USER MOD reduce.3.24.130724 H: found=0, std=0, add=944, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 946 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 32 SER OG : rot 150:sc= 1.13 USER MOD Set 1.2: A 33 SER OG : rot 101:sc= 0.497 USER MOD Set 1.3: A 92 TYR OH : rot 38:sc= 1.23 USER MOD Set 2.1: A 26 SER OG : rot 52:sc= 0.319 USER MOD Set 2.2: A 73 ASN : amide:sc= -0.442 K(o=-3.4,f=-5.4) USER MOD Set 2.3: A 79 TYR OH : rot 58:sc= -3.29! USER MOD Set 3.1: A 18 SER OG : rot -18:sc= -0.166 USER MOD Set 3.2: A 22 HIS : no HE2:sc= -3.53! X(o=-3.7!,f=-4.1) USER MOD Set 4.1: A 3 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 12 ASN : amide:sc= -0.608 K(o=-0.39,f=-1.5) USER MOD Set 4.3: A 15 LYS NZ :NH3+ 159:sc= 0.219 (180deg=-0.028) USER MOD Single : A 5 THR OG1 : rot 180:sc= -1.77! USER MOD Single : A 11 TYR OH : rot 50:sc= -0.701 USER MOD Single : A 13 GLN :FLIP amide:sc= -4.67 F(o=-5.7!,f=-4.7) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=-0.079) USER MOD Single : A 19 ASN :FLIP amide:sc= -0.592 F(o=-1.2,f=-0.59) USER MOD Single : A 20 SER OG : rot -55:sc= 0.743 USER MOD Single : A 21 HIS :FLIP no HD1:sc= -0.595 F(o=-1.7,f=-0.6) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 170:sc= 0.158 USER MOD Single : A 34 TYR OH : rot 180:sc= -0.0112 USER MOD Single : A 36 HIS : no HE2:sc= -8.26 K(o=-8.3,f=-9.8!) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= -1.62 K(o=-1.6,f=-5.3!) USER MOD Single : A 42 TYR OH : rot -111:sc= 0.00316 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.129 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot -35:sc= 0.128 USER MOD Single : A 67 LYS NZ :NH3+ 170:sc= 0.235 (180deg=0.19) USER MOD Single : A 68 HIS : no HE2:sc= -6.92! C(o=-6.9!,f=-10!) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 160:sc= -0.0141 (180deg=-0.264) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 HIS :FLIP no HD1:sc= -2.51! C(o=-4!,f=-2.5!) USER MOD Single : A 85 THR OG1 : rot -160:sc= 0 USER MOD Single : A 90 HIS : no HD1:sc= -1.7 X(o=-1.7,f=-1.9) USER MOD Single : A 93 LYS NZ :NH3+ -151:sc= -0.0487 (180deg=-0.805) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 174:sc= 0.899 (180deg=0.845) USER MOD Single : A 100 LYS NZ :NH3+ 152:sc= -0.123 (180deg=-0.654) USER MOD Single : A 102 ASN : amide:sc= -0.175 K(o=-0.17,f=-0.86) USER MOD Single : A 110 TYR OH : rot 180:sc= -0.0112 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 ASN : amide:sc= -0.118 X(o=-0.12,f=-0.38) USER MOD Single : A 115 LYS NZ :NH3+ -138:sc= -0.242 (180deg=-0.969) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 SER OG : rot 180:sc= -0.0155 USER MOD Single : A 136 HIS : no HE2:sc= -1.69 X(o=-1.7,f=-1.3!) USER MOD ----------------------------------------------------------------- ATOM 13 N VAL A 2 1.553 1.115 -3.309 1.00 0.00 N ATOM 14 CA VAL A 2 0.741 1.468 -4.467 1.00 0.00 C ATOM 15 C VAL A 2 1.341 0.814 -5.698 1.00 0.00 C ATOM 16 O VAL A 2 2.555 0.675 -5.797 1.00 0.00 O ATOM 17 CB VAL A 2 0.626 2.993 -4.563 1.00 0.00 C ATOM 18 CG1 VAL A 2 2.007 3.656 -4.580 1.00 0.00 C ATOM 19 CG2 VAL A 2 -0.183 3.383 -5.789 1.00 0.00 C ATOM 0 HA VAL A 2 -0.279 1.094 -4.375 1.00 0.00 H new ATOM 0 HB VAL A 2 0.104 3.352 -3.676 1.00 0.00 H new ATOM 0 HG11 VAL A 2 1.891 4.738 -4.649 1.00 0.00 H new ATOM 0 HG12 VAL A 2 2.542 3.406 -3.664 1.00 0.00 H new ATOM 0 HG13 VAL A 2 2.573 3.297 -5.440 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -0.257 4.469 -5.846 1.00 0.00 H new ATOM 0 HG22 VAL A 2 0.310 3.006 -6.685 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -1.183 2.954 -5.717 1.00 0.00 H new ATOM 29 N THR A 3 0.508 0.337 -6.604 1.00 0.00 N ATOM 30 CA THR A 3 0.958 -0.281 -7.836 1.00 0.00 C ATOM 31 C THR A 3 1.202 0.772 -8.899 1.00 0.00 C ATOM 32 O THR A 3 0.275 1.439 -9.329 1.00 0.00 O ATOM 33 CB THR A 3 -0.063 -1.323 -8.235 1.00 0.00 C ATOM 34 OG1 THR A 3 0.387 -2.558 -7.706 1.00 0.00 O ATOM 35 CG2 THR A 3 -0.186 -1.496 -9.723 1.00 0.00 C ATOM 0 H THR A 3 -0.507 0.368 -6.504 1.00 0.00 H new ATOM 0 HA THR A 3 1.916 -0.783 -7.702 1.00 0.00 H new ATOM 0 HB THR A 3 -1.035 -1.005 -7.858 1.00 0.00 H new ATOM 0 HG1 THR A 3 -0.249 -3.266 -7.940 1.00 0.00 H new ATOM 0 HG21 THR A 3 -0.935 -2.258 -9.940 1.00 0.00 H new ATOM 0 HG22 THR A 3 -0.488 -0.551 -10.175 1.00 0.00 H new ATOM 0 HG23 THR A 3 0.775 -1.805 -10.134 1.00 0.00 H new ATOM 43 N TRP A 4 2.457 0.967 -9.280 1.00 0.00 N ATOM 44 CA TRP A 4 2.827 1.881 -10.329 1.00 0.00 C ATOM 45 C TRP A 4 2.585 1.268 -11.691 1.00 0.00 C ATOM 46 O TRP A 4 2.895 0.104 -11.918 1.00 0.00 O ATOM 47 CB TRP A 4 4.266 2.294 -10.127 1.00 0.00 C ATOM 48 CG TRP A 4 4.512 3.073 -8.861 1.00 0.00 C ATOM 49 CD1 TRP A 4 4.332 2.617 -7.603 1.00 0.00 C ATOM 50 CD2 TRP A 4 5.014 4.427 -8.725 1.00 0.00 C ATOM 51 NE1 TRP A 4 4.686 3.619 -6.702 1.00 0.00 N ATOM 52 CE2 TRP A 4 5.100 4.755 -7.355 1.00 0.00 C ATOM 53 CE3 TRP A 4 5.432 5.390 -9.643 1.00 0.00 C ATOM 54 CZ2 TRP A 4 5.548 5.989 -6.896 1.00 0.00 C ATOM 55 CZ3 TRP A 4 5.936 6.627 -9.211 1.00 0.00 C ATOM 56 CH2 TRP A 4 5.997 6.925 -7.838 1.00 0.00 C ATOM 0 H TRP A 4 3.250 0.484 -8.858 1.00 0.00 H new ATOM 0 HA TRP A 4 2.203 2.774 -10.285 1.00 0.00 H new ATOM 0 HB2 TRP A 4 4.891 1.401 -10.118 1.00 0.00 H new ATOM 0 HB3 TRP A 4 4.583 2.896 -10.979 1.00 0.00 H new ATOM 0 HD1 TRP A 4 3.972 1.634 -7.338 1.00 0.00 H new ATOM 0 HE1 TRP A 4 4.643 3.522 -5.688 1.00 0.00 H new ATOM 0 HE3 TRP A 4 5.367 5.181 -10.701 1.00 0.00 H new ATOM 0 HZ2 TRP A 4 5.550 6.220 -5.841 1.00 0.00 H new ATOM 0 HZ3 TRP A 4 6.278 7.352 -9.935 1.00 0.00 H new ATOM 0 HH2 TRP A 4 6.390 7.876 -7.509 1.00 0.00 H new ATOM 67 N THR A 5 2.072 2.065 -12.619 1.00 0.00 N ATOM 68 CA THR A 5 1.748 1.589 -13.954 1.00 0.00 C ATOM 69 C THR A 5 2.523 2.391 -14.956 1.00 0.00 C ATOM 70 O THR A 5 2.439 3.623 -14.987 1.00 0.00 O ATOM 71 CB THR A 5 0.231 1.631 -14.186 1.00 0.00 C ATOM 72 OG1 THR A 5 -0.225 0.318 -13.994 1.00 0.00 O ATOM 73 CG2 THR A 5 -0.188 1.985 -15.611 1.00 0.00 C ATOM 0 H THR A 5 1.870 3.053 -12.468 1.00 0.00 H new ATOM 0 HA THR A 5 2.039 0.545 -14.070 1.00 0.00 H new ATOM 0 HB THR A 5 -0.173 2.390 -13.516 1.00 0.00 H new ATOM 0 HG1 THR A 5 -1.195 0.286 -14.129 1.00 0.00 H new ATOM 0 HG21 THR A 5 -1.276 1.991 -15.680 1.00 0.00 H new ATOM 0 HG22 THR A 5 0.197 2.972 -15.869 1.00 0.00 H new ATOM 0 HG23 THR A 5 0.215 1.246 -16.303 1.00 0.00 H new ATOM 81 N CYS A 6 3.285 1.699 -15.802 1.00 0.00 N ATOM 82 CA CYS A 6 4.050 2.338 -16.857 1.00 0.00 C ATOM 83 C CYS A 6 3.521 1.944 -18.225 1.00 0.00 C ATOM 84 O CYS A 6 4.284 1.645 -19.143 1.00 0.00 O ATOM 85 CB CYS A 6 5.515 1.995 -16.692 1.00 0.00 C ATOM 86 SG CYS A 6 6.055 2.185 -14.986 1.00 0.00 S ATOM 0 H CYS A 6 3.385 0.684 -15.771 1.00 0.00 H new ATOM 0 HA CYS A 6 3.942 3.420 -16.781 1.00 0.00 H new ATOM 0 HB2 CYS A 6 5.687 0.969 -17.016 1.00 0.00 H new ATOM 0 HB3 CYS A 6 6.114 2.638 -17.337 1.00 0.00 H new ATOM 91 N GLY A 7 2.193 1.880 -18.353 1.00 0.00 N ATOM 92 CA GLY A 7 1.531 1.502 -19.586 1.00 0.00 C ATOM 93 C GLY A 7 0.366 0.575 -19.322 1.00 0.00 C ATOM 94 O GLY A 7 -0.714 1.039 -18.985 1.00 0.00 O ATOM 0 H GLY A 7 1.549 2.093 -17.591 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.178 2.396 -20.101 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.245 1.013 -20.249 1.00 0.00 H new ATOM 98 N GLY A 8 0.609 -0.730 -19.417 1.00 0.00 N ATOM 99 CA GLY A 8 -0.399 -1.752 -19.137 1.00 0.00 C ATOM 100 C GLY A 8 0.044 -2.739 -18.073 1.00 0.00 C ATOM 101 O GLY A 8 -0.655 -3.707 -17.782 1.00 0.00 O ATOM 0 H GLY A 8 1.514 -1.111 -19.692 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -1.321 -1.268 -18.816 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -0.626 -2.293 -20.056 1.00 0.00 H new ATOM 105 N LEU A 9 1.243 -2.544 -17.515 1.00 0.00 N ATOM 106 CA LEU A 9 1.857 -3.469 -16.594 1.00 0.00 C ATOM 107 C LEU A 9 1.790 -2.816 -15.231 1.00 0.00 C ATOM 108 O LEU A 9 1.970 -1.596 -15.118 1.00 0.00 O ATOM 109 CB LEU A 9 3.290 -3.846 -17.018 1.00 0.00 C ATOM 110 CG LEU A 9 3.715 -3.539 -18.470 1.00 0.00 C ATOM 111 CD1 LEU A 9 2.665 -4.029 -19.480 1.00 0.00 C ATOM 112 CD2 LEU A 9 4.048 -2.043 -18.641 1.00 0.00 C ATOM 0 H LEU A 9 1.814 -1.720 -17.703 1.00 0.00 H new ATOM 0 HA LEU A 9 1.328 -4.422 -16.579 1.00 0.00 H new ATOM 0 HB2 LEU A 9 3.983 -3.333 -16.351 1.00 0.00 H new ATOM 0 HB3 LEU A 9 3.419 -4.915 -16.850 1.00 0.00 H new ATOM 0 HG LEU A 9 4.628 -4.095 -18.682 1.00 0.00 H new ATOM 0 HD11 LEU A 9 2.997 -3.796 -20.492 1.00 0.00 H new ATOM 0 HD12 LEU A 9 2.538 -5.107 -19.379 1.00 0.00 H new ATOM 0 HD13 LEU A 9 1.714 -3.532 -19.287 1.00 0.00 H new ATOM 0 HD21 LEU A 9 4.345 -1.852 -19.672 1.00 0.00 H new ATOM 0 HD22 LEU A 9 3.169 -1.445 -18.399 1.00 0.00 H new ATOM 0 HD23 LEU A 9 4.866 -1.774 -17.972 1.00 0.00 H new ATOM 124 N LEU A 10 1.508 -3.627 -14.218 1.00 0.00 N ATOM 125 CA LEU A 10 1.355 -3.152 -12.861 1.00 0.00 C ATOM 126 C LEU A 10 2.577 -3.552 -12.047 1.00 0.00 C ATOM 127 O LEU A 10 2.880 -4.731 -11.899 1.00 0.00 O ATOM 128 CB LEU A 10 0.063 -3.728 -12.270 1.00 0.00 C ATOM 129 CG LEU A 10 -1.223 -3.219 -12.951 1.00 0.00 C ATOM 130 CD1 LEU A 10 -2.349 -4.238 -12.766 1.00 0.00 C ATOM 131 CD2 LEU A 10 -1.677 -1.858 -12.423 1.00 0.00 C ATOM 0 H LEU A 10 1.380 -4.634 -14.322 1.00 0.00 H new ATOM 0 HA LEU A 10 1.281 -2.065 -12.841 1.00 0.00 H new ATOM 0 HB2 LEU A 10 0.095 -4.815 -12.345 1.00 0.00 H new ATOM 0 HB3 LEU A 10 0.021 -3.483 -11.209 1.00 0.00 H new ATOM 0 HG LEU A 10 -0.991 -3.096 -14.009 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -3.254 -3.872 -13.250 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -2.057 -5.188 -13.214 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -2.539 -4.382 -11.702 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -2.587 -1.552 -12.940 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -1.874 -1.930 -11.353 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -0.894 -1.120 -12.599 1.00 0.00 H new ATOM 143 N TYR A 11 3.274 -2.573 -11.487 1.00 0.00 N ATOM 144 CA TYR A 11 4.514 -2.747 -10.765 1.00 0.00 C ATOM 145 C TYR A 11 4.304 -2.344 -9.324 1.00 0.00 C ATOM 146 O TYR A 11 4.255 -1.156 -8.983 1.00 0.00 O ATOM 147 CB TYR A 11 5.605 -1.901 -11.429 1.00 0.00 C ATOM 148 CG TYR A 11 5.799 -2.191 -12.896 1.00 0.00 C ATOM 149 CD1 TYR A 11 6.333 -3.425 -13.298 1.00 0.00 C ATOM 150 CD2 TYR A 11 5.407 -1.251 -13.862 1.00 0.00 C ATOM 151 CE1 TYR A 11 6.547 -3.696 -14.662 1.00 0.00 C ATOM 152 CE2 TYR A 11 5.563 -1.546 -15.223 1.00 0.00 C ATOM 153 CZ TYR A 11 6.193 -2.738 -15.617 1.00 0.00 C ATOM 154 OH TYR A 11 6.510 -2.964 -16.923 1.00 0.00 O ATOM 0 H TYR A 11 2.974 -1.599 -11.528 1.00 0.00 H new ATOM 0 HA TYR A 11 4.830 -3.790 -10.788 1.00 0.00 H new ATOM 0 HB2 TYR A 11 5.357 -0.847 -11.307 1.00 0.00 H new ATOM 0 HB3 TYR A 11 6.548 -2.069 -10.908 1.00 0.00 H new ATOM 0 HD1 TYR A 11 6.581 -4.170 -12.557 1.00 0.00 H new ATOM 0 HD2 TYR A 11 4.987 -0.304 -13.557 1.00 0.00 H new ATOM 0 HE1 TYR A 11 6.981 -4.636 -14.969 1.00 0.00 H new ATOM 0 HE2 TYR A 11 5.198 -0.856 -15.970 1.00 0.00 H new ATOM 0 HH TYR A 11 6.213 -3.861 -17.181 1.00 0.00 H new ATOM 164 N ASN A 12 4.109 -3.337 -8.448 1.00 0.00 N ATOM 165 CA ASN A 12 3.908 -3.049 -7.055 1.00 0.00 C ATOM 166 C ASN A 12 5.084 -2.240 -6.544 1.00 0.00 C ATOM 167 O ASN A 12 6.202 -2.726 -6.632 1.00 0.00 O ATOM 168 CB ASN A 12 3.761 -4.345 -6.260 1.00 0.00 C ATOM 169 CG ASN A 12 3.448 -4.054 -4.821 1.00 0.00 C ATOM 170 OD1 ASN A 12 4.051 -4.610 -3.923 1.00 0.00 O ATOM 171 ND2 ASN A 12 2.483 -3.198 -4.571 1.00 0.00 N ATOM 0 H ASN A 12 4.089 -4.328 -8.691 1.00 0.00 H new ATOM 0 HA ASN A 12 2.991 -2.473 -6.930 1.00 0.00 H new ATOM 0 HB2 ASN A 12 2.968 -4.955 -6.693 1.00 0.00 H new ATOM 0 HB3 ASN A 12 4.682 -4.925 -6.327 1.00 0.00 H new ATOM 0 HD21 ASN A 12 2.225 -2.987 -3.607 1.00 0.00 H new ATOM 0 HD22 ASN A 12 1.992 -2.744 -5.341 1.00 0.00 H new ATOM 178 N GLN A 13 4.831 -1.051 -6.006 1.00 0.00 N ATOM 179 CA GLN A 13 5.899 -0.228 -5.496 1.00 0.00 C ATOM 180 C GLN A 13 6.804 -0.987 -4.570 1.00 0.00 C ATOM 181 O GLN A 13 7.997 -0.972 -4.773 1.00 0.00 O ATOM 182 CB GLN A 13 5.368 0.970 -4.717 1.00 0.00 C ATOM 183 CG GLN A 13 6.475 1.863 -4.143 1.00 0.00 C ATOM 184 CD GLN A 13 7.640 1.985 -5.116 1.00 0.00 C ATOM 185 OE1 GLN A 13 7.318 2.232 -6.371 1.00 0.00 O flip ATOM 186 NE2 GLN A 13 8.791 1.780 -4.798 1.00 0.00 N flip ATOM 0 H GLN A 13 3.899 -0.646 -5.916 1.00 0.00 H new ATOM 0 HA GLN A 13 6.451 0.102 -6.376 1.00 0.00 H new ATOM 0 HB2 GLN A 13 4.733 1.567 -5.371 1.00 0.00 H new ATOM 0 HB3 GLN A 13 4.739 0.614 -3.901 1.00 0.00 H new ATOM 0 HG2 GLN A 13 6.073 2.853 -3.927 1.00 0.00 H new ATOM 0 HG3 GLN A 13 6.828 1.449 -3.199 1.00 0.00 H new ATOM 0 HE21 GLN A 13 9.025 1.590 -3.823 1.00 0.00 H new ATOM 0 HE22 GLN A 13 9.526 1.797 -5.505 1.00 0.00 H new ATOM 195 N ASN A 14 6.236 -1.731 -3.629 1.00 0.00 N ATOM 196 CA ASN A 14 7.016 -2.557 -2.735 1.00 0.00 C ATOM 197 C ASN A 14 8.002 -3.422 -3.512 1.00 0.00 C ATOM 198 O ASN A 14 9.127 -3.562 -3.116 1.00 0.00 O ATOM 199 CB ASN A 14 6.105 -3.517 -1.986 1.00 0.00 C ATOM 200 CG ASN A 14 6.621 -3.836 -0.610 1.00 0.00 C ATOM 201 OD1 ASN A 14 7.793 -4.004 -0.359 1.00 0.00 O ATOM 202 ND2 ASN A 14 5.703 -4.020 0.305 1.00 0.00 N ATOM 0 H ASN A 14 5.229 -1.775 -3.470 1.00 0.00 H new ATOM 0 HA ASN A 14 7.542 -1.886 -2.056 1.00 0.00 H new ATOM 0 HB2 ASN A 14 5.109 -3.082 -1.906 1.00 0.00 H new ATOM 0 HB3 ASN A 14 6.005 -4.440 -2.557 1.00 0.00 H new ATOM 0 HD21 ASN A 14 5.971 -4.309 1.246 1.00 0.00 H new ATOM 0 HD22 ASN A 14 4.720 -3.874 0.077 1.00 0.00 H new ATOM 209 N LYS A 15 7.610 -4.006 -4.641 1.00 0.00 N ATOM 210 CA LYS A 15 8.513 -4.676 -5.550 1.00 0.00 C ATOM 211 C LYS A 15 9.438 -3.716 -6.289 1.00 0.00 C ATOM 212 O LYS A 15 10.585 -4.058 -6.422 1.00 0.00 O ATOM 213 CB LYS A 15 7.731 -5.509 -6.552 1.00 0.00 C ATOM 214 CG LYS A 15 7.583 -6.943 -6.042 1.00 0.00 C ATOM 215 CD LYS A 15 6.177 -7.500 -6.299 1.00 0.00 C ATOM 216 CE LYS A 15 5.548 -8.038 -5.009 1.00 0.00 C ATOM 217 NZ LYS A 15 4.129 -7.634 -4.908 1.00 0.00 N ATOM 0 H LYS A 15 6.637 -4.023 -4.948 1.00 0.00 H new ATOM 0 HA LYS A 15 9.144 -5.322 -4.939 1.00 0.00 H new ATOM 0 HB2 LYS A 15 6.747 -5.069 -6.713 1.00 0.00 H new ATOM 0 HB3 LYS A 15 8.242 -5.508 -7.515 1.00 0.00 H new ATOM 0 HG2 LYS A 15 8.321 -7.580 -6.531 1.00 0.00 H new ATOM 0 HG3 LYS A 15 7.795 -6.972 -4.973 1.00 0.00 H new ATOM 0 HD2 LYS A 15 5.544 -6.717 -6.716 1.00 0.00 H new ATOM 0 HD3 LYS A 15 6.229 -8.297 -7.041 1.00 0.00 H new ATOM 0 HE2 LYS A 15 5.624 -9.125 -4.988 1.00 0.00 H new ATOM 0 HE3 LYS A 15 6.100 -7.664 -4.