USER MOD reduce.3.24.130724 H: found=0, std=0, add=1436, rem=0, adj=50 USER MOD reduce.3.24.130724 removed 1430 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 25 HIS : no HE2:sc= 1.18 K(o=1.9,f=-7!) USER MOD Set 1.2: B 85 HIS : no HE2:sc= 0.71 K(o=1.9,f=-4.8!) USER MOD Set 2.1: B 55 LYS NZ :NH3+ -153:sc= 1.82 (180deg=1.49) USER MOD Set 2.2: B 59 THR OG1 : rot 180:sc= 0.143 USER MOD Set 3.1: B 29 LYS NZ :NH3+ 175:sc= 0.388 (180deg=-0.0735) USER MOD Set 3.2: B 50 GLN : amide:sc= 0.378 K(o=0.77,f=-1.2) USER MOD Set 4.1: B 17 TYR OH : rot 177:sc= 1.87 USER MOD Set 4.2: B 38 ASN : amide:sc= 0.733 K(o=2.6,f=0.19) USER MOD Set 5.1: B 15 HIS : no HE2:sc= 1.02 K(o=2.3,f=-5.5!) USER MOD Set 5.2: B 24 LYS NZ :NH3+ -174:sc= 1.26 (180deg=-0.0331) USER MOD Set 6.1: A 57 MET CE :methyl -179:sc= -0.492 (180deg=-0.514) USER MOD Set 6.2: A 68 CYS SG : rot 53:sc= 0.00221 USER MOD Set 7.1: A 55 LYS NZ :NH3+ 166:sc= 0.464 (180deg=-0.0951) USER MOD Set 7.2: A 59 THR OG1 : rot 69:sc= 1.63 USER MOD Set 8.1: A 17 TYR OH : rot 32:sc= 2.12 USER MOD Set 8.2: A 38 ASN : amide:sc= 0.808 K(o=2.9,f=0.66) USER MOD Set 9.1: A 1 SER OG : rot -45:sc= 1.16 USER MOD Set 9.2: B 41 SER OG : rot -96:sc= 2.22 USER MOD Single : A 1 SER N :NH3+ -175:sc= -0.355 (180deg=-0.412) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 HIS : no HE2:sc= 0.315 K(o=0.32,f=-3.7!) USER MOD Single : A 16 GLN : amide:sc= 1.07 K(o=1.1,f=-4.3!) USER MOD Single : A 18 SER OG : rot 177:sc= 1.33 USER MOD Single : A 24 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0527) USER MOD Single : A 26 LYS NZ :NH3+ 151:sc= 0.872 (180deg=0.201) USER MOD Single : A 28 LYS NZ :NH3+ -130:sc= 0.0386 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ -149:sc= 0.997 (180deg=0.484) USER MOD Single : A 30 SER OG : rot 166:sc= 1.3 USER MOD Single : A 33 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0149) USER MOD Single : A 37 ASN : amide:sc= 0.235 K(o=0.23,f=-5.2!) USER MOD Single : A 41 SER OG : rot -62:sc= 1.34 USER MOD Single : A 42 HIS : no HE2:sc= 0.896 K(o=0.9,f=-3.4!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= 1.03 K(o=1,f=0) USER MOD Single : A 62 SER OG : rot 160:sc= -0.089 USER MOD Single : A 71 GLN : amide:sc= 0.96 K(o=0.96,f=-0.0089) USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 79 MET CE :methyl 173:sc= -0.276 (180deg=-0.383) USER MOD Single : A 81 THR OG1 : rot 83:sc= 1.2 USER MOD Single : A 82 THR OG1 : rot 80:sc= 1.19 USER MOD Single : A 84 CYS SG : rot 180:sc= 0 USER MOD Single : A 85 HIS : no HD1:sc= -1.65 X(o=-1.6,f=-1.8) USER MOD Single : B 1 SER N :NH3+ -170:sc= 0.827 (180deg=0.518) USER MOD Single : B 1 SER OG : rot 180:sc= 0 USER MOD Single : B 5 LYS NZ :NH3+ -152:sc= 0.855 (180deg=0.302) USER MOD Single : B 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 18 SER OG : rot -77:sc= 0.848 USER MOD Single : B 25 HIS : no HE2:sc= 0.99 K(o=0.99,f=-3.5!) USER MOD Single : B 26 LYS NZ :NH3+ -150:sc= 0.667 (180deg=0.252) USER MOD Single : B 28 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.121) USER MOD Single : B 30 SER OG : rot 164:sc= 1.31 USER MOD Single : B 33 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0271) USER MOD Single : B 37 ASN : amide:sc= 1.76 K(o=1.8,f=-5.3!) USER MOD Single : B 42 HIS : no HE2:sc= 0.959 K(o=0.96,f=-3.6!) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 MET CE :methyl 152:sc= -0.356 (180deg=-2.92) USER MOD Single : B 62 SER OG : rot -148:sc= 0.163 USER MOD Single : B 68 CYS SG : rot -54:sc= -0.368 USER MOD Single : B 71 GLN : amide:sc= 1.06 K(o=1.1,f=0) USER MOD Single : B 74 MET CE :methyl 177:sc= 0 (180deg=-0.0066) USER MOD Single : B 79 MET CE :methyl -177:sc= -0.347 (180deg=-0.348) USER MOD Single : B 81 THR OG1 : rot 87:sc= 1.19 USER MOD Single : B 82 THR OG1 : rot 75:sc= 1.2 USER MOD Single : B 84 CYS SG : rot 157:sc= 0.943 USER MOD Single : D 74 THR OG1 : rot 25:sc= 0.19 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 10.087 2.874 -13.919 1.00 0.00 N ATOM 2 CA SER A 1 9.171 3.707 -13.111 1.00 0.00 C ATOM 3 C SER A 1 7.865 2.988 -12.744 1.00 0.00 C ATOM 4 O SER A 1 6.897 3.631 -12.341 1.00 0.00 O ATOM 5 CB SER A 1 8.847 4.979 -13.888 1.00 0.00 C ATOM 6 OG SER A 1 10.041 5.585 -14.348 1.00 0.00 O ATOM 0 H1 SER A 1 10.983 3.382 -14.062 1.00 0.00 H new ATOM 0 H2 SER A 1 10.272 1.979 -13.422 1.00 0.00 H new ATOM 0 H3 SER A 1 9.651 2.674 -14.842 1.00 0.00 H new ATOM 0 HA SER A 1 9.680 3.934 -12.174 1.00 0.00 H new ATOM 0 HB2 SER A 1 8.200 4.743 -14.733 1.00 0.00 H new ATOM 0 HB3 SER A 1 8.299 5.674 -13.251 1.00 0.00 H new ATOM 0 HG SER A 1 10.700 5.602 -13.622 1.00 0.00 H new ATOM 14 N GLU A 2 7.813 1.666 -12.920 1.00 0.00 N ATOM 15 CA GLU A 2 6.578 0.899 -12.816 1.00 0.00 C ATOM 16 C GLU A 2 5.886 1.068 -11.455 1.00 0.00 C ATOM 17 O GLU A 2 4.661 1.187 -11.405 1.00 0.00 O ATOM 18 CB GLU A 2 6.852 -0.576 -13.149 1.00 0.00 C ATOM 19 CG GLU A 2 5.564 -1.393 -13.351 1.00 0.00 C ATOM 20 CD GLU A 2 4.716 -0.883 -14.514 1.00 0.00 C ATOM 21 OE1 GLU A 2 5.250 -0.876 -15.645 1.00 0.00 O ATOM 22 OE2 GLU A 2 3.557 -0.496 -14.250 1.00 0.00 O ATOM 0 H GLU A 2 8.632 1.099 -13.139 1.00 0.00 H new ATOM 0 HA GLU A 2 5.874 1.295 -13.548 1.00 0.00 H new ATOM 0 HB2 GLU A 2 7.458 -0.633 -14.053 1.00 0.00 H new ATOM 0 HB3 GLU A 2 7.437 -1.022 -12.345 1.00 0.00 H new ATOM 0 HG2 GLU A 2 5.825 -2.436 -13.528 1.00 0.00 H new ATOM 0 HG3 GLU A 2 4.973 -1.363 -12.436 1.00 0.00 H new ATOM 29 N LEU A 3 6.645 1.103 -10.351 1.00 0.00 N ATOM 30 CA LEU A 3 6.033 1.320 -9.045 1.00 0.00 C ATOM 31 C LEU A 3 5.413 2.708 -9.021 1.00 0.00 C ATOM 32 O LEU A 3 4.257 2.851 -8.634 1.00 0.00 O ATOM 33 CB LEU A 3 7.019 1.193 -7.876 1.00 0.00 C ATOM 34 CG LEU A 3 7.619 -0.199 -7.652 1.00 0.00 C ATOM 35 CD1 LEU A 3 8.567 -0.097 -6.452 1.00 0.00 C ATOM 36 CD2 LEU A 3 6.563 -1.274 -7.385 1.00 0.00 C ATOM 0 H LEU A 3 7.658 0.986 -10.340 1.00 0.00 H new ATOM 0 HA LEU A 3 5.284 0.540 -8.910 1.00 0.00 H new ATOM 0 HB2 LEU A 3 7.835 1.897 -8.037 1.00 0.00 H new ATOM 0 HB3 LEU A 3 6.510 1.499 -6.962 1.00 0.00 H new ATOM 0 HG LEU A 3 8.138 -0.504 -8.561 1.00 0.00 H new ATOM 0 HD11 LEU A 3 9.016 -1.071 -6.259 1.00 0.00 H new ATOM 0 HD12 LEU A 3 9.352 0.628 -6.669 1.00 0.00 H new ATOM 0 HD13 LEU A 3 8.008 0.225 -5.573 1.00 0.00 H new ATOM 0 HD21 LEU A 3 7.053 -2.236 -7.235 1.00 0.00 H new ATOM 0 HD22 LEU A 3 5.995 -1.013 -6.492 1.00 0.00 H new ATOM 0 HD23 LEU A 3 5.887 -1.340 -8.238 1.00 0.00 H new ATOM 48 N GLU A 4 6.164 3.729 -9.440 1.00 0.00 N ATOM 49 CA GLU A 4 5.624 5.079 -9.470 1.00 0.00 C ATOM 50 C GLU A 4 4.348 5.130 -10.314 1.00 0.00 C ATOM 51 O GLU A 4 3.379 5.777 -9.924 1.00 0.00 O ATOM 52 CB GLU A 4 6.684 6.084 -9.935 1.00 0.00 C ATOM 53 CG GLU A 4 6.175 7.526 -9.769 1.00 0.00 C ATOM 54 CD GLU A 4 5.423 8.100 -10.973 1.00 0.00 C ATOM 55 OE1 GLU A 4 5.349 7.404 -12.009 1.00 0.00 O ATOM 56 OE2 GLU A 4 4.961 9.254 -10.842 1.00 0.00 O ATOM 0 H GLU A 4 7.130 3.645 -9.757 1.00 0.00 H new ATOM 0 HA GLU A 4 5.346 5.370 -8.457 1.00 0.00 H new ATOM 0 HB2 GLU A 4 7.599 5.947 -9.359 1.00 0.00 H new ATOM 0 HB3 GLU A 4 6.934 5.899 -10.980 1.00 0.00 H new ATOM 0 HG2 GLU A 4 5.518 7.564 -8.900 1.00 0.00 H new ATOM 0 HG3 GLU A 4 7.027 8.171 -9.553 1.00 0.00 H new ATOM 63 N LYS A 5 4.341 4.436 -11.455 1.00 0.00 N ATOM 64 CA LYS A 5 3.218 4.434 -12.378 1.00 0.00 C ATOM 65 C LYS A 5 1.990 3.841 -11.683 1.00 0.00 C ATOM 66 O LYS A 5 0.930 4.466 -11.621 1.00 0.00 O ATOM 67 CB LYS A 5 3.594 3.675 -13.660 1.00 0.00 C ATOM 68 CG LYS A 5 2.478 3.659 -14.717 1.00 0.00 C ATOM 69 CD LYS A 5 1.938 5.046 -15.105 1.00 0.00 C ATOM 70 CE LYS A 5 3.043 5.985 -15.607 1.00 0.00 C ATOM 71 NZ LYS A 5 2.486 7.262 -16.085 1.00 0.00 N ATOM 0 H LYS A 5 5.123 3.857 -11.761 1.00 0.00 H new ATOM 0 HA LYS A 5 2.969 5.453 -12.673 1.00 0.00 H new ATOM 0 HB2 LYS A 5 4.486 4.129 -14.092 1.00 0.00 H new ATOM 0 HB3 LYS A 5 3.852 2.648 -13.401 1.00 0.00 H new ATOM 0 HG2 LYS A 5 2.853 3.167 -15.614 1.00 0.00 H new ATOM 0 HG3 LYS A 5 1.652 3.054 -14.344 1.00 0.00 H new ATOM 0 HD2 LYS A 5 1.180 4.934 -15.881 1.00 0.00 H new ATOM 0 HD3 LYS A 5 1.447 5.496 -14.242 1.00 0.00 H new ATOM 0 HE2 LYS A 5 3.755 6.175 -14.803 1.00 0.00 H new ATOM 0 HE3 LYS A 5 3.595 5.502 -16.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 3.258 7.875 -16.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 1.826 7.081 -16.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 1.981 7.733 -15.308 1.00 0.00 H new ATOM 85 N ALA A 6 2.155 2.634 -11.139 1.00 0.00 N ATOM 86 CA ALA A 6 1.129 1.966 -10.354 1.00 0.00 C ATOM 87 C ALA A 6 0.601 2.903 -9.261 1.00 0.00 C ATOM 88 O ALA A 6 -0.600 3.140 -9.153 1.00 0.00 O ATOM 89 CB ALA A 6 1.734 0.690 -9.768 1.00 0.00 C ATOM 0 H ALA A 6 3.014 2.092 -11.235 1.00 0.00 H new ATOM 0 HA ALA A 6 0.277 1.701 -10.980 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.982 0.170 -9.174 1.00 0.00 H new ATOM 0 HB2 ALA A 6 2.069 0.041 -10.577 1.00 0.00 H new ATOM 0 HB3 ALA A 6 2.583 0.947 -9.134 1.00 0.00 H new ATOM 95 N VAL A 7 1.512 3.464 -8.469 1.00 0.00 N ATOM 96 CA VAL A 7 1.211 4.387 -7.387 1.00 0.00 C ATOM 97 C VAL A 7 0.354 5.561 -7.878 1.00 0.00 C ATOM 98 O VAL A 7 -0.736 5.788 -7.345 1.00 0.00 O ATOM 99 CB VAL A 7 2.539 4.794 -6.726 1.00 0.00 C ATOM 100 CG1 VAL A 7 2.437 6.061 -5.883 1.00 0.00 C ATOM 101 CG2 VAL A 7 3.042 3.645 -5.838 1.00 0.00 C ATOM 0 H VAL A 7 2.510 3.280 -8.569 1.00 0.00 H new ATOM 0 HA VAL A 7 0.595 3.912 -6.623 1.00 0.00 H new ATOM 0 HB VAL A 7 3.237 5.004 -7.537 1.00 0.00 H new ATOM 0 HG11 VAL A 7 3.410 6.288 -5.448 1.00 0.00 H new ATOM 0 HG12 VAL A 7 2.118 6.892 -6.512 1.00 0.00 H new ATOM 0 HG13 VAL A 7 1.709 5.910 -5.086 1.00 0.00 H new ATOM 0 HG21 VAL A 7 3.983 3.933 -5.369 1.00 0.00 H new ATOM 0 HG22 VAL A 7 2.303 3.431 -5.066 1.00 0.00 H new ATOM 0 HG23 VAL A 7 3.198 2.755 -6.448 1.00 0.00 H new ATOM 111 N VAL A 8 0.794 6.300 -8.901 1.00 0.00 N ATOM 112 CA VAL A 8 -0.019 7.402 -9.400 1.00 0.00 C ATOM 113 C VAL A 8 -1.355 6.901 -9.951 1.00 0.00 C ATOM 114 O VAL A 8 -2.343 7.614 -9.819 1.00 0.00 O ATOM 115 CB VAL A 8 0.715 8.346 -10.366 1.00 0.00 C ATOM 116 CG1 VAL A 8 1.922 8.996 -9.682 1.00 0.00 C ATOM 117 CG2 VAL A 8 1.132 7.690 -11.684 1.00 0.00 C ATOM 0 H VAL A 8 1.681 6.159 -9.384 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.235 8.030 -8.536 1.00 0.00 H new ATOM 0 HB VAL A 8 -0.010 9.115 -10.632 1.00 0.00 H new ATOM 0 HG11 VAL A 8 2.425 9.659 -10.385 1.00 0.00 H new ATOM 0 HG12 VAL A 8 1.585 9.570 -8.819 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.615 8.221 -9.354 1.00 0.00 H new ATOM 0 HG21 VAL A 8 1.643 8.422 -12.309 1.00 0.00 H new ATOM 0 HG22 VAL A 8 1.803 6.856 -11.479 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.247 7.324 -12.204 1.00 0.00 H new ATOM 127 N ALA A 9 -1.433 5.688 -10.515 1.00 0.00 N ATOM 128 CA ALA A 9 -2.732 5.121 -10.869 1.00 0.00 C ATOM 129 C ALA A 9 -3.628 4.991 -9.630 1.00 0.00 C ATOM 130 O ALA A 9 -4.780 5.423 -9.663 1.00 0.00 O ATOM 131 CB ALA A 9 -2.599 3.789 -11.610 1.00 0.00 C ATOM 0 H ALA A 9 -0.631 5.096 -10.730 1.00 0.00 H new ATOM 0 HA ALA A 9 -3.211 5.814 -11.560 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -3.591 3.407 -11.852 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -2.034 3.939 -12.530 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -2.078 3.071 -10.977 1.00 0.00 H new ATOM 137 N LEU A 10 -3.104 4.436 -8.526 1.00 0.00 N ATOM 138 CA LEU A 10 -3.876 4.310 -7.288 1.00 0.00 C ATOM 139 C LEU A 10 -4.423 5.680 -6.867 1.00 0.00 C ATOM 140 O LEU A 10 -5.617 5.820 -6.599 1.00 0.00 O ATOM 141 CB LEU A 10 -3.049 3.721 -6.128 1.00 0.00 C ATOM 142 CG LEU A 10 -2.403 2.346 -6.360 1.00 0.00 C ATOM 143 CD1 LEU A 10 -1.668 1.917 -5.087 1.00 0.00 C ATOM 144 CD2 LEU A 10 -3.418 1.265 -6.735 1.00 0.00 C ATOM 0 H LEU A 10 -2.154 4.070 -8.469 1.00 0.00 H new ATOM 0 HA LEU A 10 -4.693 3.620 -7.498 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -2.258 4.430 -5.882 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -3.696 3.648 -5.254 1.00 0.00 H new ATOM 0 HG LEU A 10 -1.715 2.451 -7.199 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -1.207 0.942 -5.244 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -0.896 2.649 -4.848 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -2.377 1.854 -4.261 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -2.901 0.317 -6.886 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -4.148 1.157 -5.932 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -3.930 1.550 -7.654 1.00 0.00 H new ATOM 156 N ILE A 11 -3.554 6.694 -6.810 1.00 0.00 N ATOM 157 CA ILE A 11 -3.952 8.048 -6.427 1.00 0.00 C ATOM 158 C ILE A 11 -4.993 8.603 -7.406 1.00 0.00 C ATOM 159 O ILE A 11 -6.047 9.093 -6.994 1.00 0.00 O ATOM 160 CB ILE A 11 -2.718 8.966 -6.321 1.00 0.00 C ATOM 161 CG1 ILE A 11 -1.753 8.408 -5.259 1.00 0.00 C ATOM 162 CG2 ILE A 11 -3.142 10.399 -5.957 1.00 0.00 C ATOM 163 CD1 ILE A 11 -0.458 9.212 -5.142 1.00 0.00 C ATOM 0 H ILE A 11 -2.562 6.599 -7.027 1.00 0.00 H new ATOM 0 HA ILE A 11 -4.418 8.011 -5.442 1.00 0.00 H new ATOM 0 HB ILE A 11 -2.212 8.996 -7.286 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -2.255 8.396 -4.291 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -1.511 7.374 -5.505 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -2.258 11.033 -5.886 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -3.807 10.788 -6.728 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -3.661 10.392 -4.999 1.00 0.00 H new ATOM 0 HD11 ILE A 11 0.178 8.767 -4.377 1.00 0.00 H new ATOM 0 HD12 ILE A 11 0.064 9.202 -6.099 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -0.692 10.240 -4.867 1.00 0.00 H new ATOM 175 N ASP A 12 -4.698 8.537 -8.705 1.00 0.00 N ATOM 176 CA ASP A 12 -5.544 9.060 -9.768 1.00 0.00 C ATOM 177 C ASP A 12 -6.961 8.509 -9.640 1.00 0.00 C ATOM 178 O ASP A 12 -7.932 9.267 -9.633 1.00 0.00 O ATOM 179 CB ASP A 12 -4.956 8.718 -11.141 1.00 0.00 C ATOM 180 CG ASP A 12 -5.864 9.228 -12.253 1.00 0.00 C ATOM 181 OD1 ASP A 12 -5.763 10.436 -12.557 1.00 0.00 O ATOM 182 OD2 ASP A 12 -6.663 8.410 -12.758 1.00 0.00 O ATOM 0 H ASP A 12 -3.841 8.106 -9.051 1.00 0.00 H new ATOM 0 HA ASP A 12 -5.586 10.145 -9.674 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -3.966 9.162 -11.240 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -4.832 7.639 -11.231 1.00 0.00 H new ATOM 187 N VAL A 13 -7.067 7.188 -9.523 1.00 0.00 N ATOM 188 CA VAL A 13 -8.335 6.500 -9.385 1.00 0.00 C ATOM 189 C VAL A 13 -8.993 6.886 -8.058 1.00 0.00 C ATOM 190 O VAL A 13 -10.137 7.334 -8.031 1.00 0.00 O ATOM 191 CB VAL A 13 -8.081 4.991 -9.516 1.00 0.00 C ATOM 192 CG1 VAL A 13 -9.336 4.171 -9.200 1.00 0.00 C ATOM 193 CG2 VAL A 13 -7.626 4.652 -10.941 1.00 0.00 C ATOM 0 H VAL A 13 -6.261 6.563 -9.522 1.00 0.00 H new ATOM 0 HA VAL A 13 -9.033 6.792 -10.170 1.00 0.00 H new ATOM 0 HB VAL A 13 -7.304 4.735 -8.796 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -9.113 3.109 -9.305 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -9.657 4.376 -8.178 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -10.133 4.444 -9.892 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -7.449 3.579 -11.021 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -8.400 4.946 -11.650 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -6.705 5.189 -11.166 1.00 0.00 H new ATOM 203 N PHE A 14 -8.286 6.717 -6.941 1.00 0.00 N ATOM 204 CA PHE A 14 -8.875 6.951 -5.632 1.00 0.00 C ATOM 205 C PHE A 14 -9.438 8.368 -5.503 1.00 0.00 C ATOM 206 O PHE A 14 -10.596 8.547 -5.119 1.00 0.00 O ATOM 207 CB PHE A 14 -7.827 6.708 -4.544 1.00 0.00 C ATOM 208 CG PHE A 14 -8.333 7.021 -3.152 1.00 0.00 C ATOM 209 CD1 PHE A 14 -8.972 6.025 -2.394 1.00 0.00 C ATOM 210 CD2 PHE A 14 -8.268 8.337 -2.656 1.00 0.00 C ATOM 211 CE1 PHE A 14 -9.469 6.325 -1.115 1.00 0.00 C ATOM 212 CE2 PHE A 14 -8.755 8.633 -1.376 1.00 0.00 C ATOM 213 CZ PHE A 14 -9.351 7.625 -0.602 1.00 0.00 C ATOM 0 H PHE A 14 -7.310 6.420 -6.920 1.00 0.00 H new ATOM 0 HA PHE A 14 -9.705 6.254 -5.512 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -7.507 5.667 -4.582 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -6.949 7.319 -4.751 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -9.081 5.028 -2.795 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -7.841 9.121 -3.264 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -9.943 5.554 -0.526 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -8.672 9.636 -0.985 1.00 0.00 H new ATOM 0 HZ PHE A 14 -9.719 7.850 0.388 1.00 0.00 H new ATOM 223 N HIS A 15 -8.612 9.379 -5.795 1.00 0.00 N ATOM 224 CA HIS A 15 -8.981 10.749 -5.480 1.00 0.00 C ATOM 225 C HIS A 15 -10.182 11.215 -6.301 1.00 0.00 C ATOM 226 O HIS A 15 -11.057 11.885 -5.760 1.00 0.00 O ATOM 227 CB HIS A 15 -7.785 11.708 -5.544 1.00 0.00 C ATOM 228 CG HIS A 15 -7.498 12.248 -6.916 1.00 0.00 C ATOM 229 ND1 HIS A 15 -7.143 11.496 -8.008 1.00 0.00 N ATOM 230 CD2 HIS A 15 -7.756 13.520 -7.354 1.00 0.00 C ATOM 231 CE1 HIS A 15 -7.196 12.298 -9.086 1.00 0.00 C ATOM 232 NE2 HIS A 15 -7.556 13.543 -8.736 1.00 0.00 N ATOM 0 H HIS A 15 -7.701 9.271 -6.241 1.00 0.00 H new ATOM 0 HA HIS A 15 -9.304 10.765 -4.439 1.00 0.00 H new ATOM 0 HB2 HIS A 15 -7.968 12.544 -4.868 1.00 0.00 H new ATOM 0 HB3 HIS A 15 -6.899 11.190 -5.178 1.00 0.00 H new ATOM 0 HD1 HIS A 15 -6.886 10.509 -8.003 1.00 0.00 H new ATOM 0 HD2 HIS A 15 -8.060 14.355 -6.741 1.00 0.00 H new ATOM 0 HE1 HIS A 15 -6.979 11.983 -10.096 1.00 0.00 H new ATOM 240 N GLN A 16 -10.256 10.862 -7.591 1.00 0.00 N ATOM 241 CA GLN A 16 -11.390 11.291 -8.397 1.00 0.00 C ATOM 242 C GLN A 16 -12.679 10.678 -7.842 1.00 0.00 C ATOM 243 O GLN A 16 -13.630 11.412 -7.578 1.00 0.00 O ATOM 244 CB GLN A 16 -11.160 11.038 -9.894 1.00 0.00 C ATOM 245 CG GLN A 16 -11.233 9.561 -10.276 1.00 0.00 C ATOM 246 CD GLN A 16 -10.830 9.323 -11.719 1.00 0.00 C ATOM 247 OE1 GLN A 16 -11.683 9.124 -12.582 1.00 0.00 O ATOM 248 NE2 GLN A 16 -9.527 9.322 -11.976 1.00 0.00 N ATOM 0 H GLN A 16 -9.563 10.297 -8.081 1.00 0.00 H new ATOM 0 HA GLN A 16 -11.499 12.373 -8.323 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -11.904 11.591 -10.467 