH1 ARG A 71 5.630 -19.956 -38.808 1.00 1.00 N ATOM 1103 NH2 ARG A 71 6.674 -18.696 -40.367 1.00 1.00 N ATOM 0 H ARG A 71 9.059 -16.069 -33.401 1.00 1.00 H new ATOM 0 HA ARG A 71 9.285 -15.455 -35.492 1.00 1.00 H new ATOM 0 HB2 ARG A 71 6.319 -16.226 -35.727 1.00 1.00 H new ATOM 0 HB3 ARG A 71 7.399 -16.007 -37.090 1.00 1.00 H new ATOM 0 HG2 ARG A 71 8.894 -17.828 -36.192 1.00 1.00 H new ATOM 0 HG3 ARG A 71 7.801 -18.053 -34.840 1.00 1.00 H new ATOM 0 HD2 ARG A 71 7.261 -19.731 -36.550 1.00 1.00 H new ATOM 0 HD3 ARG A 71 5.936 -18.587 -36.469 1.00 1.00 H new ATOM 0 HE ARG A 71 7.837 -17.659 -38.425 1.00 1.00 H new ATOM 0 HH11 ARG A 71 5.481 -20.211 -37.832 1.00 1.00 H new ATOM 0 HH12 ARG A 71 5.112 -20.435 -39.545 1.00 1.00 H new ATOM 0 HH21 ARG A 71 7.342 -17.965 -40.612 1.00 1.00 H new ATOM 0 HH22 ARG A 71 6.154 -19.178 -41.100 1.00 1.00 H new ATOM 1117 N HIS A 72 6.603 -13.590 -35.009 1.00 1.00 N ATOM 1118 CA HIS A 72 6.027 -12.254 -35.179 1.00 1.00 C ATOM 1119 C HIS A 72 4.903 -12.037 -34.169 1.00 1.00 C ATOM 1120 O HIS A 72 4.216 -12.978 -33.775 1.00 1.00 O ATOM 1121 CB HIS A 72 5.455 -12.112 -36.602 1.00 1.00 C ATOM 1122 CG HIS A 72 6.548 -12.316 -37.614 1.00 1.00 C ATOM 1123 ND1 HIS A 72 6.876 -13.573 -38.096 1.00 1.00 N ATOM 1124 CD2 HIS A 72 7.421 -11.443 -38.215 1.00 1.00 C ATOM 1125 CE1 HIS A 72 7.909 -13.425 -38.942 1.00 1.00 C ATOM 1126 NE2 HIS A 72 8.281 -12.147 -39.052 1.00 1.00 N ATOM 0 H HIS A 72 5.983 -14.247 -34.535 1.00 1.00 H new ATOM 0 HA HIS A 72 6.809 -11.512 -35.019 1.00 1.00 H new ATOM 0 HB2 HIS A 72 4.661 -12.842 -36.759 1.00 1.00 H new ATOM 0 HB3 HIS A 72 5.010 -11.125 -36.728 1.00 1.00 H new ATOM 0 HD2 HIS A 72 7.438 -10.374 -38.062 1.00 1.00 H new ATOM 0 HE1 HIS A 72 8.381 -14.241 -39.469 1.00 1.00 H new ATOM 0 HE2 HIS A 72 9.034 -11.768 -39.626 1.00 1.00 H new ATOM 1135 N ALA A 73 4.727 -10.785 -33.758 1.00 1.00 N ATOM 1136 CA ALA A 73 3.690 -10.434 -32.796 1.00 1.00 C ATOM 1137 C ALA A 73 2.307 -10.763 -33.356 1.00 1.00 C ATOM 1138 O ALA A 73 2.065 -10.599 -34.552 1.00 1.00 O ATOM 1139 CB ALA A 73 3.775 -8.931 -32.491 1.00 1.00 C ATOM 0 H ALA A 73 5.290 -9.997 -34.077 1.00 1.00 H new ATOM 0 HA ALA A 73 3.842 -11.010 -31.883 1.00 1.00 H new ATOM 0 HB1 ALA A 73 3.002 -8.661 -31.772 1.00 1.00 H new ATOM 0 HB2 ALA A 73 4.755 -8.699 -32.074 1.00 1.00 H new ATOM 0 HB3 ALA A 73 3.629 -8.364 -33.411 1.00 1.00 H new ATOM 1145 N GLN A 74 1.391 -11.207 -32.491 1.00 1.00 N ATOM 1146 CA GLN A 74 0.027 -11.524 -32.935 1.00 1.00 C ATOM 1147 C GLN A 74 -0.931 -11.536 -31.733 1.00 1.00 C ATOM 1148 O GLN A 74 -0.963 -12.491 -30.956 1.00 1.00 O ATOM 1149 CB GLN A 74 0.024 -12.910 -33.657 1.00 1.00 C ATOM 1150 CG GLN A 74 -1.095 -12.992 -34.723 1.00 1.00 C ATOM 1151 CD GLN A 74 -2.459 -12.679 -34.110 1.00 1.00 C ATOM 1152 OE1 GLN A 74 -2.796 -13.216 -32.972 1.00 1.00 O flip ATOM 1153 NE2 GLN A 74 -3.239 -11.924 -34.689 1.00 1.00 N flip ATOM 0 H GLN A 74 1.562 -11.354 -31.496 1.00 1.00 H new ATOM 0 HA GLN A 74 -0.314 -10.761 -33.635 1.00 1.00 H new ATOM 0 HB2 GLN A 74 0.992 -13.077 -34.130 1.00 1.00 H new ATOM 0 HB3 GLN A 74 -0.113 -13.704 -32.923 1.00 1.00 H new ATOM 0 HG2 GLN A 74 -0.885 -12.290 -35.530 1.00 1.00 H new ATOM 0 HG3 GLN A 74 -1.110 -13.989 -35.163 1.00 1.00 H new ATOM 0 HE21 GLN A 74 -2.975 -11.504 -35.580 1.00 1.00 H new ATOM 0 HE22 GLN A 74 -4.150 -11.718 -34.278 1.00 1.00 H new ATOM 1162 N CYS A 75 -1.709 -10.459 -31.599 1.00 1.00 N ATOM 1163 CA CYS A 75 -2.675 -10.324 -30.507 1.00 1.00 C ATOM 1164 C CYS A 75 -3.910 -11.180 -30.772 1.00 1.00 C ATOM 1165 O CYS A 75 -4.411 -11.208 -31.898 1.00 1.00 O ATOM 1166 CB CYS A 75 -3.088 -8.856 -30.373 1.00 1.00 C ATOM 1167 SG CYS A 75 -4.195 -8.673 -28.955 1.00 1.00 S ATOM 0 H CYS A 75 -1.688 -9.664 -32.237 1.00 1.00 H new ATOM 