USER MOD reduce.3.24.130724 H: found=0, std=0, add=882, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 870 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 87 LYS NZ :NH3+ 157:sc= 1.03 (180deg=0) USER MOD Set 1.2: B 745 SER OG : rot 170:sc= 0.892 USER MOD Set 2.1: A 74 ASN : amide:sc= 0.95 K(o=1.7,f=-0.026) USER MOD Set 2.2: A 86 HIS : no HE2:sc= 0.779 K(o=1.7,f=-0.23) USER MOD Set 3.1: A 67 HIS : no HE2:sc= -1.11 K(o=0.15,f=1.1) USER MOD Set 3.2: A 71 CYS SG : rot 90:sc= -0.183! USER MOD Set 3.3: A 76 CYS SG : rot 145:sc= 0.836 USER MOD Set 3.4: A 81 CYS SG : rot -160:sc= -1.42! USER MOD Set 3.5: A 85 LYS NZ :NH3+ 176:sc= 2.04 (180deg=1.14) USER MOD Set 4.1: A 42 HIS : no HD1:sc= -2.21 K(o=8.1,f=7.4) USER MOD Set 4.2: A 43 THR OG1 : rot -44:sc= 1.37 USER MOD Set 4.3: A 46 CYS SG : rot 156:sc= 1.18 USER MOD Set 4.4: A 49 LYS NZ :NH3+ 146:sc= 1.69 (180deg=-0.221) USER MOD Set 4.5: A 54 CYS SG : rot -158:sc= 2.99 USER MOD Set 4.6: A 57 CYS SG : rot 135:sc= 3.04 USER MOD Set 5.1: A 41 GLN : amide:sc= 0.576 K(o=1.4,f=-1.8) USER MOD Set 5.2: A 44 LYS NZ :NH3+ -143:sc= 0.841 (180deg=0) USER MOD Set 6.1: A 16 SER OG : rot 75:sc= 1.23 USER MOD Set 6.2: A 32 SER OG : rot 160:sc= 0.632 USER MOD Set 7.1: A 19 HIS : no HD1:sc= -1.25 X(o=7.7,f=7.7) USER MOD Set 7.2: A 23 CYS SG : rot 24:sc= 1.12 USER MOD Set 7.3: A 25 ASN : amide:sc= 1.36 K(o=7.7,f=5.2) USER MOD Set 7.4: A 28 CYS SG : rot 130:sc= 2.7 USER MOD Set 7.5: A 33 CYS SG : rot -164:sc= 0.78 USER MOD Set 7.6: A 37 LYS NZ :NH3+ 161:sc= 2.97 (180deg=1.12) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 84:sc= 1.37 USER MOD Single : A 11 GLN : amide:sc= -0.0358 X(o=-0.036,f=-0.46) USER MOD Single : A 13 CYS SG : rot 180:sc= 0.00282 USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 CYS SG : rot 80:sc= 0.128 USER MOD Single : A 22 GLN : amide:sc= 0.876 K(o=0.88,f=0) USER MOD Single : A 27 ASN : amide:sc= -0.071 X(o=-0.071,f=-0.071) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= 1.21 K(o=1.2,f=-0.77) USER MOD Single : A 35 LYS NZ :NH3+ -139:sc= 1.11 (180deg=0.294) USER MOD Single : A 36 MET CE :methyl 168:sc= -0.351 (180deg=-0.459) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 75:sc= 1.31 USER MOD Single : A 51 ASN : amide:sc= 0.958 K(o=0.96,f=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN : amide:sc= 0.858 K(o=0.86,f=-1.5) USER MOD Single : A 64 CYS SG : rot 82:sc= 0.234 USER MOD Single : A 65 CYS SG : rot 152:sc= -0.453 USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 HIS : no HE2:sc= 0.935 K(o=0.94,f=-2.8!) USER MOD Single : A 72 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 ASN : amide:sc= 0.818 K(o=0.82,f=0) USER MOD Single : B 722 ASN : amide:sc= -0.395 X(o=-0.39,f=0) USER MOD Single : B 726 MET CE :methyl 175:sc= 0 (180deg=-0.0426) USER MOD Single : B 727 SER OG : rot 180:sc= 0.221 USER MOD Single : B 735 SER OG : rot 180:sc= 0 USER MOD Single : B 740 SER OG : rot 180:sc= 0 USER MOD Single : B 746 MET CE :methyl 147:sc= -3.63! (180deg=-5.44!) USER MOD ----------------------------------------------------------------- ATOM 43 N GLU A 4 50.885 -12.839 27.584 1.00 0.00 N ATOM 44 CA GLU A 4 50.440 -14.226 27.765 1.00 0.00 C ATOM 45 C GLU A 4 48.921 -14.375 27.669 1.00 0.00 C ATOM 46 O GLU A 4 48.446 -15.300 27.018 1.00 0.00 O ATOM 47 CB GLU A 4 50.932 -14.739 29.123 1.00 0.00 C ATOM 48 CG GLU A 4 52.389 -15.213 29.110 1.00 0.00 C ATOM 49 CD GLU A 4 53.375 -14.223 28.470 1.00 0.00 C ATOM 50 OE1 GLU A 4 53.425 -13.045 28.897 1.00 0.00 O ATOM 51 OE2 GLU A 4 54.075 -14.625 27.512 1.00 0.00 O ATOM 0 HA GLU A 4 50.867 -14.819 26.956 1.00 0.00 H new ATOM 0 HB2 GLU A 4 50.824 -13.945 29.862 1.00 0.00 H new ATOM 0 HB3 GLU A 4 50.294 -15.563 29.443 1.00 0.00 H new ATOM 0 HG2 GLU A 4 52.704 -15.408 30.135 1.00 0.00 H new ATOM 0 HG3 GLU A 4 52.445 -16.160 28.574 1.00 0.00 H new ATOM 58 N SER A 5 48.151 -13.449 28.245 1.00 0.00 N ATOM 59 CA SER A 5 46.684 -13.450 28.146 1.00 0.00 C ATOM 60 C SER A 5 46.218 -13.468 26.683 1.00 0.00 C ATOM 61 O SER A 5 45.323 -14.233 26.315 1.00 0.00 O ATOM 62 CB SER A 5 46.131 -12.221 28.879 1.00 0.00 C ATOM 63 OG SER A 5 46.621 -11.022 28.299 1.00 0.00 O ATOM 0 H SER A 5 48.525 -12.675 28.795 1.00 0.00 H new ATOM 0 HA SER A 5 46.301 -14.357 28.614 1.00 0.00 H new ATOM 0 HB2 SER A 5 45.042 -12.229 28.841 1.00 0.00 H new ATOM 0 HB3 SER A 5 46.413 -12.263 29.931 1.00 0.00 H new ATOM 0 HG SER A 5 46.254 -10.252 28.781 1.00 0.00 H new ATOM 69 N ARG A 6 46.877 -12.672 25.833 1.00 0.00 N ATOM 70 CA ARG A 6 46.654 -12.581 24.382 1.00 0.00 C ATOM 71 C ARG A 6 47.116 -13.862 23.685 1.00 0.00 C ATOM 72 O ARG A 6 46.341 -14.462 22.943 1.00 0.00 O ATOM 73 CB ARG A 6 47.392 -11.364 23.780 1.00 0.00 C ATOM 74 CG ARG A 6 47.339 -10.079 24.627 1.00 0.00 C ATOM 75 CD ARG A 6 48.130 -8.959 23.939 1.00 0.00 C ATOM 76 NE ARG A 6 48.362 -7.808 24.837 1.00 0.00 N ATOM 77 CZ ARG A 6 47.530 -6.821 25.110 1.00 0.00 C ATOM 78 NH1 ARG A 6 46.306 -6.813 24.676 1.00 0.00 N ATOM 79 NH2 ARG A 6 47.926 -5.809 25.824 1.00 0.00 N ATOM 0 H ARG A 6 47.615 -12.044 26.151 1.00 0.00 H new ATOM 0 HA ARG A 6 45.584 -12.453 24.220 1.00 0.00 H new ATOM 0 HB2 ARG A 6 48.436 -11.634 23.624 1.00 0.00 H new ATOM 0 HB3 ARG A 6 46.967 -11.151 22.799 1.00 0.00 H new ATOM 0 HG2 ARG A 6 46.303 -9.770 24.767 1.00 0.00 H new ATOM 0 HG3 ARG A 6 47.752 -10.270 25.618 1.00 0.00 H new ATOM 0 HD2 ARG A 6 49.088 -9.350 23.597 1.00 0.00 H new ATOM 0 HD3 ARG A 6 47.588 -8.624 23.054 1.00 0.00 H new ATOM 0 HE ARG A 6 49.271 -7.773 25.299 1.00 0.00 H new ATOM 0 HH11 ARG A 6 45.962 -7.586 24.106 1.00 0.00 H new ATOM 0 HH12 ARG A 6 45.689 -6.034 24.905 1.00 0.00 H new ATOM 0 HH21 ARG A 6 48.883 -5.776 26.175 1.00 0.00 H new ATOM 0 HH22 ARG A 6 47.280 -5.048 26.033 1.00 0.00 H new ATOM 93 N ARG A 7 48.352 -14.309 23.953 1.00 0.00 N ATOM 94 CA ARG A 7 48.976 -15.519 23.371 1.00 0.00 C ATOM 95 C ARG A 7 48.115 -16.763 23.573 1.00 0.00 C ATOM 96 O ARG A 7 47.838 -17.505 22.633 1.00 0.00 O ATOM 97 CB ARG A 7 50.376 -15.715 23.973 1.00 0.00 C ATOM 98 CG ARG A 7 51.331 -14.598 23.533 1.00 0.00 C ATOM 99 CD ARG A 7 52.628 -14.600 24.336 1.00 0.00 C ATOM 100 NE ARG A 7 53.524 -13.560 23.799 1.00 0.00 N ATOM 101 CZ ARG A 7 54.700 -13.143 24.218 1.00 0.00 C ATOM 102 NH1 ARG A 7 55.279 -13.556 25.305 1.00 0.00 N ATOM 103 NH2 ARG A 7 55.310 -12.251 23.498 1.00 0.00 N ATOM 0 H ARG A 7 48.971 -13.825 24.603 1.00 0.00 H new ATOM 0 HA ARG A 7 49.063 -15.372 22.295 1.00 0.00 H new ATOM 0 HB2 ARG A 7 50.308 -15.731 25.061 1.00 0.00 H new ATOM 0 HB3 ARG A 7 50.775 -16.681 23.664 1.00 0.00 H new ATOM 0 HG2 ARG A 7 51.561 -14.715 22.474 1.00 0.00 H new ATOM 0 HG3 ARG A 7 50.836 -13.633 23.647 1.00 0.00 H new ATOM 0 HD2 ARG A 7 52.420 -14.411 25.389 1.00 0.00 H new ATOM 0 HD3 ARG A 7 53.107 -15.577 24.276 1.00 0.00 H new ATOM 0 HE ARG A 7 53.175 -13.086 22.966 1.00 0.00 H new ATOM 0 HH11 ARG A 7 54.819 -14.249 25.896 1.00 0.00 H new ATOM 0 HH12 ARG A 7 56.193 -13.188 25.568 1.00 0.00 H new ATOM 0 HH21 ARG A 7 54.876 -11.901 22.644 1.00 0.00 H new ATOM 0 HH22 ARG A 7 56.223 -11.900 23.786 1.00 0.00 H new ATOM 117 N LEU A 8 47.661 -16.960 24.808 1.00 0.00 N ATOM 118 CA LEU A 8 46.806 -18.072 25.220 1.00 0.00 C ATOM 119 C LEU A 8 45.382 -17.950 24.649 1.00 0.00 C ATOM 120 O LEU A 8 44.776 -18.967 24.312 1.00 0.00 O ATOM 121 CB LEU A 8 46.836 -18.142 26.761 1.00 0.00 C ATOM 122 CG LEU A 8 48.245 -18.432 27.336 1.00 0.00 C ATOM 123 CD1 LEU A 8 48.246 -18.262 28.853 1.00 0.00 C ATOM 124 CD2 LEU A 8 48.759 -19.829 26.992 1.00 0.00 C ATOM 0 H LEU A 8 47.886 -16.328 25.577 1.00 0.00 H new ATOM 0 HA LEU A 8 47.185 -19.009 24.812 1.00 0.00 H new ATOM 0 HB2 LEU A 8 46.473 -17.198 27.167 1.00 0.00 H new ATOM 0 HB3 LEU A 8 46.148 -18.919 27.096 1.00 0.00 H new ATOM 0 HG LEU A 8 48.916 -17.710 26.870 1.00 0.00 H new ATOM 0 HD11 LEU A 8 49.243 -18.469 29.242 1.00 0.00 H new ATOM 0 HD12 LEU A 8 47.964 -17.240 29.105 1.00 0.00 H new ATOM 0 HD13 LEU A 8 47.532 -18.955 29.297 1.00 0.00 H new ATOM 0 HD21 LEU A 8 49.750 -19.969 27.424 1.00 0.00 H new ATOM 0 HD22 LEU A 8 48.078 -20.577 27.397 1.00 0.00 H new ATOM 0 HD23 LEU A 8 48.816 -19.939 25.909 1.00 0.00 H new ATOM 136 N SER A 9 44.858 -16.731 24.468 1.00 0.00 N ATOM 137 CA SER A 9 43.546 -16.515 23.834 1.00 0.00 C ATOM 138 C SER A 9 43.578 -16.831 22.333 1.00 0.00 C ATOM 139 O SER A 9 42.655 -17.471 21.826 1.00 0.00 O ATOM 140 CB SER A 9 43.033 -15.089 24.065 1.00 0.00 C ATOM 141 OG SER A 9 42.824 -14.861 25.451 1.00 0.00 O ATOM 0 H SER A 9 45.326 -15.871 24.754 1.00 0.00 H new ATOM 0 HA SER A 9 42.853 -17.208 24.311 1.00 0.00 H new ATOM 0 HB2 SER A 9 43.752 -14.369 23.675 1.00 0.00 H new ATOM 0 HB3 SER A 9 42.102 -14.937 23.520 1.00 0.00 H new ATOM 0 HG SER A 9 43.672 -14.608 25.872 1.00 0.00 H new ATOM 147 N ILE A 10 44.655 -16.461 21.628 1.00 0.00 N ATOM 148 CA ILE A 10 44.859 -16.763 20.197 1.00 0.00 C ATOM 149 C ILE A 10 44.804 -18.283 19.948 1.00 0.00 C ATOM 150 O ILE A 10 44.200 -18.726 18.970 1.00 0.00 O ATOM 151 CB ILE A 10 46.179 -16.119 19.705 1.00 0.00 C ATOM 152 CG1 ILE A 10 46.081 -14.575 19.708 1.00 0.00 C ATOM 153 CG2 ILE A 10 46.554 -16.581 18.285 1.00 0.00 C ATOM 154 CD1 ILE A 10 47.444 -13.884 19.848 1.00 0.00 C ATOM 0 H ILE A 10 45.425 -15.934 22.039 1.00 0.00 H new ATOM 0 HA ILE A 10 44.049 -16.326 19.612 1.00 0.00 H new ATOM 0 HB ILE A 10 46.953 -16.444 20.400 1.00 0.00 H new ATOM 0 HG12 ILE A 10 45.607 -14.246 18.783 1.00 0.00 H new ATOM 0 HG13 ILE A 10 45.435 -14.260 20.527 1.00 0.00 H new ATOM 0 HG21 ILE A 10 47.486 -16.104 17.981 1.00 0.00 H new ATOM 0 HG22 ILE A 10 46.681 -17.664 18.276 1.00 0.00 H new ATOM 0 HG23 ILE A 10 45.761 -16.303 17.591 1.00 0.00 H new ATOM 0 HD11 ILE A 10 47.306 -12.803 19.843 1.00 0.00 H new ATOM 0 HD12 ILE A 10 47.911 -14.186 20.786 1.00 0.00 H new ATOM 0 HD13 ILE A 10 48.085 -14.172 19.015 1.00 0.00 H new ATOM 166 N GLN A 11 45.367 -19.103 20.848 1.00 0.00 N ATOM 167 CA GLN A 11 45.297 -20.570 20.750 1.00 0.00 C ATOM 168 C GLN A 11 43.849 -21.101 20.739 1.00 0.00 C ATOM 169 O GLN A 11 43.556 -22.044 20.002 1.00 0.00 O ATOM 170 CB GLN A 11 46.110 -21.241 21.869 1.00 0.00 C ATOM 171 CG GLN A 11 47.623 -20.994 21.781 1.00 0.00 C ATOM 172 CD GLN A 11 48.295 -21.624 20.560 1.00 0.00 C ATOM 173 OE1 GLN A 11 47.760 -22.465 19.849 1.00 0.00 O ATOM 174 NE2 GLN A 11 49.518 -21.238 20.275 1.00 0.00 N ATOM 0 H GLN A 11 45.883 -18.770 21.663 1.00 0.00 H new ATOM 0 HA GLN A 11 45.739 -20.833 19.789 1.00 0.00 H new ATOM 0 HB2 GLN A 11 45.749 -20.879 22.832 1.00 0.00 H new ATOM 0 HB3 GLN A 11 45.926 -22.315 21.843 1.00 0.00 H new ATOM 0 HG2 GLN A 11 47.803 -19.919 21.766 1.00 0.00 H new ATOM 0 HG3 GLN A 11 48.096 -21.384 22.683 1.00 0.00 H new ATOM 0 HE21 GLN A 11 49.980 -20.538 20.856 1.00 0.00 H new ATOM 0 HE22 GLN A 11 50.005 -21.638 19.473 1.00 0.00 H new ATOM 183 N ARG A 12 42.914 -20.486 21.486 1.00 0.00 N ATOM 184 CA ARG A 12 41.488 -20.879 21.469 1.00 0.00 C ATOM 185 C ARG A 12 40.872 -20.628 20.090 1.00 0.00 C ATOM 186 O ARG A 12 40.130 -21.469 19.581 1.00 0.00 O ATOM 187 CB ARG A 12 40.679 -20.145 22.553 1.00 0.00 C ATOM 188 CG ARG A 12 41.300 -20.229 23.954 1.00 0.00 C ATOM 189 CD ARG A 12 40.365 -19.608 24.998 1.00 0.00 C ATOM 190 NE ARG A 12 41.106 -19.248 26.226 1.00 0.00 N ATOM 191 CZ ARG A 12 41.436 -18.029 26.619 1.00 0.00 C ATOM 192 NH1 ARG A 12 40.954 -16.961 26.051 1.00 0.00 N ATOM 193 NH2 ARG A 12 42.283 -17.848 27.591 1.00 0.00 N ATOM 0 H ARG A 12 43.120 -19.709 22.114 1.00 0.00 H new ATOM 0 HA ARG A 12 41.446 -21.946 21.687 1.00 0.00 H new ATOM 0 HB2 ARG A 12 40.581 -19.096 22.272 1.00 0.00 H new ATOM 0 HB3 ARG A 12 39.672 -20.562 22.586 1.00 0.00 H new ATOM 0 HG2 ARG A 12 41.497 -21.270 24.208 1.00 0.00 H new ATOM 0 HG3 ARG A 12 42.259 -19.712 23.964 1.00 0.00 H new ATOM 0 HD2 ARG A 12 39.889 -18.720 24.583 1.00 0.00 H new ATOM 0 HD3 ARG A 12 39.569 -20.311 25.242 1.00 0.00 H new ATOM 0 HE ARG A 12 41.392 -20.018 26.831 1.00 0.00 H new ATOM 0 HH11 ARG A 12 40.298 -17.048 25.275 1.00 0.00 H new ATOM 0 HH12 ARG A 12 41.232 -16.037 26.382 1.00 0.00 H new ATOM 0 HH21 ARG A 12 42.701 -18.652 28.060 1.00 0.00 H new ATOM 0 HH22 ARG A 12 42.529 -16.902 27.884 1.00 0.00 H new ATOM 207 N CYS A 13 41.221 -19.504 19.457 1.00 0.00 N ATOM 208 CA CYS A 13 40.784 -19.170 18.100 1.00 0.00 C ATOM 209 C CYS A 13 41.357 -20.173 17.084 1.00 0.00 C ATOM 210 O CYS A 13 40.632 -20.638 16.208 1.00 0.00 O ATOM 211 CB CYS A 13 41.199 -17.731 17.755 1.00 0.00 C ATOM 212 SG CYS A 13 40.519 -16.553 18.958 1.00 0.00 S ATOM 0 H CYS A 13 41.821 -18.794 19.877 1.00 0.00 H new ATOM 0 HA CYS A 13 39.697 -19.235 18.052 1.00 0.00 H new ATOM 0 HB2 CYS A 13 42.286 -17.655 17.741 1.00 