USER MOD reduce.3.24.130724 H: found=0, std=0, add=1021, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1021 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 26 SER OG : rot 48:sc= 1.14 USER MOD Set 1.2: A 73 ASN :FLIP amide:sc= -0.106 F(o=-1.7!,f=1) USER MOD Set 2.1: A 32 SER OG : rot -21:sc= 0.0259 USER MOD Set 2.2: A 92 TYR OH : rot -105:sc= 0.826 USER MOD Set 3.1: A 18 SER OG : rot 180:sc= 0.0192 USER MOD Set 3.2: A 22 HIS : no HD1:sc= -2.69 X(o=-2.7,f=-2.8!) USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot -110:sc= -0.51 USER MOD Single : A 11 TYR OH : rot 156:sc= -0.213 USER MOD Single : A 12 ASN : amide:sc= -0.0852 X(o=-0.085,f=-0.00067) USER MOD Single : A 13 GLN :FLIP amide:sc= -2.27 F(o=-3.6!,f=-2.3) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.0519) USER MOD Single : A 19 ASN : amide:sc= -2.11 K(o=-2.1,f=-5!) USER MOD Single : A 20 SER OG : rot 133:sc= 0.518 USER MOD Single : A 21 HIS : no HD1:sc= -0.055 X(o=-0.055,f=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot -177:sc= 1.07 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 HIS : no HD1:sc= -5.36 K(o=-5.4,f=-7.9!) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= -0.581 K(o=-0.58,f=-3.5) USER MOD Single : A 42 TYR OH : rot -152:sc= 0.741 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.0104) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 HIS : no HD1:sc= 0.0949 K(o=0.095,f=-3.8!) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 HIS : no HE2:sc= -4.08 K(o=-4.1,f=-5.1!) USER MOD Single : A 79 TYR OH : rot 33:sc= -0.241 USER MOD Single : A 85 THR OG1 : rot -110:sc= -0.283 USER MOD Single : A 90 HIS : no HD1:sc= -0.155 K(o=-0.16,f=-0.91) USER MOD Single : A 93 LYS NZ :NH3+ -150:sc= 0.545 (180deg=-1.39) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 157:sc= -0.16 (180deg=-0.731) USER MOD Single : A 102 ASN : amide:sc= -0.579 X(o=-0.58,f=-0.34) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 150:sc= 0 USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 ASN : amide:sc= -0.0762 X(o=-0.076,f=-0.53) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 HIS : no HE2:sc= -2.42 K(o=-2.4,f=-6.8!) USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 ASN : amide:sc= 0.0443 K(o=0.044,f=-1.6) USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=-0.066) USER MOD Single : A 132 LYS NZ :NH3+ 158:sc= 0 (180deg=-0.407) USER MOD Single : A 135 SER OG : rot 28:sc= 0.103 USER MOD Single : A 136 HIS : no HE2:sc= -4.14! C(o=-4.1!,f=-9!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 1.312 0.021 0.059 1.00 0.00 N ATOM 2 CA ALA A 1 2.093 0.038 -1.208 1.00 0.00 C ATOM 3 C ALA A 1 1.886 -1.292 -1.916 1.00 0.00 C ATOM 4 O ALA A 1 2.744 -2.160 -1.863 1.00 0.00 O ATOM 5 CB ALA A 1 3.586 0.346 -0.959 1.00 0.00 C ATOM 0 H1 ALA A 1 1.441 0.924 0.559 1.00 0.00 H new ATOM 0 H2 ALA A 1 0.304 -0.114 -0.157 1.00 0.00 H new ATOM 0 H3 ALA A 1 1.645 -0.759 0.662 1.00 0.00 H new ATOM 0 HA ALA A 1 1.734 0.843 -1.849 1.00 0.00 H new ATOM 0 HB1 ALA A 1 4.120 0.349 -1.909 1.00 0.00 H new ATOM 0 HB2 ALA A 1 3.682 1.323 -0.486 1.00 0.00 H new ATOM 0 HB3 ALA A 1 4.011 -0.417 -0.306 1.00 0.00 H new ATOM 13 N VAL A 2 0.719 -1.462 -2.540 1.00 0.00 N ATOM 14 CA VAL A 2 0.425 -2.683 -3.288 1.00 0.00 C ATOM 15 C VAL A 2 1.344 -2.733 -4.507 1.00 0.00 C ATOM 16 O VAL A 2 1.660 -1.706 -5.120 1.00 0.00 O ATOM 17 CB VAL A 2 -1.079 -2.772 -3.596 1.00 0.00 C ATOM 18 CG1 VAL A 2 -1.532 -1.893 -4.753 1.00 0.00 C ATOM 19 CG2 VAL A 2 -1.547 -4.224 -3.730 1.00 0.00 C ATOM 0 H VAL A 2 -0.033 -0.773 -2.542 1.00 0.00 H new ATOM 0 HA VAL A 2 0.636 -3.578 -2.703 1.00 0.00 H new ATOM 0 HB VAL A 2 -1.583 -2.352 -2.726 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -2.605 -2.015 -4.904 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -1.314 -0.850 -4.524 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -1.002 -2.184 -5.660 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -2.615 -4.243 -3.947 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -1.003 -4.708 -4.541 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -1.357 -4.755 -2.797 1.00 0.00 H new ATOM 29 N THR A 3 1.841 -3.915 -4.809 1.00 0.00 N ATOM 30 CA THR A 3 2.796 -4.153 -5.883 1.00 0.00 C ATOM 31 C THR A 3 2.045 -4.670 -7.109 1.00 0.00 C ATOM 32 O THR A 3 1.368 -5.687 -7.048 1.00 0.00 O ATOM 33 CB THR A 3 3.869 -5.140 -5.417 1.00 0.00 C ATOM 34 OG1 THR A 3 4.255 -4.937 -4.081 1.00 0.00 O ATOM 35 CG2 THR A 3 5.132 -4.907 -6.216 1.00 0.00 C ATOM 0 H THR A 3 1.587 -4.763 -4.303 1.00 0.00 H new ATOM 0 HA THR A 3 3.301 -3.226 -6.154 1.00 0.00 H new ATOM 0 HB THR A 3 3.439 -6.134 -5.541 1.00 0.00 H new ATOM 0 HG1 THR A 3 4.939 -5.594 -3.835 1.00 0.00 H new ATOM 0 HG21 THR A 3 5.902 -5.606 -5.891 1.00 0.00 H new ATOM 0 HG22 THR A 3 4.926 -5.061 -7.275 1.00 0.00 H new ATOM 0 HG23 THR A 3 5.479 -3.886 -6.059 1.00 0.00 H new ATOM 43 N TRP A 4 2.087 -3.945 -8.222 1.00 0.00 N ATOM 44 CA TRP A 4 1.296 -4.250 -9.401 1.00 0.00 C ATOM 45 C TRP A 4 1.998 -5.316 -10.201 1.00 0.00 C ATOM 46 O TRP A 4 3.201 -5.242 -10.383 1.00 0.00 O ATOM 47 CB TRP A 4 1.137 -2.998 -10.223 1.00 0.00 C ATOM 48 CG TRP A 4 0.316 -1.917 -9.597 1.00 0.00 C ATOM 49 CD1 TRP A 4 0.599 -1.279 -8.440 1.00 0.00 C ATOM 50 CD2 TRP A 4 -0.931 -1.348 -10.087 1.00 0.00 C ATOM 51 NE1 TRP A 4 -0.388 -0.341 -8.182 1.00 0.00 N ATOM 52 CE2 TRP A 4 -1.348 -0.332 -9.182 1.00 0.00 C ATOM 53 CE3 TRP A 4 -1.760 -1.601 -11.196 1.00 0.00 C ATOM 54 CZ2 TRP A 4 -2.542 0.386 -9.369 1.00 0.00 C ATOM 55 CZ3 TRP A 4 -2.932 -0.853 -11.409 1.00 0.00 C ATOM 56 CH2 TRP A 4 -3.334 0.151 -10.506 1.00 0.00 C ATOM 0 H TRP A 4 2.679 -3.121 -8.328 1.00 0.00 H new ATOM 0 HA TRP A 4 0.310 -4.614 -9.112 1.00 0.00 H new ATOM 0 HB2 TRP A 4 2.128 -2.598 -10.440 1.00 0.00 H new ATOM 0 HB3 TRP A 4 0.685 -3.266 -11.178 1.00 0.00 H new ATOM 0 HD1 TRP A 4 1.459 -1.470 -7.815 1.00 0.00 H new ATOM 0 HE1 TRP A 4 -0.406 0.265 -7.362 1.00 0.00 H new ATOM 0 HE3 TRP A 4 -1.492 -2.381 -11.894 1.00 0.00 H new ATOM 0 HZ2 TRP A 4 -2.851 1.119 -8.638 1.00 0.00 H new ATOM 0 HZ3 TRP A 4 -3.536 -1.052 -12.282 1.00 0.00 H new ATOM 0 HH2 TRP A 4 -4.230 0.727 -10.683 1.00 0.00 H new ATOM 67 N THR A 5 1.276 -6.298 -10.703 1.00 0.00 N ATOM 68 CA THR A 5 1.867 -7.417 -11.422 1.00 0.00 C ATOM 69 C THR A 5 1.175 -7.547 -12.751 1.00 0.00 C ATOM 70 O THR A 5 -0.056 -7.539 -12.854 1.00 0.00 O ATOM 71 CB THR A 5 1.801 -8.702 -10.586 1.00 0.00 C ATOM 72 OG1 THR A 5 2.985 -8.804 -9.865 1.00 0.00 O ATOM 73 CG2 THR A 5 1.748 -10.034 -11.331 1.00 0.00 C ATOM 0 H THR A 5 0.260 -6.346 -10.625 1.00 0.00 H new ATOM 0 HA THR A 5 2.927 -7.236 -11.603 1.00 0.00 H new ATOM 0 HB THR A 5 0.871 -8.585 -10.030 1.00 0.00 H new ATOM 0 HG1 THR A 5 3.522 -9.543 -10.220 1.00 0.00 H new ATOM 0 HG21 THR A 5 1.704 -10.852 -10.612 1.00 0.00 H new ATOM 0 HG22 THR A 5 0.862 -10.061 -11.965 1.00 0.00 H new ATOM 0 HG23 THR A 5 2.640 -10.141 -11.948 1.00 0.00 H new ATOM 81 N CYS A 6 1.984 -7.675 -13.797 1.00 0.00 N ATOM 82 CA CYS A 6 1.491 -7.877 -15.146 1.00 0.00 C ATOM 83 C CYS A 6 2.011 -9.160 -15.775 1.00 0.00 C ATOM 84 O CYS A 6 2.765 -9.114 -16.741 1.00 0.00 O ATOM 85 CB CYS A 6 1.749 -6.635 -15.985 1.00 0.00 C ATOM 86 SG CYS A 6 0.172 -5.978 -16.535 1.00 0.00 S ATOM 0 H CYS A 6 3.001 -7.641 -13.729 1.00 0.00 H new ATOM 0 HA CYS A 6 0.411 -8.019 -15.101 1.00 0.00 H new ATOM 0 HB2 CYS A 6 2.287 -5.889 -15.400 1.00 0.00 H new ATOM 0 HB3 CYS A 6 2.376 -6.881 -16.842 1.00 0.00 H new ATOM 91 N GLY A 7 1.580 -10.296 -15.214 1.00 0.00 N ATOM 92 CA GLY A 7 2.025 -11.634 -15.634 1.00 0.00 C ATOM 93 C GLY A 7 3.529 -11.715 -15.900 1.00 0.00 C ATOM 94 O GLY A 7 3.952 -12.065 -16.995 1.00 0.00 O ATOM 0 H GLY A 7 0.906 -10.315 -14.448 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.760 -12.356 -14.862 1.00 0.00 H new ATOM 0 HA3 GLY A 7 1.487 -11.921 -16.537 1.00 0.00 H new ATOM 98 N GLY A 8 4.327 -11.350 -14.897 1.00 0.00 N ATOM 99 CA GLY A 8 5.781 -11.280 -15.017 1.00 0.00 C ATOM 100 C GLY A 8 6.436 -11.116 -13.657 1.00 0.00 C ATOM 101 O GLY A 8 6.733 -12.104 -12.995 1.00 0.00 O ATOM 0 H GLY A 8 3.980 -11.093 -13.973 1.00 0.00 H new ATOM 0 HA2 GLY A 8 6.153 -12.186 -15.496 1.00 0.00 H new ATOM 0 HA3 GLY A 8 6.056 -10.443 -15.659 1.00 0.00 H new ATOM 105 N LEU A 9 6.607 -9.872 -13.213 1.00 0.00 N ATOM 106 CA LEU A 9 7.169 -9.509 -11.915 1.00 0.00 C ATOM 107 C LEU A 9 6.286 -8.467 -11.238 1.00 0.00 C ATOM 108 O LEU A 9 5.413 -7.862 -11.864 1.00 0.00 O ATOM 109 CB LEU A 9 8.620 -9.021 -12.113 1.00 0.00 C ATOM 110 CG LEU A 9 9.615 -10.176 -12.340 1.00 0.00 C ATOM 111 CD1 LEU A 9 10.933 -9.663 -12.949 1.00 0.00 C ATOM 112 CD2 LEU A 9 9.819 -11.002 -11.050 1.00 0.00 C ATOM 0 H LEU A 9 6.347 -9.058 -13.770 1.00 0.00 H new ATOM 0 HA LEU A 9 7.197 -10.375 -11.254 1.00 0.00 H new ATOM 0 HB2 LEU A 9 8.657 -8.343 -12.966 1.00 0.00 H new ATOM 0 HB3 LEU A 9 8.928 -8.449 -11.238 1.00 0.00 H new ATOM 0 HG LEU A 9 9.187 -10.860 -13.073 1.00 0.00 H new ATOM 0 HD11 LEU A 9 11.615 -10.500 -13.098 1.00 0.00 H new ATOM 0 HD12 LEU A 9 10.729 -9.186 -13.908 1.00 0.00 H new ATOM 0 HD13 LEU A 9 11.389 -8.939 -12.273 1.00 0.00 H new ATOM 0 HD21 LEU A 9 10.526 -11.809 -11.243 1.00 0.00 H new ATOM 0 HD22 LEU A 9 10.210 -10.357 -10.263 1.00 0.00 H new ATOM 0 HD23 LEU A 9 8.865 -11.423 -10.733 1.00 0.00 H new ATOM 124 N LEU A 10 6.520 -8.290 -9.941 1.00 0.00 N ATOM 125 CA LEU A 10 5.812 -7.339 -9.099 1.00 0.00 C ATOM 126 C LEU A 10 6.545 -5.994 -9.091 1.00 0.00 C ATOM 127 O LEU A 10 7.627 -5.863 -8.537 1.00 0.00 O ATOM 128 CB LEU A 10 5.641 -7.900 -7.683 1.00 0.00 C ATOM 129 CG LEU A 10 5.052 -9.320 -7.551 1.00 0.00 C ATOM 130 CD1 LEU A 10 6.020 -10.192 -6.757 1.00 0.00 C ATOM 131 CD2 LEU A 10 3.651 -9.330 -6.897 1.00 0.00 C ATOM 0 H LEU A 10 7.229 -8.821 -9.435 1.00 0.00 H new ATOM 0 HA LEU A 10 4.815 -7.173 -9.508 1.00 0.00 H new ATOM 0 HB2 LEU A 10 6.617 -7.893 -7.197 1.00 0.00 H new ATOM 0 HB3 LEU A 10 5.002 -7.216 -7.124 1.00 0.00 H new ATOM 0 HG LEU A 10 4.923 -9.721 -8.556 1.00 0.00 H new ATOM 0 HD11 LEU A 10 5.609 -11.197 -6.660 1.00 0.00 H new ATOM 0 HD12 LEU A 10 6.977 -10.240 -7.277 1.00 0.00 H new ATOM 0 HD13 LEU A 10 6.167 -9.763 -5.766 1.00 0.00 H new ATOM 0 HD21 LEU A 10 3.288 -10.356 -6.831 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.713 -8.902 -5.897 1.00 0.00 H new ATOM 0 HD23 LEU A 10 2.963 -8.740 -7.502 1.00 0.00 H new ATOM 143 N TYR A 11 5.926 -4.993 -9.703 1.00 0.00 N ATOM 144 CA TYR A 11 6.324 -3.603 -9.890 1.00 0.00 C ATOM 145 C TYR A 11 5.820 -2.783 -8.722 1.00 0.00 C ATOM 146 O TYR A 11 4.609 -2.605 -8.535 1.00 0.00 O ATOM 147 CB TYR A 11 5.771 -3.077 -11.214 1.00 0.00 C ATOM 148 CG TYR A 11 6.245 -3.942 -12.352 1.00 0.00 C ATOM 149 CD1 TYR A 11 7.543 -3.761 -12.843 1.00 0.00 C ATOM 150 CD2 TYR A 11 5.419 -4.947 -12.886 1.00 0.00 C ATOM 151 CE1 TYR A 11 7.987 -4.527 -13.927 1.00 0.00 C ATOM 152 CE2 TYR A 11 5.880 -5.788 -13.907 1.00 0.00 C ATOM 153 CZ TYR A 11 7.157 -5.540 -14.453 1.00 0.00 C ATOM 154 OH TYR A 11 7.550 -6.185 -15.572 1.00 0.00 O ATOM 0 H TYR A 11 5.017 -5.158 -10.135 1.00 0.00 H new ATOM 0 HA TYR A 11 7.411 -3.527 -9.928 1.00 0.00 H new ATOM 0 HB2 TYR A 11 4.681 -3.067 -11.184 1.00 0.00 H new ATOM 0 HB3 TYR A 11 6.095 -2.048 -11.369 1.00 0.00 H new ATOM 0 HD1 TYR A 11 8.199 -3.034 -12.388 1.00 0.00 H new ATOM 0 HD2 TYR A 11 4.417 -5.072 -12.504 1.00 0.00 H new ATOM 0 HE1 TYR A 11 8.960 -4.344 -14.359 1.00 0.00 H new ATOM 0 HE2 TYR A 11 5.273 -6.606 -14.267 1.00 0.00 H new ATOM 0 HH TYR A 11 7.121 -7.065 -15.610 1.00 0.00 H new ATOM 164 N ASN A 12 6.740 -2.301 -7.885 1.00 0.00 N ATOM 165 CA ASN A 12 6.376 -1.436 -6.774 1.00 0.00 C ATOM 166 C ASN A 12 5.588 -0.258 -7.311 1.00 0.00 C ATOM 167 O ASN A 12 6.084 0.460 -8.164 1.00 0.00 O ATOM 168 CB ASN A 12 7.625 -1.000 -5.989 1.00 0.00 C ATOM 169 CG ASN A 12 7.480 -1.195 -4.509 1.00 0.00 C ATOM 170 OD1 ASN A 12 8.352 -1.672 -3.818 1.00 0.00 O ATOM 171 ND2 ASN A 12 6.388 -0.750 -3.951 1.00 0.00 N ATOM 0 H ASN A 12 7.738 -2.497 -7.959 1.00 0.00 H new ATOM 0 HA ASN A 12 5.746 -1.977 -6.068 1.00 0.00 H new ATOM 0 HB2 ASN A 12 8.487 -1.566 -6.343 1.00 0.00 H new ATOM 0 HB3 ASN A 12 7.829 0.051 -6.194 1.00 0.00 H new ATOM 0 HD21 ASN A 12 6.273 -0.805 -2.939 1.00 0.00 H new ATOM 0 HD22 ASN A 12 5.649 -0.347 -4.527 1.00 0.00 H new ATOM 178 N GLN A 13 4.359 -0.040 -6.842 1.00 0.00 N ATOM 179 CA GLN A 13 3.620 1.130 -7.320 1.00 0.00 C ATOM 180 C GLN A 13 4.371 2.432 -7.125 1.00 0.00 C ATOM 181 O GLN A 13 4.522 3.193 -8.060 1.00 0.00 O ATOM 182 CB GLN A 13 2.262 1.280 -6.638 1.00 0.00 C ATOM 183 CG GLN A 13 1.475 2.534 -7.102 1.00 0.00 C ATOM 184 CD GLN A 13 1.558 2.763 -8.602 1.00 0.00 C ATOM 185 OE1 GLN A 13 1.445 1.731 -9.387 1.00 0.00 O flip ATOM 186 NE2 GLN A 13 1.804 3.833 -9.116 1.00 0.00 N flip ATOM 0 H GLN A 13 3.872 -0.626 -6.164 1.00 0.00 H new ATOM 0 HA GLN A 13 3.489 0.943 -8.386 1.00 0.00 H new ATOM 0 HB2 GLN A 13 1.664 0.391 -6.836 1.00 0.00 H new ATOM 0 HB3 GLN A 13 2.409 1.331 -5.559 1.00 0.00 H new ATOM 0 HG2 GLN A 13 0.429 2.428 -6.813 1.00 0.00 H new ATOM 0 HG3 GLN A 13 1.861 3.412 -6.584 1.00 0.00 H new ATOM 0 HE21 GLN A 13 1.901 4.667 -8.537 1.00 0.00 H new ATOM 0 HE22 GLN A 13 1.914 3.899 -10.128 1.00 0.00 H new ATOM 195 N ASN A 14 4.901 2.653 -5.931 1.00 0.00 N ATOM 196 CA ASN A 14 5.747 3.812 -5.698 1.00 0.00 C ATOM 197 C ASN A 14 6.854 4.005 -6.748 1.00 0.00 C ATOM 198 O ASN A 14 7.153 5.110 -7.122 1.00 0.00 O ATOM 199 CB ASN A 14 6.378 3.651 -4.325 1.00 0.00 C ATOM 200 CG ASN A 14 6.431 4.960 -3.600 1.00 0.00 C ATOM 201 OD1 ASN A 14 7.413 5.674 -3.653 1.00 0.00 O ATOM 202 ND2 ASN A 14 5.373 5.262 -2.906 1.00 0.00 N ATOM 0 H ASN A 14 4.762 2.053 -5.118 1.00 0.00 H new ATOM 0 HA ASN A 14 5.117 4.699 -5.767 1.00 0.00 H new ATOM 0 HB2 ASN A 14 5.806 2.931 -3.740 1.00 0.00 H new ATOM 0 HB3 ASN A 14 7.385 3.248 -4.429 1.00 0.00 H new ATOM 0 HD21 ASN A 14 5.343 6.132 -2.374 1.00 0.00 H new ATOM 0 HD22 ASN A 14 4.573 4.629 -2.894 1.00 0.00 H new ATOM 209 N LYS A 15 7.468 2.941 -7.255 1.00 0.00 N ATOM 210 CA LYS A 15 8.334 2.937 -8.431 1.00 0.00 C ATOM 211 C LYS A 15 7.578 3.130 -9.726 1.00 0.00 C ATOM 212 O LYS A 15 8.055 3.913 -10.515 1.00 0.00 O ATOM 213 CB LYS A 15 9.181 1.667 -8.480 1.00 0.00 C ATOM 214 CG LYS A 15 10.530 1.935 -7.815 1.00 0.00 C ATOM 215 CD LYS A 15 10.988 0.714 -6.996 1.00 0.00 C ATOM 216 CE LYS A 15 12.029 1.142 -5.955 1.00 0.00 C ATOM 217 NZ LYS A 15 11.376 1.805 -4.794 1.00 0.00 N ATOM 0 H LYS A 15 7.372 2.015 -6.839 1.00 0.00 H new ATOM 0 HA LYS A 15 8.995 3.798 -8.329 1.00 0.00 H new ATOM 0 HB2 LYS A 15 8.666 0.853 -7.970 1.00 0.00 H new ATOM 0 HB3 LYS A 15 9.328 1.353 -9.514 1.00 0.00 H new ATOM 0 HG2 LYS A 15 11.275 2.169 -8.575 1.00 0.00 H new ATOM 0 HG3 LYS A 15 10.453 2.807 -7.165 1.00 0.00 H new ATOM 0 HD2 LYS A 15 10.132 0.257 -6.500 1.00 0.00 H new ATOM 0 HD3 LYS A 15 11.413 -0.040 -7.659 1.00 0.00 H new ATOM 0 HE2 LYS A 15 12.588 0.271 -5.614 1.00 0.00 H new ATOM 0 HE3 LYS A 15 12.747 1.823 -6.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 12.058 1.887 -4.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 11.052 2.753 -5.