0 HA CYS A 75 -2.209 -10.664 -29.582 1.00 1.00 H new ATOM 0 HB2 CYS A 75 -2.206 -8.229 -30.244 1.00 1.00 H new ATOM 0 HB3 CYS A 75 -3.586 -8.522 -31.283 1.00 1.00 H new ATOM 0 HG CYS A 75 -4.546 -7.427 -28.837 1.00 1.00 H new ATOM 1173 N VAL A 76 -4.403 -11.876 -29.725 1.00 1.00 N ATOM 1174 CA VAL A 76 -5.600 -12.742 -29.836 1.00 1.00 C ATOM 1175 C VAL A 76 -6.615 -12.328 -28.772 1.00 1.00 C ATOM 1176 O VAL A 76 -6.245 -12.133 -27.613 1.00 1.00 O ATOM 1177 CB VAL A 76 -5.192 -14.217 -29.635 1.00 1.00 C ATOM 1178 CG1 VAL A 76 -6.413 -15.142 -29.807 1.00 1.00 C ATOM 1179 CG2 VAL A 76 -4.118 -14.592 -30.671 1.00 1.00 C ATOM 0 H VAL A 76 -3.991 -11.856 -28.792 1.00 1.00 H new ATOM 0 HA VAL A 76 -6.047 -12.632 -30.824 1.00 1.00 H new ATOM 0 HB VAL A 76 -4.797 -14.340 -28.627 1.00 1.00 H new ATOM 0 HG11 VAL A 76 -6.108 -16.178 -29.662 1.00 1.00 H new ATOM 0 HG12 VAL A 76 -7.173 -14.881 -29.071 1.00 1.00 H new ATOM 0 HG13 VAL A 76 -6.822 -15.021 -30.810 1.00 1.00 H new ATOM 0 HG21 VAL A 76 -3.827 -15.633 -30.533 1.00 1.00 H new ATOM 0 HG22 VAL A 76 -4.519 -14.458 -31.676 1.00 1.00 H new ATOM 0 HG23 VAL A 76 -3.246 -13.951 -30.540 1.00 1.00 H new ATOM 1189 N THR A 77 -7.895 -12.213 -29.157 1.00 1.00 N ATOM 1190 CA THR A 77 -8.974 -11.840 -28.217 1.00 1.00 C ATOM 1191 C THR A 77 -9.922 -13.027 -28.037 1.00 1.00 C ATOM 1192 O THR A 77 -10.642 -13.402 -28.962 1.00 1.00 O ATOM 1193 CB THR A 77 -9.747 -10.634 -28.777 1.00 1.00 C ATOM 1194 OG1 THR A 77 -10.263 -10.958 -30.061 1.00 1.00 O ATOM 1195 CG2 THR A 77 -8.806 -9.426 -28.890 1.00 1.00 C ATOM 0 H THR A 77 -8.213 -12.372 -30.113 1.00 1.00 H new ATOM 0 HA THR A 77 -8.544 -11.573 -27.252 1.00 1.00 H new ATOM 0 HB THR A 77 -10.570 -10.387 -28.106 1.00 1.00 H new ATOM 0 HG1 THR A 77 -10.458 -11.917 -30.102 1.00 1.00 H new ATOM 0 HG21 THR A 77 -9.356 -8.573 -29.287 1.00 1.00 H new ATOM 0 HG22 THR A 77 -8.413 -9.178 -27.904 1.00 1.00 H new ATOM 0 HG23 THR A 77 -7.981 -9.669 -29.559 1.00 1.00 H new ATOM 1203 N LEU A 78 -9.911 -13.619 -26.837 1.00 1.00 N ATOM 1204 CA LEU A 78 -10.762 -14.776 -26.516 1.00 1.00 C ATOM 1205 C LEU A 78 -12.036 -14.294 -25.828 1.00 1.00 C ATOM 1206 O LEU A 78 -12.025 -13.258 -25.163 1.00 1.00 O ATOM 1207 CB LEU A 78 -9.990 -15.728 -25.577 1.00 1.00 C ATOM 1208 CG LEU A 78 -8.614 -16.111 -26.180 1.00 1.00 C ATOM 1209 CD1 LEU A 78 -7.848 -16.988 -25.171 1.00 1.00 C ATOM 1210 CD2 LEU A 78 -8.782 -16.883 -27.514 1.00 1.00 C ATOM 0 H LEU A 78 -9.318 -13.314 -26.065 1.00 1.00 H new ATOM 0 HA LEU A 78 -11.027 -15.305 -27.432 1.00 1.00 H new ATOM 0 HB2 LEU A 78 -9.846 -15.250 -24.608 1.00 1.00 H new ATOM 0 HB3 LEU A 78 -10.578 -16.629 -25.404 1.00 1.00 H new ATOM 0 HG LEU A 78 -8.058 -15.196 -26.385 1.00 1.00 H new ATOM 0 HD11 LEU A 78 -6.879 -17.261 -25.589 1.00 1.00 H new ATOM 0 HD12 LEU A 78 -7.700 -16.433 -24.245 1.00 1.00 H new ATOM 0 HD13 LEU A 78 -8.422 -17.891 -24.965 1.00 1.00 H new ATOM 0 HD21 LEU A 78 -7.800 -17.138 -27.913 1.00 1.00 H new ATOM 0 HD22 LEU A 78 -9.350 -17.796 -27.337 1.00 1.00 H new ATOM 0 HD23 LEU A 78 -9.314 -16.258 -28.231 1.00 1.00 H new ATOM 1222 N TYR A 79 -13.138 -15.047 -25.985 1.00 1.00 N ATOM 1223 CA TYR A 79 -14.422 -14.680 -25.362 1.00 1.00 C ATOM 1224 C TYR A 79 -15.206 -15.940 -24.977 1.00 1.00 C ATOM 1225 O TYR A 79 -15.413 -16.827 -25.804 1.00 1.00 O ATOM 1226 CB TYR A 79 -15.243 -13.831 -26.349 1.00 1.00 C ATOM 1227 CG TYR A 79 -15.492 -14.633 -27.628 1.00 1.00 C ATOM 1228 CD1 TYR A 79 -14.544 -14.624 -28.666 1.00 1.00 C ATOM 1229 CD2 TYR A 79 -16.662 -15.402 -27.765 1.00 1.00 C ATOM 1230 CE1 TYR A 79 -14.768 -15.372 -29.829 1.00 1.00 C ATOM 1231 CE2 TYR A 79 -16.880 -16.150 -28.927 1.00 1.00 C ATOM 1232 CZ TYR A 79 -15.934 -16.136 -29.958 1.00 1.00 C ATOM 1233 OH TYR A 79 -16.150 -16.876 -31.102 1.00 