0.00 H new ATOM 0 HB3 CYS A 13 40.849 -17.478 16.754 1.00 0.00 H new ATOM 0 HG CYS A 13 40.888 -15.347 18.641 1.00 0.00 H new ATOM 218 N ILE A 14 42.631 -20.556 17.219 1.00 0.00 N ATOM 219 CA ILE A 14 43.277 -21.563 16.361 1.00 0.00 C ATOM 220 C ILE A 14 42.524 -22.899 16.454 1.00 0.00 C ATOM 221 O ILE A 14 42.131 -23.450 15.426 1.00 0.00 O ATOM 222 CB ILE A 14 44.775 -21.678 16.723 1.00 0.00 C ATOM 223 CG1 ILE A 14 45.498 -20.401 16.244 1.00 0.00 C ATOM 224 CG2 ILE A 14 45.439 -22.922 16.106 1.00 0.00 C ATOM 225 CD1 ILE A 14 46.862 -20.156 16.886 1.00 0.00 C ATOM 0 H ILE A 14 43.251 -20.174 17.933 1.00 0.00 H new ATOM 0 HA ILE A 14 43.229 -21.254 15.317 1.00 0.00 H new ATOM 0 HB ILE A 14 44.855 -21.785 17.805 1.00 0.00 H new ATOM 0 HG12 ILE A 14 45.626 -20.457 15.163 1.00 0.00 H new ATOM 0 HG13 ILE A 14 44.858 -19.542 16.445 1.00 0.00 H new ATOM 0 HG21 ILE A 14 46.490 -22.953 16.392 1.00 0.00 H new ATOM 0 HG22 ILE A 14 44.938 -23.819 16.468 1.00 0.00 H new ATOM 0 HG23 ILE A 14 45.360 -22.876 15.020 1.00 0.00 H new ATOM 0 HD11 ILE A 14 47.292 -19.237 16.487 1.00 0.00 H new ATOM 0 HD12 ILE A 14 46.745 -20.063 17.966 1.00 0.00 H new ATOM 0 HD13 ILE A 14 47.524 -20.993 16.664 1.00 0.00 H new ATOM 237 N GLN A 15 42.251 -23.393 17.670 1.00 0.00 N ATOM 238 CA GLN A 15 41.466 -24.620 17.872 1.00 0.00 C ATOM 239 C GLN A 15 40.051 -24.504 17.279 1.00 0.00 C ATOM 240 O GLN A 15 39.562 -25.453 16.666 1.00 0.00 O ATOM 241 CB GLN A 15 41.390 -24.975 19.362 1.00 0.00 C ATOM 242 CG GLN A 15 42.747 -25.462 19.894 1.00 0.00 C ATOM 243 CD GLN A 15 42.606 -26.108 21.267 1.00 0.00 C ATOM 244 OE1 GLN A 15 42.844 -25.508 22.308 1.00 0.00 O ATOM 245 NE2 GLN A 15 42.200 -27.360 21.315 1.00 0.00 N ATOM 0 H GLN A 15 42.566 -22.957 18.537 1.00 0.00 H new ATOM 0 HA GLN A 15 41.980 -25.421 17.342 1.00 0.00 H new ATOM 0 HB2 GLN A 15 41.068 -24.102 19.929 1.00 0.00 H new ATOM 0 HB3 GLN A 15 40.639 -25.750 19.515 1.00 0.00 H new ATOM 0 HG2 GLN A 15 43.177 -26.179 19.195 1.00 0.00 H new ATOM 0 HG3 GLN A 15 43.439 -24.622 19.955 1.00 0.00 H new ATOM 0 HE21 GLN A 15 42.000 -27.865 20.451 1.00 0.00 H new ATOM 0 HE22 GLN A 15 42.085 -27.825 22.216 1.00 0.00 H new ATOM 254 N SER A 16 39.404 -23.342 17.417 1.00 0.00 N ATOM 255 CA SER A 16 38.070 -23.084 16.856 1.00 0.00 C ATOM 256 C SER A 16 38.065 -23.128 15.322 1.00 0.00 C ATOM 257 O SER A 16 37.173 -23.737 14.731 1.00 0.00 O ATOM 258 CB SER A 16 37.534 -21.730 17.322 1.00 0.00 C ATOM 259 OG SER A 16 37.349 -21.712 18.727 1.00 0.00 O ATOM 0 H SER A 16 39.793 -22.547 17.925 1.00 0.00 H new ATOM 0 HA SER A 16 37.423 -23.881 17.222 1.00 0.00 H new ATOM 0 HB2 SER A 16 38.229 -20.941 17.033 1.00 0.00 H new ATOM 0 HB3 SER A 16 36.587 -21.519 16.824 1.00 0.00 H new ATOM 0 HG SER A 16 38.219 -21.633 19.171 1.00 0.00 H new ATOM 265 N LEU A 17 39.065 -22.530 14.658 1.00 0.00 N ATOM 266 CA LEU A 17 39.183 -22.574 13.196 1.00 0.00 C ATOM 267 C LEU A 17 39.501 -24.005 12.727 1.00 0.00 C ATOM 268 O LEU A 17 38.900 -24.475 11.764 1.00 0.00 O ATOM 269 CB LEU A 17 40.220 -21.541 12.717 1.00 0.00 C ATOM 270 CG LEU A 17 40.354 -21.428 11.181 1.00 0.00 C ATOM 271 CD1 LEU A 17 39.041 -21.119 10.448 1.00 0.00 C ATOM 272 CD2 LEU A 17 41.350 -20.321 10.835 1.00 0.00 C ATOM 0 H LEU A 17 39.810 -22.006 15.117 1.00 0.00 H new ATOM 0 HA LEU A 17 38.230 -22.301 12.742 1.00 0.00 H new ATOM 0 HB2 LEU A 17 39.952 -20.564 13.118 1.00 0.00 H new ATOM 0 HB3 LEU A 17 41.192 -21.801 13.135 1.00 0.00 H new ATOM 0 HG LEU A 17 40.689 -22.410 10.847 1.00 0.00 H new ATOM 0 HD11 LEU A 17 39.229 -21.058 9.376 1.00 0.00 H new ATOM 0 HD12 LEU A 17 38.319 -21.911 10.645 1.00 0.00 H new ATOM 0 HD13 LEU A 17 38.642 -20.168 10.802 1.00 0.00 H new ATOM 0 HD21 LEU A 17 41.444 -20.242 9.752 1.00 0.00 H new ATOM 0 HD22 LEU A 17 40.995 -19.373 11.239 1.00 0.00 H new ATOM 0 HD23 LEU A 17 42.322 -20.558 11.267 1.00 0.00 H new ATOM 284 N VAL A 18 40.380 -24.727 13.435 1.00 0.00 N ATOM 285 CA VAL A 18 40.695 -26.144 13.157 1.00 0.00 C ATOM 286 C VAL A 18 39.431 -27.008 13.259 1.00 0.00 C ATOM 287 O VAL A 18 39.183 -27.831 12.374 1.00 0.00 O ATOM 288 CB VAL A 18 41.806 -26.651 14.099 1.00 0.00 C ATOM 289 CG1 VAL A 18 41.917 -28.180 14.109 1.00 0.00 C ATOM 290 CG2 VAL A 18 43.171 -26.089 13.685 1.00 0.00 C ATOM 0 H VAL A 18 40.900 -24.345 14.225 1.00 0.00 H new ATOM 0 HA VAL A 18 41.068 -26.223 12.136 1.00 0.00 H new ATOM 0 HB VAL A 18 41.530 -26.307 15.096 1.00 0.00 H new ATOM 0 HG11 VAL A 18 42.714 -28.483 14.788 1.00 0.00 H new ATOM 0 HG12 VAL A 18 40.973 -28.611 14.442 1.00 0.00 H new ATOM 0 HG13 VAL A 18 42.143 -28.535 13.104 1.00 0.00 H new ATOM 0 HG21 VAL A 18 43.939 -26.460 14.364 1.00 0.00 H new ATOM 0 HG22 VAL A 18 43.402 -26.406 12.668 1.00 0.00 H new ATOM 0 HG23 VAL A 18 43.144 -25.000 13.728 1.00 0.00 H new ATOM 300 N HIS A 19 38.610 -26.815 14.300 1.00 0.00 N ATOM 301 CA HIS A 19 37.325 -27.506 14.462 1.00 0.00 C ATOM 302 C HIS A 19 36.421 -27.194 13.260 1.00 0.00 C ATOM 303 O HIS A 19 35.973 -28.113 12.576 1.00 0.00 O ATOM 304 CB HIS A 19 36.669 -27.098 15.799 1.00 0.00 C ATOM 305 CG HIS A 19 35.273 -27.652 16.023 1.00 0.00 C ATOM 306 ND1 HIS A 19 34.899 -28.608 16.943 1.00 0.00 N ATOM 307 CD2 HIS A 19 34.124 -27.258 15.385 1.00 0.00 C ATOM 308 CE1 HIS A 19 33.566 -28.786 16.846 1.00 0.00 C ATOM 309 NE2 HIS A 19 33.040 -27.987 15.899 1.00 0.00 N ATOM 0 H HIS A 19 38.822 -26.169 15.060 1.00 0.00 H new ATOM 0 HA HIS A 19 37.484 -28.584 14.493 1.00 0.00 H new ATOM 0 HB2 HIS A 19 37.310 -27.427 16.617 1.00 0.00 H new ATOM 0 HB3 HIS A 19 36.624 -26.010 15.848 1.00 0.00 H new ATOM 0 HD2 HIS A 19 34.063 -26.507 14.611 1.00 0.00 H new ATOM 0 HE1 HIS A 19 32.996 -29.478 17.448 1.00 0.00 H new ATOM 0 HE2 HIS A 19 32.062 -27.925 15.615 1.00 0.00 H new ATOM 317 N ALA A 20 36.196 -25.912 12.954 1.00 0.00 N ATOM 318 CA ALA A 20 35.369 -25.467 11.831 1.00 0.00 C ATOM 319 C ALA A 20 35.818 -26.016 10.463 1.00 0.00 C ATOM 320 O ALA A 20 34.973 -26.306 9.614 1.00 0.00 O ATOM 321 CB ALA A 20 35.355 -23.939 11.834 1.00 0.00 C ATOM 0 H ALA A 20 36.592 -25.141 13.491 1.00 0.00 H new ATOM 0 HA ALA A 20 34.366 -25.869 11.972 1.00 0.00 H new ATOM 0 HB1 ALA A 20 34.745 -23.579 11.006 1.00 0.00 H new ATOM 0 HB2 ALA A 20 34.937 -23.581 12.775 1.00 0.00 H new ATOM 0 HB3 ALA A 20 36.373 -23.566 11.724 1.00 0.00 H new ATOM 327 N CYS A 21 37.128 -26.196 10.248 1.00 0.00 N ATOM 328 CA CYS A 21 37.689 -26.770 9.019 1.00 0.00 C ATOM 329 C CYS A 21 37.364 -28.271 8.837 1.00 0.00 C ATOM 330 O CYS A 21 37.563 -28.813 7.747 1.00 0.00 O ATOM 331 CB CYS A 21 39.204 -26.518 8.993 1.00 0.00 C ATOM 332 SG CYS A 21 39.518 -24.751 8.706 1.00 0.00 S ATOM 0 H CYS A 21 37.839 -25.943 10.935 1.00 0.00 H new ATOM 0 HA CYS A 21 37.215 -26.270 8.174 1.00 0.00 H new ATOM 0 HB2 CYS A 21 39.652 -26.829 9.937 1.00 0.00 H new ATOM 0 HB3 CYS A 21 39.669 -27.114 8.208 1.00 0.00 H new ATOM 0 HG CYS A 21 39.369 -24.097 9.820 1.00 0.00 H new ATOM 338 N GLN A 22 36.857 -28.940 9.879 1.00 0.00 N ATOM 339 CA GLN A 22 36.457 -30.358 9.884 1.00 0.00 C ATOM 340 C GLN A 22 34.945 -30.538 10.121 1.00 0.00 C ATOM 341 O GLN A 22 34.358 -31.531 9.677 1.00 0.00 O ATOM 342 CB GLN A 22 37.238 -31.093 10.984 1.00 0.00 C ATOM 343 CG GLN A 22 38.756 -31.100 10.755 1.00 0.00 C ATOM 344 CD GLN A 22 39.489 -31.541 12.016 1.00 0.00 C ATOM 345 OE1 GLN A 22 39.803 -32.707 12.221 1.00 0.00 O ATOM 346 NE2 GLN A 22 39.779 -30.619 12.908 1.00 0.00 N ATOM 0 H GLN A 22 36.706 -28.491 10.783 1.00 0.00 H new ATOM 0 HA GLN A 22 36.685 -30.774 8.903 1.00 0.00 H new ATOM 0 HB2 GLN A 22 37.025 -30.624 11.945 1.00 0.00 H new ATOM 0 HB3 GLN A 22 36.883 -32.122 11.046 1.00 0.00 H new ATOM 0 HG2 GLN A 22 39.002 -31.771 9.932 1.00 0.00 H new ATOM 0 HG3 GLN A 22 39.089 -30.104 10.464 1.00 0.00 H new ATOM 0 HE21 GLN A 22 39.519 -29.647 12.740 1.00 0.00 H new ATOM 0 HE22 GLN A 22 40.264 -30.876 13.768 1.00 0.00 H new ATOM 355 N CYS A 23 34.312 -29.595 10.824 1.00 0.00 N ATOM 356 CA CYS A 23 32.891 -29.570 11.147 1.00 0.00 C ATOM 357 C CYS A 23 32.002 -29.338 9.902 1.00 0.00 C ATOM 358 O CYS A 23 32.471 -28.921 8.837 1.00 0.00 O ATOM 359 CB CYS A 23 32.693 -28.517 12.249 1.00 0.00 C ATOM 360 SG CYS A 23 31.074 -28.692 13.050 1.00 0.00 S ATOM 0 H CYS A 23 34.808 -28.787 11.201 1.00 0.00 H new ATOM 0 HA CYS A 23 32.568 -30.544 11.515 1.00 0.00 H new ATOM 0 HB2 CYS A 23 33.482 -28.616 12.995 1.00 0.00 H new ATOM 0 HB3 CYS A 23 32.783 -27.519 11.821 1.00 0.00 H new ATOM 0 HG CYS A 23 30.646 -29.911 12.902 1.00 0.00 H new ATOM 365 N ARG A 24 30.704 -29.616 10.053 1.00 0.00 N ATOM 366 CA ARG A 24 29.659 -29.539 9.007 1.00 0.00 C ATOM 367 C ARG A 24 28.363 -28.841 9.436 1.00 0.00 C ATOM 368 O ARG A 24 27.569 -28.456 8.577 1.00 0.00 O ATOM 369 CB ARG A 24 29.361 -30.962 8.522 1.00 0.00 C ATOM 370 CG ARG A 24 30.373 -31.385 7.441 1.00 0.00 C ATOM 371 CD ARG A 24 30.897 -32.797 7.663 1.00 0.00 C ATOM 372 NE ARG A 24 31.828 -32.863 8.811 1.00 0.00 N ATOM 373 CZ ARG A 24 31.738 -33.615 9.892 1.00 0.00 C ATOM 374 NH1 ARG A 24 30.754 -34.443 10.104 1.00 0.00 N ATOM 375 NH2 ARG A 24 32.670 -33.535 10.794 1.00 0.00 N ATOM 0 H ARG A 24 30.326 -29.917 10.951 1.00 0.00 H new ATOM 0 HA ARG A 24 30.057 -28.913 8.208 1.00 0.00 H new ATOM 0 HB2 ARG A 24 29.405 -31.656 9.362 1.00 0.00 H new ATOM 0 HB3 ARG A 24 28.349 -31.012 8.121 1.00 0.00 H new ATOM 0 HG2 ARG A 24 29.901 -31.325 6.460 1.00 0.00 H new ATOM 0 HG3 ARG A 24 31.209 -30.686 7.435 1.00 0.00 H new ATOM 0 HD2 ARG A 24 30.059 -33.473 7.835 1.00 0.00 H new ATOM 0 HD3 ARG A 24 31.405 -33.142 6.763 1.00 0.00 H new ATOM 0 HE ARG A 24 32.642 -32.250 8.761 1.00 0.00 H new ATOM 0 HH11 ARG A 24 30.006 -34.532 9.417 1.00 0.00 H new ATOM 0 HH12 ARG A 24 30.732 -35.002 10.957 1.00 0.00 H new ATOM 0 HH21 ARG A 24 33.456 -32.898 10.661 1.00 0.00 H new ATOM 0 HH22 ARG A 24 32.616 -34.109 11.635 1.00 0.00 H new ATOM 389 N ASN A 25 28.141 -28.665 10.739 1.00 0.00 N ATOM 390 CA ASN A 25 26.947 -28.013 11.291 1.00 0.00 C ATOM 391 C ASN A 25 26.846 -26.542 10.837 1.00 0.00 C ATOM 392 O ASN A 25 27.725 -25.743 11.163 1.00 0.00 O ATOM 393 CB ASN A 25 27.012 -28.066 12.827 1.00 0.00 C ATOM 394 CG ASN A 25 27.077 -29.455 13.433 1.00 0.00 C ATOM 395 OD1 ASN A 25 26.394 -30.383 13.019 1.00 0.00 O ATOM 396 ND2 ASN A 25 27.902 -29.633 14.437 1.00 0.00 N ATOM 0 H ASN A 25 28.796 -28.976 11.456 1.00 0.00 H new ATOM 0 HA ASN A 25 26.067 -28.542 10.925 1.00 0.00 H new ATOM 0 HB2 ASN A 25 27.887 -27.505 13.155 1.00 0.00 H new ATOM 0 HB3 ASN A 25 26.137 -27.555 13.228 1.00 0.00 H new ATOM 0 HD21 ASN A 25 27.978 -30.549 14.878 1.00 0.00 H new ATOM 0 HD22 ASN A 25 28.468 -28.855 14.776 1.00 0.00 H new ATOM 403 N ALA A 26 25.778 -26.156 10.131 1.00 0.00 N ATOM 404 CA ALA A 26 25.563 -24.765 9.695 1.00 0.00 C ATOM 405 C ALA A 26 25.442 -23.769 10.870 1.00 0.00 C ATOM 406 O ALA A 26 25.734 -22.577 10.723 1.00 0.00 O ATOM 407 CB ALA A 26 24.319 -24.730 8.798 1.00 0.00 C ATOM 0 H ALA A 26 25.037 -26.795 9.844 1.00 0.00 H new ATOM 0 HA ALA A 26 26.441 -24.438 9.138 1.00 0.00 H new ATOM 0 HB1 ALA A 26 24.141 -23.708 8.463 1.00 0.00 H new ATOM 0 HB2 ALA A 26 24.476 -25.373 7.932 1.00 0.00 H new ATOM 0 HB3 ALA A 26 23.455 -25.084 9.360 1.00 0.00 H new ATOM 413 N ASN A 27 25.022 -24.264 12.039 1.00 0.00 N ATOM 414 CA ASN A 27 24.827 -23.519 13.284 1.00 0.00 C ATOM 415 C ASN A 27 25.290 -24.370 14.495 1.00 0.00 C ATOM 416 O ASN A 27 24.507 -24.648 15.408 1.00 0.00 O ATOM 417 CB ASN A 27 23.360 -23.049 13.372 1.00 0.00 C ATOM 418 CG ASN A 27 22.984 -22.077 12.264 1.00 0.00 C ATOM 419 OD1 ASN A 27 23.248 -20.883 12.328 1.00 0.00 O ATOM 420 ND2 ASN A 27 22.373 -22.552 11.202 1.00 0.00 N ATOM 0 H ASN A 27 24.796 -25.253 12.146 1.00 0.00 H new ATOM 0 HA ASN A 27 25.446 -22.622 13.299 1.00 0.00 H new ATOM 0 HB2 ASN A 27 22.702 -23.917 13.326 1.00 0.00 H new ATOM 0 HB3 ASN A 27 23.193 -22.573 14.338 1.00 0.00 H new ATOM 0 HD21 ASN A 27 22.121 -21.927 10.436 1.00 0.00 H new ATOM 0 HD22 ASN A 27 22.151 -23.546 11.143 1.00 0.00 H new ATOM 427 N CYS A 28 26.554 -24.824 14.470 1.00 0.00 N ATOM 428 CA CYS A 28 27.204 -25.649 15.502 1.00 0.00 C ATOM 429 C CYS A 28 27.028 -25.084 16.929 1.00 0.00 C ATOM 430 O CYS A 28 26.884 -23.872 17.120 1.00 0.00 O ATOM 431 CB CYS A 28 28.694 -25.765 15.132 1.00 0.00 C ATOM 432 SG CYS A 28 29.468 -27.249 15.852 1.00 0.00 S ATOM 0 H CYS A 28 27.180 -24.616 13.692 1.00 0.00 H new ATOM 0 HA CYS A 28 26.729 -26.630 15.522 1.00 0.00 H new ATOM 0 HB2 CYS A 28 28.796 -25.794 14.047 1.00 0.00 H new ATOM 0 HB3 CYS A 28 29.223 -24.877 15.478 1.00 0.00 H new ATOM 0 HG CYS A 28 30.107 -27.898 14.925 1.00 0.00 H new ATOM 437 N SER A 29 27.056 -25.938 17.955 1.00 0.00 N ATOM 438 CA SER A 29 26.889 -25.507 19.351 