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -10.183 11.431 -10.176 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -10.582 8.985 -9.619 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -12.248 9.196 -10.119 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -8.859 9.493 -11.224 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -9.194 9.151 -12.925 1.00 0.00 H new ATOM 257 N TYR A 17 -12.687 9.362 -7.580 1.00 0.00 N ATOM 258 CA TYR A 17 -13.842 8.680 -6.998 1.00 0.00 C ATOM 259 C TYR A 17 -14.221 9.375 -5.685 1.00 0.00 C ATOM 260 O TYR A 17 -15.350 9.832 -5.508 1.00 0.00 O ATOM 261 CB TYR A 17 -13.538 7.187 -6.793 1.00 0.00 C ATOM 262 CG TYR A 17 -13.812 6.283 -7.988 1.00 0.00 C ATOM 263 CD1 TYR A 17 -12.955 6.283 -9.105 1.00 0.00 C ATOM 264 CD2 TYR A 17 -14.901 5.390 -7.959 1.00 0.00 C ATOM 265 CE1 TYR A 17 -13.118 5.334 -10.131 1.00 0.00 C ATOM 266 CE2 TYR A 17 -15.098 4.483 -9.016 1.00 0.00 C ATOM 267 CZ TYR A 17 -14.181 4.420 -10.074 1.00 0.00 C ATOM 268 OH TYR A 17 -14.348 3.477 -11.045 1.00 0.00 O ATOM 0 H TYR A 17 -11.895 8.747 -7.766 1.00 0.00 H new ATOM 0 HA TYR A 17 -14.692 8.739 -7.677 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -12.489 7.084 -6.517 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -14.126 6.829 -5.948 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -12.166 7.017 -9.175 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -15.586 5.402 -7.124 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -12.427 5.309 -10.960 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -15.960 3.832 -9.012 1.00 0.00 H new ATOM 0 HH TYR A 17 -13.473 3.211 -11.397 1.00 0.00 H new ATOM 278 N SER A 18 -13.242 9.527 -4.793 1.00 0.00 N ATOM 279 CA SER A 18 -13.384 10.243 -3.529 1.00 0.00 C ATOM 280 C SER A 18 -13.855 11.689 -3.716 1.00 0.00 C ATOM 281 O SER A 18 -14.424 12.279 -2.800 1.00 0.00 O ATOM 282 CB SER A 18 -12.043 10.207 -2.803 1.00 0.00 C ATOM 283 OG SER A 18 -11.647 8.874 -2.584 1.00 0.00 O ATOM 0 H SER A 18 -12.307 9.146 -4.935 1.00 0.00 H new ATOM 0 HA SER A 18 -14.155 9.748 -2.939 1.00 0.00 H new ATOM 0 HB2 SER A 18 -11.288 10.727 -3.392 1.00 0.00 H new ATOM 0 HB3 SER A 18 -12.122 10.732 -1.851 1.00 0.00 H new ATOM 0 HG SER A 18 -10.761 8.861 -2.166 1.00 0.00 H new ATOM 289 N GLY A 19 -13.584 12.292 -4.872 1.00 0.00 N ATOM 290 CA GLY A 19 -14.057 13.615 -5.221 1.00 0.00 C ATOM 291 C GLY A 19 -15.538 13.574 -5.577 1.00 0.00 C ATOM 292 O GLY A 19 -16.289 14.444 -5.145 1.00 0.00 O ATOM 0 H GLY A 19 -13.018 11.859 -5.602 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -13.896 14.297 -4.386 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -13.485 14.002 -6.064 1.00 0.00 H new ATOM 296 N ARG A 20 -15.958 12.582 -6.372 1.00 0.00 N ATOM 297 CA ARG A 20 -17.332 12.519 -6.863 1.00 0.00 C ATOM 298 C ARG A 20 -18.327 12.488 -5.701 1.00 0.00 C ATOM 299 O ARG A 20 -19.254 13.293 -5.673 1.00 0.00 O ATOM 300 CB ARG A 20 -17.566 11.349 -7.829 1.00 0.00 C ATOM 301 CG ARG A 20 -16.429 11.161 -8.838 1.00 0.00 C ATOM 302 CD ARG A 20 -16.904 10.502 -10.137 1.00 0.00 C ATOM 303 NE ARG A 20 -15.768 9.934 -10.885 1.00 0.00 N ATOM 304 CZ ARG A 20 -15.329 8.668 -10.791 1.00 0.00 C ATOM 305 NH1 ARG A 20 -15.905 7.811 -9.941 1.00 0.00 N ATOM 306 NH2 ARG A 20 -14.307 8.253 -11.548 1.00 0.00 N ATOM 0 H ARG A 20 -15.364 11.815 -6.686 1.00 0.00 H new ATOM 0 HA ARG A 20 -17.502 13.430 -7.437 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -17.688 10.431 -7.254 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -18.498 11.513 -8.369 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -15.986 12.130 -9.066 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -15.646 10.550 -8.389 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -17.624 9.716 -9.909 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -17.420 11.237 -10.755 1.00 0.00 H new ATOM 0 HE ARG A 20 -15.274 10.554 -11.527 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -16.684 8.117 -9.358 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -15.565 6.851 -9.876 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -13.859 8.898 -12.199 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -13.976 7.291 -11.475 1.00 0.00 H new ATOM 320 N GLU A 21 -18.133 11.572 -4.741 1.00 0.00 N ATOM 321 CA GLU A 21 -18.885 11.593 -3.490 1.00 0.00 C ATOM 322 C GLU A 21 -17.953 11.237 -2.329 1.00 0.00 C ATOM 323 O GLU A 21 -17.614 10.072 -2.121 1.00 0.00 O ATOM 324 CB GLU A 21 -20.109 10.664 -3.537 1.00 0.00 C ATOM 325 CG GLU A 21 -21.078 10.971 -4.689 1.00 0.00 C ATOM 326 CD GLU A 21 -22.330 10.097 -4.647 1.00 0.00 C ATOM 327 OE1 GLU A 21 -22.290 9.060 -3.947 1.00 0.00 O ATOM 328 OE2 GLU A 21 -23.313 10.485 -5.314 1.00 0.00 O ATOM 0 H GLU A 21 -17.460 10.809 -4.813 1.00 0.00 H new ATOM 0 HA GLU A 21 -19.273 12.600 -3.337 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -19.767 9.633 -3.627 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -20.647 10.740 -2.592 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -21.369 12.020 -4.645 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -20.566 10.822 -5.640 1.00 0.00 H new ATOM 335 N GLY A 22 -17.563 12.243 -1.552 1.00 0.00 N ATOM 336 CA GLY A 22 -16.589 12.114 -0.488 1.00 0.00 C ATOM 337 C GLY A 22 -15.931 13.475 -0.333 1.00 0.00 C ATOM 338 O GLY A 22 -16.602 14.490 -0.522 1.00 0.00 O ATOM 0 H GLY A 22 -17.928 13.190 -1.652 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -17.069 11.808 0.441 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -15.849 11.351 -0.731 1.00 0.00 H new ATOM 342 N ASP A 23 -14.635 13.508 -0.021 1.00 0.00 N ATOM 343 CA ASP A 23 -13.878 14.746 0.139 1.00 0.00 C ATOM 344 C ASP A 23 -12.493 14.638 -0.502 1.00 0.00 C ATOM 345 O ASP A 23 -11.537 15.211 0.016 1.00 0.00 O ATOM 346 CB ASP A 23 -13.791 15.106 1.632 1.00 0.00 C ATOM 347 CG ASP A 23 -12.953 14.131 2.461 1.00 0.00 C ATOM 348 OD1 ASP A 23 -12.495 13.118 1.888 1.00 0.00 O ATOM 349 OD2 ASP A 23 -12.783 14.412 3.667 1.00 0.00 O ATOM 0 H ASP A 23 -14.078 12.667 0.129 1.00 0.00 H new ATOM 0 HA ASP A 23 -14.399 15.550 -0.380 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -13.368 16.106 1.730 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -14.799 15.144 2.045 1.00 0.00 H new ATOM 354 N LYS A 24 -12.364 13.864 -1.586 1.00 0.00 N ATOM 355 CA LYS A 24 -11.102 13.572 -2.277 1.00 0.00 C ATOM 356 C LYS A 24 -10.149 12.684 -1.462 1.00 0.00 C ATOM 357 O LYS A 24 -9.528 11.786 -2.023 1.00 0.00 O ATOM 358 CB LYS A 24 -10.405 14.835 -2.801 1.00 0.00 C ATOM 359 CG LYS A 24 -11.277 15.553 -3.837 1.00 0.00 C ATOM 360 CD LYS A 24 -10.541 16.775 -4.400 1.00 0.00 C ATOM 361 CE LYS A 24 -11.316 17.412 -5.561 1.00 0.00 C ATOM 362 NZ LYS A 24 -12.646 17.891 -5.144 1.00 0.00 N ATOM 0 H LYS A 24 -13.165 13.407 -2.022 1.00 0.00 H new ATOM 0 HA LYS A 24 -11.386 12.985 -3.150 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -10.192 15.508 -1.971 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -9.448 14.567 -3.249 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -11.530 14.868 -4.646 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -12.215 15.865 -3.378 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -10.398 17.511 -3.609 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -9.550 16.478 -4.742 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -10.742 18.245 -5.966 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -11.429 16.683 -6.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -13.100 18.389 -5.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -13.234 17.081 -4.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -12.544 18.542 -4.339 1.00 0.00 H new ATOM 376 N HIS A 25 -10.040 12.900 -0.150 1.00 0.00 N ATOM 377 CA HIS A 25 -9.248 12.074 0.747 1.00 0.00 C ATOM 378 C HIS A 25 -9.973 10.799 1.180 1.00 0.00 C ATOM 379 O HIS A 25 -9.303 9.902 1.694 1.00 0.00 O ATOM 380 CB HIS A 25 -8.826 12.903 1.962 1.00 0.00 C ATOM 381 CG HIS A 25 -7.833 13.981 1.613 1.00 0.00 C ATOM 382 ND1 HIS A 25 -6.576 13.775 1.092 1.00 0.00 N ATOM 383 CD2 HIS A 25 -7.995 15.330 1.787 1.00 0.00 C ATOM 384 CE1 HIS A 25 -5.988 14.978 0.979 1.00 0.00 C ATOM 385 NE2 HIS A 25 -6.816 15.957 1.374 1.00 0.00 N ATOM 0 H HIS A 25 -10.511 13.671 0.323 1.00 0.00 H new ATOM 0 HA HIS A 25 -8.364 11.746 0.200 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -9.709 13.359 2.410 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -8.392 12.244 2.714 1.00 0.00 H new ATOM 0 HD1 HIS A 25 -6.167 12.876 0.839 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -8.876 15.821 2.174 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -4.982 15.136 0.618 1.00 0.00 H new ATOM 393 N LYS A 26 -11.303 10.718 1.011 1.00 0.00 N ATOM 394 CA LYS A 26 -12.129 9.626 1.514 1.00 0.00 C ATOM 395 C LYS A 26 -13.188 9.198 0.497 1.00 0.00 C ATOM 396 O LYS A 26 -13.788 10.052 -0.153 1.00 0.00 O ATOM 397 CB LYS A 26 -12.826 10.032 2.823 1.00 0.00 C ATOM 398 CG LYS A 26 -11.900 10.619 3.894 1.00 0.00 C ATOM 399 CD LYS A 26 -12.718 11.015 5.131 1.00 0.00 C ATOM 400 CE LYS A 26 -11.863 11.721 6.190 1.00 0.00 C ATOM 401 NZ LYS A 26 -11.276 12.975 5.686 1.00 0.00 N ATOM 0 H LYS A 26 -11.838 11.428 0.510 1.00 0.00 H new ATOM 0 HA LYS A 26 -11.462 8.783 1.696 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -13.601 10.764 2.593 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -13.327 9.157 3.237 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -11.139 9.889 4.169 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -11.378 11.490 3.498 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -13.535 11.671 4.830 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -13.169 10.124 5.566 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -12.476 11.935 7.066 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -11.065 11.053 6.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -11.143 13.638 6.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -10.356 12.775 5.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -11.914 13.398 4.982 1.00 0.00 H new ATOM 415 N LEU A 27 -13.438 7.885 0.408 1.00 0.00 N ATOM 416 CA LEU A 27 -14.472 7.293 -0.440 1.00 0.00 C ATOM 417 C LEU A 27 -15.734 7.030 0.378 1.00 0.00 C ATOM 418 O LEU A 27 -15.628 6.408 1.435 1.00 0.00 O ATOM 419 CB LEU A 27 -14.014 5.914 -0.947 1.00 0.00 C ATOM 420 CG LEU A 27 -12.873 5.918 -1.968 1.00 0.00 C ATOM 421 CD1 LEU A 27 -12.358 4.486 -2.122 1.00 0.00 C ATOM 422 CD2 LEU A 27 -13.335 6.386 -3.349 1.00 0.00 C ATOM 0 H LEU A 27 -12.912 7.191 0.938 1.00 0.00 H new ATOM 0 HA LEU A 27 -14.658 7.986 -1.261 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.704 5.318 -0.088 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -14.872 5.410 -1.392 1.00 0.00 H new ATOM 0 HG LEU A 27 -12.106 6.601 -1.604 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -11.544 4.468 -2.846 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -11.996 4.124 -1.160 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -13.167 3.844 -2.470 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -12.491 6.372 -4.039 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -14.116 5.720 -3.717 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -13.728 7.400 -3.277 1.00 0.00 H new ATOM 434 N LYS A 28 -16.911 7.452 -0.104 1.00 0.00 N ATOM 435 CA LYS A 28 -18.193 7.043 0.475 1.00 0.00 C ATOM 436 C LYS A 28 -18.435 5.567 0.145 1.00 0.00 C ATOM 437 O LYS A 28 -17.746 5.009 -0.705 1.00 0.00 O ATOM 438 CB LYS A 28 -19.325 7.870 -0.145 1.00 0.00 C ATOM 439 CG LYS A 28 -19.311 9.327 0.313 1.00 0.00 C ATOM 440 CD LYS A 28 -20.097 9.539 1.614 1.00 0.00 C ATOM 441 CE LYS A 28 -20.071 11.023 1.994 1.00 0.00 C ATOM 442 NZ LYS A 28 -20.676 11.256 3.318 1.00 0.00 N ATOM 0 H LYS A 28 -16.999 8.082 -0.901 1.00 0.00 H new ATOM 0 HA LYS A 28 -18.170 7.197 1.554 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -19.242 7.834 -1.231 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -20.283 7.421 0.117 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -18.280 9.650 0.458 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -19.734 9.955 -0.471 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -21.126 9.204 1.488 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -19.663 8.940 2.415 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -19.041 11.380 1.996 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -20.607 11.601 1.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -21.376 12.023 3.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -21.145 10.387 3.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -19.934 11.523 3.996 1.00 0.00 H new ATOM 456 N LYS A 29 -19.437 4.933 0.762 1.00 0.00 N ATOM 457 CA LYS A 29 -19.834 3.573 0.406 1.00 0.00 C ATOM 458 C LYS A 29 -20.265 3.464 -1.052 1.00 0.00 C ATOM 459 O LYS A 29 -19.989 2.453 -1.690 1.00 0.00 O ATOM 460 CB LYS A 29 -20.873 2.987 1.380 1.00 0.00 C ATOM 461 CG LYS A 29 -22.289 3.591 1.351 1.00 0.00 C ATOM 462 CD LYS A 29 -22.419 5.060 1.788 1.00 0.00 C ATOM 463 CE LYS A 29 -21.888 5.349 3.200 1.00 0.00 C ATOM 464 NZ LYS A 29 -22.619 4.591 4.231 1.00 0.00 N ATOM 0 H LYS A 29 -19.989 5.345 1.514 1.00 0.00 H new ATOM 0 HA LYS A 29 -18.945 2.952 0.510 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -20.958 1.919 1.180 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -20.483 3.091 2.392 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -22.677 3.502 0.336 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -22.931 2.987 1.992 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -21.883 5.687 1.076 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -23.469 5.349 1.741 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -20.829 5.097 3.248 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -21.971 6.416 3.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -22.639 5.138 5.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -23.593 4.418 3.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -22.142 3.682 4.397 1.00 0.00 H new ATOM 478 N SER A 30 -20.909 4.499 -1.595 1.00 0.00 N ATOM 479 CA SER A 30 -21.265 4.531 -3.001 1.00 0.00 C ATOM 480 C SER A 30 -19.998 4.440 -3.850 1.00 0.00 C ATOM 481 O SER A 30 -19.879 3.564 -4.708 1.00 0.00 O ATOM 482 CB SER A 30 -22.003 5.846 -3.266 1.00 0.00 C ATOM 483 OG SER A 30 -21.345 6.897 -2.578 1.00 0.00 O ATOM 0 H SER A 30 -21.193 5.328 -1.072 1.00 0.00 H new ATOM 0 HA SER A 30 -21.907 3.689 -3.261 1.00 0.00 H new ATOM 0 HB2 SER A 30 -22.027 6.054 -4.336 1.00 0.00 H new ATOM 0 HB3 SER A 30 -23.038 5.769 -2.933 1.00 0.00 H new ATOM 0 HG SER A 30 -21.669 7.760 -2.911 1.00 0.00 H new ATOM 489 N GLU A 31 -19.029 5.319 -3.576 1.00 0.00 N ATOM 490 CA GLU A 31 -17.798 5.360 -4.347 1.00 0.00 C ATOM 491 C GLU A 31 -17.028 4.064 -4.170 1.00 0.00 C ATOM 492 O GLU A 31 -16.617 3.472 -5.157 1.00 0.00 O ATOM 493 CB GLU A 31 -16.943 6.572 -3.971 1.00 0.00 C ATOM 494 CG GLU A 31 -17.664 7.877 -4.310 1.00 0.00 C ATOM 495 CD GLU A 31 -17.987 8.027 -5.796 1.00 0.00 C ATOM 496 OE1 GLU A 31 -17.108 7.684 -6.618 1.00 0.00 O ATOM 497 OE2 GLU A 31 -19.116 8.477 -6.085 1.00 0.00 O ATOM 0 H GLU A 31 -19.080 6.008 -2.826 1.00 0.00 H new ATOM 0 HA GLU A 31 -18.056 5.466 -5.401 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -16.715 6.544 -2.905 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -15.992 6.529 -4.502 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -18.590 7.930 -3.738 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -17.046 8.717 -3.994 1.00 0.00 H new ATOM 504 N LEU A 32 -16.850 3.613 -2.928 1.00 0.00 N ATOM 505 CA LEU A 32 -16.166 2.369 -2.614 1.00 0.00 C ATOM 506 C LEU A 32 -16.842 1.215 -3.364 1.00 0.00 C ATOM 507 O LEU A 32 -16.164 0.423 -4.009 1.00 0.00 O ATOM 508 CB LEU A 32 -16.085 2.195 -1.084 1.00 0.00 C ATOM 509 CG LEU A 32 -15.197 1.050 -0.550 1.00 0.00 C ATOM 510 CD1 LEU A 32 -15.949 -0.283 -0.508 1.00 0.00 C ATOM 511 CD2 LEU A 32 -13.858 0.908 -1.282 1.00 0.00 C ATOM 0 H LEU A 32 -17.184 4.112 -2.104 1.00 0.00 H new ATOM 0 HA LEU A 32 -15.132 2.381 -2.960 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -15.724 3.130 -0.656 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -17.096 2.042 -0.707 1.00 0.00 H new ATOM 0 HG LEU A 32 -14.950 1.335 0.473 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.288 -1.062 -0.126 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -16.817 -0.191 0.145 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -16.278 -0.547 -1.513 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -13.292 0.083 -0.849 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -14.040 0.708 -2.338 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -13.288 1.832 -1.180 1.00 0.00 H new ATOM 523 N LYS A 33 -18.176 1.148 -3.372 1.00 0.00 N ATOM 524 CA LYS A 33 -18.887 0.143 -4.147 1.00 0.00 C ATOM 525 C LYS A 33 -18.490 0.208 -5.629 1.00 0.00 C ATOM 526 O LYS A 33 -18.015 -0.791 -6.178 1.00 0.00 O ATOM 527 CB LYS A 33 -20.401 0.280 -3.915 1.00 0.00 C ATOM 528 CG LYS A 33 -21.221 -0.603 -4.868 1.00 0.00 C ATOM 529 CD LYS A 33 -22.699 -0.610 -4.460 1.00 0.00 C ATOM 530 CE LYS A 33 -23.527 -1.585 -5.307 1.00 0.00 C ATOM 531 NZ LYS A 33 -23.520 -1.234 -6.738 1.00 0.00 N ATOM 0 H LYS A 33 -18.781 1.781 -2.848 1.00 0.00 H new ATOM 0 HA LYS A 33 -18.600 -0.852 -3.806 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -20.634 0.012 -2.885 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -20.693 1.322 -4.047 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -21.122 -0.235 -5.889 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -20.830 -1.620 -4.856 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -22.783 -0.883 -3.408 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -23.108 0.395 -4.562 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -23.135 -2.594 -5.182 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -24.555 -1.595 -4.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -24.147 -1.881 -7.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -23.855 -0.257 -6.