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 10.561 1.238 -4.484 1.00 0.00 H new ATOM 231 N ALA A 16 6.435 2.536 -9.978 1.00 0.00 N ATOM 232 CA ALA A 16 5.665 2.858 -11.162 1.00 0.00 C ATOM 233 C ALA A 16 5.410 4.351 -11.333 1.00 0.00 C ATOM 234 O ALA A 16 5.696 4.887 -12.390 1.00 0.00 O ATOM 235 CB ALA A 16 4.383 2.074 -11.148 1.00 0.00 C ATOM 0 H ALA A 16 6.015 1.825 -9.379 1.00 0.00 H new ATOM 0 HA ALA A 16 6.259 2.572 -12.030 1.00 0.00 H new ATOM 0 HB1 ALA A 16 3.800 2.313 -12.038 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.609 1.008 -11.138 1.00 0.00 H new ATOM 0 HB3 ALA A 16 3.809 2.331 -10.258 1.00 0.00 H new ATOM 241 N GLU A 17 4.962 5.049 -10.299 1.00 0.00 N ATOM 242 CA GLU A 17 4.853 6.509 -10.326 1.00 0.00 C ATOM 243 C GLU A 17 6.232 7.187 -10.208 1.00 0.00 C ATOM 244 O GLU A 17 6.554 8.059 -10.999 1.00 0.00 O ATOM 245 CB GLU A 17 3.827 7.015 -9.301 1.00 0.00 C ATOM 246 CG GLU A 17 4.091 6.450 -7.908 1.00 0.00 C ATOM 247 CD GLU A 17 3.387 7.131 -6.747 1.00 0.00 C ATOM 248 OE1 GLU A 17 2.208 7.511 -6.895 1.00 0.00 O ATOM 249 OE2 GLU A 17 4.054 7.231 -5.694 1.00 0.00 O ATOM 0 H GLU A 17 4.664 4.626 -9.420 1.00 0.00 H new ATOM 0 HA GLU A 17 4.467 6.801 -11.303 1.00 0.00 H new ATOM 0 HB2 GLU A 17 3.858 8.104 -9.263 1.00 0.00 H new ATOM 0 HB3 GLU A 17 2.824 6.735 -9.623 1.00 0.00 H new ATOM 0 HG2 GLU A 17 3.805 5.398 -7.908 1.00 0.00 H new ATOM 0 HG3 GLU A 17 5.165 6.489 -7.724 1.00 0.00 H new ATOM 256 N SER A 18 7.096 6.795 -9.264 1.00 0.00 N ATOM 257 CA SER A 18 8.406 7.421 -8.972 1.00 0.00 C ATOM 258 C SER A 18 9.392 7.248 -10.109 1.00 0.00 C ATOM 259 O SER A 18 9.934 8.237 -10.569 1.00 0.00 O ATOM 260 CB SER A 18 9.116 6.907 -7.718 1.00 0.00 C ATOM 261 OG SER A 18 10.402 7.463 -7.515 1.00 0.00 O ATOM 0 H SER A 18 6.900 6.001 -8.654 1.00 0.00 H new ATOM 0 HA SER A 18 8.131 8.464 -8.819 1.00 0.00 H new ATOM 0 HB2 SER A 18 8.496 7.124 -6.848 1.00 0.00 H new ATOM 0 HB3 SER A 18 9.206 5.823 -7.783 1.00 0.00 H new ATOM 0 HG SER A 18 10.794 7.091 -6.697 1.00 0.00 H new ATOM 267 N ASN A 19 9.677 6.023 -10.555 1.00 0.00 N ATOM 268 CA ASN A 19 10.430 5.736 -11.771 1.00 0.00 C ATOM 269 C ASN A 19 10.026 6.693 -12.905 1.00 0.00 C ATOM 270 O ASN A 19 10.887 7.352 -13.475 1.00 0.00 O ATOM 271 CB ASN A 19 10.367 4.234 -12.143 1.00 0.00 C ATOM 272 CG ASN A 19 11.517 3.814 -13.014 1.00 0.00 C ATOM 273 OD1 ASN A 19 11.401 3.089 -13.977 1.00 0.00 O ATOM 274 ND2 ASN A 19 12.711 4.172 -12.647 1.00 0.00 N ATOM 0 H ASN A 19 9.380 5.180 -10.063 1.00 0.00 H new ATOM 0 HA ASN A 19 11.486 5.930 -11.585 1.00 0.00 H new ATOM 0 HB2 ASN A 19 10.367 3.636 -11.232 1.00 0.00 H new ATOM 0 HB3 ASN A 19 9.429 4.029 -12.659 1.00 0.00 H new ATOM 0 HD21 ASN A 19 13.525 3.843 -13.167 1.00 0.00 H new ATOM 0 HD22 ASN A 19 12.835 4.782 -11.839 1.00 0.00 H new ATOM 281 N SER A 20 8.726 6.907 -13.118 1.00 0.00 N ATOM 282 CA SER A 20 8.130 7.854 -14.073 1.00 0.00 C ATOM 283 C SER A 20 8.156 9.331 -13.674 1.00 0.00 C ATOM 284 O SER A 20 8.059 10.170 -14.561 1.00 0.00 O ATOM 285 CB SER A 20 6.669 7.502 -14.356 1.00 0.00 C ATOM 286 OG SER A 20 5.769 8.599 -14.377 1.00 0.00 O ATOM 0 H SER A 20 8.014 6.394 -12.598 1.00 0.00 H new ATOM 0 HA SER A 20 8.773 7.744 -14.947 1.00 0.00 H new ATOM 0 HB2 SER A 20 6.616 6.993 -15.318 1.00 0.00 H new ATOM 0 HB3 SER A 20 6.332 6.792 -13.601 1.00 0.00 H new ATOM 0 HG SER A 20 5.195 8.536 -15.169 1.00 0.00 H new ATOM 292 N HIS A 21 8.139 9.691 -12.381 1.00 0.00 N ATOM 293 CA HIS A 21 8.209 11.061 -11.818 1.00 0.00 C ATOM 294 C HIS A 21 9.436 11.803 -12.335 1.00 0.00 C ATOM 295 O HIS A 21 9.374 13.021 -12.495 1.00 0.00 O ATOM 296 CB HIS A 21 8.230 11.083 -10.257 1.00 0.00 C ATOM 297 CG HIS A 21 6.903 11.143 -9.527 1.00 0.00 C ATOM 298 ND1 HIS A 21 6.720 11.478 -8.196 1.00 0.00 N ATOM 299 CD2 HIS A 21 5.682 10.818 -10.036 1.00 0.00 C ATOM 300 CE1 HIS A 21 5.407 11.369 -7.904 1.00 0.00 C ATOM 301 NE2 HIS A 21 4.763 10.936 -9.004 1.00 0.00 N ATOM 0 H HIS A 21 8.071 8.988 -11.645 1.00 0.00 H new ATOM 0 HA HIS A 21 7.299 11.560 -12.150 1.00 0.00 H new ATOM 0 HB2 HIS A 21 8.757 10.191 -9.918 1.00 0.00 H new ATOM 0 HB3 HIS A 21 8.823 11.942 -9.943 1.00 0.00 H new ATOM 0 HD2 HIS A 21 5.469 10.523 -11.053 1.00 0.00 H new ATOM 0 HE1 HIS A 21 4.951 11.591 -6.951 1.00 0.00 H new ATOM 0 HE2 HIS A 21 3.766 10.729 -9.068 1.00 0.00 H new ATOM 310 N HIS A 22 10.542 11.069 -12.522 1.00 0.00 N ATOM 311 CA HIS A 22 11.790 11.520 -13.110 1.00 0.00 C ATOM 312 C HIS A 22 11.707 11.650 -14.630 1.00 0.00 C ATOM 313 O HIS A 22 12.257 12.602 -15.165 1.00 0.00 O ATOM 314 CB HIS A 22 12.959 10.571 -12.778 1.00 0.00 C ATOM 315 CG HIS A 22 12.862 9.588 -11.651 1.00 0.00 C ATOM 316 ND1 HIS A 22 13.328 8.296 -11.700 1.00 0.00 N ATOM 317 CD2 HIS A 22 12.316 9.796 -10.429 1.00 0.00 C ATOM 318 CE1 HIS A 22 13.054 7.713 -10.522 1.00 0.00 C ATOM 319 NE2 HIS A 22 12.425 8.605 -9.737 1.00 0.00 N ATOM 0 H HIS A 22 10.581 10.088 -12.247 1.00 0.00 H new ATOM 0 HA HIS A 22 11.972 12.502 -12.673 1.00 0.00 H new ATOM 0 HB2 HIS A 22 13.172 10.000 -13.682 1.00 0.00 H new ATOM 0 HB3 HIS A 22 13.831 11.195 -12.582 1.00 0.00 H new ATOM 0 HD2 HIS A 22 11.880 10.715 -10.066 1.00 0.00 H new ATOM 0 HE1 HIS A 22 13.298 6.697 -10.250 1.00 0.00 H new ATOM 0 HE2 HIS A 22 12.086 8.432 -8.791 1.00 0.00 H new ATOM 328 N ALA A 23 11.075 10.666 -15.286 1.00 0.00 N ATOM 329 CA ALA A 23 10.775 10.604 -16.715 1.00 0.00 C ATOM 330 C ALA A 23 10.197 11.934 -17.238 1.00 0.00 C ATOM 331 O ALA A 23 9.218 12.434 -16.675 1.00 0.00 O ATOM 332 CB ALA A 23 9.795 9.469 -17.005 1.00 0.00 C ATOM 0 H ALA A 23 10.739 9.838 -14.794 1.00 0.00 H new ATOM 0 HA ALA A 23 11.715 10.416 -17.235 1.00 0.00 H new ATOM 0 HB1 ALA A 23 9.582 9.436 -18.073 1.00 0.00 H new ATOM 0 HB2 ALA A 23 10.234 8.521 -16.693 1.00 0.00 H new ATOM 0 HB3 ALA A 23 8.869 9.638 -16.455 1.00 0.00 H new ATOM 338 N PRO A 24 10.764 12.506 -18.306 1.00 0.00 N ATOM 339 CA PRO A 24 10.357 13.797 -18.812 1.00 0.00 C ATOM 340 C PRO A 24 8.940 13.752 -19.363 1.00 0.00 C ATOM 341 O PRO A 24 8.504 12.759 -19.943 1.00 0.00 O ATOM 342 CB PRO A 24 11.365 14.183 -19.882 1.00 0.00 C ATOM 343 CG PRO A 24 11.980 12.865 -20.295 1.00 0.00 C ATOM 344 CD PRO A 24 11.677 11.861 -19.209 1.00 0.00 C ATOM 0 HA PRO A 24 10.342 14.541 -18.016 1.00 0.00 H new ATOM 0 HB2 PRO A 24 10.883 14.680 -20.724 1.00 0.00 H new ATOM 0 HB3 PRO A 24 12.117 14.870 -19.493 1.00 0.00 H new ATOM 0 HG2 PRO A 24 11.570 12.533 -21.249 1.00 0.00 H new ATOM 0 HG3 PRO A 24 13.056 12.970 -20.430 1.00 0.00 H new ATOM 0 HD2 PRO A 24 11.236 10.957 -19.628 1.00 0.00 H new ATOM 0 HD3 PRO A 24 12.588 11.561 -18.692 1.00 0.00 H new ATOM 352 N LEU A 25 8.221 14.865 -19.215 1.00 0.00 N ATOM 353 CA LEU A 25 6.851 14.974 -19.685 1.00 0.00 C ATOM 354 C LEU A 25 6.791 15.241 -21.195 1.00 0.00 C ATOM 355 O LEU A 25 6.907 16.379 -21.643 1.00 0.00 O ATOM 356 CB LEU A 25 6.108 16.046 -18.869 1.00 0.00 C ATOM 357 CG LEU A 25 4.872 15.559 -18.087 1.00 0.00 C ATOM 358 CD1 LEU A 25 3.896 16.672 -17.634 1.00 0.00 C ATOM 359 CD2 LEU A 25 4.203 14.266 -18.586 1.00 0.00 C ATOM 0 H LEU A 25 8.575 15.710 -18.767 1.00 0.00 H new ATOM 0 HA LEU A 25 6.346 14.021 -19.529 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.810 16.489 -18.162 1.00 0.00 H new ATOM 0 HB3 LEU A 25 5.795 16.840 -19.547 1.00 0.00 H new ATOM 0 HG LEU A 25 5.327 15.222 -17.156 1.00 0.00 H new ATOM 0 HD11 LEU A 25 3.061 16.226 -17.093 1.00 0.00 H new ATOM 0 HD12 LEU A 25 4.419 17.371 -16.982 1.00 0.00 H new ATOM 0 HD13 LEU A 25 3.519 17.204 -18.508 1.00 0.00 H new ATOM 0 HD21 LEU A 25 3.347 14.031 -17.953 1.00 0.00 H new ATOM 0 HD22 LEU A 25 3.867 14.403 -19.614 1.00 0.00 H new ATOM 0 HD23 LEU A 25 4.920 13.446 -18.545 1.00 0.00 H new ATOM 371 N SER A 26 6.651 14.185 -21.988 1.00 0.00 N ATOM 372 CA SER A 26 6.677 14.206 -23.451 1.00 0.00 C ATOM 373 C SER A 26 6.488 12.798 -24.014 1.00 0.00 C ATOM 374 O SER A 26 6.608 11.811 -23.292 1.00 0.00 O ATOM 375 CB SER A 26 8.032 14.746 -23.922 1.00 0.00 C ATOM 376 OG SER A 26 8.010 16.141 -24.087 1.00 0.00 O ATOM 0 H SER A 26 6.510 13.247 -21.614 1.00 0.00 H new ATOM 0 HA SER A 26 5.866 14.843 -23.805 1.00 0.00 H new ATOM 0 HB2 SER A 26 8.801 14.478 -23.198 1.00 0.00 H new ATOM 0 HB3 SER A 26 8.304 14.273 -24.866 1.00 0.00 H new ATOM 0 HG SER A 26 7.610 16.558 -23.295 1.00 0.00 H new ATOM 382 N ASP A 27 6.245 12.711 -25.320 1.00 0.00 N ATOM 383 CA ASP A 27 6.131 11.475 -26.092 1.00 0.00 C ATOM 384 C ASP A 27 7.342 11.333 -26.982 1.00 0.00 C ATOM 385 O ASP A 27 7.591 12.201 -27.814 1.00 0.00 O ATOM 386 CB ASP A 27 4.852 11.434 -26.909 1.00 0.00 C ATOM 387 CG ASP A 27 4.937 10.581 -28.211 1.00 0.00 C ATOM 388 OD1 ASP A 27 5.212 9.366 -28.059 1.00 0.00 O ATOM 389 OD2 ASP A 27 4.685 11.126 -29.295 1.00 0.00 O ATOM 0 H ASP A 27 6.116 13.542 -25.897 1.00 0.00 H new ATOM 0 HA ASP A 27 6.087 10.636 -25.398 1.00 0.00 H new ATOM 0 HB2 ASP A 27 4.051 11.040 -26.284 1.00 0.00 H new ATOM 0 HB3 ASP A 27 4.575 12.454 -27.177 1.00 0.00 H new ATOM 394 N GLY A 28 8.114 10.269 -26.772 1.00 0.00 N ATOM 395 CA GLY A 28 9.200 9.924 -27.686 1.00 0.00 C ATOM 396 C GLY A 28 10.183 11.068 -27.889 1.00 0.00 C ATOM 397 O GLY A 28 10.368 11.568 -28.995 1.00 0.00 O ATOM 0 H GLY A 28 8.009 9.634 -25.981 1.00 0.00 H new ATOM 0 HA2 GLY A 28 9.734 9.056 -27.298 1.00 0.00 H new ATOM 0 HA3 GLY A 28 8.780 9.636 -28.650 1.00 0.00 H new ATOM 401 N LYS A 29 10.835 11.464 -26.793 1.00 0.00 N ATOM 402 CA LYS A 29 11.781 12.601 -26.712 1.00 0.00 C ATOM 403 C LYS A 29 12.943 12.411 -25.748 1.00 0.00 C ATOM 404 O LYS A 29 13.598 13.368 -25.336 1.00 0.00 O ATOM 405 CB LYS A 29 11.007 13.908 -26.441 1.00 0.00 C ATOM 406 CG LYS A 29 10.707 14.678 -27.740 1.00 0.00 C ATOM 407 CD LYS A 29 11.439 16.021 -27.788 1.00 0.00 C ATOM 408 CE LYS A 29 11.757 16.380 -29.237 1.00 0.00 C ATOM 409 NZ LYS A 29 12.664 17.546 -29.285 1.00 0.00 N ATOM 0 H LYS A 29 10.720 10.989 -25.898 1.00 0.00 H new ATOM 0 HA LYS A 29 12.267 12.660 -27.686 1.00 0.00 H new ATOM 0 HB2 LYS A 29 10.071 13.677 -25.932 1.00 0.00 H new ATOM 0 HB3 LYS A 29 11.587 14.541 -25.770 1.00 0.00 H new ATOM 0 HG2 LYS A 29 11.002 14.073 -28.597 1.00 0.00 H new ATOM 0 HG3 LYS A 29 9.633 14.846 -27.823 1.00 0.00 H new ATOM 0 HD2 LYS A 29 10.823 16.799 -27.337 1.00 0.00 H new ATOM 0 HD3 LYS A 29 12.359 15.966 -27.206 1.00 0.00 H new ATOM 0 HE2 LYS A 29 12.219 15.529 -29.737 1.00 0.00 H new ATOM 0 HE3 LYS A 29 10.836 16.604 -29.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 12.874 17.782 -30.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 12.208 18.360 -28.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 13.549 17.318 -28.788 1.00 0.00 H new ATOM 423 N THR A 30 13.221 11.162 -25.432 1.00 0.00 N ATOM 424 CA THR A 30 14.287 10.729 -24.547 1.00 0.00 C ATOM 425 C THR A 30 15.244 9.861 -25.336 1.00 0.00 C ATOM 426 O THR A 30 14.890 9.287 -26.367 1.00 0.00 O ATOM 427 CB THR A 30 13.684 9.930 -23.404 1.00 0.00 C ATOM 428 OG1 THR A 30 13.141 8.746 -23.881 1.00 0.00 O ATOM 429 CG2 THR A 30 12.582 10.707 -22.711 1.00 0.00 C ATOM 0 H THR A 30 12.682 10.380 -25.804 1.00 0.00 H new ATOM 0 HA THR A 30 14.822 11.588 -24.141 1.00 0.00 H new ATOM 0 HB THR A 30 14.485 9.725 -22.694 1.00 0.00 H new ATOM 0 HG1 THR A 30 12.710 8.264 -23.145 1.00 0.00 H new ATOM 0 HG21 THR A 30 12.171 10.109 -21.898 1.00 0.00 H new ATOM 0 HG22 THR A 30 12.989 11.635 -22.309 1.00 0.00 H new ATOM 0 HG23 THR A 30 11.793 10.937 -23.427 1.00 0.00 H new ATOM 437 N GLY A 31 16.470 9.750 -24.840 1.00 0.00 N ATOM 438 CA GLY A 31 17.531 9.003 -25.511 1.00 0.00 C ATOM 439 C GLY A 31 17.188 7.603 -25.942 1.00 0.00 C ATOM 440 O GLY A 31 17.432 7.203 -27.078 1.00 0.00 O ATOM 0 H GLY A 31 16.759 10.176 -23.959 1.00 0.00 H new ATOM 0 HA2 GLY A 31 17.842 9.566 -26.391 1.00 0.00 H new ATOM 0 HA3 GLY A 31 18.391 8.955 -24.843 1.00 0.00 H new ATOM 444 N SER A 32 16.735 6.816 -24.984 1.00 0.00 N ATOM 445 CA SER A 32 16.188 5.513 -25.282 1.00 0.00 C ATOM 446 C SER A 32 14.925 5.580 -26.163 1.00 0.00 C ATOM 447 O SER A 32 14.965 4.975 -27.233 1.00 0.00 O ATOM 448 CB SER A 32 15.922 4.698 -24.037 1.00 0.00 C ATOM 449 OG SER A 32 15.642 3.418 -24.530 1.00 0.00 O ATOM 0 H SER A 32 16.737 7.060 -23.994 1.00 0.00 H new ATOM 0 HA SER A 32 16.961 5.003 -25.857 1.00 0.00 H new ATOM 0 HB2 SER A 32 16.785 4.691 -23.372 1.00 0.00 H new ATOM 0 HB3 SER A 32 15.084 5.100 -23.467 1.00 0.00 H new ATOM 0 HG SER A 32 15.374 3.481 -25.471 1.00 0.00 H new ATOM 455 N SER A 33 13.830 6.219 -25.681 1.00 0.00 N ATOM 456 CA SER A 33 12.489 6.478 -26.288 1.00 0.00 C ATOM 457 C SER A 33 11.369 6.806 -25.313 1.00 0.00 C ATOM 458 O SER A 33 10.445 7.549 -25.622 1.00 0.00 O ATOM 459 CB SER A 33 11.912 5.287 -27.047 1.00 0.00 C ATOM 460 OG SER A 33 12.086 5.534 -28.414 1.00 0.00 O ATOM 0 H SER A 33 13.865 6.616 -24.742 1.00 0.00 H new ATOM 0 HA SER A 33 12.740 7.329 -26.922 1.00 0.00 H new ATOM 0 HB2 SER A 33 12.418 4.366 -26.757 1.00 0.00 H new ATOM 0 HB3 SER A 33 10.855 5.158 -26.812 1.00 0.00 H new ATOM 0 HG SER A 33 11.726 4.783 -28.931 1.00 0.00 H new ATOM 466 N TYR A 34 11.341 6.067 -24.209 1.00 0.00 N ATOM 467 CA TYR A 34 10.337 6.170 -23.152 1.00 0.00 C ATOM 468 C TYR A 34 10.556 7.362 -22.190 1.00 0.00 C ATOM 469 O TYR A 34 11.696 7.638 -21.843 1.00 0.00 O ATOM 470 CB TYR A 34 10.339 4.903 -22.309 1.00 0.00 C ATOM 471 CG TYR A 34 10.043 3.652 -23.095 1.00 0.00 C ATOM 472 CD1 TYR A 34 11.094 2.946 -23.705 1.00 0.00 C ATOM 473 CD2 TYR A 34 8.723 3.177 -23.201 1.00 0.00 C ATOM 474 CE1 TYR A 34 10.827 1.803 -24.475 1.00 0.00 C ATOM 475 CE2 TYR A 34 8.463 1.992 -23.896 1.00 0.00 C ATOM 476 CZ TYR A 34 9.494 1.330 -24.569 1.00 0.00 C ATOM 477 OH TYR A 34 9.121 0.246 -25.295 1.00 0.00 O ATOM 0 H TYR A 34 12.043 5.352 -24.017 1.00 0.00 H new ATOM 0 HA TYR A 34 9.389 6.322 -23.669 1.00 0.00 H new ATOM 0 HB2 TYR A 34 11.312 4.798 -21.829 1.00 0.00 H new ATOM 0 HB3 TYR A 34 9.601 5.005 -21.514 1.00 0.00 H new ATOM 0 HD1 TYR A 34 12.112 3.284 -23.581 1.00 0.00 H new ATOM 0 HD2 TYR A 34 7.912 3.727 -22.746 1.00 0.00 H new ATOM 0 HE1 TYR A 34 11.627 1.291 -24.989 1.00 0.00 H new ATOM 0 HE2 TYR A 34 7.462 1.587 -23.913 1.00 0.00 H new ATOM 0 HH TYR A 34 8.154 0.111 -25.209 1.00 0.00 H new ATOM 487 N PRO A 35 9.513 7.990 -21.634 1.00 0.00 N ATOM 488 CA PRO A 35 8.121 7.708 -21.876 1.00 0.00 C ATOM 489 C PRO A 35 7.715 8.173 -23.262 1.00 0.00 C ATOM 490 O PRO A 35 8.400 8.937 -23.938 1.00 0.00 O ATOM 491 CB PRO A 35 7.328 8.390 -20.775 1.00 0.00 C ATOM 492 CG PRO A 35 8.242 9.483 -20.271 1.00 0.00 C ATOM 493 CD PRO A 35 9.641 9.162 -20.804 1.00 0.00 C ATOM 0 HA PRO A 35 7.922 6.637 -21.853 1.00 0.00 H new ATOM 0 HB2 PRO A 35 6.392 8.799 -21.155 1.00 0.00 H new ATOM 0 HB3 PRO A 35 7.070 7.690 -19.980 1.00 0.00 H new ATOM 0 HG2 PRO A 35 7.908 10.460 -20.621 1.00 0.00 H new ATOM 0 HG3 PRO A 35 8.241 9.518 -19.182 1.00 0.00 H new ATOM 0 HD2 PRO A 35 10.038 10.000 -21.377 1.00 0.00 H new ATOM 0 HD3 PRO A 35 10.335 8.980 -19.983 1.00 0.00 H new ATOM 501 N HIS A 36 6.593 7.628 -23.683 1.00 0.00 N ATOM 502 CA HIS A 36 5.993 7.837 -24.986 1.00 0.00 C ATOM 503 C HIS A 36 4.493 7.967 -24.798 1.00 0.00 C ATOM 504 O HIS A 36 4.001 7.820 -23.680 1.00 0.00 O ATOM 505 CB HIS A 36 6.450 6.798 -26.018 1.00 0.00 C ATOM 506 CG HIS A 36 6.199 5.357 -25.735 1.00 0.00 C ATOM 507 ND1 HIS A 36 5.656 4.442 -26.603 1.00 0.00 N ATOM 508 CD2 HIS A 36 6.364 4.751 -24.542 1.00 0.00 C ATOM 509 CE1 HIS A 36 5.563 3.271 -25.958 1.00 0.00 C ATOM 510 NE2 HIS A 36 5.998 3.451 -24.711 1.00 0.00 N ATOM 0 H HIS A 36 6.047 6.996 -23.098 1.00 0.00 H new ATOM 0 HA HIS A 36 6.344 8.769 -25.429 1.00 0.00 H new ATOM 0 HB2 HIS A 36 5.969 7.038 -26.966 1.00 0.00 H new ATOM 0 HB3 HIS A 36 7.523 6.925 -26.164 1.00 0.00 H new ATOM 0 HD2 HIS A 36 6.718 5.208 -23.630 1.00 0.00 H new ATOM 0 HE1 HIS A 36 5.199 2.344 -26.376 1.00 0.00 H new ATOM 0 HE2 HIS A 36 6.049 2.727 -23.994 1.00 0.00 H new ATOM 519 N TRP A 37 3.785 8.292 -25.865 1.00 0.00 N ATOM 520 CA TRP A 37 2.342 8.314 -25.872 1.00 0.00 C