1.00 0.00 C ATOM 439 C SER A 29 28.007 -24.588 19.872 1.00 0.00 C ATOM 440 O SER A 29 27.788 -23.859 20.844 1.00 0.00 O ATOM 441 CB SER A 29 26.709 -26.714 20.281 1.00 0.00 C ATOM 442 OG SER A 29 27.847 -27.563 20.251 1.00 0.00 O ATOM 0 H SER A 29 27.194 -26.943 17.846 1.00 0.00 H new ATOM 0 HA SER A 29 25.982 -24.902 19.357 1.00 0.00 H new ATOM 0 HB2 SER A 29 26.538 -26.368 21.300 1.00 0.00 H new ATOM 0 HB3 SER A 29 25.825 -27.277 19.983 1.00 0.00 H new ATOM 0 HG SER A 29 27.705 -28.322 20.854 1.00 0.00 H new ATOM 448 N LEU A 30 29.175 -24.557 19.218 1.00 0.00 N ATOM 449 CA LEU A 30 30.264 -23.635 19.554 1.00 0.00 C ATOM 450 C LEU A 30 29.989 -22.258 18.915 1.00 0.00 C ATOM 451 O LEU A 30 29.778 -22.184 17.699 1.00 0.00 O ATOM 452 CB LEU A 30 31.615 -24.187 19.062 1.00 0.00 C ATOM 453 CG LEU A 30 32.282 -25.205 20.004 1.00 0.00 C ATOM 454 CD1 LEU A 30 33.562 -25.731 19.351 1.00 0.00 C ATOM 455 CD2 LEU A 30 32.672 -24.584 21.352 1.00 0.00 C ATOM 0 H LEU A 30 29.391 -25.175 18.436 1.00 0.00 H new ATOM 0 HA LEU A 30 30.313 -23.528 20.638 1.00 0.00 H new ATOM 0 HB2 LEU A 30 31.466 -24.657 18.090 1.00 0.00 H new ATOM 0 HB3 LEU A 30 32.299 -23.352 18.911 1.00 0.00 H new ATOM 0 HG LEU A 30 31.558 -26.001 20.181 1.00 0.00 H new ATOM 0 HD11 LEU A 30 34.039 -26.453 20.014 1.00 0.00 H new ATOM 0 HD12 LEU A 30 33.316 -26.214 18.406 1.00 0.00 H new ATOM 0 HD13 LEU A 30 34.244 -24.901 19.167 1.00 0.00 H new ATOM 0 HD21 LEU A 30 33.139 -25.342 21.981 1.00 0.00 H new ATOM 0 HD22 LEU A 30 33.375 -23.767 21.187 1.00 0.00 H new ATOM 0 HD23 LEU A 30 31.780 -24.201 21.848 1.00 0.00 H new ATOM 467 N PRO A 31 30.013 -21.151 19.686 1.00 0.00 N ATOM 468 CA PRO A 31 29.768 -19.809 19.151 1.00 0.00 C ATOM 469 C PRO A 31 30.836 -19.386 18.130 1.00 0.00 C ATOM 470 O PRO A 31 30.533 -18.678 17.168 1.00 0.00 O ATOM 471 CB PRO A 31 29.730 -18.883 20.373 1.00 0.00 C ATOM 472 CG PRO A 31 30.558 -19.626 21.424 1.00 0.00 C ATOM 473 CD PRO A 31 30.276 -21.092 21.117 1.00 0.00 C ATOM 0 HA PRO A 31 28.832 -19.768 18.595 1.00 0.00 H new ATOM 0 HB2 PRO A 31 30.156 -17.905 20.147 1.00 0.00 H new ATOM 0 HB3 PRO A 31 28.709 -18.714 20.715 1.00 0.00 H new ATOM 0 HG2 PRO A 31 31.619 -19.394 21.338 1.00 0.00 H new ATOM 0 HG3 PRO A 31 30.254 -19.361 22.437 1.00 0.00 H new ATOM 0 HD2 PRO A 31 31.127 -21.719 21.385 1.00 0.00 H new ATOM 0 HD3 PRO A 31 29.421 -21.454 21.688 1.00 0.00 H new ATOM 481 N SER A 32 32.079 -19.846 18.309 1.00 0.00 N ATOM 482 CA SER A 32 33.195 -19.581 17.400 1.00 0.00 C ATOM 483 C SER A 32 33.059 -20.354 16.083 1.00 0.00 C ATOM 484 O SER A 32 33.178 -19.744 15.028 1.00 0.00 O ATOM 485 CB SER A 32 34.516 -19.915 18.094 1.00 0.00 C ATOM 486 OG SER A 32 34.486 -21.231 18.622 1.00 0.00 O ATOM 0 H SER A 32 32.341 -20.425 19.107 1.00 0.00 H new ATOM 0 HA SER A 32 33.180 -18.521 17.147 1.00 0.00 H new ATOM 0 HB2 SER A 32 35.339 -19.821 17.385 1.00 0.00 H new ATOM 0 HB3 SER A 32 34.702 -19.200 18.896 1.00 0.00 H new ATOM 0 HG SER A 32 35.402 -21.545 18.770 1.00 0.00 H new ATOM 492 N CYS A 33 32.774 -21.659 16.107 1.00 0.00 N ATOM 493 CA CYS A 33 32.580 -22.517 14.927 1.00 0.00 C ATOM 494 C CYS A 33 31.604 -21.900 13.897 1.00 0.00 C ATOM 495 O CYS A 33 31.929 -21.785 12.708 1.00 0.00 O ATOM 496 CB CYS A 33 32.125 -23.895 15.442 1.00 0.00 C ATOM 497 SG CYS A 33 31.905 -25.121 14.115 1.00 0.00 S ATOM 0 H CYS A 33 32.667 -22.171 16.983 1.00 0.00 H new ATOM 0 HA CYS A 33 33.514 -22.619 14.374 1.00 0.00 H new ATOM 0 HB2 CYS A 33 32.859 -24.269 16.155 1.00 0.00 H new ATOM 0 HB3 CYS A 33 31.185 -23.781 15.982 1.00 0.00 H new ATOM 0 HG CYS A 33 31.206 -26.122 14.561 1.00 0.00 H new ATOM 502 N GLN A 34 30.443 -21.408 14.357 1.00 0.00 N ATOM 503 CA GLN A 34 29.456 -20.723 13.505 1.00 0.00 C ATOM 504 C GLN A 34 30.047 -19.520 12.748 1.00 0.00 C ATOM 505 O GLN A 34 29.680 -19.267 11.597 1.00 0.00 O ATOM 506 CB GLN A 34 28.267 -20.211 14.338 1.00 0.00 C ATOM 507 CG GLN A 34 27.462 -21.310 15.046 1.00 0.00 C ATOM 508 CD GLN A 34 26.149 -20.796 15.648 1.00 0.00 C ATOM 509 OE1 GLN A 34 25.561 -19.811 15.217 1.00 0.00 O ATOM 510 NE2 GLN A 34 25.613 -21.451 16.655 1.00 0.00 N ATOM 0 H GLN A 34 30.160 -21.474 15.335 1.00 0.00 H new ATOM 0 HA GLN A 34 29.131 -21.471 12.782 1.00 0.00 H new ATOM 0 HB2 GLN A 34 28.639 -19.512 15.087 1.00 0.00 H new ATOM 0 HB3 GLN A 34 27.597 -19.652 13.685 1.00 0.00 H new ATOM 0 HG2 GLN A 34 27.242 -22.107 14.336 1.00 0.00 H new ATOM 0 HG3 GLN A 34 28.072 -21.747 15.837 1.00 0.00 H new ATOM 0 HE21 GLN A 34 26.080 -22.275 17.034 1.00 0.00 H new ATOM 0 HE22 GLN A 34 24.730 -21.135 17.057 1.00 0.00 H new ATOM 519 N LYS A 35 30.962 -18.788 13.390 1.00 0.00 N ATOM 520 CA LYS A 35 31.644 -17.605 12.856 1.00 0.00 C ATOM 521 C LYS A 35 32.806 -18.007 11.953 1.00 0.00 C ATOM 522 O LYS A 35 32.911 -17.499 10.843 1.00 0.00 O ATOM 523 CB LYS A 35 32.091 -16.771 14.074 1.00 0.00 C ATOM 524 CG LYS A 35 32.632 -15.371 13.771 1.00 0.00 C ATOM 525 CD LYS A 35 33.059 -14.719 15.103 1.00 0.00 C ATOM 526 CE LYS A 35 33.482 -13.255 14.947 1.00 0.00 C ATOM 527 NZ LYS A 35 32.325 -12.363 14.667 1.00 0.00 N ATOM 0 H LYS A 35 31.261 -19.014 14.339 1.00 0.00 H new ATOM 0 HA LYS A 35 30.985 -17.010 12.224 1.00 0.00 H new ATOM 0 HB2 LYS A 35 31.243 -16.672 14.751 1.00 0.00 H new ATOM 0 HB3 LYS A 35 32.861 -17.328 14.607 1.00 0.00 H new ATOM 0 HG2 LYS A 35 33.480 -15.431 13.088 1.00 0.00 H new ATOM 0 HG3 LYS A 35 31.869 -14.767 13.280 1.00 0.00 H new ATOM 0 HD2 LYS A 35 32.233 -14.779 15.811 1.00 0.00 H new ATOM 0 HD3 LYS A 35 33.886 -15.286 15.530 1.00 0.00 H new ATOM 0 HE2 LYS A 35 33.982 -12.924 15.857 1.00 0.00 H new ATOM 0 HE3 LYS A 35 34.207 -13.172 14.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 32.593 -11.663 13.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 31.526 -12.930 14.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 32.047 -11.871 15.540 1.00 0.00 H new ATOM 541 N MET A 36 33.631 -18.964 12.377 1.00 0.00 N ATOM 542 CA MET A 36 34.772 -19.495 11.624 1.00 0.00 C ATOM 543 C MET A 36 34.369 -20.046 10.253 1.00 0.00 C ATOM 544 O MET A 36 35.052 -19.790 9.258 1.00 0.00 O ATOM 545 CB MET A 36 35.468 -20.578 12.457 1.00 0.00 C ATOM 546 CG MET A 36 36.180 -20.016 13.688 1.00 0.00 C ATOM 547 SD MET A 36 37.506 -18.850 13.270 1.00 0.00 S ATOM 548 CE MET A 36 38.387 -18.814 14.844 1.00 0.00 C ATOM 0 H MET A 36 33.521 -19.409 13.288 1.00 0.00 H new ATOM 0 HA MET A 36 35.460 -18.671 11.435 1.00 0.00 H new ATOM 0 HB2 MET A 36 34.730 -21.315 12.775 1.00 0.00 H new ATOM 0 HB3 MET A 36 36.192 -21.101 11.832 1.00 0.00 H new ATOM 0 HG2 MET A 36 35.451 -19.515 14.325 1.00 0.00 H new ATOM 0 HG3 MET A 36 36.597 -20.840 14.267 1.00 0.00 H new ATOM 0 HE1 MET A 36 39.348 -18.318 14.712 1.00 0.00 H new ATOM 0 HE2 MET A 36 37.795 -18.269 15.580 1.00 0.00 H new ATOM 0 HE3 MET A 36 38.550 -19.834 15.193 1.00 0.00 H new ATOM 558 N LYS A 37 33.231 -20.747 10.171 1.00 0.00 N ATOM 559 CA LYS A 37 32.684 -21.227 8.894 1.00 0.00 C ATOM 560 C LYS A 37 32.333 -20.054 7.980 1.00 0.00 C ATOM 561 O LYS A 37 32.733 -20.039 6.821 1.00 0.00 O ATOM 562 CB LYS A 37 31.447 -22.103 9.152 1.00 0.00 C ATOM 563 CG LYS A 37 31.865 -23.487 9.658 1.00 0.00 C ATOM 564 CD LYS A 37 30.673 -24.258 10.224 1.00 0.00 C ATOM 565 CE LYS A 37 31.147 -25.650 10.642 1.00 0.00 C ATOM 566 NZ LYS A 37 30.409 -26.118 11.823 1.00 0.00 N ATOM 0 H LYS A 37 32.666 -20.997 10.983 1.00 0.00 H new ATOM 0 HA LYS A 37 33.442 -21.828 8.392 1.00 0.00 H new ATOM 0 HB2 LYS A 37 30.800 -21.622 9.885 1.00 0.00 H new ATOM 0 HB3 LYS A 37 30.868 -22.205 8.234 1.00 0.00 H new ATOM 0 HG2 LYS A 37 32.313 -24.054 8.842 1.00 0.00 H new ATOM 0 HG3 LYS A 37 32.629 -23.379 10.428 1.00 0.00 H new ATOM 0 HD2 LYS A 37 30.252 -23.729 11.079 1.00 0.00 H new ATOM 0 HD3 LYS A 37 29.883 -24.336 9.477 1.00 0.00 H new ATOM 0 HE2 LYS A 37 31.006 -26.350 9.818 1.00 0.00 H new ATOM 0 HE3 LYS A 37 32.215 -25.625 10.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 30.498 -27.151 11.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 30.801 -25.671 12.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 29.405 -25.863 11.728 1.00 0.00 H new ATOM 580 N ARG A 38 31.643 -19.032 8.494 1.00 0.00 N ATOM 581 CA ARG A 38 31.261 -17.843 7.707 1.00 0.00 C ATOM 582 C ARG A 38 32.485 -17.032 7.271 1.00 0.00 C ATOM 583 O ARG A 38 32.531 -16.550 6.143 1.00 0.00 O ATOM 584 CB ARG A 38 30.208 -17.052 8.495 1.00 0.00 C ATOM 585 CG ARG A 38 28.891 -17.842 8.420 1.00 0.00 C ATOM 586 CD ARG A 38 27.835 -17.383 9.422 1.00 0.00 C ATOM 587 NE ARG A 38 26.606 -18.183 9.243 1.00 0.00 N ATOM 588 CZ ARG A 38 26.347 -19.385 9.733 1.00 0.00 C ATOM 589 NH1 ARG A 38 27.134 -19.998 10.566 1.00 0.00 N ATOM 590 NH2 ARG A 38 25.285 -20.049 9.389 1.00 0.00 N ATOM 0 H ARG A 38 31.331 -19.000 9.465 1.00 0.00 H new ATOM 0 HA ARG A 38 30.801 -18.139 6.764 1.00 0.00 H new ATOM 0 HB2 ARG A 38 30.520 -16.923 9.531 1.00 0.00 H new ATOM 0 HB3 ARG A 38 30.082 -16.055 8.074 1.00 0.00 H new ATOM 0 HG2 ARG A 38 28.484 -17.755 7.413 1.00 0.00 H new ATOM 0 HG3 ARG A 38 29.102 -18.898 8.588 1.00 0.00 H new ATOM 0 HD2 ARG A 38 28.210 -17.496 10.439 1.00 0.00 H new ATOM 0 HD3 ARG A 38 27.617 -16.325 9.278 1.00 0.00 H new ATOM 0 HE ARG A 38 25.871 -17.760 8.676 1.00 0.00 H new ATOM 0 HH11 ARG A 38 27.999 -19.553 10.872 1.00 0.00 H new ATOM 0 HH12 ARG A 38 26.887 -20.925 10.913 1.00 0.00 H new ATOM 0 HH21 ARG A 38 24.624 -19.646 8.725 1.00 0.00 H new ATOM 0 HH22 ARG A 38 25.112 -20.974 9.783 1.00 0.00 H new ATOM 604 N VAL A 39 33.506 -16.967 8.122 1.00 0.00 N ATOM 605 CA VAL A 39 34.812 -16.348 7.839 1.00 0.00 C ATOM 606 C VAL A 39 35.522 -17.053 6.675 1.00 0.00 C ATOM 607 O VAL A 39 35.884 -16.385 5.706 1.00 0.00 O ATOM 608 CB VAL A 39 35.682 -16.358 9.113 1.00 0.00 C ATOM 609 CG1 VAL A 39 37.146 -16.014 8.872 1.00 0.00 C ATOM 610 CG2 VAL A 39 35.198 -15.326 10.126 1.00 0.00 C ATOM 0 H VAL A 39 33.451 -17.356 9.063 1.00 0.00 H new ATOM 0 HA VAL A 39 34.649 -15.314 7.536 1.00 0.00 H new ATOM 0 HB VAL A 39 35.592 -17.383 9.473 1.00 0.00 H new ATOM 0 HG11 VAL A 39 37.687 -16.043 9.818 1.00 0.00 H new ATOM 0 HG12 VAL A 39 37.581 -16.737 8.182 1.00 0.00 H new ATOM 0 HG13 VAL A 39 37.219 -15.015 8.443 1.00 0.00 H new ATOM 0 HG21 VAL A 39 35.833 -15.360 11.011 1.00 0.00 H new ATOM 0 HG22 VAL A 39 35.246 -14.331 9.683 1.00 0.00 H new ATOM 0 HG23 VAL A 39 34.169 -15.548 10.409 1.00 0.00 H new ATOM 620 N VAL A 40 35.710 -18.385 6.722 1.00 0.00 N ATOM 621 CA VAL A 40 36.372 -19.095 5.608 1.00 0.00 C ATOM 622 C VAL A 40 35.536 -18.994 4.322 1.00 0.00 C ATOM 623 O VAL A 40 36.093 -18.719 3.263 1.00 0.00 O ATOM 624 CB VAL A 40 36.778 -20.546 5.948 1.00 0.00 C ATOM 625 CG1 VAL A 40 35.637 -21.566 5.929 1.00 0.00 C ATOM 626 CG2 VAL A 40 37.854 -21.023 4.962 1.00 0.00 C ATOM 0 H VAL A 40 35.422 -18.981 7.498 1.00 0.00 H new ATOM 0 HA VAL A 40 37.318 -18.585 5.430 1.00 0.00 H new ATOM 0 HB VAL A 40 37.139 -20.502 6.975 1.00 0.00 H new ATOM 0 HG11 VAL A 40 36.027 -22.552 6.181 1.00 0.00 H new ATOM 0 HG12 VAL A 40 34.879 -21.278 6.658 1.00 0.00 H new ATOM 0 HG13 VAL A 40 35.191 -21.595 4.935 1.00 0.00 H new ATOM 0 HG21 VAL A 40 38.140 -22.047 5.203 1.00 0.00 H new ATOM 0 HG22 VAL A 40 37.459 -20.986 3.947 1.00 0.00 H new ATOM 0 HG23 VAL A 40 38.728 -20.376 5.036 1.00 0.00 H new ATOM 636 N GLN A 41 34.206 -19.152 4.402 1.00 0.00 N ATOM 637 CA GLN A 41 33.287 -19.011 3.260 1.00 0.00 C ATOM 638 C GLN A 41 33.380 -17.625 2.610 1.00 0.00 C ATOM 639 O GLN A 41 33.388 -17.534 1.382 1.00 0.00 O ATOM 640 CB GLN A 41 31.842 -19.286 3.692 1.00 0.00 C ATOM 641 CG GLN A 41 31.550 -20.776 3.976 1.00 0.00 C ATOM 642 CD GLN A 41 31.776 -21.697 2.781 1.00 0.00 C ATOM 643 OE1 GLN A 41 32.767 -22.411 2.693 1.00 0.00 O ATOM 644 NE2 GLN A 41 30.880 -21.723 1.817 1.00 0.00 N ATOM 0 H GLN A 41 33.731 -19.385 5.274 1.00 0.00 H new ATOM 0 HA GLN A 41 33.590 -19.749 2.517 1.00 0.00 H new ATOM 0 HB2 GLN A 41 31.624 -18.705 4.588 1.00 0.00 H new ATOM 0 HB3 GLN A 41 31.166 -18.935 2.912 1.00 0.00 H new ATOM 0 HG2 GLN A 41 32.181 -21.108 4.800 1.00 0.00 H new ATOM 0 HG3 GLN A 41 30.516 -20.875 4.306 1.00 0.00 H new ATOM 0 HE21 GLN A 41 30.050 -21.134 1.877 1.00 0.00 H new ATOM 0 HE22 GLN A 41 31.016 -22.332 1.010 1.00 0.00 H new ATOM 653 N HIS A 42 33.493 -16.556 3.410 1.00 0.00 N ATOM 654 CA HIS A 42 33.717 -15.208 2.880 1.00 0.00 C ATOM 655 C HIS A 42 35.022 -15.181 2.067 1.00 0.00 C ATOM 656 O HIS A 42 35.006 -14.859 0.877 1.00 0.00 O ATOM 657 CB HIS A 42 33.737 -14.158 4.016 1.00 0.00 C ATOM 658 CG HIS A 42 34.411 -12.863 3.608 1.00 0.00 C ATOM 659 ND1 HIS A 42 33.849 -11.848 2.865 1.00 0.00 N ATOM 660 CD2 HIS A 42 35.765 -12.640 3.627 1.00 0.00 C ATOM 661 CE1 HIS A 42 34.846 -11.067 