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -22.553 -1.316 -7.111 1.00 0.00 H new ATOM 545 N GLU A 34 -18.695 1.343 -6.312 1.00 0.00 N ATOM 546 CA GLU A 34 -18.408 1.379 -7.747 1.00 0.00 C ATOM 547 C GLU A 34 -16.916 1.151 -8.021 1.00 0.00 C ATOM 548 O GLU A 34 -16.564 0.436 -8.952 1.00 0.00 O ATOM 549 CB GLU A 34 -18.978 2.619 -8.453 1.00 0.00 C ATOM 550 CG GLU A 34 -18.643 3.967 -7.806 1.00 0.00 C ATOM 551 CD GLU A 34 -18.911 5.126 -8.760 1.00 0.00 C ATOM 552 OE1 GLU A 34 -20.068 5.222 -9.224 1.00 0.00 O ATOM 553 OE2 GLU A 34 -17.957 5.888 -9.018 1.00 0.00 O ATOM 0 H GLU A 34 -19.044 2.214 -5.912 1.00 0.00 H new ATOM 0 HA GLU A 34 -18.943 0.543 -8.198 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -18.613 2.629 -9.480 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -20.062 2.520 -8.501 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -19.236 4.095 -6.901 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -17.596 3.977 -7.505 1.00 0.00 H new ATOM 560 N LEU A 35 -16.046 1.716 -7.188 1.00 0.00 N ATOM 561 CA LEU A 35 -14.602 1.529 -7.205 1.00 0.00 C ATOM 562 C LEU A 35 -14.277 0.034 -7.207 1.00 0.00 C ATOM 563 O LEU A 35 -13.580 -0.438 -8.103 1.00 0.00 O ATOM 564 CB LEU A 35 -14.041 2.279 -5.982 1.00 0.00 C ATOM 565 CG LEU A 35 -12.539 2.242 -5.668 1.00 0.00 C ATOM 566 CD1 LEU A 35 -12.032 0.849 -5.277 1.00 0.00 C ATOM 567 CD2 LEU A 35 -11.706 2.864 -6.787 1.00 0.00 C ATOM 0 H LEU A 35 -16.347 2.348 -6.446 1.00 0.00 H new ATOM 0 HA LEU A 35 -14.138 1.934 -8.104 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -14.321 3.327 -6.090 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -14.563 1.899 -5.104 1.00 0.00 H new ATOM 0 HG LEU A 35 -12.406 2.862 -4.782 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -10.963 0.896 -5.069 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -12.560 0.506 -4.387 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -12.212 0.153 -6.097 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -10.649 2.817 -6.523 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -11.874 2.315 -7.714 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.000 3.905 -6.924 1.00 0.00 H new ATOM 579 N ILE A 36 -14.803 -0.724 -6.238 1.00 0.00 N ATOM 580 CA ILE A 36 -14.546 -2.157 -6.151 1.00 0.00 C ATOM 581 C ILE A 36 -15.009 -2.836 -7.445 1.00 0.00 C ATOM 582 O ILE A 36 -14.215 -3.507 -8.102 1.00 0.00 O ATOM 583 CB ILE A 36 -15.210 -2.759 -4.895 1.00 0.00 C ATOM 584 CG1 ILE A 36 -14.611 -2.218 -3.581 1.00 0.00 C ATOM 585 CG2 ILE A 36 -15.150 -4.291 -4.902 1.00 0.00 C ATOM 586 CD1 ILE A 36 -13.249 -2.768 -3.157 1.00 0.00 C ATOM 0 H ILE A 36 -15.411 -0.363 -5.503 1.00 0.00 H new ATOM 0 HA ILE A 36 -13.476 -2.333 -6.045 1.00 0.00 H new ATOM 0 HB ILE A 36 -16.253 -2.445 -4.936 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -14.526 -1.135 -3.669 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -15.321 -2.418 -2.778 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -15.628 -4.678 -4.002 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -15.670 -4.671 -5.781 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -14.109 -4.614 -4.928 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -12.946 -2.304 -2.218 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -13.318 -3.847 -3.023 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -12.511 -2.545 -3.927 1.00 0.00 H new ATOM 598 N ASN A 37 -16.281 -2.646 -7.821 1.00 0.00 N ATOM 599 CA ASN A 37 -16.838 -3.265 -9.028 1.00 0.00 C ATOM 600 C ASN A 37 -15.956 -2.998 -10.247 1.00 0.00 C ATOM 601 O ASN A 37 -15.543 -3.915 -10.954 1.00 0.00 O ATOM 602 CB ASN A 37 -18.235 -2.713 -9.348 1.00 0.00 C ATOM 603 CG ASN A 37 -19.332 -3.225 -8.430 1.00 0.00 C ATOM 604 OD1 ASN A 37 -19.818 -4.340 -8.580 1.00 0.00 O ATOM 605 ND2 ASN A 37 -19.771 -2.405 -7.484 1.00 0.00 N ATOM 0 H ASN A 37 -16.943 -2.067 -7.305 1.00 0.00 H new ATOM 0 HA ASN A 37 -16.891 -4.334 -8.823 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -18.206 -1.625 -9.289 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -18.488 -2.970 -10.377 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -20.527 -2.699 -6.865 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -19.353 -1.481 -7.376 1.00 0.00 H new ATOM 612 N ASN A 38 -15.713 -1.715 -10.507 1.00 0.00 N ATOM 613 CA ASN A 38 -15.091 -1.228 -11.721 1.00 0.00 C ATOM 614 C ASN A 38 -13.619 -1.605 -11.777 1.00 0.00 C ATOM 615 O ASN A 38 -13.116 -1.970 -12.837 1.00 0.00 O ATOM 616 CB ASN A 38 -15.196 0.304 -11.768 1.00 0.00 C ATOM 617 CG ASN A 38 -16.618 0.849 -11.887 1.00 0.00 C ATOM 618 OD1 ASN A 38 -17.574 0.112 -12.102 1.00 0.00 O ATOM 619 ND2 ASN A 38 -16.766 2.164 -11.752 1.00 0.00 N ATOM 0 H ASN A 38 -15.953 -0.969 -9.854 1.00 0.00 H new ATOM 0 HA ASN A 38 -15.607 -1.681 -12.567 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -14.741 0.712 -10.866 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -14.611 0.668 -12.613 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -17.693 2.583 -11.827 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -15.953 2.753 -11.574 1.00 0.00 H new ATOM 626 N GLU A 39 -12.918 -1.460 -10.648 1.00 0.00 N ATOM 627 CA GLU A 39 -11.470 -1.545 -10.618 1.00 0.00 C ATOM 628 C GLU A 39 -10.881 -2.836 -10.046 1.00 0.00 C ATOM 629 O GLU A 39 -9.704 -3.088 -10.307 1.00 0.00 O ATOM 630 CB GLU A 39 -10.910 -0.320 -9.895 1.00 0.00 C ATOM 631 CG GLU A 39 -11.524 1.031 -10.310 1.00 0.00 C ATOM 632 CD GLU A 39 -11.435 1.362 -11.798 1.00 0.00 C ATOM 633 OE1 GLU A 39 -10.543 0.801 -12.471 1.00 0.00 O ATOM 634 OE2 GLU A 39 -12.253 2.207 -12.225 1.00 0.00 O ATOM 0 H GLU A 39 -13.344 -1.282 -9.738 1.00 0.00 H new ATOM 0 HA GLU A 39 -11.158 -1.565 -11.662 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -11.058 -0.453 -8.823 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -9.834 -0.279 -10.066 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -12.573 1.040 -10.015 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -11.029 1.823 -9.749 1.00 0.00 H new ATOM 641 N LEU A 40 -11.633 -3.619 -9.260 1.00 0.00 N ATOM 642 CA LEU A 40 -11.123 -4.813 -8.573 1.00 0.00 C ATOM 643 C LEU A 40 -11.762 -6.097 -9.129 1.00 0.00 C ATOM 644 O LEU A 40 -11.635 -7.164 -8.532 1.00 0.00 O ATOM 645 CB LEU A 40 -11.365 -4.633 -7.060 1.00 0.00 C ATOM 646 CG LEU A 40 -10.572 -5.532 -6.098 1.00 0.00 C ATOM 647 CD1 LEU A 40 -9.055 -5.471 -6.302 1.00 0.00 C ATOM 648 CD2 LEU A 40 -10.856 -5.053 -4.674 1.00 0.00 C ATOM 0 H LEU A 40 -12.621 -3.439 -9.082 1.00 0.00 H new ATOM 0 HA LEU A 40 -10.053 -4.923 -8.749 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -11.147 -3.596 -6.806 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -12.426 -4.791 -6.869 1.00 0.00 H new ATOM 0 HG LEU A 40 -10.888 -6.558 -6.286 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -8.565 -6.132 -5.587 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -8.811 -5.789 -7.316 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -8.708 -4.449 -6.149 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -10.306 -5.672 -3.965 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -10.540 -4.015 -4.570 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -11.924 -5.130 -4.471 1.00 0.00 H new ATOM 660 N SER A 41 -12.416 -6.002 -10.292 1.00 0.00 N ATOM 661 CA SER A 41 -13.271 -7.006 -10.913 1.00 0.00 C ATOM 662 C SER A 41 -12.721 -8.438 -10.903 1.00 0.00 C ATOM 663 O SER A 41 -13.455 -9.389 -10.653 1.00 0.00 O ATOM 664 CB SER A 41 -13.551 -6.544 -12.349 1.00 0.00 C ATOM 665 OG SER A 41 -13.539 -5.128 -12.408 1.00 0.00 O ATOM 0 H SER A 41 -12.353 -5.158 -10.861 1.00 0.00 H new ATOM 0 HA SER A 41 -14.179 -7.073 -10.314 1.00 0.00 H new ATOM 0 HB2 SER A 41 -12.800 -6.952 -13.025 1.00 0.00 H new ATOM 0 HB3 SER A 41 -14.518 -6.923 -12.681 1.00 0.00 H new ATOM 0 HG SER A 41 -14.247 -4.771 -11.833 1.00 0.00 H new ATOM 671 N HIS A 42 -11.437 -8.612 -11.227 1.00 0.00 N ATOM 672 CA HIS A 42 -10.835 -9.941 -11.300 1.00 0.00 C ATOM 673 C HIS A 42 -10.714 -10.563 -9.901 1.00 0.00 C ATOM 674 O HIS A 42 -10.705 -11.787 -9.770 1.00 0.00 O ATOM 675 CB HIS A 42 -9.478 -9.847 -12.017 1.00 0.00 C ATOM 676 CG HIS A 42 -8.844 -11.158 -12.424 1.00 0.00 C ATOM 677 ND1 HIS A 42 -9.008 -12.384 -11.816 1.00 0.00 N ATOM 678 CD2 HIS A 42 -7.918 -11.320 -13.421 1.00 0.00 C ATOM 679 CE1 HIS A 42 -8.208 -13.262 -12.443 1.00 0.00 C ATOM 680 NE2 HIS A 42 -7.525 -12.661 -13.430 1.00 0.00 N ATOM 0 H HIS A 42 -10.796 -7.848 -11.442 1.00 0.00 H new ATOM 0 HA HIS A 42 -11.478 -10.604 -11.879 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -9.605 -9.236 -12.911 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -8.782 -9.318 -11.365 1.00 0.00 H new ATOM 0 HD1 HIS A 42 -9.626 -12.588 -11.031 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -7.556 -10.547 -14.083 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -8.126 -14.308 -12.188 1.00 0.00 H new ATOM 688 N PHE A 43 -10.580 -9.731 -8.863 1.00 0.00 N ATOM 689 CA PHE A 43 -10.342 -10.173 -7.498 1.00 0.00 C ATOM 690 C PHE A 43 -11.667 -10.286 -6.740 1.00 0.00 C ATOM 691 O PHE A 43 -11.883 -11.285 -6.054 1.00 0.00 O ATOM 692 CB PHE A 43 -9.370 -9.226 -6.778 1.00 0.00 C ATOM 693 CG PHE A 43 -7.894 -9.372 -7.121 1.00 0.00 C ATOM 694 CD1 PHE A 43 -7.451 -9.253 -8.451 1.00 0.00 C ATOM 695 CD2 PHE A 43 -6.941 -9.485 -6.089 1.00 0.00 C ATOM 696 CE1 PHE A 43 -6.078 -9.287 -8.754 1.00 0.00 C ATOM 697 CE2 PHE A 43 -5.566 -9.429 -6.382 1.00 0.00 C ATOM 698 CZ PHE A 43 -5.134 -9.362 -7.717 1.00 0.00 C ATOM 0 H PHE A 43 -10.636 -8.717 -8.956 1.00 0.00 H new ATOM 0 HA PHE A 43 -9.880 -11.160 -7.528 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -9.670 -8.201 -6.995 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -9.486 -9.371 -5.704 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -8.172 -9.134 -9.247 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -7.268 -9.615 -5.068 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -5.750 -9.255 -9.783 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -4.842 -9.438 -5.580 1.00 0.00 H new ATOM 0 HZ PHE A 43 -4.078 -9.368 -7.945 1.00 0.00 H new ATOM 708 N LEU A 44 -12.528 -9.264 -6.826 1.00 0.00 N ATOM 709 CA LEU A 44 -13.849 -9.255 -6.201 1.00 0.00 C ATOM 710 C LEU A 44 -14.927 -9.254 -7.282 1.00 0.00 C ATOM 711 O LEU A 44 -14.868 -8.456 -8.215 1.00 0.00 O ATOM 712 CB LEU A 44 -14.036 -8.029 -5.290 1.00 0.00 C ATOM 713 CG LEU A 44 -13.681 -8.330 -3.827 1.00 0.00 C ATOM 714 CD1 LEU A 44 -12.167 -8.428 -3.626 1.00 0.00 C ATOM 715 CD2 LEU A 44 -14.231 -7.235 -2.907 1.00 0.00 C ATOM 0 H LEU A 44 -12.319 -8.409 -7.341 1.00 0.00 H new ATOM 0 HA LEU A 44 -13.935 -10.150 -5.586 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -13.412 -7.212 -5.652 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -15.070 -7.690 -5.348 1.00 0.00 H new ATOM 0 HG LEU A 44 -14.133 -9.290 -3.576 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -11.952 -8.642 -2.579 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -11.768 -9.228 -4.249 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -11.701 -7.483 -3.906 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -13.971 -7.463 -1.873 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -13.799 -6.274 -3.186 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -15.315 -7.187 -3.006 1.00 0.00 H new ATOM 727 N GLU A 45 -15.925 -10.127 -7.119 1.00 0.00 N ATOM 728 CA GLU A 45 -17.088 -10.162 -7.999 1.00 0.00 C ATOM 729 C GLU A 45 -18.019 -8.970 -7.742 1.00 0.00 C ATOM 730 O GLU A 45 -17.886 -8.262 -6.744 1.00 0.00 O ATOM 731 CB GLU A 45 -17.838 -11.503 -7.869 1.00 0.00 C ATOM 732 CG GLU A 45 -17.569 -12.426 -9.070 1.00 0.00 C ATOM 733 CD GLU A 45 -18.115 -11.895 -10.397 1.00 0.00 C ATOM 734 OE1 GLU A 45 -18.977 -10.988 -10.351 1.00 0.00 O ATOM 735 OE2 GLU A 45 -17.658 -12.409 -11.441 1.00 0.00 O ATOM 0 H GLU A 45 -15.946 -10.825 -6.376 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.732 -10.079 -9.026 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -17.532 -12.003 -6.950 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -18.909 -11.315 -7.788 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -16.494 -12.577 -9.166 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -18.011 -13.402 -8.871 1.00 0.00 H new ATOM 742 N GLU A 46 -18.967 -8.781 -8.664 1.00 0.00 N ATOM 743 CA GLU A 46 -19.920 -7.687 -8.693 1.00 0.00 C ATOM 744 C GLU A 46 -20.642 -7.555 -7.351 1.00 0.00 C ATOM 745 O GLU A 46 -21.251 -8.508 -6.865 1.00 0.00 O ATOM 746 CB GLU A 46 -20.909 -7.916 -9.846 1.00 0.00 C ATOM 747 CG GLU A 46 -21.850 -6.723 -10.048 1.00 0.00 C ATOM 748 CD GLU A 46 -22.770 -6.951 -11.243 1.00 0.00 C ATOM 749 OE1 GLU A 46 -23.848 -7.545 -11.025 1.00 0.00 O ATOM 750 OE2 GLU A 46 -22.372 -6.536 -12.354 1.00 0.00 O ATOM 0 H GLU A 46 -19.090 -9.424 -9.446 1.00 0.00 H new ATOM 0 HA GLU A 46 -19.392 -6.748 -8.862 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -20.355 -8.099 -10.767 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -21.498 -8.811 -9.645 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -22.447 -6.569 -9.149 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -21.266 -5.816 -10.202 1.00 0.00 H new ATOM 757 N ILE A 47 -20.584 -6.361 -6.765 1.00 0.00 N ATOM 758 CA ILE A 47 -21.214 -6.064 -5.492 1.00 0.00 C ATOM 759 C ILE A 47 -22.725 -5.961 -5.675 1.00 0.00 C ATOM 760 O ILE A 47 -23.210 -5.015 -6.293 1.00 0.00 O ATOM 761 CB ILE A 47 -20.681 -4.743 -4.913 1.00 0.00 C ATOM 762 CG1 ILE A 47 -19.147 -4.694 -4.790 1.00 0.00 C ATOM 763 CG2 ILE A 47 -21.368 -4.420 -3.577 1.00 0.00 C ATOM 764 CD1 ILE A 47 -18.561 -5.829 -3.947 1.00 0.00 C ATOM 0 H ILE A 47 -20.090 -5.566 -7.171 1.00 0.00 H new ATOM 0 HA ILE A 47 -20.980 -6.871 -4.798 1.00 0.00 H new ATOM 0 HB ILE A 47 -20.936 -3.966 -5.634 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -18.710 -4.731 -5.788 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -18.857 -3.740 -4.350 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -20.977 -3.482 -3.184 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -22.443 -4.328 -3.733 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -21.173 -5.221 -2.864 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -17.476 -5.729 -3.905 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -18.969 -5.780 -2.937 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -18.820 -6.787 -4.397 1.00 0.00 H new ATOM 776 N LYS A 48 -23.469 -6.897 -5.086 1.00 0.00 N ATOM 777 CA LYS A 48 -24.912 -6.787 -4.982 1.00 0.00 C ATOM 778 C LYS A 48 -25.216 -5.996 -3.706 1.00 0.00 C ATOM 779 O LYS A 48 -25.858 -4.948 -3.731 1.00 0.00 O ATOM 780 CB LYS A 48 -25.547 -8.187 -4.942 1.00 0.00 C ATOM 781 CG LYS A 48 -27.079 -8.084 -4.872 1.00 0.00 C ATOM 782 CD LYS A 48 -27.772 -9.451 -4.818 1.00 0.00 C ATOM 783 CE LYS A 48 -27.572 -10.158 -3.472 1.00 0.00 C ATOM 784 NZ LYS A 48 -28.343 -11.410 -3.400 1.00 0.00 N ATOM 0 H LYS A 48 -23.085 -7.746 -4.672 1.00 0.00 H new ATOM 0 HA LYS A 48 -25.332 -6.272 -5.846 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -25.255 -8.750 -5.828 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -25.174 -8.737 -4.078 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -27.358 -7.507 -3.991 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -27.440 -7.534 -5.741 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -28.839 -9.322 -5.002 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -27.385 -10.083 -5.618 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -26.513 -10.373 -3.326 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -27.877 -9.495 -2.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -28.185 -11.862 -2.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -29.355 -11.201 -3.