ATOM 521 C TRP A 37 1.786 6.914 -25.934 1.00 0.00 C ATOM 522 O TRP A 37 2.163 6.072 -26.755 1.00 0.00 O ATOM 523 CB TRP A 37 1.855 9.035 -27.109 1.00 0.00 C ATOM 524 CG TRP A 37 0.405 8.976 -27.415 1.00 0.00 C ATOM 525 CD1 TRP A 37 -0.615 9.169 -26.556 1.00 0.00 C ATOM 526 CD2 TRP A 37 -0.188 8.725 -28.709 1.00 0.00 C ATOM 527 NE1 TRP A 37 -1.816 9.048 -27.222 1.00 0.00 N ATOM 528 CE2 TRP A 37 -1.600 8.777 -28.557 1.00 0.00 C ATOM 529 CE3 TRP A 37 0.341 8.410 -29.976 1.00 0.00 C ATOM 530 CZ2 TRP A 37 -2.453 8.461 -29.609 1.00 0.00 C ATOM 531 CZ3 TRP A 37 -0.516 8.084 -31.044 1.00 0.00 C ATOM 532 CH2 TRP A 37 -1.905 8.058 -30.834 1.00 0.00 C ATOM 0 H TRP A 37 4.205 8.550 -26.758 1.00 0.00 H new ATOM 0 HA TRP A 37 2.012 8.812 -24.960 1.00 0.00 H new ATOM 0 HB2 TRP A 37 2.136 10.084 -27.018 1.00 0.00 H new ATOM 0 HB3 TRP A 37 2.395 8.633 -27.966 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -0.508 9.386 -25.503 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -2.734 9.145 -26.789 1.00 0.00 H new ATOM 0 HE3 TRP A 37 1.410 8.419 -30.129 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -3.524 8.525 -29.483 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -0.109 7.856 -32.018 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -2.558 7.723 -31.626 1.00 0.00 H new ATOM 543 N PHE A 38 0.751 6.772 -25.132 1.00 0.00 N ATOM 544 CA PHE A 38 -0.092 5.652 -24.911 1.00 0.00 C ATOM 545 C PHE A 38 -1.395 6.013 -25.589 1.00 0.00 C ATOM 546 O PHE A 38 -2.279 6.665 -25.031 1.00 0.00 O ATOM 547 CB PHE A 38 -0.214 5.426 -23.411 1.00 0.00 C ATOM 548 CG PHE A 38 -1.112 4.271 -23.094 1.00 0.00 C ATOM 549 CD1 PHE A 38 -0.925 3.015 -23.694 1.00 0.00 C ATOM 550 CD2 PHE A 38 -2.237 4.500 -22.294 1.00 0.00 C ATOM 551 CE1 PHE A 38 -1.876 2.011 -23.471 1.00 0.00 C ATOM 552 CE2 PHE A 38 -3.120 3.474 -21.995 1.00 0.00 C ATOM 553 CZ PHE A 38 -2.940 2.227 -22.578 1.00 0.00 C ATOM 0 H PHE A 38 0.457 7.556 -24.549 1.00 0.00 H new ATOM 0 HA PHE A 38 0.280 4.712 -25.319 1.00 0.00 H new ATOM 0 HB2 PHE A 38 0.775 5.244 -22.989 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -0.601 6.328 -22.938 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -0.063 2.827 -24.317 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -2.420 5.490 -21.904 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -1.791 1.066 -23.988 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -3.941 3.643 -21.314 1.00 0.00 H new ATOM 0 HZ PHE A 38 -3.619 1.420 -22.345 1.00 0.00 H new ATOM 563 N THR A 39 -1.453 5.594 -26.851 1.00 0.00 N ATOM 564 CA THR A 39 -2.668 5.488 -27.674 1.00 0.00 C ATOM 565 C THR A 39 -3.832 4.930 -26.889 1.00 0.00 C ATOM 566 O THR A 39 -4.951 5.374 -27.086 1.00 0.00 O ATOM 567 CB THR A 39 -2.473 4.616 -28.937 1.00 0.00 C ATOM 568 OG1 THR A 39 -2.136 3.307 -28.550 1.00 0.00 O ATOM 569 CG2 THR A 39 -1.321 5.096 -29.825 1.00 0.00 C ATOM 0 H THR A 39 -0.616 5.304 -27.357 1.00 0.00 H new ATOM 0 HA THR A 39 -2.883 6.510 -27.986 1.00 0.00 H new ATOM 0 HB THR A 39 -3.410 4.674 -29.491 1.00 0.00 H new ATOM 0 HG1 THR A 39 -2.013 2.751 -29.348 1.00 0.00 H new ATOM 0 HG21 THR A 39 -1.235 4.444 -30.694 1.00 0.00 H new ATOM 0 HG22 THR A 39 -1.517 6.116 -30.155 1.00 0.00 H new ATOM 0 HG23 THR A 39 -0.390 5.070 -29.259 1.00 0.00 H new ATOM 577 N ASN A 40 -3.604 3.956 -25.996 1.00 0.00 N ATOM 578 CA ASN A 40 -4.674 3.351 -25.185 1.00 0.00 C ATOM 579 C ASN A 40 -5.755 2.714 -26.050 1.00 0.00 C ATOM 580 O ASN A 40 -6.857 2.464 -25.609 1.00 0.00 O ATOM 581 CB ASN A 40 -5.207 4.413 -24.185 1.00 0.00 C ATOM 582 CG ASN A 40 -6.138 3.867 -23.109 1.00 0.00 C ATOM 583 OD1 ASN A 40 -6.024 2.737 -22.664 1.00 0.00 O ATOM 584 ND2 ASN A 40 -7.085 4.642 -22.641 1.00 0.00 N ATOM 0 H ASN A 40 -2.679 3.566 -25.815 1.00 0.00 H new ATOM 0 HA ASN A 40 -4.274 2.521 -24.603 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -4.357 4.894 -23.701 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -5.735 5.186 -24.744 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -7.714 4.298 -21.915 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -7.194 5.590 -23.002 1.00 0.00 H new ATOM 591 N GLY A 41 -5.470 2.462 -27.318 1.00 0.00 N ATOM 592 CA GLY A 41 -6.484 2.143 -28.289 1.00 0.00 C ATOM 593 C GLY A 41 -6.773 3.257 -29.299 1.00 0.00 C ATOM 594 O GLY A 41 -6.941 2.881 -30.457 1.00 0.00 O ATOM 0 H GLY A 41 -4.523 2.475 -27.696 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -6.180 1.248 -28.832 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -7.407 1.898 -27.764 1.00 0.00 H new ATOM 598 N TYR A 42 -6.878 4.540 -28.889 1.00 0.00 N ATOM 599 CA TYR A 42 -7.111 5.757 -29.700 1.00 0.00 C ATOM 600 C TYR A 42 -6.218 5.788 -30.941 1.00 0.00 C ATOM 601 O TYR A 42 -5.128 5.225 -30.938 1.00 0.00 O ATOM 602 CB TYR A 42 -6.858 7.052 -28.871 1.00 0.00 C ATOM 603 CG TYR A 42 -7.828 7.245 -27.721 1.00 0.00 C ATOM 604 CD1 TYR A 42 -9.105 7.688 -28.067 1.00 0.00 C ATOM 605 CD2 TYR A 42 -7.506 7.064 -26.354 1.00 0.00 C ATOM 606 CE1 TYR A 42 -10.059 7.971 -27.086 1.00 0.00 C ATOM 607 CE2 TYR A 42 -8.489 7.274 -25.356 1.00 0.00 C ATOM 608 CZ TYR A 42 -9.782 7.715 -25.739 1.00 0.00 C ATOM 609 OH TYR A 42 -10.814 7.944 -24.894 1.00 0.00 O ATOM 0 H TYR A 42 -6.795 4.771 -27.899 1.00 0.00 H new ATOM 0 HA TYR A 42 -8.155 5.723 -30.010 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -5.842 7.026 -28.476 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -6.920 7.914 -29.535 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -9.360 7.814 -29.109 1.00 0.00 H new ATOM 0 HD2 TYR A 42 -6.508 6.765 -26.071 1.00 0.00 H new ATOM 0 HE1 TYR A 42 -11.014 8.389 -27.369 1.00 0.00 H new ATOM 0 HE2 TYR A 42 -8.257 7.100 -24.316 1.00 0.00 H new ATOM 0 HH TYR A 42 -10.466 8.182 -24.010 1.00 0.00 H new ATOM 619 N ASP A 43 -6.650 6.497 -31.979 1.00 0.00 N ATOM 620 CA ASP A 43 -5.858 6.633 -33.220 1.00 0.00 C ATOM 621 C ASP A 43 -4.774 7.713 -33.136 1.00 0.00 C ATOM 622 O ASP A 43 -3.696 7.578 -33.713 1.00 0.00 O ATOM 623 CB ASP A 43 -6.790 6.934 -34.404 1.00 0.00 C ATOM 624 CG ASP A 43 -7.017 5.768 -35.383 1.00 0.00 C ATOM 625 OD1 ASP A 43 -6.199 4.818 -35.401 1.00 0.00 O ATOM 626 OD2 ASP A 43 -8.047 5.816 -36.092 1.00 0.00 O ATOM 0 H ASP A 43 -7.543 6.990 -31.996 1.00 0.00 H new ATOM 0 HA ASP A 43 -5.346 5.682 -33.365 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -7.757 7.249 -34.012 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -6.381 7.778 -34.960 1.00 0.00 H new ATOM 631 N GLY A 44 -5.071 8.795 -32.412 1.00 0.00 N ATOM 632 CA GLY A 44 -4.234 9.991 -32.257 1.00 0.00 C ATOM 633 C GLY A 44 -4.821 11.009 -31.281 1.00 0.00 C ATOM 634 O GLY A 44 -4.270 11.215 -30.202 1.00 0.00 O ATOM 0 H GLY A 44 -5.945 8.866 -31.891 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -3.245 9.693 -31.910 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -4.102 10.464 -33.230 1.00 0.00 H new ATOM 638 N ASP A 45 -5.939 11.632 -31.665 1.00 0.00 N ATOM 639 CA ASP A 45 -6.656 12.703 -30.945 1.00 0.00 C ATOM 640 C ASP A 45 -8.078 12.337 -30.551 1.00 0.00 C ATOM 641 O ASP A 45 -8.478 12.357 -29.390 1.00 0.00 O ATOM 642 CB ASP A 45 -6.754 13.967 -31.829 1.00 0.00 C ATOM 643 CG ASP A 45 -5.993 15.126 -31.254 1.00 0.00 C ATOM 644 OD1 ASP A 45 -4.814 14.890 -30.904 1.00 0.00 O ATOM 645 OD2 ASP A 45 -6.567 16.215 -31.096 1.00 0.00 O ATOM 0 H ASP A 45 -6.401 11.391 -32.542 1.00 0.00 H new ATOM 0 HA ASP A 45 -6.075 12.871 -30.038 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -6.371 13.742 -32.824 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -7.801 14.245 -31.946 1.00 0.00 H new ATOM 650 N GLY A 46 -8.879 12.096 -31.586 1.00 0.00 N ATOM 651 CA GLY A 46 -10.265 11.691 -31.505 1.00 0.00 C ATOM 652 C GLY A 46 -10.396 10.327 -30.856 1.00 0.00 C ATOM 653 O GLY A 46 -9.453 9.770 -30.307 1.00 0.00 O ATOM 0 H GLY A 46 -8.555 12.185 -32.549 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -10.829 12.426 -30.931 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -10.699 11.665 -32.505 1.00 0.00 H new ATOM 657 N LYS A 47 -11.592 9.749 -30.940 1.00 0.00 N ATOM 658 CA LYS A 47 -11.777 8.373 -30.473 1.00 0.00 C ATOM 659 C LYS A 47 -10.876 7.348 -31.195 1.00 0.00 C ATOM 660 O LYS A 47 -9.984 7.637 -31.983 1.00 0.00 O ATOM 661 CB LYS A 47 -13.252 7.991 -30.502 1.00 0.00 C ATOM 662 CG LYS A 47 -13.691 7.799 -31.955 1.00 0.00 C ATOM 663 CD LYS A 47 -14.966 6.987 -31.987 1.00 0.00 C ATOM 664 CE LYS A 47 -15.509 7.041 -33.404 1.00 0.00 C ATOM 665 NZ LYS A 47 -16.762 6.265 -33.488 1.00 0.00 N ATOM 0 H LYS A 47 -12.428 10.195 -31.316 1.00 0.00 H new ATOM 0 HA LYS A 47 -11.445 8.341 -29.435 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -13.414 7.074 -29.936 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -13.851 8.768 -30.028 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -13.850 8.767 -32.430 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -12.909 7.292 -32.520 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -14.771 5.956 -31.691 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -15.694 7.389 -31.282 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -15.691 8.076 -33.695 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -14.774 6.639 -34.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -17.130 6.305 -34.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -16.575 5.275 -33.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -17.464 6.668 -32.835 1.00 0.00 H new ATOM 679 N LEU A 48 -11.143 6.092 -30.905 1.00 0.00 N ATOM 680 CA LEU A 48 -10.395 4.969 -31.429 1.00 0.00 C ATOM 681 C LEU A 48 -10.943 4.496 -32.780 1.00 0.00 C ATOM 682 O LEU A 48 -12.041 4.920 -33.176 1.00 0.00 O ATOM 683 CB LEU A 48 -10.311 3.878 -30.367 1.00 0.00 C ATOM 684 CG LEU A 48 -10.707 4.236 -28.927 1.00 0.00 C ATOM 685 CD1 LEU A 48 -12.237 4.091 -28.797 1.00 0.00 C ATOM 686 CD2 LEU A 48 -9.958 3.323 -27.981 1.00 0.00 C ATOM 0 H LEU A 48 -11.904 5.817 -30.284 1.00 0.00 H new ATOM 0 HA LEU A 48 -9.373 5.279 -31.650 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -10.942 3.050 -30.690 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -9.285 3.509 -30.349 1.00 0.00 H new ATOM 0 HG LEU A 48 -10.443 5.263 -28.675 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -12.541 4.341 -27.781 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -12.727 4.766 -29.499 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -12.525 3.064 -29.020 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -10.228 3.564 -26.953 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -10.221 2.286 -28.192 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -8.885 3.460 -28.116 1.00 0.00 H new ATOM 698 N PRO A 49 -10.223 3.600 -33.473 1.00 0.00 N ATOM 699 CA PRO A 49 -10.705 3.068 -34.721 1.00 0.00 C ATOM 700 C PRO A 49 -12.013 2.289 -34.490 1.00 0.00 C ATOM 701 O PRO A 49 -12.393 1.924 -33.371 1.00 0.00 O ATOM 702 CB PRO A 49 -9.543 2.246 -35.286 1.00 0.00 C ATOM 703 CG PRO A 49 -8.598 1.951 -34.125 1.00 0.00 C ATOM 704 CD PRO A 49 -9.020 2.909 -33.029 1.00 0.00 C ATOM 0 HA PRO A 49 -10.981 3.828 -35.452 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -9.907 1.320 -35.732 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -9.027 2.797 -36.072 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -8.684 0.914 -33.799 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -7.558 2.110 -34.411 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -9.212 2.367 -32.103 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -8.224 3.624 -32.821 1.00 0.00 H new ATOM 712 N LYS A 50 -12.740 2.010 -35.571 1.00 0.00 N ATOM 713 CA LYS A 50 -13.898 1.112 -35.580 1.00 0.00 C ATOM 714 C LYS A 50 -13.496 -0.299 -35.113 1.00 0.00 C ATOM 715 O LYS A 50 -12.914 -1.065 -35.860 1.00 0.00 O ATOM 716 CB LYS A 50 -14.587 1.176 -36.951 1.00 0.00 C ATOM 717 CG LYS A 50 -15.491 -0.029 -37.274 1.00 0.00 C ATOM 718 CD LYS A 50 -16.538 0.198 -38.362 1.00 0.00 C ATOM 719 CE LYS A 50 -17.898 0.476 -37.728 1.00 0.00 C ATOM 720 NZ LYS A 50 -17.934 1.811 -37.092 1.00 0.00 N ATOM 0 H LYS A 50 -12.537 2.410 -36.487 1.00 0.00 H new ATOM 0 HA LYS A 50 -14.646 1.437 -34.856 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -15.186 2.085 -36.999 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -13.822 1.257 -37.723 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -14.858 -0.864 -37.574 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -16.003 -0.330 -36.360 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -16.243 1.037 -38.992 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -16.600 -0.679 -39.007 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -18.676 0.413 -38.489 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -18.117 -0.289 -36.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -18.882 1.983 -36.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -17.231 1.850 -36.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -17.715 2.539 -37.801 1.00 0.00 H new ATOM 734 N GLY A 51 -13.815 -0.620 -33.864 1.00 0.00 N ATOM 735 CA GLY A 51 -13.452 -1.890 -33.229 1.00 0.00 C ATOM 736 C GLY A 51 -12.155 -1.764 -32.451 1.00 0.00 C ATOM 737 O GLY A 51 -11.104 -2.207 -32.899 1.00 0.00 O ATOM 0 H GLY A 51 -14.342 0.002 -33.251 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -14.252 -2.206 -32.559 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -13.349 -2.664 -33.990 1.00 0.00 H new ATOM 741 N ARG A 52 -12.239 -1.178 -31.259 1.00 0.00 N ATOM 742 CA ARG A 52 -11.152 -1.132 -30.287 1.00 0.00 C ATOM 743 C ARG A 52 -11.716 -1.123 -28.880 1.00 0.00 C ATOM 744 O ARG A 52 -12.836 -0.680 -28.652 1.00 0.00 O ATOM 745 CB ARG A 52 -10.327 0.127 -30.564 1.00 0.00 C ATOM 746 CG ARG A 52 -9.129 0.359 -29.650 1.00 0.00 C ATOM 747 CD ARG A 52 -8.143 -0.808 -29.705 1.00 0.00 C ATOM 748 NE ARG A 52 -6.858 -0.365 -30.222 1.00 0.00 N ATOM 749 CZ ARG A 52 -5.741 -1.049 -30.206 1.00 0.00 C ATOM 750 NH1 ARG A 52 -5.681 -2.283 -29.798 1.00 0.00 N ATOM 751 NH2 ARG A 52 -4.651 -0.474 -30.593 1.00 0.00 N ATOM 0 H ARG A 52 -13.086 -0.711 -30.935 1.00 0.00 H new ATOM 0 HA ARG A 52 -10.514 -2.011 -30.376 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -9.970 0.084 -31.593 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -10.986 0.992 -30.492 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -8.621 1.279 -29.941 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -9.474 0.496 -28.625 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -8.015 -1.231 -28.708 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -8.543 -1.600 -30.338 1.00 0.00 H new ATOM 0 HE ARG A 52 -6.823 0.566 -30.636 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -6.525 -2.755 -29.474 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -4.790 -2.779 -29.802 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -4.669 0.497 -30.904 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -3.772 -0.991 -30.587 1.00 0.00 H new ATOM 765 N THR A 53 -10.911 -1.601 -27.944 1.00 0.00 N ATOM 766 CA THR A 53 -11.202 -1.613 -26.511 1.00 0.00 C ATOM 767 C THR A 53 -10.057 -0.899 -25.763 1.00 0.00 C ATOM 768 O THR A 53 -8.969 -1.467 -25.652 1.00 0.00 O ATOM 769 CB THR A 53 -11.487 -3.054 -26.072 1.00 0.00 C ATOM 770 OG1 THR A 53 -12.709 -3.393 -26.695 1.00 0.00 O ATOM 771 CG2 THR A 53 -11.632 -3.220 -24.560 1.00 0.00 C ATOM 0 H THR A 53 -10.002 -2.007 -28.165 1.00 0.00 H new ATOM 0 HA THR A 53 -12.103 -1.053 -26.262 1.00 0.00 H new ATOM 0 HB THR A 53 -10.651 -3.693 -26.355 1.00 0.00 H new ATOM 0 HG1 THR A 53 -12.954 -4.312 -26.457 1.00 0.00 H new ATOM 