2.407 1.00 0.00 C ATOM 662 NE2 HIS A 42 36.035 -11.531 2.822 1.00 0.00 N ATOM 0 H HIS A 42 33.433 -16.601 4.427 1.00 0.00 H new ATOM 0 HA HIS A 42 32.891 -14.947 2.219 1.00 0.00 H new ATOM 0 HB2 HIS A 42 32.714 -13.947 4.328 1.00 0.00 H new ATOM 0 HB3 HIS A 42 34.254 -14.575 4.880 1.00 0.00 H new ATOM 0 HD2 HIS A 42 36.495 -13.221 4.170 1.00 0.00 H new ATOM 0 HE1 HIS A 42 34.708 -10.190 1.792 1.00 0.00 H new ATOM 0 HE2 HIS A 42 36.953 -11.150 2.595 1.00 0.00 H new ATOM 670 N THR A 43 36.150 -15.554 2.684 1.00 0.00 N ATOM 671 CA THR A 43 37.469 -15.521 2.038 1.00 0.00 C ATOM 672 C THR A 43 37.540 -16.370 0.772 1.00 0.00 C ATOM 673 O THR A 43 38.130 -15.934 -0.222 1.00 0.00 O ATOM 674 CB THR A 43 38.563 -15.910 3.040 1.00 0.00 C ATOM 675 OG1 THR A 43 38.722 -14.861 3.960 1.00 0.00 O ATOM 676 CG2 THR A 43 39.919 -16.179 2.390 1.00 0.00 C ATOM 0 H THR A 43 36.174 -15.888 3.647 1.00 0.00 H new ATOM 0 HA THR A 43 37.639 -14.495 1.713 1.00 0.00 H new ATOM 0 HB THR A 43 38.240 -16.836 3.516 1.00 0.00 H new ATOM 0 HG1 THR A 43 38.730 -14.005 3.482 1.00 0.00 H new ATOM 0 HG21 THR A 43 40.644 -16.448 3.158 1.00 0.00 H new ATOM 0 HG22 THR A 43 39.825 -16.998 1.677 1.00 0.00 H new ATOM 0 HG23 THR A 43 40.258 -15.283 1.870 1.00 0.00 H new ATOM 684 N LYS A 44 36.891 -17.541 0.781 1.00 0.00 N ATOM 685 CA LYS A 44 36.768 -18.487 -0.343 1.00 0.00 C ATOM 686 C LYS A 44 36.163 -17.864 -1.616 1.00 0.00 C ATOM 687 O LYS A 44 36.344 -18.423 -2.699 1.00 0.00 O ATOM 688 CB LYS A 44 35.915 -19.684 0.121 1.00 0.00 C ATOM 689 CG LYS A 44 36.698 -20.820 0.796 1.00 0.00 C ATOM 690 CD LYS A 44 35.670 -21.804 1.376 1.00 0.00 C ATOM 691 CE LYS A 44 36.281 -23.064 1.990 1.00 0.00 C ATOM 692 NZ LYS A 44 35.203 -24.016 2.375 1.00 0.00 N ATOM 0 H LYS A 44 36.410 -17.875 1.616 1.00 0.00 H new ATOM 0 HA LYS A 44 37.774 -18.801 -0.620 1.00 0.00 H new ATOM 0 HB2 LYS A 44 35.158 -19.322 0.817 1.00 0.00 H new ATOM 0 HB3 LYS A 44 35.387 -20.090 -0.742 1.00 0.00 H new ATOM 0 HG2 LYS A 44 37.345 -21.321 0.076 1.00 0.00 H new ATOM 0 HG3 LYS A 44 37.341 -20.428 1.584 1.00 0.00 H new ATOM 0 HD2 LYS A 44 35.083 -21.291 2.138 1.00 0.00 H new ATOM 0 HD3 LYS A 44 34.979 -22.098 0.585 1.00 0.00 H new ATOM 0 HE2 LYS A 44 36.956 -23.536 1.276 1.00 0.00 H new ATOM 0 HE3 LYS A 44 36.875 -22.801 2.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 35.463 -24.495 3.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 34.313 -23.496 2.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 35.079 -24.723 1.622 1.00 0.00 H new ATOM 706 N GLY A 45 35.469 -16.726 -1.503 1.00 0.00 N ATOM 707 CA GLY A 45 34.837 -16.008 -2.617 1.00 0.00 C ATOM 708 C GLY A 45 35.153 -14.507 -2.702 1.00 0.00 C ATOM 709 O GLY A 45 34.728 -13.862 -3.664 1.00 0.00 O ATOM 0 H GLY A 45 35.327 -16.264 -0.605 1.00 0.00 H new ATOM 0 HA2 GLY A 45 35.144 -16.479 -3.551 1.00 0.00 H new ATOM 0 HA3 GLY A 45 33.757 -16.130 -2.538 1.00 0.00 H new ATOM 713 N CYS A 46 35.877 -13.936 -1.732 1.00 0.00 N ATOM 714 CA CYS A 46 36.219 -12.519 -1.690 1.00 0.00 C ATOM 715 C CYS A 46 37.160 -12.112 -2.837 1.00 0.00 C ATOM 716 O CYS A 46 38.143 -12.799 -3.145 1.00 0.00 O ATOM 717 CB CYS A 46 36.756 -12.220 -0.290 1.00 0.00 C ATOM 718 SG CYS A 46 37.760 -10.707 -0.206 1.00 0.00 S ATOM 0 H CYS A 46 36.247 -14.462 -0.940 1.00 0.00 H new ATOM 0 HA CYS A 46 35.338 -11.900 -1.861 1.00 0.00 H new ATOM 0 HB2 CYS A 46 35.917 -12.129 0.400 1.00 0.00 H new ATOM 0 HB3 CYS A 46 37.357 -13.064 0.048 1.00 0.00 H new ATOM 0 HG CYS A 46 37.745 -10.243 1.008 1.00 0.00 H new ATOM 723 N LYS A 47 36.830 -10.974 -3.459 1.00 0.00 N ATOM 724 CA LYS A 47 37.524 -10.378 -4.609 1.00 0.00 C ATOM 725 C LYS A 47 38.383 -9.159 -4.238 1.00 0.00 C ATOM 726 O LYS A 47 38.859 -8.467 -5.142 1.00 0.00 O ATOM 727 CB LYS A 47 36.488 -10.034 -5.703 1.00 0.00 C ATOM 728 CG LYS A 47 35.576 -11.198 -6.145 1.00 0.00 C ATOM 729 CD LYS A 47 36.303 -12.458 -6.644 1.00 0.00 C ATOM 730 CE LYS A 47 37.180 -12.172 -7.871 1.00 0.00 C ATOM 731 NZ LYS A 47 37.816 -13.411 -8.390 1.00 0.00 N ATOM 0 H LYS A 47 36.031 -10.415 -3.159 1.00 0.00 H new ATOM 0 HA LYS A 47 38.230 -11.116 -4.991 1.00 0.00 H new ATOM 0 HB2 LYS A 47 35.859 -9.221 -5.340 1.00 0.00 H new ATOM 0 HB3 LYS A 47 37.020 -9.660 -6.578 1.00 0.00 H new ATOM 0 HG2 LYS A 47 34.939 -11.476 -5.305 1.00 0.00 H new ATOM 0 HG3 LYS A 47 34.919 -10.841 -6.938 1.00 0.00 H new ATOM 0 HD2 LYS A 47 36.922 -12.860 -5.842 1.00 0.00 H new ATOM 0 HD3 LYS A 47 35.569 -13.224 -6.894 1.00 0.00 H new ATOM 0 HE2 LYS A 47 36.573 -11.718 -8.655 1.00 0.00 H new ATOM 0 HE3 LYS A 47 37.952 -11.449 -7.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 38.401 -13.180 -9.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 38.414 -13.830 -7.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 37.079 -14.091 -8.665 1.00 0.00 H new ATOM 745 N ARG A 48 38.612 -8.891 -2.941 1.00 0.00 N ATOM 746 CA ARG A 48 39.444 -7.769 -2.463 1.00 0.00 C ATOM 747 C ARG A 48 40.684 -8.282 -1.724 1.00 0.00 C ATOM 748 O ARG A 48 41.787 -7.945 -2.157 1.00 0.00 O ATOM 749 CB ARG A 48 38.613 -6.714 -1.690 1.00 0.00 C ATOM 750 CG ARG A 48 37.595 -7.311 -0.709 1.00 0.00 C ATOM 751 CD ARG A 48 37.025 -6.345 0.338 1.00 0.00 C ATOM 752 NE ARG A 48 36.709 -7.104 1.560 1.00 0.00 N ATOM 753 CZ ARG A 48 35.751 -6.957 2.447 1.00 0.00 C ATOM 754 NH1 ARG A 48 34.845 -6.023 2.383 1.00 0.00 N ATOM 755 NH2 ARG A 48 35.721 -7.781 3.449 1.00 0.00 N ATOM 0 H ARG A 48 38.221 -9.453 -2.185 1.00 0.00 H new ATOM 0 HA ARG A 48 39.826 -7.225 -3.327 1.00 0.00 H new ATOM 0 HB2 ARG A 48 39.293 -6.064 -1.140 1.00 0.00 H new ATOM 0 HB3 ARG A 48 38.084 -6.087 -2.408 1.00 0.00 H new ATOM 0 HG2 ARG A 48 36.766 -7.724 -1.283 1.00 0.00 H new ATOM 0 HG3 ARG A 48 38.067 -8.143 -0.188 1.00 0.00 H new ATOM 0 HD2 ARG A 48 37.746 -5.558 0.558 1.00 0.00 H new ATOM 0 HD3 ARG A 48 36.129 -5.858 -0.046 1.00 0.00 H new ATOM 0 HE ARG A 48 37.345 -7.879 1.751 1.00 0.00 H new ATOM 0 HH11 ARG A 48 34.855 -5.355 1.613 1.00 0.00 H new ATOM 0 HH12 ARG A 48 34.125 -5.960 3.103 1.00 0.00 H new ATOM 0 HH21 ARG A 48 36.427 -8.513 3.529 1.00 0.00 H new ATOM 0 HH22 ARG A 48 34.992 -7.697 4.157 1.00 0.00 H new ATOM 769 N LYS A 49 40.539 -9.131 -0.698 1.00 0.00 N ATOM 770 CA LYS A 49 41.636 -9.737 0.088 1.00 0.00 C ATOM 771 C LYS A 49 42.808 -8.815 0.486 1.00 0.00 C ATOM 772 O LYS A 49 42.681 -7.587 0.454 1.00 0.00 O ATOM 773 CB LYS A 49 41.939 -11.183 -0.361 1.00 0.00 C ATOM 774 CG LYS A 49 41.680 -11.554 -1.829 1.00 0.00 C ATOM 775 CD LYS A 49 41.742 -13.073 -2.066 1.00 0.00 C ATOM 776 CE LYS A 49 40.976 -13.957 -1.057 1.00 0.00 C ATOM 777 NZ LYS A 49 39.609 -13.475 -0.742 1.00 0.00 N ATOM 0 H LYS A 49 39.619 -9.430 -0.375 1.00 0.00 H new ATOM 0 HA LYS A 49 41.252 -9.864 1.100 1.00 0.00 H new ATOM 0 HB2 LYS A 49 42.988 -11.386 -0.146 1.00 0.00 H new ATOM 0 HB3 LYS A 49 41.350 -11.856 0.262 1.00 0.00 H new ATOM 0 HG2 LYS A 49 40.700 -11.181 -2.128 1.00 0.00 H new ATOM 0 HG3 LYS A 49 42.417 -11.059 -2.462 1.00 0.00 H new ATOM 0 HD2 LYS A 49 41.355 -13.279 -3.064 1.00 0.00 H new ATOM 0 HD3 LYS A 49 42.789 -13.377 -2.061 1.00 0.00 H new ATOM 0 HE2 LYS A 49 40.909 -14.969 -1.455 1.00 0.00 H new ATOM 0 HE3 LYS A 49 41.551 -14.015 -0.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 38.983 -14.289 -0.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 39.638 -12.883 0.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 39.246 -12.915 -1.540 1.00 0.00 H new ATOM 791 N THR A 50 43.940 -9.373 0.918 1.00 0.00 N ATOM 792 CA THR A 50 45.136 -8.626 1.363 1.00 0.00 C ATOM 793 C THR A 50 45.666 -7.628 0.323 1.00 0.00 C ATOM 794 O THR A 50 46.217 -6.591 0.696 1.00 0.00 O ATOM 795 CB THR A 50 46.285 -9.585 1.733 1.00 0.00 C ATOM 796 OG1 THR A 50 46.489 -10.529 0.707 1.00 0.00 O ATOM 797 CG2 THR A 50 46.017 -10.370 3.016 1.00 0.00 C ATOM 0 H THR A 50 44.062 -10.384 0.973 1.00 0.00 H new ATOM 0 HA THR A 50 44.804 -8.062 2.235 1.00 0.00 H new ATOM 0 HB THR A 50 47.160 -8.951 1.878 1.00 0.00 H new ATOM 0 HG1 THR A 50 46.948 -10.100 -0.045 1.00 0.00 H new ATOM 0 HG21 THR A 50 46.861 -11.027 3.223 1.00 0.00 H new ATOM 0 HG22 THR A 50 45.885 -9.676 3.846 1.00 0.00 H new ATOM 0 HG23 THR A 50 45.113 -10.967 2.895 1.00 0.00 H new ATOM 805 N ASN A 51 45.501 -7.925 -0.972 1.00 0.00 N ATOM 806 CA ASN A 51 46.003 -7.095 -2.071 1.00 0.00 C ATOM 807 C ASN A 51 45.150 -5.837 -2.334 1.00 0.00 C ATOM 808 O ASN A 51 45.691 -4.797 -2.718 1.00 0.00 O ATOM 809 CB ASN A 51 46.116 -7.984 -3.321 1.00 0.00 C ATOM 810 CG ASN A 51 46.955 -7.326 -4.404 1.00 0.00 C ATOM 811 OD1 ASN A 51 46.445 -6.759 -5.362 1.00 0.00 O ATOM 812 ND2 ASN A 51 48.264 -7.382 -4.295 1.00 0.00 N ATOM 0 H ASN A 51 45.008 -8.760 -1.289 1.00 0.00 H new ATOM 0 HA ASN A 51 46.982 -6.704 -1.793 1.00 0.00 H new ATOM 0 HB2 ASN A 51 46.560 -8.941 -3.048 1.00 0.00 H new ATOM 0 HB3 ASN A 51 45.120 -8.194 -3.710 1.00 0.00 H new ATOM 0 HD21 ASN A 51 48.854 -6.953 -5.008 1.00 0.00 H new ATOM 0 HD22 ASN A 51 48.690 -7.854 -3.497 1.00 0.00 H new ATOM 819 N GLY A 52 43.832 -5.918 -2.118 1.00 0.00 N ATOM 820 CA GLY A 52 42.882 -4.817 -2.321 1.00 0.00 C ATOM 821 C GLY A 52 42.571 -4.026 -1.045 1.00 0.00 C ATOM 822 O GLY A 52 42.367 -2.811 -1.124 1.00 0.00 O ATOM 0 H GLY A 52 43.385 -6.773 -1.789 1.00 0.00 H new ATOM 0 HA2 GLY A 52 43.284 -4.136 -3.071 1.00 0.00 H new ATOM 0 HA3 GLY A 52 41.953 -5.221 -2.723 1.00 0.00 H new ATOM 826 N GLY A 53 42.566 -4.681 0.125 1.00 0.00 N ATOM 827 CA GLY A 53 42.349 -4.035 1.429 1.00 0.00 C ATOM 828 C GLY A 53 41.353 -4.717 2.379 1.00 0.00 C ATOM 829 O GLY A 53 40.981 -4.102 3.382 1.00 0.00 O ATOM 0 H GLY A 53 42.714 -5.688 0.194 1.00 0.00 H new ATOM 0 HA2 GLY A 53 43.310 -3.964 1.938 1.00 0.00 H new ATOM 0 HA3 GLY A 53 42.006 -3.016 1.251 1.00 0.00 H new ATOM 833 N CYS A 54 40.900 -5.944 2.094 1.00 0.00 N ATOM 834 CA CYS A 54 39.949 -6.681 2.927 1.00 0.00 C ATOM 835 C CYS A 54 40.430 -6.866 4.381 1.00 0.00 C ATOM 836 O CYS A 54 41.504 -7.448 4.605 1.00 0.00 O ATOM 837 CB CYS A 54 39.762 -8.053 2.301 1.00 0.00 C ATOM 838 SG CYS A 54 38.464 -9.018 3.116 1.00 0.00 S ATOM 0 H CYS A 54 41.191 -6.459 1.263 1.00 0.00 H new ATOM 0 HA CYS A 54 39.023 -6.108 2.970 1.00 0.00 H new ATOM 0 HB2 CYS A 54 39.515 -7.936 1.246 1.00 0.00 H new ATOM 0 HB3 CYS A 54 40.703 -8.602 2.349 1.00 0.00 H new ATOM 0 HG CYS A 54 38.644 -10.282 2.871 1.00 0.00 H new ATOM 843 N PRO A 55 39.656 -6.412 5.384 1.00 0.00 N ATOM 844 CA PRO A 55 40.004 -6.619 6.778 1.00 0.00 C ATOM 845 C PRO A 55 39.652 -8.036 7.255 1.00 0.00 C ATOM 846 O PRO A 55 40.213 -8.467 8.260 1.00 0.00 O ATOM 847 CB PRO A 55 39.198 -5.565 7.539 1.00 0.00 C ATOM 848 CG PRO A 55 37.919 -5.447 6.707 1.00 0.00 C ATOM 849 CD PRO A 55 38.396 -5.691 5.274 1.00 0.00 C ATOM 0 HA PRO A 55 41.077 -6.521 6.942 1.00 0.00 H new ATOM 0 HB2 PRO A 55 38.987 -5.878 8.562 1.00 0.00 H new ATOM 0 HB3 PRO A 55 39.730 -4.615 7.599 1.00 0.00 H new ATOM 0 HG2 PRO A 55 37.174 -6.182 7.012 1.00 0.00 H new ATOM 0 HG3 PRO A 55 37.460 -4.464 6.815 1.00 0.00 H new ATOM 0 HD2 PRO A 55 37.663 -6.271 4.713 1.00 0.00 H new ATOM 0 HD3 PRO A 55 38.531 -4.749 4.743 1.00 0.00 H new ATOM 857 N VAL A 56 38.767 -8.773 6.561 1.00 0.00 N ATOM 858 CA VAL A 56 38.401 -10.144 6.945 1.00 0.00 C ATOM 859 C VAL A 56 39.478 -11.120 6.492 1.00 0.00 C ATOM 860 O VAL A 56 40.074 -11.761 7.359 1.00 0.00 O ATOM 861 CB VAL A 56 37.026 -10.601 6.416 1.00 0.00 C ATOM 862 CG1 VAL A 56 36.685 -11.981 7.003 1.00 0.00 C ATOM 863 CG2 VAL A 56 35.884 -9.651 6.802 1.00 0.00 C ATOM 0 H VAL A 56 38.290 -8.437 5.725 1.00 0.00 H new ATOM 0 HA VAL A 56 38.323 -10.138 8.032 1.00 0.00 H new ATOM 0 HB VAL A 56 37.109 -10.621 5.329 1.00 0.00 H new ATOM 0 HG11 VAL A 56 35.713 -12.305 6.630 1.00 0.00 H new ATOM 0 HG12 VAL A 56 37.447 -12.701 6.705 1.00 0.00 H new ATOM 0 HG13 VAL A 56 36.653 -11.916 8.091 1.00 0.00 H new ATOM 0 HG21 VAL A 56 34.944 -10.029 6.400 1.00 0.00 H new ATOM 0 HG22 VAL A 56 35.814 -9.588 7.888 1.00 0.00 H new ATOM 0 HG23 VAL A 56 36.081 -8.660 6.393 1.00 0.00 H new ATOM 873 N CYS A 57 39.766 -11.219 5.190 1.00 0.00 N ATOM 874 CA CYS A 57 40.771 -12.128 4.648 1.00 0.00 C ATOM 875 C CYS A 57 42.115 -12.024 5.383 1.00 0.00 C ATOM 876 O CYS A 57 42.632 -13.032 5.874 1.00 0.00 O ATOM 877 CB CYS A 57 40.915 -11.866 3.148 1.00 0.00 C ATOM 878 SG CYS A 57 39.463 -12.494 2.252 1.00 0.00 S ATOM 0 H CYS A 57 39.299 -10.660 4.476 1.00 0.00 H new ATOM 0 HA CYS A 57 40.437 -13.154 4.803 1.00 0.00 H new ATOM 0 HB2 CYS A 57 41.027 -10.797 2.968 1.00 0.00 H new ATOM 0 HB3 CYS A 57 41.818 -12.348 2.773 1.00 0.00 H new ATOM 0 HG CYS A 57 39.068 -11.605 1.389 1.00 0.00 H new ATOM 883 N LYS A 58 42.662 -10.807 5.526 1.00 0.00 N ATOM 884 CA LYS A 58 43.906 -10.516 6.227 1.00 0.00 C ATOM 885 C LYS A 58 43.911 -10.997 7.690 1.00 0.00 C ATOM 886 O LYS A 58 44.967 -11.367 8.207 1.00 0.00 O ATOM 887 CB LYS A 58 44.105 -9.002 6.063 1.00 0.00 C ATOM 888 CG LYS A 58 45.512 -8.577 6.453 1.00 0.00 C ATOM 889 CD LYS A 58 45.888 -7.217 5.844 1.00 0.00 C ATOM 890 CE LYS A 58 47.228 -6.721 6.398 1.00 0.00 C ATOM 891 NZ LYS A 58 47.568 -5.368 5.883 1.00 0.00 N ATOM 0 H LYS A 58 42.226 -9.970 5.138 1.00 0.00 H new ATOM 0 HA LYS A 58 44.746 -11.068 5.805 1.00 0.00 H new ATOM 0 HB2 LYS A 58 43.913 -8.719 5.028 1.00 0.00 H new ATOM 0 HB3 LYS A 58 43.380 -8.470 6.679 1.00 0.00 H new ATOM 0 HG2 LYS A 58 45.587 -8.522 7.539 1.00 0.00 H new ATOM 0 HG3 LYS A 58 46.225 -9.333 6.122 1.00 0.00 H new ATOM 0 HD2 LYS A 58 45.948 -7.304 4.759 1.00 0.00 H new ATOM 0 HD3 LYS A 58 45.108 -6.488 6.062 1.00 0.00 H new ATOM 0 HE2 LYS A 58 47.185 -6.696 7.487 1.00 0.00 H new ATOM 0 HE3 LYS A 58 48.017 -7.423 6.