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 3.633 -8.271 -4.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 4.070 -6.658 -4.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 3.685 -7.689 -5.847 1.00 0.00 H new ATOM 231 N ALA A 16 9.031 -2.539 -6.693 1.00 0.00 N ATOM 232 CA ALA A 16 9.912 -1.545 -7.261 1.00 0.00 C ATOM 233 C ALA A 16 11.088 -1.186 -6.343 1.00 0.00 C ATOM 234 O ALA A 16 12.232 -1.140 -6.788 1.00 0.00 O ATOM 235 CB ALA A 16 9.095 -0.315 -7.593 1.00 0.00 C ATOM 0 H ALA A 16 8.058 -2.237 -6.636 1.00 0.00 H new ATOM 0 HA ALA A 16 10.360 -1.964 -8.162 1.00 0.00 H new ATOM 0 HB1 ALA A 16 9.744 0.448 -8.024 1.00 0.00 H new ATOM 0 HB2 ALA A 16 8.318 -0.577 -8.311 1.00 0.00 H new ATOM 0 HB3 ALA A 16 8.634 0.072 -6.684 1.00 0.00 H new ATOM 241 N GLU A 17 10.818 -0.980 -5.054 1.00 0.00 N ATOM 242 CA GLU A 17 11.836 -0.701 -4.067 1.00 0.00 C ATOM 243 C GLU A 17 12.467 -2.005 -3.597 1.00 0.00 C ATOM 244 O GLU A 17 13.661 -2.060 -3.400 1.00 0.00 O ATOM 245 CB GLU A 17 11.279 0.091 -2.878 1.00 0.00 C ATOM 246 CG GLU A 17 9.984 -0.510 -2.338 1.00 0.00 C ATOM 247 CD GLU A 17 9.639 -0.068 -0.934 1.00 0.00 C ATOM 248 OE1 GLU A 17 9.745 1.142 -0.659 1.00 0.00 O ATOM 249 OE2 GLU A 17 9.310 -0.963 -0.127 1.00 0.00 O ATOM 0 H GLU A 17 9.873 -1.005 -4.671 1.00 0.00 H new ATOM 0 HA GLU A 17 12.599 -0.079 -4.535 1.00 0.00 H new ATOM 0 HB2 GLU A 17 12.023 0.119 -2.082 1.00 0.00 H new ATOM 0 HB3 GLU A 17 11.099 1.122 -3.183 1.00 0.00 H new ATOM 0 HG2 GLU A 17 9.165 -0.240 -3.004 1.00 0.00 H new ATOM 0 HG3 GLU A 17 10.065 -1.597 -2.356 1.00 0.00 H new ATOM 256 N SER A 18 11.721 -3.095 -3.439 1.00 0.00 N ATOM 257 CA SER A 18 12.196 -4.369 -2.928 1.00 0.00 C ATOM 258 C SER A 18 13.027 -5.054 -3.979 1.00 0.00 C ATOM 259 O SER A 18 14.203 -5.291 -3.756 1.00 0.00 O ATOM 260 CB SER A 18 11.084 -5.323 -2.541 1.00 0.00 C ATOM 261 OG SER A 18 11.565 -6.602 -2.164 1.00 0.00 O ATOM 0 H SER A 18 10.729 -3.111 -3.674 1.00 0.00 H new ATOM 0 HA SER A 18 12.770 -4.135 -2.031 1.00 0.00 H new ATOM 0 HB2 SER A 18 10.516 -4.896 -1.715 1.00 0.00 H new ATOM 0 HB3 SER A 18 10.396 -5.431 -3.379 1.00 0.00 H new ATOM 0 HG SER A 18 12.483 -6.715 -2.488 1.00 0.00 H new ATOM 267 N ASN A 19 12.464 -5.351 -5.150 1.00 0.00 N ATOM 268 CA ASN A 19 13.181 -5.857 -6.300 1.00 0.00 C ATOM 269 C ASN A 19 14.521 -5.169 -6.494 1.00 0.00 C ATOM 270 O ASN A 19 15.515 -5.842 -6.778 1.00 0.00 O ATOM 271 CB ASN A 19 12.375 -5.744 -7.597 1.00 0.00 C ATOM 272 CG ASN A 19 13.028 -6.514 -8.698 1.00 0.00 C ATOM 273 OD1 ASN A 19 13.194 -7.797 -8.499 1.00 0.00 O flip ATOM 274 ND2 ASN A 19 13.396 -5.986 -9.724 1.00 0.00 N flip ATOM 0 H ASN A 19 11.465 -5.239 -5.321 1.00 0.00 H new ATOM 0 HA ASN A 19 13.349 -6.912 -6.084 1.00 0.00 H new ATOM 0 HB2 ASN A 19 11.364 -6.118 -7.436 1.00 0.00 H new ATOM 0 HB3 ASN A 19 12.285 -4.696 -7.884 1.00 0.00 H new ATOM 0 HD21 ASN A 19 13.258 -4.985 -9.860 1.00 0.00 H new ATOM 0 HD22 ASN A 19 13.844 -6.543 -10.452 1.00 0.00 H new ATOM 281 N SER A 20 14.556 -3.857 -6.219 1.00 0.00 N ATOM 282 CA SER A 20 15.763 -3.072 -6.238 1.00 0.00 C ATOM 283 C SER A 20 16.578 -3.165 -4.969 1.00 0.00 C ATOM 284 O SER A 20 17.792 -3.104 -5.035 1.00 0.00 O ATOM 285 CB SER A 20 15.456 -1.605 -6.492 1.00 0.00 C ATOM 286 OG SER A 20 15.432 -0.801 -5.319 1.00 0.00 O ATOM 0 H SER A 20 13.725 -3.319 -5.975 1.00 0.00 H new ATOM 0 HA SER A 20 16.355 -3.496 -7.049 1.00 0.00 H new ATOM 0 HB2 SER A 20 16.201 -1.203 -7.179 1.00 0.00 H new ATOM 0 HB3 SER A 20 14.490 -1.529 -6.990 1.00 0.00 H new ATOM 0 HG SER A 20 14.800 -1.182 -4.674 1.00 0.00 H new ATOM 292 N HIS A 21 15.966 -3.252 -3.786 1.00 0.00 N ATOM 293 CA HIS A 21 16.610 -3.376 -2.495 1.00 0.00 C ATOM 294 C HIS A 21 17.710 -4.420 -2.558 1.00 0.00 C ATOM 295 O HIS A 21 18.759 -4.230 -1.953 1.00 0.00 O ATOM 296 CB HIS A 21 15.602 -3.727 -1.387 1.00 0.00 C ATOM 297 CG HIS A 21 14.990 -2.545 -0.662 1.00 0.00 C ATOM 298 ND1 HIS A 21 14.885 -1.256 -1.117 1.00 0.00 N flip ATOM 299 CD2 HIS A 21 14.429 -2.618 0.586 1.00 0.00 C flip ATOM 300 CE1 HIS A 21 14.232 -0.541 -0.121 1.00 0.00 C flip ATOM 301 NE2 HIS A 21 13.976 -1.385 0.896 1.00 0.00 N flip ATOM 0 H HIS A 21 14.949 -3.236 -3.709 1.00 0.00 H new ATOM 0 HA HIS A 21 17.047 -2.409 -2.247 1.00 0.00 H new ATOM 0 HB2 HIS A 21 14.798 -4.318 -1.826 1.00 0.00 H new ATOM 0 HB3 HIS A 21 16.101 -4.362 -0.654 1.00 0.00 H new ATOM 0 HD2 HIS A 21 14.362 -3.499 1.207 1.00 0.00 H new ATOM 0 HE1 HIS A 21 13.975 0.507 -0.156 1.00 0.00 H new ATOM 0 HE2 HIS A 21 13.511 -1.131 1.768 1.00 0.00 H new ATOM 310 N HIS A 22 17.463 -5.510 -3.290 1.00 0.00 N ATOM 311 CA HIS A 22 18.428 -6.553 -3.526 1.00 0.00 C ATOM 312 C HIS A 22 19.529 -6.111 -4.480 1.00 0.00 C ATOM 313 O HIS A 22 20.693 -6.337 -4.173 1.00 0.00 O ATOM 314 CB HIS A 22 17.750 -7.817 -4.045 1.00 0.00 C ATOM 315 CG HIS A 22 16.251 -7.927 -3.846 1.00 0.00 C ATOM 316 ND1 HIS A 22 15.381 -8.358 -4.809 1.00 0.00 N ATOM 317 CD2 HIS A 22 15.551 -7.612 -2.707 1.00 0.00 C ATOM 318 CE1 HIS A 22 14.151 -8.327 -4.258 1.00 0.00 C ATOM 319 NE2 HIS A 22 14.213 -7.884 -2.991 1.00 0.00 N ATOM 0 H HIS A 22 16.563 -5.682 -3.739 1.00 0.00 H new ATOM 0 HA HIS A 22 18.895 -6.775 -2.567 1.00 0.00 H new ATOM 0 HB2 HIS A 22 17.957 -7.898 -5.112 1.00 0.00 H new ATOM 0 HB3 HIS A 22 18.219 -8.675 -3.563 1.00 0.00 H new ATOM 0 HD1 HIS A 22 15.617 -8.647 -5.759 1.00 0.00 H new ATOM 0 HD2 HIS A 22 15.955 -7.231 -1.780 1.00 0.00 H new ATOM 0 HE1 HIS A 22 13.242 -8.618 -4.764 1.00 0.00 H new ATOM 328 N ALA A 23 19.142 -5.495 -5.603 1.00 0.00 N ATOM 329 CA ALA A 23 20.043 -4.902 -6.562 1.00 0.00 C ATOM 330 C ALA A 23 21.243 -4.213 -5.881 1.00 0.00 C ATOM 331 O ALA A 23 21.071 -3.438 -4.933 1.00 0.00 O ATOM 332 CB ALA A 23 19.301 -3.926 -7.468 1.00 0.00 C ATOM 0 H ALA A 23 18.161 -5.400 -5.865 1.00 0.00 H new ATOM 0 HA ALA A 23 20.441 -5.711 -7.174 1.00 0.00 H new ATOM 0 HB1 ALA A 23 19.999 -3.491 -8.183 1.00 0.00 H new ATOM 0 HB2 ALA A 23 18.514 -4.455 -8.005 1.00 0.00 H new ATOM 0 HB3 ALA A 23 18.859 -3.134 -6.864 1.00 0.00 H new ATOM 338 N PRO A 24 22.459 -4.518 -6.343 1.00 0.00 N ATOM 339 CA PRO A 24 23.664 -3.992 -5.731 1.00 0.00 C ATOM 340 C PRO A 24 23.797 -2.525 -6.088 1.00 0.00 C ATOM 341 O PRO A 24 23.772 -2.164 -7.266 1.00 0.00 O ATOM 342 CB PRO A 24 24.813 -4.833 -6.283 1.00 0.00 C ATOM 343 CG PRO A 24 24.257 -5.533 -7.508 1.00 0.00 C ATOM 344 CD PRO A 24 22.751 -5.369 -7.482 1.00 0.00 C ATOM 0 HA PRO A 24 23.654 -4.050 -4.643 1.00 0.00 H new ATOM 0 HB2 PRO A 24 25.667 -4.207 -6.543 1.00 0.00 H new ATOM 0 HB3 PRO A 24 25.161 -5.555 -5.544 1.00 0.00 H new ATOM 0 HG2 PRO A 24 24.674 -5.102 -8.418 1.00 0.00 H new ATOM 0 HG3 PRO A 24 24.528 -6.589 -7.502 1.00 0.00 H new ATOM 0 HD2 PRO A 24 22.392 -4.919 -8.407 1.00 0.00 H new ATOM 0 HD3 PRO A 24 22.255 -6.335 -7.384 1.00 0.00 H new ATOM 352 N LEU A 25 23.909 -1.670 -5.065 1.00 0.00 N ATOM 353 CA LEU A 25 24.057 -0.242 -5.228 1.00 0.00 C ATOM 354 C LEU A 25 25.320 0.095 -5.998 1.00 0.00 C ATOM 355 O LEU A 25 26.403 0.144 -5.416 1.00 0.00 O ATOM 356 CB LEU A 25 24.001 0.453 -3.851 1.00 0.00 C ATOM 357 CG LEU A 25 23.165 1.726 -3.814 1.00 0.00 C ATOM 358 CD1 LEU A 25 21.857 1.545 -4.559 1.00 0.00 C ATOM 359 CD2 LEU A 25 22.922 2.128 -2.362 1.00 0.00 C ATOM 0 H LEU A 25 23.898 -1.968 -4.090 1.00 0.00 H new ATOM 0 HA LEU A 25 23.226 0.136 -5.824 1.00 0.00 H new ATOM 0 HB2 LEU A 25 23.600 -0.250 -3.120 1.00 0.00 H new ATOM 0 HB3 LEU A 25 25.017 0.693 -3.539 1.00 0.00 H new ATOM 0 HG LEU A 25 23.711 2.524 -4.317 1.00 0.00 H new ATOM 0 HD11 LEU A 25 21.282 2.470 -4.515 1.00 0.00 H new ATOM 0 HD12 LEU A 25 22.063 1.295 -5.600 1.00 0.00 H new ATOM 0 HD13 LEU A 25 21.284 0.740 -4.099 1.00 0.00 H new ATOM 0 HD21 LEU A 25 22.324 3.039 -2.332 1.00 0.00 H new ATOM 0 HD22 LEU A 25 22.391 1.328 -1.847 1.00 0.00 H new ATOM 0 HD23 LEU A 25 23.878 2.305 -1.869 1.00 0.00 H new ATOM 371 N SER A 26 25.187 0.238 -7.310 1.00 0.00 N ATOM 372 CA SER A 26 26.314 0.435 -8.200 1.00 0.00 C ATOM 373 C SER A 26 25.832 0.528 -9.642 1.00 0.00 C ATOM 374 O SER A 26 24.784 -0.020 -9.997 1.00 0.00 O ATOM 375 CB SER A 26 27.339 -0.700 -8.112 1.00 0.00 C ATOM 376 OG SER A 26 28.450 -0.489 -7.258 1.00 0.00 O ATOM 0 H SER A 26 24.285 0.220 -7.786 1.00 0.00 H new ATOM 0 HA SER A 26 26.796 1.361 -7.888 1.00 0.00 H new ATOM 0 HB2 SER A 26 26.822 -1.601 -7.781 1.00 0.00 H new ATOM 0 HB3 SER A 26 27.714 -0.898 -9.116 1.00 0.00 H new ATOM 0 HG SER A 26 28.134 -0.210 -6.373 1.00 0.00 H new ATOM 382 N ASP A 27 26.611 1.195 -10.494 1.00 0.00 N ATOM 383 CA ASP A 27 26.316 1.358 -11.903 1.00 0.00 C ATOM 384 C ASP A 27 27.046 0.294 -12.684 1.00 0.00 C ATOM 385 O ASP A 27 28.260 0.187 -12.554 1.00 0.00 O ATOM 386 CB ASP A 27 26.702 2.759 -12.388 1.00 0.00 C ATOM 387 CG ASP A 27 27.432 2.837 -13.739 1.00 0.00 C ATOM 388 OD1 ASP A 27 28.670 2.803 -13.840 1.00 0.00 O ATOM 389 OD2 ASP A 27 26.747 3.168 -14.726 1.00 0.00 O ATOM 0 H ASP A 27 27.482 1.644 -10.210 1.00 0.00 H new ATOM 0 HA ASP A 27 25.243 1.248 -12.061 1.00 0.00 H new ATOM 0 HB2 ASP A 27 25.795 3.360 -12.455 1.00 0.00 H new ATOM 0 HB3 ASP A 27 27.335 3.221 -11.630 1.00 0.00 H new ATOM 394 N GLY A 28 26.315 -0.509 -13.460 1.00 0.00 N ATOM 395 CA GLY A 28 26.933 -1.516 -14.306 1.00 0.00 C ATOM 396 C GLY A 28 27.962 -2.341 -13.547 1.00 0.00 C ATOM 397 O GLY A 28 29.170 -2.239 -13.762 1.00 0.00 O ATOM 0 H GLY A 28 25.297 -0.477 -13.516 1.00 0.00 H new ATOM 0 HA2 GLY A 28 26.163 -2.175 -14.707 1.00 0.00 H new ATOM 0 HA3 GLY A 28 27.412 -1.031 -15.157 1.00 0.00 H new ATOM 401 N LYS A 29 27.479 -3.181 -12.630 1.00 0.00 N ATOM 402 CA LYS A 29 28.329 -4.050 -11.822 1.00 0.00 C ATOM 403 C LYS A 29 27.633 -5.339 -11.456 1.00 0.00 C ATOM 404 O LYS A 29 27.877 -5.917 -10.395 1.00 0.00 O ATOM 405 CB LYS A 29 28.865 -3.265 -10.611 1.00 0.00 C ATOM 406 CG LYS A 29 30.279 -2.736 -10.883 1.00 0.00 C ATOM 407 CD LYS A 29 31.088 -2.659 -9.587 1.00 0.00 C ATOM 408 CE LYS A 29 32.031 -3.868 -9.469 1.00 0.00 C ATOM 409 NZ LYS A 29 31.963 -4.465 -8.117 1.00 0.00 N ATOM 0 H LYS A 29 26.484 -3.276 -12.428 1.00 0.00 H new ATOM 0 HA LYS A 29 29.191 -4.362 -12.412 1.00 0.00 H new ATOM 0 HB2 LYS A 29 28.198 -2.432 -10.388 1.00 0.00 H new ATOM 0 HB3 LYS A 29 28.876 -3.909 -9.731 1.00 0.00 H new ATOM 0 HG2 LYS A 29 30.785 -3.388 -11.595 1.00 0.00 H new ATOM 0 HG3 LYS A 29 30.221 -1.748 -11.340 1.00 0.00 H new ATOM 0 HD2 LYS A 29 31.667 -1.735 -9.567 1.00 0.00 H new ATOM 0 HD3 LYS A 29 30.413 -2.631 -8.731 1.00 0.00 H new ATOM 0 HE2 LYS A 29 31.763 -4.617 -10.215 1.00 0.00 H new ATOM 0 HE3 LYS A 29 33.054 -3.558 -9.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 32.609 -5.279 -8.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 32.242 -3.755 -7.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 30.991 -4.781 -7.926 1.00 0.00 H new ATOM 423 N THR A 30 26.740 -5.787 -12.323 1.00 0.00 N ATOM 424 CA THR A 30 25.927 -6.967 -12.067 1.00 0.00 C ATOM 425 C THR A 30 26.071 -7.899 -13.238 1.00 0.00 C ATOM 426 O THR A 30 26.280 -7.438 -14.366 1.00 0.00 O ATOM 427 CB THR A 30 24.484 -6.551 -11.861 1.00 0.00 C ATOM 428 OG1 THR A 30 24.072 -6.101 -13.115 1.00 0.00 O ATOM 429 CG2 THR A 30 24.332 -5.461 -10.812 1.00 0.00 C ATOM 0 H THR A 30 26.557 -5.344 -13.224 1.00 0.00 H new ATOM 0 HA THR A 30 26.256 -7.480 -11.163 1.00 0.00 H new ATOM 0 HB THR A 30 23.882 -7.379 -11.487 1.00 0.00 H new ATOM 0 HG1 THR A 30 23.102 -5.961 -13.110 1.00 0.00 H new ATOM 0 HG21 THR A 30 23.278 -5.202 -10.706 1.00 0.00 H new ATOM 0 HG22 THR A 30 24.716 -5.819 -9.857 1.00 0.00 H new ATOM 0 HG23 THR A 30 24.893 -4.579 -11.120 1.00 0.00 H new ATOM 437 N GLY A 31 26.009 -9.205 -12.965 1.00 0.00 N ATOM 438 CA GLY A 31 26.154 -10.220 -13.987 1.00 0.00 C ATOM 439 C GLY A 31 25.424 -9.854 -15.259 1.00 0.00 C ATOM 440 O GLY A 31 26.029 -9.834 -16.331 1.00 0.00 O ATOM 0 H GLY A 31 25.857 -9.578 -12.028 1.00 0.00 H new ATOM 0 HA2 GLY A 31 27.212 -10.365 -14.206 1.00 0.00 H new ATOM 0 HA3 GLY A 31 25.773 -11.169 -13.611 1.00 0.00 H new ATOM 444 N SER A 32 24.121 -9.579 -15.145 1.00 0.00 N ATOM 445 CA SER A 32 23.345 -9.117 -16.278 1.00 0.00 C ATOM 446 C SER A 32 23.778 -7.730 -16.720 1.00 0.00 C ATOM 447 O SER A 32 24.286 -7.594 -17.832 1.00 0.00 O ATOM 448 CB SER A 32 21.861 -9.146 -15.951 1.00 0.00 C ATOM 449 OG SER A 32 21.129 -8.570 -17.017 1.00 0.00 O ATOM 0 H SER A 32 23.591 -9.671 -14.278 1.00 0.00 H new ATOM 0 HA SER A 32 23.529 -9.796 -17.111 1.00 0.00 H new ATOM 0 HB2 SER A 32 21.535 -10.173 -15.785 1.00 0.00 H new ATOM 0 HB3 SER A 32 21.671 -8.598 -15.028 1.00 0.00 H new ATOM 0 HG SER A 32 20.241 -8.982 -17.064 1.00 0.00 H new ATOM 455 N SER A 33 23.475 -6.706 -15.913 1.00 0.00 N ATOM 456 CA SER A 33 23.821 -5.313 -16.185 1.00 0.00 C ATOM 457 C SER A 33 23.270 -4.357 -15.148 1.00 0.00 C ATOM 458 O SER A 33 23.995 -3.597 -14.506 1.00 0.00 O ATOM 459 CB SER A 33 23.276 -4.882 -17.554 1.00 0.00 C ATOM 460 OG SER A 33 21.901 -5.252 -17.721 1.00 0.00 O ATOM 0 H SER A 33 22.971 -6.830 -15.035 1.00 0.00 H new ATOM 0 HA SER A 33 24.910 -5.266 -16.161 1.00 0.00 H new ATOM 0 HB2 SER A 33 23.377 -3.802 -17.662 1.00 0.00 H new ATOM 0 HB3 SER A 33 23.874 -5.339 -18.343 1.00 0.00 H new ATOM 0 HG SER A 33 21.331 -4.469 -17.572 1.00 0.00 H new ATOM 466 N TYR A 34 21.943 -4.381 -14.982 1.00 0.00 N ATOM 467 CA TYR A 34 21.240 -3.578 -14.035 1.00 0.00 C ATOM 468 C TYR A 34 21.559 -3.985 -12.578 1.00 0.00 C ATOM 469 O TYR A 34 21.700 -5.176 -12.325 