0 HG21 THR A 53 -11.832 -4.266 -24.326 1.00 0.00 H new ATOM 0 HG22 THR A 53 -10.710 -2.909 -24.070 1.00 0.00 H new ATOM 0 HG23 THR A 53 -12.458 -2.604 -24.204 1.00 0.00 H new ATOM 779 N PRO A 54 -10.244 0.374 -25.348 1.00 0.00 N ATOM 780 CA PRO A 54 -9.306 1.080 -24.508 1.00 0.00 C ATOM 781 C PRO A 54 -9.284 0.502 -23.114 1.00 0.00 C ATOM 782 O PRO A 54 -10.298 0.025 -22.603 1.00 0.00 O ATOM 783 CB PRO A 54 -9.723 2.559 -24.503 1.00 0.00 C ATOM 784 CG PRO A 54 -11.193 2.563 -24.898 1.00 0.00 C ATOM 785 CD PRO A 54 -11.442 1.173 -25.496 1.00 0.00 C ATOM 0 HA PRO A 54 -8.292 0.979 -24.894 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -9.579 3.005 -23.519 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -9.125 3.139 -25.206 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -11.834 2.743 -24.035 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -11.406 3.349 -25.622 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -12.280 0.691 -24.992 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -11.709 1.259 -26.549 1.00 0.00 H new ATOM 793 N ILE A 55 -8.117 0.581 -22.482 1.00 0.00 N ATOM 794 CA ILE A 55 -7.935 0.167 -21.104 1.00 0.00 C ATOM 795 C ILE A 55 -8.858 1.048 -20.250 1.00 0.00 C ATOM 796 O ILE A 55 -8.786 2.277 -20.271 1.00 0.00 O ATOM 797 CB ILE A 55 -6.453 0.208 -20.699 1.00 0.00 C ATOM 798 CG1 ILE A 55 -5.581 -0.502 -21.779 1.00 0.00 C ATOM 799 CG2 ILE A 55 -6.302 -0.443 -19.314 1.00 0.00 C ATOM 800 CD1 ILE A 55 -4.168 -0.865 -21.331 1.00 0.00 C ATOM 0 H ILE A 55 -7.267 0.938 -22.919 1.00 0.00 H new ATOM 0 HA ILE A 55 -8.215 -0.875 -20.951 1.00 0.00 H new ATOM 0 HB ILE A 55 -6.104 1.239 -20.636 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -6.091 -1.412 -22.095 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -5.514 0.146 -22.653 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -5.254 -0.421 -19.014 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -6.900 0.106 -18.587 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -6.645 -1.477 -19.359 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -3.641 -1.354 -22.150 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -3.633 0.041 -21.044 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -4.219 -1.541 -20.478 1.00 0.00 H new ATOM 812 N LYS A 56 -9.808 0.416 -19.563 1.00 0.00 N ATOM 813 CA LYS A 56 -10.679 1.103 -18.612 1.00 0.00 C ATOM 814 C LYS A 56 -10.004 1.151 -17.246 1.00 0.00 C ATOM 815 O LYS A 56 -9.567 0.133 -16.720 1.00 0.00 O ATOM 816 CB LYS A 56 -12.024 0.385 -18.551 1.00 0.00 C ATOM 817 CG LYS A 56 -13.020 1.016 -17.558 1.00 0.00 C ATOM 818 CD LYS A 56 -13.775 2.202 -18.159 1.00 0.00 C ATOM 819 CE LYS A 56 -14.884 1.688 -19.080 1.00 0.00 C ATOM 820 NZ LYS A 56 -16.177 2.359 -18.803 1.00 0.00 N ATOM 0 H LYS A 56 -9.995 -0.583 -19.650 1.00 0.00 H new ATOM 0 HA LYS A 56 -10.857 2.129 -18.934 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -12.469 0.382 -19.546 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -11.858 -0.656 -18.273 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -13.736 0.259 -17.236 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -12.482 1.345 -16.669 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -14.202 2.815 -17.365 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -13.089 2.838 -18.718 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -14.602 1.856 -20.119 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -14.997 0.612 -18.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -16.906 1.987 -19.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -16.458 2.178 -17.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -16.075 3.383 -18.952 1.00 0.00 H new ATOM 834 N PHE A 57 -10.019 2.343 -16.660 1.00 0.00 N ATOM 835 CA PHE A 57 -9.474 2.674 -15.331 1.00 0.00 C ATOM 836 C PHE A 57 -10.564 3.094 -14.338 1.00 0.00 C ATOM 837 O PHE A 57 -10.494 2.785 -13.153 1.00 0.00 O ATOM 838 CB PHE A 57 -8.408 3.764 -15.489 1.00 0.00 C ATOM 839 CG PHE A 57 -7.501 3.551 -16.674 1.00 0.00 C ATOM 840 CD1 PHE A 57 -6.368 2.729 -16.564 1.00 0.00 C ATOM 841 CD2 PHE A 57 -7.797 4.170 -17.899 1.00 0.00 C ATOM 842 CE1 PHE A 57 -5.486 2.605 -17.646 1.00 0.00 C ATOM 843 CE2 PHE A 57 -6.898 4.083 -18.961 1.00 0.00 C ATOM 844 CZ PHE A 57 -5.763 3.277 -18.844 1.00 0.00 C ATOM 0 H PHE A 57 -10.433 3.155 -17.118 1.00 0.00 H new ATOM 0 HA PHE A 57 -9.020 1.777 -14.910 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -8.901 4.731 -15.588 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -7.804 3.805 -14.582 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -6.176 2.193 -15.646 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -8.722 4.714 -18.019 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -4.599 1.996 -17.557 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -7.078 4.637 -19.871 1.00 0.00 H new ATOM 0 HZ PHE A 57 -5.093 3.171 -19.684 1.00 0.00 H new ATOM 854 N GLY A 58 -11.583 3.809 -14.831 1.00 0.00 N ATOM 855 CA GLY A 58 -12.652 4.438 -14.034 1.00 0.00 C ATOM 856 C GLY A 58 -12.460 5.933 -13.804 1.00 0.00 C ATOM 857 O GLY A 58 -13.274 6.576 -13.142 1.00 0.00 O ATOM 0 H GLY A 58 -11.693 3.973 -15.832 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -13.606 4.278 -14.536 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -12.712 3.937 -13.068 1.00 0.00 H new ATOM 861 N LYS A 59 -11.380 6.502 -14.340 1.00 0.00 N ATOM 862 CA LYS A 59 -11.107 7.930 -14.294 1.00 0.00 C ATOM 863 C LYS A 59 -11.467 8.598 -15.595 1.00 0.00 C ATOM 864 O LYS A 59 -11.049 8.134 -16.644 1.00 0.00 O ATOM 865 CB LYS A 59 -9.618 8.145 -13.973 1.00 0.00 C ATOM 866 CG LYS A 59 -9.480 8.582 -12.512 1.00 0.00 C ATOM 867 CD LYS A 59 -10.217 9.907 -12.203 1.00 0.00 C ATOM 868 CE LYS A 59 -11.453 9.738 -11.329 1.00 0.00 C ATOM 869 NZ LYS A 59 -11.083 9.755 -9.901 1.00 0.00 N ATOM 0 H LYS A 59 -10.659 5.969 -14.827 1.00 0.00 H new ATOM 0 HA LYS A 59 -11.721 8.382 -13.515 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -9.059 7.225 -14.145 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -9.196 8.902 -14.634 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -9.871 7.796 -11.865 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -8.423 8.696 -12.271 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -9.525 10.589 -11.709 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -10.510 10.376 -13.142 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -12.164 10.538 -11.536 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -11.951 8.799 -11.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -11.937 9.639 -9.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -10.422 8.977 -9.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -10.629 10.662 -9.671 1.00 0.00 H new ATOM 883 N SER A 60 -12.145 9.742 -15.500 1.00 0.00 N ATOM 884 CA SER A 60 -12.528 10.570 -16.651 1.00 0.00 C ATOM 885 C SER A 60 -11.336 11.245 -17.343 1.00 0.00 C ATOM 886 O SER A 60 -11.513 11.836 -18.403 1.00 0.00 O ATOM 887 CB SER A 60 -13.544 11.651 -16.276 1.00 0.00 C ATOM 888 OG SER A 60 -12.963 12.657 -15.467 1.00 0.00 O ATOM 0 H SER A 60 -12.450 10.129 -14.607 1.00 0.00 H new ATOM 0 HA SER A 60 -12.980 9.866 -17.350 1.00 0.00 H new ATOM 0 HB2 SER A 60 -13.948 12.101 -17.183 1.00 0.00 H new ATOM 0 HB3 SER A 60 -14.381 11.196 -15.746 1.00 0.00 H new ATOM 0 HG SER A 60 -13.639 13.332 -15.248 1.00 0.00 H new ATOM 894 N ASP A 61 -10.127 11.182 -16.765 1.00 0.00 N ATOM 895 CA ASP A 61 -8.860 11.693 -17.309 1.00 0.00 C ATOM 896 C ASP A 61 -8.270 10.654 -18.245 1.00 0.00 C ATOM 897 O ASP A 61 -7.969 10.975 -19.392 1.00 0.00 O ATOM 898 CB ASP A 61 -7.843 12.058 -16.208 1.00 0.00 C ATOM 899 CG ASP A 61 -8.502 12.212 -14.851 1.00 0.00 C ATOM 900 OD1 ASP A 61 -9.015 13.301 -14.535 1.00 0.00 O ATOM 901 OD2 ASP A 61 -8.609 11.155 -14.195 1.00 0.00 O ATOM 0 H ASP A 61 -10.000 10.747 -15.851 1.00 0.00 H new ATOM 0 HA ASP A 61 -9.076 12.614 -17.850 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -7.076 11.285 -16.153 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -7.340 12.988 -16.474 1.00 0.00 H new ATOM 906 N CYS A 62 -8.135 9.409 -17.762 1.00 0.00 N ATOM 907 CA CYS A 62 -7.572 8.291 -18.521 1.00 0.00 C ATOM 908 C CYS A 62 -8.556 7.670 -19.521 1.00 0.00 C ATOM 909 O CYS A 62 -8.165 6.929 -20.420 1.00 0.00 O ATOM 910 CB CYS A 62 -7.092 7.182 -17.569 1.00 0.00 C ATOM 911 SG CYS A 62 -6.269 7.560 -16.002 1.00 0.00 S ATOM 0 H CYS A 62 -8.420 9.151 -16.817 1.00 0.00 H new ATOM 0 HA CYS A 62 -6.741 8.712 -19.086 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -7.964 6.574 -17.328 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -6.410 6.551 -18.139 1.00 0.00 H new ATOM 916 N ASP A 63 -9.836 7.986 -19.354 1.00 0.00 N ATOM 917 CA ASP A 63 -10.942 7.742 -20.292 1.00 0.00 C ATOM 918 C ASP A 63 -11.077 8.859 -21.316 1.00 0.00 C ATOM 919 O ASP A 63 -11.478 8.595 -22.443 1.00 0.00 O ATOM 920 CB ASP A 63 -12.232 7.641 -19.489 1.00 0.00 C ATOM 921 CG ASP A 63 -13.492 7.257 -20.263 1.00 0.00 C ATOM 922 OD1 ASP A 63 -13.405 6.423 -21.195 1.00 0.00 O ATOM 923 OD2 ASP A 63 -14.564 7.671 -19.784 1.00 0.00 O ATOM 0 H ASP A 63 -10.157 8.451 -18.505 1.00 0.00 H new ATOM 0 HA ASP A 63 -10.739 6.820 -20.836 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -12.083 6.908 -18.696 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -12.409 8.602 -19.006 1.00 0.00 H new ATOM 928 N ARG A 64 -10.732 10.110 -20.977 1.00 0.00 N ATOM 929 CA ARG A 64 -10.833 11.202 -21.948 1.00 0.00 C ATOM 930 C ARG A 64 -10.061 10.945 -23.251 1.00 0.00 C ATOM 931 O ARG A 64 -9.030 10.272 -23.247 1.00 0.00 O ATOM 932 CB ARG A 64 -10.446 12.526 -21.284 1.00 0.00 C ATOM 933 CG ARG A 64 -9.254 13.322 -21.844 1.00 0.00 C ATOM 934 CD ARG A 64 -8.881 14.632 -21.144 1.00 0.00 C ATOM 935 NE ARG A 64 -9.919 15.157 -20.251 1.00 0.00 N ATOM 936 CZ ARG A 64 -11.017 15.790 -20.611 1.00 0.00 C ATOM 937 NH1 ARG A 64 -11.297 16.083 -21.849 1.00 0.00 N ATOM 938 NH2 ARG A 64 -11.916 16.044 -19.723 1.00 0.00 N ATOM 0 H ARG A 64 -10.388 10.384 -20.057 1.00 0.00 H new ATOM 0 HA ARG A 64 -11.875 11.263 -22.262 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -11.320 13.177 -21.315 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -10.239 12.319 -20.234 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -8.379 12.672 -21.827 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -9.463 13.548 -22.890 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -7.969 14.476 -20.569 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -8.656 15.383 -21.901 1.00 0.00 H new ATOM 0 HE ARG A 64 -9.777 15.018 -19.251 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -10.651 15.821 -22.594 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -12.162 16.575 -22.074 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -11.773 15.756 -18.755 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -12.771 16.533 -19.988 1.00 0.00 H new ATOM 952 N PRO A 65 -10.489 11.564 -24.362 1.00 0.00 N ATOM 953 CA PRO A 65 -9.728 11.474 -25.588 1.00 0.00 C ATOM 954 C PRO A 65 -8.363 12.205 -25.474 1.00 0.00 C ATOM 955 O PRO A 65 -8.329 13.315 -24.928 1.00 0.00 O ATOM 956 CB PRO A 65 -10.632 12.057 -26.657 1.00 0.00 C ATOM 957 CG PRO A 65 -11.688 12.896 -25.936 1.00 0.00 C ATOM 958 CD PRO A 65 -11.609 12.484 -24.477 1.00 0.00 C ATOM 0 HA PRO A 65 -9.456 10.447 -25.830 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -10.061 12.671 -27.353 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -11.101 11.265 -27.241 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -11.490 13.961 -26.054 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -12.682 12.710 -26.343 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -11.462 13.354 -23.837 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -12.536 12.007 -24.159 1.00 0.00 H new ATOM 966 N PRO A 66 -7.239 11.648 -25.960 1.00 0.00 N ATOM 967 CA PRO A 66 -5.926 12.283 -25.992 1.00 0.00 C ATOM 968 C PRO A 66 -5.858 13.483 -26.943 1.00 0.00 C ATOM 969 O PRO A 66 -6.837 13.825 -27.597 1.00 0.00 O ATOM 970 CB PRO A 66 -4.981 11.136 -26.377 1.00 0.00 C ATOM 971 CG PRO A 66 -5.795 10.025 -27.002 1.00 0.00 C ATOM 972 CD PRO A 66 -7.222 10.372 -26.636 1.00 0.00 C ATOM 0 HA PRO A 66 -5.656 12.732 -25.036 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -4.224 11.489 -27.077 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -4.454 10.769 -25.496 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -5.657 9.988 -28.083 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -5.508 9.049 -26.610 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -7.841 10.413 -27.532 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -7.644 9.600 -25.993 1.00 0.00 H new ATOM 980 N LYS A 67 -4.725 14.199 -26.962 1.00 0.00 N ATOM 981 CA LYS A 67 -4.547 15.355 -27.872 1.00 0.00 C ATOM 982 C LYS A 67 -3.216 15.415 -28.634 1.00 0.00 C ATOM 983 O LYS A 67 -2.643 16.492 -28.806 1.00 0.00 O ATOM 984 CB LYS A 67 -5.050 16.654 -27.202 1.00 0.00 C ATOM 985 CG LYS A 67 -6.353 17.181 -27.848 1.00 0.00 C ATOM 986 CD LYS A 67 -6.019 18.309 -28.823 1.00 0.00 C ATOM 987 CE LYS A 67 -7.266 18.714 -29.606 1.00 0.00 C ATOM 988 NZ LYS A 67 -7.000 19.879 -30.477 1.00 0.00 N ATOM 0 H LYS A 67 -3.920 14.006 -26.366 1.00 0.00 H new ATOM 0 HA LYS A 67 -5.203 15.200 -28.729 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -5.221 16.470 -26.141 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -4.277 17.419 -27.272 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -6.864 16.373 -28.371 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -7.033 17.542 -27.077 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -5.628 19.168 -28.277 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -5.238 17.986 -29.511 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -7.606 17.874 -30.212 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -8.072 18.953 -28.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -7.866 20.130 -30.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -6.699 20.686 -29.895 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -6.248 19.641 -31.154 1.00 0.00 H new ATOM 1002 N HIS A 68 -2.766 14.260 -29.117 1.00 0.00 N ATOM 1003 CA HIS A 68 -1.515 14.046 -29.826 1.00 0.00 C ATOM 1004 C HIS A 68 -1.363 14.873 -31.082 1.00 0.00 C ATOM 1005 O HIS A 68 -2.288 15.284 -31.760 1.00 0.00 O ATOM 1006 CB HIS A 68 -1.201 12.542 -29.915 1.00 0.00 C ATOM 1007 CG HIS A 68 0.170 12.237 -30.427 1.00 0.00 C ATOM 1008 ND1 HIS A 68 0.527 12.046 -31.740 1.00 0.00 N ATOM 1009 CD2 HIS A 68 1.301 12.197 -29.677 1.00 0.00 C ATOM 1010 CE1 HIS A 68 1.870 11.875 -31.791 1.00 0.00 C ATOM 1011 NE2 HIS A 68 2.365 11.951 -30.539 1.00 0.00 N ATOM 0 H HIS A 68 -3.301 13.397 -29.016 1.00 0.00 H new ATOM 0 HA HIS A 68 -0.698 14.462 -29.236 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -1.316 12.098 -28.926 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -1.935 12.066 -30.565 1.00 0.00 H new ATOM 0 HD2 HIS A 68 1.363 12.332 -28.607 1.00 0.00 H new ATOM 0 HE1 HIS A 68 2.449 11.706 -32.687 1.00 0.00 H new ATOM 0 HE2 HIS A 68 3.344 11.847 -30.272 1.00 0.00 H new ATOM 1020 N SER A 69 -0.116 15.158 -31.428 1.00 0.00 N ATOM 1021 CA SER A 69 0.163 15.936 -32.634 1.00 0.00 C ATOM 1022 C SER A 69 1.480 15.525 -33.252 1.00 0.00 C ATOM 1023 O SER A 69 2.106 14.540 -32.854 1.00 0.00 O ATOM 1024 CB SER A 69 0.028 17.442 -32.363 1.00 0.00 C ATOM 1025 OG SER A 69 -0.873 18.032 -33.279 1.00 0.00 O ATOM 0 H SER A 69 0.709 14.869 -30.903 1.00 0.00 H new ATOM 0 HA SER A 69 -0.591 15.711 -33.388 1.00 0.00 H new ATOM 0 HB2 SER A 69 -0.323 17.604 -31.344 1.00 0.00 H new ATOM 0 HB3 SER A 69 1.004 17.921 -32.444 1.00 0.00 H new ATOM 0 HG SER A 69 -0.949 18.991 -33.092 1.00 0.00 H new ATOM 1031 N LYS A 70 1.928 16.261 -34.258 1.00 0.00 N ATOM 1032 CA LYS A 70 3.254 16.063 -34.831 1.00 0.00 C ATOM 1033 C LYS A 70 4.352 16.703 -33.973 1.00 0.00 C ATOM 1034 O LYS A 70 4.956 17.659 -34.413 1.00 0.00 O ATOM 1035 CB LYS A 70 3.216 16.553 -36.287 1.00 0.00 C ATOM 1036 CG LYS A 70 3.516 15.390 -37.215 1.00 0.00 C ATOM 1037 CD LYS A 70 5.020 15.094 -37.191 1.00 0.00 C ATOM 1038 CE LYS A 70 5.318 13.879 -38.064 1.00 0.00 C ATOM 1039 NZ LYS A 70 5.967 14.267 -39.340 1.00 0.00 N ATOM 0 H LYS A 70 1.389 17.007 -34.698 1.00 0.00 H new ATOM 0 HA LYS A 70 3.519 15.006 -34.837 1.00 0.00 H new ATOM 0 HB2 LYS A 70 2.237 16.973 -36.516 1.00 0.00 H new ATOM 0 HB3 LYS A 70 3.946 17.349 -36.434 1.00 0.00 H new ATOM 0 HG2 LYS A 70 2.956 14.508 -36.904 1.00 0.00 H new ATOM 0 HG3 LYS A 70 3.197 15.629 -38.230 1.00 0.00 H new ATOM 0 HD2 LYS A 70 5.577 15.959 -37.552 1.00 0.00 H new ATOM 0 HD3 LYS A 70 5.348 14.908 -36.168 1.00 0.00 H new ATOM 0 HE2 LYS A 70 5.965 13.191 -37.521 1.00 0.00 H new ATOM 0 HE3 LYS A 70 4.391 13.346 -38.