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 48.481 -5.065 6.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 47.634 -5.398 4.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 46.828 -4.694 6.164 1.00 0.00 H new ATOM 905 N GLN A 59 42.740 -11.065 8.334 1.00 0.00 N ATOM 906 CA GLN A 59 42.583 -11.581 9.697 1.00 0.00 C ATOM 907 C GLN A 59 42.865 -13.091 9.758 1.00 0.00 C ATOM 908 O GLN A 59 43.584 -13.531 10.657 1.00 0.00 O ATOM 909 CB GLN A 59 41.173 -11.257 10.242 1.00 0.00 C ATOM 910 CG GLN A 59 41.179 -10.900 11.739 1.00 0.00 C ATOM 911 CD GLN A 59 41.755 -9.508 12.045 1.00 0.00 C ATOM 912 OE1 GLN A 59 42.457 -8.888 11.260 1.00 0.00 O ATOM 913 NE2 GLN A 59 41.482 -8.946 13.201 1.00 0.00 N ATOM 0 H GLN A 59 41.862 -10.758 7.915 1.00 0.00 H new ATOM 0 HA GLN A 59 43.317 -11.084 10.332 1.00 0.00 H new ATOM 0 HB2 GLN A 59 40.752 -10.425 9.677 1.00 0.00 H new ATOM 0 HB3 GLN A 59 40.520 -12.115 10.080 1.00 0.00 H new ATOM 0 HG2 GLN A 59 40.159 -10.952 12.119 1.00 0.00 H new ATOM 0 HG3 GLN A 59 41.759 -11.649 12.279 1.00 0.00 H new ATOM 0 HE21 GLN A 59 40.899 -9.435 13.881 1.00 0.00 H new ATOM 0 HE22 GLN A 59 41.853 -8.021 13.419 1.00 0.00 H new ATOM 922 N LEU A 60 42.361 -13.878 8.791 1.00 0.00 N ATOM 923 CA LEU A 60 42.641 -15.321 8.713 1.00 0.00 C ATOM 924 C LEU A 60 44.134 -15.550 8.512 1.00 0.00 C ATOM 925 O LEU A 60 44.705 -16.383 9.208 1.00 0.00 O ATOM 926 CB LEU A 60 41.956 -16.050 7.539 1.00 0.00 C ATOM 927 CG LEU A 60 40.429 -16.173 7.544 1.00 0.00 C ATOM 928 CD1 LEU A 60 39.789 -14.818 7.286 1.00 0.00 C ATOM 929 CD2 LEU A 60 40.019 -17.141 6.432 1.00 0.00 C ATOM 0 H LEU A 60 41.753 -13.534 8.048 1.00 0.00 H new ATOM 0 HA LEU A 60 42.255 -15.720 9.651 1.00 0.00 H new ATOM 0 HB2 LEU A 60 42.244 -15.541 6.619 1.00 0.00 H new ATOM 0 HB3 LEU A 60 42.369 -17.057 7.488 1.00 0.00 H new ATOM 0 HG LEU A 60 40.096 -16.539 8.515 1.00 0.00 H new ATOM 0 HD11 LEU A 60 38.704 -14.921 7.292 1.00 0.00 H new ATOM 0 HD12 LEU A 60 40.092 -14.118 8.065 1.00 0.00 H new ATOM 0 HD13 LEU A 60 40.112 -14.442 6.315 1.00 0.00 H new ATOM 0 HD21 LEU A 60 38.934 -17.242 6.419 1.00 0.00 H new ATOM 0 HD22 LEU A 60 40.359 -16.756 5.471 1.00 0.00 H new ATOM 0 HD23 LEU A 60 40.472 -18.116 6.613 1.00 0.00 H new ATOM 941 N ILE A 61 44.758 -14.838 7.564 1.00 0.00 N ATOM 942 CA ILE A 61 46.188 -15.025 7.258 1.00 0.00 C ATOM 943 C ILE A 61 47.049 -14.872 8.512 1.00 0.00 C ATOM 944 O ILE A 61 47.914 -15.712 8.736 1.00 0.00 O ATOM 945 CB ILE A 61 46.721 -14.102 6.137 1.00 0.00 C ATOM 946 CG1 ILE A 61 45.786 -13.898 4.938 1.00 0.00 C ATOM 947 CG2 ILE A 61 48.045 -14.657 5.576 1.00 0.00 C ATOM 948 CD1 ILE A 61 45.528 -15.190 4.173 1.00 0.00 C ATOM 0 H ILE A 61 44.298 -14.127 6.995 1.00 0.00 H new ATOM 0 HA ILE A 61 46.265 -16.045 6.883 1.00 0.00 H new ATOM 0 HB ILE A 61 46.832 -13.136 6.630 1.00 0.00 H new ATOM 0 HG12 ILE A 61 44.837 -13.490 5.287 1.00 0.00 H new ATOM 0 HG13 ILE A 61 46.221 -13.161 4.263 1.00 0.00 H new ATOM 0 HG21 ILE A 61 48.410 -13.999 4.788 1.00 0.00 H new ATOM 0 HG22 ILE A 61 48.784 -14.711 6.375 1.00 0.00 H new ATOM 0 HG23 ILE A 61 47.878 -15.654 5.168 1.00 0.00 H new ATOM 0 HD11 ILE A 61 44.861 -14.989 3.335 1.00 0.00 H new ATOM 0 HD12 ILE A 61 46.472 -15.586 3.799 1.00 0.00 H new ATOM 0 HD13 ILE A 61 45.067 -15.920 4.838 1.00 0.00 H new ATOM 960 N ALA A 62 46.815 -13.854 9.351 1.00 0.00 N ATOM 961 CA ALA A 62 47.574 -13.668 10.592 1.00 0.00 C ATOM 962 C ALA A 62 47.397 -14.881 11.520 1.00 0.00 C ATOM 963 O ALA A 62 48.370 -15.512 11.939 1.00 0.00 O ATOM 964 CB ALA A 62 47.116 -12.366 11.276 1.00 0.00 C ATOM 0 H ALA A 62 46.101 -13.143 9.190 1.00 0.00 H new ATOM 0 HA ALA A 62 48.636 -13.587 10.362 1.00 0.00 H new ATOM 0 HB1 ALA A 62 47.677 -12.223 12.199 1.00 0.00 H new ATOM 0 HB2 ALA A 62 47.294 -11.523 10.609 1.00 0.00 H new ATOM 0 HB3 ALA A 62 46.052 -12.430 11.504 1.00 0.00 H new ATOM 970 N LEU A 63 46.139 -15.223 11.802 1.00 0.00 N ATOM 971 CA LEU A 63 45.734 -16.339 12.661 1.00 0.00 C ATOM 972 C LEU A 63 46.344 -17.675 12.182 1.00 0.00 C ATOM 973 O LEU A 63 46.863 -18.459 12.979 1.00 0.00 O ATOM 974 CB LEU A 63 44.191 -16.326 12.699 1.00 0.00 C ATOM 975 CG LEU A 63 43.573 -16.698 14.055 1.00 0.00 C ATOM 976 CD1 LEU A 63 42.141 -16.164 14.128 1.00 0.00 C ATOM 977 CD2 LEU A 63 43.540 -18.206 14.266 1.00 0.00 C ATOM 0 H LEU A 63 45.342 -14.711 11.424 1.00 0.00 H new ATOM 0 HA LEU A 63 46.116 -16.229 13.676 1.00 0.00 H new ATOM 0 HB2 LEU A 63 43.844 -15.331 12.419 1.00 0.00 H new ATOM 0 HB3 LEU A 63 43.818 -17.018 11.944 1.00 0.00 H new ATOM 0 HG LEU A 63 44.193 -16.253 14.833 1.00 0.00 H new ATOM 0 HD11 LEU A 63 41.703 -16.428 15.090 1.00 0.00 H new ATOM 0 HD12 LEU A 63 42.151 -15.079 14.019 1.00 0.00 H new ATOM 0 HD13 LEU A 63 41.548 -16.603 13.326 1.00 0.00 H new ATOM 0 HD21 LEU A 63 43.096 -18.428 15.236 1.00 0.00 H new ATOM 0 HD22 LEU A 63 42.945 -18.670 13.480 1.00 0.00 H new ATOM 0 HD23 LEU A 63 44.556 -18.600 14.233 1.00 0.00 H new ATOM 989 N CYS A 64 46.344 -17.902 10.866 1.00 0.00 N ATOM 990 CA CYS A 64 46.937 -19.071 10.222 1.00 0.00 C ATOM 991 C CYS A 64 48.473 -19.021 10.250 1.00 0.00 C ATOM 992 O CYS A 64 49.076 -20.051 10.514 1.00 0.00 O ATOM 993 CB CYS A 64 46.409 -19.206 8.789 1.00 0.00 C ATOM 994 SG CYS A 64 44.617 -19.508 8.810 1.00 0.00 S ATOM 0 H CYS A 64 45.918 -17.256 10.201 1.00 0.00 H new ATOM 0 HA CYS A 64 46.642 -19.955 10.787 1.00 0.00 H new ATOM 0 HB2 CYS A 64 46.626 -18.298 8.226 1.00 0.00 H new ATOM 0 HB3 CYS A 64 46.918 -20.025 8.281 1.00 0.00 H new ATOM 0 HG CYS A 64 43.988 -18.380 8.956 1.00 0.00 H new ATOM 1000 N CYS A 65 49.126 -17.867 10.046 1.00 0.00 N ATOM 1001 CA CYS A 65 50.589 -17.724 10.142 1.00 0.00 C ATOM 1002 C CYS A 65 51.091 -18.113 11.540 1.00 0.00 C ATOM 1003 O CYS A 65 52.081 -18.833 11.660 1.00 0.00 O ATOM 1004 CB CYS A 65 51.023 -16.290 9.806 1.00 0.00 C ATOM 1005 SG CYS A 65 50.930 -15.959 8.027 1.00 0.00 S ATOM 0 H CYS A 65 48.650 -16.997 9.807 1.00 0.00 H new ATOM 0 HA CYS A 65 51.035 -18.402 9.414 1.00 0.00 H new ATOM 0 HB2 CYS A 65 50.389 -15.583 10.341 1.00 0.00 H new ATOM 0 HB3 CYS A 65 52.044 -16.128 10.153 1.00 0.00 H new ATOM 0 HG CYS A 65 50.710 -14.693 7.832 1.00 0.00 H new ATOM 1011 N TYR A 66 50.389 -17.675 12.591 1.00 0.00 N ATOM 1012 CA TYR A 66 50.707 -17.994 13.988 1.00 0.00 C ATOM 1013 C TYR A 66 50.753 -19.512 14.234 1.00 0.00 C ATOM 1014 O TYR A 66 51.666 -20.020 14.888 1.00 0.00 O ATOM 1015 CB TYR A 66 49.649 -17.335 14.880 1.00 0.00 C ATOM 1016 CG TYR A 66 50.088 -17.048 16.301 1.00 0.00 C ATOM 1017 CD1 TYR A 66 50.703 -15.817 16.589 1.00 0.00 C ATOM 1018 CD2 TYR A 66 49.801 -17.951 17.342 1.00 0.00 C ATOM 1019 CE1 TYR A 66 50.927 -15.435 17.924 1.00 0.00 C ATOM 1020 CE2 TYR A 66 50.058 -17.589 18.678 1.00 0.00 C ATOM 1021 CZ TYR A 66 50.603 -16.321 18.972 1.00 0.00 C ATOM 1022 OH TYR A 66 50.818 -15.961 20.264 1.00 0.00 O ATOM 0 H TYR A 66 49.568 -17.077 12.493 1.00 0.00 H new ATOM 0 HA TYR A 66 51.699 -17.610 14.225 1.00 0.00 H new ATOM 0 HB2 TYR A 66 49.339 -16.398 14.417 1.00 0.00 H new ATOM 0 HB3 TYR A 66 48.771 -17.980 14.912 1.00 0.00 H new ATOM 0 HD1 TYR A 66 51.004 -15.163 15.784 1.00 0.00 H new ATOM 0 HD2 TYR A 66 49.384 -18.921 17.116 1.00 0.00 H new ATOM 0 HE1 TYR A 66 51.346 -14.465 18.146 1.00 0.00 H new ATOM 0 HE2 TYR A 66 49.838 -18.281 19.477 1.00 0.00 H new ATOM 0 HH TYR A 66 50.538 -16.689 20.857 1.00 0.00 H new ATOM 1032 N HIS A 67 49.787 -20.244 13.673 1.00 0.00 N ATOM 1033 CA HIS A 67 49.708 -21.700 13.754 1.00 0.00 C ATOM 1034 C HIS A 67 50.726 -22.379 12.808 1.00 0.00 C ATOM 1035 O HIS A 67 51.543 -23.184 13.255 1.00 0.00 O ATOM 1036 CB HIS A 67 48.260 -22.120 13.453 1.00 0.00 C ATOM 1037 CG HIS A 67 48.101 -23.615 13.372 1.00 0.00 C ATOM 1038 ND1 HIS A 67 48.037 -24.505 14.421 1.00 0.00 N ATOM 1039 CD2 HIS A 67 48.198 -24.348 12.222 1.00 0.00 C ATOM 1040 CE1 HIS A 67 48.129 -25.749 13.913 1.00 0.00 C ATOM 1041 NE2 HIS A 67 48.258 -25.703 12.577 1.00 0.00 N ATOM 0 H HIS A 67 49.023 -19.830 13.139 1.00 0.00 H new ATOM 0 HA HIS A 67 49.975 -22.031 14.758 1.00 0.00 H new ATOM 0 HB2 HIS A 67 47.602 -21.729 14.229 1.00 0.00 H new ATOM 0 HB3 HIS A 67 47.943 -21.672 12.511 1.00 0.00 H new ATOM 0 HD1 HIS A 67 47.938 -24.265 15.407 1.00 0.00 H new ATOM 0 HD2 HIS A 67 48.224 -23.953 11.217 1.00 0.00 H new ATOM 0 HE1 HIS A 67 48.103 -26.656 14.498 1.00 0.00 H new ATOM 1049 N ALA A 68 50.718 -22.035 11.515 1.00 0.00 N ATOM 1050 CA ALA A 68 51.583 -22.584 10.468 1.00 0.00 C ATOM 1051 C ALA A 68 53.089 -22.473 10.764 1.00 0.00 C ATOM 1052 O ALA A 68 53.847 -23.376 10.405 1.00 0.00 O ATOM 1053 CB ALA A 68 51.213 -21.906 9.147 1.00 0.00 C ATOM 0 H ALA A 68 50.075 -21.330 11.154 1.00 0.00 H new ATOM 0 HA ALA A 68 51.406 -23.658 10.415 1.00 0.00 H new ATOM 0 HB1 ALA A 68 51.843 -22.297 8.348 1.00 0.00 H new ATOM 0 HB2 ALA A 68 50.167 -22.107 8.915 1.00 0.00 H new ATOM 0 HB3 ALA A 68 51.365 -20.830 9.235 1.00 0.00 H new ATOM 1059 N LYS A 69 53.530 -21.408 11.455 1.00 0.00 N ATOM 1060 CA LYS A 69 54.926 -21.239 11.908 1.00 0.00 C ATOM 1061 C LYS A 69 55.371 -22.409 12.804 1.00 0.00 C ATOM 1062 O LYS A 69 56.518 -22.848 12.723 1.00 0.00 O ATOM 1063 CB LYS A 69 55.059 -19.921 12.697 1.00 0.00 C ATOM 1064 CG LYS A 69 55.433 -18.696 11.860 1.00 0.00 C ATOM 1065 CD LYS A 69 55.482 -17.418 12.729 1.00 0.00 C ATOM 1066 CE LYS A 69 56.594 -16.470 12.256 1.00 0.00 C ATOM 1067 NZ LYS A 69 57.936 -16.902 12.731 1.00 0.00 N ATOM 0 H LYS A 69 52.923 -20.631 11.719 1.00 0.00 H new ATOM 0 HA LYS A 69 55.565 -21.217 11.025 1.00 0.00 H new ATOM 0 HB2 LYS A 69 54.114 -19.721 13.202 1.00 0.00 H new ATOM 0 HB3 LYS A 69 55.813 -20.055 13.473 1.00 0.00 H new ATOM 0 HG2 LYS A 69 56.403 -18.856 11.390 1.00 0.00 H new ATOM 0 HG3 LYS A 69 54.707 -18.565 11.057 1.00 0.00 H new ATOM 0 HD2 LYS A 69 54.520 -16.907 12.684 1.00 0.00 H new ATOM 0 HD3 LYS A 69 55.650 -17.689 13.771 1.00 0.00 H new ATOM 0 HE2 LYS A 69 56.592 -16.425 11.167 1.00 0.00 H new ATOM 0 HE3 LYS A 69 56.389 -15.462 12.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 58.657 -16.235 12.