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -28.034 -12.052 -4.158 1.00 0.00 H new ATOM 798 N GLU A 49 -24.759 -6.523 -2.570 1.00 0.00 N ATOM 799 CA GLU A 49 -25.136 -6.029 -1.262 1.00 0.00 C ATOM 800 C GLU A 49 -24.179 -4.920 -0.826 1.00 0.00 C ATOM 801 O GLU A 49 -23.226 -5.178 -0.097 1.00 0.00 O ATOM 802 CB GLU A 49 -25.172 -7.199 -0.265 1.00 0.00 C ATOM 803 CG GLU A 49 -26.183 -8.266 -0.715 1.00 0.00 C ATOM 804 CD GLU A 49 -26.300 -9.442 0.252 1.00 0.00 C ATOM 805 OE1 GLU A 49 -26.062 -9.222 1.459 1.00 0.00 O ATOM 806 OE2 GLU A 49 -26.631 -10.543 -0.242 1.00 0.00 O ATOM 0 H GLU A 49 -24.112 -7.311 -2.540 1.00 0.00 H new ATOM 0 HA GLU A 49 -26.135 -5.593 -1.297 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -24.180 -7.643 -0.182 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -25.441 -6.831 0.725 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -27.162 -7.801 -0.830 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -25.891 -8.641 -1.696 1.00 0.00 H new ATOM 813 N GLN A 50 -24.461 -3.680 -1.242 1.00 0.00 N ATOM 814 CA GLN A 50 -23.762 -2.472 -0.796 1.00 0.00 C ATOM 815 C GLN A 50 -23.435 -2.525 0.702 1.00 0.00 C ATOM 816 O GLN A 50 -22.331 -2.190 1.122 1.00 0.00 O ATOM 817 CB GLN A 50 -24.642 -1.250 -1.097 1.00 0.00 C ATOM 818 CG GLN A 50 -23.993 0.067 -0.640 1.00 0.00 C ATOM 819 CD GLN A 50 -24.931 1.252 -0.835 1.00 0.00 C ATOM 820 OE1 GLN A 50 -24.660 2.142 -1.634 1.00 0.00 O ATOM 821 NE2 GLN A 50 -26.036 1.281 -0.095 1.00 0.00 N ATOM 0 H GLN A 50 -25.201 -3.485 -1.916 1.00 0.00 H new ATOM 0 HA GLN A 50 -22.817 -2.401 -1.334 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -24.839 -1.202 -2.168 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -25.605 -1.368 -0.601 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -23.716 -0.009 0.411 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -23.073 0.234 -1.201 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -26.231 0.524 0.560 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -26.688 2.060 -0.183 1.00 0.00 H new ATOM 830 N GLU A 51 -24.397 -2.955 1.517 1.00 0.00 N ATOM 831 CA GLU A 51 -24.246 -2.973 2.963 1.00 0.00 C ATOM 832 C GLU A 51 -23.040 -3.816 3.390 1.00 0.00 C ATOM 833 O GLU A 51 -22.379 -3.512 4.381 1.00 0.00 O ATOM 834 CB GLU A 51 -25.539 -3.487 3.605 1.00 0.00 C ATOM 835 CG GLU A 51 -26.796 -2.772 3.072 1.00 0.00 C ATOM 836 CD GLU A 51 -26.628 -1.254 2.994 1.00 0.00 C ATOM 837 OE1 GLU A 51 -26.578 -0.635 4.078 1.00 0.00 O ATOM 838 OE2 GLU A 51 -26.524 -0.743 1.855 1.00 0.00 O ATOM 0 H GLU A 51 -25.300 -3.299 1.190 1.00 0.00 H new ATOM 0 HA GLU A 51 -24.059 -1.956 3.309 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -25.630 -4.557 3.421 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -25.481 -3.353 4.685 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -27.035 -3.158 2.081 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -27.643 -3.006 3.717 1.00 0.00 H new ATOM 845 N VAL A 52 -22.715 -4.857 2.624 1.00 0.00 N ATOM 846 CA VAL A 52 -21.514 -5.622 2.880 1.00 0.00 C ATOM 847 C VAL A 52 -20.285 -4.744 2.646 1.00 0.00 C ATOM 848 O VAL A 52 -19.383 -4.756 3.478 1.00 0.00 O ATOM 849 CB VAL A 52 -21.494 -6.913 2.053 1.00 0.00 C ATOM 850 CG1 VAL A 52 -20.217 -7.698 2.371 1.00 0.00 C ATOM 851 CG2 VAL A 52 -22.710 -7.782 2.404 1.00 0.00 C ATOM 0 H VAL A 52 -23.267 -5.181 1.830 1.00 0.00 H new ATOM 0 HA VAL A 52 -21.498 -5.936 3.924 1.00 0.00 H new ATOM 0 HB VAL A 52 -21.525 -6.656 0.994 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -20.199 -8.617 1.785 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -19.346 -7.092 2.122 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -20.196 -7.945 3.433 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -22.687 -8.697 1.811 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -22.682 -8.035 3.464 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -23.625 -7.232 2.186 1.00 0.00 H new ATOM 861 N VAL A 53 -20.219 -3.954 1.567 1.00 0.00 N ATOM 862 CA VAL A 53 -19.081 -3.070 1.376 1.00 0.00 C ATOM 863 C VAL A 53 -19.033 -2.026 2.486 1.00 0.00 C ATOM 864 O VAL A 53 -17.958 -1.685 2.974 1.00 0.00 O ATOM 865 CB VAL A 53 -19.000 -2.464 -0.032 1.00 0.00 C ATOM 866 CG1 VAL A 53 -19.400 -3.481 -1.097 1.00 0.00 C ATOM 867 CG2 VAL A 53 -19.681 -1.106 -0.272 1.00 0.00 C ATOM 0 H VAL A 53 -20.926 -3.914 0.833 1.00 0.00 H new ATOM 0 HA VAL A 53 -18.180 -3.678 1.451 1.00 0.00 H new ATOM 0 HB VAL A 53 -17.942 -2.215 -0.120 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -19.332 -3.021 -2.083 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -18.730 -4.339 -1.050 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -20.424 -3.810 -0.920 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -19.540 -0.807 -1.310 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -20.747 -1.191 -0.061 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -19.240 -0.357 0.385 1.00 0.00 H new ATOM 877 N ASP A 54 -20.206 -1.551 2.917 1.00 0.00 N ATOM 878 CA ASP A 54 -20.287 -0.690 4.085 1.00 0.00 C ATOM 879 C ASP A 54 -19.615 -1.385 5.274 1.00 0.00 C ATOM 880 O ASP A 54 -18.803 -0.771 5.957 1.00 0.00 O ATOM 881 CB ASP A 54 -21.729 -0.276 4.386 1.00 0.00 C ATOM 882 CG ASP A 54 -21.760 0.815 5.449 1.00 0.00 C ATOM 883 OD1 ASP A 54 -21.804 0.449 6.642 1.00 0.00 O ATOM 884 OD2 ASP A 54 -21.735 1.998 5.042 1.00 0.00 O ATOM 0 H ASP A 54 -21.103 -1.750 2.473 1.00 0.00 H new ATOM 0 HA ASP A 54 -19.751 0.237 3.883 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -22.209 0.082 3.475 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -22.298 -1.141 4.727 1.00 0.00 H new ATOM 889 N LYS A 55 -19.879 -2.677 5.487 1.00 0.00 N ATOM 890 CA LYS A 55 -19.168 -3.431 6.510 1.00 0.00 C ATOM 891 C LYS A 55 -17.657 -3.487 6.231 1.00 0.00 C ATOM 892 O LYS A 55 -16.871 -3.193 7.132 1.00 0.00 O ATOM 893 CB LYS A 55 -19.752 -4.842 6.669 1.00 0.00 C ATOM 894 CG LYS A 55 -19.320 -5.467 8.007 1.00 0.00 C ATOM 895 CD LYS A 55 -19.138 -6.988 7.896 1.00 0.00 C ATOM 896 CE LYS A 55 -17.820 -7.377 7.205 1.00 0.00 C ATOM 897 NZ LYS A 55 -16.639 -7.066 8.032 1.00 0.00 N ATOM 0 H LYS A 55 -20.574 -3.214 4.968 1.00 0.00 H new ATOM 0 HA LYS A 55 -19.306 -2.902 7.453 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -20.840 -4.798 6.618 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -19.420 -5.473 5.844 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -18.385 -5.012 8.335 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -20.067 -5.245 8.769 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -19.164 -7.427 8.893 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -19.974 -7.411 7.339 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -17.832 -8.443 6.980 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -17.743 -6.851 6.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -15.805 -7.551 7.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -16.474 -6.039 8.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -16.803 -7.388 9.007 1.00 0.00 H new ATOM 911 N VAL A 56 -17.220 -3.867 5.018 1.00 0.00 N ATOM 912 CA VAL A 56 -15.789 -4.055 4.758 1.00 0.00 C ATOM 913 C VAL A 56 -15.017 -2.742 4.910 1.00 0.00 C ATOM 914 O VAL A 56 -13.861 -2.757 5.326 1.00 0.00 O ATOM 915 CB VAL A 56 -15.453 -4.778 3.431 1.00 0.00 C ATOM 916 CG1 VAL A 56 -16.388 -5.943 3.081 1.00 0.00 C ATOM 917 CG2 VAL A 56 -15.292 -3.844 2.223 1.00 0.00 C ATOM 0 H VAL A 56 -17.827 -4.046 4.218 1.00 0.00 H new ATOM 0 HA VAL A 56 -15.451 -4.745 5.531 1.00 0.00 H new ATOM 0 HB VAL A 56 -14.474 -5.207 3.645 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -16.076 -6.389 2.136 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -16.343 -6.695 3.869 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -17.410 -5.574 2.989 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -15.058 -4.433 1.336 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -16.220 -3.296 2.060 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -14.483 -3.138 2.414 1.00 0.00 H new ATOM 927 N MET A 57 -15.639 -1.606 4.584 1.00 0.00 N ATOM 928 CA MET A 57 -15.005 -0.312 4.783 1.00 0.00 C ATOM 929 C MET A 57 -15.095 0.096 6.260 1.00 0.00 C ATOM 930 O MET A 57 -14.089 0.482 6.846 1.00 0.00 O ATOM 931 CB MET A 57 -15.540 0.710 3.774 1.00 0.00 C ATOM 932 CG MET A 57 -16.827 1.417 4.202 1.00 0.00 C ATOM 933 SD MET A 57 -17.640 2.371 2.904 1.00 0.00 S ATOM 934 CE MET A 57 -16.328 3.524 2.460 1.00 0.00 C ATOM 0 H MET A 57 -16.576 -1.562 4.184 1.00 0.00 H new ATOM 0 HA MET A 57 -13.937 -0.367 4.572 1.00 0.00 H new ATOM 0 HB2 MET A 57 -14.771 1.461 3.596 1.00 0.00 H new ATOM 0 HB3 MET A 57 -15.718 0.204 2.825 1.00 0.00 H new ATOM 0 HG2 MET A 57 -17.527 0.670 4.576 1.00 0.00 H new ATOM 0 HG3 MET A 57 -16.598 2.084 5.033 1.00 0.00 H new ATOM 0 HE1 MET A 57 -16.683 4.196 1.679 1.00 0.00 H new ATOM 0 HE2 MET A 57 -16.043 4.106 3.337 1.00 0.00 H new ATOM 0 HE3 MET A 57 -15.464 2.969 2.096 1.00 0.00 H new ATOM 944 N GLU A 58 -16.264 -0.070 6.897 1.00 0.00 N ATOM 945 CA GLU A 58 -16.473 0.217 8.318 1.00 0.00 C ATOM 946 C GLU A 58 -15.423 -0.500 9.168 1.00 0.00 C ATOM 947 O GLU A 58 -14.844 0.078 10.085 1.00 0.00 O ATOM 948 CB GLU A 58 -17.890 -0.199 8.733 1.00 0.00 C ATOM 949 CG GLU A 58 -18.133 0.022 10.229 1.00 0.00 C ATOM 950 CD GLU A 58 -19.598 -0.200 10.584 1.00 0.00 C ATOM 951 OE1 GLU A 58 -19.975 -1.386 10.710 1.00 0.00 O ATOM 952 OE2 GLU A 58 -20.313 0.816 10.720 1.00 0.00 O ATOM 0 H GLU A 58 -17.102 -0.413 6.428 1.00 0.00 H new ATOM 0 HA GLU A 58 -16.365 1.289 8.483 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -18.619 0.372 8.158 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -18.046 -1.250 8.491 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -17.508 -0.659 10.807 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -17.838 1.035 10.503 1.00 0.00 H new ATOM 959 N THR A 59 -15.117 -1.737 8.784 1.00 0.00 N ATOM 960 CA THR A 59 -14.111 -2.584 9.407 1.00 0.00 C ATOM 961 C THR A 59 -12.764 -1.851 9.482 1.00 0.00 C ATOM 962 O THR A 59 -12.022 -2.034 10.444 1.00 0.00 O ATOM 963 CB THR A 59 -14.020 -3.863 8.549 1.00 0.00 C ATOM 964 OG1 THR A 59 -15.194 -4.630 8.728 1.00 0.00 O ATOM 965 CG2 THR A 59 -12.781 -4.739 8.750 1.00 0.00 C ATOM 0 H THR A 59 -15.583 -2.192 7.999 1.00 0.00 H new ATOM 0 HA THR A 59 -14.380 -2.837 10.433 1.00 0.00 H new ATOM 0 HB THR A 59 -13.919 -3.503 7.525 1.00 0.00 H new ATOM 0 HG1 THR A 59 -15.955 -4.162 8.326 1.00 0.00 H new ATOM 0 HG21 THR A 59 -12.837 -5.605 8.090 1.00 0.00 H new ATOM 0 HG22 THR A 59 -11.886 -4.162 8.517 1.00 0.00 H new ATOM 0 HG23 THR A 59 -12.737 -5.074 9.786 1.00 0.00 H new ATOM 973 N LEU A 60 -12.444 -1.032 8.477 1.00 0.00 N ATOM 974 CA LEU A 60 -11.216 -0.251 8.401 1.00 0.00 C ATOM 975 C LEU A 60 -11.438 1.236 8.685 1.00 0.00 C ATOM 976 O LEU A 60 -10.517 2.025 8.500 1.00 0.00 O ATOM 977 CB LEU A 60 -10.612 -0.426 7.005 1.00 0.00 C ATOM 978 CG LEU A 60 -10.444 -1.897 6.596 1.00 0.00 C ATOM 979 CD1 LEU A 60 -9.845 -1.949 5.191 1.00 0.00 C ATOM 980 CD2 LEU A 60 -9.542 -2.647 7.579 1.00 0.00 C ATOM 0 H LEU A 60 -13.054 -0.893 7.671 1.00 0.00 H new ATOM 0 HA LEU A 60 -10.538 -0.619 9.171 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -11.248 0.076 6.276 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -9.640 0.066 6.973 1.00 0.00 H new ATOM 0 HG LEU A 60 -11.420 -2.382 6.608 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -9.720 -2.988 4.887 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -10.512 -1.444 4.492 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -8.875 -1.452 5.190 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -9.443 -3.685 7.262 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -8.558 -2.178 7.600 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -9.982 -2.612 8.576 1.00 0.00 H new ATOM 992 N ASP A 61 -12.639 1.652 9.091 1.00 0.00 N ATOM 993 CA ASP A 61 -12.995 3.069 9.169 1.00 0.00 C ATOM 994 C ASP A 61 -12.372 3.753 10.389 1.00 0.00 C ATOM 995 O ASP A 61 -13.073 4.177 11.308 1.00 0.00 O ATOM 996 CB ASP A 61 -14.519 3.235 9.101 1.00 0.00 C ATOM 997 CG ASP A 61 -14.983 4.692 9.149 1.00 0.00 C ATOM 998 OD1 ASP A 61 -14.185 5.580 8.781 1.00 0.00 O ATOM 999 OD2 ASP A 61 -16.145 4.904 9.558 1.00 0.00 O ATOM 0 H ASP A 61 -13.388 1.020 9.373 1.00 0.00 H new ATOM 0 HA ASP A 61 -12.571 3.580 8.305 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -14.885 2.777 8.182 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -14.972 2.691 9.930 1.00 0.00 H new ATOM 1004 N SER A 62 -11.050 3.929 10.348 1.00 0.00 N ATOM 1005 CA SER A 62 -10.262 4.713 11.288 1.00 0.00 C ATOM 1006 C SER A 62 -10.887 6.091 11.513 1.00 0.00 C ATOM 1007 O SER A 62 -10.883 6.612 12.624 1.00 0.00 O ATOM 1008 CB SER A 62 -8.851 4.866 10.714 1.00 0.00 C ATOM 1009 OG SER A 62 -8.928 5.460 9.431 1.00 0.00 O ATOM 0 H SER A 62 -10.475 3.505 9.620 1.00 0.00 H new ATOM 0 HA SER A 62 -10.231 4.203 12.251 1.00 0.00 H new ATOM 0 HB2 SER A 62 -8.242 5.481 11.376 1.00 0.00 H new ATOM 0 HB3 SER A 62 -8.366 3.892 10.648 1.00 0.00 H new ATOM 0 HG SER A 62 -8.059 5.849 9.198 1.00 0.00 H new ATOM 1015 N ASP A 63 -11.431 6.669 10.438 1.00 0.00 N ATOM 1016 CA ASP A 63 -11.984 8.013 10.439 1.00 0.00 C ATOM 1017 C ASP A 63 -13.304 8.073 11.214 1.00 0.00 C ATOM 1018 O ASP A 63 -13.760 9.166 11.539 1.00 0.00 O ATOM 1019 CB ASP A 63 -12.237 8.459 8.989 1.00 0.00 C ATOM 1020 CG ASP A 63 -11.012 8.309 8.095 1.00 0.00 C ATOM 1021 OD1 ASP A 63 -10.136 9.196 8.183 1.00 0.00 O ATOM 1022 OD2 ASP A 63 -10.977 7.314 7.333 1.00 0.00 O ATOM 0 H ASP A 63 -11.497 6.204 9.533 1.00 0.00 H new ATOM 0 HA ASP A 63 -11.267 8.675 10.925 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -13.057 7.874 8.573 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -12.556 9.501 8.986 1.00 0.00 H new ATOM 1027 N GLY A 64 -13.930 6.921 11.490 1.00 0.00 N ATOM 1028 CA GLY A 64 -15.247 6.841 12.109 1.00 0.00 C ATOM 1029 C GLY A 64 -16.272 7.727 11.398 1.00 0.00 C ATOM 1030 O GLY A 64 -17.168 8.264 12.044 1.00 0.00 O ATOM 0 H GLY A 64 -13.524 6.008 11.284 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -15.591 5.807 12.096 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -15.174 7.139 13.155 1.00 0.00 H new ATOM 1034 N ASP A 65 -16.132 7.895 10.076 1.00 0.00 N ATOM 1035 CA ASP A 65 -16.905 8.846 9.285 1.00 0.00 C ATOM 1036 C ASP A 65 -17.739 8.115 8.229 1.00 0.00 C ATOM 1037 O ASP A 65 -18.308 8.739 7.336 1.00 0.00 O ATOM 1038 CB ASP A 65 -15.922 9.844 8.653 1.00 0.00 C ATOM 1039 CG ASP A 65 -16.593 11.062 8.019 1.00 0.00 C ATOM 1040 OD1 ASP A 65 -17.654 11.480 8.534 1.00 0.00 O ATOM 1041 OD2 ASP A 65 -16.003 11.582 7.047 1.00 0.00 O ATOM 0 H ASP A 65 -15.464 7.360 9.521 1.00 0.00 H new ATOM 0 HA ASP A 65 -17.610 9.388 9.915 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -15.224 10.184 9.418 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -15.336 9.328 7.893 1.00 0.00 H new ATOM 1046 N GLY A 66 -17.772 6.780 8.279 1.00 0.00 N ATOM 1047 CA GLY A 66 -18.342 5.955 7.230 1.00 0.00 C ATOM 1048 C GLY A 66 -17.415 5.945 6.021 1.00 0.00 C ATOM 1049 O GLY A 66 -16.805 4.923 5.700 1.00 0.00 O ATOM 0 H GLY A 66 -17.397 6.243 9.061 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -18.491 4.939 7.594 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -19.322 6.338 6.945 1.00 0.00 H new ATOM 1053 N GLU A 67 -17.300 7.098 5.360 1.00 0.00 N ATOM 1054 CA GLU A 67 -16.361 7.288 4.271 1.00 0.00 C ATOM 1055 C GLU A 67 -14.937 7.003 4.762 1.00 0.00 C ATOM 1056 O GLU A 67 -14.548 7.453 5.839 1.00 0.00 O ATOM 1057 CB GLU A 67 -16.532 8.660 3.598 1.00 0.00 C ATOM 1058 CG GLU A 67 -16.398 9.862 4.539 1.00 0.00 C ATOM 1059 CD GLU A 67 -16.691 11.174 3.816 1.00 0.00 C ATOM 1060 OE1 GLU A 67 -15.950 11.480 2.858 1.00 0.00 O ATOM 1061 OE2 GLU A 67 -17.674 11.836 4.213 1.00 0.00 O ATOM 0 H GLU A 67 -17.860 7.924 5.571 1.00 0.00 H new ATOM 0 HA GLU A 67 -16.574 6.569 3.480 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -15.791 8.754 2.805 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -17.513 8.696 3.124 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -17.084 9.747 5.378 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -15.390 9.891 4.953 1.00 0.00 H new ATOM 1068 N CYS A 68 -14.185 6.217 3.985 1.00 0.00 N ATOM 1069 CA CYS A 68 -12.895 5.654 4.389 1.00 0.00 C ATOM 1070 C CYS A 68 -11.752 6.339 3.654 1.00 0.00 C ATOM 1071 O CYS A 68 -11.854 6.536 2.442 1.00 0.00 O ATOM 1072 CB CYS A 68 -12.891 4.148 4.107 1.00 0.00 C ATOM 1073 SG CYS A 68 -13.767 3.334 5.458 1.00 0.00 S ATOM 0 H CYS A 68 -14.462 5.950 3.040 1.00 0.00 H new ATOM 0 HA CYS A 68 -12.751 5.822 5.456 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -13.376 3.936 3.154 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -11.869 3.775 4.034 1.00 0.00 H new ATOM 0 HG CYS A 68 -14.934 3.886 5.613 1.00 0.00 H new ATOM 1079 N ASP A 69 -10.685 6.719 4.378 1.00 0.00 N ATOM 1080 CA ASP A 69 -9.624 7.536 3.808 1.00 0.00 C ATOM 1081 C ASP A 69 -8.611 6.728 3.007 1.00 0.00 C ATOM 1082 O ASP A 69 -8.557 5.497 3.096 1.00 0.00 O ATOM 1083 CB ASP A 69 -8.972 8.477 4.839 1.00 0.00 C ATOM 1084 CG ASP A 69 -7.719 7.911 5.495 1.00 0.00 C ATOM 1085 OD1 ASP A 69 -6.630 8.148 4.926 1.00 0.00 O ATOM 1086 OD2 ASP A 69 -7.868 7.258 6.548 1.00 0.00 O ATOM 0 H ASP A 69 -10.544 6.469 5.357 1.00 0.00 H new ATOM 0 HA ASP A 69 -10.111 8.188 3.083 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -8.719 9.417 4.348 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -9.702 8.709 5.615 1.00 0.00 H new ATOM 1091 N PHE A 70 -7.781 7.456 2.254 1.00 0.00 N ATOM 1092 CA PHE A 70 -6.749 6.888 1.398 1.00 0.00 C ATOM 1093 C PHE A 70 -5.930 5.834 2.151 1.00 0.00 C ATOM 1094 O PHE A 70 -5.710 4.745 1.630 1.00 0.00 O ATOM 1095 CB PHE A 70 -5.873 8.014 0.827 1.00 0.00 C ATOM 1096 CG PHE A 70 -4.847 7.526 -0.185 1.00 0.00 C ATOM 1097 CD1 PHE A 70 -3.744 6.753 0.223 1.00 0.00 C ATOM 1098 CD2 PHE A 70 -5.153 7.607 -1.554 1.00 0.00 C ATOM 1099 CE1 PHE A 70 -3.095 5.916 -0.702 1.00 0.00 C ATOM 1100 CE2 PHE A 70 -4.535 6.746 -2.473 1.00 0.00 C ATOM 1101 CZ PHE A 70 -3.540 5.862 -2.035 1.00 0.00 C ATOM 0 H PHE A 70 -7.813 8.475 2.226 1.00 0.00 H new ATOM 0 HA PHE A 70 -7.218 6.373 0.560 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -6.513 8.758 0.354 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -5.356 8.513 1.646 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -3.397 6.803 1.244 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -5.869 8.337 -1.901 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -2.255 5.314 -0.389 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -4.825 6.764 -3.513 1.00 0.00 H new ATOM 0 HZ PHE A 70 -3.116 5.141 -2.719 1.00 0.00 H new ATOM 1111 N GLN A 71 -5.520 6.121 3.388 1.00 0.00 N ATOM 1112 CA GLN A 71 -4.784 5.179 4.221 1.00 0.00 C ATOM 1113 C GLN A 71 -5.514 3.837 4.362 1.00 0.00 C ATOM 1114 O GLN A 71 -4.881 2.781 4.315 1.00 0.00 O ATOM 1115 CB GLN A 71 -4.535 5.812 5.598 1.00 0.00 C ATOM 1116 CG GLN A 71 -3.825 4.888 6.597 1.00 0.00 C ATOM 1117 CD GLN A 71 -2.432 4.467 6.135 1.00 0.00 C ATOM 1118 OE1 GLN A 71 -1.439 5.077 6.511 1.00 0.00 O ATOM 1119 NE2 GLN A 71 -2.338 3.413 5.327 1.00 0.00 N ATOM 0 H GLN A 71 -5.692 7.020 3.839 1.00 0.00 H new ATOM 0 HA GLN A 71 -3.831 4.965 3.736 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -3.938 6.715 5.468 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -5.491 6.120 6.022 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -3.745 5.395 7.559 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -4.434 3.998 6.756 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -3.181 2.922 5.029 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -1.423 3.096 5.007 1.00 0.00 H new ATOM 1128 N GLU A 72 -6.829 3.859 4.584 1.00 0.00 N ATOM 1129 CA GLU A 72 -7.598 2.650 4.852 1.00 0.00 C ATOM 1130 C GLU A 72 -7.816 1.881 3.556 1.00 0.00 C ATOM 1131 O GLU A 72 -7.674 0.659 3.506 1.00 0.00 O ATOM 1132 CB GLU A 72 -8.925 3.010 5.530 1.00 0.00 C ATOM 1133 CG GLU A 72 -8.710 3.884 6.774 1.00 0.00 C ATOM 1134 CD GLU A 72 -7.654 3.332 7.731 1.00 0.00 C ATOM 1135 OE1 GLU A 72 -7.647 2.103 7.956 1.00 0.00 O ATOM 1136 OE2 GLU A 72 -6.858 4.166 8.222 1.00 0.00 O ATOM 0 H GLU A 72 -7.386 4.713 4.582 1.00 0.00 H new ATOM 0 HA GLU A 72 -7.044 2.006 5.535 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -9.564 3.537 4.821 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -9.448 2.097 5.813 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -8.416 4.885 6.459 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -9.656 