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 6.154 13.416 -39.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 5.338 14.904 -39.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 6.864 14.754 -39.139 1.00 0.00 H new ATOM 1053 N ASP A 71 4.628 16.154 -32.788 1.00 0.00 N ATOM 1054 CA ASP A 71 5.663 16.670 -31.847 1.00 0.00 C ATOM 1055 C ASP A 71 5.917 15.704 -30.697 1.00 0.00 C ATOM 1056 O ASP A 71 7.050 15.396 -30.341 1.00 0.00 O ATOM 1057 CB ASP A 71 5.263 18.050 -31.269 1.00 0.00 C ATOM 1058 CG ASP A 71 6.327 19.121 -31.552 1.00 0.00 C ATOM 1059 OD1 ASP A 71 6.362 19.638 -32.689 1.00 0.00 O ATOM 1060 OD2 ASP A 71 7.128 19.378 -30.632 1.00 0.00 O ATOM 0 H ASP A 71 4.142 15.329 -32.437 1.00 0.00 H new ATOM 0 HA ASP A 71 6.580 16.774 -32.427 1.00 0.00 H new ATOM 0 HB2 ASP A 71 4.311 18.362 -31.699 1.00 0.00 H new ATOM 0 HB3 ASP A 71 5.113 17.963 -30.193 1.00 0.00 H new ATOM 1065 N GLY A 72 4.810 15.221 -30.151 1.00 0.00 N ATOM 1066 CA GLY A 72 4.758 14.308 -29.044 1.00 0.00 C ATOM 1067 C GLY A 72 3.726 14.794 -28.056 1.00 0.00 C ATOM 1068 O GLY A 72 2.711 14.158 -27.932 1.00 0.00 O ATOM 0 H GLY A 72 3.883 15.475 -30.493 1.00 0.00 H new ATOM 0 HA2 GLY A 72 4.504 13.307 -29.393 1.00 0.00 H new ATOM 0 HA3 GLY A 72 5.735 14.240 -28.565 1.00 0.00 H new ATOM 1072 N ASN A 73 3.961 15.933 -27.408 1.00 0.00 N ATOM 1073 CA ASN A 73 3.181 16.610 -26.348 1.00 0.00 C ATOM 1074 C ASN A 73 2.456 17.880 -26.837 1.00 0.00 C ATOM 1075 O ASN A 73 1.700 18.531 -26.105 1.00 0.00 O ATOM 1076 CB ASN A 73 4.093 16.969 -25.153 1.00 0.00 C ATOM 1077 CG ASN A 73 5.405 17.601 -25.562 1.00 0.00 C ATOM 1078 OD1 ASN A 73 6.231 16.834 -26.222 1.00 0.00 O flip ATOM 1079 ND2 ASN A 73 5.712 18.739 -25.287 1.00 0.00 N flip ATOM 0 H ASN A 73 4.796 16.474 -27.632 1.00 0.00 H new ATOM 0 HA ASN A 73 2.414 15.900 -26.039 1.00 0.00 H new ATOM 0 HB2 ASN A 73 3.560 17.653 -24.492 1.00 0.00 H new ATOM 0 HB3 ASN A 73 4.298 16.066 -24.579 1.00 0.00 H new ATOM 0 HD21 ASN A 73 5.062 19.332 -24.771 1.00 0.00 H new ATOM 0 HD22 ASN A 73 6.621 19.105 -25.571 1.00 0.00 H new ATOM 1086 N GLY A 74 2.696 18.207 -28.108 1.00 0.00 N ATOM 1087 CA GLY A 74 2.225 19.371 -28.844 1.00 0.00 C ATOM 1088 C GLY A 74 2.109 20.628 -27.995 1.00 0.00 C ATOM 1089 O GLY A 74 3.065 21.094 -27.396 1.00 0.00 O ATOM 0 H GLY A 74 3.276 17.608 -28.696 1.00 0.00 H new ATOM 0 HA2 GLY A 74 2.906 19.565 -29.673 1.00 0.00 H new ATOM 0 HA3 GLY A 74 1.251 19.145 -29.278 1.00 0.00 H new ATOM 1093 N LYS A 75 0.902 21.187 -27.953 1.00 0.00 N ATOM 1094 CA LYS A 75 0.543 22.239 -26.988 1.00 0.00 C ATOM 1095 C LYS A 75 0.436 21.780 -25.535 1.00 0.00 C ATOM 1096 O LYS A 75 1.266 22.107 -24.701 1.00 0.00 O ATOM 1097 CB LYS A 75 -0.728 22.961 -27.459 1.00 0.00 C ATOM 1098 CG LYS A 75 -0.401 24.125 -28.398 1.00 0.00 C ATOM 1099 CD LYS A 75 -1.309 25.305 -28.064 1.00 0.00 C ATOM 1100 CE LYS A 75 -0.991 26.483 -28.980 1.00 0.00 C ATOM 1101 NZ LYS A 75 -1.774 27.689 -28.601 1.00 0.00 N ATOM 0 H LYS A 75 0.142 20.929 -28.583 1.00 0.00 H new ATOM 0 HA LYS A 75 1.380 22.937 -26.974 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -1.381 22.253 -27.970 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -1.277 23.334 -26.594 1.00 0.00 H new ATOM 0 HG2 LYS A 75 0.645 24.413 -28.290 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -0.543 23.823 -29.436 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -2.353 25.015 -28.180 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -1.173 25.596 -27.023 1.00 0.00 H new ATOM 0 HE2 LYS A 75 0.074 26.708 -28.930 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -1.212 26.213 -30.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -1.536 28.473 -29.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -2.790 27.480 -28.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -1.544 27.959 -27.623 1.00 0.00 H new ATOM 1115 N THR A 76 -0.684 21.153 -25.202 1.00 0.00 N ATOM 1116 CA THR A 76 -0.951 20.651 -23.849 1.00 0.00 C ATOM 1117 C THR A 76 -1.251 19.177 -23.845 1.00 0.00 C ATOM 1118 O THR A 76 -1.735 18.718 -22.820 1.00 0.00 O ATOM 1119 CB THR A 76 -2.006 21.518 -23.101 1.00 0.00 C ATOM 1120 OG1 THR A 76 -1.611 21.619 -21.759 1.00 0.00 O ATOM 1121 CG2 THR A 76 -3.518 21.144 -23.083 1.00 0.00 C ATOM 0 H THR A 76 -1.441 20.974 -25.862 1.00 0.00 H new ATOM 0 HA THR A 76 -0.034 20.758 -23.270 1.00 0.00 H new ATOM 0 HB THR A 76 -1.992 22.422 -23.710 1.00 0.00 H new ATOM 0 HG1 THR A 76 -2.261 22.163 -21.267 1.00 0.00 H new ATOM 0 HG21 THR A 76 -4.069 21.885 -22.504 1.00 0.00 H new ATOM 0 HG22 THR A 76 -3.900 21.123 -24.104 1.00 0.00 H new ATOM 0 HG23 THR A 76 -3.644 20.161 -22.628 1.00 0.00 H new ATOM 1129 N ASP A 77 -1.018 18.482 -24.970 1.00 0.00 N ATOM 1130 CA ASP A 77 -1.390 17.095 -25.231 1.00 0.00 C ATOM 1131 C ASP A 77 -1.713 16.292 -23.988 1.00 0.00 C ATOM 1132 O ASP A 77 -0.852 15.831 -23.267 1.00 0.00 O ATOM 1133 CB ASP A 77 -0.288 16.393 -25.949 1.00 0.00 C ATOM 1134 CG ASP A 77 -0.739 15.050 -26.440 1.00 0.00 C ATOM 1135 OD1 ASP A 77 -1.860 14.602 -26.109 1.00 0.00 O ATOM 1136 OD2 ASP A 77 -0.021 14.591 -27.337 1.00 0.00 O ATOM 0 H ASP A 77 -0.536 18.904 -25.764 1.00 0.00 H new ATOM 0 HA ASP A 77 -2.297 17.154 -25.833 1.00 0.00 H new ATOM 0 HB2 ASP A 77 0.047 16.999 -26.791 1.00 0.00 H new ATOM 0 HB3 ASP A 77 0.567 16.273 -25.283 1.00 0.00 H new ATOM 1141 N HIS A 78 -2.988 16.239 -23.666 1.00 0.00 N ATOM 1142 CA HIS A 78 -3.432 15.627 -22.401 1.00 0.00 C ATOM 1143 C HIS A 78 -3.599 14.110 -22.461 1.00 0.00 C ATOM 1144 O HIS A 78 -4.259 13.504 -21.614 1.00 0.00 O ATOM 1145 CB HIS A 78 -4.637 16.354 -21.851 1.00 0.00 C ATOM 1146 CG HIS A 78 -5.694 16.486 -22.871 1.00 0.00 C ATOM 1147 ND1 HIS A 78 -6.649 15.546 -23.104 1.00 0.00 N ATOM 1148 CD2 HIS A 78 -5.817 17.496 -23.762 1.00 0.00 C ATOM 1149 CE1 HIS A 78 -7.450 16.028 -24.064 1.00 0.00 C ATOM 1150 NE2 HIS A 78 -6.953 17.203 -24.493 1.00 0.00 N ATOM 0 H HIS A 78 -3.741 16.605 -24.248 1.00 0.00 H new ATOM 0 HA HIS A 78 -2.620 15.757 -21.685 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -5.027 15.815 -20.988 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -4.340 17.343 -21.502 1.00 0.00 H new ATOM 0 HD1 HIS A 78 -6.739 14.644 -22.636 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -5.166 18.350 -23.878 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -8.347 15.552 -24.433 1.00 0.00 H new ATOM 1159 N TYR A 79 -3.098 13.545 -23.550 1.00 0.00 N ATOM 1160 CA TYR A 79 -2.917 12.132 -23.783 1.00 0.00 C ATOM 1161 C TYR A 79 -2.340 11.404 -22.598 1.00 0.00 C ATOM 1162 O TYR A 79 -1.780 11.963 -21.656 1.00 0.00 O ATOM 1163 CB TYR A 79 -2.032 11.896 -25.017 1.00 0.00 C ATOM 1164 CG TYR A 79 -0.545 12.310 -24.925 1.00 0.00 C ATOM 1165 CD1 TYR A 79 -0.005 13.099 -23.884 1.00 0.00 C ATOM 1166 CD2 TYR A 79 0.333 12.015 -25.976 1.00 0.00 C ATOM 1167 CE1 TYR A 79 1.270 13.657 -23.927 1.00 0.00 C ATOM 1168 CE2 TYR A 79 1.672 12.415 -25.959 1.00 0.00 C ATOM 1169 CZ TYR A 79 2.124 13.285 -24.958 1.00 0.00 C ATOM 1170 OH TYR A 79 3.349 13.845 -25.034 1.00 0.00 O ATOM 0 H TYR A 79 -2.788 14.106 -24.344 1.00 0.00 H new ATOM 0 HA TYR A 79 -3.913 11.724 -23.957 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -2.070 10.834 -25.259 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -2.477 12.430 -25.856 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -0.613 13.278 -23.010 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -0.037 11.461 -26.826 1.00 0.00 H new ATOM 0 HE1 TYR A 79 1.588 14.364 -23.175 1.00 0.00 H new ATOM 0 HE2 TYR A 79 2.355 12.055 -26.714 1.00 0.00 H new ATOM 0 HH TYR A 79 3.680 14.031 -24.131 1.00 0.00 H new ATOM 1180 N LEU A 80 -2.510 10.104 -22.656 1.00 0.00 N ATOM 1181 CA LEU A 80 -1.823 9.275 -21.719 1.00 0.00 C ATOM 1182 C LEU A 80 -0.409 9.005 -22.189 1.00 0.00 C ATOM 1183 O LEU A 80 -0.175 8.928 -23.387 1.00 0.00 O ATOM 1184 CB LEU A 80 -2.622 8.020 -21.545 1.00 0.00 C ATOM 1185 CG LEU A 80 -3.931 8.377 -20.830 1.00 0.00 C ATOM 1186 CD1 LEU A 80 -5.179 8.023 -21.623 1.00 0.00 C ATOM 1187 CD2 LEU A 80 -3.945 7.581 -19.556 1.00 0.00 C ATOM 0 H LEU A 80 -3.104 9.616 -23.327 1.00 0.00 H new ATOM 0 HA LEU A 80 -1.731 9.770 -20.752 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -2.830 7.565 -22.513 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -2.059 7.289 -20.964 1.00 0.00 H new ATOM 0 HG LEU A 80 -3.956 9.456 -20.679 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -6.064 8.305 -21.053 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -5.172 8.560 -22.572 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -5.197 6.950 -21.814 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -4.859 7.796 -19.003 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -3.905 6.517 -19.791 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -3.081 7.851 -18.949 1.00 0.00 H new ATOM 1199 N LEU A 81 0.531 8.799 -21.280 1.00 0.00 N ATOM 1200 CA LEU A 81 1.890 8.402 -21.601 1.00 0.00 C ATOM 1201 C LEU A 81 2.294 7.249 -20.713 1.00 0.00 C ATOM 1202 O LEU A 81 2.152 7.308 -19.491 1.00 0.00 O ATOM 1203 CB LEU A 81 2.853 9.576 -21.393 1.00 0.00 C ATOM 1204 CG LEU A 81 2.556 10.779 -22.299 1.00 0.00 C ATOM 1205 CD1 LEU A 81 2.536 12.069 -21.489 1.00 0.00 C ATOM 1206 CD2 LEU A 81 3.493 10.885 -23.491 1.00 0.00 C ATOM 0 H LEU A 81 0.366 8.906 -20.279 1.00 0.00 H new ATOM 0 HA LEU A 81 1.935 8.097 -22.646 1.00 0.00 H new ATOM 0 HB2 LEU A 81 2.805 9.895 -20.352 1.00 0.00 H new ATOM 0 HB3 LEU A 81 3.872 9.236 -21.576 1.00 0.00 H new ATOM 0 HG LEU A 81 1.564 10.614 -22.719 1.00 0.00 H new ATOM 0 HD11 LEU A 81 2.324 12.910 -22.149 1.00 0.00 H new ATOM 0 HD12 LEU A 81 1.763 12.005 -20.723 1.00 0.00 H new ATOM 0 HD13 LEU A 81 3.506 12.216 -21.015 1.00 0.00 H new ATOM 0 HD21 LEU A 81 3.226 11.757 -24.088 1.00 0.00 H new ATOM 0 HD22 LEU A 81 4.520 10.987 -23.139 1.00 0.00 H new ATOM 0 HD23 LEU A 81 3.407 9.987 -24.103 1.00 0.00 H new ATOM 1218 N GLU A 82 2.828 6.204 -21.337 1.00 0.00 N ATOM 1219 CA GLU A 82 3.333 5.036 -20.656 1.00 0.00 C ATOM 1220 C GLU A 82 4.829 5.131 -20.389 1.00 0.00 C ATOM 1221 O GLU A 82 5.577 5.736 -21.160 1.00 0.00 O ATOM 1222 CB GLU A 82 3.000 3.745 -21.408 1.00 0.00 C ATOM 1223 CG GLU A 82 3.783 3.412 -22.646 1.00 0.00 C ATOM 1224 CD GLU A 82 3.144 3.897 -23.929 1.00 0.00 C ATOM 1225 OE1 GLU A 82 3.370 5.066 -24.271 1.00 0.00 O ATOM 1226 OE2 GLU A 82 2.626 3.030 -24.650 1.00 0.00 O ATOM 0 H GLU A 82 2.920 6.153 -22.352 1.00 0.00 H new ATOM 0 HA GLU A 82 2.825 5.001 -19.692 1.00 0.00 H new ATOM 0 HB2 GLU A 82 3.116 2.916 -20.710 1.00 0.00 H new ATOM 0 HB3 GLU A 82 1.946 3.785 -21.683 1.00 0.00 H new ATOM 0 HG2 GLU A 82 4.779 3.847 -22.561 1.00 0.00 H new ATOM 0 HG3 GLU A 82 3.911 2.331 -22.702 1.00 0.00 H new ATOM 1233 N PHE A 83 5.303 4.414 -19.370 1.00 0.00 N ATOM 1234 CA PHE A 83 6.724 4.404 -19.021 1.00 0.00 C ATOM 1235 C PHE A 83 7.213 3.068 -18.403 1.00 0.00 C ATOM 1236 O PHE A 83 6.580 2.595 -17.460 1.00 0.00 O ATOM 1237 CB PHE A 83 6.929 5.503 -18.005 1.00 0.00 C ATOM 1238 CG PHE A 83 8.367 5.684 -17.689 1.00 0.00 C ATOM 1239 CD1 PHE A 83 9.252 6.171 -18.670 1.00 0.00 C ATOM 1240 CD2 PHE A 83 8.823 5.285 -16.423 1.00 0.00 C ATOM 1241 CE1 PHE A 83 10.593 6.378 -18.350 1.00 0.00 C ATOM 1242 CE2 PHE A 83 10.165 5.464 -16.121 1.00 0.00 C ATOM 1243 CZ PHE A 83 11.014 6.038 -17.058 1.00 0.00 C ATOM 0 H PHE A 83 4.721 3.830 -18.769 1.00 0.00 H new ATOM 0 HA PHE A 83 7.297 4.544 -19.938 1.00 0.00 H new ATOM 0 HB2 PHE A 83 6.519 6.437 -18.389 1.00 0.00 H new ATOM 0 HB3 PHE A 83 6.381 5.265 -17.093 1.00 0.00 H new ATOM 0 HD1 PHE A 83 8.893 6.383 -19.666 1.00 0.00 H new ATOM 0 HD2 PHE A 83 8.146 4.850 -15.702 1.00 0.00 H new ATOM 0 HE1 PHE A 83 11.283 6.786 -19.073 1.00 0.00 H new ATOM 0 HE2 PHE A 83 10.549 5.158 -15.159 1.00 0.00 H new ATOM 0 HZ PHE A 83 12.040 6.230 -16.780 1.00 0.00 H new ATOM 1253 N PRO A 84 8.282 2.420 -18.912 1.00 0.00 N ATOM 1254 CA PRO A 84 8.786 1.132 -18.477 1.00 0.00 C ATOM 1255 C PRO A 84 9.441 1.261 -17.116 1.00 0.00 C ATOM 1256 O PRO A 84 10.599 1.648 -16.984 1.00 0.00 O ATOM 1257 CB PRO A 84 9.726 0.626 -19.555 1.00 0.00 C ATOM 1258 CG PRO A 84 10.120 1.846 -20.349 1.00 0.00 C ATOM 1259 CD PRO A 84 9.125 2.925 -19.952 1.00 0.00 C ATOM 0 HA PRO A 84 7.985 0.404 -18.349 1.00 0.00 H new ATOM 0 HB2 PRO A 84 10.600 0.142 -19.119 1.00 0.00 H new ATOM 0 HB3 PRO A 84 9.236 -0.113 -20.188 1.00 0.00 H new ATOM 0 HG2 PRO A 84 11.141 2.150 -20.121 1.00 0.00 H new ATOM 0 HG3 PRO A 84 10.078 1.648 -21.420 1.00 0.00 H new ATOM 0 HD2 PRO A 84 9.652 3.816 -19.610 1.00 0.00 H new ATOM 0 HD3 PRO A 84 8.525 3.220 -20.813 1.00 0.00 H new ATOM 1267 N THR A 85 8.626 0.971 -16.115 1.00 0.00 N ATOM 1268 CA THR A 85 9.007 0.989 -14.717 1.00 0.00 C ATOM 1269 C THR A 85 9.420 -0.397 -14.272 1.00 0.00 C ATOM 1270 O THR A 85 8.640 -1.343 -14.293 1.00 0.00 O ATOM 1271 CB THR A 85 7.929 1.597 -13.824 1.00 0.00 C ATOM 1272 OG1 THR A 85 8.352 1.527 -12.480 1.00 0.00 O ATOM 1273 CG2 THR A 85 6.523 1.003 -14.045 1.00 0.00 C ATOM 0 H THR A 85 7.651 0.709 -16.260 1.00 0.00 H new ATOM 0 HA THR A 85 9.870 1.646 -14.611 1.00 0.00 H new ATOM 0 HB THR A 85 7.810 2.643 -14.106 1.00 0.00 H new ATOM 0 HG1 THR A 85 7.805 0.872 -11.999 1.00 0.00 H new ATOM 0 HG21 THR A 85 5.814 1.487 -13.374 1.00 0.00 H new ATOM 0 HG22 THR A 85 6.216 1.169 -15.078 1.00 0.00 H new ATOM 0 HG23 THR A 85 6.544 -0.067 -13.840 1.00 0.00 H new ATOM 1281 N PHE A 86 10.695 -0.540 -13.933 1.00 0.00 N ATOM 1282 CA PHE A 86 11.256 -1.797 -13.446 1.00 0.00 C ATOM 1283 C PHE A 86 10.997 -2.004 -11.942 1.00 0.00 C ATOM 1284 O PHE A 86 10.898 -1.023 -11.194 1.00 0.00 O ATOM 1285 CB PHE A 86 12.757 -1.820 -13.721 1.00 0.00 C ATOM 1286 CG PHE A 86 13.097 -1.736 -15.177 1.00 0.00 C ATOM 1287 CD1 PHE A 86 13.122 -0.477 -15.792 1.00 0.00 C ATOM 1288 CD2 PHE A 86 13.337 -2.905 -15.928 1.00 0.00 C ATOM 1289 CE1 PHE A 86 13.399 -0.399 -17.153 1.00 0.00 C ATOM 1290 CE2 PHE A 86 13.696 -2.795 -17.279 1.00 0.00 C ATOM 1291 CZ PHE A 86 13.773 -1.528 -17.871 1.00 0.00 C ATOM 0 H PHE A 86 11.375 0.218 -13.988 1.00 0.00 H new ATOM 0 HA PHE A 86 10.762 -2.612 -13.976 1.00 0.00 H new ATOM 0 HB2 PHE A 86 13.227 -0.988 -13.197 1.00 0.00 H new ATOM 0 HB3 PHE A 86 13.180 -2.736 -13.309 1.00 0.00 H new ATOM 0 HD1 PHE A 86 12.929 0.418 -15.219 1.00 0.00 H