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 57.947 -16.921 13.771 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 58.144 -17.853 12.365 1.00 0.00 H new ATOM 1081 N HIS A 70 54.465 -22.898 13.656 1.00 0.00 N ATOM 1082 CA HIS A 70 54.681 -24.011 14.586 1.00 0.00 C ATOM 1083 C HIS A 70 54.335 -25.395 13.997 1.00 0.00 C ATOM 1084 O HIS A 70 54.908 -26.397 14.433 1.00 0.00 O ATOM 1085 CB HIS A 70 53.871 -23.742 15.865 1.00 0.00 C ATOM 1086 CG HIS A 70 54.286 -22.477 16.582 1.00 0.00 C ATOM 1087 ND1 HIS A 70 53.706 -21.232 16.466 1.00 0.00 N ATOM 1088 CD2 HIS A 70 55.330 -22.350 17.459 1.00 0.00 C ATOM 1089 CE1 HIS A 70 54.380 -20.378 17.252 1.00 0.00 C ATOM 1090 NE2 HIS A 70 55.385 -21.013 17.882 1.00 0.00 N ATOM 0 H HIS A 70 53.522 -22.514 13.719 1.00 0.00 H new ATOM 0 HA HIS A 70 55.748 -24.055 14.805 1.00 0.00 H new ATOM 0 HB2 HIS A 70 52.813 -23.676 15.610 1.00 0.00 H new ATOM 0 HB3 HIS A 70 53.983 -24.589 16.542 1.00 0.00 H new ATOM 0 HD1 HIS A 70 52.902 -21.000 15.883 1.00 0.00 H new ATOM 0 HD2 HIS A 70 55.995 -23.141 17.771 1.00 0.00 H new ATOM 0 HE1 HIS A 70 54.148 -19.329 17.363 1.00 0.00 H new ATOM 1098 N CYS A 71 53.400 -25.466 13.039 1.00 0.00 N ATOM 1099 CA CYS A 71 52.946 -26.707 12.398 1.00 0.00 C ATOM 1100 C CYS A 71 54.065 -27.421 11.601 1.00 0.00 C ATOM 1101 O CYS A 71 55.015 -26.791 11.124 1.00 0.00 O ATOM 1102 CB CYS A 71 51.718 -26.385 11.531 1.00 0.00 C ATOM 1103 SG CYS A 71 50.675 -27.860 11.307 1.00 0.00 S ATOM 0 H CYS A 71 52.926 -24.638 12.679 1.00 0.00 H new ATOM 0 HA CYS A 71 52.665 -27.422 13.172 1.00 0.00 H new ATOM 0 HB2 CYS A 71 51.136 -25.591 11.999 1.00 0.00 H new ATOM 0 HB3 CYS A 71 52.042 -26.013 10.559 1.00 0.00 H new ATOM 0 HG CYS A 71 49.794 -27.918 12.262 1.00 0.00 H new ATOM 1108 N GLN A 72 53.949 -28.749 11.459 1.00 0.00 N ATOM 1109 CA GLN A 72 54.937 -29.619 10.795 1.00 0.00 C ATOM 1110 C GLN A 72 54.313 -30.748 9.937 1.00 0.00 C ATOM 1111 O GLN A 72 54.991 -31.727 9.614 1.00 0.00 O ATOM 1112 CB GLN A 72 55.900 -30.210 11.854 1.00 0.00 C ATOM 1113 CG GLN A 72 56.685 -29.166 12.661 1.00 0.00 C ATOM 1114 CD GLN A 72 57.697 -29.822 13.597 1.00 0.00 C ATOM 1115 OE1 GLN A 72 57.357 -30.454 14.591 1.00 0.00 O ATOM 1116 NE2 GLN A 72 58.982 -29.711 13.323 1.00 0.00 N ATOM 0 H GLN A 72 53.143 -29.265 11.812 1.00 0.00 H new ATOM 0 HA GLN A 72 55.483 -28.989 10.093 1.00 0.00 H new ATOM 0 HB2 GLN A 72 55.324 -30.826 12.545 1.00 0.00 H new ATOM 0 HB3 GLN A 72 56.608 -30.870 11.353 1.00 0.00 H new ATOM 0 HG2 GLN A 72 57.203 -28.493 11.978 1.00 0.00 H new ATOM 0 HG3 GLN A 72 55.992 -28.559 13.243 1.00 0.00 H new ATOM 0 HE21 GLN A 72 59.285 -29.189 12.501 1.00 0.00 H new ATOM 0 HE22 GLN A 72 59.673 -30.147 13.933 1.00 0.00 H new ATOM 1125 N GLU A 73 53.035 -30.644 9.556 1.00 0.00 N ATOM 1126 CA GLU A 73 52.315 -31.661 8.762 1.00 0.00 C ATOM 1127 C GLU A 73 51.688 -31.075 7.485 1.00 0.00 C ATOM 1128 O GLU A 73 51.308 -29.908 7.431 1.00 0.00 O ATOM 1129 CB GLU A 73 51.284 -32.344 9.674 1.00 0.00 C ATOM 1130 CG GLU A 73 50.450 -33.442 9.006 1.00 0.00 C ATOM 1131 CD GLU A 73 49.788 -34.360 10.054 1.00 0.00 C ATOM 1132 OE1 GLU A 73 50.426 -35.354 10.481 1.00 0.00 O ATOM 1133 OE2 GLU A 73 48.624 -34.107 10.443 1.00 0.00 O ATOM 0 H GLU A 73 52.456 -29.838 9.792 1.00 0.00 H new ATOM 0 HA GLU A 73 53.022 -32.408 8.402 1.00 0.00 H new ATOM 0 HB2 GLU A 73 51.807 -32.775 10.528 1.00 0.00 H new ATOM 0 HB3 GLU A 73 50.608 -31.584 10.065 1.00 0.00 H new ATOM 0 HG2 GLU A 73 49.682 -32.988 8.380 1.00 0.00 H new ATOM 0 HG3 GLU A 73 51.086 -34.036 8.349 1.00 0.00 H new ATOM 1140 N ASN A 74 51.559 -31.900 6.444 1.00 0.00 N ATOM 1141 CA ASN A 74 51.046 -31.503 5.117 1.00 0.00 C ATOM 1142 C ASN A 74 49.588 -31.949 4.877 1.00 0.00 C ATOM 1143 O ASN A 74 49.070 -31.853 3.763 1.00 0.00 O ATOM 1144 CB ASN A 74 52.004 -32.047 4.037 1.00 0.00 C ATOM 1145 CG ASN A 74 53.454 -31.643 4.261 1.00 0.00 C ATOM 1146 OD1 ASN A 74 54.256 -32.398 4.793 1.00 0.00 O ATOM 1147 ND2 ASN A 74 53.846 -30.450 3.875 1.00 0.00 N ATOM 0 H ASN A 74 51.812 -32.887 6.494 1.00 0.00 H new ATOM 0 HA ASN A 74 51.018 -30.415 5.066 1.00 0.00 H new ATOM 0 HB2 ASN A 74 51.936 -33.135 4.015 1.00 0.00 H new ATOM 0 HB3 ASN A 74 51.681 -31.688 3.060 1.00 0.00 H new ATOM 0 HD21 ASN A 74 54.813 -30.159 4.020 1.00 0.00 H new ATOM 0 HD22 ASN A 74 53.183 -29.814 3.431 1.00 0.00 H new ATOM 1154 N LYS A 75 48.944 -32.463 5.931 1.00 0.00 N ATOM 1155 CA LYS A 75 47.579 -33.017 5.986 1.00 0.00 C ATOM 1156 C LYS A 75 46.644 -32.238 6.936 1.00 0.00 C ATOM 1157 O LYS A 75 45.491 -32.634 7.121 1.00 0.00 O ATOM 1158 CB LYS A 75 47.678 -34.498 6.413 1.00 0.00 C ATOM 1159 CG LYS A 75 48.679 -35.367 5.629 1.00 0.00 C ATOM 1160 CD LYS A 75 48.416 -35.414 4.120 1.00 0.00 C ATOM 1161 CE LYS A 75 49.540 -36.202 3.440 1.00 0.00 C ATOM 1162 NZ LYS A 75 49.337 -36.293 1.971 1.00 0.00 N ATOM 0 H LYS A 75 49.398 -32.508 6.843 1.00 0.00 H new ATOM 0 HA LYS A 75 47.133 -32.926 4.995 1.00 0.00 H new ATOM 0 HB2 LYS A 75 47.948 -34.533 7.469 1.00 0.00 H new ATOM 0 HB3 LYS A 75 46.689 -34.948 6.322 1.00 0.00 H new ATOM 0 HG2 LYS A 75 49.686 -34.987 5.800 1.00 0.00 H new ATOM 0 HG3 LYS A 75 48.650 -36.382 6.024 1.00 0.00 H new ATOM 0 HD2 LYS A 75 47.453 -35.884 3.921 1.00 0.00 H new ATOM 0 HD3 LYS A 75 48.367 -34.403 3.715 1.00 0.00 H new ATOM 0 HE2 LYS A 75 50.497 -35.722 3.646 1.00 0.00 H new ATOM 0 HE3 LYS A 75 49.589 -37.205 3.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 50.117 -36.833 1.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 48.436 -36.773 1.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 49.316 -35.336 1.564 1.00 0.00 H new ATOM 1176 N CYS A 76 47.137 -31.144 7.528 1.00 0.00 N ATOM 1177 CA CYS A 76 46.418 -30.248 8.440 1.00 0.00 C ATOM 1178 C CYS A 76 45.102 -29.740 7.775 1.00 0.00 C ATOM 1179 O CYS A 76 45.115 -29.419 6.579 1.00 0.00 O ATOM 1180 CB CYS A 76 47.420 -29.134 8.820 1.00 0.00 C ATOM 1181 SG CYS A 76 47.103 -28.391 10.450 1.00 0.00 S ATOM 0 H CYS A 76 48.100 -30.844 7.375 1.00 0.00 H new ATOM 0 HA CYS A 76 46.083 -30.743 9.352 1.00 0.00 H new ATOM 0 HB2 CYS A 76 48.429 -29.546 8.808 1.00 0.00 H new ATOM 0 HB3 CYS A 76 47.386 -28.352 8.061 1.00 0.00 H new ATOM 0 HG CYS A 76 48.233 -28.089 11.016 1.00 0.00 H new ATOM 1186 N PRO A 77 43.949 -29.698 8.479 1.00 0.00 N ATOM 1187 CA PRO A 77 42.654 -29.355 7.878 1.00 0.00 C ATOM 1188 C PRO A 77 42.478 -27.888 7.449 1.00 0.00 C ATOM 1189 O PRO A 77 41.669 -27.613 6.561 1.00 0.00 O ATOM 1190 CB PRO A 77 41.608 -29.757 8.924 1.00 0.00 C ATOM 1191 CG PRO A 77 42.359 -29.623 10.247 1.00 0.00 C ATOM 1192 CD PRO A 77 43.773 -30.063 9.876 1.00 0.00 C ATOM 0 HA PRO A 77 42.555 -29.888 6.932 1.00 0.00 H new ATOM 0 HB2 PRO A 77 40.735 -29.105 8.890 1.00 0.00 H new ATOM 0 HB3 PRO A 77 41.252 -30.775 8.765 1.00 0.00 H new ATOM 0 HG2 PRO A 77 42.339 -28.600 10.622 1.00 0.00 H new ATOM 0 HG3 PRO A 77 41.928 -30.256 11.023 1.00 0.00 H new ATOM 0 HD2 PRO A 77 44.514 -29.569 10.505 1.00 0.00 H new ATOM 0 HD3 PRO A 77 43.898 -31.136 10.018 1.00 0.00 H new ATOM 1200 N VAL A 78 43.208 -26.941 8.047 1.00 0.00 N ATOM 1201 CA VAL A 78 43.128 -25.508 7.705 1.00 0.00 C ATOM 1202 C VAL A 78 43.720 -25.279 6.299 1.00 0.00 C ATOM 1203 O VAL A 78 44.853 -25.702 6.052 1.00 0.00 O ATOM 1204 CB VAL A 78 43.860 -24.666 8.768 1.00 0.00 C ATOM 1205 CG1 VAL A 78 43.798 -23.165 8.463 1.00 0.00 C ATOM 1206 CG2 VAL A 78 43.253 -24.870 10.165 1.00 0.00 C ATOM 0 H VAL A 78 43.878 -27.144 8.789 1.00 0.00 H new ATOM 0 HA VAL A 78 42.085 -25.192 7.693 1.00 0.00 H new ATOM 0 HB VAL A 78 44.895 -25.007 8.745 1.00 0.00 H new ATOM 0 HG11 VAL A 78 44.328 -22.614 9.240 1.00 0.00 H new ATOM 0 HG12 VAL A 78 44.265 -22.970 7.498 1.00 0.00 H new ATOM 0 HG13 VAL A 78 42.757 -22.842 8.434 1.00 0.00 H new ATOM 0 HG21 VAL A 78 43.794 -24.261 10.889 1.00 0.00 H new ATOM 0 HG22 VAL A 78 42.204 -24.573 10.153 1.00 0.00 H new ATOM 0 HG23 VAL A 78 43.330 -25.921 10.445 1.00 0.00 H new ATOM 1216 N PRO A 79 43.007 -24.625 5.354 1.00 0.00 N ATOM 1217 CA PRO A 79 43.502 -24.453 3.982 1.00 0.00 C ATOM 1218 C PRO A 79 44.751 -23.565 3.877 1.00 0.00 C ATOM 1219 O PRO A 79 45.651 -23.844 3.079 1.00 0.00 O ATOM 1220 CB PRO A 79 42.319 -23.883 3.189 1.00 0.00 C ATOM 1221 CG PRO A 79 41.459 -23.190 4.246 1.00 0.00 C ATOM 1222 CD PRO A 79 41.670 -24.054 5.489 1.00 0.00 C ATOM 0 HA PRO A 79 43.841 -25.409 3.582 1.00 0.00 H new ATOM 0 HB2 PRO A 79 42.653 -23.181 2.425 1.00 0.00 H new ATOM 0 HB3 PRO A 79 41.765 -24.671 2.679 1.00 0.00 H new ATOM 0 HG2 PRO A 79 41.777 -22.161 4.412 1.00 0.00 H new ATOM 0 HG3 PRO A 79 40.410 -23.156 3.953 1.00 0.00 H new ATOM 0 HD2 PRO A 79 41.589 -23.458 6.398 1.00 0.00 H new ATOM 0 HD3 PRO A 79 40.915 -24.837 5.554 1.00 0.00 H new ATOM 1230 N PHE A 80 44.835 -22.500 4.680 1.00 0.00 N ATOM 1231 CA PHE A 80 45.988 -21.597 4.664 1.00 0.00 C ATOM 1232 C PHE A 80 47.219 -22.135 5.393 1.00 0.00 C ATOM 1233 O PHE A 80 48.324 -21.766 5.012 1.00 0.00 O ATOM 1234 CB PHE A 80 45.597 -20.220 5.208 1.00 0.00 C ATOM 1235 CG PHE A 80 45.069 -19.325 4.114 1.00 0.00 C ATOM 1236 CD1 PHE A 80 45.966 -18.629 3.276 1.00 0.00 C ATOM 1237 CD2 PHE A 80 43.684 -19.260 3.885 1.00 0.00 C ATOM 1238 CE1 PHE A 80 45.461 -17.865 2.208 1.00 0.00 C ATOM 1239 CE2 PHE A 80 43.184 -18.493 2.818 1.00 0.00 C ATOM 1240 CZ PHE A 80 44.073 -17.797 1.981 1.00 0.00 C ATOM 0 H PHE A 80 44.113 -22.242 5.353 1.00 0.00 H new ATOM 0 HA PHE A 80 46.282 -21.511 3.618 1.00 0.00 H new ATOM 0 HB2 PHE A 80 44.839 -20.335 5.983 1.00 0.00 H new ATOM 0 HB3 PHE A 80 46.463 -19.753 5.676 1.00 0.00 H new ATOM 0 HD1 PHE A 80 47.030 -18.682 3.453 1.00 0.00 H new ATOM 0 HD2 PHE A 80 43.004 -19.799 4.528 1.00 0.00 H new ATOM 0 HE1 PHE A 80 46.140 -17.329 1.561 1.00 0.00 H new ATOM 0 HE2 PHE A 80 42.120 -18.439 2.642 1.00 0.00 H new ATOM 0 HZ PHE A 80 43.690 -17.208 1.161 1.00 0.00 H new ATOM 1250 N CYS A 81 47.069 -23.009 6.393 1.00 0.00 N ATOM 1251 CA CYS A 81 48.185 -23.570 7.147 1.00 0.00 C ATOM 1252 C CYS A 81 49.241 -24.194 6.212 1.00 0.00 C ATOM 1253 O CYS A 81 50.427 -23.857 6.275 1.00 0.00 O ATOM 1254 CB CYS A 81 47.564 -24.550 8.147 1.00 0.00 C ATOM 1255 SG CYS A 81 48.785 -25.387 9.177 1.00 0.00 S ATOM 0 H CYS A 81 46.158 -23.348 6.702 1.00 0.00 H new ATOM 0 HA CYS A 81 48.745 -22.809 7.689 1.00 0.00 H new ATOM 0 HB2 CYS A 81 46.866 -24.011 8.788 1.00 0.00 H new ATOM 0 HB3 CYS A 81 46.985 -25.296 7.602 1.00 0.00 H new ATOM 0 HG CYS A 81 48.265 -26.470 9.673 1.00 0.00 H new ATOM 1260 N LEU A 82 48.788 -25.033 5.272 1.00 0.00 N ATOM 1261 CA LEU A 82 49.616 -25.662 4.237 1.00 0.00 C ATOM 1262 C LEU A 82 50.262 -24.603 3.334 1.00 0.00 C ATOM 1263 O LEU A 82 51.486 -24.547 3.235 1.00 0.00 O ATOM 1264 CB LEU A 82 48.749 -26.626 3.403 1.00 0.00 C ATOM 1265 CG LEU A 82 48.537 -28.019 4.025 1.00 0.00 C ATOM 1266 CD1 LEU A 82 48.024 -27.979 5.463 1.00 0.00 C ATOM 1267 CD2 LEU A 82 47.529 -28.790 3.176 1.00 0.00 C ATOM 0 H LEU A 82 47.806 -25.300 5.209 1.00 0.00 H new ATOM 0 HA LEU A 82 50.417 -26.222 4.718 1.00 0.00 H new ATOM 0 HB2 LEU A 82 47.774 -26.165 3.241 1.00 0.00 H new ATOM 0 HB3 LEU A 82 49.210 -26.749 2.423 1.00 0.00 H new ATOM 0 HG LEU A 82 49.513 -28.503 4.046 1.00 0.00 H new ATOM 0 HD11 LEU A 82 47.899 -28.997 5.833 1.00 0.00 H new ATOM 0 HD12 LEU A 82 48.741 -27.450 6.091 1.00 0.00 H new ATOM 0 HD13 LEU A 82 47.065 -27.462 5.493 1.00 0.00 H new ATOM 0 HD21 LEU A 82 47.371 -29.779 3.607 1.00 0.00 H new ATOM 0 HD22 LEU A 82 46.583 -28.249 3.153 1.00 0.00 H new ATOM 0 HD23 LEU A 82 47.912 -28.894 2.161 1.00 0.00 H new ATOM 1279 N ASN A 83 49.447 -23.746 2.708 1.00 0.00 N ATOM 1280 CA ASN A 83 49.915 -22.682 1.815 1.00 0.00 C ATOM 1281 C ASN A 83 50.997 -21.799 2.460 1.00 0.00 C ATOM 1282 O ASN A 83 51.995 -21.484 1.814 1.00 0.00 O ATOM 1283 CB ASN A 83 48.711 -21.845 1.341 1.00 0.00 C ATOM 1284 CG ASN A 83 47.933 -22.530 0.231 1.00 0.00 C ATOM 1285 OD1 ASN A 83 48.293 -22.458 -0.934 1.00 0.00 O ATOM 1286 ND2 ASN A 83 46.856 -23.222 0.532 1.00 0.00 N ATOM 0 H ASN A 83 48.432 -23.773 2.809 1.00 0.00 H new ATOM 0 HA ASN A 83 50.390 -23.150 0.953 1.00 0.00 H new ATOM 0 HB2 ASN A 83 48.047 -21.658 2.185 1.00 0.00 H new ATOM 0 HB3 ASN A 83 49.062 -20.874 0.990 1.00 0.00 H new ATOM 0 HD21 ASN A 83 46.330 -23.692 -0.204 1.00 0.00 H new ATOM 0 HD22 ASN A 83 46.547 -23.288 1.502 1.00 0.00 H new ATOM 1293 N ILE A 84 50.825 -21.416 3.730 1.00 0.00 N ATOM 1294 CA ILE A 84 51.777 -20.592 4.471 1.00 0.00 C ATOM 1295 C ILE A 84 53.016 -21.406 4.868 1.00 0.00 C ATOM 1296 O ILE A 84 54.122 -21.019 4.492 1.00 0.00 O ATOM 1297 CB ILE A 84 51.071 -19.946 5.684 1.00 0.00 C ATOM 1298 CG1 ILE A 84 49.887 -19.054 5.246 1.00 0.00 C ATOM 1299 CG2 ILE A 84 52.011 -19.084 6.551 1.00 0.00 C ATOM 1300 CD1 ILE A 84 48.943 -18.755 6.407 1.00 0.00 C ATOM 0 H ILE A 84 50.005 -21.676 4.278 1.00 0.00 H new ATOM 0 HA ILE A 84 52.136 -19.786 3.831 1.00 0.00 H new ATOM 0 HB ILE A 84 50.718 -20.789 6.278 1.00 0.00 H new ATOM 0 HG12 ILE A 84 50.269 -18.118 4.838 1.00 0.00 H new ATOM 0 HG13 ILE A 84 49.335 -19.549 4.447 1.00 0.00 H new ATOM 0 HG21 ILE A 84 51.451 -18.661 7.385 1.00 0.00 H new ATOM 0 HG22 ILE A 84 52.821 -19.703 6.936 1.00 0.00 H new ATOM 0 HG23 ILE A 84 52.426 -18.278 5.946 1.00 0.00 H new ATOM 0 HD11 ILE A 84 48.125 -18.126 6.058 1.00 0.00 H new ATOM 0 HD12 ILE A 84 48.541 -19.689 6.799 1.00 0.00 H new ATOM 0 HD13 ILE A 84 49.489 -18.236 7.195 1.00 0.00 H new ATOM 1312 N LYS A 85 52.888 -22.532 5.587 1.00 0.00 N ATOM 1313 CA LYS A 85 54.059 -23.324 6.024 1.00 0.00 C ATOM 1314 C LYS A 85 54.940 -23.783 4.863 1.00 0.00 C ATOM 1315 O LYS A 85 56.157 -23.747 4.988 1.00 0.00 O ATOM 1316 CB LYS A 85 53.677 -24.471 6.985 1.00 0.00 C ATOM 1317 CG LYS A 85 53.377 -25.817 6.306 1.00 0.00 C ATOM 1318 CD LYS A 85 52.798 -26.862 7.265 1.00 0.00 C ATOM 1319 CE LYS A 85 51.362 -26.468 7.596 1.00 0.00 C ATOM 1320 NZ LYS A 85 50.666 -27.445 8.442 1.00 0.00 N ATOM 0 H LYS A 85 51.990 -22.918 5.880 1.00 0.00 H new ATOM 0 HA LYS A 85 54.680 -22.642 6.605 1.00 0.00 H new ATOM 0 HB2 LYS A 85 54.490 -24.614 7.697 1.00 0.00 H new ATOM 0 HB3 LYS A 85 52.801 -24.168 7.558 1.00 0.00 H new ATOM 0 HG2 LYS A 85 52.675 -25.655 5.488 1.00 0.00 H new ATOM 0 HG3 LYS A 85 54.295 -26.207 5.866 1.00 0.00 H new ATOM 0 HD2 LYS A 85 52.824 -27.851 6.809 1.00 0.00 H new ATOM 0 HD3 LYS A 85 53.396 -26.915 8.175 1.00 0.00 H new ATOM 0 HE2 LYS A 85 51.366 -25.501 8.099 1.00 0.00 H new ATOM 0 HE3 LYS A 85 50.805 -26.342 6.