3.983 7.307 1.00 0.00 H new ATOM 1143 N PHE A 73 -8.105 2.617 2.485 1.00 0.00 N ATOM 1144 CA PHE A 73 -8.128 2.067 1.139 1.00 0.00 C ATOM 1145 C PHE A 73 -6.808 1.332 0.868 1.00 0.00 C ATOM 1146 O PHE A 73 -6.799 0.157 0.500 1.00 0.00 O ATOM 1147 CB PHE A 73 -8.386 3.219 0.163 1.00 0.00 C ATOM 1148 CG PHE A 73 -7.935 2.977 -1.260 1.00 0.00 C ATOM 1149 CD1 PHE A 73 -8.744 2.222 -2.126 1.00 0.00 C ATOM 1150 CD2 PHE A 73 -6.756 3.579 -1.746 1.00 0.00 C ATOM 1151 CE1 PHE A 73 -8.406 2.114 -3.484 1.00 0.00 C ATOM 1152 CE2 PHE A 73 -6.418 3.463 -3.106 1.00 0.00 C ATOM 1153 CZ PHE A 73 -7.258 2.752 -3.980 1.00 0.00 C ATOM 0 H PHE A 73 -8.329 3.611 2.530 1.00 0.00 H new ATOM 0 HA PHE A 73 -8.924 1.334 1.013 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -9.455 3.434 0.156 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -7.884 4.110 0.539 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -9.625 1.725 -1.747 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -6.113 4.129 -1.074 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -9.031 1.538 -4.150 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -5.513 3.920 -3.479 1.00 0.00 H new ATOM 0 HZ PHE A 73 -7.021 2.696 -5.032 1.00 0.00 H new ATOM 1163 N MET A 74 -5.687 2.007 1.117 1.00 0.00 N ATOM 1164 CA MET A 74 -4.358 1.445 0.977 1.00 0.00 C ATOM 1165 C MET A 74 -4.170 0.213 1.865 1.00 0.00 C ATOM 1166 O MET A 74 -3.611 -0.786 1.425 1.00 0.00 O ATOM 1167 CB MET A 74 -3.330 2.549 1.236 1.00 0.00 C ATOM 1168 CG MET A 74 -1.892 2.037 1.331 1.00 0.00 C ATOM 1169 SD MET A 74 -1.236 1.037 -0.035 1.00 0.00 S ATOM 1170 CE MET A 74 -1.269 2.226 -1.390 1.00 0.00 C ATOM 0 H MET A 74 -5.684 2.979 1.427 1.00 0.00 H new ATOM 0 HA MET A 74 -4.211 1.080 -0.039 1.00 0.00 H new ATOM 0 HB2 MET A 74 -3.392 3.287 0.436 1.00 0.00 H new ATOM 0 HB3 MET A 74 -3.586 3.062 2.163 1.00 0.00 H new ATOM 0 HG2 MET A 74 -1.240 2.902 1.452 1.00 0.00 H new ATOM 0 HG3 MET A 74 -1.810 1.446 2.243 1.00 0.00 H new ATOM 0 HE1 MET A 74 -0.893 1.754 -2.298 1.00 0.00 H new ATOM 0 HE2 MET A 74 -2.293 2.563 -1.553 1.00 0.00 H new ATOM 0 HE3 MET A 74 -0.641 3.081 -1.139 1.00 0.00 H new ATOM 1180 N ALA A 75 -4.632 0.257 3.112 1.00 0.00 N ATOM 1181 CA ALA A 75 -4.570 -0.901 3.999 1.00 0.00 C ATOM 1182 C ALA A 75 -5.304 -2.098 3.381 1.00 0.00 C ATOM 1183 O ALA A 75 -4.794 -3.218 3.373 1.00 0.00 O ATOM 1184 CB ALA A 75 -5.130 -0.548 5.381 1.00 0.00 C ATOM 0 H ALA A 75 -5.055 1.085 3.532 1.00 0.00 H new ATOM 0 HA ALA A 75 -3.526 -1.187 4.127 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -5.076 -1.422 6.030 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -4.544 0.262 5.815 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -6.169 -0.232 5.283 1.00 0.00 H new ATOM 1190 N PHE A 76 -6.499 -1.857 2.835 1.00 0.00 N ATOM 1191 CA PHE A 76 -7.285 -2.883 2.164 1.00 0.00 C ATOM 1192 C PHE A 76 -6.496 -3.449 0.978 1.00 0.00 C ATOM 1193 O PHE A 76 -6.274 -4.659 0.888 1.00 0.00 O ATOM 1194 CB PHE A 76 -8.657 -2.311 1.779 1.00 0.00 C ATOM 1195 CG PHE A 76 -9.511 -3.218 0.922 1.00 0.00 C ATOM 1196 CD1 PHE A 76 -9.405 -3.104 -0.475 1.00 0.00 C ATOM 1197 CD2 PHE A 76 -10.424 -4.134 1.491 1.00 0.00 C ATOM 1198 CE1 PHE A 76 -10.161 -3.937 -1.309 1.00 0.00 C ATOM 1199 CE2 PHE A 76 -11.161 -4.987 0.645 1.00 0.00 C ATOM 1200 CZ PHE A 76 -11.012 -4.904 -0.754 1.00 0.00 C ATOM 0 H PHE A 76 -6.946 -0.940 2.849 1.00 0.00 H new ATOM 0 HA PHE A 76 -7.476 -3.722 2.833 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -9.205 -2.077 2.692 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -8.506 -1.371 1.248 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -8.739 -2.372 -0.906 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -10.556 -4.180 2.562 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -10.089 -3.835 -2.382 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -11.843 -5.708 1.071 1.00 0.00 H new ATOM 0 HZ PHE A 76 -11.552 -5.583 -1.397 1.00 0.00 H new ATOM 1210 N VAL A 77 -6.009 -2.557 0.111 1.00 0.00 N ATOM 1211 CA VAL A 77 -5.147 -2.910 -1.012 1.00 0.00 C ATOM 1212 C VAL A 77 -3.978 -3.771 -0.529 1.00 0.00 C ATOM 1213 O VAL A 77 -3.666 -4.782 -1.158 1.00 0.00 O ATOM 1214 CB VAL A 77 -4.670 -1.628 -1.717 1.00 0.00 C ATOM 1215 CG1 VAL A 77 -3.525 -1.889 -2.707 1.00 0.00 C ATOM 1216 CG2 VAL A 77 -5.827 -0.979 -2.489 1.00 0.00 C ATOM 0 H VAL A 77 -6.207 -1.558 0.173 1.00 0.00 H new ATOM 0 HA VAL A 77 -5.705 -3.502 -1.737 1.00 0.00 H new ATOM 0 HB VAL A 77 -4.307 -0.966 -0.931 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -3.228 -0.951 -3.175 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -2.674 -2.314 -2.175 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -3.859 -2.588 -3.474 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -5.473 -0.074 -2.982 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.202 -1.677 -3.238 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -6.629 -0.725 -1.796 1.00 0.00 H new ATOM 1226 N ALA A 78 -3.340 -3.390 0.580 1.00 0.00 N ATOM 1227 CA ALA A 78 -2.166 -4.076 1.087 1.00 0.00 C ATOM 1228 C ALA A 78 -2.471 -5.549 1.345 1.00 0.00 C ATOM 1229 O ALA A 78 -1.782 -6.420 0.812 1.00 0.00 O ATOM 1230 CB ALA A 78 -1.649 -3.392 2.355 1.00 0.00 C ATOM 0 H ALA A 78 -3.630 -2.594 1.148 1.00 0.00 H new ATOM 0 HA ALA A 78 -1.383 -4.023 0.331 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -0.769 -3.921 2.720 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -1.384 -2.359 2.129 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -2.425 -3.409 3.120 1.00 0.00 H new ATOM 1236 N MET A 79 -3.515 -5.841 2.127 1.00 0.00 N ATOM 1237 CA MET A 79 -3.830 -7.230 2.443 1.00 0.00 C ATOM 1238 C MET A 79 -4.267 -7.998 1.198 1.00 0.00 C ATOM 1239 O MET A 79 -3.817 -9.124 0.983 1.00 0.00 O ATOM 1240 CB MET A 79 -4.812 -7.375 3.613 1.00 0.00 C ATOM 1241 CG MET A 79 -6.088 -6.535 3.556 1.00 0.00 C ATOM 1242 SD MET A 79 -7.126 -6.786 5.016 1.00 0.00 S ATOM 1243 CE MET A 79 -8.230 -5.374 4.859 1.00 0.00 C ATOM 0 H MET A 79 -4.140 -5.150 2.542 1.00 0.00 H new ATOM 0 HA MET A 79 -2.907 -7.691 2.793 1.00 0.00 H new ATOM 0 HB2 MET A 79 -5.100 -8.424 3.686 1.00 0.00 H new ATOM 0 HB3 MET A 79 -4.283 -7.125 4.533 1.00 0.00 H new ATOM 0 HG2 MET A 79 -5.825 -5.480 3.474 1.00 0.00 H new ATOM 0 HG3 MET A 79 -6.653 -6.793 2.660 1.00 0.00 H new ATOM 0 HE1 MET A 79 -9.017 -5.442 5.610 1.00 0.00 H new ATOM 0 HE2 MET A 79 -7.666 -4.453 5.006 1.00 0.00 H new ATOM 0 HE3 MET A 79 -8.677 -5.371 3.865 1.00 0.00 H new ATOM 1253 N ILE A 80 -5.109 -7.391 0.358 1.00 0.00 N ATOM 1254 CA ILE A 80 -5.578 -8.026 -0.872 1.00 0.00 C ATOM 1255 C ILE A 80 -4.373 -8.436 -1.732 1.00 0.00 C ATOM 1256 O ILE A 80 -4.236 -9.594 -2.135 1.00 0.00 O ATOM 1257 CB ILE A 80 -6.514 -7.050 -1.612 1.00 0.00 C ATOM 1258 CG1 ILE A 80 -7.806 -6.789 -0.810 1.00 0.00 C ATOM 1259 CG2 ILE A 80 -6.832 -7.521 -3.037 1.00 0.00 C ATOM 1260 CD1 ILE A 80 -8.948 -7.772 -1.091 1.00 0.00 C ATOM 0 H ILE A 80 -5.481 -6.454 0.511 1.00 0.00 H new ATOM 0 HA ILE A 80 -6.141 -8.932 -0.648 1.00 0.00 H new ATOM 0 HB ILE A 80 -5.978 -6.105 -1.699 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -7.570 -6.823 0.254 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -8.154 -5.779 -1.027 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -7.494 -6.802 -3.519 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -5.907 -7.602 -3.608 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -7.321 -8.495 -2.998 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -9.813 -7.509 -0.482 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -9.219 -7.723 -2.146 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -8.626 -8.784 -0.845 1.00 0.00 H new ATOM 1272 N THR A 81 -3.486 -7.475 -1.997 1.00 0.00 N ATOM 1273 CA THR A 81 -2.310 -7.694 -2.822 1.00 0.00 C ATOM 1274 C THR A 81 -1.393 -8.729 -2.168 1.00 0.00 C ATOM 1275 O THR A 81 -0.925 -9.641 -2.843 1.00 0.00 O ATOM 1276 CB THR A 81 -1.580 -6.364 -3.053 1.00 0.00 C ATOM 1277 OG1 THR A 81 -2.483 -5.396 -3.541 1.00 0.00 O ATOM 1278 CG2 THR A 81 -0.452 -6.506 -4.077 1.00 0.00 C ATOM 0 H THR A 81 -3.569 -6.522 -1.642 1.00 0.00 H new ATOM 0 HA THR A 81 -2.615 -8.085 -3.792 1.00 0.00 H new ATOM 0 HB THR A 81 -1.160 -6.061 -2.094 1.00 0.00 H new ATOM 0 HG1 THR A 81 -2.964 -4.989 -2.790 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.040 -5.543 -4.212 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.274 -7.237 -3.720 1.00 0.00 H new ATOM 0 HG23 THR A 81 -0.865 -6.840 -5.029 1.00 0.00 H new ATOM 1286 N THR A 82 -1.127 -8.597 -0.865 1.00 0.00 N ATOM 1287 CA THR A 82 -0.259 -9.531 -0.158 1.00 0.00 C ATOM 1288 C THR A 82 -0.795 -10.956 -0.266 1.00 0.00 C ATOM 1289 O THR A 82 -0.046 -11.861 -0.625 1.00 0.00 O ATOM 1290 CB THR A 82 -0.055 -9.081 1.296 1.00 0.00 C ATOM 1291 OG1 THR A 82 0.532 -7.796 1.299 1.00 0.00 O ATOM 1292 CG2 THR A 82 0.873 -10.026 2.065 1.00 0.00 C ATOM 0 H THR A 82 -1.503 -7.850 -0.282 1.00 0.00 H new ATOM 0 HA THR A 82 0.723 -9.531 -0.630 1.00 0.00 H new ATOM 0 HB THR A 82 -1.031 -9.080 1.782 1.00 0.00 H new ATOM 0 HG1 THR A 82 -0.158 -7.121 1.133 1.00 0.00 H new ATOM 0 HG21 THR A 82 0.989 -9.669 3.088 1.00 0.00 H new ATOM 0 HG22 THR A 82 0.444 -11.028 2.076 1.00 0.00 H new ATOM 0 HG23 THR A 82 1.848 -10.054 1.578 1.00 0.00 H new ATOM 1300 N ALA A 83 -2.087 -11.159 0.009 1.00 0.00 N ATOM 1301 CA ALA A 83 -2.684 -12.481 -0.093 1.00 0.00 C ATOM 1302 C ALA A 83 -2.479 -13.037 -1.504 1.00 0.00 C ATOM 1303 O ALA A 83 -1.988 -14.152 -1.676 1.00 0.00 O ATOM 1304 CB ALA A 83 -4.172 -12.379 0.251 1.00 0.00 C ATOM 0 H ALA A 83 -2.731 -10.425 0.302 1.00 0.00 H new ATOM 0 HA ALA A 83 -2.206 -13.165 0.608 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -4.631 -13.365 0.178 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -4.285 -12.000 1.267 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -4.661 -11.699 -0.446 1.00 0.00 H new ATOM 1310 N CYS A 84 -2.768 -12.224 -2.524 1.00 0.00 N ATOM 1311 CA CYS A 84 -2.557 -12.657 -3.899 1.00 0.00 C ATOM 1312 C CYS A 84 -1.093 -13.021 -4.146 1.00 0.00 C ATOM 1313 O CYS A 84 -0.813 -14.073 -4.708 1.00 0.00 O ATOM 1314 CB CYS A 84 -3.046 -11.600 -4.883 1.00 0.00 C ATOM 1315 SG CYS A 84 -2.760 -12.234 -6.553 1.00 0.00 S ATOM 0 H CYS A 84 -3.142 -11.280 -2.423 1.00 0.00 H new ATOM 0 HA CYS A 84 -3.147 -13.559 -4.063 1.00 0.00 H new ATOM 0 HB2 CYS A 84 -4.105 -11.393 -4.728 1.00 0.00 H new ATOM 0 HB3 CYS A 84 -2.513 -10.661 -4.733 1.00 0.00 H new ATOM 0 HG CYS A 84 -3.167 -11.360 -7.425 1.00 0.00 H new ATOM 1321 N HIS A 85 -0.154 -12.185 -3.696 1.00 0.00 N ATOM 1322 CA HIS A 85 1.275 -12.426 -3.850 1.00 0.00 C ATOM 1323 C HIS A 85 1.658 -13.772 -3.233 1.00 0.00 C ATOM 1324 O HIS A 85 2.257 -14.618 -3.898 1.00 0.00 O ATOM 1325 CB HIS A 85 2.072 -11.272 -3.225 1.00 0.00 C ATOM 1326 CG HIS A 85 3.519 -11.252 -3.649 1.00 0.00 C ATOM 1327 ND1 HIS A 85 4.462 -12.223 -3.413 1.00 0.00 N ATOM 1328 CD2 HIS A 85 4.118 -10.285 -4.406 1.00 0.00 C ATOM 1329 CE1 HIS A 85 5.600 -11.847 -4.021 1.00 0.00 C ATOM 1330 NE2 HIS A 85 5.436 -10.672 -4.648 1.00 0.00 N ATOM 0 H HIS A 85 -0.371 -11.315 -3.210 1.00 0.00 H new ATOM 0 HA HIS A 85 1.520 -12.469 -4.911 1.00 0.00 H new ATOM 0 HB2 HIS A 85 1.606 -10.326 -3.501 1.00 0.00 H new ATOM 0 HB3 HIS A 85 2.019 -11.349 -2.139 1.00 0.00 H new ATOM 0 HD2 HIS A 85 3.651 -9.377 -4.757 1.00 0.00 H new ATOM 0 HE1 HIS A 85 6.520 -12.413 -4.007 1.00 0.00 H new ATOM 0 HE2 HIS A 85 6.134 -10.164 -5.192 1.00 0.00 H new ATOM 1338 N GLU A 86 1.297 -13.966 -1.962 1.00 0.00 N ATOM 1339 CA GLU A 86 1.569 -15.196 -1.233 1.00 0.00 C ATOM 1340 C GLU A 86 1.075 -16.405 -2.025 1.00 0.00 C ATOM 1341 O GLU A 86 1.817 -17.371 -2.192 1.00 0.00 O ATOM 1342 CB GLU A 86 0.903 -15.155 0.150 1.00 0.00 C ATOM 1343 CG GLU A 86 1.603 -14.171 1.097 1.00 0.00 C ATOM 1344 CD GLU A 86 0.879 -14.073 2.438 1.00 0.00 C ATOM 1345 OE1 GLU A 86 -0.286 -13.620 2.424 1.00 0.00 O ATOM 1346 OE2 GLU A 86 1.503 -14.452 3.452 1.00 0.00 O ATOM 0 H GLU A 86 0.804 -13.264 -1.410 1.00 0.00 H new ATOM 0 HA GLU A 86 2.647 -15.288 -1.097 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -0.143 -14.870 0.040 1.00 0.00 H new ATOM 0 HB3 GLU A 86 0.917 -16.153 0.589 1.00 0.00 H new ATOM 0 HG2 GLU A 86 2.632 -14.491 1.261 1.00 0.00 H new ATOM 0 HG3 GLU A 86 1.646 -13.186 0.633 1.00 0.00 H new ATOM 1353 N PHE A 87 -0.160 -16.359 -2.531 1.00 0.00 N ATOM 1354 CA PHE A 87 -0.739 -17.527 -3.189 1.00 0.00 C ATOM 1355 C PHE A 87 -0.207 -17.706 -4.606 1.00 0.00 C ATOM 1356 O PHE A 87 -0.054 -18.828 -5.080 1.00 0.00 O ATOM 1357 CB PHE A 87 -2.264 -17.449 -3.161 1.00 0.00 C ATOM 1358 CG PHE A 87 -2.854 -17.363 -1.759 1.00 0.00 C ATOM 1359 CD1 PHE A 87 -2.369 -18.188 -0.722 1.00 0.00 C ATOM 1360 CD2 PHE A 87 -3.883 -16.445 -1.484 1.00 0.00 C ATOM 1361 CE1 PHE A 87 -2.848 -18.029 0.590 1.00 0.00 C ATOM 1362 CE2 PHE A 87 -4.393 -16.319 -0.181 1.00 0.00 C ATOM 1363 CZ PHE A 87 -3.855 -17.090 0.863 1.00 0.00 C ATOM 0 H PHE A 87 -0.767 -15.540 -2.498 1.00 0.00 H new ATOM 0 HA PHE A 87 -0.433 -18.413 -2.632 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -2.584 -16.578 -3.733 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -2.672 -18.327 -3.663 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -1.628 -18.944 -0.937 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -4.284 -15.833 -2.279 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -2.441 -18.630 1.389 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -5.199 -15.629 0.018 1.00 0.00 H new ATOM 0 HZ PHE A 87 -4.215 -16.961 1.873 1.00 0.00 H new ATOM 1373 N PHE A 88 0.102 -16.596 -5.271 1.00 0.00 N ATOM 1374 CA PHE A 88 0.732 -16.591 -6.577 1.00 0.00 C ATOM 1375 C PHE A 88 2.072 -17.326 -6.499 1.00 0.00 C ATOM 1376 O PHE A 88 2.417 -18.074 -7.410 1.00 0.00 O ATOM 1377 CB PHE A 88 0.892 -15.131 -7.018 1.00 0.00 C ATOM 1378 CG PHE A 88 1.705 -14.932 -8.275 1.00 0.00 C ATOM 1379 CD1 PHE A 88 1.235 -15.455 -9.491 1.00 0.00 C ATOM 1380 CD2 PHE A 88 2.931 -14.245 -8.227 1.00 0.00 C ATOM 1381 CE1 PHE A 88 1.984 -15.273 -10.666 1.00 0.00 C ATOM 1382 CE2 PHE A 88 3.678 -14.059 -9.402 1.00 0.00 C ATOM 1383 CZ PHE A 88 3.203 -14.570 -10.623 1.00 0.00 C ATOM 0 H PHE A 88 -0.084 -15.662 -4.906 1.00 0.00 H new ATOM 0 HA PHE A 88 0.124 -17.113 -7.317 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -0.098 -14.702 -7.172 1.00 0.00 H new ATOM 0 HB3 PHE A 88 1.359 -14.571 -6.208 1.00 0.00 H new ATOM 0 HD1 PHE A 88 0.301 -15.996 -9.523 1.00 0.00 H new ATOM 0 HD2 PHE A 88 3.298 -13.860 -7.287 1.00 0.00 H new ATOM 0 HE1 PHE A 88 1.624 -15.673 -11.603 1.00 0.00 H new ATOM 0 HE2 PHE A 88 4.616 -13.524 -9.368 1.00 0.00 H new ATOM 0 HZ PHE A 88 3.774 -14.423 -11.528 1.00 0.00 H new ATOM 1442 N SER B 1 -10.630 -1.459 -14.286 1.00 0.00 N ATOM 1443 CA SER B 1 -9.665 -2.480 -13.829 1.00 0.00 C ATOM 1444 C SER B 1 -8.320 -1.882 -13.398 1.00 0.00 C ATOM 1445 O SER B 1 -7.362 -2.613 -13.169 1.00 0.00 O ATOM 1446 CB SER B 1 -9.442 -3.504 -14.938 1.00 0.00 C ATOM 1447 OG SER B 1 -10.688 -3.974 -15.419 1.00 0.00 O ATOM 0 H1 SER B 1 -11.567 -1.895 -14.402 1.00 0.00 H new ATOM 0 H2 SER B 1 -10.688 -0.696 -13.582 1.00 0.00 H new ATOM 0 H3 SER B 1 -10.315 -1.067 -15.196 1.00 0.00 H new ATOM 0 HA SER B 1 -10.096 -2.958 -12.949 1.00 0.00 H new ATOM 0 HB2 SER B 1 -8.875 -3.053 -15.752 1.00 0.00 H new ATOM 0 HB3 SER B 1 -8.850 -4.338 -14.561 1.00 0.00 H new ATOM 0 HG SER B 1 -10.537 -4.630 -16.132 1.00 0.00 H new ATOM 1455 N GLU B 2 -8.229 -0.555 -13.311 1.00 0.00 N ATOM 1456 CA GLU B 2 -6.978 0.149 -13.067 1.00 0.00 C ATOM 1457 C GLU B 2 -6.286 -0.368 -11.806 1.00 0.00 C ATOM 1458 O GLU B 2 -5.100 -0.688 -11.830 1.00 0.00 O ATOM 1459 CB GLU B 2 -7.246 1.655 -12.959 1.00 0.00 C ATOM 1460 CG GLU B 2 -7.925 2.249 -14.200 1.00 0.00 C ATOM 1461 CD GLU B 2 -7.195 1.882 -15.487 1.00 0.00 C ATOM 1462 OE1 GLU B 2 -6.126 2.485 -15.723 1.00 0.00 O ATOM 1463 OE2 GLU B 2 -7.706 0.988 -16.195 1.00 0.00 O ATOM 0 H GLU B 2 -9.033 0.065 -13.410 1.00 0.00 H new ATOM 0 HA GLU B 2 -6.308 -0.036 -13.906 1.00 0.00 H new ATOM 0 HB2 GLU B 2 -7.873 1.842 -12.087 1.00 0.00 H new ATOM 0 HB3 GLU B 2 -6.302 2.172 -12.789 1.00 0.00 H new ATOM 0 HG2 GLU B 2 -8.954 1.894 -14.254 1.00 0.00 H new ATOM 0 HG3 GLU B 2 -7.967 3.334 -14.105 1.00 0.00 H new ATOM 1470 N LEU B 3 -7.036 -0.461 -10.706 1.00 0.00 N ATOM 1471 CA LEU B 3 -6.495 -0.979 -9.458 1.00 0.00 C ATOM 1472 C LEU B 3 -6.019 -2.416 -9.644 1.00 0.00 C ATOM 1473 O LEU B 3 -4.890 -2.721 -9.288 1.00 0.00 O ATOM 1474 CB LEU B 3 -7.503 -0.883 -8.310 1.00 0.00 C ATOM 1475 CG LEU B 3 -7.991 0.542 -8.013 1.00 0.00 C ATOM 1476 CD1 LEU B 3 -8.806 0.480 -6.723 1.00 0.00 C ATOM 1477 CD2 LEU B 3 -6.863 1.562 -7.853 1.00 0.00 C ATOM 0 H LEU B 3 -8.017 -0.184 -10.659 1.00 0.00 H new ATOM 0 HA LEU B 3 -5.642 -0.357 -9.186 1.00 0.00 H new ATOM 0 HB2 LEU B 3 -8.365 -1.507 -8.546 1.00 0.00 H new ATOM 0 HB3 LEU B 3 -7.049 -1.294 -7.408 1.00 0.00 H new ATOM 0 HG LEU B 3 -8.579 0.882 -8.865 1.00 0.00 H new ATOM 0 HD11 LEU B 3 -9.172 1.476 -6.476 1.00 0.00 H new ATOM 0 HD12 LEU B 3 -9.652 -0.194 -6.859 1.00 0.00 H new ATOM 0 HD13 LEU B 3 -8.176 0.114 -5.912 1.00 0.00 H new ATOM 0 HD21 LEU B 3 -7.287 2.544 -7.645 1.00 0.00 H new ATOM 0 HD22 LEU B 3 -6.217 1.264 -7.027 1.00 0.00 H new ATOM 0 HD23 LEU B 3 -6.279 1.606 -8.772 1.00 0.00 H new ATOM 1489 N GLU B 4 -6.850 -3.293 -10.210 1.00 0.00 N ATOM 1490 CA GLU B 4 -6.462 -4.666 -10.520 1.00 0.00 C ATOM 1491 C GLU B 4 -5.125 -4.704 -11.277 1.00 0.00 C ATOM 1492 O GLU B 4 -4.234 -5.482 -10.937 1.00 0.00 O ATOM 1493 CB GLU B 4 -7.615 -5.331 -11.290 1.00 0.00 C ATOM 1494 CG GLU B 4 -7.454 -6.834 -11.540 1.00 0.00 C ATOM 1495 CD GLU B 4 -6.461 -7.188 -12.644 1.00 0.00 C ATOM 1496 OE1 GLU B 4 -6.496 -6.500 -13.687 1.00 0.00 O ATOM 1497 OE2 GLU B 4 -5.705 -8.159 -12.432 1.00 0.00 O ATOM 0 H GLU B 4 -7.812 -3.069 -10.466 1.00 0.00 H new ATOM 0 HA GLU B 4 -6.291 -5.232 -9.605 1.00 0.00 H new ATOM 0 HB2 GLU B 4 -8.540 -5.168 -10.738 1.00 0.00 H new ATOM 0 HB3 GLU B 4 -7.725 -4.829 -12.251 1.00 0.00 H new ATOM 0 HG2 GLU B 4 -7.134 -7.312 -10.614 1.00 0.00 H new ATOM 0 HG3 GLU B 4 -8.427 -7.254 -11.795 