1.00 O ATOM 0 H TYR A 79 -13.167 -15.907 -26.533 1.00 1.00 H new ATOM 0 HA TYR A 79 -14.229 -14.102 -24.458 1.00 1.00 H new ATOM 0 HB2 TYR A 79 -16.192 -13.544 -25.896 1.00 1.00 H new ATOM 0 HB3 TYR A 79 -14.710 -12.909 -26.583 1.00 1.00 H new ATOM 0 HD1 TYR A 79 -13.641 -14.039 -28.567 1.00 1.00 H new ATOM 0 HD2 TYR A 79 -17.394 -15.415 -26.971 1.00 1.00 H new ATOM 0 HE1 TYR A 79 -14.040 -15.359 -30.627 1.00 1.00 H new ATOM 0 HE2 TYR A 79 -17.780 -16.739 -29.028 1.00 1.00 H new ATOM 0 HH TYR A 79 -17.005 -17.349 -31.029 1.00 1.00 H new ATOM 1243 N HIS A 80 -15.633 -16.021 -23.718 1.00 1.00 N ATOM 1244 CA HIS A 80 -16.389 -17.185 -23.240 1.00 1.00 C ATOM 1245 C HIS A 80 -17.171 -16.832 -21.979 1.00 1.00 C ATOM 1246 O HIS A 80 -17.821 -17.692 -21.383 1.00 1.00 O ATOM 1247 CB HIS A 80 -15.429 -18.357 -22.968 1.00 1.00 C ATOM 1248 CG HIS A 80 -16.208 -19.597 -22.603 1.00 1.00 C ATOM 1249 ND1 HIS A 80 -16.503 -19.923 -21.290 1.00 1.00 N ATOM 1250 CD2 HIS A 80 -16.769 -20.587 -23.372 1.00 1.00 C ATOM 1251 CE1 HIS A 80 -17.213 -21.065 -21.306 1.00 1.00 C ATOM 1252 NE2 HIS A 80 -17.405 -21.513 -22.550 1.00 1.00 N ATOM 0 H HIS A 80 -15.472 -15.302 -23.013 1.00 1.00 H new ATOM 0 HA HIS A 80 -17.100 -17.484 -24.010 1.00 1.00 H new ATOM 0 HB2 HIS A 80 -14.819 -18.549 -23.851 1.00 1.00 H new ATOM 0 HB3 HIS A 80 -14.746 -18.097 -22.159 1.00 1.00 H new ATOM 0 HD2 HIS A 80 -16.724 -20.639 -24.450 1.00 1.00 H new ATOM 0 HE1 HIS A 80 -17.583 -21.560 -20.420 1.00 1.00 H new ATOM 0 HE2 HIS A 80 -17.909 -22.353 -22.836 1.00 1.00 H new ATOM 1261 N ASN A 81 -17.118 -15.563 -21.580 1.00 1.00 N ATOM 1262 CA ASN A 81 -17.843 -15.111 -20.390 1.00 1.00 C ATOM 1263 C ASN A 81 -17.906 -13.584 -20.357 1.00 1.00 C ATOM 1264 O ASN A 81 -18.109 -12.978 -19.306 1.00 1.00 O ATOM 1265 CB ASN A 81 -17.156 -15.660 -19.132 1.00 1.00 C ATOM 1266 CG ASN A 81 -17.956 -15.313 -17.881 1.00 1.00 C ATOM 1267 OD1 ASN A 81 -19.183 -15.404 -17.881 1.00 1.00 O ATOM 1268 ND2 ASN A 81 -17.328 -14.912 -16.811 1.00 1.00 N ATOM 0 H ASN A 81 -16.587 -14.834 -22.056 1.00 1.00 H new ATOM 0 HA ASN A 81 -18.865 -15.488 -20.423 1.00 1.00 H new ATOM 0 HB2 ASN A 81 -17.051 -16.742 -19.213 1.00 1.00 H new ATOM 0 HB3 ASN A 81 -16.151 -15.247 -19.052 1.00 1.00 H new ATOM 0 HD21 ASN A 81 -17.854 -14.673 -15.971 1.00 1.00 H new ATOM 0 HD22 ASN A 81 -16.311 -14.838 -16.814 1.00 1.00 H new ATOM 1275 N GLY A 82 -17.746 -12.969 -21.531 1.00 1.00 N ATOM 1276 CA GLY A 82 -17.795 -11.508 -21.668 1.00 1.00 C ATOM 1277 C GLY A 82 -16.427 -10.888 -21.417 1.00 1.00 C ATOM 1278 O GLY A 82 -16.099 -9.848 -21.986 1.00 1.00 O ATOM 0 H GLY A 82 -17.580 -13.463 -22.408 1.00 1.00 H new ATOM 0 HA2 GLY A 82 -18.139 -11.245 -22.668 1.00 1.00 H new ATOM 0 HA3 GLY A 82 -18.519 -11.098 -20.964 1.00 1.00 H new ATOM 1282 N PHE A 83 -15.616 -11.537 -20.580 1.00 1.00 N ATOM 1283 CA PHE A 83 -14.272 -11.041 -20.279 1.00 1.00 C ATOM 1284 C PHE A 83 -13.372 -11.266 -21.489 1.00 1.00 C ATOM 1285 O PHE A 83 -13.498 -12.282 -22.174 1.00 1.00 O ATOM 1286 CB PHE A 83 -13.714 -11.801 -19.060 1.00 1.00 C ATOM 1287 CG PHE A 83 -14.517 -11.438 -17.809 1.00 1.00 C ATOM 1288 CD1 PHE A 83 -15.669 -12.169 -17.473 1.00 1.00 C ATOM 1289 CD2 PHE A 83 -14.113 -10.370 -16.993 1.00 1.00 C ATOM 1290 CE1 PHE A 83 -16.408 -11.834 -16.334 1.00 1.00 C ATOM 1291 CE2 PHE A 83 -14.853 -10.040 -15.852 1.00 1.00 C ATOM 1292 CZ PHE A 83 -16.000 -10.771 -15.523 1.00 1.00 C ATOM 0 H PHE A 83 -15.864 -12.403 -20.101 1.00 1.00 H new ATOM 0 HA PHE A 83 -14.309 -9.975 -20.053 1.00 1.00 H new ATOM 0 HB2 PHE A 83 -13.764 -12.876 -19.236 1.00 1.00 H new ATOM 0 HB3 PHE A 83 -12.663 -11.551 -18.914 1.00 1.00 H new ATOM 0 HD1 PHE A 83 -15.985 -12.992 -18.096 1.00 1.00 H new ATOM 0 HD2 PHE A 83 -13.230 -9.802 -17.246 1.00 1.00 H new