new ATOM 0 HD2 PHE A 86 13.245 -3.877 -15.466 1.00 0.00 H new ATOM 0 HE1 PHE A 86 13.322 0.552 -17.658 1.00 0.00 H new ATOM 0 HE2 PHE A 86 13.911 -3.680 -17.859 1.00 0.00 H new ATOM 0 HZ PHE A 86 14.124 -1.429 -18.888 1.00 0.00 H new ATOM 1301 N PRO A 87 10.961 -3.260 -11.457 1.00 0.00 N ATOM 1302 CA PRO A 87 10.767 -3.558 -10.048 1.00 0.00 C ATOM 1303 C PRO A 87 11.965 -3.269 -9.153 1.00 0.00 C ATOM 1304 O PRO A 87 11.745 -2.859 -8.015 1.00 0.00 O ATOM 1305 CB PRO A 87 10.497 -5.043 -9.973 1.00 0.00 C ATOM 1306 CG PRO A 87 11.026 -5.652 -11.260 1.00 0.00 C ATOM 1307 CD PRO A 87 11.225 -4.480 -12.201 1.00 0.00 C ATOM 0 HA PRO A 87 9.961 -2.919 -9.687 1.00 0.00 H new ATOM 0 HB2 PRO A 87 10.991 -5.482 -9.106 1.00 0.00 H new ATOM 0 HB3 PRO A 87 9.430 -5.237 -9.864 1.00 0.00 H new ATOM 0 HG2 PRO A 87 11.962 -6.183 -11.089 1.00 0.00 H new ATOM 0 HG3 PRO A 87 10.321 -6.374 -11.673 1.00 0.00 H new ATOM 0 HD2 PRO A 87 12.242 -4.475 -12.594 1.00 0.00 H new ATOM 0 HD3 PRO A 87 10.553 -4.559 -13.056 1.00 0.00 H new ATOM 1315 N ASP A 88 13.200 -3.478 -9.658 1.00 0.00 N ATOM 1316 CA ASP A 88 14.511 -3.180 -9.029 1.00 0.00 C ATOM 1317 C ASP A 88 14.558 -1.744 -8.519 1.00 0.00 C ATOM 1318 O ASP A 88 15.244 -1.402 -7.559 1.00 0.00 O ATOM 1319 CB ASP A 88 15.674 -3.318 -10.039 1.00 0.00 C ATOM 1320 CG ASP A 88 15.534 -4.406 -11.094 1.00 0.00 C ATOM 1321 OD1 ASP A 88 14.790 -4.104 -12.046 1.00 0.00 O ATOM 1322 OD2 ASP A 88 16.270 -5.410 -11.035 1.00 0.00 O ATOM 0 H ASP A 88 13.319 -3.889 -10.584 1.00 0.00 H new ATOM 0 HA ASP A 88 14.621 -3.896 -8.214 1.00 0.00 H new ATOM 0 HB2 ASP A 88 15.798 -2.363 -10.549 1.00 0.00 H new ATOM 0 HB3 ASP A 88 16.591 -3.502 -9.480 1.00 0.00 H new ATOM 1327 N GLY A 89 13.826 -0.882 -9.223 1.00 0.00 N ATOM 1328 CA GLY A 89 13.694 0.521 -8.889 1.00 0.00 C ATOM 1329 C GLY A 89 14.815 1.395 -9.364 1.00 0.00 C ATOM 1330 O GLY A 89 14.910 2.566 -8.990 1.00 0.00 O ATOM 0 H GLY A 89 13.302 -1.152 -10.055 1.00 0.00 H new ATOM 0 HA2 GLY A 89 12.760 0.893 -9.311 1.00 0.00 H new ATOM 0 HA3 GLY A 89 13.614 0.615 -7.806 1.00 0.00 H new ATOM 1334 N HIS A 90 15.637 0.808 -10.220 1.00 0.00 N ATOM 1335 CA HIS A 90 16.670 1.500 -10.927 1.00 0.00 C ATOM 1336 C HIS A 90 15.960 2.543 -11.806 1.00 0.00 C ATOM 1337 O HIS A 90 14.920 2.278 -12.411 1.00 0.00 O ATOM 1338 CB HIS A 90 17.633 0.453 -11.558 1.00 0.00 C ATOM 1339 CG HIS A 90 17.160 -0.385 -12.744 1.00 0.00 C ATOM 1340 ND1 HIS A 90 16.967 -1.760 -12.788 1.00 0.00 N ATOM 1341 CD2 HIS A 90 16.884 0.087 -13.993 1.00 0.00 C ATOM 1342 CE1 HIS A 90 16.503 -2.097 -14.005 1.00 0.00 C ATOM 1343 NE2 HIS A 90 16.427 -0.982 -14.757 1.00 0.00 N ATOM 0 H HIS A 90 15.592 -0.187 -10.438 1.00 0.00 H new ATOM 0 HA HIS A 90 17.367 2.090 -10.332 1.00 0.00 H new ATOM 0 HB2 HIS A 90 18.532 0.983 -11.871 1.00 0.00 H new ATOM 0 HB3 HIS A 90 17.928 -0.237 -10.768 1.00 0.00 H new ATOM 0 HD2 HIS A 90 16.999 1.107 -14.329 1.00 0.00 H new ATOM 0 HE1 HIS A 90 16.236 -3.093 -14.325 1.00 0.00 H new ATOM 0 HE2 HIS A 90 16.093 -0.930 -15.719 1.00 0.00 H new ATOM 1352 N ASP A 91 16.439 3.778 -11.781 1.00 0.00 N ATOM 1353 CA ASP A 91 16.245 4.769 -12.837 1.00 0.00 C ATOM 1354 C ASP A 91 16.788 4.129 -14.112 1.00 0.00 C ATOM 1355 O ASP A 91 17.960 3.805 -14.257 1.00 0.00 O ATOM 1356 CB ASP A 91 16.862 6.096 -12.365 1.00 0.00 C ATOM 1357 CG ASP A 91 16.947 7.244 -13.363 1.00 0.00 C ATOM 1358 OD1 ASP A 91 15.912 7.459 -14.038 1.00 0.00 O ATOM 1359 OD2 ASP A 91 17.960 7.960 -13.307 1.00 0.00 O ATOM 0 H ASP A 91 16.992 4.133 -11.001 1.00 0.00 H new ATOM 0 HA ASP A 91 15.214 5.041 -13.062 1.00 0.00 H new ATOM 0 HB2 ASP A 91 16.288 6.443 -11.506 1.00 0.00 H new ATOM 0 HB3 ASP A 91 17.871 5.887 -12.011 1.00 0.00 H new ATOM 1364 N TYR A 92 15.875 3.602 -14.916 1.00 0.00 N ATOM 1365 CA TYR A 92 16.089 3.144 -16.260 1.00 0.00 C ATOM 1366 C TYR A 92 16.874 4.208 -17.013 1.00 0.00 C ATOM 1367 O TYR A 92 16.606 5.398 -16.924 1.00 0.00 O ATOM 1368 CB TYR A 92 14.734 2.776 -16.875 1.00 0.00 C ATOM 1369 CG TYR A 92 14.787 2.465 -18.361 1.00 0.00 C ATOM 1370 CD1 TYR A 92 15.849 1.719 -18.914 1.00 0.00 C ATOM 1371 CD2 TYR A 92 13.774 2.950 -19.207 1.00 0.00 C ATOM 1372 CE1 TYR A 92 15.945 1.539 -20.298 1.00 0.00 C ATOM 1373 CE2 TYR A 92 13.838 2.734 -20.593 1.00 0.00 C ATOM 1374 CZ TYR A 92 14.916 2.003 -21.128 1.00 0.00 C ATOM 1375 OH TYR A 92 14.963 1.718 -22.448 1.00 0.00 O ATOM 0 H TYR A 92 14.907 3.480 -14.617 1.00 0.00 H new ATOM 0 HA TYR A 92 16.692 2.237 -16.307 1.00 0.00 H new ATOM 0 HB2 TYR A 92 14.332 1.910 -16.348 1.00 0.00 H new ATOM 0 HB3 TYR A 92 14.038 3.599 -16.712 1.00 0.00 H new ATOM 0 HD1 TYR A 92 16.594 1.284 -18.264 1.00 0.00 H new ATOM 0 HD2 TYR A 92 12.940 3.493 -18.787 1.00 0.00 H new ATOM 0 HE1 TYR A 92 16.806 1.046 -20.724 1.00 0.00 H new ATOM 0 HE2 TYR A 92 13.068 3.125 -21.242 1.00 0.00 H new ATOM 0 HH TYR A 92 15.220 2.521 -22.947 1.00 0.00 H new ATOM 1385 N LYS A 93 17.860 3.792 -17.792 1.00 0.00 N ATOM 1386 CA LYS A 93 18.548 4.696 -18.694 1.00 0.00 C ATOM 1387 C LYS A 93 17.710 5.032 -19.933 1.00 0.00 C ATOM 1388 O LYS A 93 18.112 4.788 -21.066 1.00 0.00 O ATOM 1389 CB LYS A 93 19.914 4.142 -19.004 1.00 0.00 C ATOM 1390 CG LYS A 93 19.856 2.656 -19.402 1.00 0.00 C ATOM 1391 CD LYS A 93 21.100 2.241 -20.157 1.00 0.00 C ATOM 1392 CE LYS A 93 22.396 2.770 -19.538 1.00 0.00 C ATOM 1393 NZ LYS A 93 22.853 4.015 -20.224 1.00 0.00 N ATOM 0 H LYS A 93 18.201 2.831 -17.816 1.00 0.00 H new ATOM 0 HA LYS A 93 18.690 5.659 -18.204 1.00 0.00 H new ATOM 0 HB2 LYS A 93 20.363 4.717 -19.814 1.00 0.00 H new ATOM 0 HB3 LYS A 93 20.559 4.259 -18.133 1.00 0.00 H new ATOM 0 HG2 LYS A 93 19.748 2.042 -18.508 1.00 0.00 H new ATOM 0 HG3 LYS A 93 18.976 2.477 -20.020 1.00 0.00 H new ATOM 0 HD2 LYS A 93 21.144 1.153 -20.198 1.00 0.00 H new ATOM 0 HD3 LYS A 93 21.027 2.596 -21.185 1.00 0.00 H new ATOM 0 HE2 LYS A 93 22.240 2.972 -18.478 1.00 0.00 H new ATOM 0 HE3 LYS A 93 23.172 2.008 -19.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 23.890 4.075 -20.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 22.550 3.995 -21.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 22.438 4.844 -19.752 1.00 0.00 H new ATOM 1407 N PHE A 94 16.533 5.601 -19.695 1.00 0.00 N ATOM 1408 CA PHE A 94 15.637 6.116 -20.720 1.00 0.00 C ATOM 1409 C PHE A 94 16.157 7.397 -21.365 1.00 0.00 C ATOM 1410 O PHE A 94 15.880 7.622 -22.531 1.00 0.00 O ATOM 1411 CB PHE A 94 14.228 6.354 -20.193 1.00 0.00 C ATOM 1412 CG PHE A 94 14.124 7.190 -18.944 1.00 0.00 C ATOM 1413 CD1 PHE A 94 14.107 8.596 -18.947 1.00 0.00 C ATOM 1414 CD2 PHE A 94 14.101 6.502 -17.735 1.00 0.00 C ATOM 1415 CE1 PHE A 94 14.120 9.290 -17.720 1.00 0.00 C ATOM 1416 CE2 PHE A 94 14.101 7.180 -16.518 1.00 0.00 C ATOM 1417 CZ PHE A 94 14.125 8.577 -16.503 1.00 0.00 C ATOM 0 H PHE A 94 16.166 5.720 -18.751 1.00 0.00 H new ATOM 0 HA PHE A 94 15.599 5.337 -21.481 1.00 0.00 H new ATOM 0 HB2 PHE A 94 13.644 6.834 -20.978 1.00 0.00 H new ATOM 0 HB3 PHE A 94 13.766 5.386 -19.999 1.00 0.00 H new ATOM 0 HD1 PHE A 94 14.084 9.139 -19.880 1.00 0.00 H new ATOM 0 HD2 PHE A 94 14.083 5.422 -17.740 1.00 0.00 H new ATOM 0 HE1 PHE A 94 14.126 10.370 -17.712 1.00 0.00 H new ATOM 0 HE2 PHE A 94 14.083 6.628 -15.590 1.00 0.00 H new ATOM 0 HZ PHE A 94 14.147 9.109 -15.563 1.00 0.00 H new ATOM 1427 N ASP A 95 16.924 8.214 -20.645 1.00 0.00 N ATOM 1428 CA ASP A 95 17.586 9.444 -21.121 1.00 0.00 C ATOM 1429 C ASP A 95 18.812 9.123 -21.973 1.00 0.00 C ATOM 1430 O ASP A 95 19.059 9.741 -23.005 1.00 0.00 O ATOM 1431 CB ASP A 95 17.940 10.298 -19.890 1.00 0.00 C ATOM 1432 CG ASP A 95 18.956 11.413 -20.169 1.00 0.00 C ATOM 1433 OD1 ASP A 95 20.152 11.058 -20.250 1.00 0.00 O ATOM 1434 OD2 ASP A 95 18.525 12.576 -20.337 1.00 0.00 O ATOM 0 H ASP A 95 17.115 8.033 -19.660 1.00 0.00 H new ATOM 0 HA ASP A 95 16.914 10.006 -21.770 1.00 0.00 H new ATOM 0 HB2 ASP A 95 17.027 10.744 -19.497 1.00 0.00 H new ATOM 0 HB3 ASP A 95 18.337 9.646 -19.112 1.00 0.00 H new ATOM 1439 N SER A 96 19.568 8.101 -21.581 1.00 0.00 N ATOM 1440 CA SER A 96 20.804 7.744 -22.261 1.00 0.00 C ATOM 1441 C SER A 96 20.468 6.996 -23.540 1.00 0.00 C ATOM 1442 O SER A 96 20.044 5.841 -23.513 1.00 0.00 O ATOM 1443 CB SER A 96 21.691 6.875 -21.375 1.00 0.00 C ATOM 1444 OG SER A 96 23.056 7.050 -21.677 1.00 0.00 O ATOM 0 H SER A 96 19.341 7.502 -20.788 1.00 0.00 H new ATOM 0 HA SER A 96 21.351 8.658 -22.492 1.00 0.00 H new ATOM 0 HB2 SER A 96 21.515 7.123 -20.328 1.00 0.00 H new ATOM 0 HB3 SER A 96 21.421 5.827 -21.505 1.00 0.00 H new ATOM 0 HG SER A 96 23.596 6.481 -21.090 1.00 0.00 H new ATOM 1450 N LYS A 97 20.658 7.642 -24.693 1.00 0.00 N ATOM 1451 CA LYS A 97 20.392 7.000 -25.996 1.00 0.00 C ATOM 1452 C LYS A 97 21.222 5.763 -26.256 1.00 0.00 C ATOM 1453 O LYS A 97 20.776 4.776 -26.842 1.00 0.00 O ATOM 1454 CB LYS A 97 20.529 8.006 -27.148 1.00 0.00 C ATOM 1455 CG LYS A 97 21.968 8.162 -27.670 1.00 0.00 C ATOM 1456 CD LYS A 97 22.101 9.125 -28.830 1.00 0.00 C ATOM 1457 CE LYS A 97 23.522 9.687 -28.809 1.00 0.00 C ATOM 1458 NZ LYS A 97 23.829 10.344 -30.097 1.00 0.00 N ATOM 0 H LYS A 97 20.993 8.603 -24.758 1.00 0.00 H new ATOM 0 HA LYS A 97 19.359 6.657 -25.946 1.00 0.00 H new ATOM 0 HB2 LYS A 97 19.886 7.692 -27.970 1.00 0.00 H new ATOM 0 HB3 LYS A 97 20.167 8.978 -26.814 1.00 0.00 H new ATOM 0 HG2 LYS A 97 22.605 8.503 -26.854 1.00 0.00 H new ATOM 0 HG3 LYS A 97 22.340 7.185 -27.978 1.00 0.00 H new ATOM 0 HD2 LYS A 97 21.905 8.616 -29.774 1.00 0.00 H new ATOM 0 HD3 LYS A 97 21.371 9.930 -28.744 1.00 0.00 H new ATOM 0 HE2 LYS A 97 23.626 10.402 -27.993 1.00 0.00 H new ATOM 0 HE3 LYS A 97 24.236 8.885 -28.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 24.797 10.722 -30.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 23.748 9.651 -30.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 23.158 11.122 -30.259 1.00 0.00 H new ATOM 1472 N LYS A 98 22.491 5.869 -25.875 1.00 0.00 N ATOM 1473 CA LYS A 98 23.486 4.819 -25.993 1.00 0.00 C ATOM 1474 C LYS A 98 24.469 4.862 -24.812 1.00 0.00 C ATOM 1475 O LYS A 98 25.019 5.921 -24.542 1.00 0.00 O ATOM 1476 CB LYS A 98 24.164 4.864 -27.368 1.00 0.00 C ATOM 1477 CG LYS A 98 25.351 3.886 -27.525 1.00 0.00 C ATOM 1478 CD LYS A 98 25.167 2.806 -28.595 1.00 0.00 C ATOM 1479 CE LYS A 98 24.326 1.623 -28.082 1.00 0.00 C ATOM 1480 NZ LYS A 98 24.399 0.453 -28.998 1.00 0.00 N ATOM 0 H LYS A 98 22.865 6.723 -25.460 1.00 0.00 H new ATOM 0 HA LYS A 98 22.994 3.848 -25.935 1.00 0.00 H new ATOM 0 HB2 LYS A 98 23.421 4.641 -28.134 1.00 0.00 H new ATOM 0 HB3 LYS A 98 24.517 5.878 -27.553 1.00 0.00 H new ATOM 0 HG2 LYS A 98 26.246 4.461 -27.762 1.00 0.00 H new ATOM 0 HG3 LYS A 98 25.529 3.399 -26.566 1.00 0.00 H new ATOM 0 HD2 LYS A 98 24.684 3.241 -29.470 1.00 0.00 H new ATOM 0 HD3 LYS A 98 26.144 2.444 -28.916 1.00 0.00 H new ATOM 0 HE2 LYS A 98 24.676 1.331 -27.092 1.00 0.00 H new ATOM 0 HE3 LYS A 98 23.287 1.936 -27.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 23.820 -0.322 -28.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 24.042 0.724 -29.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 25.387 0.138 -29.081 1.00 0.00 H new ATOM 1494 N PRO A 99 24.724 3.712 -24.164 1.00 0.00 N ATOM 1495 CA PRO A 99 23.973 2.479 -24.344 1.00 0.00 C ATOM 1496 C PRO A 99 22.551 2.639 -23.805 1.00 0.00 C ATOM 1497 O PRO A 99 22.268 3.568 -23.051 1.00 0.00 O ATOM 1498 CB PRO A 99 24.756 1.392 -23.646 1.00 0.00 C ATOM 1499 CG PRO A 99 25.611 2.119 -22.620 1.00 0.00 C ATOM 1500 CD PRO A 99 25.607 3.595 -23.021 1.00 0.00 C ATOM 0 HA PRO A 99 23.856 2.218 -25.396 1.00 0.00 H new ATOM 0 HB2 PRO A 99 24.092 0.673 -23.167 1.00 0.00 H new ATOM 0 HB3 PRO A 99 25.373 0.836 -24.351 1.00 0.00 H new ATOM 0 HG2 PRO A 99 25.207 1.988 -21.616 1.00 0.00 H new ATOM 0 HG3 PRO A 99 26.626 1.722 -22.610 1.00 0.00 H new ATOM 0 HD2 PRO A 99 25.259 4.219 -22.198 1.00 0.00 H new ATOM 0 HD3 PRO A 99 26.613 3.931 -23.273 1.00 0.00 H new ATOM 1508 N LYS A 100 21.687 1.707 -24.180 1.00 0.00 N ATOM 1509 CA LYS A 100 20.295 1.624 -23.756 1.00 0.00 C ATOM 1510 C LYS A 100 20.079 0.248 -23.143 1.00 0.00 C ATOM 1511 O LYS A 100 20.747 -0.698 -23.547 1.00 0.00 O ATOM 1512 CB LYS A 100 19.388 1.969 -24.940 1.00 0.00 C ATOM 1513 CG LYS A 100 19.198 0.892 -26.032 1.00 0.00 C ATOM 1514 CD LYS A 100 17.710 0.544 -26.160 1.00 0.00 C ATOM 1515 CE LYS A 100 16.928 1.580 -26.967 1.00 0.00 C ATOM 1516 NZ LYS A 100 17.496 1.719 -28.326 1.00 0.00 N ATOM 0 H LYS A 100 21.948 0.954 -24.817 1.00 0.00 H new ATOM 0 HA LYS A 100 20.038 2.349 -22.984 1.00 0.00 H new ATOM 0 HB2 LYS A 100 18.405 2.226 -24.546 1.00 0.00 H new ATOM 0 HB3 LYS A 100 19.784 2.865 -25.417 1.00 0.00 H new ATOM 0 HG2 LYS A 100 19.580 1.256 -26.986 1.00 0.00 H new ATOM 0 HG3 LYS A 100 19.770 -0.001 -25.779 1.00 0.00 H new ATOM 0 HD2 LYS A 100 17.609 -0.432 -26.635 1.00 0.00 H new ATOM 0 HD3 LYS A 100 17.274 0.461 -25.165 1.00 0.00 H new ATOM 0 HE2 LYS A 100 15.881 1.283 -27.033 1.00 0.00 H new ATOM 0 HE3 LYS A 100 16.954 2.542 -26.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 16.771 2.098 -28.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 18.308 2.369 -28.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 17.809 0.788 -28.668 1.00 0.00 H new ATOM 1530 N GLU A 101 19.189 0.162 -22.174 1.00 0.00 N ATOM 1531 CA GLU A 101 18.721 -1.127 -21.663 1.00 0.00 C ATOM 1532 C GLU A 101 17.405 -1.508 -22.356 1.00 0.00 C ATOM 1533 O GLU A 101 16.844 -0.711 -23.117 1.00 0.00 O ATOM 1534 CB GLU A 101 18.720 -1.068 -20.113 1.00 0.00 C ATOM 1535 CG GLU A 101 18.489 -2.382 -19.368 1.00 0.00 C ATOM 1536 CD GLU A 101 19.471 -3.407 -19.934 1.00 0.00 C ATOM 1537 OE1 GLU A 101 20.672 -3.286 -19.612 1.00 0.00 O ATOM 1538 OE2 GLU A 101 19.014 -4.166 -20.811 1.00 0.00 O ATOM 0 H GLU A 101 18.768 0.971 -21.717 1.00 0.00 H new ATOM 0 HA GLU A 101 19.386 -1.955 -21.908 1.00 0.00 H new ATOM 0 HB2 GLU A 101 19.677 -0.659 -19.789 1.00 0.00 H new ATOM 0 HB3 GLU A 101 17.950 -0.362 -19.802 1.00 0.00 H new ATOM 0 HG2 GLU A 101 18.647 -2.249 -18.298 1.00 0.00 H new ATOM 0 HG3 GLU A 101 17.462 -2.722 -19.499 1.00 0.00 H new ATOM 1545 N ASN A 102 16.951 -2.741 -22.132 1.00 0.00 N ATOM 1546 CA ASN A 102 15.634 -3.273 -22.459 1.00 0.00 C ATOM 1547 C ASN A 102 14.504 -2.311 -22.035 1.00 0.00 C ATOM 1548 O ASN A 102 14.648 -1.563 -21.075 1.00 0.00 O ATOM 1549 CB ASN A 102 15.460 -4.671 -21.812 1.00 0.00 C ATOM 1550 CG ASN A 102 15.209 -5.728 -22.871 1.00 0.00 C ATOM 1551 OD1 ASN A 102 15.919 -5.905 -23.843 1.00 0.00 O ATOM 1552 ND2 ASN A 102 14.111 -6.432 -22.790 1.00 0.00 N ATOM 0 H ASN A 102 17.540 -3.443 -21.684 1.00 0.00 H new ATOM 0 HA ASN A 102 15.564 -3.375 -23.542 1.00 0.00 H new ATOM 0 HB2 ASN A 102 16.353 -4.926 -21.242 1.00 0.00 H new ATOM 0 HB3 ASN A 102 14.628 -4.650 -21.108 1.00 0.00 H new ATOM 0 HD21 ASN A 102 13.878 -7.099 -23.525 1.00 0.00 H new ATOM 0 HD22 ASN A 102 13.488 -6.314 -21.991 1.00 0.00 H new ATOM 1559 N PRO A 103 13.348 -2.334 -22.715 1.00 0.00 N ATOM 1560 CA PRO A 103 12.207 -1.521 -22.360 1.00 0.00 C ATOM 1561 C PRO A 103 11.515 -2.017 -21.098 1.00 0.00 C ATOM 1562 O PRO A 103 11.776 -1.543 -20.009 1.00 0.00 O ATOM 1563 CB PRO A 103 11.338 -1.535 -23.619 1.00 0.00 C ATOM 1564 CG PRO A 103 11.718 -2.796 -24.397 1.00 0.00 C ATOM 1565 CD PRO A 103 13.065 -3.200 -23.837 1.00 0.00 C ATOM 0 HA PRO A 103 12.472 -0.500 -22.087 1.00 0.00 H new ATOM 0 HB2 PRO A 103 10.279 -1.544 -23.359 1.00 0.00 H new ATOM 0 HB3 PRO A 103 11.511 -0.642 -24.220 1.00 0.00 H new ATOM 0 HG2 PRO A 103 10.979 -3.585 -24.259 1.00 0.00 H new ATOM 0 HG3 PRO A 