1.00 0.00 H new ATOM 1504 N LYS B 5 -4.974 -3.851 -12.292 1.00 0.00 N ATOM 1505 CA LYS B 5 -3.768 -3.807 -13.107 1.00 0.00 C ATOM 1506 C LYS B 5 -2.574 -3.342 -12.276 1.00 0.00 C ATOM 1507 O LYS B 5 -1.534 -3.997 -12.261 1.00 0.00 O ATOM 1508 CB LYS B 5 -3.981 -2.951 -14.362 1.00 0.00 C ATOM 1509 CG LYS B 5 -4.993 -3.580 -15.332 1.00 0.00 C ATOM 1510 CD LYS B 5 -4.492 -4.904 -15.932 1.00 0.00 C ATOM 1511 CE LYS B 5 -5.442 -5.427 -17.016 1.00 0.00 C ATOM 1512 NZ LYS B 5 -6.791 -5.680 -16.480 1.00 0.00 N ATOM 0 H LYS B 5 -5.685 -3.174 -12.568 1.00 0.00 H new ATOM 0 HA LYS B 5 -3.543 -4.816 -13.453 1.00 0.00 H new ATOM 0 HB2 LYS B 5 -4.329 -1.961 -14.069 1.00 0.00 H new ATOM 0 HB3 LYS B 5 -3.028 -2.815 -14.873 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -5.933 -3.755 -14.808 1.00 0.00 H new ATOM 0 HG3 LYS B 5 -5.204 -2.877 -16.138 1.00 0.00 H new ATOM 0 HD2 LYS B 5 -3.499 -4.759 -16.357 1.00 0.00 H new ATOM 0 HD3 LYS B 5 -4.395 -5.649 -15.142 1.00 0.00 H new ATOM 0 HE2 LYS B 5 -5.503 -4.702 -17.828 1.00 0.00 H new ATOM 0 HE3 LYS B 5 -5.040 -6.347 -17.440 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 -7.250 -6.430 -17.035 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 -6.719 -5.979 -15.486 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 -7.357 -4.810 -16.540 1.00 0.00 H new ATOM 1526 N ALA B 6 -2.730 -2.228 -11.560 1.00 0.00 N ATOM 1527 CA ALA B 6 -1.721 -1.728 -10.640 1.00 0.00 C ATOM 1528 C ALA B 6 -1.279 -2.833 -9.673 1.00 0.00 C ATOM 1529 O ALA B 6 -0.092 -3.095 -9.513 1.00 0.00 O ATOM 1530 CB ALA B 6 -2.296 -0.520 -9.898 1.00 0.00 C ATOM 0 H ALA B 6 -3.567 -1.647 -11.606 1.00 0.00 H new ATOM 0 HA ALA B 6 -0.833 -1.416 -11.189 1.00 0.00 H new ATOM 0 HB1 ALA B 6 -1.552 -0.132 -9.203 1.00 0.00 H new ATOM 0 HB2 ALA B 6 -2.561 0.256 -10.616 1.00 0.00 H new ATOM 0 HB3 ALA B 6 -3.186 -0.822 -9.345 1.00 0.00 H new ATOM 1536 N VAL B 7 -2.245 -3.508 -9.053 1.00 0.00 N ATOM 1537 CA VAL B 7 -2.032 -4.605 -8.124 1.00 0.00 C ATOM 1538 C VAL B 7 -1.177 -5.700 -8.773 1.00 0.00 C ATOM 1539 O VAL B 7 -0.117 -6.038 -8.239 1.00 0.00 O ATOM 1540 CB VAL B 7 -3.410 -5.085 -7.623 1.00 0.00 C ATOM 1541 CG1 VAL B 7 -3.405 -6.490 -7.021 1.00 0.00 C ATOM 1542 CG2 VAL B 7 -3.953 -4.104 -6.575 1.00 0.00 C ATOM 0 H VAL B 7 -3.233 -3.294 -9.192 1.00 0.00 H new ATOM 0 HA VAL B 7 -1.462 -4.285 -7.252 1.00 0.00 H new ATOM 0 HB VAL B 7 -4.047 -5.122 -8.506 1.00 0.00 H new ATOM 0 HG11 VAL B 7 -4.412 -6.749 -6.694 1.00 0.00 H new ATOM 0 HG12 VAL B 7 -3.071 -7.206 -7.772 1.00 0.00 H new ATOM 0 HG13 VAL B 7 -2.728 -6.518 -6.167 1.00 0.00 H new ATOM 0 HG21 VAL B 7 -4.926 -4.448 -6.225 1.00 0.00 H new ATOM 0 HG22 VAL B 7 -3.262 -4.051 -5.733 1.00 0.00 H new ATOM 0 HG23 VAL B 7 -4.057 -3.115 -7.022 1.00 0.00 H new ATOM 1552 N VAL B 8 -1.583 -6.247 -9.927 1.00 0.00 N ATOM 1553 CA VAL B 8 -0.768 -7.297 -10.531 1.00 0.00 C ATOM 1554 C VAL B 8 0.596 -6.752 -10.967 1.00 0.00 C ATOM 1555 O VAL B 8 1.583 -7.479 -10.889 1.00 0.00 O ATOM 1556 CB VAL B 8 -1.496 -8.090 -11.628 1.00 0.00 C ATOM 1557 CG1 VAL B 8 -2.742 -8.779 -11.055 1.00 0.00 C ATOM 1558 CG2 VAL B 8 -1.876 -7.244 -12.841 1.00 0.00 C ATOM 0 H VAL B 8 -2.429 -5.993 -10.437 1.00 0.00 H new ATOM 0 HA VAL B 8 -0.580 -8.039 -9.755 1.00 0.00 H new ATOM 0 HB VAL B 8 -0.788 -8.839 -11.981 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -3.246 -9.336 -11.845 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -2.446 -9.464 -10.260 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -3.421 -8.027 -10.652 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -2.386 -7.868 -13.575 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -2.538 -6.437 -12.528 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -0.975 -6.822 -13.287 1.00 0.00 H new ATOM 1568 N ALA B 9 0.686 -5.479 -11.370 1.00 0.00 N ATOM 1569 CA ALA B 9 1.971 -4.853 -11.653 1.00 0.00 C ATOM 1570 C ALA B 9 2.874 -4.869 -10.415 1.00 0.00 C ATOM 1571 O ALA B 9 4.023 -5.293 -10.514 1.00 0.00 O ATOM 1572 CB ALA B 9 1.795 -3.439 -12.214 1.00 0.00 C ATOM 0 H ALA B 9 -0.119 -4.867 -11.506 1.00 0.00 H new ATOM 0 HA ALA B 9 2.466 -5.441 -12.426 1.00 0.00 H new ATOM 0 HB1 ALA B 9 2.774 -3.002 -12.413 1.00 0.00 H new ATOM 0 HB2 ALA B 9 1.222 -3.484 -13.140 1.00 0.00 H new ATOM 0 HB3 ALA B 9 1.264 -2.823 -11.488 1.00 0.00 H new ATOM 1578 N LEU B 10 2.372 -4.451 -9.246 1.00 0.00 N ATOM 1579 CA LEU B 10 3.142 -4.504 -8.003 1.00 0.00 C ATOM 1580 C LEU B 10 3.636 -5.930 -7.752 1.00 0.00 C ATOM 1581 O LEU B 10 4.822 -6.131 -7.480 1.00 0.00 O ATOM 1582 CB LEU B 10 2.308 -4.021 -6.802 1.00 0.00 C ATOM 1583 CG LEU B 10 1.906 -2.536 -6.831 1.00 0.00 C ATOM 1584 CD1 LEU B 10 0.973 -2.249 -5.649 1.00 0.00 C ATOM 1585 CD2 LEU B 10 3.116 -1.600 -6.753 1.00 0.00 C ATOM 0 H LEU B 10 1.431 -4.071 -9.138 1.00 0.00 H new ATOM 0 HA LEU B 10 3.997 -3.836 -8.111 1.00 0.00 H new ATOM 0 HB2 LEU B 10 1.402 -4.624 -6.745 1.00 0.00 H new ATOM 0 HB3 LEU B 10 2.874 -4.209 -5.890 1.00 0.00 H new ATOM 0 HG LEU B 10 1.406 -2.348 -7.781 1.00 0.00 H new ATOM 0 HD11 LEU B 10 0.683 -1.198 -5.661 1.00 0.00 H new ATOM 0 HD12 LEU B 10 0.082 -2.872 -5.729 1.00 0.00 H new ATOM 0 HD13 LEU B 10 1.489 -2.472 -4.715 1.00 0.00 H new ATOM 0 HD21 LEU B 10 2.777 -0.564 -6.777 1.00 0.00 H new ATOM 0 HD22 LEU B 10 3.658 -1.783 -5.825 1.00 0.00 H new ATOM 0 HD23 LEU B 10 3.775 -1.786 -7.601 1.00 0.00 H new ATOM 1597 N ILE B 11 2.739 -6.918 -7.853 1.00 0.00 N ATOM 1598 CA ILE B 11 3.124 -8.310 -7.639 1.00 0.00 C ATOM 1599 C ILE B 11 4.220 -8.718 -8.627 1.00 0.00 C ATOM 1600 O ILE B 11 5.263 -9.218 -8.215 1.00 0.00 O ATOM 1601 CB ILE B 11 1.894 -9.244 -7.675 1.00 0.00 C ATOM 1602 CG1 ILE B 11 0.972 -8.899 -6.490 1.00 0.00 C ATOM 1603 CG2 ILE B 11 2.301 -10.728 -7.622 1.00 0.00 C ATOM 1604 CD1 ILE B 11 -0.244 -9.817 -6.354 1.00 0.00 C ATOM 0 H ILE B 11 1.754 -6.778 -8.079 1.00 0.00 H new ATOM 0 HA ILE B 11 3.546 -8.411 -6.639 1.00 0.00 H new ATOM 0 HB ILE B 11 1.368 -9.090 -8.617 1.00 0.00 H new ATOM 0 HG12 ILE B 11 1.552 -8.944 -5.568 1.00 0.00 H new ATOM 0 HG13 ILE B 11 0.627 -7.871 -6.600 1.00 0.00 H new ATOM 0 HG21 ILE B 11 1.407 -11.352 -7.649 1.00 0.00 H new ATOM 0 HG22 ILE B 11 2.934 -10.963 -8.478 1.00 0.00 H new ATOM 0 HG23 ILE B 11 2.851 -10.922 -6.701 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -0.840 -9.506 -5.496 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -0.849 -9.755 -7.258 1.00 0.00 H new ATOM 0 HD13 ILE B 11 0.090 -10.845 -6.210 1.00 0.00 H new ATOM 1616 N ASP B 12 4.006 -8.487 -9.922 1.00 0.00 N ATOM 1617 CA ASP B 12 4.942 -8.879 -10.967 1.00 0.00 C ATOM 1618 C ASP B 12 6.314 -8.237 -10.746 1.00 0.00 C ATOM 1619 O ASP B 12 7.331 -8.929 -10.740 1.00 0.00 O ATOM 1620 CB ASP B 12 4.379 -8.491 -12.338 1.00 0.00 C ATOM 1621 CG ASP B 12 5.371 -8.834 -13.445 1.00 0.00 C ATOM 1622 OD1 ASP B 12 5.402 -10.022 -13.831 1.00 0.00 O ATOM 1623 OD2 ASP B 12 6.096 -7.908 -13.865 1.00 0.00 O ATOM 0 H ASP B 12 3.171 -8.019 -10.275 1.00 0.00 H new ATOM 0 HA ASP B 12 5.073 -9.960 -10.929 1.00 0.00 H new ATOM 0 HB2 ASP B 12 3.438 -9.013 -12.511 1.00 0.00 H new ATOM 0 HB3 ASP B 12 4.159 -7.424 -12.358 1.00 0.00 H new ATOM 1628 N VAL B 13 6.334 -6.916 -10.562 1.00 0.00 N ATOM 1629 CA VAL B 13 7.557 -6.164 -10.329 1.00 0.00 C ATOM 1630 C VAL B 13 8.280 -6.745 -9.117 1.00 0.00 C ATOM 1631 O VAL B 13 9.446 -7.123 -9.213 1.00 0.00 O ATOM 1632 CB VAL B 13 7.229 -4.672 -10.151 1.00 0.00 C ATOM 1633 CG1 VAL B 13 8.430 -3.878 -9.626 1.00 0.00 C ATOM 1634 CG2 VAL B 13 6.819 -4.066 -11.495 1.00 0.00 C ATOM 0 H VAL B 13 5.493 -6.338 -10.571 1.00 0.00 H new ATOM 0 HA VAL B 13 8.222 -6.247 -11.188 1.00 0.00 H new ATOM 0 HB VAL B 13 6.418 -4.610 -9.426 1.00 0.00 H new ATOM 0 HG11 VAL B 13 8.153 -2.830 -9.516 1.00 0.00 H new ATOM 0 HG12 VAL B 13 8.735 -4.277 -8.658 1.00 0.00 H new ATOM 0 HG13 VAL B 13 9.258 -3.962 -10.330 1.00 0.00 H new ATOM 0 HG21 VAL B 13 6.588 -3.009 -11.362 1.00 0.00 H new ATOM 0 HG22 VAL B 13 7.638 -4.172 -12.207 1.00 0.00 H new ATOM 0 HG23 VAL B 13 5.939 -4.585 -11.875 1.00 0.00 H new ATOM 1644 N PHE B 14 7.595 -6.827 -7.975 1.00 0.00 N ATOM 1645 CA PHE B 14 8.222 -7.358 -6.779 1.00 0.00 C ATOM 1646 C PHE B 14 8.792 -8.749 -7.050 1.00 0.00 C ATOM 1647 O PHE B 14 9.964 -9.000 -6.773 1.00 0.00 O ATOM 1648 CB PHE B 14 7.234 -7.384 -5.617 1.00 0.00 C ATOM 1649 CG PHE B 14 7.896 -7.768 -4.309 1.00 0.00 C ATOM 1650 CD1 PHE B 14 8.117 -9.123 -3.997 1.00 0.00 C ATOM 1651 CD2 PHE B 14 8.220 -6.778 -3.364 1.00 0.00 C ATOM 1652 CE1 PHE B 14 8.554 -9.493 -2.716 1.00 0.00 C ATOM 1653 CE2 PHE B 14 8.649 -7.151 -2.079 1.00 0.00 C ATOM 1654 CZ PHE B 14 8.778 -8.508 -1.743 1.00 0.00 C ATOM 0 H PHE B 14 6.624 -6.537 -7.860 1.00 0.00 H new ATOM 0 HA PHE B 14 9.047 -6.702 -6.499 1.00 0.00 H new ATOM 0 HB2 PHE B 14 6.772 -6.402 -5.514 1.00 0.00 H new ATOM 0 HB3 PHE B 14 6.434 -8.091 -5.838 1.00 0.00 H new ATOM 0 HD1 PHE B 14 7.949 -9.881 -4.747 1.00 0.00 H new ATOM 0 HD2 PHE B 14 8.139 -5.733 -3.625 1.00 0.00 H new ATOM 0 HE1 PHE B 14 8.718 -10.534 -2.480 1.00 0.00 H new ATOM 0 HE2 PHE B 14 8.880 -6.391 -1.347 1.00 0.00 H new ATOM 0 HZ PHE B 14 9.049 -8.793 -0.737 1.00 0.00 H new ATOM 1664 N HIS B 15 7.973 -9.646 -7.607 1.00 0.00 N ATOM 1665 CA HIS B 15 8.357 -11.017 -7.910 1.00 0.00 C ATOM 1666 C HIS B 15 9.640 -11.035 -8.746 1.00 0.00 C ATOM 1667 O HIS B 15 10.576 -11.771 -8.434 1.00 0.00 O ATOM 1668 CB HIS B 15 7.202 -11.737 -8.614 1.00 0.00 C ATOM 1669 CG HIS B 15 7.485 -13.195 -8.865 1.00 0.00 C ATOM 1670 ND1 HIS B 15 7.762 -13.769 -10.084 1.00 0.00 N ATOM 1671 CD2 HIS B 15 7.531 -14.184 -7.919 1.00 0.00 C ATOM 1672 CE1 HIS B 15 7.965 -15.081 -9.874 1.00 0.00 C ATOM 1673 NE2 HIS B 15 7.837 -15.383 -8.571 1.00 0.00 N ATOM 0 H HIS B 15 7.009 -9.430 -7.862 1.00 0.00 H new ATOM 0 HA HIS B 15 8.566 -11.552 -6.984 1.00 0.00 H new ATOM 0 HB2 HIS B 15 6.301 -11.646 -8.008 1.00 0.00 H new ATOM 0 HB3 HIS B 15 6.998 -11.243 -9.564 1.00 0.00 H new ATOM 0 HD1 HIS B 15 7.805 -13.288 -10.982 1.00 0.00 H new ATOM 0 HD2 HIS B 15 7.361 -14.060 -6.860 1.00 0.00 H new ATOM 0 HE1 HIS B 15 8.199 -15.796 -10.648 1.00 0.00 H new ATOM 1681 N GLN B 16 9.693 -10.197 -9.788 1.00 0.00 N ATOM 1682 CA GLN B 16 10.855 -10.090 -10.656 1.00 0.00 C ATOM 1683 C GLN B 16 12.130 -9.865 -9.838 1.00 0.00 C ATOM 1684 O GLN B 16 13.096 -10.594 -10.032 1.00 0.00 O ATOM 1685 CB GLN B 16 10.632 -8.960 -11.677 1.00 0.00 C ATOM 1686 CG GLN B 16 11.742 -8.871 -12.733 1.00 0.00 C ATOM 1687 CD GLN B 16 11.556 -7.645 -13.623 1.00 0.00 C ATOM 1688 OE1 GLN B 16 12.376 -6.732 -13.618 1.00 0.00 O ATOM 1689 NE2 GLN B 16 10.470 -7.603 -14.389 1.00 0.00 N ATOM 0 H GLN B 16 8.926 -9.576 -10.047 1.00 0.00 H new ATOM 0 HA GLN B 16 10.984 -11.027 -11.198 1.00 0.00 H new ATOM 0 HB2 GLN B 16 9.676 -9.114 -12.177 1.00 0.00 H new ATOM 0 HB3 GLN B 16 10.566 -8.009 -11.148 1.00 0.00 H new ATOM 0 HG2 GLN B 16 12.713 -8.823 -12.241 1.00 0.00 H new ATOM 0 HG3 GLN B 16 11.739 -9.773 -13.345 1.00 0.00 H new ATOM 0 HE21 GLN B 16 9.805 -8.376 -14.373 1.00 0.00 H new ATOM 0 HE22 GLN B 16 10.302 -6.798 -14.992 1.00 0.00 H new ATOM 1698 N TYR B 17 12.143 -8.881 -8.932 1.00 0.00 N ATOM 1699 CA TYR B 17 13.329 -8.569 -8.129 1.00 0.00 C ATOM 1700 C TYR B 17 13.574 -9.584 -7.003 1.00 0.00 C ATOM 1701 O TYR B 17 14.672 -10.121 -6.857 1.00 0.00 O ATOM 1702 CB TYR B 17 13.266 -7.128 -7.615 1.00 0.00 C ATOM 1703 CG TYR B 17 13.453 -6.093 -8.709 1.00 0.00 C ATOM 1704 CD1 TYR B 17 14.744 -5.754 -9.158 1.00 0.00 C ATOM 1705 CD2 TYR B 17 12.335 -5.480 -9.295 1.00 0.00 C ATOM 1706 CE1 TYR B 17 14.907 -4.791 -10.171 1.00 0.00 C ATOM 1707 CE2 TYR B 17 12.497 -4.517 -10.303 1.00 0.00 C ATOM 1708 CZ TYR B 17 13.783 -4.169 -10.740 1.00 0.00 C ATOM 1709 OH TYR B 17 13.944 -3.178 -11.663 1.00 0.00 O ATOM 0 H TYR B 17 11.340 -8.284 -8.736 1.00 0.00 H new ATOM 0 HA TYR B 17 14.196 -8.653 -8.784 1.00 0.00 H new ATOM 0 HB2 TYR B 17 12.304 -6.964 -7.130 1.00 0.00 H new ATOM 0 HB3 TYR B 17 14.034 -6.986 -6.855 1.00 0.00 H new ATOM 0 HD1 TYR B 17 15.609 -6.233 -8.725 1.00 0.00 H new ATOM 0 HD2 TYR B 17 11.342 -5.751 -8.968 1.00 0.00 H new ATOM 0 HE1 TYR B 17 15.898 -4.530 -10.512 1.00 0.00 H new ATOM 0 HE2 TYR B 17 11.631 -4.044 -10.742 1.00 0.00 H new ATOM 0 HH TYR B 17 13.066 -2.890 -11.990 1.00 0.00 H new ATOM 1719 N SER B 18 12.554 -9.856 -6.188 1.00 0.00 N ATOM 1720 CA SER B 18 12.636 -10.813 -5.085 1.00 0.00 C ATOM 1721 C SER B 18 13.145 -12.183 -5.548 1.00 0.00 C ATOM 1722 O SER B 18 13.849 -12.855 -4.796 1.00 0.00 O ATOM 1723 CB SER B 18 11.278 -10.939 -4.406 1.00 0.00 C ATOM 1724 OG SER B 18 10.308 -11.319 -5.353 1.00 0.00 O ATOM 0 H SER B 18 11.639 -9.414 -6.276 1.00 0.00 H new ATOM 0 HA SER B 18 13.361 -10.433 -4.365 1.00 0.00 H new ATOM 0 HB2 SER B 18 11.328 -11.677 -3.606 1.00 0.00 H new ATOM 0 HB3 SER B 18 11.000 -9.990 -3.947 1.00 0.00 H new ATOM 0 HG SER B 18 10.063 -10.543 -5.899 1.00 0.00 H new ATOM 1730 N GLY B 19 12.822 -12.589 -6.783 1.00 0.00 N ATOM 1731 CA GLY B 19 13.250 -13.866 -7.325 1.00 0.00 C ATOM 1732 C GLY B 19 14.767 -13.933 -7.479 1.00 0.00 C ATOM 1733 O GLY B 19 15.333 -15.023 -7.506 1.00 0.00 O ATOM 0 H GLY B 19 12.257 -12.035 -7.427 1.00 0.00 H new ATOM 0 HA2 GLY B 19 12.915 -14.670 -6.670 1.00 0.00 H new ATOM 0 HA3 GLY B 19 12.778 -14.027 -8.294 1.00 0.00 H new ATOM 1737 N ARG B 20 15.421 -12.776 -7.609 1.00 0.00 N ATOM 1738 CA ARG B 20 16.845 -12.702 -7.866 1.00 0.00 C ATOM 1739 C ARG B 20 17.609 -12.949 -6.568 1.00 0.00 C ATOM 1740 O ARG B 20 18.468 -13.826 -6.528 1.00 0.00 O ATOM 1741 CB ARG B 20 17.205 -11.362 -8.521 1.00 0.00 C ATOM 1742 CG ARG B 20 16.180 -10.999 -9.606 1.00 0.00 C ATOM 1743 CD ARG B 20 16.534 -9.770 -10.453 1.00 0.00 C ATOM 1744 NE ARG B 20 17.945 -9.729 -10.864 1.00 0.00 N ATOM 1745 CZ ARG B 20 18.872 -8.905 -10.349 1.00 0.00 C ATOM 1746 NH1 ARG B 20 18.626 -8.192 -9.243 1.00 0.00 N ATOM 1747 NH2 ARG B 20 20.058 -8.793 -10.952 1.00 0.00 N ATOM 0 H ARG B 20 14.968 -11.865 -7.537 1.00 0.00 H new ATOM 0 HA ARG B 20 17.136 -13.479 -8.573 1.00 0.00 H new ATOM 0 HB2 ARG B 20 17.235 -10.578 -7.765 1.00 0.00 H new ATOM 0 HB3 ARG B 20 18.201 -11.421 -8.959 1.00 0.00 H new ATOM 0 HG2 ARG B 20 16.058 -11.855 -10.270 1.00 0.00 H new ATOM 0 HG3 ARG B 20 15.215 -10.826 -9.129 1.00 0.00 H new ATOM 0 HD2 ARG B 20 15.904 -9.758 -11.342 1.00 0.00 H new ATOM 0 HD3 ARG B 20 16.302 -8.868 -9.886 1.00 0.00 H new ATOM 0 HE ARG B 20 18.242 -10.375 -11.595 1.00 0.00 H new ATOM 0 HH11 ARG B 20 17.722 -8.269 -8.777 1.00 0.00 H new ATOM 0 HH12 ARG B 20 19.342 -7.571 -8.866 1.00 0.00 H new ATOM 0 HH21 ARG B 20 20.254 -9.331 -11.796 1.00 0.00 H new ATOM 0 HH22 ARG B 20 20.768 -8.170 -10.568 1.00 0.00 H new ATOM 1761 N GLU B 21 17.290 -12.197 -5.505 1.00 0.00 N ATOM 1762 CA GLU B 21 17.845 -12.449 -4.180 1.00 0.00 C ATOM 1763 C GLU B 21 16.803 -12.157 -3.092 1.00 0.00 C ATOM 1764 O GLU B 21 16.570 -11.003 -2.731 1.00 0.00 O ATOM 1765 CB GLU B 21 19.126 -11.632 -3.947 1.00 0.00 C ATOM 1766 CG GLU B 21 20.202 -11.800 -5.029 1.00 0.00 C ATOM 1767 CD GLU B 21 21.486 -11.058 -4.671 1.00 0.00 C ATOM 1768 OE1 GLU B 21 21.372 -9.934 -4.132 1.00 0.00 O ATOM 1769 OE2 GLU B 21 22.566 -11.632 -4.929 1.00 0.00 O ATOM 0 H GLU B 21 16.646 -11.407 -5.544 1.00 0.00 H new ATOM 0 HA GLU B 21 18.112 -13.504 -4.124 1.00 0.00 H new ATOM 0 HB2 GLU B 21 18.860 -10.577 -3.879 1.00 0.00 H new ATOM 0 HB3 GLU B 21 19.551 -11.916 -2.984 1.00 0.00 H new ATOM 0 HG2 GLU B 21 20.420 -12.859 -5.164 1.00 0.00 H new ATOM 0 HG3 GLU B 21 19.821 -11.429 -5.981 1.00 0.00 H new ATOM 1776 N GLY B 22 16.230 -13.217 -2.523 1.00 0.00 N ATOM 1777 CA GLY B 22 15.270 -13.162 -1.437 1.00 0.00 C ATOM 1778 C GLY B 22 14.477 -14.464 -1.457 1.00 0.00 C ATOM 1779 O GLY B 22 14.486 -15.172 -2.463 1.00 0.00 O ATOM 0 H GLY B 22 16.434 -14.171 -2.822 1.00 0.00 H new ATOM 0 HA2 GLY B 22 15.779 -13.039 -0.481 1.00 0.00 H new ATOM 0 HA3 GLY B 22 14.605 -12.307 -1.557 1.00 0.00 H new ATOM 1783 N ASP B 23 13.782 -14.801 -0.367 1.00 0.00 N ATOM 1784 CA ASP B 23 13.012 -16.040 -0.274 1.00 0.00 C ATOM 1785 C ASP B 23 11.669 -15.903 -1.006 1.00 0.00 C ATOM 1786 O ASP B 23 10.622 -16.252 -0.459 1.00 0.00 O ATOM 1787 CB ASP B 23 12.836 -16.402 1.210 1.00 0.00 C ATOM 1788 CG ASP B 23 12.130 -17.743 1.415 1.00 0.00 C ATOM 1789 OD1 ASP B 23 12.456 -18.683 0.659 1.00 0.00 O ATOM 1790 OD2 ASP B 23 11.282 -17.803 2.332 1.00 0.00 O ATOM 0 H ASP B 23 13.739 -14.223 0.472 1.00 0.00 H new ATOM 0 HA ASP B 23 13.547 -16.852 -0.766 1.00 0.00 H new ATOM 0 HB2 ASP B 23 13.814 -16.435 1.689 1.00 0.00 H new ATOM 0 HB3 ASP B 23 12.265 -15.617 1.705 1.00 0.00 H new ATOM 1795 N LYS B 24 11.691 -15.353 -2.229 1.00 0.00 N ATOM 1796 CA LYS B 24 10.550 -15.035 -3.090 1.00 0.00 C ATOM 1797 C LYS B 24 9.624 -13.947 -2.521 1.00 0.00 C ATOM 1798 O LYS B 24 9.219 -13.033 -3.231 1.00 0.00 O ATOM 1799 CB LYS B 24 9.776 -16.302 -3.486 1.00 0.00 C ATOM 1800 CG LYS B 24 10.643 -17.404 -4.113 1.00 0.00 C ATOM 1801 CD LYS B 24 11.400 -16.971 -5.381 1.00 0.00 C ATOM 1802 CE LYS B 24 10.512 -16.322 -6.453 1.00 0.00 C ATOM 1803 NZ LYS B 24 9.355 -17.164 -6.808 1.00 0.00 N ATOM 0 H LYS B 24 12.575 -15.101 -2.672 1.00 0.00 H new ATOM 0 HA LYS B 24 10.973 -14.602 -3.997 1.00 0.00 H new ATOM 0 HB2 LYS B 24 9.283 -16.704 -2.601 1.00 0.00 H new ATOM 0 HB3 LYS B 24 8.991 -16.028 -4.191 1.00 0.00 H new ATOM 0 HG2 LYS B 24 11.365 -17.747 -3.372 1.00 0.00 H new ATOM 0 HG3 LYS B 24 10.007 -18.255 -4.357 1.00 0.00 H new ATOM 0 HD2 LYS B 24 12.184 -16.268 -5.100 1.00 0.00 H new ATOM 0 HD3 LYS B 24 11.893 -17.843 -5.812 1.00 0.00 H new ATOM 0 HE2 LYS B 24 10.158 -15.356 -6.092 1.00 0.00 H new ATOM 0 HE3 LYS B 24 11.106 -16.130 -7.346 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 8.843 -16.733 -7.604 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 9.686 -18.111 -7.081 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 8.718 -17.242 -5.989 1.00 0.00 H new ATOM 1817 N HIS B 25 9.281 -14.021 -1.237 1.00 0.00 N ATOM 1818 CA HIS B 25 8.335 -13.137 -0.580 1.00 0.00 C ATOM 1819 C HIS B 25 9.023 -11.866 -0.075 1.00 0.00 C ATOM 1820 O HIS B 25 8.354 -11.036 0.542 1.00 0.00 O ATOM 1821 CB HIS B 25 7.725 -13.888 0.617 1.00 0.00 C ATOM 1822 