ATOM 0 HE1 PHE A 83 -17.294 -12.397 -16.081 1.00 1.00 H new ATOM 0 HE2 PHE A 83 -14.538 -9.220 -15.224 1.00 1.00 H new ATOM 0 HZ PHE A 83 -16.570 -10.514 -14.642 1.00 1.00 H new ATOM 1302 N THR A 84 -12.457 -10.319 -21.744 1.00 1.00 N ATOM 1303 CA THR A 84 -11.519 -10.418 -22.877 1.00 1.00 C ATOM 1304 C THR A 84 -10.109 -10.068 -22.410 1.00 1.00 C ATOM 1305 O THR A 84 -9.811 -8.905 -22.148 1.00 1.00 O ATOM 1306 CB THR A 84 -11.946 -9.443 -23.983 1.00 1.00 C ATOM 1307 OG1 THR A 84 -11.874 -8.113 -23.488 1.00 1.00 O ATOM 1308 CG2 THR A 84 -13.383 -9.747 -24.418 1.00 1.00 C ATOM 0 H THR A 84 -12.345 -9.475 -21.182 1.00 1.00 H new ATOM 0 HA THR A 84 -11.529 -11.437 -23.264 1.00 1.00 H new ATOM 0 HB THR A 84 -11.281 -9.555 -24.840 1.00 1.00 H new ATOM 0 HG1 THR A 84 -11.322 -8.095 -22.678 1.00 1.00 H new ATOM 0 HG21 THR A 84 -13.680 -9.052 -25.203 1.00 1.00 H new ATOM 0 HG22 THR A 84 -13.440 -10.768 -24.796 1.00 1.00 H new ATOM 0 HG23 THR A 84 -14.052 -9.638 -23.565 1.00 1.00 H new ATOM 1316 N CYS A 85 -9.235 -11.079 -22.304 1.00 1.00 N ATOM 1317 CA CYS A 85 -7.843 -10.866 -21.866 1.00 1.00 C ATOM 1318 C CYS A 85 -6.958 -10.603 -23.083 1.00 1.00 C ATOM 1319 O CYS A 85 -7.133 -11.263 -24.108 1.00 1.00 O ATOM 1320 CB CYS A 85 -7.348 -12.121 -21.139 1.00 1.00 C ATOM 1321 SG CYS A 85 -5.651 -11.859 -20.564 1.00 1.00 S ATOM 0 H CYS A 85 -9.464 -12.051 -22.514 1.00 1.00 H new ATOM 0 HA CYS A 85 -7.798 -10.008 -21.195 1.00 1.00 H new ATOM 0 HB2 CYS A 85 -7.999 -12.345 -20.294 1.00 1.00 H new ATOM 0 HB3 CYS A 85 -7.388 -12.981 -21.808 1.00 1.00 H new ATOM 0 HG CYS A 85 -5.456 -10.592 -20.349 1.00 1.00 H new ATOM 1327 N GLU A 86 -5.995 -9.669 -22.985 1.00 1.00 N ATOM 1328 CA GLU A 86 -5.084 -9.373 -24.112 1.00 1.00 C ATOM 1329 C GLU A 86 -3.770 -10.128 -23.906 1.00 1.00 C ATOM 1330 O GLU A 86 -3.257 -10.187 -22.788 1.00 1.00 O ATOM 1331 CB GLU A 86 -4.812 -7.857 -24.172 1.00 1.00 C ATOM 1332 CG GLU A 86 -3.942 -7.506 -25.393 1.00 1.00 C ATOM 1333 CD GLU A 86 -3.702 -5.995 -25.474 1.00 1.00 C ATOM 1334 OE1 GLU A 86 -3.945 -5.314 -24.489 1.00 1.00 O ATOM 1335 OE2 GLU A 86 -3.268 -5.545 -26.520 1.00 1.00 O ATOM 0 H GLU A 86 -5.826 -9.110 -22.148 1.00 1.00 H new ATOM 0 HA GLU A 86 -5.542 -9.689 -25.049 1.00 1.00 H new ATOM 0 HB2 GLU A 86 -5.756 -7.315 -24.225 1.00 1.00 H new ATOM 0 HB3 GLU A 86 -4.311 -7.536 -23.259 1.00 1.00 H new ATOM 0 HG2 GLU A 86 -2.987 -8.027 -25.327 1.00 1.00 H new ATOM 0 HG3 GLU A 86 -4.431 -7.851 -26.304 1.00 1.00 H new ATOM 1342 N ALA A 87 -3.230 -10.704 -24.985 1.00 1.00 N ATOM 1343 CA ALA A 87 -1.965 -11.461 -24.922 1.00 1.00 C ATOM 1344 C ALA A 87 -1.139 -11.201 -26.175 1.00 1.00 C ATOM 1345 O ALA A 87 -1.695 -10.976 -27.244 1.00 1.00 O ATOM 1346 CB ALA A 87 -2.272 -12.960 -24.815 1.00 1.00 C ATOM 0 H ALA A 87 -3.646 -10.663 -25.915 1.00 1.00 H new ATOM 0 HA ALA A 87 -1.399 -11.139 -24.048 1.00 1.00 H new ATOM 0 HB1 ALA A 87 -1.338 -13.520 -24.768 1.00 1.00 H new ATOM 0 HB2 ALA A 87 -2.854 -13.149 -23.913 1.00 1.00 H new ATOM 0 HB3 ALA A 87 -2.843 -13.278 -25.688 1.00 1.00 H new ATOM 1352 N ASP A 88 0.186 -11.243 -26.051 1.00 1.00 N ATOM 1353 CA ASP A 88 1.066 -11.020 -27.203 1.00 1.00 C ATOM 1354 C ASP A 88 2.494 -11.406 -26.832 1.00 1.00 C ATOM 1355 O ASP A 88 2.931 -11.154 -25.709 1.00 1.00 O ATOM 1356 CB ASP A 88 0.997 -9.541 -27.621 1.00 1.00 C ATOM 1357 CG ASP A 88 1.346 -8.628 -26.440 1.00 1.00 C ATOM 1358 OD1 ASP A 88 1.539 -9.133 -25.343 1.00 1.00 O ATOM 1359 OD2 ASP A 88 1.409 -7.428 -26.651 1.00 1.00 O ATOM 0 H ASP A 88 0.673 -11.427 -25.174 1.00 1.00 H new ATOM 0 HA ASP A 88 0.743 -11.636 -28.042 1.00 1.00 H new ATOM 0 HB2 ASP A 88 1.687 -9.358 -28.445 1.00 1.00 H new ATOM 0 HB3 ASP A 88 -0.003 -9.307 -27.985 1.00 1.00 H new ATOM 1364 N THR A 89 3.230 -12.022 -27.767 1.00 