103 11.777 -2.599 -25.467 1.00 0.00 H new ATOM 0 HD2 PRO A 103 13.052 -4.243 -23.522 1.00 0.00 H new ATOM 0 HD3 PRO A 103 13.840 -3.107 -24.598 1.00 0.00 H new ATOM 1573 N GLY A 104 10.617 -2.981 -21.222 1.00 0.00 N ATOM 1574 CA GLY A 104 9.877 -3.507 -20.088 1.00 0.00 C ATOM 1575 C GLY A 104 8.416 -3.726 -20.472 1.00 0.00 C ATOM 1576 O GLY A 104 7.884 -2.959 -21.286 1.00 0.00 O ATOM 0 H GLY A 104 10.381 -3.420 -22.112 1.00 0.00 H new ATOM 0 HA2 GLY A 104 10.320 -4.447 -19.759 1.00 0.00 H new ATOM 0 HA3 GLY A 104 9.941 -2.814 -19.249 1.00 0.00 H new ATOM 1580 N PRO A 105 7.761 -4.760 -19.918 1.00 0.00 N ATOM 1581 CA PRO A 105 6.373 -5.083 -20.191 1.00 0.00 C ATOM 1582 C PRO A 105 5.412 -4.151 -19.463 1.00 0.00 C ATOM 1583 O PRO A 105 4.691 -3.399 -20.121 1.00 0.00 O ATOM 1584 CB PRO A 105 6.185 -6.543 -19.782 1.00 0.00 C ATOM 1585 CG PRO A 105 7.331 -6.854 -18.835 1.00 0.00 C ATOM 1586 CD PRO A 105 8.340 -5.726 -19.006 1.00 0.00 C ATOM 0 HA PRO A 105 6.143 -4.946 -21.248 1.00 0.00 H new ATOM 0 HB2 PRO A 105 5.222 -6.692 -19.294 1.00 0.00 H new ATOM 0 HB3 PRO A 105 6.206 -7.199 -20.652 1.00 0.00 H new ATOM 0 HG2 PRO A 105 6.980 -6.910 -17.804 1.00 0.00 H new ATOM 0 HG3 PRO A 105 7.781 -7.818 -19.071 1.00 0.00 H new ATOM 0 HD2 PRO A 105 8.562 -5.261 -18.045 1.00 0.00 H new ATOM 0 HD3 PRO A 105 9.281 -6.110 -19.400 1.00 0.00 H new ATOM 1594 N ALA A 106 5.367 -4.235 -18.128 1.00 0.00 N ATOM 1595 CA ALA A 106 4.561 -3.357 -17.304 1.00 0.00 C ATOM 1596 C ALA A 106 5.093 -1.936 -17.313 1.00 0.00 C ATOM 1597 O ALA A 106 6.274 -1.657 -17.092 1.00 0.00 O ATOM 1598 CB ALA A 106 4.589 -3.856 -15.889 1.00 0.00 C ATOM 0 H ALA A 106 5.897 -4.924 -17.595 1.00 0.00 H new ATOM 0 HA ALA A 106 3.548 -3.355 -17.707 1.00 0.00 H new ATOM 0 HB1 ALA A 106 3.985 -3.202 -15.260 1.00 0.00 H new ATOM 0 HB2 ALA A 106 4.186 -4.868 -15.852 1.00 0.00 H new ATOM 0 HB3 ALA A 106 5.617 -3.861 -15.525 1.00 0.00 H new ATOM 1604 N ARG A 107 4.162 -1.024 -17.525 1.00 0.00 N ATOM 1605 CA ARG A 107 4.422 0.400 -17.621 1.00 0.00 C ATOM 1606 C ARG A 107 3.366 1.174 -16.871 1.00 0.00 C ATOM 1607 O ARG A 107 2.244 0.699 -16.764 1.00 0.00 O ATOM 1608 CB ARG A 107 4.454 0.802 -19.102 1.00 0.00 C ATOM 1609 CG ARG A 107 5.552 0.060 -19.882 1.00 0.00 C ATOM 1610 CD ARG A 107 6.203 0.879 -20.996 1.00 0.00 C ATOM 1611 NE ARG A 107 6.154 0.156 -22.256 1.00 0.00 N ATOM 1612 CZ ARG A 107 5.082 -0.215 -22.903 1.00 0.00 C ATOM 1613 NH1 ARG A 107 3.892 0.002 -22.450 1.00 0.00 N ATOM 1614 NH2 ARG A 107 5.206 -0.763 -24.059 1.00 0.00 N ATOM 0 H ARG A 107 3.176 -1.261 -17.638 1.00 0.00 H new ATOM 0 HA ARG A 107 5.387 0.632 -17.170 1.00 0.00 H new ATOM 0 HB2 ARG A 107 3.485 0.593 -19.554 1.00 0.00 H new ATOM 0 HB3 ARG A 107 4.617 1.877 -19.181 1.00 0.00 H new ATOM 0 HG2 ARG A 107 6.325 -0.257 -19.182 1.00 0.00 H new ATOM 0 HG3 ARG A 107 5.124 -0.844 -20.316 1.00 0.00 H new ATOM 0 HD2 ARG A 107 5.691 1.836 -21.099 1.00 0.00 H new ATOM 0 HD3 ARG A 107 7.239 1.098 -20.736 1.00 0.00 H new ATOM 0 HE ARG A 107 7.050 -0.087 -22.679 1.00 0.00 H new ATOM 0 HH11 ARG A 107 3.765 0.479 -21.557 1.00 0.00 H new ATOM 0 HH12 ARG A 107 3.079 -0.303 -22.985 1.00 0.00 H new ATOM 0 HH21 ARG A 107 6.133 -0.903 -24.460 1.00 0.00 H new ATOM 0 HH22 ARG A 107 4.377 -1.058 -24.575 1.00 0.00 H new ATOM 1628 N VAL A 108 3.721 2.349 -16.380 1.00 0.00 N ATOM 1629 CA VAL A 108 2.822 3.289 -15.696 1.00 0.00 C ATOM 1630 C VAL A 108 2.162 4.184 -16.715 1.00 0.00 C ATOM 1631 O VAL A 108 2.814 4.905 -17.460 1.00 0.00 O ATOM 1632 CB VAL A 108 3.570 4.150 -14.682 1.00 0.00 C ATOM 1633 CG1 VAL A 108 4.834 4.772 -15.262 1.00 0.00 C ATOM 1634 CG2 VAL A 108 2.699 5.203 -13.972 1.00 0.00 C ATOM 0 H VAL A 108 4.678 2.696 -16.445 1.00 0.00 H new ATOM 0 HA VAL A 108 2.074 2.706 -15.159 1.00 0.00 H new ATOM 0 HB VAL A 108 3.871 3.448 -13.905 1.00 0.00 H new ATOM 0 HG11 VAL A 108 5.327 5.374 -14.498 1.00 0.00 H new ATOM 0 HG12 VAL A 108 5.509 3.983 -15.593 1.00 0.00 H new ATOM 0 HG13 VAL A 108 4.572 5.405 -16.110 1.00 0.00 H new ATOM 0 HG21 VAL A 108 3.312 5.769 -13.270 1.00 0.00 H new ATOM 0 HG22 VAL A 108 2.274 5.882 -14.711 1.00 0.00 H new ATOM 0 HG23 VAL A 108 1.894 4.705 -13.432 1.00 0.00 H new ATOM 1644 N ILE A 109 0.852 4.078 -16.805 1.00 0.00 N ATOM 1645 CA ILE A 109 0.069 4.847 -17.757 1.00 0.00 C ATOM 1646 C ILE A 109 -0.587 5.926 -16.936 1.00 0.00 C ATOM 1647 O ILE A 109 -1.342 5.667 -15.999 1.00 0.00 O ATOM 1648 CB ILE A 109 -0.869 3.924 -18.518 1.00 0.00 C ATOM 1649 CG1 ILE A 109 -0.153 3.198 -19.675 1.00 0.00 C ATOM 1650 CG2 ILE A 109 -2.026 4.698 -19.123 1.00 0.00 C ATOM 1651 CD1 ILE A 109 1.101 2.442 -19.253 1.00 0.00 C ATOM 0 H ILE A 109 0.296 3.455 -16.219 1.00 0.00 H new ATOM 0 HA ILE A 109 0.650 5.322 -18.548 1.00 0.00 H new ATOM 0 HB ILE A 109 -1.228 3.197 -17.789 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -0.849 2.497 -20.136 1.00 0.00 H new ATOM 0 HG13 ILE A 109 0.116 3.929 -20.438 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -2.680 4.012 -19.661 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -2.589 5.190 -18.330 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -1.640 5.448 -19.813 1.00 0.00 H new ATOM 0 HD11 ILE A 109 1.545 1.959 -20.124 1.00 0.00 H new ATOM 0 HD12 ILE A 109 1.818 3.139 -18.820 1.00 0.00 H new ATOM 0 HD13 ILE A 109 0.838 1.686 -18.514 1.00 0.00 H new ATOM 1663 N TYR A 110 -0.208 7.145 -17.238 1.00 0.00 N ATOM 1664 CA TYR A 110 -0.760 8.314 -16.609 1.00 0.00 C ATOM 1665 C TYR A 110 -1.245 9.251 -17.685 1.00 0.00 C ATOM 1666 O TYR A 110 -0.806 9.173 -18.828 1.00 0.00 O ATOM 1667 CB TYR A 110 0.308 8.889 -15.696 1.00 0.00 C ATOM 1668 CG TYR A 110 1.553 9.356 -16.428 1.00 0.00 C ATOM 1669 CD1 TYR A 110 1.495 10.510 -17.222 1.00 0.00 C ATOM 1670 CD2 TYR A 110 2.769 8.656 -16.338 1.00 0.00 C ATOM 1671 CE1 TYR A 110 2.599 11.001 -17.908 1.00 0.00 C ATOM 1672 CE2 TYR A 110 3.907 9.147 -17.010 1.00 0.00 C ATOM 1673 CZ TYR A 110 3.825 10.328 -17.786 1.00 0.00 C ATOM 1674 OH TYR A 110 4.932 10.861 -18.362 1.00 0.00 O ATOM 0 H TYR A 110 0.504 7.352 -17.939 1.00 0.00 H new ATOM 0 HA TYR A 110 -1.628 8.101 -15.985 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -0.113 9.728 -15.143 1.00 0.00 H new ATOM 0 HB3 TYR A 110 0.591 8.134 -14.963 1.00 0.00 H new ATOM 0 HD1 TYR A 110 0.556 11.038 -17.304 1.00 0.00 H new ATOM 0 HD2 TYR A 110 2.831 7.747 -15.757 1.00 0.00 H new ATOM 0 HE1 TYR A 110 2.516 11.884 -18.524 1.00 0.00 H new ATOM 0 HE2 TYR A 110 4.846 8.619 -16.932 1.00 0.00 H new ATOM 0 HH TYR A 110 5.702 10.281 -18.189 1.00 0.00 H new ATOM 1684 N THR A 111 -2.185 10.109 -17.330 1.00 0.00 N ATOM 1685 CA THR A 111 -2.750 11.139 -18.203 1.00 0.00 C ATOM 1686 C THR A 111 -1.881 12.367 -18.232 1.00 0.00 C ATOM 1687 O THR A 111 -1.014 12.532 -17.384 1.00 0.00 O ATOM 1688 CB THR A 111 -4.174 11.518 -17.809 1.00 0.00 C ATOM 1689 OG1 THR A 111 -4.342 12.456 -16.765 1.00 0.00 O ATOM 1690 CG2 THR A 111 -4.935 10.298 -17.351 1.00 0.00 C ATOM 0 H THR A 111 -2.594 10.113 -16.396 1.00 0.00 H new ATOM 0 HA THR A 111 -2.786 10.707 -19.203 1.00 0.00 H new ATOM 0 HB THR A 111 -4.538 11.979 -18.727 1.00 0.00 H new ATOM 0 HG1 THR A 111 -5.168 12.963 -16.910 1.00 0.00 H new ATOM 0 HG21 THR A 111 -5.949 10.585 -17.073 1.00 0.00 H new ATOM 0 HG22 THR A 111 -4.973 9.568 -18.160 1.00 0.00 H new ATOM 0 HG23 THR A 111 -4.433 9.859 -16.489 1.00 0.00 H new ATOM 1698 N TYR A 112 -2.099 13.277 -19.170 1.00 0.00 N ATOM 1699 CA TYR A 112 -1.318 14.513 -19.164 1.00 0.00 C ATOM 1700 C TYR A 112 -2.169 15.743 -18.779 1.00 0.00 C ATOM 1701 O TYR A 112 -3.396 15.707 -18.890 1.00 0.00 O ATOM 1702 CB TYR A 112 -0.486 14.559 -20.436 1.00 0.00 C ATOM 1703 CG TYR A 112 0.455 15.736 -20.628 1.00 0.00 C ATOM 1704 CD1 TYR A 112 0.008 17.049 -20.875 1.00 0.00 C ATOM 1705 CD2 TYR A 112 1.829 15.500 -20.543 1.00 0.00 C ATOM 1706 CE1 TYR A 112 0.921 18.103 -21.047 1.00 0.00 C ATOM 1707 CE2 TYR A 112 2.765 16.540 -20.664 1.00 0.00 C ATOM 1708 CZ TYR A 112 2.305 17.859 -20.896 1.00 0.00 C ATOM 1709 OH TYR A 112 3.178 18.899 -20.923 1.00 0.00 O ATOM 0 H TYR A 112 -2.784 13.193 -19.921 1.00 0.00 H new ATOM 0 HA TYR A 112 -0.585 14.539 -18.358 1.00 0.00 H new ATOM 0 HB2 TYR A 112 0.107 13.646 -20.481 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -1.170 14.536 -21.284 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -1.052 17.248 -20.933 1.00 0.00 H new ATOM 0 HD2 TYR A 112 2.181 14.492 -20.380 1.00 0.00 H new ATOM 0 HE1 TYR A 112 0.568 19.093 -21.293 1.00 0.00 H new ATOM 0 HE2 TYR A 112 3.822 16.336 -20.581 1.00 0.00 H new ATOM 0 HH TYR A 112 4.091 18.563 -20.804 1.00 0.00 H new ATOM 1719 N PRO A 113 -1.571 16.854 -18.305 1.00 0.00 N ATOM 1720 CA PRO A 113 -0.241 16.933 -17.687 1.00 0.00 C ATOM 1721 C PRO A 113 -0.131 16.269 -16.323 1.00 0.00 C ATOM 1722 O PRO A 113 0.879 15.628 -16.021 1.00 0.00 O ATOM 1723 CB PRO A 113 0.058 18.407 -17.526 1.00 0.00 C ATOM 1724 CG PRO A 113 -1.286 19.127 -17.616 1.00 0.00 C ATOM 1725 CD PRO A 113 -2.269 18.125 -18.214 1.00 0.00 C ATOM 0 HA PRO A 113 0.460 16.399 -18.329 1.00 0.00 H new ATOM 0 HB2 PRO A 113 0.542 18.604 -16.569 1.00 0.00 H new ATOM 0 HB3 PRO A 113 0.738 18.753 -18.304 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -1.617 19.456 -16.631 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -1.209 20.017 -18.241 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -3.157 18.034 -17.588 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -2.605 18.453 -19.198 1.00 0.00 H new ATOM 1733 N ASN A 114 -1.161 16.476 -15.494 1.00 0.00 N ATOM 1734 CA ASN A 114 -1.377 15.793 -14.224 1.00 0.00 C ATOM 1735 C ASN A 114 -1.258 14.295 -14.444 1.00 0.00 C ATOM 1736 O ASN A 114 -2.166 13.723 -15.037 1.00 0.00 O ATOM 1737 CB ASN A 114 -2.785 16.099 -13.659 1.00 0.00 C ATOM 1738 CG ASN A 114 -2.721 16.665 -12.268 1.00 0.00 C ATOM 1739 OD1 ASN A 114 -1.863 16.355 -11.457 1.00 0.00 O ATOM 1740 ND2 ASN A 114 -3.669 17.497 -11.949 1.00 0.00 N ATOM 0 H ASN A 114 -1.894 17.153 -15.703 1.00 0.00 H new ATOM 0 HA ASN A 114 -0.630 16.143 -13.512 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -3.294 16.805 -14.315 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -3.380 15.185 -13.652 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -3.701 17.898 -11.012 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -4.380 17.748 -12.636 1.00 0.00 H new ATOM 1747 N LYS A 115 -0.151 13.701 -13.982 1.00 0.00 N ATOM 1748 CA LYS A 115 0.186 12.284 -14.015 1.00 0.00 C ATOM 1749 C LYS A 115 -0.771 11.530 -13.098 1.00 0.00 C ATOM 1750 O LYS A 115 -0.374 11.017 -12.055 1.00 0.00 O ATOM 1751 CB LYS A 115 1.671 12.085 -13.615 1.00 0.00 C ATOM 1752 CG LYS A 115 2.624 12.089 -14.807 1.00 0.00 C ATOM 1753 CD LYS A 115 3.929 12.823 -14.644 1.00 0.00 C ATOM 1754 CE LYS A 115 3.641 14.249 -15.082 1.00 0.00 C ATOM 1755 NZ LYS A 115 4.646 15.160 -14.511 1.00 0.00 N ATOM 0 H LYS A 115 0.588 14.249 -13.541 1.00 0.00 H new ATOM 0 HA LYS A 115 0.073 11.884 -15.023 1.00 0.00 H new ATOM 0 HB2 LYS A 115 1.963 12.875 -12.923 1.00 0.00 H new ATOM 0 HB3 LYS A 115 1.773 11.140 -13.081 1.00 0.00 H new ATOM 0 HG2 LYS A 115 2.849 11.054 -15.063 1.00 0.00 H new ATOM 0 HG3 LYS A 115 2.098 12.521 -15.658 1.00 0.00 H new ATOM 0 HD2 LYS A 115 4.273 12.790 -13.610 1.00 0.00 H new ATOM 0 HD3 LYS A 115 4.712 12.374 -15.255 1.00 0.00 H new ATOM 0 HE2 LYS A 115 3.654 14.314 -16.170 1.00 0.00 H new ATOM 0 HE3 LYS A 115 2.643 14.544 -14.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 4.444 16.134 -14.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 4.613 15.107 -13.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 5.593 14.884 -14.842 1.00 0.00 H new ATOM 1769 N VAL A 116 -2.049 11.532 -13.476 1.00 0.00 N ATOM 1770 CA VAL A 116 -3.170 10.840 -12.859 1.00 0.00 C ATOM 1771 C VAL A 116 -2.932 9.396 -13.230 1.00 0.00 C ATOM 1772 O VAL A 116 -3.263 8.947 -14.318 1.00 0.00 O ATOM 1773 CB VAL A 116 -4.535 11.379 -13.342 1.00 0.00 C ATOM 1774 CG1 VAL A 116 -5.704 10.472 -12.924 1.00 0.00 C ATOM 1775 CG2 VAL A 116 -4.782 12.827 -12.875 1.00 0.00 C ATOM 0 H VAL A 116 -2.347 12.065 -14.293 1.00 0.00 H new ATOM 0 HA VAL A 116 -3.219 10.985 -11.780 1.00 0.00 H new ATOM 0 HB VAL A 116 -4.490 11.378 -14.431 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -6.641 10.895 -13.288 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -5.564 9.479 -13.351 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -5.737 10.399 -11.837 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -5.753 13.165 -13.237 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -4.767 12.866 -11.786 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -4.001 13.475 -13.272 1.00 0.00 H new ATOM 1785 N PHE A 117 -2.138 8.751 -12.389 1.00 0.00 N ATOM 1786 CA PHE A 117 -1.743 7.363 -12.392 1.00 0.00 C ATOM 1787 C PHE A 117 -2.973 6.485 -12.619 1.00 0.00 C ATOM 1788 O PHE A 117 -3.829 6.331 -11.744 1.00 0.00 O ATOM 1789 CB PHE A 117 -1.042 7.052 -11.068 1.00 0.00 C ATOM 1790 CG PHE A 117 -0.907 5.578 -10.879 1.00 0.00 C ATOM 1791 CD1 PHE A 117 -0.060 4.848 -11.720 1.00 0.00 C ATOM 1792 CD2 PHE A 117 -1.712 4.930 -9.936 1.00 0.00 C ATOM 1793 CE1 PHE A 117 -0.008 3.457 -11.622 1.00 0.00 C ATOM 1794 CE2 PHE A 117 -1.656 3.544 -9.823 1.00 0.00 C ATOM 1795 CZ PHE A 117 -0.834 2.807 -10.696 1.00 0.00 C ATOM 0 H PHE A 117 -1.713 9.247 -11.606 1.00 0.00 H new ATOM 0 HA PHE A 117 -1.044 7.156 -13.202 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -0.057 7.518 -11.054 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -1.609 7.480 -10.241 1.00 0.00 H new ATOM 0 HD1 PHE A 117 0.554 5.361 -12.445 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -2.372 5.501 -9.300 1.00 0.00 H new ATOM 0 HE1 PHE A 117 0.660 2.889 -12.252 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -2.240 3.037 -9.069 1.00 0.00 H new ATOM 0 HZ PHE A 117 -0.840 1.728 -10.651 1.00 0.00 H new ATOM 1805 N CYS A 118 -3.110 5.967 -13.833 1.00 0.00 N ATOM 1806 CA CYS A 118 -4.283 5.190 -14.180 1.00 0.00 C ATOM 1807 C CYS A 118 -4.152 3.771 -13.659 1.00 0.00 C ATOM 1808 O CYS A 118 -5.096 3.149 -13.165 1.00 0.00 O ATOM 1809 CB CYS A 118 -4.492 5.232 -15.687 1.00 0.00 C ATOM 1810 SG CYS A 118 -4.403 6.900 -16.342 1.00 0.00 S ATOM 0 H CYS A 118 -2.428 6.072 -14.584 1.00 0.00 H new ATOM 0 HA CYS A 118 -5.165 5.622 -13.706 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -3.738 4.613 -16.173 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -5.463 4.801 -15.929 1.00 0.00 H new ATOM 1815 N GLY A 119 -2.943 3.255 -13.821 1.00 0.00 N ATOM 1816 CA GLY A 119 -2.580 1.923 -13.438 1.00 0.00 C ATOM 1817 C GLY A 119 -1.350 1.489 -14.183 1.00 0.00 C ATOM 1818 O GLY A 119 -0.511 2.292 -14.606 1.00 0.00 O ATOM 0 H GLY A 119 -2.172 3.778 -14.237 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -2.398 1.882 -12.364 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -3.402 1.239 -13.648 1.00 0.00 H new ATOM 1822 N ILE A 120 -1.239 0.182 -14.330 1.00 0.00 N ATOM 1823 CA ILE A 120 -0.110 -0.403 -15.003 1.00 0.00 C ATOM 1824 C ILE A 120 -0.701 -1.223 -16.131 1.00 0.00 C ATOM 1825 O ILE A 120 -1.794 -1.753 -16.013 1.00 0.00 O ATOM 1826 CB ILE A 120 0.752 -1.194 -14.023 1.00 0.00 C ATOM 1827 CG1 ILE A 120 1.057 -0.474 -12.695 1.00 0.00 C ATOM 1828 CG2 ILE A 120 2.036 -1.727 -14.681 1.00 0.00 C ATOM 1829 CD1 ILE A 120 2.365 0.247 -12.539 1.00 0.00 C ATOM 0 H ILE A 120 -1.924 -0.492 -13.988 1.00 0.00 H new ATOM 0 HA ILE A 120 0.579 0.334 -15.415 1.00 0.00 H new ATOM 0 HB ILE A 120 0.129 -2.045 -13.746 1.00 0.00 H new ATOM 0 HG12 ILE A 120 0.260 0.250 -12.523 1.00 0.00 H new ATOM 0 HG13 ILE A 120 0.993 -1.214 -11.898 1.00 0.00 H new ATOM 0 HG21 ILE A 120 2.618 -2.283 -13.946 1.00 0.00 H new ATOM 0 HG22 ILE A 120 1.774 -2.385 -15.510 1.00 0.00 H new ATOM 0 HG23 ILE A 120 2.627 -0.891 -15.054 1.00 0.00 H new ATOM 0 HD11 ILE A 120 2.417 0.697 -11.547 1.00 0.00 H new ATOM 0 HD12 ILE A 120 3.186 -0.459 -12.661 1.00 0.00 H new ATOM 0 HD13 ILE A 120 2.443 1.028 -13.296 1.00 0.00 H new ATOM 1841 N ILE A 121 -0.028 -1.355 -17.251 1.00 0.00 N ATOM 1842 CA ILE A 121 -0.489 -2.124 -18.388 1.00 0.00 C ATOM 1843 C ILE A 121 0.669 -2.936 -18.944 1.00 0.00 C ATOM 1844 O ILE A 121 1.823 -2.506 -18.910 1.00 0.00 O ATOM 1845 CB ILE A 121 -1.105 -1.199 -19.451 1.00 0.00 C ATOM 1846 CG1 ILE A 121 0.010 -0.598 -20.318 1.00 0.00 C ATOM 1847 CG2 ILE A 121 -2.027 -0.117 -18.799 1.00 0.00 C ATOM 1848 CD1 ILE A 121 -0.555 0.121 -21.512 1.00 0.00 C ATOM 0 H ILE A 121 0.881 -0.918 -17.402 1.00 0.00 H new ATOM 0 HA ILE A 121 -1.273 -2.814 -18.075 1.00 0.00 H new ATOM 0 HB ILE A 121 -1.753 -1.780 -20.106 1.00 0.00 H new ATOM 0 HG12 ILE A 121 0.604 0.094 -19.722 1.00 0.00 H new ATOM 0 HG13 ILE A 121 0.681 -1.389 -20.651 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -2.447 0.520 -19.577 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -2.835 -0.607 -18.256 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -1.442 0.491 -18.108 1.00 0.00 H new ATOM 0 HD11 ILE A 121 0.259 0.535 -22.106 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -1.128 -0.579 -22.120 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -1.206 0.928 -21.176 1.00 0.00 H new ATOM 1860 N ALA A 122 0.372 -4.073 -19.555 1.00 0.00 N ATOM 1861 CA ALA A 122 1.398 -4.895 -20.186 1.00 0.00 C ATOM 1862 C ALA A 122 0.759 -5.938 -21.088 1.00 0.00 C ATOM 1863 O ALA A 122 -0.409 -6.303 -20.932 1.00 0.00 O ATOM 1864 CB ALA A 122 2.246 -5.626 -19.142 1.00 0.00 C ATOM 0 H ALA A 122 -0.573 -4.450 -19.628 1.00 0.00 H new ATOM 0 HA ALA A 122 2.033 -4.226 -20.767 1.00 0.00 H new ATOM 0 HB1 ALA A 122 3.001 -6.230 -19.645 1.00 0.00 H new ATOM 0 HB2 ALA A 122 2.735 -4.897 -18.496 1.00 0.00 H new ATOM 0 HB3 ALA A 122 1.606 -6.272 -18.541 1.00 0.00 H new ATOM 1870 N HIS A 123 1.553 -6.455 -22.019 1.00 0.00 N ATOM 1871 CA HIS A 123 1.088 -7.440 -22.983 1.00 0.00 C ATOM 1872 C HIS A 123 1.285 -8.858 -22.444 1.00 0.00 C ATOM 1873 O HIS A 123 2.319 -9.463 -22.680 1.00 0.00 O ATOM 1874 CB HIS A 123 1.793 -7.248 -24.343 1.00 0.00 C ATOM 1875 CG HIS A 123 1.807 -5.844 -24.918 1.00 0.00 C ATOM 1876 ND1 HIS A 123 0.973 -5.347 -25.892 1.00 0.00 N ATOM 1877 CD2 HIS A 123 2.580 -4.807 -24.487 1.00 0.00 C ATOM 1878 CE1 HIS A 123 1.226 -4.041 -26.059 1.00 0.00 C ATOM 1879 NE2 HIS A 123 2.196 -3.682 -25.201 1.00 0.00 N ATOM 0 H HIS A 123 2.535 -6.202 -22.125 1.00 0.00 H new ATOM 0 HA HIS A 123 0.020 -7.292 -23.141 1.00 0.00 H new ATOM 0 HB2 HIS A 123 2.825 -7.582 -24.240 1.00 0.00 H new ATOM 0 HB3 HIS A 123 1.315 -7.907 -25.068 1.00 0.00 H new ATOM 0 HD1 HIS A 123 0.275 -5.885 -26.405 1.00 0.00 H new ATOM 0 HD2 HIS A 123 3.349 -4.853 -23.730 1.00 0.00 H new ATOM 0 HE1 HIS A 123 0.733 -3.388 -26.764 1.00 0.00 H new ATOM 1888 N THR A 124 0.287 -9.421 -21.760 1.00 0.00 N ATOM 1889 CA THR A 124 0.364 -10.787 -21.168 1.00 0.00 C ATOM 1890 C THR A 124 -0.167 -11.873 -22.104 1.00 0.00 C ATOM 1891 O THR A 124 -0.758 -12.872 -21.708 1.00 0.00 O ATOM 1892 CB THR A 124 -0.269 -10.830 -19.775 1.00 0.00 C ATOM 1893 OG1 THR A 124 0.195 -11.881 -18.986 1.00 0.00 O ATOM 1894 CG2 THR A 124 -1.782 -10.973 -19.736 1.00 0.00 C ATOM 0 H THR A 124 -0.604 -8.954 -21.593 1.00 0.00 H new ATOM 0 HA THR A 124 1.421 -11.018 -21.039 1.00 0.00 H new ATOM 0 HB THR A 124 0.028 -9.852 -19.396 1.00 0.00 H new ATOM 0 HG1 THR A 124 -0.245 -11.852 -18.111 1.00 0.00 H new ATOM 0 HG21 THR A 124 -2.119 -10.992 -18.700 1.00 0.00 H new ATOM 0 HG22 THR A 124 -2.241 -10.129 -20.251 1.00 0.00 H new ATOM 0 HG23 THR A 124 -2.073 -11.900 -20.229 1.00 0.00 H new ATOM 1902 N LYS A 125 0.030 -11.667 -23.398 1.00 0.00 N ATOM 1903 CA LYS A 125 -0.408 -12.608 -24.431 1.00 0.00 C ATOM 1904 C LYS A 125 0.702 -13.567 -24.837 1.00 0.00 C ATOM 1905 O LYS A 125 0.402 -14.725 -25.093 1.00 0.00 O ATOM 1906 CB LYS A 125 -1.067 -11.843 -25.581 1.00 0.00 C ATOM 1907 CG LYS A 125 -1.872 -12.783 -26.502 1.00 0.00 C ATOM 1908 CD LYS A 125 -3.383 -12.813 -26.207 1.00 0.00 C ATOM 1909 CE LYS A 125 -3.927 -14.247 -26.096 1.00 0.00 C ATOM 1910 NZ LYS A 125 -4.344 -14.574 -24.707 1.00 0.00 N ATOM 0 H LYS A 125 0.500 -10.840 -23.768 1.00 0.00 H new ATOM 0 HA LYS A 125 -1.177 -13.267 -24.029 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -1.727 -11.076 -25.177 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -0.301 -11.330 -26.163 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -1.721 -12.476 -27.537 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -1.475 -13.794 -26.408 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -3.580 -12.279 -25.278 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -3.916 -12.285 -26.998 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -4.777 -14.366 -26.768 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -3.162 -14.952 -26.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -4.705 -15.549 -24.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -3.527 -14.485 -24.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -5.092 -13.917 -24.405 1.00 0.00 H new ATOM 1924 N GLU A 126 1.944 -13.092 -24.825 1.00 0.00 N ATOM 1925 CA GLU A 126 3.140 -13.832 -25.209 1.00 0.00 C ATOM 1926 C GLU A 126 4.396 -13.014 -24.837 1.00 0.00 C ATOM 1927 O GLU A 126 4.956 -13.169 -23.758 1.00 0.00 O ATOM 1928 CB GLU A 126 2.990 -14.258 -26.693 1.00 0.00 C ATOM 1929 CG GLU A 126 3.195 -15.762 -26.870 1.00 0.00 C ATOM 1930 CD GLU A 126 4.692 -16.014 -27.066 1.00 0.00 C ATOM 1931 OE1 GLU A 126 5.488 -15.439 -26.290 1.00 0.00 O ATOM 1932 OE2 GLU A 126 5.041 -16.632 -28.092 1.00 0.00 O ATOM 0 H GLU A 126 2.153 -12.137 -24.534 1.00 0.00 H new ATOM 0 HA GLU A 126 3.267 -14.763 -24.657 1.00 0.00 H new ATOM 0 HB2 GLU A 126 2.000 -13.980 -27.054 1.00 0.00 H new ATOM 0 HB3 GLU A 126 3.714 -13.717 -27.302 1.00 0.00 H new ATOM 0 HG2 GLU A 126 2.828 -16.302 -25.997 1.00 0.00 H new ATOM 0 HG3 GLU A 126 2.631 -16.125 -27.729 1.00 0.00 H new ATOM 1939 N ASN A 127 4.719 -12.023 -25.664 1.00 0.00 N ATOM 1940 CA ASN A 127 5.870 -11.118 -25.622 1.00 0.00 C ATOM 1941 C ASN A 127 5.405 -9.655 -25.691 1.00 0.00 C ATOM 1942 O ASN A 127 5.635 -8.834 -24.798 1.00 0.00 O ATOM 1943 CB ASN A 127 6.859 -11.540 -26.738 1.00 0.00 C ATOM 1944 CG ASN A 127 6.189 -11.967 -28.035 1.00 0.00 C ATOM 1945 OD1 ASN A 127 5.726 -11.137 -28.800 1.00 0.00 O ATOM 1946 ND2 ASN A 127 6.040 -13.244 -28.287 1.00 0.00 N ATOM 0 H ASN A 127 4.121 -11.810 -26.463 1.00 0.00 H new ATOM 0 HA ASN A 127 6.407 -11.192 -24.676 1.00 0.00 H new ATOM 0 HB2 ASN A 127 7.531 -10.708 -26.946 1.00 0.00 H new ATOM 0 HB3 ASN A 127 7.474 -12.362 -26.372 1.00 0.00 H new ATOM 0 HD21 ASN A 127 5.537 -13.544 -29.122 1.00 0.00 H new ATOM 0 HD22 ASN A 127 6.427 -13.938 -27.648 1.00 0.00 H new ATOM 1953 N GLN A 128 4.699 -9.335 -26.770 1.00 0.00 N ATOM 1954 CA GLN A 128 4.206 -8.018 -27.123 1.00 0.00 C ATOM 1955 C GLN A 128 3.064 -8.082 -28.151 1.00 0.00 C ATOM 1956 O GLN A 128 3.213 -7.751 -29.320 1.00 0.00 O ATOM 1957 CB GLN A 128 5.397 -7.128 -27.552 1.00 0.00 C ATOM 1958 CG GLN A 128 5.808 -6.140 -26.447 1.00 0.00 C ATOM 1959 CD GLN A 128 6.014 -4.713 -26.937 1.00 0.00 C ATOM 1960 OE1 GLN A 128 6.439 -4.380 -28.022 1.00 0.00 O ATOM 1961 NE2 GLN A 128 5.768 -3.734 -26.107 1.00 0.00 N ATOM 0 H GLN A 128 4.442 -10.038 -27.463 1.00 0.00 H new ATOM 0 HA GLN A 128 3.750 -7.552 -26.250 1.00 0.00 H new ATOM 0 HB2 GLN A 128 6.248 -7.760 -27.808 1.00 0.00 H new ATOM 0 HB3 GLN A 128 5.130 -6.574 -28.452 1.00 0.00 H new ATOM 0 HG2 GLN A 128 5.043 -6.140 -25.671 1.00 0.00 H new ATOM 0 HG3 GLN A 128 6.730 -6.491 -25.985 1.00 0.00 H new ATOM 0 HE21 GLN A 128 5.408 -3.935 -25.174 1.00 0.00 H new ATOM 0 HE22 GLN A 128 5.936 -2.769 -26.392 1.00 0.00 H new ATOM 1970 N GLY A 129 1.875 -8.480 -27.687 1.00 0.00 N ATOM 1971 CA GLY A 129 0.672 -8.536 -28.526 1.00 0.00 C ATOM 1972 C GLY A 129 -0.461 -7.686 -27.971 1.00 0.00 C ATOM 1973 O GLY A 129 -0.407 -6.455 -27.978 1.00 0.00 O ATOM 0 H GLY A 129 1.719 -8.772 -26.722 1.00 0.00 H new ATOM 0 HA2 GLY A 129 0.918 -8.197 -29.532 1.00 0.00 H new ATOM 0 HA3 GLY A 129 0.339 -9.570 -28.611 1.00 0.00 H new ATOM 1977 N GLU A 130 -1.476 -8.335 -27.424 1.00 0.00 N ATOM 1978 CA GLU A 130 -2.619 -7.660 -26.794 1.00 0.00 C ATOM 1979 C GLU A 130 -2.209 -6.857 -25.566 1.00 0.00 C ATOM 1980 O GLU A 130 -1.227 -7.200 -24.918 1.00 0.00 O ATOM 1981 CB GLU A 130 -3.640 -8.716 -26.362 1.00 0.00 C ATOM 1982 CG GLU A 130 -4.913 -8.579 -27.191 1.00 0.00 C ATOM 1983 CD GLU A 130 -5.847 -7.513 -26.616 1.00 0.00 C ATOM 1984 OE1 GLU A 130 -5.347 -6.384 -26.423 1.00 0.00 O ATOM 1985 OE2 GLU A 130 -7.023 -7.849 -26.378 1.00 0.00 O ATOM 0 H GLU A 130 -1.538 -9.353 -27.400 1.00 0.00 H new ATOM 0 HA GLU A 130 -3.041 -6.970 -27.525 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -3.219 -9.714 -26.488 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -3.871 -8.599 -25.303 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -4.653 -8.321 -28.218 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -5.431 -9.538 -27.225 1.00 0.00 H new ATOM 1992 N LEU A 131 -2.960 -5.825 -25.198 1.00 0.00 N ATOM 1993 CA LEU A 131 -2.677 -4.951 -24.078 1.00 0.00 C ATOM 1994 C LEU A 131 -3.867 -4.887 -23.139 1.00 0.00 C ATOM 1995 O LEU A 131 -5.010 -4.717 -23.537 1.00 0.00 O ATOM 1996 CB LEU A 131 -2.272 -3.564 -24.593 1.00 0.00 C ATOM 1997 CG LEU A 131 -1.407 -2.721 -23.651 1.00 0.00 C ATOM 1998 CD1 LEU A 131 -0.268 -3.476 -22.966 1.00 0.00 C ATOM 1999 CD2 LEU A 131 -0.844 -1.563 -24.493 1.00 0.00 C ATOM 0 H LEU A 131 -3.814 -5.569 -25.694 1.00 0.00 H new ATOM 0 HA LEU A 131 -1.841 -5.352 -23.505 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -1.733 -3.691 -25.532 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -3.179 -3.004 -24.819 1.00 0.00 H new ATOM 0 HG LEU A 131 -2.037 -2.385 -22.828 1.00 0.00 H new ATOM 0 HD11 LEU A 131 0.285 -2.793 -22.321 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -0.679 -4.289 -22.367 1.00 0.00 H new ATOM 0 HD13 LEU A 131 0.403 -3.885 -23.721 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -0.217 -0.929 -23.866 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -0.249 -1.965 -25.313 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -1.667 -0.974 -24.897 1.00 0.00 H new ATOM 2011 N LYS A 132 -3.559 -4.989 -21.855 1.00 0.00 N ATOM 2012 CA LYS A 132 -4.537 -5.008 -20.779 1.00 0.00 C ATOM 2013 C LYS A 132 -3.939 -4.347 -19.556 1.00 0.00 C ATOM 2014 O LYS A 132 -2.721 -4.164 -19.459 1.00 0.00 O ATOM 2015 CB LYS A 132 -4.962 -6.451 -20.494 1.00 0.00 C ATOM 2016 CG LYS A 132 -3.797 -7.450 -20.390 1.00 0.00 C ATOM 2017 CD LYS A 132 -4.118 -8.536 -19.363 1.00 0.00 C ATOM 2018 CE LYS A 132 -3.213 -8.333 -18.133 1.00 0.00 C ATOM 2019 NZ LYS A 132 -3.518 -9.306 -17.056 1.00 0.00 N ATOM 0 H LYS A 132 -2.597 -5.063 -21.525 1.00 0.00 H new ATOM 0 HA LYS A 132 -5.429 -4.452 -21.066 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -5.527 -6.473 -19.562 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -5.637 -6.780 -21.284 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -3.611 -7.904 -21.363 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -2.885 -6.927 -20.103 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -5.167 -8.484 -19.073 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -3.955 -9.524 -19.794 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -2.169 -8.435 -18.429 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -3.339 -7.319 -17.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -2.694 -9.399 -16.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -4.335 -8.971 -16.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -3.739 -10.231 -17.476 1.00 0.00 H new ATOM 2033 N LEU A 133 -4.807 -4.046 -18.603 1.00 0.00 N ATOM 2034 CA LEU A 133 -4.433 -3.525 -17.299 1.00 0.00 C ATOM 2035 C LEU A 133 -3.908 -4.674 -16.434 1.00 0.00 C ATOM 2036 O LEU A 133 -4.391 -5.803 -16.491 1.00 0.00 O ATOM 2037 CB LEU A 133 -5.647 -2.790 -16.699 1.00 0.00 C ATOM 2038 CG LEU A 133 -5.395 -1.997 -15.398 1.00 0.00 C ATOM 2039 CD1 LEU A 133 -4.710 -0.628 -15.631 1.00 0.00 C ATOM 2040 CD2 LEU A 133 -6.698 -1.824 -14.602 1.00 0.00 C ATOM 0 H LEU A 133 -5.814 -4.160 -18.718 1.00 0.00 H new ATOM 0 HA LEU A 133 -3.624 -2.797 -17.365 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -6.034 -2.101 -17.450 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -6.429 -3.524 -16.506 1.00 0.00 H new ATOM 0 HG LEU A 133 -4.694 -2.592 -14.813 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -4.564 -0.127 -14.674 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -3.744 -0.782 -16.111 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -5.339 -0.011 -16.272 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -6.495 -1.263 -13.690 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -7.425 -1.283 -15.207 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -7.099 -2.804 -14.343 1.00 0.00 H new ATOM 2052 N CYS A 134 -2.881 -4.405 -15.642 1.00 0.00 N ATOM 2053 CA CYS A 134 -2.353 -5.260 -14.593 1.00 0.00 C ATOM 2054 C CYS A 134 -3.307 -5.339 -13.416 1.00 0.00 C ATOM 2055 O CYS A 134 -4.318 -4.654 -13.321 1.00 0.00 O ATOM 2056 CB CYS A 134 -1.018 -4.692 -14.112 1.00 0.00 C ATOM 2057 SG CYS A 134 0.162 -4.340 -15.412 1.00 0.00 S ATOM 0 H CYS A 134 -2.363 -3.530 -15.721 1.00 0.00 H new ATOM 0 HA CYS A 134 -2.222 -6.263 -15.000 1.00 0.00 H new ATOM 0 HB2 CYS A 134 -1.209 -3.774 -13.556 1.00 0.00 H new ATOM 0 HB3 CYS A 134 -0.569 -5.399 -13.415 1.00 0.00 H new ATOM 2062 N SER A 135 -2.933 -6.149 -12.447 1.00 0.00 N ATOM 2063 CA SER A 135 -3.738 -6.388 -11.263 1.00 0.00 C ATOM 2064 C SER A 135 -2.742 -6.499 -10.116 1.00 0.00 C ATOM 2065 O SER A 135 -1.940 -7.430 -10.045 1.00 0.00 O ATOM 2066 CB SER A 135 -4.711 -7.540 -11.545 1.00 0.00 C ATOM 2067 OG SER A 135 -4.040 -8.743 -11.805 1.00 0.00 O ATOM 0 H SER A 135 -2.054 -6.666 -12.458 1.00 0.00 H new ATOM 0 HA SER A 135 -4.427 -5.597 -10.967 1.00 0.00 H new ATOM 0 HB2 SER A 135 -5.374 -7.672 -10.690 1.00 0.00 H new ATOM 0 HB3 SER A 135 -5.339 -7.283 -12.398 1.00 0.00 H new ATOM 0 HG SER A 135 -3.178 -8.744 -11.339 1.00 0.00 H new ATOM 2073 N HIS A 136 -2.616 -5.403 -9.367 1.00 0.00 N ATOM 2074 CA HIS A 136 -1.965 -5.423 -8.057 1.00 0.00 C ATOM 2075 C HIS A 136 -2.695 -6.236 -6.997 1.00 0.00 C ATOM 2076 O HIS A 136 -2.020 -6.508 -5.985 1.00 0.00 O ATOM 2077 CB HIS A 136 -1.831 -4.003 -7.526 1.00 0.00 C ATOM 2078 CG HIS A 136 -3.079 -3.129 -7.534 1.00 0.00 C ATOM 2079 ND1 HIS A 136 -3.065 -1.775 -7.369 1.00 0.00 N ATOM 2080 CD2 HIS A 136 -4.386 -3.466 -7.740 1.00 0.00 C ATOM 2081 CE1 HIS A 136 -4.313 -1.286 -7.459 1.00 0.00 C ATOM 2082 NE2 HIS A 136 -5.146 -2.311 -7.698 1.00 0.00 N ATOM 2083 OXT HIS A 136 -3.913 -6.437 -7.149 1.00 0.00 O ATOM 0 H HIS A 136 -2.959 -4.484 -9.648 1.00 0.00 H new ATOM 0 HA HIS A 136 -1.000 -5.899 -8.230 1.00 0.00 H new ATOM 0 HB2 HIS A 136 -1.467 -4.060 -6.500 1.00 0.00 H new ATOM 0 HB3 HIS A 136 -1.062 -3.497 -8.109 1.00 0.00 H new ATOM 0 HD1 HIS A 136 -2.229 -1.215 -7.202 1.00 0.00 H new ATOM 0 HD2 HIS A 136 -4.762 -4.464 -7.907 1.00 0.00 H new ATOM 0 HE1 HIS A 136 -4.597 -0.249 -7.357 1.00 0.00 H new TER 2092 HIS A 136