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 49.721 -27.084 8.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 50.572 -28.344 7.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 51.211 -27.600 9.314 1.00 0.00 H new ATOM 1334 N HIS A 86 54.363 -24.153 3.718 1.00 0.00 N ATOM 1335 CA HIS A 86 55.120 -24.567 2.530 1.00 0.00 C ATOM 1336 C HIS A 86 56.009 -23.444 1.952 1.00 0.00 C ATOM 1337 O HIS A 86 57.012 -23.735 1.292 1.00 0.00 O ATOM 1338 CB HIS A 86 54.137 -25.022 1.438 1.00 0.00 C ATOM 1339 CG HIS A 86 53.389 -26.326 1.646 1.00 0.00 C ATOM 1340 ND1 HIS A 86 52.649 -26.973 0.680 1.00 0.00 N ATOM 1341 CD2 HIS A 86 53.256 -27.068 2.794 1.00 0.00 C ATOM 1342 CE1 HIS A 86 52.086 -28.064 1.226 1.00 0.00 C ATOM 1343 NE2 HIS A 86 52.431 -28.169 2.522 1.00 0.00 N ATOM 0 H HIS A 86 53.352 -24.175 3.586 1.00 0.00 H new ATOM 0 HA HIS A 86 55.778 -25.378 2.843 1.00 0.00 H new ATOM 0 HB2 HIS A 86 53.398 -24.232 1.305 1.00 0.00 H new ATOM 0 HB3 HIS A 86 54.691 -25.101 0.503 1.00 0.00 H new ATOM 0 HD1 HIS A 86 52.546 -26.673 -0.289 1.00 0.00 H new ATOM 0 HD2 HIS A 86 53.711 -26.841 3.747 1.00 0.00 H new ATOM 0 HE1 HIS A 86 51.447 -28.758 0.699 1.00 0.00 H new ATOM 1351 N LYS A 87 55.667 -22.173 2.215 1.00 0.00 N ATOM 1352 CA LYS A 87 56.460 -20.986 1.847 1.00 0.00 C ATOM 1353 C LYS A 87 57.436 -20.631 2.973 1.00 0.00 C ATOM 1354 O LYS A 87 58.605 -20.345 2.710 1.00 0.00 O ATOM 1355 CB LYS A 87 55.521 -19.803 1.540 1.00 0.00 C ATOM 1356 CG LYS A 87 54.656 -20.045 0.288 1.00 0.00 C ATOM 1357 CD LYS A 87 53.475 -19.066 0.196 1.00 0.00 C ATOM 1358 CE LYS A 87 53.864 -17.622 -0.153 1.00 0.00 C ATOM 1359 NZ LYS A 87 53.968 -17.426 -1.620 1.00 0.00 N ATOM 0 H LYS A 87 54.805 -21.934 2.705 1.00 0.00 H new ATOM 0 HA LYS A 87 57.041 -21.207 0.952 1.00 0.00 H new ATOM 0 HB2 LYS A 87 54.872 -19.627 2.398 1.00 0.00 H new ATOM 0 HB3 LYS A 87 56.114 -18.900 1.399 1.00 0.00 H new ATOM 0 HG2 LYS A 87 55.276 -19.948 -0.603 1.00 0.00 H new ATOM 0 HG3 LYS A 87 54.277 -21.067 0.303 1.00 0.00 H new ATOM 0 HD2 LYS A 87 52.776 -19.431 -0.556 1.00 0.00 H new ATOM 0 HD3 LYS A 87 52.946 -19.065 1.149 1.00 0.00 H new ATOM 0 HE2 LYS A 87 53.122 -16.936 0.255 1.00 0.00 H new ATOM 0 HE3 LYS A 87 54.817 -17.377 0.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 53.843 -16.418 -1.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 54.904 -17.740 -1.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 53.230 -17.982 -2.098 1.00 0.00 H new ATOM 1373 N LEU A 88 56.975 -20.665 4.230 1.00 0.00 N ATOM 1374 CA LEU A 88 57.784 -20.350 5.423 1.00 0.00 C ATOM 1375 C LEU A 88 58.891 -21.380 5.716 1.00 0.00 C ATOM 1376 O LEU A 88 59.913 -21.010 6.286 1.00 0.00 O ATOM 1377 CB LEU A 88 56.874 -20.161 6.657 1.00 0.00 C ATOM 1378 CG LEU A 88 56.382 -18.718 6.893 1.00 0.00 C ATOM 1379 CD1 LEU A 88 55.618 -18.143 5.692 1.00 0.00 C ATOM 1380 CD2 LEU A 88 55.515 -18.692 8.160 1.00 0.00 C ATOM 0 H LEU A 88 56.012 -20.916 4.454 1.00 0.00 H new ATOM 0 HA LEU A 88 58.299 -19.415 5.201 1.00 0.00 H new ATOM 0 HB2 LEU A 88 56.006 -20.812 6.552 1.00 0.00 H new ATOM 0 HB3 LEU A 88 57.416 -20.493 7.543 1.00 0.00 H new ATOM 0 HG LEU A 88 57.255 -18.079 7.022 1.00 0.00 H new ATOM 0 HD11 LEU A 88 55.297 -17.126 5.918 1.00 0.00 H new ATOM 0 HD12 LEU A 88 56.269 -18.133 4.818 1.00 0.00 H new ATOM 0 HD13 LEU A 88 54.744 -18.762 5.486 1.00 0.00 H new ATOM 0 HD21 LEU A 88 55.161 -17.677 8.338 1.00 0.00 H new ATOM 0 HD22 LEU A 88 54.661 -19.357 8.030 1.00 0.00 H new ATOM 0 HD23 LEU A 88 56.107 -19.024 9.013 1.00 0.00 H new ATOM 1704 N ASN B 722 32.525 -7.741 10.226 1.00 0.00 N ATOM 1705 CA ASN B 722 32.297 -8.173 11.610 1.00 0.00 C ATOM 1706 C ASN B 722 32.480 -9.692 11.769 1.00 0.00 C ATOM 1707 O ASN B 722 32.530 -10.189 12.895 1.00 0.00 O ATOM 1708 CB ASN B 722 30.910 -7.705 12.083 1.00 0.00 C ATOM 1709 CG ASN B 722 30.736 -6.204 12.308 1.00 0.00 C ATOM 1710 OD1 ASN B 722 29.662 -5.748 12.672 1.00 0.00 O ATOM 1711 ND2 ASN B 722 31.741 -5.376 12.116 1.00 0.00 N ATOM 0 HA ASN B 722 33.048 -7.707 12.247 1.00 0.00 H new ATOM 0 HB2 ASN B 722 30.172 -8.027 11.348 1.00 0.00 H new ATOM 0 HB3 ASN B 722 30.676 -8.219 13.015 1.00 0.00 H new ATOM 0 HD21 ASN B 722 31.615 -4.376 12.271 1.00 0.00 H new ATOM 0 HD22 ASN B 722 32.646 -5.735 11.812 1.00 0.00 H new ATOM 1718 N LEU B 723 32.671 -10.422 10.660 1.00 0.00 N ATOM 1719 CA LEU B 723 33.043 -11.843 10.655 1.00 0.00 C ATOM 1720 C LEU B 723 34.359 -12.066 11.426 1.00 0.00 C ATOM 1721 O LEU B 723 34.569 -13.144 11.968 1.00 0.00 O ATOM 1722 CB LEU B 723 33.196 -12.340 9.201 1.00 0.00 C ATOM 1723 CG LEU B 723 31.947 -12.262 8.311 1.00 0.00 C ATOM 1724 CD1 LEU B 723 32.255 -12.828 6.930 1.00 0.00 C ATOM 1725 CD2 LEU B 723 30.767 -13.029 8.902 1.00 0.00 C ATOM 0 H LEU B 723 32.569 -10.032 9.723 1.00 0.00 H new ATOM 0 HA LEU B 723 32.253 -12.408 11.150 1.00 0.00 H new ATOM 0 HB2 LEU B 723 33.989 -11.763 8.726 1.00 0.00 H new ATOM 0 HB3 LEU B 723 33.530 -13.377 9.229 1.00 0.00 H new ATOM 0 HG LEU B 723 31.671 -11.210 8.242 1.00 0.00 H new ATOM 0 HD11 LEU B 723 31.364 -12.769 6.305 1.00 0.00 H new ATOM 0 HD12 LEU B 723 33.058 -12.252 6.471 1.00 0.00 H new ATOM 0 HD13 LEU B 723 32.564 -13.869 7.024 1.00 0.00 H new ATOM 0 HD21 LEU B 723 29.908 -12.944 8.237 1.00 0.00 H new ATOM 0 HD22 LEU B 723 31.036 -14.079 9.015 1.00 0.00 H new ATOM 0 HD23 LEU B 723 30.514 -12.612 9.877 1.00 0.00 H new ATOM 1737 N LEU B 724 35.201 -11.025 11.496 1.00 0.00 N ATOM 1738 CA LEU B 724 36.513 -10.937 12.153 1.00 0.00 C ATOM 1739 C LEU B 724 36.657 -11.880 13.377 1.00 0.00 C ATOM 1740 O LEU B 724 36.102 -11.583 14.441 1.00 0.00 O ATOM 1741 CB LEU B 724 36.798 -9.458 12.510 1.00 0.00 C ATOM 1742 CG LEU B 724 36.607 -8.408 11.381 1.00 0.00 C ATOM 1743 CD1 LEU B 724 37.125 -7.052 11.859 1.00 0.00 C ATOM 1744 CD2 LEU B 724 37.396 -8.802 10.135 1.00 0.00 C ATOM 0 H LEU B 724 34.957 -10.140 11.052 1.00 0.00 H new ATOM 0 HA LEU B 724 37.268 -11.290 11.451 1.00 0.00 H new ATOM 0 HB2 LEU B 724 36.152 -9.181 13.343 1.00 0.00 H new ATOM 0 HB3 LEU B 724 37.826 -9.388 12.867 1.00 0.00 H new ATOM 0 HG LEU B 724 35.545 -8.357 11.139 1.00 0.00 H new ATOM 0 HD11 LEU B 724 36.992 -6.313 11.069 1.00 0.00 H new ATOM 0 HD12 LEU B 724 36.569 -6.741 12.744 1.00 0.00 H new ATOM 0 HD13 LEU B 724 38.184 -7.133 12.106 1.00 0.00 H new ATOM 0 HD21 LEU B 724 37.247 -8.052 9.358 1.00 0.00 H new ATOM 0 HD22 LEU B 724 38.456 -8.865 10.380 1.00 0.00 H new ATOM 0 HD23 LEU B 724 37.049 -9.771 9.776 1.00 0.00 H new ATOM 1756 N PRO B 725 37.363 -13.026 13.255 1.00 0.00 N ATOM 1757 CA PRO B 725 37.482 -14.030 14.322 1.00 0.00 C ATOM 1758 C PRO B 725 38.484 -13.681 15.438 1.00 0.00 C ATOM 1759 O PRO B 725 38.633 -14.450 16.389 1.00 0.00 O ATOM 1760 CB PRO B 725 37.922 -15.304 13.592 1.00 0.00 C ATOM 1761 CG PRO B 725 38.802 -14.762 12.469 1.00 0.00 C ATOM 1762 CD PRO B 725 38.051 -13.499 12.056 1.00 0.00 C ATOM 0 HA PRO B 725 36.533 -14.117 14.851 1.00 0.00 H new ATOM 0 HB2 PRO B 725 38.473 -15.977 14.249 1.00 0.00 H new ATOM 0 HB3 PRO B 725 37.070 -15.863 13.205 1.00 0.00 H new ATOM 0 HG2 PRO B 725 39.812 -14.541 12.813 1.00 0.00 H new ATOM 0 HG3 PRO B 725 38.893 -15.470 11.645 1.00 0.00 H new ATOM 0 HD2 PRO B 725 38.739 -12.743 11.678 1.00 0.00 H new ATOM 0 HD3 PRO B 725 37.340 -13.712 11.257 1.00 0.00 H new ATOM 1770 N MET B 726 39.192 -12.552 15.324 1.00 0.00 N ATOM 1771 CA MET B 726 40.238 -12.114 16.257 1.00 0.00 C ATOM 1772 C MET B 726 40.242 -10.587 16.400 1.00 0.00 C ATOM 1773 O MET B 726 39.953 -9.871 15.437 1.00 0.00 O ATOM 1774 CB MET B 726 41.564 -12.656 15.709 1.00 0.00 C ATOM 1775 CG MET B 726 42.798 -12.340 16.548 1.00 0.00 C ATOM 1776 SD MET B 726 44.283 -13.276 16.084 1.00 0.00 S ATOM 1777 CE MET B 726 44.522 -12.745 14.367 1.00 0.00 C ATOM 0 H MET B 726 39.049 -11.897 14.556 1.00 0.00 H new ATOM 0 HA MET B 726 40.065 -12.498 17.262 1.00 0.00 H new ATOM 0 HB2 MET B 726 41.481 -13.738 15.609 1.00 0.00 H new ATOM 0 HB3 MET B 726 41.715 -12.254 14.707 1.00 0.00 H new ATOM 0 HG2 MET B 726 43.015 -11.275 16.466 1.00 0.00 H new ATOM 0 HG3 MET B 726 42.571 -12.539 17.595 1.00 0.00 H new ATOM 0 HE1 MET B 726 45.448 -13.170 13.980 1.00 0.00 H new ATOM 0 HE2 MET B 726 43.684 -13.088 13.760 1.00 0.00 H new ATOM 0 HE3 MET B 726 44.577 -11.657 14.327 1.00 0.00 H new ATOM 1787 N SER B 727 40.560 -10.096 17.598 1.00 0.00 N ATOM 1788 CA SER B 727 40.574 -8.663 17.942 1.00 0.00 C ATOM 1789 C SER B 727 41.831 -7.933 17.429 1.00 0.00 C ATOM 1790 O SER B 727 42.825 -8.593 17.108 1.00 0.00 O ATOM 1791 CB SER B 727 40.437 -8.510 19.469 1.00 0.00 C ATOM 1792 OG SER B 727 41.690 -8.344 20.117 1.00 0.00 O ATOM 0 H SER B 727 40.823 -10.695 18.381 1.00 0.00 H new ATOM 0 HA SER B 727 39.728 -8.192 17.441 1.00 0.00 H new ATOM 0 HB2 SER B 727 39.802 -7.652 19.689 1.00 0.00 H new ATOM 0 HB3 SER B 727 39.936 -9.389 19.875 1.00 0.00 H new ATOM 0 HG SER B 727 41.549 -8.250 21.082 1.00 0.00 H new ATOM 1798 N PRO B 728 41.850 -6.583 17.374 1.00 0.00 N ATOM 1799 CA PRO B 728 43.041 -5.839 16.961 1.00 0.00 C ATOM 1800 C PRO B 728 44.195 -5.977 17.973 1.00 0.00 C ATOM 1801 O PRO B 728 45.360 -5.933 17.581 1.00 0.00 O ATOM 1802 CB PRO B 728 42.582 -4.386 16.801 1.00 0.00 C ATOM 1803 CG PRO B 728 41.399 -4.274 17.760 1.00 0.00 C ATOM 1804 CD PRO B 728 40.769 -5.665 17.710 1.00 0.00 C ATOM 0 HA PRO B 728 43.448 -6.231 16.029 1.00 0.00 H new ATOM 0 HB2 PRO B 728 43.375 -3.684 17.060 1.00 0.00 H new ATOM 0 HB3 PRO B 728 42.287 -4.170 15.774 1.00 0.00 H new ATOM 0 HG2 PRO B 728 41.722 -4.015 18.768 1.00 0.00 H new ATOM 0 HG3 PRO B 728 40.697 -3.503 17.443 1.00 0.00 H new ATOM 0 HD2 PRO B 728 40.320 -5.925 18.669 1.00 0.00 H new ATOM 0 HD3 PRO B 728 39.975 -5.707 16.964 1.00 0.00 H new ATOM 1812 N GLU B 729 43.901 -6.192 19.261 1.00 0.00 N ATOM 1813 CA GLU B 729 44.918 -6.412 20.302 1.00 0.00 C ATOM 1814 C GLU B 729 45.540 -7.816 20.198 1.00 0.00 C ATOM 1815 O GLU B 729 46.740 -7.988 20.418 1.00 0.00 O ATOM 1816 CB GLU B 729 44.310 -6.214 21.697 1.00 0.00 C ATOM 1817 CG GLU B 729 44.071 -4.735 22.028 1.00 0.00 C ATOM 1818 CD GLU B 729 43.653 -4.553 23.501 1.00 0.00 C ATOM 1819 OE1 GLU B 729 44.516 -4.711 24.401 1.00 0.00 O ATOM 1820 OE2 GLU B 729 42.466 -4.248 23.771 1.00 0.00 O ATOM 0 H GLU B 729 42.945 -6.219 19.615 1.00 0.00 H new ATOM 0 HA GLU B 729 45.709 -5.678 20.147 1.00 0.00 H new ATOM 0 HB2 GLU B 729 43.365 -6.754 21.758 1.00 0.00 H new ATOM 0 HB3 GLU B 729 44.974 -6.648 22.444 1.00 0.00 H new ATOM 0 HG2 GLU B 729 44.979 -4.165 21.832 1.00 0.00 H new ATOM 0 HG3 GLU B 729 43.296 -4.334 21.375 1.00 0.00 H new ATOM 1827 N GLU B 730 44.751 -8.824 19.816 1.00 0.00 N ATOM 1828 CA GLU B 730 45.243 -10.183 19.563 1.00 0.00 C ATOM 1829 C GLU B 730 46.057 -10.187 18.260 1.00 0.00 C ATOM 1830 O GLU B 730 47.181 -10.685 18.225 1.00 0.00 O ATOM 1831 CB GLU B 730 44.057 -11.146 19.447 1.00 0.00 C ATOM 1832 CG GLU B 730 43.329 -11.345 20.776 1.00 0.00 C ATOM 1833 CD GLU B 730 42.078 -12.231 20.614 1.00 0.00 C ATOM 1834 OE1 GLU B 730 41.205 -11.913 19.769 1.00 0.00 O ATOM 1835 OE2 GLU B 730 41.954 -13.234 21.356 1.00 0.00 O ATOM 0 H GLU B 730 43.746 -8.720 19.672 1.00 0.00 H new ATOM 0 HA GLU B 730 45.879 -10.507 20.387 1.00 0.00 H new ATOM 0 HB2 GLU B 730 43.355 -10.764 18.706 1.00 0.00 H new ATOM 0 HB3 GLU B 730 44.411 -12.110 19.083 1.00 0.00 H new ATOM 0 HG2 GLU B 730 44.007 -11.801 21.497 1.00 0.00 H new ATOM 0 HG3 GLU B 730 43.038 -10.375 21.180 1.00 0.00 H new ATOM 1842 N PHE B 731 45.516 -9.569 17.205 1.00 0.00 N ATOM 1843 CA PHE B 731 46.185 -9.397 15.909 1.00 0.00 C ATOM 1844 C PHE B 731 47.551 -8.699 16.055 1.00 0.00 C ATOM 1845 O PHE B 731 48.501 -9.082 15.377 1.00 0.00 O ATOM 1846 CB PHE B 731 45.260 -8.628 14.951 1.00 0.00 C ATOM 1847 CG PHE B 731 45.821 -8.402 13.556 1.00 0.00 C ATOM 1848 CD1 PHE B 731 46.667 -7.302 13.303 1.00 0.00 C ATOM 1849 CD2 PHE B 731 45.482 -9.270 12.500 1.00 0.00 C ATOM 1850 CE1 PHE B 731 47.184 -7.086 12.013 1.00 0.00 C ATOM 1851 CE2 PHE B 731 45.986 -9.044 11.205 1.00 0.00 C ATOM 1852 CZ PHE B 731 46.844 -7.958 10.964 1.00 0.00 C ATOM 0 H PHE B 731 44.580 -9.165 17.228 1.00 0.00 H new ATOM 0 HA PHE B 731 46.386 -10.383 15.491 1.00 0.00 H new ATOM 0 HB2 PHE B 731 44.320 -9.172 14.864 1.00 0.00 H new ATOM 0 HB3 PHE B 731 45.028 -7.659 15.394 1.00 0.00 H new ATOM 0 HD1 PHE B 731 46.919 -6.622 14.104 1.00 0.00 H new ATOM 0 HD2 PHE B 731 44.832 -10.113 12.684 1.00 0.00 H new ATOM 0 HE1 PHE B 731 47.842 -6.250 11.828 1.00 0.00 H new ATOM 0 HE2 PHE B 731 45.713 -9.706 10.396 1.00 0.00 H new ATOM 0 HZ PHE B 731 47.242 -7.793 9.974 1.00 0.00 H new ATOM 1862 N ASP B 732 47.686 -7.714 16.950 1.00 