1.00 N ATOM 1365 CA THR A 89 4.617 -12.432 -27.493 1.00 1.00 C ATOM 1366 C THR A 89 5.576 -11.275 -27.770 1.00 1.00 C ATOM 1367 O THR A 89 6.643 -11.182 -27.164 1.00 1.00 O ATOM 1368 CB THR A 89 4.984 -13.634 -28.375 1.00 1.00 C ATOM 1369 OG1 THR A 89 4.879 -13.264 -29.743 1.00 1.00 O ATOM 1370 CG2 THR A 89 4.032 -14.801 -28.088 1.00 1.00 C ATOM 0 H THR A 89 2.897 -12.245 -28.705 1.00 1.00 H new ATOM 0 HA THR A 89 4.701 -12.714 -26.443 1.00 1.00 H new ATOM 0 HB THR A 89 6.006 -13.943 -28.155 1.00 1.00 H new ATOM 0 HG1 THR A 89 4.957 -14.063 -30.305 1.00 1.00 H new ATOM 0 HG21 THR A 89 4.298 -15.651 -28.717 1.00 1.00 H new ATOM 0 HG22 THR A 89 4.113 -15.087 -27.039 1.00 1.00 H new ATOM 0 HG23 THR A 89 3.008 -14.496 -28.303 1.00 1.00 H new ATOM 1378 N LEU A 90 5.187 -10.410 -28.714 1.00 1.00 N ATOM 1379 CA LEU A 90 6.005 -9.262 -29.114 1.00 1.00 C ATOM 1380 C LEU A 90 7.361 -9.724 -29.631 1.00 1.00 C ATOM 1381 O LEU A 90 8.310 -8.942 -29.707 1.00 1.00 O ATOM 1382 CB LEU A 90 6.185 -8.270 -27.948 1.00 1.00 C ATOM 1383 CG LEU A 90 4.808 -7.808 -27.396 1.00 1.00 C ATOM 1384 CD1 LEU A 90 5.035 -6.860 -26.201 1.00 1.00 C ATOM 1385 CD2 LEU A 90 3.969 -7.081 -28.491 1.00 1.00 C ATOM 0 H LEU A 90 4.303 -10.486 -29.218 1.00 1.00 H new ATOM 0 HA LEU A 90 5.482 -8.745 -29.918 1.00 1.00 H new ATOM 0 HB2 LEU A 90 6.762 -8.740 -27.151 1.00 1.00 H new ATOM 0 HB3 LEU A 90 6.755 -7.404 -28.286 1.00 1.00 H new ATOM 0 HG LEU A 90 4.251 -8.689 -27.078 1.00 1.00 H new ATOM 0 HD11 LEU A 90 4.072 -6.532 -25.809 1.00 1.00 H new ATOM 0 HD12 LEU A 90 5.585 -7.384 -25.420 1.00 1.00 H new ATOM 0 HD13 LEU A 90 5.608 -5.992 -26.528 1.00 1.00 H new ATOM 0 HD21 LEU A 90 3.012 -6.771 -28.071 1.00 1.00 H new ATOM 0 HD22 LEU A 90 4.512 -6.204 -28.842 1.00 1.00 H new ATOM 0 HD23 LEU A 90 3.796 -7.759 -29.327 1.00 1.00 H new ATOM 1397 N GLY A 91 7.448 -11.008 -29.980 1.00 1.00 N ATOM 1398 CA GLY A 91 8.690 -11.582 -30.484 1.00 1.00 C ATOM 1399 C GLY A 91 9.691 -11.731 -29.350 1.00 1.00 C ATOM 1400 O GLY A 91 10.867 -12.012 -29.574 1.00 1.00 O ATOM 0 H GLY A 91 6.672 -11.668 -29.922 1.00 1.00 H new ATOM 0 HA2 GLY A 91 8.494 -12.554 -30.937 1.00 1.00 H new ATOM 0 HA3 GLY A 91 9.105 -10.944 -31.265 1.00 1.00 H new ATOM 1404 N SER A 92 9.207 -11.534 -28.119 1.00 1.00 N ATOM 1405 CA SER A 92 10.054 -11.636 -26.929 1.00 1.00 C ATOM 1406 C SER A 92 10.870 -12.921 -26.920 1.00 1.00 C ATOM 1407 O SER A 92 11.920 -12.954 -26.282 1.00 1.00 O ATOM 1408 CB SER A 92 9.208 -11.552 -25.658 1.00 1.00 C ATOM 1409 OG SER A 92 10.066 -11.591 -24.525 1.00 1.00 O ATOM 0 H SER A 92 8.233 -11.303 -27.922 1.00 1.00 H new ATOM 0 HA SER A 92 10.749 -10.797 -26.957 1.00 1.00 H new ATOM 0 HB2 SER A 92 8.623 -10.632 -25.656 1.00 1.00 H new ATOM 0 HB3 SER A 92 8.500 -12.380 -25.622 1.00 1.00 H new ATOM 0 HG SER A 92 10.957 -11.892 -24.800 1.00 1.00 H new ATOM 1415 N CYS A 93 10.426 -13.956 -27.661 1.00 1.00 N ATOM 1416 CA CYS A 93 11.195 -15.214 -27.754 1.00 1.00 C ATOM 1417 C CYS A 93 11.885 -15.601 -26.445 1.00 1.00 C ATOM 1418 O CYS A 93 12.980 -16.162 -26.453 1.00 1.00 O ATOM 1419 CB CYS A 93 12.250 -15.055 -28.870 1.00 1.00 C ATOM 1420 SG CYS A 93 13.499 -13.829 -28.407 1.00 1.00 S ATOM 0 H CYS A 93 9.556 -13.948 -28.194 1.00 1.00 H new ATOM 0 HA CYS A 93 10.493 -16.017 -27.978 1.00 1.00 H new ATOM 0 HB2 CYS A 93 12.730 -16.015 -29.062 1.00 1.00 H new ATOM 0 HB3 CYS A 93 11.762 -14.752 -29.796 1.00 1.00 H new ATOM 0 HG CYS A 93 13.182 -13.297 -27.264 1.00 1.00 H new ATOM 1426 N GLY A 94 11.234 -15.291 -25.319 1.00 1.00 N ATOM 1427 CA GLY A 94 11.795 -15.605 -24.003 1.00 1.00 C ATOM 1428 C GLY A 94 10.742 -15.518 -22.901 1.00 1.00 C ATOM 1429 O GLY A 94 10.550 -16.480 -22.156 1.00 1.00 O ATOM 0 H GLY A 94 10.326 -14.827 -25.293 1.00 1.00 H new ATOM 0 HA2 GLY A 94 