1.00 0.00 O ATOM 470 CB TYR A 34 19.744 -3.737 -14.298 1.00 0.00 C ATOM 471 CG TYR A 34 19.328 -3.411 -15.711 1.00 0.00 C ATOM 472 CD1 TYR A 34 19.111 -2.080 -16.090 1.00 0.00 C ATOM 473 CD2 TYR A 34 19.127 -4.437 -16.643 1.00 0.00 C ATOM 474 CE1 TYR A 34 18.733 -1.790 -17.415 1.00 0.00 C ATOM 475 CE2 TYR A 34 18.735 -4.142 -17.957 1.00 0.00 C ATOM 476 CZ TYR A 34 18.555 -2.817 -18.348 1.00 0.00 C ATOM 477 OH TYR A 34 18.196 -2.507 -19.626 1.00 0.00 O ATOM 0 H TYR A 34 21.331 -4.985 -15.530 1.00 0.00 H new ATOM 0 HA TYR A 34 21.553 -2.541 -14.154 1.00 0.00 H new ATOM 0 HB2 TYR A 34 19.454 -4.763 -14.073 1.00 0.00 H new ATOM 0 HB3 TYR A 34 19.195 -3.093 -13.611 1.00 0.00 H new ATOM 0 HD1 TYR A 34 19.233 -1.283 -15.372 1.00 0.00 H new ATOM 0 HD2 TYR A 34 19.275 -5.465 -16.347 1.00 0.00 H new ATOM 0 HE1 TYR A 34 18.579 -0.764 -17.714 1.00 0.00 H new ATOM 0 HE2 TYR A 34 18.573 -4.941 -18.665 1.00 0.00 H new ATOM 0 HH TYR A 34 18.113 -3.330 -20.151 1.00 0.00 H new ATOM 487 N PRO A 35 21.475 -3.036 -11.636 1.00 0.00 N ATOM 488 CA PRO A 35 21.133 -1.652 -11.929 1.00 0.00 C ATOM 489 C PRO A 35 22.296 -0.928 -12.577 1.00 0.00 C ATOM 490 O PRO A 35 23.426 -1.416 -12.670 1.00 0.00 O ATOM 491 CB PRO A 35 20.704 -1.010 -10.618 1.00 0.00 C ATOM 492 CG PRO A 35 21.294 -1.909 -9.546 1.00 0.00 C ATOM 493 CD PRO A 35 21.712 -3.217 -10.214 1.00 0.00 C ATOM 0 HA PRO A 35 20.317 -1.594 -12.649 1.00 0.00 H new ATOM 0 HB2 PRO A 35 21.080 0.009 -10.533 1.00 0.00 H new ATOM 0 HB3 PRO A 35 19.618 -0.957 -10.538 1.00 0.00 H new ATOM 0 HG2 PRO A 35 22.152 -1.429 -9.074 1.00 0.00 H new ATOM 0 HG3 PRO A 35 20.563 -2.098 -8.760 1.00 0.00 H new ATOM 0 HD2 PRO A 35 22.762 -3.437 -10.019 1.00 0.00 H new ATOM 0 HD3 PRO A 35 21.133 -4.055 -9.826 1.00 0.00 H new ATOM 501 N HIS A 36 21.979 0.210 -13.170 1.00 0.00 N ATOM 502 CA HIS A 36 22.966 1.015 -13.854 1.00 0.00 C ATOM 503 C HIS A 36 22.668 2.472 -13.638 1.00 0.00 C ATOM 504 O HIS A 36 21.570 2.762 -13.187 1.00 0.00 O ATOM 505 CB HIS A 36 23.099 0.614 -15.320 1.00 0.00 C ATOM 506 CG HIS A 36 21.881 0.812 -16.195 1.00 0.00 C ATOM 507 ND1 HIS A 36 21.903 1.231 -17.498 1.00 0.00 N ATOM 508 CD2 HIS A 36 20.588 0.639 -15.816 1.00 0.00 C ATOM 509 CE1 HIS A 36 20.630 1.328 -17.917 1.00 0.00 C ATOM 510 NE2 HIS A 36 19.826 0.960 -16.925 1.00 0.00 N ATOM 0 H HIS A 36 21.035 0.597 -13.189 1.00 0.00 H new ATOM 0 HA HIS A 36 23.951 0.829 -13.427 1.00 0.00 H new ATOM 0 HB2 HIS A 36 23.924 1.180 -15.753 1.00 0.00 H new ATOM 0 HB3 HIS A 36 23.378 -0.439 -15.360 1.00 0.00 H new ATOM 0 HD1 HIS A 36 22.736 1.433 -18.051 1.00 0.00 H new ATOM 0 HD2 HIS A 36 20.229 0.318 -14.849 1.00 0.00 H new ATOM 0 HE1 HIS A 36 20.313 1.651 -18.897 1.00 0.00 H new ATOM 519 N TRP A 37 23.653 3.338 -13.861 1.00 0.00 N ATOM 520 CA TRP A 37 23.452 4.764 -13.726 1.00 0.00 C ATOM 521 C TRP A 37 22.358 5.231 -14.675 1.00 0.00 C ATOM 522 O TRP A 37 22.356 4.851 -15.843 1.00 0.00 O ATOM 523 CB TRP A 37 24.732 5.522 -14.034 1.00 0.00 C ATOM 524 CG TRP A 37 24.559 6.998 -14.270 1.00 0.00 C ATOM 525 CD1 TRP A 37 23.903 7.889 -13.488 1.00 0.00 C ATOM 526 CD2 TRP A 37 25.021 7.751 -15.415 1.00 0.00 C ATOM 527 NE1 TRP A 37 23.983 9.152 -14.049 1.00 0.00 N ATOM 528 CE2 TRP A 37 24.687 9.111 -15.227 1.00 0.00 C ATOM 529 CE3 TRP A 37 25.736 7.389 -16.559 1.00 0.00 C ATOM 530 CZ2 TRP A 37 25.045 10.094 -16.132 1.00 0.00 C ATOM 531 CZ3 TRP A 37 26.155 8.365 -17.480 1.00 0.00 C ATOM 532 CH2 TRP A 37 25.783 9.702 -17.255 1.00 0.00 C ATOM 0 H TRP A 37 24.598 3.069 -14.136 1.00 0.00 H new ATOM 0 HA TRP A 37 23.158 4.966 -12.696 1.00 0.00 H new ATOM 0 HB2 TRP A 37 25.427 5.381 -13.206 1.00 0.00 H new ATOM 0 HB3 TRP A 37 25.194 5.080 -14.917 1.00 0.00 H new ATOM 0 HD1 TRP A 37 23.394 7.650 -12.566 1.00 0.00 H new ATOM 0 HE1 TRP A 37 23.576 9.995 -13.644 1.00 0.00 H new ATOM 0 HE3 TRP A 37 25.969 6.350 -16.738 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 24.765 11.126 -15.978 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 26.749 8.094 -18.340 1.00 0.00 H new ATOM 0 HH2 TRP A 37 26.077 10.453 -17.974 1.00 0.00 H new ATOM 543 N PHE A 38 21.503 6.122 -14.182 1.00 0.00 N ATOM 544 CA PHE A 38 20.360 6.637 -14.856 1.00 0.00 C ATOM 545 C PHE A 38 20.693 8.062 -15.183 1.00 0.00 C ATOM 546 O PHE A 38 20.391 8.977 -14.405 1.00 0.00 O ATOM 547 CB PHE A 38 19.141 6.558 -13.935 1.00 0.00 C ATOM 548 CG PHE A 38 17.909 7.265 -14.448 1.00 0.00 C ATOM 549 CD1 PHE A 38 17.529 7.153 -15.791 1.00 0.00 C ATOM 550 CD2 PHE A 38 17.170 8.107 -13.613 1.00 0.00 C ATOM 551 CE1 PHE A 38 16.403 7.817 -16.275 1.00 0.00 C ATOM 552 CE2 PHE A 38 16.035 8.774 -14.090 1.00 0.00 C ATOM 553 CZ PHE A 38 15.647 8.625 -15.420 1.00 0.00 C ATOM 0 H PHE A 38 21.613 6.514 -13.247 1.00 0.00 H new ATOM 0 HA PHE A 38 20.120 6.073 -15.757 1.00 0.00 H new ATOM 0 HB2 PHE A 38 18.897 5.509 -13.769 1.00 0.00 H new ATOM 0 HB3 PHE A 38 19.408 6.981 -12.966 1.00 0.00 H new ATOM 0 HD1 PHE A 38 18.117 6.543 -16.461 1.00 0.00 H new ATOM 0 HD2 PHE A 38 17.478 8.245 -12.587 1.00 0.00 H new ATOM 0 HE1 PHE A 38 16.115 7.707 -17.310 1.00 0.00 H new ATOM 0 HE2 PHE A 38 15.460 9.404 -13.427 1.00 0.00 H new ATOM 0 HZ PHE A 38 14.767 9.131 -15.789 1.00 0.00 H new ATOM 563 N THR A 39 21.361 8.244 -16.322 1.00 0.00 N ATOM 564 CA THR A 39 21.608 9.549 -16.914 1.00 0.00 C ATOM 565 C THR A 39 20.415 10.436 -16.752 1.00 0.00 C ATOM 566 O THR A 39 20.592 11.616 -16.502 1.00 0.00 O ATOM 567 CB THR A 39 21.942 9.402 -18.404 1.00 0.00 C ATOM 568 OG1 THR A 39 20.978 8.555 -19.000 1.00 0.00 O ATOM 569 CG2 THR A 39 23.293 8.737 -18.606 1.00 0.00 C ATOM 0 H THR A 39 21.750 7.473 -16.865 1.00 0.00 H new ATOM 0 HA THR A 39 22.455 10.001 -16.399 1.00 0.00 H new ATOM 0 HB THR A 39 21.952 10.398 -18.846 1.00 0.00 H new ATOM 0 HG1 THR A 39 21.178 8.453 -19.954 1.00 0.00 H new ATOM 0 HG21 THR A 39 23.499 8.648 -19.673 1.00 0.00 H new ATOM 0 HG22 THR A 39 24.069 9.340 -18.136 1.00 0.00 H new ATOM 0 HG23 THR A 39 23.281 7.745 -18.155 1.00 0.00 H new ATOM 577 N ASN A 40 19.173 9.933 -16.797 1.00 0.00 N ATOM 578 CA ASN A 40 17.977 10.729 -16.599 1.00 0.00 C ATOM 579 C ASN A 40 17.941 11.928 -17.533 1.00 0.00 C ATOM 580 O ASN A 40 17.334 12.960 -17.253 1.00 0.00 O ATOM 581 CB ASN A 40 17.821 11.150 -15.119 1.00 0.00 C ATOM 582 CG ASN A 40 16.489 11.829 -14.845 1.00 0.00 C ATOM 583 OD1 ASN A 40 15.449 11.590 -15.443 1.00 0.00 O ATOM 584 ND2 ASN A 40 16.474 12.755 -13.927 1.00 0.00 N ATOM 0 H ASN A 40 18.980 8.947 -16.975 1.00 0.00 H new ATOM 0 HA ASN A 40 17.121 10.103 -16.851 1.00 0.00 H new ATOM 0 HB2 ASN A 40 17.915 10.270 -14.482 1.00 0.00 H new ATOM 0 HB3 ASN A 40 18.632 11.826 -14.849 1.00 0.00 H new ATOM 0 HD21 ASN A 40 15.610 13.258 -13.724 1.00 0.00 H new ATOM 0 HD22 ASN A 40 17.326 12.976 -13.412 1.00 0.00 H new ATOM 591 N GLY A 41 18.676 11.833 -18.639 1.00 0.00 N ATOM 592 CA GLY A 41 18.936 12.941 -19.486 1.00 0.00 C ATOM 593 C GLY A 41 20.334 13.529 -19.373 1.00 0.00 C ATOM 594 O GLY A 41 20.899 13.835 -20.414 1.00 0.00 O ATOM 0 H GLY A 41 19.103 10.962 -18.956 1.00 0.00 H new ATOM 0 HA2 GLY A 41 18.770 12.635 -20.519 1.00 0.00 H new ATOM 0 HA3 GLY A 41 18.211 13.724 -19.266 1.00 0.00 H new ATOM 598 N TYR A 42 20.869 13.720 -18.164 1.00 0.00 N ATOM 599 CA TYR A 42 22.213 14.198 -17.899 1.00 0.00 C ATOM 600 C TYR A 42 23.250 13.538 -18.802 1.00 0.00 C ATOM 601 O TYR A 42 23.111 12.377 -19.183 1.00 0.00 O ATOM 602 CB TYR A 42 22.571 13.937 -16.424 1.00 0.00 C ATOM 603 CG TYR A 42 21.687 14.680 -15.439 1.00 0.00 C ATOM 604 CD1 TYR A 42 21.857 16.055 -15.292 1.00 0.00 C ATOM 605 CD2 TYR A 42 20.708 14.042 -14.667 1.00 0.00 C ATOM 606 CE1 TYR A 42 21.103 16.797 -14.362 1.00 0.00 C ATOM 607 CE2 TYR A 42 19.918 14.764 -13.764 1.00 0.00 C ATOM 608 CZ TYR A 42 20.126 16.137 -13.610 1.00 0.00 C ATOM 609 OH TYR A 42 19.410 16.829 -12.696 1.00 0.00 O ATOM 0 H TYR A 42 20.346 13.534 -17.308 1.00 0.00 H new ATOM 0 HA TYR A 42 22.229 15.267 -18.109 1.00 0.00 H new ATOM 0 HB2 TYR A 42 22.500 12.867 -16.226 1.00 0.00 H new ATOM 0 HB3 TYR A 42 23.609 14.224 -16.255 1.00 0.00 H new ATOM 0 HD1 TYR A 42 22.585 16.564 -15.906 1.00 0.00 H new ATOM 0 HD2 TYR A 42 20.560 12.977 -14.770 1.00 0.00 H new ATOM 0 HE1 TYR A 42 21.276 17.855 -14.232 1.00 0.00 H new ATOM 0 HE2 TYR A 42 19.153 14.263 -13.190 1.00 0.00 H new ATOM 0 HH TYR A 42 19.656 16.532 -11.795 1.00 0.00 H new ATOM 619 N ASP A 43 24.328 14.263 -19.076 1.00 0.00 N ATOM 620 CA ASP A 43 25.401 13.707 -19.893 1.00 0.00 C ATOM 621 C ASP A 43 26.350 12.850 -19.074 1.00 0.00 C ATOM 622 O ASP A 43 26.869 11.838 -19.547 1.00 0.00 O ATOM 623 CB ASP A 43 26.224 14.848 -20.500 1.00 0.00 C ATOM 624 CG ASP A 43 26.233 14.874 -22.017 1.00 0.00 C ATOM 625 OD1 ASP A 43 25.884 13.854 -22.655 1.00 0.00 O ATOM 626 OD2 ASP A 43 26.621 15.949 -22.522 1.00 0.00 O ATOM 0 H ASP A 43 24.482 15.218 -18.752 1.00 0.00 H new ATOM 0 HA ASP A 43 24.934 13.092 -20.663 1.00 0.00 H new ATOM 0 HB2 ASP A 43 25.832 15.797 -20.134 1.00 0.00 H new ATOM 0 HB3 ASP A 43 27.251 14.769 -20.144 1.00 0.00 H new ATOM 631 N GLY A 44 26.600 13.264 -17.824 1.00 0.00 N ATOM 632 CA GLY A 44 27.491 12.591 -16.900 1.00 0.00 C ATOM 633 C GLY A 44 27.299 13.075 -15.479 1.00 0.00 C ATOM 634 O GLY A 44 26.630 12.428 -14.670 1.00 0.00 O ATOM 0 H GLY A 44 26.171 14.100 -17.428 1.00 0.00 H new ATOM 0 HA2 GLY A 44 27.316 11.516 -16.944 1.00 0.00 H new ATOM 0 HA3 GLY A 44 28.524 12.759 -17.204 1.00 0.00 H new ATOM 638 N ASP A 45 27.852 14.253 -15.194 1.00 0.00 N ATOM 639 CA ASP A 45 27.788 14.874 -13.879 1.00 0.00 C ATOM 640 C ASP A 45 26.881 16.085 -13.894 1.00 0.00 C ATOM 641 O ASP A 45 25.842 16.098 -13.231 1.00 0.00 O ATOM 642 CB ASP A 45 29.183 15.350 -13.450 1.00 0.00 C ATOM 643 CG ASP A 45 29.773 14.602 -12.280 1.00 0.00 C ATOM 644 OD1 ASP A 45 29.691 13.369 -12.275 1.00 0.00 O ATOM 645 OD2 ASP A 45 30.310 15.300 -11.389 1.00 0.00 O ATOM 0 H ASP A 45 28.363 14.807 -15.881 1.00 0.00 H new ATOM 0 HA ASP A 45 27.402 14.126 -13.186 1.00 0.00 H new ATOM 0 HB2 ASP A 45 29.860 15.260 -14.300 1.00 0.00 H new ATOM 0 HB3 ASP A 45 29.129 16.409 -13.197 1.00 0.00 H new ATOM 650 N GLY A 46 27.316 17.144 -14.606 1.00 0.00 N ATOM 651 CA GLY A 46 26.584 18.377 -14.764 1.00 0.00 C ATOM 652 C GLY A 46 25.208 18.120 -15.340 1.00 0.00 C ATOM 653 O GLY A 46 24.751 16.990 -15.456 1.00 0.00 O ATOM 0 H GLY A 46 28.212 17.146 -15.093 1.00 0.00 H new ATOM 0 HA2 GLY A 46 26.491 18.875 -13.799 1.00 0.00 H new ATOM 0 HA3 GLY A 46 27.136 19.051 -15.419 1.00 0.00 H new ATOM 657 N LYS A 47 24.509 19.185 -15.710 1.00 0.00 N ATOM 658 CA LYS A 47 23.203 19.074 -16.327 1.00 0.00 C ATOM 659 C LYS A 47 23.256 18.251 -17.630 1.00 0.00 C ATOM 660 O LYS A 47 24.212 17.563 -17.975 1.00 0.00 O ATOM 661 CB LYS A 47 22.577 20.455 -16.526 1.00 0.00 C ATOM 662 CG LYS A 47 22.879 21.378 -15.339 1.00 0.00 C ATOM 663 CD LYS A 47 21.867 22.518 -15.243 1.00 0.00 C ATOM 664 CE LYS A 47 22.485 23.839 -15.711 1.00 0.00 C ATOM 665 NZ LYS A 47 22.122 24.121 -17.117 1.00 0.00 N ATOM 0 H LYS A 47 24.834 20.144 -15.590 1.00 0.00 H new ATOM 0 HA LYS A 47 22.552 18.523 -15.648 1.00 0.00 H new ATOM 0 HB2 LYS A 47 22.960 20.902 -17.444 1.00 0.00 H new ATOM 0 HB3 LYS A 47 21.498 20.354 -16.646 1.00 0.00 H new ATOM 0 HG2 LYS A 47 22.866 20.800 -14.415 1.00 0.00 H new ATOM 0 HG3 LYS A 47 23.883 21.789 -15.443 1.00 0.00 H new ATOM 0 HD2 LYS A 47 20.993 22.285 -15.851 1.00 0.00 H new ATOM 0 HD3 LYS A 47 21.522 22.618 -14.214 1.00 0.00 H new ATOM 0 HE2 LYS A 47 22.142 24.653 -15.072 1.00 0.00 H new ATOM 0 HE3 LYS A 47 23.570 23.793 -15.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 22.552 25.021 -17.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 22.471 23.354 -17.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 21.088 24.187 -17.202 1.00 0.00 H new ATOM 679 N LEU A 48 22.180 18.311 -18.383 1.00 0.00 N ATOM 680 CA LEU A 48 22.108 17.573 -19.617 1.00 0.00 C ATOM 681 C LEU A 48 22.706 18.384 -20.762 1.00 0.00 C ATOM 682 O LEU A 48 22.865 19.604 -20.623 1.00 0.00 O ATOM 683 CB LEU A 48 20.670 17.146 -19.872 1.00 0.00 C ATOM 684 CG LEU A 48 19.736 17.149 -18.647 1.00 0.00 C ATOM 685 CD1 LEU A 48 19.136 18.553 -18.484 1.00 0.00 C ATOM 686 CD2 LEU A 48 18.676 16.074 -18.773 1.00 0.00 C ATOM 0 H LEU A 48 21.350 18.860 -18.162 1.00 0.00 H new ATOM 0 HA LEU A 48 22.706 16.665 -19.544 1.00 0.00 H new ATOM 0 HB2 LEU A 48 20.245 17.805 -20.629 1.00 0.00 H new ATOM 0 HB3 LEU A 48 20.680 16.141 -20.294 1.00 0.00 H new ATOM 0 HG LEU A 48 20.301 16.912 -17.746 1.00 0.00 H new ATOM 0 HD11 LEU A 48 18.473 18.567 -17.619 1.00 0.00 H new ATOM 0 HD12 LEU A 48 19.938 19.277 -18.338 1.00 0.00 H new ATOM 0 HD13 LEU A 48 18.571 18.813 -19.379 1.00 0.00 H new ATOM 0 HD21 LEU A 48 18.029 16.096 -17.896 1.00 0.00 H new ATOM 0 HD22 LEU A 48 18.080 16.254 -19.668 1.00 0.00 H new ATOM 0 HD23 LEU A 48 19.155 15.098 -18.846 1.00 0.00 H new ATOM 698 N PRO A 49 23.021 17.722 -21.881 1.00 0.00 N ATOM 699 CA PRO A 49 23.557 18.395 -23.049 1.00 0.00 C ATOM 700 C PRO A 49 22.491 19.223 -23.738 1.00 0.00 C ATOM 701 O PRO A 49 21.295 19.185 -23.395 1.00 0.00 O ATOM 702 CB PRO A 49 24.088 17.286 -23.958 1.00 0.00 C ATOM 703 CG PRO A 49 23.408 16.003 -23.482 1.00 0.00 C ATOM 704 CD PRO A 49 22.807 16.302 -22.121 1.00 0.00 C ATOM 0 HA PRO A 49 24.348 19.096 -22.783 1.00 0.00 H new ATOM 0 HB2 PRO A 49 23.853 17.490 -25.003 1.00 0.00 H new ATOM 0 HB3 PRO A 49 25.173 17.205 -23.885 1.00 0.00 H new ATOM 0 HG2 PRO A 49 22.636 15.691 -24.185 1.00 0.00 H new ATOM 0 HG3 PRO A 49 24.127 15.186 -23.416 1.00 0.00 H new ATOM 0 HD2 PRO A 49 21.744 16.061 -22.104 1.00 0.00 H new ATOM 0 HD3 PRO A 49 23.282 15.701 -21.346 1.00 0.00 H new ATOM 712 N LYS A 50 22.920 20.025 -24.724 1.00 0.00 N ATOM 713 CA LYS A 50 22.027 20.838 -25.526 1.00 0.00 C ATOM 714 C LYS A 50 21.000 19.952 -26.236 1.00 0.00 C ATOM 715 O LYS A 50 21.260 19.418 -27.312 1.00 0.00 O ATOM 716 CB LYS A 50 22.830 21.753 -26.465 1.00 0.00 C ATOM 717 CG LYS A 50 22.027 22.145 -27.715 1.00 0.00 C ATOM 718 CD LYS A 50 22.478 23.473 -28.300 1.00 0.00 C ATOM 719 CE LYS A 50 22.616 23.357 -29.820 1.00 0.00 C ATOM 720 NZ LYS A 50 23.178 24.606 -30.370 1.00 0.00 N ATOM 0 H LYS A 50 23.903 20.120 -24.980 1.00 0.00 H new ATOM 0 HA LYS A 50 21.453 21.507 -24.885 1.00 0.00 H new ATOM 0 HB2 LYS A 50 23.126 22.654 -25.927 1.00 0.00 H new ATOM 0 HB3 LYS A 50 23.747 21.247 -26.767 1.00 0.00 H new ATOM 0 HG2 LYS A 50 22.130 21.365 -28.469 1.00 0.00 H new ATOM 0 HG3 LYS A 50 20.969 22.204 -27.460 1.00 0.00 H new ATOM 0 HD2 LYS A 50 21.758 24.253 -28.051 1.00 0.00 H new ATOM 0 HD3 LYS A 50 23.432 23.768 -27.862 1.00 0.00 H new ATOM 0 HE2 LYS A 50 23.261 22.516 -30.072 1.00 0.00 H new ATOM 0 HE3 LYS A 50 21.643 23.158 -30.