0.00 N ATOM 1863 CA ASP B 732 48.959 -7.033 17.230 1.00 0.00 C ATOM 1864 C ASP B 732 50.030 -8.016 17.751 1.00 0.00 C ATOM 1865 O ASP B 732 51.164 -8.011 17.271 1.00 0.00 O ATOM 1866 CB ASP B 732 48.713 -5.892 18.227 1.00 0.00 C ATOM 1867 CG ASP B 732 50.017 -5.219 18.675 1.00 0.00 C ATOM 1868 OD1 ASP B 732 50.563 -4.377 17.926 1.00 0.00 O ATOM 1869 OD2 ASP B 732 50.505 -5.531 19.787 1.00 0.00 O ATOM 0 H ASP B 732 46.907 -7.362 17.507 1.00 0.00 H new ATOM 0 HA ASP B 732 49.347 -6.617 16.300 1.00 0.00 H new ATOM 0 HB2 ASP B 732 48.061 -5.148 17.770 1.00 0.00 H new ATOM 0 HB3 ASP B 732 48.189 -6.282 19.100 1.00 0.00 H new ATOM 1874 N GLU B 733 49.671 -8.907 18.682 1.00 0.00 N ATOM 1875 CA GLU B 733 50.576 -9.949 19.190 1.00 0.00 C ATOM 1876 C GLU B 733 50.861 -11.028 18.138 1.00 0.00 C ATOM 1877 O GLU B 733 51.973 -11.555 18.100 1.00 0.00 O ATOM 1878 CB GLU B 733 50.016 -10.530 20.500 1.00 0.00 C ATOM 1879 CG GLU B 733 50.954 -11.524 21.205 1.00 0.00 C ATOM 1880 CD GLU B 733 52.353 -10.959 21.522 1.00 0.00 C ATOM 1881 OE1 GLU B 733 52.507 -9.725 21.682 1.00 0.00 O ATOM 1882 OE2 GLU B 733 53.303 -11.761 21.663 1.00 0.00 O ATOM 0 H GLU B 733 48.744 -8.927 19.106 1.00 0.00 H new ATOM 0 HA GLU B 733 51.542 -9.495 19.409 1.00 0.00 H new ATOM 0 HB2 GLU B 733 49.796 -9.709 21.183 1.00 0.00 H new ATOM 0 HB3 GLU B 733 49.071 -11.029 20.287 1.00 0.00 H new ATOM 0 HG2 GLU B 733 50.487 -11.850 22.135 1.00 0.00 H new ATOM 0 HG3 GLU B 733 51.066 -12.408 20.577 1.00 0.00 H new ATOM 1889 N VAL B 734 49.921 -11.311 17.228 1.00 0.00 N ATOM 1890 CA VAL B 734 50.179 -12.217 16.107 1.00 0.00 C ATOM 1891 C VAL B 734 51.199 -11.564 15.166 1.00 0.00 C ATOM 1892 O VAL B 734 52.226 -12.165 14.857 1.00 0.00 O ATOM 1893 CB VAL B 734 48.879 -12.590 15.376 1.00 0.00 C ATOM 1894 CG1 VAL B 734 49.169 -13.340 14.081 1.00 0.00 C ATOM 1895 CG2 VAL B 734 47.956 -13.477 16.221 1.00 0.00 C ATOM 0 H VAL B 734 48.977 -10.925 17.248 1.00 0.00 H new ATOM 0 HA VAL B 734 50.595 -13.151 16.484 1.00 0.00 H new ATOM 0 HB VAL B 734 48.382 -11.642 15.173 1.00 0.00 H new ATOM 0 HG11 VAL B 734 48.230 -13.590 13.587 1.00 0.00 H new ATOM 0 HG12 VAL B 734 49.769 -12.711 13.423 1.00 0.00 H new ATOM 0 HG13 VAL B 734 49.716 -14.256 14.306 1.00 0.00 H new ATOM 0 HG21 VAL B 734 47.054 -13.708 15.654 1.00 0.00 H new ATOM 0 HG22 VAL B 734 48.473 -14.403 16.474 1.00 0.00 H new ATOM 0 HG23 VAL B 734 47.684 -12.951 17.136 1.00 0.00 H new ATOM 1905 N SER B 735 50.960 -10.314 14.761 1.00 0.00 N ATOM 1906 CA SER B 735 51.843 -9.519 13.897 1.00 0.00 C ATOM 1907 C SER B 735 53.270 -9.421 14.453 1.00 0.00 C ATOM 1908 O SER B 735 54.235 -9.565 13.697 1.00 0.00 O ATOM 1909 CB SER B 735 51.233 -8.126 13.699 1.00 0.00 C ATOM 1910 OG SER B 735 51.993 -7.374 12.768 1.00 0.00 O ATOM 0 H SER B 735 50.117 -9.808 15.034 1.00 0.00 H new ATOM 0 HA SER B 735 51.924 -10.024 12.935 1.00 0.00 H new ATOM 0 HB2 SER B 735 50.206 -8.220 13.346 1.00 0.00 H new ATOM 0 HB3 SER B 735 51.195 -7.601 14.654 1.00 0.00 H new ATOM 0 HG SER B 735 51.588 -6.489 12.654 1.00 0.00 H new ATOM 1916 N ARG B 736 53.424 -9.247 15.776 1.00 0.00 N ATOM 1917 CA ARG B 736 54.723 -9.192 16.472 1.00 0.00 C ATOM 1918 C ARG B 736 55.610 -10.414 16.202 1.00 0.00 C ATOM 1919 O ARG B 736 56.824 -10.267 16.063 1.00 0.00 O ATOM 1920 CB ARG B 736 54.448 -8.992 17.967 1.00 0.00 C ATOM 1921 CG ARG B 736 55.715 -8.710 18.786 1.00 0.00 C ATOM 1922 CD ARG B 736 55.351 -8.240 20.199 1.00 0.00 C ATOM 1923 NE ARG B 736 54.857 -6.846 20.195 1.00 0.00 N ATOM 1924 CZ ARG B 736 53.597 -6.446 20.216 1.00 0.00 C ATOM 1925 NH1 ARG B 736 52.594 -7.223 20.480 1.00 0.00 N ATOM 1926 NH2 ARG B 736 53.280 -5.218 19.943 1.00 0.00 N ATOM 0 H ARG B 736 52.630 -9.138 16.408 1.00 0.00 H new ATOM 0 HA ARG B 736 55.298 -8.352 16.082 1.00 0.00 H new ATOM 0 HB2 ARG B 736 53.751 -8.164 18.093 1.00 0.00 H new ATOM 0 HB3 ARG B 736 53.960 -9.883 18.362 1.00 0.00 H new ATOM 0 HG2 ARG B 736 56.326 -9.611 18.843 1.00 0.00 H new ATOM 0 HG3 ARG B 736 56.315 -7.949 18.287 1.00 0.00 H new ATOM 0 HD2 ARG B 736 54.588 -8.897 20.617 1.00 0.00 H new ATOM 0 HD3 ARG B 736 56.225 -8.316 20.845 1.00 0.00 H new ATOM 0 HE ARG B 736 55.566 -6.113 20.174 1.00 0.00 H new ATOM 0 HH11 ARG B 736 52.753 -8.209 20.688 1.00 0.00 H new ATOM 0 HH12 ARG B 736 51.645 -6.849 20.479 1.00 0.00 H new ATOM 0 HH21 ARG B 736 54.008 -4.544 19.707 1.00 0.00 H new ATOM 0 HH22 ARG B 736 52.303 -4.927 19.964 1.00 0.00 H new ATOM 1940 N ILE B 737 55.009 -11.604 16.107 1.00 0.00 N ATOM 1941 CA ILE B 737 55.718 -12.868 15.822 1.00 0.00 C ATOM 1942 C ILE B 737 55.801 -13.149 14.314 1.00 0.00 C ATOM 1943 O ILE B 737 56.863 -13.513 13.809 1.00 0.00 O ATOM 1944 CB ILE B 737 55.031 -14.049 16.542 1.00 0.00 C ATOM 1945 CG1 ILE B 737 54.917 -13.765 18.058 1.00 0.00 C ATOM 1946 CG2 ILE B 737 55.796 -15.365 16.289 1.00 0.00 C ATOM 1947 CD1 ILE B 737 54.330 -14.927 18.860 1.00 0.00 C ATOM 0 H ILE B 737 54.003 -11.724 16.226 1.00 0.00 H new ATOM 0 HA ILE B 737 56.735 -12.761 16.199 1.00 0.00 H new ATOM 0 HB ILE B 737 54.026 -14.160 16.136 1.00 0.00 H new ATOM 0 HG12 ILE B 737 55.906 -13.528 18.449 1.00 0.00 H new ATOM 0 HG13 ILE B 737 54.296 -12.882 18.207 1.00 0.00 H new ATOM 0 HG21 ILE B 737 55.294 -16.183 16.806 1.00 0.00 H new ATOM 0 HG22 ILE B 737 55.820 -15.572 15.219 1.00 0.00 H new ATOM 0 HG23 ILE B 737 56.815 -15.271 16.663 1.00 0.00 H new ATOM 0 HD11 ILE B 737 54.281 -14.654 19.914 1.00 0.00 H new ATOM 0 HD12 ILE B 737 53.327 -15.150 18.496 1.00 0.00 H new ATOM 0 HD13 ILE B 737 54.963 -15.807 18.742 1.00 0.00 H new ATOM 1959 N VAL B 738 54.686 -13.000 13.589 1.00 0.00 N ATOM 1960 CA VAL B 738 54.581 -13.268 12.140 1.00 0.00 C ATOM 1961 C VAL B 738 55.489 -12.352 11.310 1.00 0.00 C ATOM 1962 O VAL B 738 56.027 -12.775 10.288 1.00 0.00 O ATOM 1963 CB VAL B 738 53.109 -13.179 11.683 1.00 0.00 C ATOM 1964 CG1 VAL B 738 52.936 -13.359 10.169 1.00 0.00 C ATOM 1965 CG2 VAL B 738 52.296 -14.290 12.362 1.00 0.00 C ATOM 0 H VAL B 738 53.808 -12.682 13.999 1.00 0.00 H new ATOM 0 HA VAL B 738 54.934 -14.284 11.965 1.00 0.00 H new ATOM 0 HB VAL B 738 52.764 -12.182 11.958 1.00 0.00 H new ATOM 0 HG11 VAL B 738 51.879 -13.286 9.912 1.00 0.00 H new ATOM 0 HG12 VAL B 738 53.492 -12.582 9.644 1.00 0.00 H new ATOM 0 HG13 VAL B 738 53.314 -14.338 9.873 1.00 0.00 H new ATOM 0 HG21 VAL B 738 51.256 -14.229 12.040 1.00 0.00 H new ATOM 0 HG22 VAL B 738 52.705 -15.262 12.084 1.00 0.00 H new ATOM 0 HG23 VAL B 738 52.349 -14.170 13.444 1.00 0.00 H new ATOM 1975 N GLY B 739 55.675 -11.107 11.752 1.00 0.00 N ATOM 1976 CA GLY B 739 56.529 -10.092 11.113 1.00 0.00 C ATOM 1977 C GLY B 739 56.250 -9.832 9.623 1.00 0.00 C ATOM 1978 O GLY B 739 57.141 -9.382 8.900 1.00 0.00 O ATOM 0 H GLY B 739 55.220 -10.760 12.596 1.00 0.00 H new ATOM 0 HA2 GLY B 739 56.415 -9.153 11.655 1.00 0.00 H new ATOM 0 HA3 GLY B 739 57.570 -10.398 11.222 1.00 0.00 H new ATOM 1982 N SER B 740 55.029 -10.128 9.158 1.00 0.00 N ATOM 1983 CA SER B 740 54.552 -9.985 7.769 1.00 0.00 C ATOM 1984 C SER B 740 55.445 -10.629 6.683 1.00 0.00 C ATOM 1985 O SER B 740 55.422 -10.173 5.540 1.00 0.00 O ATOM 1986 CB SER B 740 54.245 -8.509 7.461 1.00 0.00 C ATOM 1987 OG SER B 740 53.322 -7.980 8.403 1.00 0.00 O ATOM 0 H SER B 740 54.303 -10.495 9.774 1.00 0.00 H new ATOM 0 HA SER B 740 53.633 -10.569 7.718 1.00 0.00 H new ATOM 0 HB2 SER B 740 55.167 -7.928 7.483 1.00 0.00 H new ATOM 0 HB3 SER B 740 53.836 -8.420 6.455 1.00 0.00 H new ATOM 0 HG SER B 740 53.141 -7.040 8.191 1.00 0.00 H new ATOM 1993 N VAL B 741 56.213 -11.679 7.032 1.00 0.00 N ATOM 1994 CA VAL B 741 57.170 -12.461 6.199 1.00 0.00 C ATOM 1995 C VAL B 741 57.051 -12.274 4.672 1.00 0.00 C ATOM 1996 O VAL B 741 57.927 -11.666 4.057 1.00 0.00 O ATOM 1997 CB VAL B 741 57.163 -13.963 6.590 1.00 0.00 C ATOM 1998 CG1 VAL B 741 58.118 -14.214 7.763 1.00 0.00 C ATOM 1999 CG2 VAL B 741 55.781 -14.527 6.982 1.00 0.00 C ATOM 0 H VAL B 741 56.183 -12.040 7.986 1.00 0.00 H new ATOM 0 HA VAL B 741 58.142 -12.029 6.439 1.00 0.00 H new ATOM 0 HB VAL B 741 57.480 -14.481 5.685 1.00 0.00 H new ATOM 0 HG11 VAL B 741 58.102 -15.272 8.025 1.00 0.00 H new ATOM 0 HG12 VAL B 741 59.130 -13.927 7.476 1.00 0.00 H new ATOM 0 HG13 VAL B 741 57.802 -13.622 8.622 1.00 0.00 H new ATOM 0 HG21 VAL B 741 55.878 -15.582 7.238 1.00 0.00 H new ATOM 0 HG22 VAL B 741 55.395 -13.979 7.841 1.00 0.00 H new ATOM 0 HG23 VAL B 741 55.093 -14.419 6.144 1.00 0.00 H new ATOM 2009 N GLU B 742 55.952 -12.736 4.073 1.00 0.00 N ATOM 2010 CA GLU B 742 55.575 -12.560 2.651 1.00 0.00 C ATOM 2011 C GLU B 742 54.038 -12.452 2.540 1.00 0.00 C ATOM 2012 O GLU B 742 53.424 -12.874 1.567 1.00 0.00 O ATOM 2013 CB GLU B 742 56.072 -13.736 1.791 1.00 0.00 C ATOM 2014 CG GLU B 742 57.593 -13.850 1.663 1.00 0.00 C ATOM 2015 CD GLU B 742 57.951 -14.808 0.511 1.00 0.00 C ATOM 2016 OE1 GLU B 742 57.496 -15.978 0.534 1.00 0.00 O ATOM 2017 OE2 GLU B 742 58.671 -14.394 -0.430 1.00 0.00 O ATOM 0 H GLU B 742 55.255 -13.275 4.588 1.00 0.00 H new ATOM 0 HA GLU B 742 56.044 -11.648 2.282 1.00 0.00 H new ATOM 0 HB2 GLU B 742 55.688 -14.664 2.215 1.00 0.00 H new ATOM 0 HB3 GLU B 742 55.645 -13.642 0.793 1.00 0.00 H new ATOM 0 HG2 GLU B 742 58.026 -12.867 1.478 1.00 0.00 H new ATOM 0 HG3 GLU B 742 58.019 -14.215 2.597 1.00 0.00 H new ATOM 2024 N PHE B 743 53.413 -11.952 3.603 1.00 0.00 N ATOM 2025 CA PHE B 743 51.978 -11.906 3.890 1.00 0.00 C ATOM 2026 C PHE B 743 50.967 -11.759 2.729 1.00 0.00 C ATOM 2027 O PHE B 743 50.003 -12.520 2.668 1.00 0.00 O ATOM 2028 CB PHE B 743 51.785 -10.863 4.991 1.00 0.00 C ATOM 2029 CG PHE B 743 50.618 -11.099 5.922 1.00 0.00 C ATOM 2030 CD1 PHE B 743 50.407 -12.358 6.529 1.00 0.00 C ATOM 2031 CD2 PHE B 743 49.788 -10.011 6.247 1.00 0.00 C ATOM 2032 CE1 PHE B 743 49.379 -12.502 7.471 1.00 0.00 C ATOM 2033 CE2 PHE B 743 48.755 -10.169 7.183 1.00 0.00 C ATOM 2034 CZ PHE B 743 48.553 -11.412 7.795 1.00 0.00 C ATOM 0 H PHE B 743 53.949 -11.527 4.360 1.00 0.00 H new ATOM 0 HA PHE B 743 51.707 -12.916 4.197 1.00 0.00 H new ATOM 0 HB2 PHE B 743 52.697 -10.817 5.586 1.00 0.00 H new ATOM 0 HB3 PHE B 743 51.661 -9.887 4.523 1.00 0.00 H new ATOM 0 HD1 PHE B 743 51.031 -13.200 6.270 1.00 0.00 H new ATOM 0 HD2 PHE B 743 49.946 -9.052 5.775 1.00 0.00 H new ATOM 0 HE1 PHE B 743 49.221 -13.457 7.951 1.00 0.00 H new ATOM 0 HE2 PHE B 743 48.117 -9.334 7.431 1.00 0.00 H new ATOM 0 HZ PHE B 743 47.760 -11.534 8.518 1.00 0.00 H new ATOM 2044 N ASP B 744 51.152 -10.832 1.785 1.00 0.00 N ATOM 2045 CA ASP B 744 50.224 -10.695 0.643 1.00 0.00 C ATOM 2046 C ASP B 744 50.355 -11.845 -0.393 1.00 0.00 C ATOM 2047 O ASP B 744 49.427 -12.142 -1.146 1.00 0.00 O ATOM 2048 CB ASP B 744 50.396 -9.303 0.020 1.00 0.00 C ATOM 2049 CG ASP B 744 49.391 -9.045 -1.113 1.00 0.00 C ATOM 2050 OD1 ASP B 744 48.179 -9.237 -0.876 1.00 0.00 O ATOM 2051 OD2 ASP B 744 49.798 -8.607 -2.215 1.00 0.00 O ATOM 0 H ASP B 744 51.926 -10.168 1.782 1.00 0.00 H new ATOM 0 HA ASP B 744 49.203 -10.787 1.015 1.00 0.00 H new ATOM 0 HB2 ASP B 744 50.273 -8.544 0.792 1.00 0.00 H new ATOM 0 HB3 ASP B 744 51.410 -9.203 -0.367 1.00 0.00 H new ATOM 2056 N SER B 745 51.490 -12.552 -0.394 1.00 0.00 N ATOM 2057 CA SER B 745 51.784 -13.727 -1.229 1.00 0.00 C ATOM 2058 C SER B 745 51.223 -15.031 -0.635 1.00 0.00 C ATOM 2059 O SER B 745 51.207 -16.049 -1.325 1.00 0.00 O ATOM 2060 CB SER B 745 53.307 -13.849 -1.403 1.00 0.00 C ATOM 2061 OG SER B 745 53.654 -14.703 -2.482 1.00 0.00 O ATOM 0 H SER B 745 52.269 -12.310 0.218 1.00 0.00 H new ATOM 0 HA SER B 745 51.296 -13.580 -2.192 1.00 0.00 H new ATOM 0 HB2 SER B 745 53.732 -12.860 -1.573 1.00 0.00 H new ATOM 0 HB3 SER B 745 53.747 -14.232 -0.482 1.00 0.00 H new ATOM 0 HG SER B 745 54.614 -14.629 -2.662 1.00 0.00 H new ATOM 2067 N MET B 746 50.730 -15.044 0.616 1.00 0.00 N ATOM 2068 CA MET B 746 50.151 -16.248 1.254 1.00 0.00 C ATOM 2069 C MET B 746 48.980 -16.850 0.447 1.00 0.00 C ATOM 2070 O MET B 746 48.678 -18.036 0.576 1.00 0.00 O ATOM 2071 CB MET B 746 49.682 -15.958 2.692 1.00 0.00 C ATOM 2072 CG MET B 746 50.746 -15.483 3.702 1.00 0.00 C ATOM 2073 SD MET B 746 52.503 -15.565 3.249 1.00 0.00 S ATOM 2074 CE MET B 746 52.762 -17.343 3.366 1.00 0.00 C ATOM 0 H MET B 746 50.720 -14.220 1.217 1.00 0.00 H new ATOM 0 HA MET B 746 50.957 -16.982 1.278 1.00 0.00 H new ATOM 0 HB2 MET B 746 48.900 -15.200 2.645 1.00 0.00 H new ATOM 0 HB3 MET B 746 49.224 -16.865 3.087 1.00 0.00 H new ATOM 0 HG2 MET B 746 50.520 -14.446 3.952 1.00 0.00 H new ATOM 0 HG3 MET B 746 50.615 -16.066 4.614 1.00 0.00 H new ATOM 0 HE1 MET B 746 53.497 -17.653 2.624 1.00 0.00 H new ATOM 0 HE2 MET B 746 53.125 -17.593 4.363 1.00 0.00 H new ATOM 0 HE3 MET B 746 51.821 -17.861 3.182 1.00 0.00 H new