12.221 -16.608 -24.020 1.00 1.00 H new ATOM 0 HA3 GLY A 94 12.610 -14.916 -23.782 1.00 1.00 H new ATOM 1433 N TYR A 95 10.068 -14.357 -22.791 1.00 1.00 N ATOM 1434 CA TYR A 95 9.033 -14.129 -21.762 1.00 1.00 C ATOM 1435 C TYR A 95 7.718 -13.712 -22.414 1.00 1.00 C ATOM 1436 O TYR A 95 7.714 -12.908 -23.346 1.00 1.00 O ATOM 1437 CB TYR A 95 9.501 -13.002 -20.818 1.00 1.00 C ATOM 1438 CG TYR A 95 10.771 -13.440 -20.086 1.00 1.00 C ATOM 1439 CD1 TYR A 95 12.032 -13.210 -20.660 1.00 1.00 C ATOM 1440 CD2 TYR A 95 10.684 -14.088 -18.838 1.00 1.00 C ATOM 1441 CE1 TYR A 95 13.192 -13.619 -19.993 1.00 1.00 C ATOM 1442 CE2 TYR A 95 11.847 -14.496 -18.175 1.00 1.00 C ATOM 1443 CZ TYR A 95 13.101 -14.263 -18.752 1.00 1.00 C ATOM 1444 OH TYR A 95 14.248 -14.666 -18.099 1.00 1.00 O ATOM 0 H TYR A 95 10.223 -13.558 -23.406 1.00 1.00 H new ATOM 0 HA TYR A 95 8.878 -15.053 -21.205 1.00 1.00 H new ATOM 0 HB2 TYR A 95 9.693 -12.093 -21.388 1.00 1.00 H new ATOM 0 HB3 TYR A 95 8.717 -12.768 -20.098 1.00 1.00 H new ATOM 0 HD1 TYR A 95 12.106 -12.717 -21.618 1.00 1.00 H new ATOM 0 HD2 TYR A 95 9.717 -14.270 -18.392 1.00 1.00 H new ATOM 0 HE1 TYR A 95 14.160 -13.438 -20.436 1.00 1.00 H new ATOM 0 HE2 TYR A 95 11.777 -14.991 -17.218 1.00 1.00 H new ATOM 0 HH TYR A 95 14.008 -15.095 -17.251 1.00 1.00 H new ATOM 1454 N VAL A 96 6.609 -14.241 -21.904 1.00 1.00 N ATOM 1455 CA VAL A 96 5.269 -13.911 -22.413 1.00 1.00 C ATOM 1456 C VAL A 96 4.568 -12.994 -21.407 1.00 1.00 C ATOM 1457 O VAL A 96 4.310 -13.403 -20.274 1.00 1.00 O ATOM 1458 CB VAL A 96 4.461 -15.217 -22.598 1.00 1.00 C ATOM 1459 CG1 VAL A 96 3.123 -14.918 -23.300 1.00 1.00 C ATOM 1460 CG2 VAL A 96 5.279 -16.202 -23.460 1.00 1.00 C ATOM 0 H VAL A 96 6.607 -14.907 -21.131 1.00 1.00 H new ATOM 0 HA VAL A 96 5.344 -13.401 -23.373 1.00 1.00 H new ATOM 0 HB VAL A 96 4.260 -15.655 -21.620 1.00 1.00 H new ATOM 0 HG11 VAL A 96 2.563 -15.845 -23.425 1.00 1.00 H new ATOM 0 HG12 VAL A 96 2.542 -14.222 -22.695 1.00 1.00 H new ATOM 0 HG13 VAL A 96 3.316 -14.476 -24.278 1.00 1.00 H new ATOM 0 HG21 VAL A 96 4.714 -17.125 -23.594 1.00 1.00 H new ATOM 0 HG22 VAL A 96 5.478 -15.754 -24.434 1.00 1.00 H new ATOM 0 HG23 VAL A 96 6.223 -16.424 -22.962 1.00 1.00 H new ATOM 1470 N TYR A 97 4.273 -11.748 -21.815 1.00 1.00 N ATOM 1471 CA TYR A 97 3.609 -10.769 -20.926 1.00 1.00 C ATOM 1472 C TYR A 97 2.112 -10.758 -21.233 1.00 1.00 C ATOM 1473 O TYR A 97 1.720 -10.764 -22.401 1.00 1.00 O ATOM 1474 CB TYR A 97 4.209 -9.336 -21.141 1.00 1.00 C ATOM 1475 CG TYR A 97 5.700 -9.447 -21.469 1.00 1.00 C ATOM 1476 CD1 TYR A 97 6.597 -9.899 -20.492 1.00 1.00 C ATOM 1477 CD2 TYR A 97 6.185 -9.107 -22.747 1.00 1.00 C ATOM 1478 CE1 TYR A 97 7.961 -10.006 -20.781 1.00 1.00 C ATOM 1479 CE2 TYR A 97 7.550 -9.217 -23.032 1.00 1.00 C ATOM 1480 CZ TYR A 97 8.438 -9.666 -22.050 1.00 1.00 C ATOM 1481 OH TYR A 97 9.783 -9.775 -22.334 1.00 1.00 O ATOM 0 H TYR A 97 4.481 -11.393 -22.748 1.00 1.00 H new ATOM 0 HA TYR A 97 3.773 -11.056 -19.887 1.00 1.00 H new ATOM 0 HB2 TYR A 97 3.685 -8.829 -21.951 1.00 1.00 H new ATOM 0 HB3 TYR A 97 4.068 -8.733 -20.244 1.00 1.00 H new ATOM 0 HD1 TYR A 97 6.233 -10.166 -19.511 1.00 1.00 H new ATOM 0 HD2 TYR A 97 5.502 -8.761 -23.508 1.00 1.00 H new ATOM 0 HE1 TYR A 97 8.647 -10.352 -20.022 1.00 1.00 H new ATOM 0 HE2 TYR A 97 7.919 -8.955 -24.013 1.00 1.00 H new ATOM 0 HH TYR A 97 9.911 -10.406 -23.072 1.00 1.00 H new ATOM 1491 N ILE A 98 1.281 -10.729 -20.187 1.00 1.00 N ATOM 1492 CA ILE A 98 -0.185 -10.698 -20.351 1.00 1.00 C ATOM 1493 C ILE A 98 -0.798 -9.722 -19.356 1.00 1.00 C ATOM 1494 O ILE A 98 -0.172 -9.357 -18.361 1.00 1.00 O ATOM 1495 CB ILE A 98 -0.775 -12.122 -20.178 1.00 1.00 C ATOM 1496 CG1 ILE A 98 -0.348 -12.709 -18.806 1.00 1.00 C ATOM 1497 CG2 ILE A 98 -0.276 -13.036 -21.317 1.00 1.00 C ATOM 1498 CD1 ILE A 98 -1.053 -14.050 -18.548 1.00 1.00 C ATOM 0 H ILE A 98 1.593 -10.726 -19.216 1.00 1.00 H new ATOM 0 HA ILE A 98 -0.427 -10.356 -21.357 1.00 1.00 H new ATOM 0 HB ILE A 98 -1.863 -12.064 -20.216 1.00 1.00 H new ATOM 0 HG12 ILE A 98 0.733 -12.850 -18.785 1.00 1.00 H new ATOM 0 HG13 ILE A 98 -0.593 -12.005 -18.011 1.00 1.00 H new ATOM 0 HG21 ILE A 98 -0.693 -14.035 -21.191 1.00 1.00 H new ATOM 0 HG22 ILE A 98 -0.594 -12.628 -22.277 1.00 1.00 H new ATOM 0 HG23 ILE A 98 0.812 -13.091 -21.289 1.00 1.00 H new ATOM 0 HD11 ILE A 98 -0.741 -14.445 -17.581 1.00 1.00 H new ATOM 0 HD12 ILE A 98 -2.133 -13.899 -18.547 1.00 1.00 H new ATOM 0 HD13 ILE A 98 -0.787 -14.758 -19.333 1.00 1.00 H new ATOM 1510 N ALA A 99 -2.028 -9.302 -19.635 1.00 1.00 N ATOM 1511 CA ALA A 99 -2.740 -8.363 -18.769 1.00 1.00 C ATOM 1512 C ALA A 99 -4.245 -8.592 -18.879 1.00 1.00 C ATOM 1513 O ALA A 99 -4.753 -8.990 -19.927 1.00 1.00 O ATOM 1514 CB ALA A 99 -2.395 -6.922 -19.161 1.00 1.00 C ATOM 0 H ALA A 99 -2.556 -9.597 -20.457 1.00 1.00 H new ATOM 0 HA ALA A 99 -2.432 -8.529 -17.737 1.00 1.00 H new ATOM 0 HB1 ALA A 99 -2.930 -6.230 -18.511 1.00 1.00 H new ATOM 0 HB2 ALA A 99 -1.322 -6.763 -19.055 1.00 1.00 H new ATOM 0 HB3 ALA A 99 -2.688 -6.747 -20.196 1.00 1.00 H new ATOM 1520 N VAL A 100 -4.939 -8.347 -17.762 1.00 1.00 N ATOM 1521 CA VAL A 100 -6.394 -8.525 -17.659 1.00 1.00 C ATOM 1522 C VAL A 100 -7.042 -7.193 -17.275 1.00 1.00 C ATOM 1523 O VAL A 100 -6.602 -6.528 -16.336 1.00 1.00 O ATOM 1524 CB VAL A 100 -6.704 -9.586 -16.574 1.00 1.00 C ATOM 1525 CG1 VAL A 100 -8.216 -9.888 -16.535 1.00 1.00 C ATOM 1526 CG2 VAL A 100 -5.928 -10.879 -16.886 1.00 1.00 C ATOM 0 H VAL A 100 -4.506 -8.018 -16.899 1.00 1.00 H new ATOM 0 HA VAL A 100 -6.793 -8.858 -18.617 1.00 1.00 H new ATOM 0 HB VAL A 100 -6.398 -9.198 -15.602 1.00 1.00 H new ATOM 0 HG11 VAL A 100 -8.418 -10.635 -15.768 1.00 1.00 H new ATOM 0 HG12 VAL A 100 -8.764 -8.974 -16.305 1.00 1.00 H new ATOM 0 HG13 VAL A 100 -8.536 -10.268 -17.505 1.00 1.00 H new ATOM 0 HG21 VAL A 100 -6.145 -11.627 -16.123 1.00 1.00 H new ATOM 0 HG22 VAL A 100 -6.230 -11.258 -17.862 1.00 1.00 H new ATOM 0 HG23 VAL A 100 -4.859 -10.669 -16.894 1.00 1.00 H new ATOM 1536 N TYR A 101 -8.090 -6.817 -18.013 1.00 1.00 N ATOM 1537 CA TYR A 101 -8.828 -5.569 -17.782 1.00 1.00 C ATOM 1538 C TYR A 101 -10.333 -5.882 -17.761 1.00 1.00 C ATOM 1539 O TYR A 101 -10.959 -5.930 -18.819 1.00 1.00 O ATOM 1540 CB TYR A 101 -8.501 -4.565 -18.910 1.00 1.00 C ATOM 1541 CG TYR A 101 -8.745 -5.194 -20.285 1.00 1.00 C ATOM 1542 CD1 TYR A 101 -7.839 -6.144 -20.788 1.00 1.00 C ATOM 1543 CD2 TYR A 101 -9.859 -4.822 -21.066 1.00 1.00 C ATOM 1544 CE1 TYR A 101 -8.046 -6.716 -22.047 1.00 1.00 C ATOM 1545 CE2 TYR A 101 -10.058 -5.399 -22.328 1.00 1.00 C ATOM 1546 CZ TYR A 101 -9.153 -6.344 -22.816 1.00 1.00 C ATOM 1547 OH TYR A 101 -9.348 -6.912 -24.060 1.00 1.00 O ATOM 0 H TYR A 101 -8.453 -7.370 -18.790 1.00 1.00 H new ATOM 0 HA TYR A 101 -8.539 -5.128 -16.828 1.00 1.00 H new ATOM 0 HB2 TYR A 101 -9.117 -3.673 -18.799 1.00 1.00 H new ATOM 0 HB3 TYR A 101 -7.462 -4.247 -18.830 1.00 1.00 H new ATOM 0 HD1 TYR A 101 -6.980 -6.433 -20.200 1.00 1.00 H new ATOM 0 HD2 TYR A 101 -10.560 -4.091 -20.691 1.00 1.00 H new ATOM 0 HE1 TYR A 101 -7.348 -7.448 -22.427 1.00 1.00 H new ATOM 0 HE2 TYR A 101 -10.912 -5.112 -22.924 1.00 1.00 H new ATOM 0 HH TYR A 101 -10.229 -7.339 -24.090 1.00 1.00 H new ATOM 1557 N PRO A 102 -10.945 -6.113 -16.601 1.00 1.00 N ATOM 1558 CA PRO A 102 -12.411 -6.438 -16.537 1.00 1.00 C ATOM 1559 C PRO A 102 -13.250 -5.437 -17.339 1.00 1.00 C ATOM 1560 O PRO A 102 -13.004 -4.232 -17.284 1.00 1.00 O ATOM 1561 CB PRO A 102 -12.726 -6.370 -15.019 1.00 1.00 C ATOM 1562 CG PRO A 102 -11.429 -6.746 -14.361 1.00 1.00 C ATOM 1563 CD PRO A 102 -10.337 -6.111 -15.245 1.00 1.00 C ATOM 0 HA PRO A 102 -12.650 -7.407 -16.975 1.00 1.00 H new ATOM 0 HB2 PRO A 102 -13.049 -5.372 -14.723 1.00 1.00 H new ATOM 0 HB3 PRO A 102 -13.526 -7.058 -14.746 1.00 1.00 H new ATOM 0 HG2 PRO A 102 -11.380 -6.368 -13.340 1.00 1.00 H new ATOM 0 HG3 PRO A 102 -11.313 -7.828 -14.306 1.00 1.00 H new ATOM 0 HD2 PRO A 102 -10.091 -5.101 -14.917 1.00 1.00 H new ATOM 0 HD3 PRO A 102 -9.413 -6.688 -15.218 1.00 1.00 H new ATOM 1571 N THR A 103 -14.244 -5.945 -18.087 1.00 1.00 N ATOM 1572 CA THR A 103 -15.121 -5.084 -18.903 1.00 1.00 C ATOM 1573 C THR A 103 -16.402 -4.771 -18.138 1.00 1.00 C ATOM 1574 O THR A 103 -16.867 -5.582 -17.339 1.00 1.00 O ATOM 1575 CB THR A 103 -15.477 -5.783 -20.229 1.00 1.00 C ATOM 1576 OG1 THR A 103 -16.499 -5.046 -20.883 1.00 1.00 O ATOM 1577 CG2 THR A 103 -15.973 -7.211 -19.968 1.00 1.00 C ATOM 0 H THR A 103 -14.461 -6.940 -18.145 1.00 1.00 H new ATOM 0 HA THR A 103 -14.590 -4.157 -19.119 1.00 1.00 H new ATOM 0 HB THR A 103 -14.586 -5.829 -20.855 1.00 1.00 H new ATOM 0 HG1 THR A 103 -16.729 -5.485 -21.729 1.00 1.00 H new ATOM 0 HG21 THR A 103 -16.220 -7.689 -20.916 1.00 1.00 H new ATOM 0 HG22 THR A 103 -15.192 -7.782 -19.466 1.00 1.00 H new ATOM 0 HG23 THR A 103 -16.861 -7.178 -19.336 1.00 1.00 H new ATOM 1585 N GLN A 104 -16.965 -3.590 -18.384 1.00 1.00 N ATOM 1586 CA GLN A 104 -18.194 -3.179 -17.705 1.00 1.00 C ATOM 1587 C GLN A 104 -19.354 -4.094 -18.110 1.00 1.00 C ATOM 1588 O GLN A 104 -20.201 -3.721 -18.923 1.00 1.00 O ATOM 1589 CB GLN A 104 -18.528 -1.721 -18.069 1.00 1.00 C ATOM 1590 CG GLN A 104 -17.366 -0.785 -17.680 1.00 1.00 C ATOM 1591 CD GLN A 104 -17.157 -0.771 -16.165 1.00 1.00 C ATOM 1592 OE1 GLN A 104 -18.105 -0.559 -15.409 1.00 1.00 O ATOM 1593 NE2 GLN A 104 -15.965 -0.982 -15.678 1.00 1.00 N ATOM 0 H GLN A 104 -16.594 -2.905 -19.043 1.00 1.00 H new ATOM 0 HA GLN A 104 -18.044 -3.256 -16.628 1.00 1.00 H new ATOM 0 HB2 GLN A 104 -18.723 -1.643 -19.139 1.00 1.00 H new ATOM 0 HB3 GLN A 104 -19.439 -1.412 -17.556 1.00 1.00 H new ATOM 0 HG2 GLN A 104 -16.451 -1.111 -18.174 1.00 1.00 H new ATOM 0 HG3 GLN A 104 -17.575 0.225 -18.031 1.00 1.00 H new ATOM 0 HE21 GLN A 104 -15.181 -1.157 -16.306 1.00 1.00 H new ATOM 0 HE22 GLN A 104 -15.817 -0.972 -14.669 1.00 1.00 H new ATOM 1602 N ARG A 105 -19.382 -5.294 -17.532 1.00 1.00 N ATOM 1603 CA ARG A 105 -20.436 -6.265 -17.827 1.00 1.00 C ATOM 1604 C ARG A 105 -21.812 -5.698 -17.465 1.00 1.00 C ATOM 1605 O ARG A 105 -22.797 -6.249 -17.929 1.00 1.00 O ATOM 1606 CB ARG A 105 -20.169 -7.572 -17.053 1.00 1.00 C ATOM 1607 CG ARG A 105 -20.034 -7.280 -15.548 1.00 1.00 C ATOM 1608 CD ARG A 105 -19.782 -8.582 -14.782 1.00 1.00 C ATOM 1609 NE ARG A 105 -19.640 -8.295 -13.349 1.00 1.00 N ATOM 1610 CZ ARG A 105 -20.693 -7.997 -12.578 1.00 1.00 C ATOM 1611 NH1 ARG A 105 -21.892 -7.938 -13.094 1.00 1.00 N ATOM 1612 NH2 ARG A 105 -20.519 -7.756 -11.308 1.00 1.00 N ATOM 0 H ARG A 105 -18.688 -5.617 -16.858 1.00 1.00 H new ATOM 0 HA ARG A 105 -20.430 -6.477 -18.896 1.00 1.00 H new ATOM 0 HB2 ARG A 105 -20.983 -8.277 -17.223 1.00 1.00 H new ATOM 0 HB3 ARG A 105 -19.258 -8.043 -17.423 1.00 1.00 H new ATOM 0 HG2 ARG A 105 -19.214 -6.583 -15.377 1.00 1.00 H new ATOM 0 HG3 ARG A 105 -20.941 -6.801 -15.179 1.00 1.00 H new ATOM 0 HD2 ARG A 105 -20.607 -9.276 -14.944 1.00 1.00 H new ATOM 0 HD3 ARG A 105 -18.880 -9.067 -15.157 1.00 1.00 H new ATOM 0 HE ARG A 105 -18.711 -8.324 -12.928 1.00 1.00 H new ATOM 0 HH11 ARG A 105 -22.029 -8.119 -14.088 1.00 1.00 H new ATOM 0 HH12 ARG A 105 -22.691 -7.711 -12.502 1.00 1.00 H new ATOM 0 HH21 ARG A 105 -19.583 -7.795 -10.905 1.00 1.00 H new ATOM 0 HH22 ARG A 105 -21.319 -7.529 -10.718 1.00 1.00 H new TER 1626 ARG A 105