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 23.269 24.521 -31.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 22.547 25.400 -30.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 24.115 24.778 -29.953 1.00 0.00 H new ATOM 734 N GLY A 51 19.818 19.827 -25.641 1.00 0.00 N ATOM 735 CA GLY A 51 18.767 18.982 -26.166 1.00 0.00 C ATOM 736 C GLY A 51 18.564 17.747 -25.323 1.00 0.00 C ATOM 737 O GLY A 51 19.146 16.699 -25.601 1.00 0.00 O ATOM 0 H GLY A 51 19.568 20.313 -24.780 1.00 0.00 H new ATOM 0 HA2 GLY A 51 17.836 19.547 -26.212 1.00 0.00 H new ATOM 0 HA3 GLY A 51 19.013 18.689 -27.187 1.00 0.00 H new ATOM 741 N ARG A 52 17.705 17.854 -24.304 1.00 0.00 N ATOM 742 CA ARG A 52 17.333 16.747 -23.442 1.00 0.00 C ATOM 743 C ARG A 52 16.120 17.080 -22.602 1.00 0.00 C ATOM 744 O ARG A 52 15.825 18.253 -22.412 1.00 0.00 O ATOM 745 CB ARG A 52 18.516 16.411 -22.525 1.00 0.00 C ATOM 746 CG ARG A 52 19.172 15.081 -22.902 1.00 0.00 C ATOM 747 CD ARG A 52 18.224 13.901 -22.733 1.00 0.00 C ATOM 748 NE ARG A 52 17.527 13.580 -23.985 1.00 0.00 N ATOM 749 CZ ARG A 52 16.383 12.936 -24.100 1.00 0.00 C ATOM 750 NH1 ARG A 52 15.755 12.504 -23.038 1.00 0.00 N ATOM 751 NH2 ARG A 52 15.853 12.737 -25.275 1.00 0.00 N ATOM 0 H ARG A 52 17.246 18.731 -24.058 1.00 0.00 H new ATOM 0 HA ARG A 52 17.080 15.891 -24.068 1.00 0.00 H new ATOM 0 HB2 ARG A 52 19.256 17.209 -22.581 1.00 0.00 H new ATOM 0 HB3 ARG A 52 18.173 16.366 -21.491 1.00 0.00 H new ATOM 0 HG2 ARG A 52 19.511 15.126 -23.937 1.00 0.00 H new ATOM 0 HG3 ARG A 52 20.056 14.926 -22.283 1.00 0.00 H new ATOM 0 HD2 ARG A 52 18.785 13.029 -22.395 1.00 0.00 H new ATOM 0 HD3 ARG A 52 17.493 14.130 -21.958 1.00 0.00 H new ATOM 0 HE ARG A 52 17.972 13.885 -24.851 1.00 0.00 H new ATOM 0 HH11 ARG A 52 16.150 12.665 -22.111 1.00 0.00 H new ATOM 0 HH12 ARG A 52 14.870 12.006 -23.136 1.00 0.00 H new ATOM 0 HH21 ARG A 52 16.324 13.081 -26.112 1.00 0.00 H new ATOM 0 HH22 ARG A 52 14.967 12.238 -25.357 1.00 0.00 H new ATOM 765 N THR A 53 15.496 16.045 -22.034 1.00 0.00 N ATOM 766 CA THR A 53 14.277 16.217 -21.255 1.00 0.00 C ATOM 767 C THR A 53 14.279 15.246 -20.082 1.00 0.00 C ATOM 768 O THR A 53 14.024 14.052 -20.277 1.00 0.00 O ATOM 769 CB THR A 53 13.052 16.105 -22.148 1.00 0.00 C ATOM 770 OG1 THR A 53 13.178 17.149 -23.098 1.00 0.00 O ATOM 771 CG2 THR A 53 11.753 16.325 -21.381 1.00 0.00 C ATOM 0 H THR A 53 15.819 15.080 -22.102 1.00 0.00 H new ATOM 0 HA THR A 53 14.238 17.220 -20.830 1.00 0.00 H new ATOM 0 HB THR A 53 13.007 15.108 -22.587 1.00 0.00 H new ATOM 0 HG1 THR A 53 12.412 17.129 -23.709 1.00 0.00 H new ATOM 0 HG21 THR A 53 10.908 16.235 -22.063 1.00 0.00 H new ATOM 0 HG22 THR A 53 11.665 15.577 -20.593 1.00 0.00 H new ATOM 0 HG23 THR A 53 11.756 17.321 -20.938 1.00 0.00 H new ATOM 779 N PRO A 54 14.735 15.714 -18.900 1.00 0.00 N ATOM 780 CA PRO A 54 14.795 14.889 -17.702 1.00 0.00 C ATOM 781 C PRO A 54 13.404 14.650 -17.138 1.00 0.00 C ATOM 782 O PRO A 54 12.412 15.280 -17.534 1.00 0.00 O ATOM 783 CB PRO A 54 15.668 15.659 -16.699 1.00 0.00 C ATOM 784 CG PRO A 54 15.687 17.105 -17.181 1.00 0.00 C ATOM 785 CD PRO A 54 15.151 17.088 -18.615 1.00 0.00 C ATOM 0 HA PRO A 54 15.214 13.906 -17.919 1.00 0.00 H new ATOM 0 HB2 PRO A 54 15.258 15.589 -15.691 1.00 0.00 H new ATOM 0 HB3 PRO A 54 16.676 15.247 -16.663 1.00 0.00 H new ATOM 0 HG2 PRO A 54 15.069 17.736 -16.542 1.00 0.00 H new ATOM 0 HG3 PRO A 54 16.698 17.512 -17.149 1.00 0.00 H new ATOM 0 HD2 PRO A 54 14.311 17.775 -18.721 1.00 0.00 H new ATOM 0 HD3 PRO A 54 15.919 17.412 -19.318 1.00 0.00 H new ATOM 793 N ILE A 55 13.314 13.741 -16.172 1.00 0.00 N ATOM 794 CA ILE A 55 12.049 13.383 -15.569 1.00 0.00 C ATOM 795 C ILE A 55 11.923 14.125 -14.258 1.00 0.00 C ATOM 796 O ILE A 55 12.883 14.230 -13.496 1.00 0.00 O ATOM 797 CB ILE A 55 11.936 11.863 -15.421 1.00 0.00 C ATOM 798 CG1 ILE A 55 12.386 11.158 -16.715 1.00 0.00 C ATOM 799 CG2 ILE A 55 10.484 11.516 -15.103 1.00 0.00 C ATOM 800 CD1 ILE A 55 12.066 9.671 -16.721 1.00 0.00 C ATOM 0 H ILE A 55 14.116 13.238 -15.792 1.00 0.00 H new ATOM 0 HA ILE A 55 11.215 13.679 -16.205 1.00 0.00 H new ATOM 0 HB ILE A 55 12.585 11.522 -14.614 1.00 0.00 H new ATOM 0 HG12 ILE A 55 11.901 11.632 -17.568 1.00 0.00 H new ATOM 0 HG13 ILE A 55 13.460 11.294 -16.842 1.00 0.00 H new ATOM 0 HG21 ILE A 55 10.383 10.436 -14.994 1.00 0.00 H new ATOM 0 HG22 ILE A 55 10.188 12.004 -14.174 1.00 0.00 H new ATOM 0 HG23 ILE A 55 9.842 11.860 -15.914 1.00 0.00 H new ATOM 0 HD11 ILE A 55 12.407 9.229 -17.658 1.00 0.00 H new ATOM 0 HD12 ILE A 55 12.572 9.187 -15.886 1.00 0.00 H new ATOM 0 HD13 ILE A 55 10.990 9.530 -16.624 1.00 0.00 H new ATOM 812 N LYS A 56 10.753 14.722 -14.010 1.00 0.00 N ATOM 813 CA LYS A 56 10.496 15.401 -12.756 1.00 0.00 C ATOM 814 C LYS A 56 9.992 14.413 -11.719 1.00 0.00 C ATOM 815 O LYS A 56 9.416 13.389 -12.051 1.00 0.00 O ATOM 816 CB LYS A 56 9.529 16.570 -13.014 1.00 0.00 C ATOM 817 CG LYS A 56 9.153 17.319 -11.725 1.00 0.00 C ATOM 818 CD LYS A 56 10.381 17.982 -11.080 1.00 0.00 C ATOM 819 CE LYS A 56 10.792 19.224 -11.878 1.00 0.00 C ATOM 820 NZ LYS A 56 12.266 19.287 -12.068 1.00 0.00 N ATOM 0 H LYS A 56 9.974 14.744 -14.668 1.00 0.00 H new ATOM 0 HA LYS A 56 11.414 15.823 -12.346 1.00 0.00 H new ATOM 0 HB2 LYS A 56 9.987 17.268 -13.715 1.00 0.00 H new ATOM 0 HB3 LYS A 56 8.623 16.190 -13.487 1.00 0.00 H new ATOM 0 HG2 LYS A 56 8.404 18.078 -11.950 1.00 0.00 H new ATOM 0 HG3 LYS A 56 8.700 16.624 -11.018 1.00 0.00 H new ATOM 0 HD2 LYS A 56 10.154 18.261 -10.051 1.00 0.00 H new ATOM 0 HD3 LYS A 56 11.209 17.274 -11.044 1.00 0.00 H new ATOM 0 HE2 LYS A 56 10.299 19.213 -12.850 1.00 0.00 H new ATOM 0 HE3 LYS A 56 10.452 20.120 -11.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 12.510 20.139 -12.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 12.734 19.322 -11.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 12.586 18.443 -12.585 1.00 0.00 H new ATOM 834 N PHE A 57 10.151 14.765 -10.441 1.00 0.00 N ATOM 835 CA PHE A 57 9.698 13.965 -9.323 1.00 0.00 C ATOM 836 C PHE A 57 9.122 14.840 -8.225 1.00 0.00 C ATOM 837 O PHE A 57 8.074 14.529 -7.676 1.00 0.00 O ATOM 838 CB PHE A 57 10.911 13.181 -8.798 1.00 0.00 C ATOM 839 CG PHE A 57 11.729 12.514 -9.878 1.00 0.00 C ATOM 840 CD1 PHE A 57 11.292 11.304 -10.433 1.00 0.00 C ATOM 841 CD2 PHE A 57 12.903 13.118 -10.360 1.00 0.00 C ATOM 842 CE1 PHE A 57 12.041 10.681 -11.446 1.00 0.00 C ATOM 843 CE2 PHE A 57 13.653 12.487 -11.360 1.00 0.00 C ATOM 844 CZ PHE A 57 13.220 11.275 -11.915 1.00 0.00 C ATOM 0 H PHE A 57 10.608 15.632 -10.159 1.00 0.00 H new ATOM 0 HA PHE A 57 8.907 13.287 -9.644 1.00 0.00 H new ATOM 0 HB2 PHE A 57 11.554 13.860 -8.237 1.00 0.00 H new ATOM 0 HB3 PHE A 57 10.564 12.421 -8.099 1.00 0.00 H new ATOM 0 HD1 PHE A 57 10.378 10.849 -10.082 1.00 0.00 H new ATOM 0 HD2 PHE A 57 13.226 14.068 -9.960 1.00 0.00 H new ATOM 0 HE1 PHE A 57 11.707 9.743 -11.864 1.00 0.00 H new ATOM 0 HE2 PHE A 57 14.572 12.937 -11.706 1.00 0.00 H new ATOM 0 HZ PHE A 57 13.792 10.802 -12.700 1.00 0.00 H new ATOM 854 N GLY A 58 9.842 15.913 -7.878 1.00 0.00 N ATOM 855 CA GLY A 58 9.487 16.799 -6.775 1.00 0.00 C ATOM 856 C GLY A 58 10.469 16.733 -5.620 1.00 0.00 C ATOM 857 O GLY A 58 10.334 17.475 -4.651 1.00 0.00 O ATOM 0 H GLY A 58 10.696 16.189 -8.363 1.00 0.00 H new ATOM 0 HA2 GLY A 58 9.435 17.824 -7.142 1.00 0.00 H new ATOM 0 HA3 GLY A 58 8.492 16.539 -6.414 1.00 0.00 H new ATOM 861 N LYS A 59 11.461 15.837 -5.696 1.00 0.00 N ATOM 862 CA LYS A 59 12.503 15.714 -4.691 1.00 0.00 C ATOM 863 C LYS A 59 13.723 16.489 -5.104 1.00 0.00 C ATOM 864 O LYS A 59 14.133 16.343 -6.247 1.00 0.00 O ATOM 865 CB LYS A 59 12.801 14.226 -4.454 1.00 0.00 C ATOM 866 CG LYS A 59 12.070 13.763 -3.186 1.00 0.00 C ATOM 867 CD LYS A 59 11.427 12.390 -3.381 1.00 0.00 C ATOM 868 CE LYS A 59 10.069 12.531 -4.089 1.00 0.00 C ATOM 869 NZ LYS A 59 9.936 11.539 -5.181 1.00 0.00 N ATOM 0 H LYS A 59 11.556 15.175 -6.467 1.00 0.00 H new ATOM 0 HA LYS A 59 12.168 16.143 -3.747 1.00 0.00 H new ATOM 0 HB2 LYS A 59 12.477 13.636 -5.311 1.00 0.00 H new ATOM 0 HB3 LYS A 59 13.874 14.070 -4.347 1.00 0.00 H new ATOM 0 HG2 LYS A 59 12.773 13.722 -2.354 1.00 0.00 H new ATOM 0 HG3 LYS A 59 11.303 14.491 -2.920 1.00 0.00 H new ATOM 0 HD2 LYS A 59 12.087 11.752 -3.969 1.00 0.00 H new ATOM 0 HD3 LYS A 59 11.292 11.904 -2.415 1.00 0.00 H new ATOM 0 HE2 LYS A 59 9.263 12.394 -3.368 1.00 0.00 H new ATOM 0 HE3 LYS A 59 9.968 13.538 -4.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 9.012 11.654 -5.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 10.693 11.687 -5.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 10.010 10.579 -4.789 1.00 0.00 H new ATOM 883 N SER A 60 14.303 17.247 -4.171 1.00 0.00 N ATOM 884 CA SER A 60 15.536 17.995 -4.417 1.00 0.00 C ATOM 885 C SER A 60 16.734 17.063 -4.579 1.00 0.00 C ATOM 886 O SER A 60 17.836 17.485 -4.907 1.00 0.00 O ATOM 887 CB SER A 60 15.777 18.987 -3.277 1.00 0.00 C ATOM 888 OG SER A 60 16.846 19.881 -3.542 1.00 0.00 O ATOM 0 H SER A 60 13.932 17.359 -3.227 1.00 0.00 H new ATOM 0 HA SER A 60 15.421 18.544 -5.352 1.00 0.00 H new ATOM 0 HB2 SER A 60 14.866 19.559 -3.101 1.00 0.00 H new ATOM 0 HB3 SER A 60 15.989 18.436 -2.361 1.00 0.00 H new ATOM 0 HG SER A 60 17.540 19.418 -4.056 1.00 0.00 H new ATOM 894 N ASP A 61 16.551 15.756 -4.354 1.00 0.00 N ATOM 895 CA ASP A 61 17.587 14.753 -4.455 1.00 0.00 C ATOM 896 C ASP A 61 17.636 14.216 -5.863 1.00 0.00 C ATOM 897 O ASP A 61 18.685 14.270 -6.502 1.00 0.00 O ATOM 898 CB ASP A 61 17.341 13.568 -3.513 1.00 0.00 C ATOM 899 CG ASP A 61 16.697 13.968 -2.200 1.00 0.00 C ATOM 900 OD1 ASP A 61 15.442 14.010 -2.186 1.00 0.00 O ATOM 901 OD2 ASP A 61 17.472 14.280 -1.273 1.00 0.00 O ATOM 0 H ASP A 61 15.645 15.368 -4.089 1.00 0.00 H new ATOM 0 HA ASP A 61 18.524 15.236 -4.178 1.00 0.00 H new ATOM 0 HB2 ASP A 61 16.704 12.840 -4.015 1.00 0.00 H new ATOM 0 HB3 ASP A 61 18.290 13.073 -3.308 1.00 0.00 H new ATOM 906 N CYS A 62 16.497 13.691 -6.341 1.00 0.00 N ATOM 907 CA CYS A 62 16.379 13.191 -7.697 1.00 0.00 C ATOM 908 C CYS A 62 16.390 14.341 -8.698 1.00 0.00 C ATOM 909 O CYS A 62 16.581 14.113 -9.889 1.00 0.00 O ATOM 910 CB CYS A 62 15.089 12.376 -7.864 1.00 0.00 C ATOM 911 SG CYS A 62 14.786 11.115 -6.618 1.00 0.00 S ATOM 0 H CYS A 62 15.642 13.607 -5.792 1.00 0.00 H new ATOM 0 HA CYS A 62 17.235 12.544 -7.890 1.00 0.00 H new ATOM 0 HB2 CYS A 62 14.245 13.066 -7.867 1.00 0.00 H new ATOM 0 HB3 CYS A 62 15.111 11.895 -8.842 1.00 0.00 H new ATOM 916 N ASP A 63 16.128 15.564 -8.222 1.00 0.00 N ATOM 917 CA ASP A 63 16.207 16.775 -9.023 1.00 0.00 C ATOM 918 C ASP A 63 17.636 17.256 -9.163 1.00 0.00 C ATOM 919 O ASP A 63 18.038 17.708 -10.240 1.00 0.00 O ATOM 920 CB ASP A 63 15.399 17.891 -8.361 1.00 0.00 C ATOM 921 CG ASP A 63 15.555 19.248 -9.033 1.00 0.00 C ATOM 922 OD1 ASP A 63 15.070 19.353 -10.188 1.00 0.00 O ATOM 923 OD2 ASP A 63 16.015 20.182 -8.341 1.00 0.00 O ATOM 0 H ASP A 63 15.852 15.735 -7.255 1.00 0.00 H new ATOM 0 HA ASP A 63 15.808 16.537 -10.009 1.00 0.00 H new ATOM 0 HB2 ASP A 63 14.345 17.614 -8.364 1.00 0.00 H new ATOM 0 HB3 ASP A 63 15.703 17.976 -7.318 1.00 0.00 H new ATOM 928 N ARG A 64 18.409 17.187 -8.066 1.00 0.00 N ATOM 929 CA ARG A 64 19.790 17.607 -8.091 1.00 0.00 C ATOM 930 C ARG A 64 20.550 16.931 -9.238 1.00 0.00 C ATOM 931 O ARG A 64 20.274 15.795 -9.632 1.00 0.00 O ATOM 932 CB ARG A 64 20.464 17.345 -6.738 1.00 0.00 C ATOM 933 CG ARG A 64 21.529 16.248 -6.769 1.00 0.00 C ATOM 934 CD ARG A 64 22.213 16.035 -5.447 1.00 0.00 C ATOM 935 NE ARG A 64 21.280 16.075 -4.338 1.00 0.00 N ATOM 936 CZ ARG A 64 21.548 16.475 -3.117 1.00 0.00 C ATOM 937 NH1 ARG A 64 22.774 16.792 -2.787 1.00 0.00 N ATOM 938 NH2 ARG A 64 20.605 16.546 -2.224 1.00 0.00 N ATOM 0 H ARG A 64 18.087 16.843 -7.161 1.00 0.00 H new ATOM 0 HA ARG A 64 19.816 18.682 -8.271 1.00 0.00 H new ATOM 0 HB2 ARG A 64 20.922 18.270 -6.388 1.00 0.00 H new ATOM 0 HB3 ARG A 64 19.699 17.073 -6.011 1.00 0.00 H new ATOM 0 HG2 ARG A 64 21.066 15.313 -7.084 1.00 0.00 H new ATOM 0 HG3 ARG A 64 22.278 16.501 -7.519 1.00 0.00 H new ATOM 0 HD2 ARG A 64 22.725 15.073 -5.455 1.00 0.00 H new ATOM 0 HD3 ARG A 64 22.976 16.801 -5.306 1.00 0.00 H new ATOM 0 HE ARG A 64 20.327 15.763 -4.524 1.00 0.00 H new ATOM 0 HH11 ARG A 64 23.521 16.728 -3.479 1.00 0.00 H new ATOM 0 HH12 ARG A 64 22.983 17.103 -1.838 1.00 0.00 H new ATOM 0 HH21 ARG A 64 19.649 16.290 -2.470 1.00 0.00 H new ATOM 0 HH22 ARG A 64 20.822 16.858 -1.277 1.00 0.00 H new ATOM 952 N PRO A 65 21.675 17.542 -9.636 1.00 0.00 N ATOM 953 CA PRO A 65 22.542 16.937 -10.620 1.00 0.00 C ATOM 954 C PRO A 65 23.307 15.705 -10.097 1.00 0.00 C ATOM 955 O PRO A 65 23.844 15.698 -8.976 1.00 0.00 O ATOM 956 CB PRO A 65 23.474 18.050 -11.072 1.00 0.00 C ATOM 957 CG PRO A 65 23.429 19.108 -9.965 1.00 0.00 C ATOM 958 CD PRO A 65 22.239 18.765 -9.082 1.00 0.00 C ATOM 0 HA PRO A 65 21.959 16.534 -11.448 1.00 0.00 H new ATOM 0 HB2 PRO A 65 24.488 17.677 -11.215 1.00 0.00 H new ATOM 0 HB3 PRO A 65 23.151 18.468 -12.025 1.00 0.00 H new ATOM 0 HG2 PRO A 65 24.353 19.104 -9.388 1.00 0.00 H new ATOM 0 HG3 PRO A 65 23.322 20.107 -10.388 1.00 0.00 H new ATOM 0 HD2 PRO A 65 22.549 18.619 -8.047 1.00 0.00 H new ATOM 0 HD3 PRO A 65 21.505 19.571 -9.085 1.00 0.00 H new ATOM 966 N PRO A 66 23.380 14.624 -10.890 1.00 0.00 N ATOM 967 CA PRO A 66 24.095 13.423 -10.519 1.00 0.00 C ATOM 968 C PRO A 66 25.597 13.643 -10.578 1.00 0.00 C ATOM 969 O PRO A 66 26.099 14.698 -10.954 1.00 0.00 O ATOM 970 CB PRO A 66 23.622 12.352 -11.507 1.00 0.00 C ATOM 971 CG PRO A 66 23.017 13.090 -12.688 1.00 0.00 C ATOM 972 CD PRO A 66 22.839 14.530 -12.228 1.00 0.00 C ATOM 0 HA PRO A 66 23.892 13.121 -9.491 1.00 0.00 H new ATOM 0 HB2 PRO A 66 24.454 11.725 -11.827 1.00 0.00 H new ATOM 0 HB3 PRO A 66 22.887 11.694 -11.043 1.00 0.00 H new ATOM 0 HG2 PRO A 66 23.669 13.035 -13.559 1.00 0.00 H new ATOM 0 HG3 PRO A 66 22.062 12.651 -12.977 1.00 0.00 H new ATOM 0 HD2 PRO A 66 23.356 15.215 -12.900 1.00 0.00 H new ATOM 0 HD3 PRO A 66 21.785 14.809 -12.237 1.00 0.00 H new ATOM 980 N LYS A 67 26.340 12.656 -10.083 1.00 0.00 N ATOM 981 CA LYS A 67 27.782 12.712 -10.100 1.00 0.00 C ATOM 982 C LYS A 67 28.342 11.442 -10.714 1.00 0.00 C ATOM 983 O LYS A 67 29.075 10.736 -10.056 1.00 0.00 O ATOM 984 CB LYS A 67 28.325 13.085 -8.711 1.00 0.00 C ATOM 985 CG LYS A 67 29.868 13.091 -8.649 1.00 0.00 C ATOM 986 CD LYS A 67 30.431 14.497 -8.530 1.00 0.00 C ATOM 987 CE LYS A 67 31.861 14.529 -9.091 1.00 0.00 C ATOM 988 NZ LYS A 67 32.276 15.923 -9.351 1.00 0.00 N ATOM 0 H LYS A 67 25.956 11.808 -9.665 1.00 0.00 H new ATOM 0 HA LYS A 67 28.133 13.515 -10.748 1.00 0.00 H new ATOM 0 HB2 LYS A 67 27.952 14.071 -8.434 1.00 0.00 H new ATOM 0 HB3 LYS A 67 27.940 12.380 -7.975 1.00 0.00 H new ATOM 0 HG2 LYS A 67 30.198 12.496 -7.798 1.00 0.00 H new ATOM 0 HG3 LYS A 67 30.268 12.616 -9.545 1.00 0.00 H new ATOM 0 HD2 LYS A 67 29.800 15.199 -9.075 1.00 0.00 H new ATOM 0 HD3 LYS A 67 30.432 14.812 -7.487 1.00 0.00 H new ATOM 0 HE2 LYS A 67 32.547 14.063 -8.384 1.00 0.00 H new ATOM 0 HE3 LYS A 67 31.911 13.949 -10.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 33.293 15.948 -9.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 31.741 16.299 -10.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 32.086 16.504 -8.510 1.00 0.00 H new ATOM 1002 N HIS A 68 27.871 11.012 -11.877 1.00 0.00 N ATOM 1003 CA HIS A 68 28.403 9.785 -12.469 1.00 0.00 C ATOM 1004 C HIS A 68 29.773 10.005 -13.120 1.00 0.00 C ATOM 1005 O HIS A 68 30.134 11.082 -13.572 1.00 0.00 O ATOM 1006 CB HIS A 68 27.381 9.271 -13.463 1.00 0.00 C ATOM 1007 CG HIS A 68 27.795 7.971 -14.120 1.00 0.00 C ATOM 1008 ND1 HIS A 68 28.317 7.887 -15.381 1.00 0.00 N ATOM 1009 CD2 HIS A 68 27.726 6.713 -13.573 1.00 0.00 C ATOM 1010 CE1 HIS A 68 28.525 6.575 -15.632 1.00 0.00 C ATOM 1011 NE2 HIS A 68 28.185 5.836 -14.562 1.00 0.00 N ATOM 0 H HIS A 68 27.142 11.477 -12.419 1.00 0.00 H new ATOM 0 HA HIS A 68 28.570 9.042 -11.689 1.00 0.00 H new ATOM 0 HB2 HIS A 68 26.428 9.127 -12.954 1.00 0.00 H new ATOM 0 HB3 HIS A 68 27.220 10.026 -14.233 1.00 0.00 H new ATOM 0 HD1 HIS A 68 28.512 8.665 -16.011 1.00 0.00 H new ATOM 0 HD2 HIS A 68 27.386 6.453 -12.581 1.00 0.00 H new ATOM 0 HE1 HIS A 68 28.909 6.177 -16.560 1.00 0.00 H new ATOM 1020 N SER A 69 30.516 8.942 -13.345 1.00 0.00 N ATOM 1021 CA SER A 69 31.796 9.034 -14.015 1.00 0.00 C ATOM 1022 C SER A 69 32.163 7.666 -14.514 1.00 0.00 C ATOM 1023 O SER A 69 31.400 6.712 -14.323 1.00 0.00 O ATOM 1024 CB SER A 69 32.836 9.598 -13.054 1.00 0.00 C ATOM 1025 OG SER A 69 33.364 10.784 -13.629 1.00 0.00 O ATOM 0 H SER A 69 30.252 7.996 -13.071 1.00 0.00 H new ATOM 0 HA SER A 69 31.748 9.711 -14.868 1.00 0.00 H new ATOM 0 HB2 SER A 69 32.384 9.812 -12.085 1.00 0.00 H new ATOM 0 HB3 SER A 69 33.630 8.871 -12.882 1.00 0.00 H new ATOM 0 HG SER A 69 34.036 11.168 -13.028 1.00 0.00 H new ATOM 1031 N LYS A 70 33.305 7.560 -15.204 1.00 0.00 N ATOM 1032 CA LYS A 70 33.871 6.316 -15.681 1.00 0.00 C ATOM 1033 C LYS A 70 34.279 5.399 -14.525 1.00 0.00 C ATOM 1034 O LYS A 70 35.466 5.306 -14.233 1.00 0.00 O ATOM 1035 CB LYS A 70 35.046 6.602 -16.624 1.00 0.00 C ATOM 1036 CG LYS A 70 35.939 7.745 -16.125 1.00 0.00 C ATOM 1037 CD LYS A 70 37.365 7.633 -16.676 1.00 0.00 C ATOM 1038 CE LYS A 70 38.318 8.521 -15.868 1.00 0.00 C ATOM 1039 NZ LYS A 70 38.561 7.947 -14.518 1.00 0.00 N ATOM 0 H LYS A 70 33.871 8.372 -15.448 1.00 0.00 H new ATOM 0 HA LYS A 70 33.104 5.782 -16.242 1.00 0.00 H new ATOM 0 HB2 LYS A 70 35.646 5.699 -16.735 1.00 0.00 H new ATOM 0 HB3 LYS A 70 34.661 6.852 -17.613 1.00 0.00 H new ATOM 0 HG2 LYS A 70 35.508 8.701 -16.423 1.00 0.00 H new ATOM 0 HG3 LYS A 70 35.968 7.735 -15.035 1.00 0.00 H new ATOM 0 HD2 LYS A 70 37.699 6.596 -16.633 1.00 0.00 H new ATOM 0 HD3 LYS A 70 37.381 7.930 -17.725 1.00 0.00 H new ATOM 0 HE2 LYS A 70 39.264 8.624 -16.399 1.00 0.00 H new ATOM 0 HE3 LYS A 70 37.896 9.521 -15.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 39.435 8.348 -14.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 37.761 8.177 -13.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 38.657 6.914 -14.592 1.00 0.00 H new ATOM 1053 N ASP A 71 33.292 4.800 -13.879 1.00 0.00 N ATOM 1054 CA ASP A 71 33.441 3.952 -12.710 1.00 0.00 C ATOM 1055 C ASP A 71 32.085 3.455 -12.244 1.00 0.00 C ATOM 1056 O ASP A 71 31.909 2.271 -11.967 1.00 0.00 O ATOM 1057 CB ASP A 71 34.096 4.731 -11.547 1.00 0.00 C ATOM 1058 CG ASP A 71 35.497 4.229 -11.228 1.00 0.00 C ATOM 1059 OD1 ASP A 71 35.635 3.010 -10.991 1.00 0.00 O ATOM 1060 OD2 ASP A 71 36.427 5.074 -11.218 1.00 0.00 O ATOM 0 H ASP A 71 32.319 4.897 -14.170 1.00 0.00 H new ATOM 0 HA ASP A 71 34.074 3.111 -12.991 1.00 0.00 H new ATOM 0 HB2 ASP A 71 34.142 5.790 -11.803 1.00 0.00 H new ATOM 0 HB3 ASP A 71 33.471 4.645 -10.658 1.00 0.00 H new ATOM 1065 N GLY A 72 31.123 4.380 -12.142 1.00 0.00 N ATOM 1066 CA GLY A 72 29.792 4.083 -11.664 1.00 0.00 C ATOM 1067 C GLY A 72 29.503 4.743 -10.362 1.00 0.00 C ATOM 1068 O GLY A 72 28.752 5.716 -10.345 1.00 0.00 O ATOM 0 H GLY A 72 31.260 5.359 -12.394 1.00 0.00 H new ATOM 0 HA2 GLY A 72 29.061 4.408 -12.404 1.00 0.00 H new ATOM 0 HA3 GLY A 72 29.679 3.004 -11.556 1.00 0.00 H new ATOM 1072 N ASN A 73 30.126 4.248 -9.297 1.00 0.00 N ATOM 1073 CA ASN A 73 29.963 4.697 -7.937 1.00 0.00 C ATOM 1074 C ASN A 73 31.337 4.960 -7.370 1.00 0.00 C ATOM 1075 O ASN A 73 31.756 4.246 -6.455 1.00 0.00 O ATOM 1076 CB ASN A 73 29.251 3.637 -7.067 1.00 0.00 C ATOM 1077 CG ASN A 73 29.707 2.229 -7.372 1.00 0.00 C ATOM 1078 OD1 ASN A 73 29.558 1.707 -8.466 1.00 0.00 O ATOM 1079 ND2 ASN A 73 30.289 1.575 -6.398 1.00 0.00 N ATOM 0 H ASN A 73 30.793 3.480 -9.375 1.00 0.00 H new ATOM 0 HA ASN A 73 29.348 5.597 -7.932 1.00 0.00 H new ATOM 0 HB2 ASN A 73 29.435 3.854 -6.015 1.00 0.00 H new ATOM 0 HB3 ASN A 73 28.175 3.708 -7.224 1.00 0.00 H new ATOM 0 HD21 ASN A 73 30.622 0.623 -6.550 1.00 0.00 H new ATOM 0 HD22 ASN A 73 30.410 2.018 -5.487 1.00 0.00 H new ATOM 1086 N GLY A 74 32.043 5.941 -7.935 1.00 0.00 N ATOM 1087 CA GLY A 74 33.368 6.317 -7.473 1.00 0.00 C ATOM 1088 C GLY A 74 33.374 6.761 -6.020 1.00 0.00 C ATOM 1089 O GLY A 74 33.244 5.970 -5.090 1.00 0.00 O ATOM 0 H GLY A 74 31.707 6.493 -8.724 1.00 0.00 H new ATOM 0 HA2 GLY A 74 34.045 5.471 -7.594 1.00 0.00 H new ATOM 0 HA3 GLY A 74 33.752 7.124 -8.098 1.00 0.00 H new ATOM 1093 N LYS A 75 33.602 8.052 -5.766 1.00 0.00 N ATOM 1094 CA LYS A 75 33.574 8.577 -4.404 1.00 0.00 C ATOM 1095 C LYS A 75 32.185 8.438 -3.770 1.00 0.00 C ATOM 1096 O LYS A 75 31.788 7.409 -3.244 1.00 0.00 O ATOM 1097 CB LYS A 75 34.100 10.023 -4.422 1.00 0.00 C ATOM 1098 CG LYS A 75 35.629 10.051 -4.370 1.00 0.00 C ATOM 1099 CD LYS A 75 36.093 11.120 -3.378 1.00 0.00 C ATOM 1100 CE LYS A 75 37.624 11.158 -3.312 1.00 0.00 C ATOM 1101 NZ LYS A 75 38.137 12.476 -3.747 1.00 0.00 N ATOM 0 H LYS A 75 33.807 8.748 -6.483 1.00 0.00 H new ATOM 0 HA LYS A 75 34.231 7.987 -3.764 1.00 0.00 H new ATOM 0 HB2 LYS A 75 33.754 10.528 -5.324 1.00 0.00 H new ATOM 0 HB3 LYS A 75 33.694 10.572 -3.573 1.00 0.00 H new ATOM 0 HG2 LYS A 75 36.010 9.074 -4.071 1.00 0.00 H new ATOM 0 HG3 LYS A 75 36.032 10.261 -5.361 1.00 0.00 H new ATOM 0 HD2 LYS A 75 35.711 12.095 -3.679 1.00 0.00 H new ATOM 0 HD3 LYS A 75 35.685 10.910 -2.389 1.00 0.00 H new ATOM 0 HE2 LYS A 75 37.954 10.953 -2.294 1.00 0.00 H new ATOM 0 HE3 LYS A 75 38.039 10.374 -3.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 39.176 12.479 -3.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 37.840 12.658 -4.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 37.757 13.219 -3.126 1.00 0.00 H new ATOM 1115 N THR A 76 31.421 9.519 -3.798 1.00 0.00 N ATOM 1116 CA THR A 76 30.065 9.528 -3.269 1.00 0.00 C ATOM 1117 C THR A 76 29.054 9.739 -4.370 1.00 0.00 C ATOM 1118 O THR A 76 27.927 10.145 -4.094 1.00 0.00 O ATOM 1119 CB THR A 76 29.972 10.544 -2.122 1.00 0.00 C ATOM 1120 OG1 THR A 76 29.239 9.955 -1.067 1.00 0.00 O ATOM 1121 CG2 THR A 76 29.272 11.858 -2.463 1.00 0.00 C ATOM 0 H THR A 76 31.722 10.413 -4.187 1.00 0.00 H new ATOM 0 HA THR A 76 29.819 8.554 -2.846 1.00 0.00 H new ATOM 0 HB THR A 76 31.004 10.790 -1.870 1.00 0.00 H new ATOM 0 HG1 THR A 76 29.170 10.589 -0.323 1.00 0.00 H new ATOM 0 HG21 THR A 76 29.261 12.503 -1.584 1.00 0.00 H new ATOM 0 HG22 THR A 76 29.807 12.356 -3.272 1.00 0.00 H new ATOM 0 HG23 THR A 76 28.248 11.654 -2.777 1.00 0.00 H new ATOM 1129 N ASP A 77 29.474 9.555 -5.629 1.00 0.00 N ATOM 1130 CA ASP A 77 28.667 9.766 -6.804 1.00 0.00 C ATOM 1131 C ASP A 77 27.217 9.486 -6.496 1.00 0.00 C ATOM 1132 O ASP A 77 26.860 8.349 -6.253 1.00 0.00 O ATOM 1133 CB ASP A 77 29.111 8.837 -7.937 1.00 0.00 C ATOM 1134 CG ASP A 77 30.543 9.051 -8.427 1.00 0.00 C ATOM 1135 OD1 ASP A 77 31.256 9.910 -7.843 1.00 0.00 O ATOM 1136 OD2 ASP A 77 30.961 8.291 -9.328 1.00 0.00 O ATOM 0 H ASP A 77 30.420 9.244 -5.848 1.00 0.00 H new ATOM 0 HA ASP A 77 28.790 10.804 -7.113 1.00 0.00 H new ATOM 0 HB2 ASP A 77 29.009 7.805 -7.601 1.00 0.00 H new ATOM 0 HB3 ASP A 77 28.432 8.967 -8.780 1.00 0.00 H new ATOM 1141 N HIS A 78 26.380 10.513 -6.408 1.00 0.00 N ATOM 1142 CA HIS A 78 24.976 10.344 -6.053 1.00 0.00 C ATOM 1143 C HIS A 78 24.146 10.070 -7.286 1.00 0.00 C ATOM 1144 O HIS A 78 22.931 10.272 -7.279 1.00 0.00 O ATOM 1145 CB HIS A 78 24.476 11.549 -5.245 1.00 0.00 C ATOM 1146 CG HIS A 78 25.063 12.869 -5.692 1.00 0.00 C ATOM 1147 ND1 HIS A 78 26.338 13.314 -5.436 1.00 0.00 N flip ATOM 1148 CD2 HIS A 78 24.394 13.798 -6.433 1.00 0.00 C flip ATOM 1149 CE1 HIS A 78 26.415 14.577 -6.017 1.00 0.00 C flip ATOM 1150 NE2 HIS A 78 25.227 14.845 -6.587 1.00 0.00 N flip ATOM 0 H HIS A 78 26.653 11.481 -6.580 1.00 0.00 H new ATOM 0 HA HIS A 78 24.869 9.472 -5.408 1.00 0.00 H new ATOM 0 HB2 HIS A 78 23.390 11.600 -5.321 1.00 0.00 H new ATOM 0 HB3 HIS A 78 24.715 11.393 -4.193 1.00 0.00 H new ATOM 0 HD2 HIS A 78 23.390 13.711 -6.821 1.00 0.00 H new ATOM 0 HE1 HIS A 78 27.277 15.227 -6.011 1.00 0.00 H new ATOM 0 HE2 HIS A 78 24.991 15.714 -7.066 1.00 0.00 H new ATOM 1159 N TYR A 79 24.830 9.733 -8.385 1.00 0.00 N ATOM 1160 CA TYR A 79 24.257 9.372 -9.643 1.00 0.00 C ATOM 1161 C TYR A 79 23.019 8.509 -9.443 1.00 0.00 C ATOM 1162 O TYR A 79 22.987 7.697 -8.530 1.00 0.00 O ATOM 1163 CB TYR A 79 25.331 8.675 -10.470 1.00 0.00 C ATOM 1164 CG TYR A 79 25.673 7.276 -10.032 1.00 0.00 C ATOM 1165 CD1 TYR A 79 26.405 7.070 -8.874 1.00 0.00 C ATOM 1166 CD2 TYR A 79 25.221 6.168 -10.724 1.00 0.00 C ATOM 1167 CE1 TYR A 79 26.700 5.806 -8.357 1.00 0.00 C ATOM 1168 CE2 TYR A 79 25.588 4.897 -10.290 1.00 0.00 C ATOM 1169 CZ TYR A 79 26.310 4.712 -9.117 1.00 0.00 C ATOM 1170 OH TYR A 79 26.583 3.468 -8.710 1.00 0.00 O ATOM 0 H TYR A 79 25.850 9.710 -8.399 1.00 0.00 H new ATOM 0 HA TYR A 79 23.921 10.258 -10.182 1.00 0.00 H new ATOM 0 HB2 TYR A 79 25.003 8.643 -11.509 1.00 0.00 H new ATOM 0 HB3 TYR A 79 26.238 9.279 -10.441 1.00 0.00 H new ATOM 0 HD1 TYR A 79 26.768 7.936 -8.340 1.00 0.00 H new ATOM 0 HD2 TYR A 79 24.590 6.287 -11.592 1.00 0.00 H new ATOM 0 HE1 TYR A 79 27.207 5.686 -7.411 1.00 0.00 H new ATOM 0 HE2 TYR A 79 25.305 4.036 -10.878 1.00 0.00 H new ATOM 0 HH TYR A 79 26.187 3.319 -7.826 1.00 0.00 H new ATOM 1180 N LEU A 80 21.962 8.765 -10.198 1.00 0.00 N ATOM 1181 CA LEU A 80 20.774 7.943 -10.099 1.00 0.00 C ATOM 1182 C LEU A 80 21.018 6.574 -10.711 1.00 0.00 C ATOM 1183 O LEU A 80 21.927 6.438 -11.516 1.00 0.00 O ATOM 1184 CB LEU A 80 19.635 8.675 -10.792 1.00 0.00 C ATOM 1185 CG LEU A 80 18.858 9.583 -9.833 1.00 0.00 C ATOM 1186 CD1 LEU A 80 18.651 10.985 -10.411 1.00 0.00 C ATOM 1187 CD2 LEU A 80 17.508 8.965 -9.508 1.00 0.00 C ATOM 0 H LEU A 80 21.905 9.525 -10.876 1.00 0.00 H new ATOM 0 HA LEU A 80 20.512 7.776 -9.054 1.00 0.00 H new ATOM 0 HB2 LEU A 80 20.035 9.273 -11.611 1.00 0.00 H new ATOM 0 HB3 LEU A 80 18.953 7.947 -11.232 1.00 0.00 H new ATOM 0 HG LEU A 80 19.452 9.679 -8.924 1.00 0.00 H new ATOM 0 HD11 LEU A 80 18.096 11.594 -9.698 1.00 0.00 H new ATOM 0 HD12 LEU A 80 19.620 11.445 -10.605 1.00 0.00 H new ATOM 0 HD13 LEU A 80 18.090 10.915 -11.343 1.00 0.00 H new ATOM 0 HD21 LEU A 80 16.964 9.618 -8.826 1.00 0.00 H new ATOM 0 HD22 LEU A 80 16.934 8.840 -10.426 1.00 0.00 H new ATOM 0 HD23 LEU A 80 17.657 7.993 -9.038 1.00 0.00 H new ATOM 1199 N LEU A 81 20.247 5.563 -10.337 1.00 0.00 N ATOM 1200 CA LEU A 81 20.437 4.216 -10.835 1.00 0.00 C ATOM 1201 C LEU A 81 19.091 3.607 -11.100 1.00 0.00 C ATOM 1202 O LEU A 81 18.247 3.561 -10.206 1.00 0.00 O ATOM 1203 CB LEU A 81 21.273 3.341 -9.894 1.00 0.00 C ATOM 1204 CG LEU A 81 22.699 3.815 -9.716 1.00 0.00 C ATOM 1205 CD1 LEU A 81 22.833 4.832 -8.588 1.00 0.00 C ATOM 1206 CD2 LEU A 81 23.579 2.627 -9.395 1.00 0.00 C ATOM 0 H LEU A 81 19.473 5.658 -9.679 1.00 0.00 H new ATOM 0 HA LEU A 81 21.009 4.271 -11.761 1.00 0.00 H new ATOM 0 HB2 LEU A 81 20.788 3.308 -8.919 1.00 0.00 H new ATOM 0 HB3 LEU A 81 21.285 2.321 -10.278 1.00 0.00 H new ATOM 0 HG LEU A 81 23.003 4.296 -10.646 1.00 0.00 H new ATOM 0 HD11 LEU A 81 23.874 5.142 -8.499 1.00 0.00 H new ATOM 0 HD12 LEU A 81 22.213 5.701 -8.806 1.00 0.00 H new ATOM 0 HD13 LEU A 81 22.508 4.381 -7.651 1.00 0.00 H new ATOM 0 HD21 LEU A 81 24.608 2.961 -9.265 1.00 0.00 H new ATOM 0 HD22 LEU A 81 23.232 2.155 -8.476 1.00 0.00 H new ATOM 0 HD23 LEU A 81 23.531 1.907 -10.212 1.00 0.00 H new ATOM 1218 N GLU A 82 18.853 3.209 -12.348 1.00 0.00 N ATOM 1219 CA GLU A 82 17.607 2.587 -12.709 1.00 0.00 C ATOM 1220 C GLU A 82 17.687 1.071 -12.604 1.00 0.00 C ATOM 1221 O GLU A 82 18.734 0.443 -12.844 1.00 0.00 O ATOM 1222 CB GLU A 82 17.166 3.054 -14.103 1.00 0.00 C ATOM 1223 CG GLU A 82 17.947 2.494 -15.241 1.00 0.00 C ATOM 1224 CD GLU A 82 18.968 3.521 -15.731 1.00 0.00 C ATOM 1225 OE1 GLU A 82 18.576 4.327 -16.585 1.00 0.00 O ATOM 1226 OE2 GLU A 82 20.126 3.321 -15.376 1.00 0.00 O ATOM 0 H GLU A 82 19.515 3.312 -13.118 1.00 0.00 H new ATOM 0 HA GLU A 82 16.843 2.901 -11.997 1.00 0.00 H new ATOM 0 HB2 GLU A 82 16.117 2.792 -14.240 1.00 0.00 H new ATOM 0 HB3 GLU A 82 17.230 4.141 -14.141 1.00 0.00 H new ATOM 0 HG2 GLU A 82 18.457 1.583 -14.929 1.00 0.00 H new ATOM 0 HG3 GLU A 82 17.275 2.221 -16.054 1.00 0.00 H new ATOM 1233 N PHE A 83 16.533 0.449 -12.356 1.00 0.00 N ATOM 1234 CA PHE A 83 16.486 -0.989 -12.236 1.00 0.00 C ATOM 1235 C PHE A 83 15.192 -1.580 -12.783 1.00 0.00 C ATOM 1236 O PHE A 83 14.136 -1.029 -12.514 1.00 0.00 O ATOM 1237 CB PHE A 83 16.634 -1.382 -10.770 1.00 0.00 C ATOM 1238 CG PHE A 83 17.045 -2.799 -10.530 1.00 0.00 C ATOM 1239 CD1 PHE A 83 18.245 -3.260 -11.062 1.00 0.00 C ATOM 1240 CD2 PHE A 83 16.227 -3.673 -9.806 1.00 0.00 C ATOM 1241 CE1 PHE A 83 18.670 -4.569 -10.866 1.00 0.00 C ATOM 1242 CE2 PHE A 83 16.649 -4.990 -9.611 1.00 0.00 C ATOM 1243 CZ PHE A 83 17.876 -5.420 -10.114 1.00 0.00 C ATOM 0 H PHE A 83 15.636 0.920 -12.238 1.00 0.00 H new ATOM 0 HA PHE A 83 17.308 -1.390 -12.829 1.00 0.00 H new ATOM 0 HB2 PHE A 83 17.369 -0.724 -10.306 1.00 0.00 H new ATOM 0 HB3 PHE A 83 15.684 -1.205 -10.265 1.00 0.00 H new ATOM 0 HD1 PHE A 83 18.860 -2.586 -11.640 1.00 0.00 H new ATOM 0 HD2 PHE A 83 15.284 -3.334 -9.404 1.00 0.00 H new ATOM 0 HE1 PHE A 83 19.600 -4.916 -11.291 1.00 0.00 H new ATOM 0 HE2 PHE A 83 16.021 -5.680 -9.067 1.00 0.00 H new ATOM 0 HZ PHE A 83 18.211 -6.427 -9.915 1.00 0.00 H new ATOM 1253 N PRO A 84 15.243 -2.653 -13.581 1.00 0.00 N ATOM 1254 CA PRO A 84 14.062 -3.247 -14.183 1.00 0.00 C ATOM 1255 C PRO A 84 13.277 -4.018 -13.143 1.00 0.00 C ATOM 1256 O PRO A 84 13.742 -5.045 -12.645 1.00 0.00 O ATOM 1257 CB PRO A 84 14.567 -4.138 -15.314 1.00 0.00 C ATOM 1258 CG PRO A 84 16.046 -4.366 -15.021 1.00 0.00 C ATOM 1259 CD PRO A 84 16.444 -3.351 -13.966 1.00 0.00 C ATOM 0 HA PRO A 84 13.376 -2.497 -14.578 1.00 0.00 H new ATOM 0 HB2 PRO A 84 14.022 -5.082 -15.344 1.00 0.00 H new ATOM 0 HB3 PRO A 84 14.428 -3.659 -16.283 1.00 0.00 H new ATOM 0 HG2 PRO A 84 16.218 -5.382 -14.665 1.00 0.00 H new ATOM 0 HG3 PRO A 84 16.643 -4.240 -15.924 1.00 0.00 H new ATOM 0 HD2 PRO A 84 16.896 -3.845 -13.106 1.00 0.00 H new ATOM 0 HD3 PRO A 84 17.185 -2.656 -14.360 1.00 0.00 H new ATOM 1267 N THR A 85 12.082 -3.509 -12.839 1.00 0.00 N ATOM 1268 CA THR A 85 11.194 -4.096 -11.859 1.00 0.00 C ATOM 1269 C THR A 85 10.054 -4.815 -12.554 1.00 0.00 C ATOM 1270 O THR A 85 9.185 -4.202 -13.168 1.00 0.00 O ATOM 1271 CB THR A 85 10.695 -3.035 -10.870 1.00 0.00 C ATOM 1272 OG1 THR A 85 9.639 -3.596 -10.128 1.00 0.00 O ATOM 1273 CG2 THR A 85 10.145 -1.771 -11.547 1.00 0.00 C ATOM 0 H THR A 85 11.708 -2.667 -13.277 1.00 0.00 H new ATOM 0 HA THR A 85 11.744 -4.835 -11.277 1.00 0.00 H new ATOM 0 HB THR A 85 11.550 -2.743 -10.260 1.00 0.00 H new ATOM 0 HG1 THR A 85 9.102 -2.879 -9.730 1.00 0.00 H new ATOM 0 HG21 THR A 85 9.811 -1.066 -10.785 1.00 0.00 H new ATOM 0 HG22 THR A 85 10.928 -1.310 -12.149 1.00 0.00 H new ATOM 0 HG23 THR A 85 9.305 -2.038 -12.188 1.00 0.00 H new ATOM 1281 N PHE A 86 10.044 -6.136 -12.479 1.00 0.00 N ATOM 1282 CA PHE A 86 9.002 -6.940 -13.076 1.00 0.00 C ATOM 1283 C PHE A 86 7.760 -7.026 -12.192 1.00 0.00 C ATOM 1284 O PHE A 86 7.843 -6.848 -10.972 1.00 0.00 O ATOM 1285 CB PHE A 86 9.569 -8.343 -13.306 1.00 0.00 C ATOM 1286 CG PHE A 86 10.771 -8.366 -14.209 1.00 0.00 C ATOM 1287 CD1 PHE A 86 12.041 -8.056 -13.694 1.00 0.00 C ATOM 1288 CD2 PHE A 86 10.619 -8.673 -15.571 1.00 0.00 C ATOM 1289 CE1 PHE A 86 13.149 -8.037 -14.542 1.00 0.00 C ATOM 1290 CE2 PHE A 86 11.739 -8.690 -16.406 1.00 0.00 C ATOM 1291 CZ PHE A 86 13.005 -8.379 -15.883 1.00 0.00 C ATOM 0 H PHE A 86 10.763 -6.678 -12.000 1.00 0.00 H new ATOM 0 HA PHE A 86 8.693 -6.476 -14.013 1.00 0.00 H new ATOM 0 HB2 PHE A 86 9.839 -8.779 -12.344 1.00 0.00 H new ATOM 0 HB3 PHE A 86 8.791 -8.975 -13.735 1.00 0.00 H new ATOM 0 HD1 PHE A 86 12.159 -7.833 -12.644 1.00 0.00 H new ATOM 0 HD2 PHE A 86 9.641 -8.895 -15.971 1.00 0.00 H new ATOM 0 HE1 PHE A 86 14.119 -7.757 -14.157 1.00 0.00 H new ATOM 0 HE2 PHE A 86 11.632 -8.942 -17.451 1.00 0.00 H new ATOM 0 HZ PHE A 86 13.872 -8.406 -16.526 1.00 0.00 H new ATOM 1301 N PRO A 87 6.596 -7.335 -12.790 1.00 0.00 N ATOM 1302 CA PRO A 87 5.346 -7.456 -12.055 1.00 0.00 C ATOM 1303 C PRO A 87 5.255 -8.746 -11.293 1.00 0.00 C ATOM 1304 O PRO A 87 4.845 -8.703 -10.128 1.00 0.00 O ATOM 1305 CB PRO A 87 4.243 -7.443 -13.105 1.00 0.00 C ATOM 1306 CG PRO A 87 4.909 -7.738 -14.440 1.00 0.00 C ATOM 1307 CD PRO A 87 6.407 -7.604 -14.211 1.00 0.00 C ATOM 0 HA PRO A 87 5.268 -6.646 -11.330 1.00 0.00 H new ATOM 0 HB2 PRO A 87 3.483 -8.191 -12.878 1.00 0.00 H new ATOM 0 HB3 PRO A 87 3.741 -6.476 -13.128 1.00 0.00 H new ATOM 0 HG2 PRO A 87 4.657 -8.740 -14.787 1.00 0.00 H new ATOM 0 HG3 PRO A 87 4.569 -7.041 -15.206 1.00 0.00 H new ATOM 0 HD2 PRO A 87 6.926 -8.517 -14.503 1.00 0.00 H new ATOM 0 HD3 PRO A 87 6.819 -6.796 -14.815 1.00 0.00 H new ATOM 1315 N ASP A 88 5.676 -9.875 -11.908 1.00 0.00 N ATOM 1316 CA ASP A 88 5.714 -11.188 -11.273 1.00 0.00 C ATOM 1317 C ASP A 88 6.300 -11.095 -9.869 1.00 0.00 C ATOM 1318 O ASP A 88 5.940 -11.842 -8.957 1.00 0.00 O ATOM 1319 CB ASP A 88 6.585 -12.167 -12.068 1.00 0.00 C ATOM 1320 CG ASP A 88 6.507 -12.017 -13.583 1.00 0.00 C ATOM 1321 OD1 ASP A 88 7.259 -11.148 -14.079 1.00 0.00 O ATOM 1322 OD2 ASP A 88 5.812 -12.830 -14.214 1.00 0.00 O ATOM 0 H ASP A 88 6.001 -9.886 -12.875 1.00 0.00 H new ATOM 0 HA ASP A 88 4.685 -11.546 -11.237 1.00 0.00 H new ATOM 0 HB2 ASP A 88 7.622 -12.040 -11.759 1.00 0.00 H new ATOM 0 HB3 ASP A 88 6.296 -13.184 -11.804 1.00 0.00 H new ATOM 1327 N GLY A 89 7.216 -10.133 -9.679 1.00 0.00 N ATOM 1328 CA GLY A 89 7.832 -9.861 -8.413 1.00 0.00 C ATOM 1329 C GLY A 89 9.018 -10.763 -8.203 1.00 0.00 C ATOM 1330 O GLY A 89 9.571 -10.786 -7.105 1.00 0.00 O ATOM 0 H GLY A 89 7.541 -9.522 -10.428 1.00 0.00 H new ATOM 0 HA2 GLY A 89 8.148 -8.819 -8.371 1.00 0.00 H new ATOM 0 HA3 GLY A 89 7.109 -10.007 -7.611 1.00 0.00 H new ATOM 1334 N HIS A 90 9.403 -11.502 -9.253 1.00 0.00 N ATOM 1335 CA HIS A 90 10.535 -12.390 -9.222 1.00 0.00 C ATOM 1336 C HIS A 90 11.797 -11.549 -9.255 1.00 0.00 C ATOM 1337 O HIS A 90 11.930 -10.638 -10.084 1.00 0.00 O ATOM 1338 CB HIS A 90 10.420 -13.445 -10.332 1.00 0.00 C ATOM 1339 CG HIS A 90 10.631 -12.955 -11.764 1.00 0.00 C ATOM 1340 ND1 HIS A 90 9.685 -12.997 -12.756 1.00 0.00 N ATOM 1341 CD2 HIS A 90 11.776 -12.408 -12.290 1.00 0.00 C ATOM 1342 CE1 HIS A 90 10.215 -12.438 -13.861 1.00 0.00 C ATOM 1343 NE2 HIS A 90 11.481 -12.058 -13.607 1.00 0.00 N ATOM 0 H HIS A 90 8.920 -11.487 -10.151 1.00 0.00 H new ATOM 0 HA HIS A 90 10.571 -12.972 -8.301 1.00 0.00 H new ATOM 0 HB2 HIS A 90 11.146 -14.232 -10.131 1.00 0.00 H new ATOM 0 HB3 HIS A 90 9.431 -13.900 -10.269 1.00 0.00 H new ATOM 0 HD2 HIS A 90 12.720 -12.275 -11.783 1.00 0.00 H new ATOM 0 HE1 HIS A 90 9.704 -12.314 -14.804 1.00 0.00 H new ATOM 0 HE2 HIS A 90 12.112 -11.596 -14.262 1.00 0.00 H new ATOM 1352 N ASP A 91 12.714 -11.784 -8.323 1.00 0.00 N ATOM 1353 CA ASP A 91 14.006 -11.170 -8.311 1.00 0.00 C ATOM 1354 C ASP A 91 14.766 -11.553 -9.562 1.00 0.00 C ATOM 1355 O ASP A 91 15.359 -12.622 -9.638 1.00 0.00 O ATOM 1356 CB ASP A 91 14.775 -11.566 -7.054 1.00 0.00 C ATOM 1357 CG ASP A 91 14.465 -12.965 -6.523 1.00 0.00 C ATOM 1358 OD1 ASP A 91 14.990 -13.955 -7.058 1.00 0.00 O ATOM 1359 OD2 ASP A 91 13.604 -12.982 -5.622 1.00 0.00 O ATOM 0 H ASP A 91 12.561 -12.424 -7.544 1.00 0.00 H new ATOM 0 HA ASP A 91 13.887 -10.087 -8.298 1.00 0.00 H new ATOM 0 HB2 ASP A 91 15.843 -11.501 -7.264 1.00 0.00 H new ATOM 0 HB3 ASP A 91 14.559 -10.840 -6.270 1.00 0.00 H new ATOM 1364 N TYR A 92 14.678 -10.723 -10.608 1.00 0.00 N ATOM 1365 CA TYR A 92 15.358 -10.962 -11.857 1.00 0.00 C ATOM 1366 C TYR A 92 16.755 -11.517 -11.625 1.00 0.00 C ATOM 1367 O TYR A 92 17.443 -11.163 -10.679 1.00 0.00 O ATOM 1368 CB TYR A 92 15.405 -9.631 -12.596 1.00 0.00 C ATOM 1369 CG TYR A 92 16.235 -9.621 -13.854 1.00 0.00 C ATOM 1370 CD1 TYR A 92 16.129 -10.671 -14.775 1.00 0.00 C ATOM 1371 CD2 TYR A 92 17.139 -8.576 -14.099 1.00 0.00 C ATOM 1372 CE1 TYR A 92 16.948 -10.660 -15.916 1.00 0.00 C ATOM 1373 CE2 TYR A 92 17.960 -8.580 -15.241 1.00 0.00 C ATOM 1374 CZ TYR A 92 17.851 -9.621 -16.163 1.00 0.00 C ATOM 1375 OH TYR A 92 18.567 -9.601 -17.320 1.00 0.00 O ATOM 0 H TYR A 92 14.126 -9.865 -10.597 1.00 0.00 H new ATOM 0 HA TYR A 92 14.829 -11.709 -12.448 1.00 0.00 H new ATOM 0 HB2 TYR A 92 14.386 -9.340 -12.851 1.00 0.00 H new ATOM 0 HB3 TYR A 92 15.794 -8.871 -11.918 1.00 0.00 H new ATOM 0 HD1 TYR A 92 15.429 -11.476 -14.610 1.00 0.00 H new ATOM 0 HD2 TYR A 92 17.205 -7.756 -13.400 1.00 0.00 H new ATOM 0 HE1 TYR A 92 16.879 -11.475 -16.621 1.00 0.00 H new ATOM 0 HE2 TYR A 92 18.670 -7.782 -15.403 1.00 0.00 H new ATOM 0 HH TYR A 92 18.005 -9.916 -18.058 1.00 0.00 H new ATOM 1385 N LYS A 93 17.220 -12.407 -12.484 1.00 0.00 N ATOM 1386 CA LYS A 93 18.563 -12.926 -12.371 1.00 0.00 C ATOM 1387 C LYS A 93 19.562 -11.903 -12.894 1.00 0.00 C ATOM 1388 O LYS A 93 20.329 -12.184 -13.813 1.00 0.00 O ATOM 1389 CB LYS A 93 18.637 -14.274 -13.069 1.00 0.00 C ATOM 1390 CG LYS A 93 17.976 -14.233 -14.458 1.00 0.00 C ATOM 1391 CD LYS A 93 18.471 -15.374 -15.341 1.00 0.00 C ATOM 1392 CE LYS A 93 18.396 -16.718 -14.615 1.00 0.00 C ATOM 1393 NZ LYS A 93 19.729 -17.101 -14.088 1.00 0.00 N ATOM 0 H LYS A 93 16.684 -12.783 -13.266 1.00 0.00 H new ATOM 0 HA LYS A 93 18.829 -13.097 -11.328 1.00 0.00 H new ATOM 0 HB2 LYS A 93 19.680 -14.574 -13.171 1.00 0.00 H new ATOM 0 HB3 LYS A 93 18.147 -15.029 -12.455 1.00 0.00 H new ATOM 0 HG2 LYS A 93 16.893 -14.297 -14.350 1.00 0.00 H new ATOM 0 HG3 LYS A 93 18.192 -13.279 -14.938 1.00 0.00 H new ATOM 0 HD2 LYS A 93 17.873 -15.417 -16.251 1.00 0.00 H new ATOM 0 HD3 LYS A 93 19.500 -15.180 -15.645 1.00 0.00 H new ATOM 0 HE2 LYS A 93 17.679 -16.656 -13.796 1.00 0.00 H new ATOM 0 HE3 LYS A 93 18.034 -17.487 -15.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 19.803 -18.138 -14.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 20.471 -16.723 -14.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 19.849 -16.712 -13.131 1.00 0.00 H new ATOM 1407 N PHE A 94 19.552 -10.706 -12.322 1.00 0.00 N ATOM 1408 CA PHE A 94 20.485 -9.656 -12.633 1.00 0.00 C ATOM 1409 C PHE A 94 21.876 -9.954 -12.111 1.00 0.00 C ATOM 1410 O PHE A 94 22.816 -9.270 -12.501 1.00 0.00 O ATOM 1411 CB PHE A 94 19.981 -8.342 -12.035 1.00 0.00 C ATOM 1412 CG PHE A 94 19.637 -8.427 -10.564 1.00 0.00 C ATOM 1413 CD1 PHE A 94 20.620 -8.241 -9.588 1.00 0.00 C ATOM 1414 CD2 PHE A 94 18.324 -8.698 -10.165 1.00 0.00 C ATOM 1415 CE1 PHE A 94 20.283 -8.342 -8.232 1.00 0.00 C ATOM 1416 CE2 PHE A 94 17.979 -8.826 -8.815 1.00 0.00 C ATOM 1417 CZ PHE A 94 18.967 -8.643 -7.841 1.00 0.00 C ATOM 0 H PHE A 94 18.871 -10.442 -11.610 1.00 0.00 H new ATOM 0 HA PHE A 94 20.554 -9.579 -13.718 1.00 0.00 H new ATOM 0 HB2 PHE A 94 20.743 -7.575 -12.176 1.00 0.00 H new ATOM 0 HB3 PHE A 94 19.098 -8.019 -12.586 1.00 0.00 H new ATOM 0 HD1 PHE A 94 21.636 -8.020 -9.878 1.00 0.00 H new ATOM 0 HD2 PHE A 94 17.558 -8.811 -10.917 1.00 0.00 H new ATOM 0 HE1 PHE A 94 21.042 -8.187 -7.480 1.00 0.00 H new ATOM 0 HE2 PHE A 94 16.965 -9.063 -8.529 1.00 0.00 H new ATOM 0 HZ PHE A 94 18.719 -8.733 -6.794 1.00 0.00 H new ATOM 1427 N ASP A 95 22.027 -10.992 -11.287 1.00 0.00 N ATOM 1428 CA ASP A 95 23.306 -11.379 -10.720 1.00 0.00 C ATOM 1429 C ASP A 95 24.014 -12.366 -11.632 1.00 0.00 C ATOM 1430 O ASP A 95 25.232 -12.364 -11.809 1.00 0.00 O ATOM 1431 CB ASP A 95 23.059 -12.055 -9.368 1.00 0.00 C ATOM 1432 CG ASP A 95 24.239 -11.909 -8.413 1.00 0.00 C ATOM 1433 OD1 ASP A 95 25.070 -10.992 -8.612 1.00 0.00 O ATOM 1434 OD2 ASP A 95 24.268 -12.724 -7.473 1.00 0.00 O ATOM 0 H ASP A 95 21.253 -11.589 -10.996 1.00 0.00 H new ATOM 0 HA ASP A 95 23.927 -10.491 -10.603 1.00 0.00 H new ATOM 0 HB2 ASP A 95 22.169 -11.625 -8.908 1.00 0.00 H new ATOM 0 HB3 ASP A 95 22.855 -13.114 -9.528 1.00 0.00 H new ATOM 1439 N SER A 96 23.239 -13.254 -12.269 1.00 0.00 N ATOM 1440 CA SER A 96 23.769 -14.243 -13.173 1.00 0.00 C ATOM 1441 C SER A 96 23.930 -13.632 -14.548 1.00 0.00 C ATOM 1442 O SER A 96 22.951 -13.343 -15.235 1.00 0.00 O ATOM 1443 CB SER A 96 22.870 -15.477 -13.250 1.00 0.00 C ATOM 1444 OG SER A 96 22.451 -15.899 -11.968 1.00 0.00 O ATOM 0 H SER A 96 22.226 -13.294 -12.161 1.00 0.00 H new ATOM 0 HA SER A 96 24.739 -14.566 -12.794 1.00 0.00 H new ATOM 0 HB2 SER A 96 21.997 -15.253 -13.863 1.00 0.00 H new ATOM 0 HB3 SER A 96 23.406 -16.288 -13.743 1.00 0.00 H new ATOM 0 HG SER A 96 21.877 -16.688 -12.055 1.00 0.00 H new ATOM 1450 N LYS A 97 25.183 -13.453 -14.978 1.00 0.00 N ATOM 1451 CA LYS A 97 25.468 -12.908 -16.298 1.00 0.00 C ATOM 1452 C LYS A 97 24.861 -13.761 -17.384 1.00 0.00 C ATOM 1453 O LYS A 97 24.250 -13.252 -18.319 1.00 0.00 O ATOM 1454 CB LYS A 97 26.981 -12.687 -16.466 1.00 0.00 C ATOM 1455 CG LYS A 97 27.707 -13.925 -17.004 1.00 0.00 C ATOM 1456 CD LYS A 97 29.178 -13.679 -17.247 1.00 0.00 C ATOM 1457 CE LYS A 97 29.945 -13.817 -15.934 1.00 0.00 C ATOM 1458 NZ LYS A 97 31.321 -13.315 -16.104 1.00 0.00 N ATOM 0 H LYS A 97 26.012 -13.679 -14.428 1.00 0.00 H new ATOM 0 HA LYS A 97 24.995 -11.931 -16.393 1.00 0.00 H new ATOM 0 HB2 LYS A 97 27.148 -11.850 -17.144 1.00 0.00 H new ATOM 0 HB3 LYS A 97 27.412 -12.408 -15.504 1.00 0.00 H new ATOM 0 HG2 LYS A 97 27.592 -14.745 -16.295 1.00 0.00 H new ATOM 0 HG3 LYS A 97 27.237 -14.241 -17.935 1.00 0.00 H new ATOM 0 HD2 LYS A 97 29.560 -14.391 -17.979 1.00 0.00 H new ATOM 0 HD3 LYS A 97 29.326 -12.683 -17.663 1.00 0.00 H new ATOM 0 HE2 LYS A 97 29.439 -13.259 -15.146 1.00 0.00 H new ATOM 0 HE3 LYS A 97 29.965 -14.861 -15.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 31.839 -13.411 -15.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 31.803 -13.866 -16.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 31.293 -12.313 -16.382 1.00 0.00 H new ATOM 1472 N LYS A 98 25.085 -15.076 -17.276 1.00 0.00 N ATOM 1473 CA LYS A 98 24.640 -16.041 -18.236 1.00 0.00 C ATOM 1474 C LYS A 98 24.209 -17.331 -17.504 1.00 0.00 C ATOM 1475 O LYS A 98 24.971 -17.872 -16.704 1.00 0.00 O ATOM 1476 CB LYS A 98 25.649 -16.235 -19.378 1.00 0.00 C ATOM 1477 CG LYS A 98 26.902 -16.988 -18.919 1.00 0.00 C ATOM 1478 CD LYS A 98 26.852 -18.460 -19.363 1.00 0.00 C ATOM 1479 CE LYS A 98 27.300 -19.398 -18.235 1.00 0.00 C ATOM 1480 NZ LYS A 98 26.166 -20.210 -17.732 1.00 0.00 N ATOM 0 H LYS A 98 25.594 -15.488 -16.494 1.00 0.00 H new ATOM 0 HA LYS A 98 23.754 -15.671 -18.752 1.00 0.00 H new ATOM 0 HB2 LYS A 98 25.174 -16.784 -20.191 1.00 0.00 H new ATOM 0 HB3 LYS A 98 25.937 -15.262 -19.776 1.00 0.00 H new ATOM 0 HG2 LYS A 98 27.790 -16.510 -19.332 1.00 0.00 H new ATOM 0 HG3 LYS A 98 26.986 -16.934 -17.834 1.00 0.00 H new ATOM 0 HD2 LYS A 98 25.838 -18.715 -19.670 1.00 0.00 H new ATOM 0 HD3 LYS A 98 27.493 -18.602 -20.233 1.00 0.00 H new ATOM 0 HE2 LYS A 98 28.090 -20.056 -18.598 1.00 0.00 H new ATOM 0 HE3 LYS A 98 27.723 -18.813 -17.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 26.516 -20.905 -17.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 25.470 -19.588 -17.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 25.716 -20.707 -18.527 1.00 0.00 H new ATOM 1494 N PRO A 99 23.022 -17.848 -17.819 1.00 0.00 N ATOM 1495 CA PRO A 99 22.089 -17.169 -18.706 1.00 0.00 C ATOM 1496 C PRO A 99 21.500 -15.921 -18.034 1.00 0.00 C ATOM 1497 O PRO A 99 21.787 -15.638 -16.862 1.00 0.00 O ATOM 1498 CB PRO A 99 21.035 -18.193 -19.073 1.00 0.00 C ATOM 1499 CG PRO A 99 21.127 -19.266 -17.987 1.00 0.00 C ATOM 1500 CD PRO A 99 22.437 -19.043 -17.231 1.00 0.00 C ATOM 0 HA PRO A 99 22.580 -16.800 -19.607 1.00 0.00 H new ATOM 0 HB2 PRO A 99 20.042 -17.744 -19.101 1.00 0.00 H new ATOM 0 HB3 PRO A 99 21.222 -18.615 -20.061 1.00 0.00 H new ATOM 0 HG2 PRO A 99 20.277 -19.199 -17.309 1.00 0.00 H new ATOM 0 HG3 PRO A 99 21.104 -20.262 -18.429 1.00 0.00 H new ATOM 0 HD2 PRO A 99 22.257 -18.909 -16.164 1.00 0.00 H new ATOM 0 HD3 PRO A 99 23.103 -19.900 -17.337 1.00 0.00 H new ATOM 1508 N LYS A 100 20.706 -15.173 -18.792 1.00 0.00 N ATOM 1509 CA LYS A 100 20.039 -13.980 -18.304 1.00 0.00 C ATOM 1510 C LYS A 100 18.619 -13.933 -18.827 1.00 0.00 C ATOM 1511 O LYS A 100 18.365 -14.379 -19.938 1.00 0.00 O ATOM 1512 CB LYS A 100 20.878 -12.750 -18.654 1.00 0.00 C ATOM 1513 CG LYS A 100 20.672 -12.242 -20.091 1.00 0.00 C ATOM 1514 CD LYS A 100 19.985 -10.880 -20.077 1.00 0.00 C ATOM 1515 CE LYS A 100 21.005 -9.761 -19.912 1.00 0.00 C ATOM 1516 NZ LYS A 100 21.840 -9.663 -21.126 1.00 0.00 N ATOM 0 H LYS A 100 20.508 -15.383 -19.770 1.00 0.00 H new ATOM 0 HA LYS A 100 19.955 -13.996 -17.217 1.00 0.00 H new ATOM 0 HB2 LYS A 100 20.636 -11.947 -17.957 1.00 0.00 H new ATOM 0 HB3 LYS A 100 21.932 -12.989 -18.511 1.00 0.00 H new ATOM 0 HG2 LYS A 100 21.634 -12.167 -20.599 1.00 0.00 H new ATOM 0 HG3 LYS A 100 20.069 -12.955 -20.653 1.00 0.00 H new ATOM 0 HD2 LYS A 100 19.430 -10.738 -21.004 1.00 0.00 H new ATOM 0 HD3 LYS A 100 19.261 -10.841 -19.263 1.00 0.00 H new ATOM 0 HE2 LYS A 100 20.495 -8.815 -19.733 1.00 0.00 H new ATOM 0 HE3 LYS A 100 21.633 -9.954 -19.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 22.177 -8.686 -21.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 22.655 -10.303 -21.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 21.276 -9.931 -21.958 1.00 0.00 H new ATOM 1530 N GLU A 101 17.718 -13.382 -18.031 1.00 0.00 N ATOM 1531 CA GLU A 101 16.336 -13.235 -18.469 1.00 0.00 C ATOM 1532 C GLU A 101 16.108 -11.931 -19.219 1.00 0.00 C ATOM 1533 O GLU A 101 16.974 -11.044 -19.257 1.00 0.00 O ATOM 1534 CB GLU A 101 15.394 -13.370 -17.259 1.00 0.00 C ATOM 1535 CG GLU A 101 14.173 -14.228 -17.565 1.00 0.00 C ATOM 1536 CD GLU A 101 14.593 -15.623 -18.041 1.00 0.00 C ATOM 1537 OE1 GLU A 101 14.935 -16.453 -17.168 1.00 0.00 O ATOM 1538 OE2 GLU A 101 14.663 -15.792 -19.275 1.00 0.00 O ATOM 0 H GLU A 101 17.912 -13.033 -17.092 1.00 0.00 H new ATOM 0 HA GLU A 101 16.113 -14.033 -19.178 1.00 0.00 H new ATOM 0 HB2 GLU A 101 15.941 -13.807 -16.423 1.00 0.00 H new ATOM 0 HB3 GLU A 101 15.068 -12.379 -16.944 1.00 0.00 H new ATOM 0 HG2 GLU A 101 13.551 -14.315 -16.674 1.00 0.00 H new ATOM 0 HG3 GLU A 101 13.566 -13.745 -18.331 1.00 0.00 H new ATOM 1545 N ASN A 102 14.911 -11.770 -19.775 1.00 0.00 N ATOM 1546 CA ASN A 102 14.571 -10.547 -20.459 1.00 0.00 C ATOM 1547 C ASN A 102 14.360 -9.406 -19.473 1.00 0.00 C ATOM 1548 O ASN A 102 13.815 -9.659 -18.405 1.00 0.00 O ATOM 1549 CB ASN A 102 13.308 -10.755 -21.293 1.00 0.00 C ATOM 1550 CG ASN A 102 13.607 -10.723 -22.771 1.00 0.00 C ATOM 1551 OD1 ASN A 102 14.704 -10.968 -23.244 1.00 0.00 O ATOM 1552 ND2 ASN A 102 12.622 -10.350 -23.547 1.00 0.00 N ATOM 0 H ASN A 102 14.171 -12.472 -19.761 1.00 0.00 H new ATOM 0 HA ASN A 102 15.400 -10.280 -21.114 1.00 0.00 H new ATOM 0 HB2 ASN A 102 12.854 -11.711 -21.034 1.00 0.00 H new ATOM 0 HB3 ASN A 102 12.580 -9.980 -21.052 1.00 0.00 H new ATOM 0 HD21 ASN A 102 12.770 -10.263 -24.552 1.00 0.00 H new ATOM 0 HD22 ASN A 102 11.706 -10.146 -23.147 1.00 0.00 H new ATOM 1559 N PRO A 103 14.774 -8.172 -19.822 1.00 0.00 N ATOM 1560 CA PRO A 103 14.556 -6.992 -18.995 1.00 0.00 C ATOM 1561 C PRO A 103 13.090 -6.544 -19.020 1.00 0.00 C ATOM 1562 O PRO A 103 12.182 -7.277 -19.423 1.00 0.00 O ATOM 1563 CB PRO A 103 15.529 -5.937 -19.546 1.00 0.00 C ATOM 1564 CG PRO A 103 15.883 -6.388 -20.961 1.00 0.00 C ATOM 1565 CD PRO A 103 15.427 -7.834 -21.078 1.00 0.00 C ATOM 0 HA PRO A 103 14.751 -7.181 -17.939 1.00 0.00 H new ATOM 0 HB2 PRO A 103 15.069 -4.949 -19.555 1.00 0.00 H new ATOM 0 HB3 PRO A 103 16.421 -5.867 -18.924 1.00 0.00 H new ATOM 0 HG2 PRO A 103 15.387 -5.763 -21.703 1.00 0.00 H new ATOM 0 HG3 PRO A 103 16.955 -6.303 -21.139 1.00 0.00 H new ATOM 0 HD2 PRO A 103 14.740 -7.956 -21.916 1.00 0.00 H new ATOM 0 HD3 PRO A 103 16.275 -8.493 -21.262 1.00 0.00 H new ATOM 1573 N GLY A 104 12.845 -5.316 -18.563 1.00 0.00 N ATOM 1574 CA GLY A 104 11.528 -4.733 -18.574 1.00 0.00 C ATOM 1575 C GLY A 104 11.549 -3.254 -18.936 1.00 0.00 C ATOM 1576 O GLY A 104 12.612 -2.628 -18.915 1.00 0.00 O ATOM 0 H GLY A 104 13.565 -4.706 -18.176 1.00 0.00 H new ATOM 0 HA2 GLY A 104 10.902 -5.270 -19.287 1.00 0.00 H new ATOM 0 HA3 GLY A 104 11.071 -4.857 -17.592 1.00 0.00 H new ATOM 1580 N PRO A 105 10.390 -2.685 -19.287 1.00 0.00 N ATOM 1581 CA PRO A 105 10.280 -1.280 -19.635 1.00 0.00 C ATOM 1582 C PRO A 105 10.343 -0.419 -18.390 1.00 0.00 C ATOM 1583 O PRO A 105 11.218 0.449 -18.312 1.00 0.00 O ATOM 1584 CB PRO A 105 8.939 -1.138 -20.359 1.00 0.00 C ATOM 1585 CG PRO A 105 8.135 -2.388 -19.994 1.00 0.00 C ATOM 1586 CD PRO A 105 9.112 -3.373 -19.365 1.00 0.00 C ATOM 0 HA PRO A 105 11.100 -0.948 -20.271 1.00 0.00 H new ATOM 0 HB2 PRO A 105 8.419 -0.233 -20.045 1.00 0.00 H new ATOM 0 HB3 PRO A 105 9.082 -1.066 -21.437 1.00 0.00 H new ATOM 0 HG2 PRO A 105 7.333 -2.142 -19.298 1.00 0.00 H new ATOM 0 HG3 PRO A 105 7.668 -2.819 -20.879 1.00 0.00 H new ATOM 0 HD2 PRO A 105 8.773 -3.678 -18.375 1.00 0.00 H new ATOM 0 HD3 PRO A 105 9.194 -4.278 -19.967 1.00 0.00 H new ATOM 1594 N ALA A 106 9.401 -0.609 -17.459 1.00 0.00 N ATOM 1595 CA ALA A 106 9.394 0.130 -16.225 1.00 0.00 C ATOM 1596 C ALA A 106 10.614 -0.163 -15.397 1.00 0.00 C ATOM 1597 O ALA A 106 11.052 -1.317 -15.306 1.00 0.00 O ATOM 1598 CB ALA A 106 8.158 -0.222 -15.453 1.00 0.00 C ATOM 0 H ALA A 106 8.636 -1.277 -17.553 1.00 0.00 H new ATOM 0 HA ALA A 106 9.403 1.194 -16.459 1.00 0.00 H new ATOM 0 HB1 ALA A 106 8.144 0.334 -14.515 1.00 0.00 H new ATOM 0 HB2 ALA A 106 7.277 0.035 -16.040 1.00 0.00 H new ATOM 0 HB3 ALA A 106 8.154 -1.291 -15.241 1.00 0.00 H new ATOM 1604 N ARG A 107 11.154 0.889 -14.781 1.00 0.00 N ATOM 1605 CA ARG A 107 12.332 0.794 -13.955 1.00 0.00 C ATOM 1606 C ARG A 107 12.243 1.716 -12.766 1.00 0.00 C ATOM 1607 O ARG A 107 11.698 2.812 -12.885 1.00 0.00 O ATOM 1608 CB ARG A 107 13.589 1.118 -14.773 1.00 0.00 C ATOM 1609 CG ARG A 107 13.905 0.042 -15.816 1.00 0.00 C ATOM 1610 CD ARG A 107 15.378 -0.373 -15.811 1.00 0.00 C ATOM 1611 NE ARG A 107 16.014 -0.053 -17.081 1.00 0.00 N ATOM 1612 CZ ARG A 107 15.791 -0.697 -18.213 1.00 0.00 C ATOM 1613 NH1 ARG A 107 15.039 -1.754 -18.256 1.00 0.00 N ATOM 1614 NH2 ARG A 107 16.332 -0.284 -19.323 1.00 0.00 N ATOM 0 H ARG A 107 10.774 1.833 -14.849 1.00 0.00 H new ATOM 0 HA ARG A 107 12.397 -0.231 -13.589 1.00 0.00 H new ATOM 0 HB2 ARG A 107 13.455 2.077 -15.274 1.00 0.00 H new ATOM 0 HB3 ARG A 107 14.439 1.227 -14.099 1.00 0.00 H new ATOM 0 HG2 ARG A 107 13.285 -0.834 -15.627 1.00 0.00 H new ATOM 0 HG3 ARG A 107 13.640 0.413 -16.806 1.00 0.00 H new ATOM 0 HD2 ARG A 107 15.900 0.135 -15.000 1.00 0.00 H new ATOM 0 HD3 ARG A 107 15.457 -1.443 -15.620 1.00 0.00 H new ATOM 0 HE ARG A 107 16.677 0.722 -17.098 1.00 0.00 H new ATOM 0 HH11 ARG A 107 14.604 -2.106 -17.403 1.00 0.00 H new ATOM 0 HH12 ARG A 107 14.883 -2.233 -19.143 1.00 0.00 H new ATOM 0 HH21 ARG A 107 16.932 0.541 -19.322 1.00 0.00 H new ATOM 0 HH22 ARG A 107 16.156 -0.785 -20.194 1.00 0.00 H new ATOM 1628 N VAL A 108 12.763 1.266 -11.629 1.00 0.00 N ATOM 1629 CA VAL A 108 12.779 2.043 -10.404 1.00 0.00 C ATOM 1630 C VAL A 108 13.958 2.994 -10.395 1.00 0.00 C ATOM 1631 O VAL A 108 15.101 2.585 -10.594 1.00 0.00 O ATOM 1632 CB VAL A 108 12.796 1.120 -9.182 1.00 0.00 C ATOM 1633 CG1 VAL A 108 13.968 0.135 -9.210 1.00 0.00 C ATOM 1634 CG2 VAL A 108 12.786 1.939 -7.888 1.00 0.00 C ATOM 0 H VAL A 108 13.188 0.343 -11.535 1.00 0.00 H new ATOM 0 HA VAL A 108 11.868 2.640 -10.357 1.00 0.00 H new ATOM 0 HB VAL A 108 11.887 0.519 -9.217 1.00 0.00 H new ATOM 0 HG11 VAL A 108 13.934 -0.496 -8.322 1.00 0.00 H new ATOM 0 HG12 VAL A 108 13.898 -0.489 -10.101 1.00 0.00 H new ATOM 0 HG13 VAL A 108 14.907 0.688 -9.227 1.00 0.00 H new ATOM 0 HG21 VAL A 108 12.798 1.266 -7.031 1.00 0.00 H new ATOM 0 HG22 VAL A 108 13.666 2.582 -7.857 1.00 0.00 H new ATOM 0 HG23 VAL A 108 11.887 2.554 -7.853 1.00 0.00 H new ATOM 1644 N ILE A 109 13.687 4.281 -10.223 1.00 0.00 N ATOM 1645 CA ILE A 109 14.711 5.303 -10.209 1.00 0.00 C ATOM 1646 C ILE A 109 14.934 5.793 -8.807 1.00 0.00 C ATOM 1647 O ILE A 109 13.982 5.929 -8.032 1.00 0.00 O ATOM 1648 CB ILE A 109 14.311 6.415 -11.179 1.00 0.00 C ATOM 1649 CG1 ILE A 109 14.187 5.912 -12.607 1.00 0.00 C ATOM 1650 CG2 ILE A 109 15.320 7.528 -11.126 1.00 0.00 C ATOM 1651 CD1 ILE A 109 15.216 4.886 -12.984 1.00 0.00 C ATOM 0 H ILE A 109 12.742 4.642 -10.089 1.00 0.00 H new ATOM 0 HA ILE A 109 15.666 4.899 -10.546 1.00 0.00 H new ATOM 0 HB ILE A 109 13.332 6.781 -10.868 1.00 0.00 H new ATOM 0 HG12 ILE A 109 13.194 5.484 -12.746 1.00 0.00 H new ATOM 0 HG13 ILE A 109 14.267 6.759 -13.288 1.00 0.00 H new ATOM 0 HG21 ILE A 109 15.029 8.317 -11.820 1.00 0.00 H new ATOM 0 HG22 ILE A 109 15.363 7.932 -10.115 1.00 0.00 H new ATOM 0 HG23 ILE A 109 16.301 7.143 -11.405 1.00 0.00 H new ATOM 0 HD11 ILE A 109 15.060 4.577 -14.018 1.00 0.00 H new ATOM 0 HD12 ILE A 109 16.213 5.315 -12.880 1.00 0.00 H new ATOM 0 HD13 ILE A 109 15.123 4.020 -12.329 1.00 0.00 H new ATOM 1663 N TYR A 110 16.200 6.039 -8.477 1.00 0.00 N ATOM 1664 CA TYR A 110 16.585 6.460 -7.161 1.00 0.00 C ATOM 1665 C TYR A 110 18.001 7.000 -7.170 1.00 0.00 C ATOM 1666 O TYR A 110 18.835 6.634 -8.000 1.00 0.00 O ATOM 1667 CB TYR A 110 16.498 5.242 -6.241 1.00 0.00 C ATOM 1668 CG TYR A 110 17.493 4.154 -6.596 1.00 0.00 C ATOM 1669 CD1 TYR A 110 18.861 4.328 -6.346 1.00 0.00 C ATOM 1670 CD2 TYR A 110 17.065 2.938 -7.151 1.00 0.00 C ATOM 1671 CE1 TYR A 110 19.803 3.345 -6.636 1.00 0.00 C ATOM 1672 CE2 TYR A 110 18.003 1.918 -7.423 1.00 0.00 C ATOM 1673 CZ TYR A 110 19.371 2.131 -7.173 1.00 0.00 C ATOM 1674 OH TYR A 110 20.277 1.141 -7.391 1.00 0.00 O ATOM 0 H TYR A 110 16.980 5.947 -9.128 1.00 0.00 H new ATOM 0 HA TYR A 110 15.925 7.255 -6.813 1.00 0.00 H new ATOM 0 HB2 TYR A 110 16.668 5.559 -5.212 1.00 0.00 H new ATOM 0 HB3 TYR A 110 15.489 4.832 -6.286 1.00 0.00 H new ATOM 0 HD1 TYR A 110 19.197 5.259 -5.913 1.00 0.00 H new ATOM 0 HD2 TYR A 110 16.019 2.782 -7.370 1.00 0.00 H new ATOM 0 HE1 TYR A 110 20.852 3.519 -6.448 1.00 0.00 H new ATOM 0 HE2 TYR A 110 17.669 0.972 -7.824 1.00 0.00 H new ATOM 0 HH TYR A 110 19.822 0.358 -7.767 1.00 0.00 H new ATOM 1684 N THR A 111 18.281 7.891 -6.232 1.00 0.00 N ATOM 1685 CA THR A 111 19.588 8.520 -6.122 1.00 0.00 C ATOM 1686 C THR A 111 20.487 7.681 -5.243 1.00 0.00 C ATOM 1687 O THR A 111 19.995 6.809 -4.531 1.00 0.00 O ATOM 1688 CB THR A 111 19.424 9.951 -5.596 1.00 0.00 C ATOM 1689 OG1 THR A 111 19.417 9.949 -4.191 1.00 0.00 O ATOM 1690 CG2 THR A 111 18.084 10.575 -5.980 1.00 0.00 C ATOM 0 H THR A 111 17.611 8.198 -5.527 1.00 0.00 H new ATOM 0 HA THR A 111 20.062 8.583 -7.102 1.00 0.00 H new ATOM 0 HB THR A 111 20.252 10.513 -6.029 1.00 0.00 H new ATOM 0 HG1 THR A 111 19.313 10.867 -3.863 1.00 0.00 H new ATOM 0 HG21 THR A 111 18.026 11.587 -5.580 1.00 0.00 H new ATOM 0 HG22 THR A 111 17.996 10.608 -7.066 1.00 0.00 H new ATOM 0 HG23 THR A 111 17.272 9.975 -5.569 1.00 0.00 H new ATOM 1698 N TYR A 112 21.786 7.943 -5.270 1.00 0.00 N ATOM 1699 CA TYR A 112 22.731 7.224 -4.454 1.00 0.00 C ATOM 1700 C TYR A 112 23.330 8.132 -3.351 1.00 0.00 C ATOM 1701 O TYR A 112 23.482 9.333 -3.548 1.00 0.00 O ATOM 1702 CB TYR A 112 23.773 6.572 -5.377 1.00 0.00 C ATOM 1703 CG TYR A 112 25.068 6.120 -4.731 1.00 0.00 C ATOM 1704 CD1 TYR A 112 25.931 7.047 -4.124 1.00 0.00 C ATOM 1705 CD2 TYR A 112 25.392 4.761 -4.652 1.00 0.00 C ATOM 1706 CE1 TYR A 112 27.116 6.663 -3.496 1.00 0.00 C ATOM 1707 CE2 TYR A 112 26.571 4.353 -3.998 1.00 0.00 C ATOM 1708 CZ TYR A 112 27.440 5.305 -3.443 1.00 0.00 C ATOM 1709 OH TYR A 112 28.603 4.906 -2.866 1.00 0.00 O ATOM 0 H TYR A 112 22.206 8.661 -5.860 1.00 0.00 H new ATOM 0 HA TYR A 112 22.236 6.424 -3.903 1.00 0.00 H new ATOM 0 HB2 TYR A 112 23.311 5.708 -5.854 1.00 0.00 H new ATOM 0 HB3 TYR A 112 24.017 7.281 -6.169 1.00 0.00 H new ATOM 0 HD1 TYR A 112 25.668 8.094 -4.144 1.00 0.00 H new ATOM 0 HD2 TYR A 112 24.737 4.024 -5.093 1.00 0.00 H new ATOM 0 HE1 TYR A 112 27.771 7.402 -3.059 1.00 0.00 H new ATOM 0 HE2 TYR A 112 26.807 3.302 -3.923 1.00 0.00 H new ATOM 0 HH TYR A 112 28.673 3.930 -2.912 1.00 0.00 H new ATOM 1719 N PRO A 113 23.779 7.537 -2.232 1.00 0.00 N ATOM 1720 CA PRO A 113 23.600 6.119 -1.947 1.00 0.00 C ATOM 1721 C PRO A 113 22.173 5.855 -1.572 1.00 0.00 C ATOM 1722 O PRO A 113 21.545 4.992 -2.179 1.00 0.00 O ATOM 1723 CB PRO A 113 24.565 5.755 -0.835 1.00 0.00 C ATOM 1724 CG PRO A 113 24.970 7.092 -0.213 1.00 0.00 C ATOM 1725 CD PRO A 113 24.545 8.197 -1.188 1.00 0.00 C ATOM 0 HA PRO A 113 23.814 5.502 -2.820 1.00 0.00 H new ATOM 0 HB2 PRO A 113 24.093 5.104 -0.099 1.00 0.00 H new ATOM 0 HB3 PRO A 113 25.432 5.221 -1.223 1.00 0.00 H new ATOM 0 HG2 PRO A 113 24.487 7.227 0.755 1.00 0.00 H new ATOM 0 HG3 PRO A 113 26.046 7.125 -0.040 1.00 0.00 H new ATOM 0 HD2 PRO A 113 23.945 8.954 -0.683 1.00 0.00 H new ATOM 0 HD3 PRO A 113 25.414 8.706 -1.604 1.00 0.00 H new ATOM 1733 N ASN A 114 21.644 6.598 -0.593 1.00 0.00 N ATOM 1734 CA ASN A 114 20.283 6.478 -0.142 1.00 0.00 C ATOM 1735 C ASN A 114 19.356 6.351 -1.330 1.00 0.00 C ATOM 1736 O ASN A 114 19.243 7.322 -2.069 1.00 0.00 O ATOM 1737 CB ASN A 114 19.885 7.730 0.652 1.00 0.00 C ATOM 1738 CG ASN A 114 18.957 7.370 1.780 1.00 0.00 C ATOM 1739 OD1 ASN A 114 19.196 6.430 2.520 1.00 0.00 O ATOM 1740 ND2 ASN A 114 17.847 8.059 1.882 1.00 0.00 N ATOM 0 H ASN A 114 22.175 7.310 -0.092 1.00 0.00 H new ATOM 0 HA ASN A 114 20.203 5.593 0.490 1.00 0.00 H new ATOM 0 HB2 ASN A 114 20.777 8.214 1.049 1.00 0.00 H new ATOM 0 HB3 ASN A 114 19.400 8.448 -0.010 1.00 0.00 H new ATOM 0 HD21 ASN A 114 17.158 7.814 2.593 1.00 0.00 H new ATOM 0 HD22 ASN A 114 17.672 8.841 1.250 1.00 0.00 H new ATOM 1747 N LYS A 115 18.747 5.175 -1.530 1.00 0.00 N ATOM 1748 CA LYS A 115 17.860 4.887 -2.648 1.00 0.00 C ATOM 1749 C LYS A 115 16.613 5.725 -2.499 1.00 0.00 C ATOM 1750 O LYS A 115 15.577 5.211 -2.087 1.00 0.00 O ATOM 1751 CB LYS A 115 17.545 3.378 -2.705 1.00 0.00 C ATOM 1752 CG LYS A 115 18.316 2.701 -3.823 1.00 0.00 C ATOM 1753 CD LYS A 115 18.835 1.322 -3.476 1.00 0.00 C ATOM 1754 CE LYS A 115 19.799 1.445 -2.287 1.00 0.00 C ATOM 1755 NZ LYS A 115 19.195 0.913 -1.057 1.00 0.00 N ATOM 0 H LYS A 115 18.865 4.382 -0.899 1.00 0.00 H new ATOM 0 HA LYS A 115 18.339 5.144 -3.593 1.00 0.00 H new ATOM 0 HB2 LYS A 115 17.798 2.914 -1.752 1.00 0.00 H new ATOM 0 HB3 LYS A 115 16.475 3.232 -2.856 1.00 0.00 H new ATOM 0 HG2 LYS A 115 17.671 2.624 -4.698 1.00 0.00 H new ATOM 0 HG3 LYS A 115 19.158 3.334 -4.102 1.00 0.00 H new ATOM 0 HD2 LYS A 115 18.007 0.659 -3.225 1.00 0.00 H new ATOM 0 HD3 LYS A 115 19.346 0.884 -4.333 1.00 0.00 H new ATOM 0 HE2 LYS A 115 20.721 0.906 -2.505 1.00 0.00 H new ATOM 0 HE3 LYS A 115 20.068 2.491 -2.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 19.414 1.545 -0.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 18.164 0.851 -1.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 19.579 -0.034 -0.863 1.00 0.00 H new ATOM 1769 N VAL A 116 16.737 7.032 -2.738 1.00 0.00 N ATOM 1770 CA VAL A 116 15.684 8.004 -2.589 1.00 0.00 C ATOM 1771 C VAL A 116 14.734 7.753 -3.737 1.00 0.00 C ATOM 1772 O VAL A 116 14.821 8.421 -4.763 1.00 0.00 O ATOM 1773 CB VAL A 116 16.237 9.444 -2.588 1.00 0.00 C ATOM 1774 CG1 VAL A 116 15.123 10.470 -2.789 1.00 0.00 C ATOM 1775 CG2 VAL A 116 16.991 9.740 -1.296 1.00 0.00 C ATOM 0 H VAL A 116 17.615 7.446 -3.053 1.00 0.00 H new ATOM 0 HA VAL A 116 15.173 7.901 -1.632 1.00 0.00 H new ATOM 0 HB VAL A 116 16.931 9.523 -3.425 1.00 0.00 H new ATOM 0 HG11 VAL A 116 15.548 11.474 -2.783 1.00 0.00 H new ATOM 0 HG12 VAL A 116 14.631 10.290 -3.745 1.00 0.00 H new ATOM 0 HG13 VAL A 116 14.395 10.379 -1.983 1.00 0.00 H new ATOM 0 HG21 VAL A 116 17.370 10.762 -1.322 1.00 0.00 H new ATOM 0 HG22 VAL A 116 16.317 9.624 -0.447 1.00 0.00 H new ATOM 0 HG23 VAL A 116 17.825 9.046 -1.194 1.00 0.00 H new ATOM 1785 N PHE A 117 13.913 6.708 -3.610 1.00 0.00 N ATOM 1786 CA PHE A 117 12.939 6.279 -4.572 1.00 0.00 C ATOM 1787 C PHE A 117 12.254 7.491 -5.199 1.00 0.00 C ATOM 1788 O PHE A 117 11.509 8.237 -4.542 1.00 0.00 O ATOM 1789 CB PHE A 117 11.926 5.388 -3.850 1.00 0.00 C ATOM 1790 CG PHE A 117 10.691 5.145 -4.661 1.00 0.00 C ATOM 1791 CD1 PHE A 117 10.764 4.344 -5.809 1.00 0.00 C ATOM 1792 CD2 PHE A 117 9.487 5.768 -4.298 1.00 0.00 C ATOM 1793 CE1 PHE A 117 9.629 4.162 -6.597 1.00 0.00 C ATOM 1794 CE2 PHE A 117 8.344 5.570 -5.071 1.00 0.00 C ATOM 1795 CZ PHE A 117 8.434 4.790 -6.228 1.00 0.00 C ATOM 0 H PHE A 117 13.924 6.116 -2.780 1.00 0.00 H new ATOM 0 HA PHE A 117 13.414 5.718 -5.377 1.00 0.00 H new ATOM 0 HB2 PHE A 117 12.393 4.433 -3.612 1.00 0.00 H new ATOM 0 HB3 PHE A 117 11.649 5.852 -2.904 1.00 0.00 H new ATOM 0 HD1 PHE A 117 11.695 3.870 -6.082 1.00 0.00 H new ATOM 0 HD2 PHE A 117 9.446 6.399 -3.422 1.00 0.00 H new ATOM 0 HE1 PHE A 117 9.671 3.544 -7.482 1.00 0.00 H new ATOM 0 HE2 PHE A 117 7.403 6.013 -4.780 1.00 0.00 H new ATOM 0 HZ PHE A 117 7.561 4.669 -6.852 1.00 0.00 H new ATOM 1805 N CYS A 118 12.595 7.764 -6.455 1.00 0.00 N ATOM 1806 CA CYS A 118 12.051 8.901 -7.142 1.00 0.00 C ATOM 1807 C CYS A 118 10.687 8.527 -7.671 1.00 0.00 C ATOM 1808 O CYS A 118 9.733 9.290 -7.493 1.00 0.00 O ATOM 1809 CB CYS A 118 12.980 9.376 -8.256 1.00 0.00 C ATOM 1810 SG CYS A 118 14.707 9.463 -7.777 1.00 0.00 S ATOM 0 H CYS A 118 13.246 7.206 -7.006 1.00 0.00 H new ATOM 0 HA CYS A 118 11.954 9.738 -6.451 1.00 0.00 H new ATOM 0 HB2 CYS A 118 12.883 8.703 -9.108 1.00 0.00 H new ATOM 0 HB3 CYS A 118 12.656 10.362 -8.590 1.00 0.00 H new ATOM 1815 N GLY A 119 10.597 7.349 -8.291 1.00 0.00 N ATOM 1816 CA GLY A 119 9.381 6.832 -8.866 1.00 0.00 C ATOM 1817 C GLY A 119 9.698 5.757 -9.875 1.00 0.00 C ATOM 1818 O GLY A 119 10.662 5.000 -9.715 1.00 0.00 O ATOM 0 H GLY A 119 11.394 6.723 -8.403 1.00 0.00 H new ATOM 0 HA2 GLY A 119 8.742 6.427 -8.081 1.00 0.00 H new ATOM 0 HA3 GLY A 119 8.825 7.638 -9.345 1.00 0.00 H new ATOM 1822 N ILE A 120 8.863 5.663 -10.905 1.00 0.00 N ATOM 1823 CA ILE A 120 9.009 4.610 -11.891 1.00 0.00 C ATOM 1824 C ILE A 120 9.014 5.280 -13.234 1.00 0.00 C ATOM 1825 O ILE A 120 8.265 6.235 -13.412 1.00 0.00 O ATOM 1826 CB ILE A 120 7.904 3.561 -11.768 1.00 0.00 C ATOM 1827 CG1 ILE A 120 7.666 3.164 -10.309 1.00 0.00 C ATOM 1828 CG2 ILE A 120 8.233 2.337 -12.637 1.00 0.00 C ATOM 1829 CD1 ILE A 120 8.331 1.882 -9.884 1.00 0.00 C ATOM 0 H ILE A 120 8.085 6.301 -11.074 1.00 0.00 H new ATOM 0 HA ILE A 120 9.937 4.059 -11.739 1.00 0.00 H new ATOM 0 HB ILE A 120 6.976 4.000 -12.133 1.00 0.00 H new ATOM 0 HG12 ILE A 120 8.020 3.970 -9.666 1.00 0.00 H new ATOM 0 HG13 ILE A 120 6.593 3.072 -10.143 1.00 0.00 H new ATOM 0 HG21 ILE A 120 7.438 1.598 -12.540 1.00 0.00 H new ATOM 0 HG22 ILE A 120 8.319 2.643 -13.680 1.00 0.00 H new ATOM 0 HG23 ILE A 120 9.176 1.901 -12.309 1.00 0.00 H new ATOM 0 HD11 ILE A 120 8.105 1.685 -8.836 1.00 0.00 H new ATOM 0 HD12 ILE A 120 7.961 1.060 -10.496 1.00 0.00 H new ATOM 0 HD13 ILE A 120 9.410 1.972 -10.012 1.00 0.00 H new ATOM 1841 N ILE A 121 9.860 4.853 -14.139 1.00 0.00 N ATOM 1842 CA ILE A 121 9.973 5.461 -15.448 1.00 0.00 C ATOM 1843 C ILE A 121 9.909 4.377 -16.484 1.00 0.00 C ATOM 1844 O ILE A 121 10.270 3.238 -16.190 1.00 0.00 O ATOM 1845 CB ILE A 121 11.246 6.311 -15.558 1.00 0.00 C ATOM 1846 CG1 ILE A 121 12.500 5.434 -15.806 1.00 0.00 C ATOM 1847 CG2 ILE A 121 11.424 7.223 -14.334 1.00 0.00 C ATOM 1848 CD1 ILE A 121 13.726 6.265 -16.173 1.00 0.00 C ATOM 0 H ILE A 121 10.495 4.069 -13.990 1.00 0.00 H new ATOM 0 HA ILE A 121 9.144 6.149 -15.614 1.00 0.00 H new ATOM 0 HB ILE A 121 11.129 6.957 -16.428 1.00 0.00 H new ATOM 0 HG12 ILE A 121 12.715 4.850 -14.911 1.00 0.00 H new ATOM 0 HG13 ILE A 121 12.292 4.725 -16.607 1.00 0.00 H new ATOM 0 HG21 ILE A 121 12.336 7.810 -14.447 1.00 0.00 H new ATOM 0 HG22 ILE A 121 10.569 7.894 -14.252 1.00 0.00 H new ATOM 0 HG23 ILE A 121 11.494 6.613 -13.433 1.00 0.00 H new ATOM 0 HD11 ILE A 121 14.578 5.605 -16.337 1.00 0.00 H new ATOM 0 HD12 ILE A 121 13.524 6.829 -17.084 1.00 0.00 H new ATOM 0 HD13 ILE A 121 13.953 6.956 -15.361 1.00 0.00 H new ATOM 1860 N ALA A 122 9.491 4.703 -17.702 1.00 0.00 N ATOM 1861 CA ALA A 122 9.402 3.758 -18.791 1.00 0.00 C ATOM 1862 C ALA A 122 8.917 4.463 -20.041 1.00 0.00 C ATOM 1863 O ALA A 122 8.291 5.526 -19.987 1.00 0.00 O ATOM 1864 CB ALA A 122 8.433 2.629 -18.411 1.00 0.00 C ATOM 0 H ALA A 122 9.202 5.647 -17.957 1.00 0.00 H new ATOM 0 HA ALA A 122 10.386 3.333 -18.986 1.00 0.00 H new ATOM 0 HB1 ALA A 122 8.365 1.916 -19.232 1.00 0.00 H new ATOM 0 HB2 ALA A 122 8.798 2.121 -17.518 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.447 3.048 -18.212 1.00 0.00 H new ATOM 2011 N LYS A 132 9.479 8.723 -19.553 1.00 0.00 N ATOM 2012 CA LYS A 132 8.621 9.548 -18.714 1.00 0.00 C ATOM 2013 C LYS A 132 8.398 8.865 -17.387 1.00 0.00 C ATOM 2014 O LYS A 132 8.765 7.698 -17.245 1.00 0.00 O ATOM 2015 CB LYS A 132 7.315 9.836 -19.455 1.00 0.00 C ATOM 2016 CG LYS A 132 6.735 8.589 -20.134 1.00 0.00 C ATOM 2017 CD LYS A 132 5.221 8.679 -20.157 1.00 0.00 C ATOM 2018 CE LYS A 132 4.626 8.123 -18.855 1.00 0.00 C ATOM 2019 NZ LYS A 132 3.192 8.461 -18.747 1.00 0.00 N ATOM 0 HA LYS A 132 9.097 10.506 -18.505 1.00 0.00 H new ATOM 0 HB2 LYS A 132 6.584 10.236 -18.753 1.00 0.00 H new ATOM 0 HB3 LYS A 132 7.490 10.606 -20.206 1.00 0.00 H new ATOM 0 HG2 LYS A 132 7.120 8.504 -21.150 1.00 0.00 H new ATOM 0 HG3 LYS A 132 7.048 7.693 -19.599 1.00 0.00 H new ATOM 0 HD2 LYS A 132 4.915 9.717 -20.289 1.00 0.00 H new ATOM 0 HD3 LYS A 132 4.831 8.121 -21.008 1.00 0.00 H new ATOM 0 HE2 LYS A 132 4.752 7.041 -18.825 1.00 0.00 H new ATOM 0 HE3 LYS A 132 5.166 8.531 -18.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 2.810 8.075 -17.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 3.078 9.495 -18.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 2.677 8.051 -19.552 1.00 0.00 H new ATOM 2033 N LEU A 133 7.759 9.560 -16.448 1.00 0.00 N ATOM 2034 CA LEU A 133 7.435 9.008 -15.145 1.00 0.00 C ATOM 2035 C LEU A 133 6.099 8.278 -15.221 1.00 0.00 C ATOM 2036 O LEU A 133 5.147 8.729 -15.877 1.00 0.00 O ATOM 2037 CB LEU A 133 7.443 10.145 -14.111 1.00 0.00 C ATOM 2038 CG LEU A 133 7.628 9.658 -12.669 1.00 0.00 C ATOM 2039 CD1 LEU A 133 9.067 9.207 -12.405 1.00 0.00 C ATOM 2040 CD2 LEU A 133 7.231 10.761 -11.683 1.00 0.00 C ATOM 0 H LEU A 133 7.453 10.525 -16.575 1.00 0.00 H new ATOM 0 HA LEU A 133 8.177 8.274 -14.831 1.00 0.00 H new ATOM 0 HB2 LEU A 133 8.244 10.843 -14.356 1.00 0.00 H new ATOM 0 HB3 LEU A 133 6.506 10.697 -14.182 1.00 0.00 H new ATOM 0 HG LEU A 133 6.978 8.795 -12.525 1.00 0.00 H new ATOM 0 HD11 LEU A 133 9.159 8.869 -11.373 1.00 0.00 H new ATOM 0 HD12 LEU A 133 9.321 8.389 -13.079 1.00 0.00 H new ATOM 0 HD13 LEU A 133 9.747 10.042 -12.575 1.00 0.00 H new ATOM 0 HD21 LEU A 133 7.367 10.403 -10.662 1.00 0.00 H new ATOM 0 HD22 LEU A 133 7.858 11.638 -11.846 1.00 0.00 H new ATOM 0 HD23 LEU A 133 6.186 11.028 -11.838 1.00 0.00 H new ATOM 2052 N CYS A 134 6.036 7.093 -14.612 1.00 0.00 N ATOM 2053 CA CYS A 134 4.834 6.302 -14.501 1.00 0.00 C ATOM 2054 C CYS A 134 3.832 7.029 -13.625 1.00 0.00 C ATOM 2055 O CYS A 134 4.113 8.103 -13.088 1.00 0.00 O ATOM 2056 CB CYS A 134 5.172 4.933 -13.929 1.00 0.00 C ATOM 2057 SG CYS A 134 6.488 4.145 -14.887 1.00 0.00 S ATOM 0 H CYS A 134 6.847 6.655 -14.175 1.00 0.00 H new ATOM 0 HA CYS A 134 4.391 6.158 -15.486 1.00 0.00 H new ATOM 0 HB2 CYS A 134 5.484 5.035 -12.889 1.00 0.00 H new ATOM 0 HB3 CYS A 134 4.283 4.302 -13.935 1.00 0.00 H new ATOM 2062 N SER A 135 2.679 6.409 -13.430 1.00 0.00 N ATOM 2063 CA SER A 135 1.624 7.020 -12.643 1.00 0.00 C ATOM 2064 C SER A 135 0.730 5.887 -12.212 1.00 0.00 C ATOM 2065 O SER A 135 -0.106 5.464 -13.000 1.00 0.00 O ATOM 2066 CB SER A 135 0.818 8.027 -13.470 1.00 0.00 C ATOM 2067 OG SER A 135 1.621 9.125 -13.891 1.00 0.00 O ATOM 0 H SER A 135 2.452 5.488 -13.804 1.00 0.00 H new ATOM 0 HA SER A 135 2.041 7.568 -11.798 1.00 0.00 H new ATOM 0 HB2 SER A 135 0.398 7.528 -14.343 1.00 0.00 H new ATOM 0 HB3 SER A 135 -0.021 8.395 -12.879 1.00 0.00 H new ATOM 0 HG SER A 135 1.076 9.746 -14.417 1.00 0.00 H new ATOM 2073 N HIS A 136 1.009 5.326 -11.029 1.00 0.00 N ATOM 2074 CA HIS A 136 0.134 4.361 -10.370 1.00 0.00 C ATOM 2075 C HIS A 136 -1.363 4.636 -10.587 1.00 0.00 C ATOM 2076 O HIS A 136 -1.684 5.845 -10.459 1.00 0.00 O ATOM 2077 CB HIS A 136 0.442 4.287 -8.863 1.00 0.00 C ATOM 2078 CG HIS A 136 1.004 5.541 -8.239 1.00 0.00 C ATOM 2079 ND1 HIS A 136 0.670 6.803 -8.622 1.00 0.00 N ATOM 2080 CD2 HIS A 136 1.964 5.605 -7.266 1.00 0.00 C ATOM 2081 CE1 HIS A 136 1.429 7.647 -7.898 1.00 0.00 C ATOM 2082 NE2 HIS A 136 2.201 6.956 -7.036 1.00 0.00 N ATOM 2083 OXT HIS A 136 -2.095 3.651 -10.782 1.00 0.00 O ATOM 0 H HIS A 136 1.857 5.534 -10.501 1.00 0.00 H new ATOM 0 HA HIS A 136 0.346 3.400 -10.839 1.00 0.00 H new ATOM 0 HB2 HIS A 136 -0.476 4.024 -8.338 1.00 0.00 H new ATOM 0 HB3 HIS A 136 1.149 3.474 -8.697 1.00 0.00 H new ATOM 0 HD1 HIS A 136 -0.024 7.061 -9.324 1.00 0.00 H new ATOM 0 HD2 HIS A 136 2.443 4.771 -6.774 1.00 0.00 H new ATOM 0 HE1 HIS A 136 1.420 8.723 -7.994 1.00 0.00 H new