CG HIS B 25 7.130 -15.240 0.299 1.00 0.00 C ATOM 1823 ND1 HIS B 25 7.826 -16.398 0.016 1.00 0.00 N ATOM 1824 CD2 HIS B 25 5.798 -15.556 0.308 1.00 0.00 C ATOM 1825 CE1 HIS B 25 6.924 -17.376 -0.170 1.00 0.00 C ATOM 1826 NE2 HIS B 25 5.675 -16.914 -0.002 1.00 0.00 N ATOM 0 H HIS B 25 9.670 -14.724 -0.608 1.00 0.00 H new ATOM 0 HA HIS B 25 7.566 -12.846 -1.295 1.00 0.00 H new ATOM 0 HB2 HIS B 25 8.498 -14.019 1.374 1.00 0.00 H new ATOM 0 HB3 HIS B 25 6.949 -13.263 1.059 1.00 0.00 H new ATOM 0 HD1 HIS B 25 8.840 -16.494 -0.041 1.00 0.00 H new ATOM 0 HD2 HIS B 25 4.985 -14.876 0.518 1.00 0.00 H new ATOM 0 HE1 HIS B 25 7.171 -18.397 -0.421 1.00 0.00 H new ATOM 1834 N LYS B 26 10.342 -11.717 -0.279 1.00 0.00 N ATOM 1835 CA LYS B 26 11.120 -10.669 0.361 1.00 0.00 C ATOM 1836 C LYS B 26 12.196 -10.109 -0.571 1.00 0.00 C ATOM 1837 O LYS B 26 12.524 -10.733 -1.578 1.00 0.00 O ATOM 1838 CB LYS B 26 11.741 -11.207 1.661 1.00 0.00 C ATOM 1839 CG LYS B 26 10.827 -12.154 2.462 1.00 0.00 C ATOM 1840 CD LYS B 26 11.425 -12.463 3.836 1.00 0.00 C ATOM 1841 CE LYS B 26 10.474 -13.318 4.678 1.00 0.00 C ATOM 1842 NZ LYS B 26 11.017 -13.525 6.031 1.00 0.00 N ATOM 0 H LYS B 26 10.888 -12.323 -0.892 1.00 0.00 H new ATOM 0 HA LYS B 26 10.450 -9.843 0.600 1.00 0.00 H new ATOM 0 HB2 LYS B 26 12.664 -11.733 1.417 1.00 0.00 H new ATOM 0 HB3 LYS B 26 12.013 -10.363 2.295 1.00 0.00 H new ATOM 0 HG2 LYS B 26 9.844 -11.699 2.583 1.00 0.00 H new ATOM 0 HG3 LYS B 26 10.683 -13.081 1.907 1.00 0.00 H new ATOM 0 HD2 LYS B 26 12.374 -12.985 3.713 1.00 0.00 H new ATOM 0 HD3 LYS B 26 11.639 -11.531 4.359 1.00 0.00 H new ATOM 0 HE2 LYS B 26 9.501 -12.832 4.742 1.00 0.00 H new ATOM 0 HE3 LYS B 26 10.317 -14.281 4.193 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 10.691 -14.441 6.400 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 12.056 -13.517 5.993 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 10.688 -12.763 6.657 1.00 0.00 H new ATOM 1856 N LEU B 27 12.739 -8.938 -0.221 1.00 0.00 N ATOM 1857 CA LEU B 27 13.734 -8.194 -0.985 1.00 0.00 C ATOM 1858 C LEU B 27 15.004 -7.978 -0.157 1.00 0.00 C ATOM 1859 O LEU B 27 14.931 -7.336 0.891 1.00 0.00 O ATOM 1860 CB LEU B 27 13.159 -6.804 -1.302 1.00 0.00 C ATOM 1861 CG LEU B 27 12.096 -6.764 -2.408 1.00 0.00 C ATOM 1862 CD1 LEU B 27 11.530 -5.344 -2.465 1.00 0.00 C ATOM 1863 CD2 LEU B 27 12.631 -7.084 -3.807 1.00 0.00 C ATOM 0 H LEU B 27 12.481 -8.465 0.645 1.00 0.00 H new ATOM 0 HA LEU B 27 13.973 -8.757 -1.888 1.00 0.00 H new ATOM 0 HB2 LEU B 27 12.725 -6.393 -0.390 1.00 0.00 H new ATOM 0 HB3 LEU B 27 13.980 -6.147 -1.588 1.00 0.00 H new ATOM 0 HG LEU B 27 11.358 -7.525 -2.155 1.00 0.00 H new ATOM 0 HD11 LEU B 27 10.770 -5.286 -3.244 1.00 0.00 H new ATOM 0 HD12 LEU B 27 11.083 -5.092 -1.503 1.00 0.00 H new ATOM 0 HD13 LEU B 27 12.333 -4.641 -2.688 1.00 0.00 H new ATOM 0 HD21 LEU B 27 11.816 -7.034 -4.529 1.00 0.00 H new ATOM 0 HD22 LEU B 27 13.400 -6.360 -4.077 1.00 0.00 H new ATOM 0 HD23 LEU B 27 13.059 -8.086 -3.812 1.00 0.00 H new ATOM 1875 N LYS B 28 16.163 -8.471 -0.612 1.00 0.00 N ATOM 1876 CA LYS B 28 17.442 -8.104 0.000 1.00 0.00 C ATOM 1877 C LYS B 28 17.698 -6.609 -0.208 1.00 0.00 C ATOM 1878 O LYS B 28 17.041 -5.978 -1.032 1.00 0.00 O ATOM 1879 CB LYS B 28 18.585 -8.870 -0.670 1.00 0.00 C ATOM 1880 CG LYS B 28 18.565 -10.365 -0.375 1.00 0.00 C ATOM 1881 CD LYS B 28 19.207 -10.704 0.977 1.00 0.00 C ATOM 1882 CE LYS B 28 19.205 -12.217 1.219 1.00 0.00 C ATOM 1883 NZ LYS B 28 20.101 -12.930 0.290 1.00 0.00 N ATOM 0 H LYS B 28 16.239 -9.120 -1.395 1.00 0.00 H new ATOM 0 HA LYS B 28 17.398 -8.345 1.062 1.00 0.00 H new ATOM 0 HB2 LYS B 28 18.531 -8.719 -1.748 1.00 0.00 H new ATOM 0 HB3 LYS B 28 19.536 -8.454 -0.337 1.00 0.00 H new ATOM 0 HG2 LYS B 28 17.535 -10.720 -0.384 1.00 0.00 H new ATOM 0 HG3 LYS B 28 19.092 -10.896 -1.168 1.00 0.00 H new ATOM 0 HD2 LYS B 28 20.230 -10.329 1.003 1.00 0.00 H new ATOM 0 HD3 LYS B 28 18.664 -10.203 1.778 1.00 0.00 H new ATOM 0 HE2 LYS B 28 19.512 -12.420 2.245 1.00 0.00 H new ATOM 0 HE3 LYS B 28 18.190 -12.600 1.108 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 20.227 -13.910 0.613 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 19.684 -12.930 -0.663 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 21.025 -12.453 0.264 1.00 0.00 H new ATOM 1897 N LYS B 29 18.698 -6.048 0.483 1.00 0.00 N ATOM 1898 CA LYS B 29 19.094 -4.658 0.278 1.00 0.00 C ATOM 1899 C LYS B 29 19.441 -4.382 -1.186 1.00 0.00 C ATOM 1900 O LYS B 29 19.085 -3.331 -1.715 1.00 0.00 O ATOM 1901 CB LYS B 29 20.216 -4.249 1.249 1.00 0.00 C ATOM 1902 CG LYS B 29 21.563 -4.952 1.027 1.00 0.00 C ATOM 1903 CD LYS B 29 22.612 -4.347 1.970 1.00 0.00 C ATOM 1904 CE LYS B 29 23.983 -5.021 1.822 1.00 0.00 C ATOM 1905 NZ LYS B 29 24.542 -4.874 0.464 1.00 0.00 N ATOM 0 H LYS B 29 19.246 -6.540 1.189 1.00 0.00 H new ATOM 0 HA LYS B 29 18.238 -4.025 0.510 1.00 0.00 H new ATOM 0 HB2 LYS B 29 20.369 -3.173 1.169 1.00 0.00 H new ATOM 0 HB3 LYS B 29 19.884 -4.449 2.268 1.00 0.00 H new ATOM 0 HG2 LYS B 29 21.463 -6.021 1.213 1.00 0.00 H new ATOM 0 HG3 LYS B 29 21.880 -4.837 -0.010 1.00 0.00 H new ATOM 0 HD2 LYS B 29 22.709 -3.281 1.766 1.00 0.00 H new ATOM 0 HD3 LYS B 29 22.271 -4.444 3.001 1.00 0.00 H new ATOM 0 HE2 LYS B 29 24.676 -4.590 2.545 1.00 0.00 H new ATOM 0 HE3 LYS B 29 23.891 -6.081 2.061 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 25.503 -5.271 0.439 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 23.940 -5.381 -0.216 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 24.578 -3.866 0.211 1.00 0.00 H new ATOM 1919 N SER B 30 20.111 -5.329 -1.845 1.00 0.00 N ATOM 1920 CA SER B 30 20.473 -5.225 -3.245 1.00 0.00 C ATOM 1921 C SER B 30 19.214 -5.072 -4.095 1.00 0.00 C ATOM 1922 O SER B 30 19.101 -4.130 -4.881 1.00 0.00 O ATOM 1923 CB SER B 30 21.212 -6.515 -3.619 1.00 0.00 C ATOM 1924 OG SER B 30 20.601 -7.607 -2.946 1.00 0.00 O ATOM 0 H SER B 30 20.418 -6.198 -1.408 1.00 0.00 H new ATOM 0 HA SER B 30 21.106 -4.356 -3.421 1.00 0.00 H new ATOM 0 HB2 SER B 30 21.178 -6.670 -4.697 1.00 0.00 H new ATOM 0 HB3 SER B 30 22.263 -6.441 -3.341 1.00 0.00 H new ATOM 0 HG SER B 30 20.887 -8.448 -3.360 1.00 0.00 H new ATOM 1930 N GLU B 31 18.254 -5.986 -3.908 1.00 0.00 N ATOM 1931 CA GLU B 31 17.038 -5.986 -4.699 1.00 0.00 C ATOM 1932 C GLU B 31 16.245 -4.719 -4.416 1.00 0.00 C ATOM 1933 O GLU B 31 15.864 -4.012 -5.343 1.00 0.00 O ATOM 1934 CB GLU B 31 16.211 -7.246 -4.418 1.00 0.00 C ATOM 1935 CG GLU B 31 16.996 -8.530 -4.708 1.00 0.00 C ATOM 1936 CD GLU B 31 17.630 -8.534 -6.094 1.00 0.00 C ATOM 1937 OE1 GLU B 31 16.928 -8.133 -7.049 1.00 0.00 O ATOM 1938 OE2 GLU B 31 18.812 -8.932 -6.177 1.00 0.00 O ATOM 0 H GLU B 31 18.305 -6.731 -3.213 1.00 0.00 H new ATOM 0 HA GLU B 31 17.296 -5.999 -5.758 1.00 0.00 H new ATOM 0 HB2 GLU B 31 15.892 -7.244 -3.376 1.00 0.00 H new ATOM 0 HB3 GLU B 31 15.307 -7.229 -5.027 1.00 0.00 H new ATOM 0 HG2 GLU B 31 17.776 -8.651 -3.956 1.00 0.00 H new ATOM 0 HG3 GLU B 31 16.329 -9.387 -4.616 1.00 0.00 H new ATOM 1945 N LEU B 32 16.042 -4.427 -3.132 1.00 0.00 N ATOM 1946 CA LEU B 32 15.294 -3.281 -2.643 1.00 0.00 C ATOM 1947 C LEU B 32 15.866 -2.002 -3.250 1.00 0.00 C ATOM 1948 O LEU B 32 15.123 -1.197 -3.807 1.00 0.00 O ATOM 1949 CB LEU B 32 15.355 -3.292 -1.105 1.00 0.00 C ATOM 1950 CG LEU B 32 14.504 -2.257 -0.352 1.00 0.00 C ATOM 1951 CD1 LEU B 32 15.145 -0.864 -0.326 1.00 0.00 C ATOM 1952 CD2 LEU B 32 13.053 -2.202 -0.835 1.00 0.00 C ATOM 0 H LEU B 32 16.410 -5.008 -2.379 1.00 0.00 H new ATOM 0 HA LEU B 32 14.247 -3.328 -2.942 1.00 0.00 H new ATOM 0 HB2 LEU B 32 15.058 -4.284 -0.764 1.00 0.00 H new ATOM 0 HB3 LEU B 32 16.395 -3.152 -0.809 1.00 0.00 H new ATOM 0 HG LEU B 32 14.473 -2.611 0.678 1.00 0.00 H new ATOM 0 HD11 LEU B 32 14.499 -0.176 0.219 1.00 0.00 H new ATOM 0 HD12 LEU B 32 16.115 -0.919 0.168 1.00 0.00 H new ATOM 0 HD13 LEU B 32 15.278 -0.505 -1.347 1.00 0.00 H new ATOM 0 HD21 LEU B 32 12.507 -1.452 -0.263 1.00 0.00 H new ATOM 0 HD22 LEU B 32 13.031 -1.938 -1.892 1.00 0.00 H new ATOM 0 HD23 LEU B 32 12.586 -3.177 -0.694 1.00 0.00 H new ATOM 1964 N LYS B 33 17.188 -1.829 -3.185 1.00 0.00 N ATOM 1965 CA LYS B 33 17.846 -0.652 -3.720 1.00 0.00 C ATOM 1966 C LYS B 33 17.479 -0.472 -5.193 1.00 0.00 C ATOM 1967 O LYS B 33 16.894 0.550 -5.563 1.00 0.00 O ATOM 1968 CB LYS B 33 19.359 -0.804 -3.512 1.00 0.00 C ATOM 1969 CG LYS B 33 20.203 0.236 -4.265 1.00 0.00 C ATOM 1970 CD LYS B 33 21.687 0.060 -3.919 1.00 0.00 C ATOM 1971 CE LYS B 33 22.555 1.142 -4.571 1.00 0.00 C ATOM 1972 NZ LYS B 33 22.539 1.054 -6.042 1.00 0.00 N ATOM 0 H LYS B 33 17.824 -2.503 -2.760 1.00 0.00 H new ATOM 0 HA LYS B 33 17.515 0.247 -3.199 1.00 0.00 H new ATOM 0 HB2 LYS B 33 19.578 -0.731 -2.447 1.00 0.00 H new ATOM 0 HB3 LYS B 33 19.661 -1.801 -3.832 1.00 0.00 H new ATOM 0 HG2 LYS B 33 20.056 0.126 -5.339 1.00 0.00 H new ATOM 0 HG3 LYS B 33 19.876 1.242 -4.000 1.00 0.00 H new ATOM 0 HD2 LYS B 33 21.815 0.095 -2.837 1.00 0.00 H new ATOM 0 HD3 LYS B 33 22.023 -0.923 -4.248 1.00 0.00 H new ATOM 0 HE2 LYS B 33 22.200 2.125 -4.263 1.00 0.00 H new ATOM 0 HE3 LYS B 33 23.580 1.048 -4.214 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 23.191 1.760 -6.439 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 22.838 0.102 -6.336 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 21.576 1.238 -6.390 1.00 0.00 H new ATOM 1986 N GLU B 34 17.830 -1.438 -6.045 1.00 0.00 N ATOM 1987 CA GLU B 34 17.633 -1.248 -7.475 1.00 0.00 C ATOM 1988 C GLU B 34 16.141 -1.117 -7.801 1.00 0.00 C ATOM 1989 O GLU B 34 15.759 -0.240 -8.573 1.00 0.00 O ATOM 1990 CB GLU B 34 18.351 -2.338 -8.288 1.00 0.00 C ATOM 1991 CG GLU B 34 17.831 -3.759 -8.032 1.00 0.00 C ATOM 1992 CD GLU B 34 18.649 -4.808 -8.780 1.00 0.00 C ATOM 1993 OE1 GLU B 34 18.696 -4.705 -10.025 1.00 0.00 O ATOM 1994 OE2 GLU B 34 19.212 -5.697 -8.103 1.00 0.00 O ATOM 0 H GLU B 34 18.240 -2.333 -5.777 1.00 0.00 H new ATOM 0 HA GLU B 34 18.096 -0.308 -7.775 1.00 0.00 H new ATOM 0 HB2 GLU B 34 18.248 -2.111 -9.349 1.00 0.00 H new ATOM 0 HB3 GLU B 34 19.416 -2.306 -8.057 1.00 0.00 H new ATOM 0 HG2 GLU B 34 17.861 -3.970 -6.963 1.00 0.00 H new ATOM 0 HG3 GLU B 34 16.788 -3.825 -8.340 1.00 0.00 H new ATOM 2001 N LEU B 35 15.304 -1.951 -7.176 1.00 0.00 N ATOM 2002 CA LEU B 35 13.851 -1.893 -7.268 1.00 0.00 C ATOM 2003 C LEU B 35 13.367 -0.462 -7.024 1.00 0.00 C ATOM 2004 O LEU B 35 12.685 0.098 -7.882 1.00 0.00 O ATOM 2005 CB LEU B 35 13.278 -2.931 -6.287 1.00 0.00 C ATOM 2006 CG LEU B 35 11.777 -2.953 -5.960 1.00 0.00 C ATOM 2007 CD1 LEU B 35 11.408 -1.889 -4.926 1.00 0.00 C ATOM 2008 CD2 LEU B 35 10.854 -2.866 -7.174 1.00 0.00 C ATOM 0 H LEU B 35 15.634 -2.706 -6.575 1.00 0.00 H new ATOM 0 HA LEU B 35 13.493 -2.149 -8.265 1.00 0.00 H new ATOM 0 HB2 LEU B 35 13.537 -3.916 -6.675 1.00 0.00 H new ATOM 0 HB3 LEU B 35 13.810 -2.810 -5.344 1.00 0.00 H new ATOM 0 HG LEU B 35 11.608 -3.942 -5.533 1.00 0.00 H new ATOM 0 HD11 LEU B 35 10.338 -1.936 -4.721 1.00 0.00 H new ATOM 0 HD12 LEU B 35 11.962 -2.069 -4.005 1.00 0.00 H new ATOM 0 HD13 LEU B 35 11.660 -0.902 -5.314 1.00 0.00 H new ATOM 0 HD21 LEU B 35 9.815 -2.889 -6.844 1.00 0.00 H new ATOM 0 HD22 LEU B 35 11.044 -1.936 -7.710 1.00 0.00 H new ATOM 0 HD23 LEU B 35 11.043 -3.711 -7.836 1.00 0.00 H new ATOM 2020 N ILE B 36 13.741 0.163 -5.900 1.00 0.00 N ATOM 2021 CA ILE B 36 13.276 1.517 -5.616 1.00 0.00 C ATOM 2022 C ILE B 36 13.846 2.494 -6.647 1.00 0.00 C ATOM 2023 O ILE B 36 13.072 3.193 -7.297 1.00 0.00 O ATOM 2024 CB ILE B 36 13.572 1.946 -4.165 1.00 0.00 C ATOM 2025 CG1 ILE B 36 12.779 1.073 -3.176 1.00 0.00 C ATOM 2026 CG2 ILE B 36 13.144 3.405 -3.950 1.00 0.00 C ATOM 2027 CD1 ILE B 36 12.974 1.488 -1.715 1.00 0.00 C ATOM 0 H ILE B 36 14.351 -0.241 -5.189 1.00 0.00 H new ATOM 0 HA ILE B 36 12.190 1.531 -5.706 1.00 0.00 H new ATOM 0 HB ILE B 36 14.642 1.832 -3.993 1.00 0.00 H new ATOM 0 HG12 ILE B 36 11.719 1.126 -3.424 1.00 0.00 H new ATOM 0 HG13 ILE B 36 13.082 0.033 -3.295 1.00 0.00 H new ATOM 0 HG21 ILE B 36 13.357 3.699 -2.922 1.00 0.00 H new ATOM 0 HG22 ILE B 36 13.695 4.050 -4.634 1.00 0.00 H new ATOM 0 HG23 ILE B 36 12.075 3.503 -4.141 1.00 0.00 H new ATOM 0 HD11 ILE B 36 12.388 0.833 -1.070 1.00 0.00 H new ATOM 0 HD12 ILE B 36 14.029 1.408 -1.452 1.00 0.00 H new ATOM 0 HD13 ILE B 36 12.644 2.518 -1.582 1.00 0.00 H new ATOM 2039 N ASN B 37 15.175 2.558 -6.799 1.00 0.00 N ATOM 2040 CA ASN B 37 15.793 3.547 -7.691 1.00 0.00 C ATOM 2041 C ASN B 37 15.153 3.479 -9.077 1.00 0.00 C ATOM 2042 O ASN B 37 14.788 4.503 -9.648 1.00 0.00 O ATOM 2043 CB ASN B 37 17.311 3.353 -7.841 1.00 0.00 C ATOM 2044 CG ASN B 37 18.122 3.820 -6.635 1.00 0.00 C ATOM 2045 OD1 ASN B 37 18.668 4.920 -6.603 1.00 0.00 O ATOM 2046 ND2 ASN B 37 18.251 2.959 -5.638 1.00 0.00 N ATOM 0 H ASN B 37 15.836 1.945 -6.322 1.00 0.00 H new ATOM 0 HA ASN B 37 15.623 4.521 -7.233 1.00 0.00 H new ATOM 0 HB2 ASN B 37 17.516 2.297 -8.016 1.00 0.00 H new ATOM 0 HB3 ASN B 37 17.650 3.894 -8.725 1.00 0.00 H new ATOM 0 HD21 ASN B 37 18.813 3.204 -4.822 1.00 0.00 H new ATOM 0 HD22 ASN B 37 17.789 2.051 -5.685 1.00 0.00 H new ATOM 2053 N ASN B 38 15.035 2.269 -9.624 1.00 0.00 N ATOM 2054 CA ASN B 38 14.573 2.069 -10.985 1.00 0.00 C ATOM 2055 C ASN B 38 13.062 2.272 -11.084 1.00 0.00 C ATOM 2056 O ASN B 38 12.584 3.096 -11.862 1.00 0.00 O ATOM 2057 CB ASN B 38 14.960 0.649 -11.427 1.00 0.00 C ATOM 2058 CG ASN B 38 14.557 0.337 -12.865 1.00 0.00 C ATOM 2059 OD1 ASN B 38 14.290 1.228 -13.661 1.00 0.00 O ATOM 2060 ND2 ASN B 38 14.515 -0.945 -13.213 1.00 0.00 N ATOM 0 H ASN B 38 15.259 1.404 -9.131 1.00 0.00 H new ATOM 0 HA ASN B 38 15.043 2.802 -11.641 1.00 0.00 H new ATOM 0 HB2 ASN B 38 16.038 0.524 -11.323 1.00 0.00 H new ATOM 0 HB3 ASN B 38 14.490 -0.073 -10.760 1.00 0.00 H new ATOM 0 HD21 ASN B 38 14.255 -1.207 -14.164 1.00 0.00 H new ATOM 0 HD22 ASN B 38 14.742 -1.667 -12.529 1.00 0.00 H new ATOM 2067 N GLU B 39 12.290 1.547 -10.270 1.00 0.00 N ATOM 2068 CA GLU B 39 10.847 1.489 -10.438 1.00 0.00 C ATOM 2069 C GLU B 39 10.092 2.612 -9.729 1.00 0.00 C ATOM 2070 O GLU B 39 8.923 2.837 -10.049 1.00 0.00 O ATOM 2071 CB GLU B 39 10.322 0.114 -10.020 1.00 0.00 C ATOM 2072 CG GLU B 39 11.068 -1.075 -10.641 1.00 0.00 C ATOM 2073 CD GLU B 39 10.943 -1.180 -12.160 1.00 0.00 C ATOM 2074 OE1 GLU B 39 10.111 -0.445 -12.740 1.00 0.00 O ATOM 2075 OE2 GLU B 39 11.682 -2.026 -12.709 1.00 0.00 O ATOM 0 H GLU B 39 12.646 0.994 -9.490 1.00 0.00 H new ATOM 0 HA GLU B 39 10.654 1.643 -11.500 1.00 0.00 H new ATOM 0 HB2 GLU B 39 10.378 0.034 -8.934 1.00 0.00 H new ATOM 0 HB3 GLU B 39 9.268 0.045 -10.290 1.00 0.00 H new ATOM 0 HG2 GLU B 39 12.124 -1.001 -10.381 1.00 0.00 H new ATOM 0 HG3 GLU B 39 10.693 -1.996 -10.194 1.00 0.00 H new ATOM 2082 N LEU B 40 10.725 3.310 -8.784 1.00 0.00 N ATOM 2083 CA LEU B 40 10.145 4.466 -8.110 1.00 0.00 C ATOM 2084 C LEU B 40 10.815 5.764 -8.588 1.00 0.00 C ATOM 2085 O LEU B 40 10.548 6.826 -8.030 1.00 0.00 O ATOM 2086 CB LEU B 40 10.263 4.260 -6.590 1.00 0.00 C ATOM 2087 CG LEU B 40 9.191 4.957 -5.736 1.00 0.00 C ATOM 2088 CD1 LEU B 40 7.774 4.419 -5.972 1.00 0.00 C ATOM 2089 CD2 LEU B 40 9.532 4.700 -4.269 1.00 0.00 C ATOM 0 H LEU B 40 11.666 3.083 -8.464 1.00 0.00 H new ATOM 0 HA LEU B 40 9.088 4.561 -8.359 1.00 0.00 H new ATOM 0 HB2 LEU B 40 10.227 3.190 -6.383 1.00 0.00 H new ATOM 0 HB3 LEU B 40 11.243 4.614 -6.269 1.00 0.00 H new ATOM 0 HG LEU B 40 9.195 6.012 -6.008 1.00 0.00 H new ATOM 0 HD11 LEU B 40 7.070 4.957 -5.337 1.00 0.00 H new ATOM 0 HD12 LEU B 40 7.500 4.561 -7.018 1.00 0.00 H new ATOM 0 HD13 LEU B 40 7.743 3.357 -5.730 1.00 0.00 H new ATOM 0 HD21 LEU B 40 8.789 5.182 -3.633 1.00 0.00 H new ATOM 0 HD22 LEU B 40 9.532 3.627 -4.078 1.00 0.00 H new ATOM 0 HD23 LEU B 40 10.518 5.108 -4.048 1.00 0.00 H new ATOM 2101 N SER B 41 11.658 5.684 -9.628 1.00 0.00 N ATOM 2102 CA SER B 41 12.498 6.756 -10.165 1.00 0.00 C ATOM 2103 C SER B 41 11.777 8.099 -10.261 1.00 0.00 C ATOM 2104 O SER B 41 12.268 9.128 -9.806 1.00 0.00 O ATOM 2105 CB SER B 41 12.947 6.341 -11.575 1.00 0.00 C ATOM 2106 OG SER B 41 11.876 5.711 -12.265 1.00 0.00 O ATOM 0 H SER B 41 11.776 4.813 -10.146 1.00 0.00 H new ATOM 0 HA SER B 41 13.337 6.893 -9.482 1.00 0.00 H new ATOM 0 HB2 SER B 41 13.282 7.217 -12.131 1.00 0.00 H new ATOM 0 HB3 SER B 41 13.797 5.661 -11.509 1.00 0.00 H new ATOM 0 HG SER B 41 11.956 4.738 -12.176 1.00 0.00 H new ATOM 2112 N HIS B 42 10.602 8.081 -10.886 1.00 0.00 N ATOM 2113 CA HIS B 42 9.821 9.280 -11.161 1.00 0.00 C ATOM 2114 C HIS B 42 9.438 10.015 -9.860 1.00 0.00 C ATOM 2115 O HIS B 42 9.154 11.210 -9.901 1.00 0.00 O ATOM 2116 CB HIS B 42 8.652 8.885 -12.079 1.00 0.00 C ATOM 2117 CG HIS B 42 7.785 9.997 -12.627 1.00 0.00 C ATOM 2118 ND1 HIS B 42 7.714 11.300 -12.187 1.00 0.00 N ATOM 2119 CD2 HIS B 42 6.922 9.880 -13.685 1.00 0.00 C ATOM 2120 CE1 HIS B 42 6.830 11.948 -12.964 1.00 0.00 C ATOM 2121 NE2 HIS B 42 6.323 11.126 -13.896 1.00 0.00 N ATOM 0 H HIS B 42 10.162 7.223 -11.219 1.00 0.00 H new ATOM 0 HA HIS B 42 10.405 10.026 -11.699 1.00 0.00 H new ATOM 0 HB2 HIS B 42 9.061 8.330 -12.924 1.00 0.00 H new ATOM 0 HB3 HIS B 42 8.009 8.198 -11.528 1.00 0.00 H new ATOM 0 HD1 HIS B 42 8.239 11.701 -11.410 1.00 0.00 H new ATOM 0 HD2 HIS B 42 6.737 8.982 -14.256 1.00 0.00 H new ATOM 0 HE1 HIS B 42 6.564 12.989 -12.854 1.00 0.00 H new ATOM 2129 N PHE B 43 9.439 9.330 -8.708 1.00 0.00 N ATOM 2130 CA PHE B 43 9.316 9.962 -7.398 1.00 0.00 C ATOM 2131 C PHE B 43 10.710 10.113 -6.781 1.00 0.00 C ATOM 2132 O PHE B 43 11.154 11.228 -6.516 1.00 0.00 O ATOM 2133 CB PHE B 43 8.433 9.128 -6.459 1.00 0.00 C ATOM 2134 CG PHE B 43 6.922 9.203 -6.598 1.00 0.00 C ATOM 2135 CD1 PHE B 43 6.292 9.948 -7.616 1.00 0.00 C ATOM 2136 CD2 PHE B 43 6.137 8.563 -5.619 1.00 0.00 C ATOM 2137 CE1 PHE B 43 4.887 10.003 -7.678 1.00 0.00 C ATOM 2138 CE2 PHE B 43 4.738 8.670 -5.648 1.00 0.00 C ATOM 2139 CZ PHE B 43 4.112 9.347 -6.708 1.00 0.00 C ATOM 0 H PHE B 43 9.526 8.315 -8.665 1.00 0.00 H new ATOM 0 HA PHE B 43 8.850 10.939 -7.528 1.00 0.00 H new ATOM 0 HB2 PHE B 43 8.722 8.084 -6.579 1.00 0.00 H new ATOM 0 HB3 PHE B 43 8.682 9.412 -5.437 1.00 0.00 H new ATOM 0 HD1 PHE B 43 6.887 10.476 -8.347 1.00 0.00 H new ATOM 0 HD2 PHE B 43 6.615 7.986 -4.841 1.00 0.00 H new ATOM 0 HE1 PHE B 43 4.404 10.551 -8.473 1.00 0.00 H new ATOM 0 HE2 PHE B 43 4.145 8.233 -4.858 1.00 0.00 H new ATOM 0 HZ PHE B 43 3.034 9.363 -6.777 1.00 0.00 H new ATOM 2149 N LEU B 44 11.371 8.992 -6.474 1.00 0.00 N ATOM 2150 CA LEU B 44 12.598 8.995 -5.693 1.00 0.00 C ATOM 2151 C LEU B 44 13.820 9.217 -6.578 1.00 0.00 C ATOM 2152 O LEU B 44 14.098 8.439 -7.487 1.00 0.00 O ATOM 2153 CB LEU B 44 12.750 7.712 -4.858 1.00 0.00 C ATOM 2154 CG LEU B 44 12.282 7.934 -3.411 1.00 0.00 C ATOM 2155 CD1 LEU B 44 10.765 8.141 -3.338 1.00 0.00 C ATOM 2156 CD2 LEU B 44 12.716 6.769 -2.520 1.00 0.00 C ATOM 0 H LEU B 44 11.066 8.062 -6.762 1.00 0.00 H new ATOM 0 HA LEU B 44 12.530 9.831 -4.997 1.00 0.00 H new ATOM 0 HB2 LEU B 44 12.170 6.908 -5.312 1.00 0.00 H new ATOM 0 HB3 LEU B 44 13.792 7.394 -4.861 1.00 0.00 H new ATOM 0 HG LEU B 44 12.756 8.844 -3.043 1.00 0.00 H new ATOM 0 HD11 LEU B 44 10.468 8.295 -2.301 1.00 0.00 H new ATOM 0 HD12 LEU B 44 10.488 9.015 -3.928 1.00 0.00 H new ATOM 0 HD13 LEU B 44 10.258 7.261 -3.733 1.00 0.00 H new ATOM 0 HD21 LEU B 44 12.375 6.945 -1.500 1.00 0.00 H new ATOM 0 HD22 LEU B 44 12.280 5.843 -2.894 1.00 0.00 H new ATOM 0 HD23 LEU B 44 13.803 6.688 -2.531 1.00 0.00 H new ATOM 2168 N GLU B 45 14.567 10.273 -6.248 1.00 0.00 N ATOM 2169 CA GLU B 45 15.877 10.548 -6.807 1.00 0.00 C ATOM 2170 C GLU B 45 16.845 9.419 -6.429 1.00 0.00 C ATOM 2171 O GLU B 45 16.546 8.600 -5.558 1.00 0.00 O ATOM 2172 CB GLU B 45 16.360 11.926 -6.320 1.00 0.00 C ATOM 2173 CG GLU B 45 16.524 12.017 -4.793 1.00 0.00 C ATOM 2174 CD GLU B 45 16.911 13.426 -4.353 1.00 0.00 C ATOM 2175 OE1 GLU B 45 15.980 14.231 -4.123 1.00 0.00 O ATOM 2176 OE2 GLU B 45 18.132 13.677 -4.268 1.00 0.00 O ATOM 0 H GLU B 45 14.264 10.971 -5.569 1.00 0.00 H new ATOM 0 HA GLU B 45 15.829 10.583 -7.895 1.00 0.00 H new ATOM 0 HB2 GLU B 45 17.314 12.155 -6.794 1.00 0.00 H new ATOM 0 HB3 GLU B 45 15.651 12.687 -6.647 1.00 0.00 H new ATOM 0 HG2 GLU B 45 15.592 11.727 -4.308 1.00 0.00 H new ATOM 0 HG3 GLU B 45 17.287 11.310 -4.466 1.00 0.00 H new ATOM 2183 N GLU B 46 18.011 9.383 -7.081 1.00 0.00 N ATOM 2184 CA GLU B 46 19.023 8.370 -6.834 1.00 0.00 C ATOM 2185 C GLU B 46 19.363 8.298 -5.344 1.00 0.00 C ATOM 2186 O GLU B 46 19.585 9.320 -4.699 1.00 0.00 O ATOM 2187 CB GLU B 46 20.270 8.663 -7.679 1.00 0.00 C ATOM 2188 CG GLU B 46 21.409 7.688 -7.357 1.00 0.00 C ATOM 2189 CD GLU B 46 22.613 7.902 -8.267 1.00 0.00 C ATOM 2190 OE1 GLU B 46 22.535 7.442 -9.426 1.00 0.00 O ATOM 2191 OE2 GLU B 46 23.586 8.522 -7.786 1.00 0.00 O ATOM 0 H GLU B 46 18.274 10.061 -7.796 1.00 0.00 H new ATOM 0 HA GLU B 46 18.631 7.396 -7.127 1.00 0.00 H new ATOM 0 HB2 GLU B 46 20.018 8.593 -8.737 1.00 0.00 H new ATOM 0 HB3 GLU B 46 20.602 9.685 -7.497 1.00 0.00 H new ATOM 0 HG2 GLU B 46 21.712 7.814 -6.318 1.00 0.00 H new ATOM 0 HG3 GLU B 46 21.051 6.664 -7.463 1.00 0.00 H new ATOM 2198 N ILE B 47 19.411 7.068 -4.832 1.00 0.00 N ATOM 2199 CA ILE B 47 19.607 6.775 -3.422 1.00 0.00 C ATOM 2200 C ILE B 47 21.085 6.469 -3.177 1.00 0.00 C ATOM 2201 O ILE B 47 21.722 7.114 -2.349 1.00 0.00 O ATOM 2202 CB ILE B 47 18.670 5.635 -2.988 1.00 0.00 C ATOM 2203 CG1 ILE B 47 17.240 5.924 -3.482 1.00 0.00 C ATOM 2204 CG2 ILE B 47 18.692 5.507 -1.458 1.00 0.00 C ATOM 2205 CD1 ILE B 47 16.257 4.800 -3.179 1.00 0.00 C ATOM 0 H ILE B 47 19.312 6.230 -5.405 1.00 0.00 H new ATOM 0 HA ILE B 47 19.348 7.637 -2.807 1.00 0.00 H new ATOM 0 HB ILE B 47 19.009 4.696 -3.425 1.00 0.00 H new ATOM 0 HG12 ILE B 47 16.883 6.844 -3.019 1.00 0.00 H new ATOM 0 HG13 ILE B 47 17.263 6.096 -4.558 1.00 0.00 H new ATOM 0 HG21 ILE B 47 18.028 4.699 -1.151 1.00 0.00 H new ATOM 0 HG22 ILE B 47 19.707 5.289 -1.126 1.00 0.00 H new ATOM 0 HG23 ILE B 47 18.357 6.442 -1.010 1.00 0.00 H new ATOM 0 HD11 ILE B 47 15.270 5.069 -3.554 1.00 0.00 H new ATOM 0 HD12 ILE B 47 16.592 3.883 -3.664 1.00 0.00 H new ATOM 0 HD13 ILE B 47 16.205 4.642 -2.102 1.00 0.00 H new ATOM 2217 N LYS B 48 21.634 5.494 -3.917 1.00 0.00 N ATOM 2218 CA LYS B 48 23.058 5.162 -3.980 1.00 0.00 C ATOM 2219 C LYS B 48 23.609 4.551 -2.683 1.00 0.00 C ATOM 2220 O LYS B 48 24.076 3.413 -2.689 1.00 0.00 O ATOM 2221 CB LYS B 48 23.863 6.384 -4.453 1.00 0.00 C ATOM 2222 CG LYS B 48 25.356 6.099 -4.647 1.00 0.00 C ATOM 2223 CD LYS B 48 26.037 7.238 -5.420 1.00 0.00 C ATOM 2224 CE LYS B 48 25.822 8.606 -4.758 1.00 0.00 C ATOM 2225 NZ LYS B 48 26.624 9.650 -5.419 1.00 0.00 N ATOM 0 H LYS B 48 21.068 4.890 -4.514 1.00 0.00 H new ATOM 0 HA LYS B 48 23.174 4.368 -4.718 1.00 0.00 H new ATOM 0 HB2 LYS B 48 23.445 6.742 -5.394 1.00 0.00 H new ATOM 0 HB3 LYS B 48 23.747 7.188 -3.726 1.00 0.00 H new ATOM 0 HG2 LYS B 48 25.836 5.976 -3.676 1.00 0.00 H new ATOM 0 HG3 LYS B 48 25.484 5.161 -5.187 1.00 0.00 H new ATOM 0 HD2 LYS B 48 27.106 7.036 -5.492 1.00 0.00 H new ATOM 0 HD3 LYS B 48 25.649 7.265 -6.438 1.00 0.00 H new ATOM 0 HE2 LYS B 48 24.766 8.872 -4.802 1.00 0.00 H new ATOM 0 HE3 LYS B 48 26.092 8.549 -3.704 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 26.459 10.564 -4.950 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 27.633 9.406 -5.355 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 26.348 9.719 -6.419 1.00 0.00 H new ATOM 2239 N GLU B 49 23.600 5.311 -1.588 1.00 0.00 N ATOM 2240 CA GLU B 49 24.259 4.973 -0.336 1.00 0.00 C ATOM 2241 C GLU B 49 23.686 3.690 0.272 1.00 0.00 C ATOM 2242 O GLU B 49 22.678 3.739 0.979 1.00 0.00 O ATOM 2243 CB GLU B 49 24.119 6.151 0.644 1.00 0.00 C ATOM 2244 CG GLU B 49 24.737 7.455 0.114 1.00 0.00 C ATOM 2245 CD GLU B 49 26.233 7.314 -0.141 1.00 0.00 C ATOM 2246 OE1 GLU B 49 26.975 7.263 0.862 1.00 0.00 O ATOM 2247 OE2 GLU B 49 26.604 7.245 -1.334 1.00 0.00 O ATOM 0 H GLU B 49 23.116 6.208 -1.552 1.00 0.00 H new ATOM 0 HA GLU B 49 25.315 4.789 -0.535 1.00 0.00 H new ATOM 0 HB2 GLU B 49 23.062 6.316 0.855 1.00 0.00 H new ATOM 0 HB3 GLU B 49 24.595 5.888 1.589 1.00 0.00 H new ATOM 0 HG2 GLU B 49 24.237 7.744 -0.811 1.00 0.00 H new ATOM 0 HG3 GLU B 49 24.565 8.256 0.833 1.00 0.00 H new ATOM 2254 N GLN B 50 24.353 2.551 0.045 1.00 0.00 N ATOM 2255 CA GLN B 50 23.987 1.259 0.620 1.00 0.00 C ATOM 2256 C GLN B 50 23.725 1.341 2.127 1.00 0.00 C ATOM 2257 O GLN B 50 22.874 0.624 2.644 1.00 0.00 O ATOM 2258 CB GLN B 50 25.049 0.196 0.315 1.00 0.00 C ATOM 2259 CG GLN B 50 24.942 -0.321 -1.125 1.00 0.00 C ATOM 2260 CD GLN B 50 25.834 -1.541 -1.322 1.00 0.00 C ATOM 2261 OE1 GLN B 50 25.364 -2.672 -1.260 1.00 0.00 O ATOM 2262 NE2 GLN B 50 27.127 -1.331 -1.545 1.00 0.00 N ATOM 0 H GLN B 50 25.177 2.505 -0.555 1.00 0.00 H new ATOM 0 HA GLN B 50 23.051 0.962 0.146 1.00 0.00 H new ATOM 0 HB2 GLN B 50 26.041 0.617 0.477 1.00 0.00 H new ATOM 0 HB3 GLN B 50 24.939 -0.637 1.009 1.00 0.00 H new ATOM 0 HG2 GLN B 50 23.907 -0.580 -1.349 1.00 0.00 H new ATOM 0 HG3 GLN B 50 25.232 0.465 -1.822 1.00 0.00 H new ATOM 0 HE21 GLN B 50 27.488 -0.378 -1.591 1.00 0.00 H new ATOM 0 HE22 GLN B 50 27.758 -2.123 -1.670 1.00 0.00 H new ATOM 2271 N GLU B 51 24.425 2.229 2.831 1.00 0.00 N ATOM 2272 CA GLU B 51 24.204 2.468 4.248 1.00 0.00 C ATOM 2273 C GLU B 51 22.745 2.885 4.475 1.00 0.00 C ATOM 2274 O GLU B 51 22.053 2.335 5.331 1.00 0.00 O ATOM 2275 CB GLU B 51 25.171 3.554 4.750 1.00 0.00 C ATOM 2276 CG GLU B 51 26.661 3.177 4.636 1.00 0.00 C ATOM 2277 CD GLU B 51 27.227 3.188 3.213 1.00 0.00 C ATOM 2278 OE1 GLU B 51 26.602 3.835 2.343 1.00 0.00 O ATOM 2279 OE2 GLU B 51 28.269 2.528 3.016 1.00 0.00 O ATOM 0 H GLU B 51 25.165 2.804 2.428 1.00 0.00 H new ATOM 0 HA GLU B 51 24.395 1.554 4.810 1.00 0.00 H new ATOM 0 HB2 GLU B 51 24.996 4.470 4.185 1.00 0.00 H new ATOM 0 HB3 GLU B 51 24.942 3.774 5.793 1.00 0.00 H new ATOM 0 HG2 GLU B 51 27.242 3.868 5.247 1.00 0.00 H new ATOM 0 HG3 GLU B 51 26.801 2.182 5.059 1.00 0.00 H new ATOM 2286 N VAL B 52 22.262 3.845 3.681 1.00 0.00 N ATOM 2287 CA VAL B 52 20.887 4.293 3.782 1.00 0.00 C ATOM 2288 C VAL B 52 19.939 3.226 3.245 1.00 0.00 C ATOM 2289 O VAL B 52 18.914 2.989 3.878 1.00 0.00 O ATOM 2290 CB VAL B 52 20.667 5.652 3.101 1.00 0.00 C ATOM 2291 CG1 VAL B 52 19.175 6.010 3.178 1.00 0.00 C ATOM 2292 CG2 VAL B 52 21.507 6.731 3.800 1.00 0.00 C ATOM 0 H VAL B 52 22.810 4.321 2.964 1.00 0.00 H new ATOM 0 HA VAL B 52 20.663 4.444 4.838 1.00 0.00 H new ATOM 0 HB VAL B 52 20.976 5.596 2.057 1.00 0.00 H new ATOM 0 HG11 VAL B 52 19.007 6.974 2.697 1.00 0.00 H new ATOM 0 HG12 VAL B 52 18.590 5.244 2.669 1.00 0.00 H new ATOM 0 HG13 VAL B 52 18.868 6.067 4.222 1.00 0.00 H new ATOM 0 HG21 VAL B 52 21.345 7.692 3.311 1.00 0.00 H new ATOM 0 HG22 VAL B 52 21.210 6.802 4.846 1.00 0.00 H new ATOM 0 HG23 VAL B 52 22.563 6.466 3.739 1.00 0.00 H new ATOM 2302 N VAL B 53 20.232 2.586 2.103 1.00 0.00 N ATOM 2303 CA VAL B 53 19.312 1.572 1.599 1.00 0.00 C ATOM 2304 C VAL B 53 19.097 0.490 2.667 1.00 0.00 C ATOM 2305 O VAL B 53 17.960 0.135 2.978 1.00 0.00 O ATOM 2306 CB VAL B 53 19.694 1.023 0.211 1.00 0.00 C ATOM 2307 CG1 VAL B 53 20.310 2.081 -0.709 1.00 0.00 C ATOM 2308 CG2 VAL B 53 20.520 -0.268 0.234 1.00 0.00 C ATOM 0 H VAL B 53 21.064 2.747 1.536 1.00 0.00 H new ATOM 0 HA VAL B 53 18.349 2.049 1.416 1.00 0.00 H new ATOM 0 HB VAL B 53 18.736 0.740 -0.225 1.00 0.00 H new ATOM 0 HG11 VAL B 53 20.556 1.629 -1.670 1.00 0.00 H new ATOM 0 HG12 VAL B 53 19.596 2.891 -0.861 1.00 0.00 H new ATOM 0 HG13 VAL B 53 21.217 2.477 -0.252 1.00 0.00 H new ATOM 0 HG21 VAL B 53 20.740 -0.577 -0.788 1.00 0.00 H new ATOM 0 HG22 VAL B 53 21.453 -0.093 0.770 1.00 0.00 H new ATOM 0 HG23 VAL B 53 19.955 -1.053 0.737 1.00 0.00 H new ATOM 2318 N ASP B 54 20.197 0.030 3.276 1.00 0.00 N ATOM 2319 CA ASP B 54 20.186 -0.883 4.405 1.00 0.00 C ATOM 2320 C ASP B 54 19.340 -0.314 5.544 1.00 0.00 C ATOM 2321 O ASP B 54 18.477 -1.010 6.067 1.00 0.00 O ATOM 2322 CB ASP B 54 21.613 -1.178 4.873 1.00 0.00 C ATOM 2323 CG ASP B 54 21.600 -2.173 6.028 1.00 0.00 C ATOM 2324 OD1 ASP B 54 21.509 -3.383 5.727 1.00 0.00 O ATOM 2325 OD2 ASP B 54 21.669 -1.704 7.184 1.00 0.00 O ATOM 0 H ASP B 54 21.138 0.294 2.983 1.00 0.00 H new ATOM 0 HA ASP B 54 19.736 -1.824 4.087 1.00 0.00 H new ATOM 0 HB2 ASP B 54 22.198 -1.580 4.046 1.00 0.00 H new ATOM 0 HB3 ASP B 54 22.098 -0.254 5.187 1.00 0.00 H new ATOM 2330 N LYS B 55 19.563 0.948 5.925 1.00 0.00 N ATOM 2331 CA LYS B 55 18.818 1.542 7.026 1.00 0.00 C ATOM 2332 C LYS B 55 17.313 1.550 6.740 1.00 0.00 C ATOM 2333 O LYS B 55 16.532 1.099 7.579 1.00 0.00 O ATOM 2334 CB LYS B 55 19.339 2.961 7.304 1.00 0.00 C ATOM 2335 CG LYS B 55 18.700 3.601 8.545 1.00 0.00 C ATOM 2336 CD LYS B 55 19.196 2.961 9.852 1.00 0.00 C ATOM 2337 CE LYS B 55 18.034 2.622 10.794 1.00 0.00 C ATOM 2338 NZ LYS B 55 17.254 1.464 10.316 1.00 0.00 N ATOM 0 H LYS B 55 20.247 1.567 5.489 1.00 0.00 H new ATOM 0 HA LYS B 55 18.972 0.933 7.917 1.00 0.00 H new ATOM 0 HB2 LYS B 55 20.420 2.926 7.436 1.00 0.00 H new ATOM 0 HB3 LYS B 55 19.144 3.591 6.436 1.00 0.00 H new ATOM 0 HG2 LYS B 55 18.924 4.668 8.557 1.00 0.00 H new ATOM 0 HG3 LYS B 55 17.616 3.504 8.484 1.00 0.00 H new ATOM 0 HD2 LYS B 55 19.756 2.054 9.624 1.00 0.00 H new ATOM 0 HD3 LYS B 55 19.884 3.642 10.353 1.00 0.00 H new ATOM 0 HE2 LYS B 55 18.424 2.410 11.789 1.00 0.00 H new ATOM 0 HE3 LYS B 55 17.378 3.488 10.886 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 16.278 1.534 10.667 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 17.248 1.455 9.276 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 17.686 0.586 10.667 1.00 0.00 H new ATOM 2352 N VAL B 56 16.882 2.048 5.576 1.00 0.00 N ATOM 2353 CA VAL B 56 15.454 2.131 5.296 1.00 0.00 C ATOM 2354 C VAL B 56 14.858 0.724 5.251 1.00 0.00 C ATOM 2355 O VAL B 56 13.856 0.462 5.911 1.00 0.00 O ATOM 2356 CB VAL B 56 15.108 2.995 4.063 1.00 0.00 C ATOM 2357 CG1 VAL B 56 15.652 4.424 4.209 1.00 0.00 C ATOM 2358 CG2 VAL B 56 15.581 2.413 2.730 1.00 0.00 C ATOM 0 H VAL B 56 17.489 2.391 4.832 1.00 0.00 H new ATOM 0 HA VAL B 56 14.982 2.671 6.117 1.00 0.00 H new ATOM 0 HB VAL B 56 14.018 3.007 4.036 1.00 0.00 H new ATOM 0 HG11 VAL B 56 15.391 5.005 3.324 1.00 0.00 H new ATOM 0 HG12 VAL B 56 15.215 4.891 5.092 1.00 0.00 H new ATOM 0 HG13 VAL B 56 16.736 4.391 4.315 1.00 0.00 H new ATOM 0 HG21 VAL B 56 15.296 3.083 1.919 1.00 0.00 H new ATOM 0 HG22 VAL B 56 16.665 2.302 2.746 1.00 0.00 H new ATOM 0 HG23 VAL B 56 15.119 1.438 2.574 1.00 0.00 H new ATOM 2368 N MET B 57 15.480 -0.205 4.516 1.00 0.00 N ATOM 2369 CA MET B 57 14.920 -1.544 4.391 1.00 0.00 C ATOM 2370 C MET B 57 14.902 -2.272 5.739 1.00 0.00 C ATOM 2371 O MET B 57 13.903 -2.908 6.067 1.00 0.00 O ATOM 2372 CB MET B 57 15.571 -2.302 3.231 1.00 0.00 C ATOM 2373 CG MET B 57 17.029 -2.710 3.443 1.00 0.00 C ATOM 2374 SD MET B 57 17.366 -4.328 4.168 1.00 0.00 S ATOM 2375 CE MET B 57 16.507 -5.386 2.984 1.00 0.00 C ATOM 0 H MET B 57 16.353 -0.054 4.011 1.00 0.00 H new ATOM 0 HA MET B 57 13.867 -1.477 4.117 1.00 0.00 H new ATOM 0 HB2 MET B 57 14.986 -3.200 3.034 1.00 0.00 H new ATOM 0 HB3 MET B 57 15.513 -1.681 2.337 1.00 0.00 H new ATOM 0 HG2 MET B 57 17.530 -2.668 2.476 1.00 0.00 H new ATOM 0 HG3 MET B 57 17.496 -1.957 4.078 1.00 0.00 H new ATOM 0 HE1 MET B 57 16.985 -6.365 2.957 1.00 0.00 H new ATOM 0 HE2 MET B 57 15.466 -5.499 3.285 1.00 0.00 H new ATOM 0 HE3 MET B 57 16.551 -4.934 1.993 1.00 0.00 H new ATOM 2385 N GLU B 58 15.947 -2.104 6.559 1.00 0.00 N ATOM 2386 CA GLU B 58 15.963 -2.567 7.942 1.00 0.00 C ATOM 2387 C GLU B 58 14.765 -1.993 8.704 1.00 0.00 C ATOM 2388 O GLU B 58 14.044 -2.725 9.375 1.00 0.00 O ATOM 2389 CB GLU B 58 17.291 -2.156 8.595 1.00 0.00 C ATOM 2390 CG GLU B 58 17.360 -2.526 10.080 1.00 0.00 C ATOM 2391 CD GLU B 58 18.703 -2.119 10.678 1.00 0.00 C ATOM 2392 OE1 GLU B 58 18.886 -0.897 10.868 1.00 0.00 O ATOM 2393 OE2 GLU B 58 19.519 -3.032 10.931 1.00 0.00 O ATOM 0 H GLU B 58 16.809 -1.639 6.274 1.00 0.00 H new ATOM 0 HA GLU B 58 15.882 -3.654 7.971 1.00 0.00 H new ATOM 0 HB2 GLU B 58 18.115 -2.636 8.067 1.00 0.00 H new ATOM 0 HB3 GLU B 58 17.427 -1.080 8.486 1.00 0.00 H new ATOM 0 HG2 GLU B 58 16.552 -2.033 10.620 1.00 0.00 H new ATOM 0 HG3 GLU B 58 17.214 -3.600 10.199 1.00 0.00 H new ATOM 2400 N THR B 59 14.540 -0.683 8.579 1.00 0.00 N ATOM 2401 CA THR B 59 13.388 -0.013 9.169 1.00 0.00 C ATOM 2402 C THR B 59 12.071 -0.639 8.693 1.00 0.00 C ATOM 2403 O THR B 59 11.148 -0.765 9.497 1.00 0.00 O ATOM 2404 CB THR B 59 13.477 1.507 8.920 1.00 0.00 C ATOM 2405 OG1 THR B 59 14.296 2.092 9.915 1.00 0.00 O ATOM 2406 CG2 THR B 59 12.127 2.235 8.886 1.00 0.00 C ATOM 0 H THR B 59 15.158 -0.057 8.062 1.00 0.00 H new ATOM 0 HA THR B 59 13.401 -0.158 10.249 1.00 0.00 H new ATOM 0 HB THR B 59 13.902 1.622 7.923 1.00 0.00 H new ATOM 0 HG1 THR B 59 14.358 3.058 9.761 1.00 0.00 H new ATOM 0 HG21 THR B 59 12.291 3.297 8.706 1.00 0.00 H new ATOM 0 HG22 THR B 59 11.511 1.822 8.087 1.00 0.00 H new ATOM 0 HG23 THR B 59 11.618 2.103 9.841 1.00 0.00 H new ATOM 2414 N LEU B 60 11.953 -1.042 7.423 1.00 0.00 N ATOM 2415 CA LEU B 60 10.731 -1.718 6.987 1.00 0.00 C ATOM 2416 C LEU B 60 10.635 -3.105 7.620 1.00 0.00 C ATOM 2417 O LEU B 60 9.576 -3.473 8.113 1.00 0.00 O ATOM 2418 CB LEU B 60 10.590 -1.838 5.459 1.00 0.00 C ATOM 2419 CG LEU B 60 10.894 -0.565 4.661 1.00 0.00 C ATOM 2420 CD1 LEU B 60 10.680 -0.854 3.172 1.00 0.00 C ATOM 2421 CD2 LEU B 60 10.031 0.607 5.141 1.00 0.00 C ATOM 0 H LEU B 60 12.664 -0.917 6.702 1.00 0.00 H new ATOM 0 HA LEU B 60 9.910 -1.086 7.325 1.00 0.00 H new ATOM 0 HB2 LEU B 60 11.255 -2.629 5.112 1.00 0.00 H new ATOM 0 HB3 LEU B 60 9.572 -2.154 5.230 1.00 0.00 H new ATOM 0 HG LEU B 60 11.932 -0.272 4.820 1.00 0.00 H new ATOM 0 HD11 LEU B 60 10.893 0.044 2.593 1.00 0.00 H new ATOM 0 HD12 LEU B 60 11.348 -1.656 2.857 1.00 0.00 H new ATOM 0 HD13 LEU B 60 9.646 -1.157 3.005 1.00 0.00 H new ATOM 0 HD21 LEU B 60 10.268 1.496 4.557 1.00 0.00 H new ATOM 0 HD22 LEU B 60 8.977 0.359 5.013 1.00 0.00 H new ATOM 0 HD23 LEU B 60 10.233 0.800 6.195 1.00 0.00 H new ATOM 2433 N ASP B 61 11.730 -3.868 7.556 1.00 0.00 N ATOM 2434 CA ASP B 61 11.861 -5.287 7.882 1.00 0.00 C ATOM 2435 C ASP B 61 11.437 -5.657 9.314 1.00 0.00 C ATOM 2436 O ASP B 61 12.244 -6.103 10.132 1.00 0.00 O ATOM 2437 CB ASP B 61 13.305 -5.716 7.572 1.00 0.00 C ATOM 2438 CG ASP B 61 13.597 -7.171 7.930 1.00 0.00 C ATOM 2439 OD1 ASP B 61 12.732 -8.026 7.642 1.00 0.00 O ATOM 2440 OD2 ASP B 61 14.673 -7.414 8.519 1.00 0.00 O ATOM 0 H ASP B 61 12.620 -3.474 7.249 1.00 0.00 H new ATOM 0 HA ASP B 61 11.157 -5.841 7.261 1.00 0.00 H new ATOM 0 HB2 ASP B 61 13.501 -5.565 6.510 1.00 0.00 H new ATOM 0 HB3 ASP B 61 13.993 -5.070 8.118 1.00 0.00 H new ATOM 2445 N SER B 62 10.135 -5.593 9.586 1.00 0.00 N ATOM 2446 CA SER B 62 9.509 -6.095 10.799 1.00 0.00 C ATOM 2447 C SER B 62 9.810 -7.582 11.006 1.00 0.00 C ATOM 2448 O SER B 62 9.795 -8.064 12.136 1.00 0.00 O ATOM 2449 CB SER B 62 8.003 -5.858 10.693 1.00 0.00 C ATOM 2450 OG SER B 62 7.530 -6.514 9.536 1.00 0.00 O ATOM 0 H SER B 62 9.465 -5.174 8.941 1.00 0.00 H new ATOM 0 HA SER B 62 9.912 -5.566 11.662 1.00 0.00 H new ATOM 0 HB2 SER B 62 7.496 -6.239 11.579 1.00 0.00 H new ATOM 0 HB3 SER B 62 7.790 -4.790 10.638 1.00 0.00 H new ATOM 0 HG SER B 62 6.773 -6.015 9.164 1.00 0.00 H new ATOM 2456 N ASP B 63 10.110 -8.307 9.922 1.00 0.00 N ATOM 2457 CA ASP B 63 10.409 -9.729 9.980 1.00 0.00 C ATOM 2458 C ASP B 63 11.774 -9.967 10.629 1.00 0.00 C ATOM 2459 O ASP B 63 12.071 -11.101 10.995 1.00 0.00 O ATOM 2460 CB ASP B 63 10.438 -10.340 8.567 1.00 0.00 C ATOM 2461 CG ASP B 63 9.315 -9.864 7.654 1.00 0.00 C ATOM 2462 OD1 ASP B 63 9.422 -8.705 7.192 1.00 0.00 O ATOM 2463 OD2 ASP B 63 8.391 -10.668 7.412 1.00 0.00 O ATOM 0 H ASP B 63 10.150 -7.916 8.981 1.00 0.00 H new ATOM 0 HA ASP B 63 9.626 -10.202 10.572 1.00 0.00 H new ATOM 0 HB2 ASP B 63 11.394 -10.103 8.101 1.00 0.00 H new ATOM 0 HB3 ASP B 63 10.386 -11.425 8.652 1.00 0.00 H new ATOM 2468 N GLY B 64 12.615 -8.929 10.751 1.00 0.00 N ATOM 2469 CA GLY B 64 13.962 -9.059 11.286 1.00 0.00 C ATOM 2470 C GLY B 64 14.757 -10.145 10.558 1.00 0.00 C ATOM 2471 O GLY B 64 15.559 -10.840 11.176 1.00 0.00 O ATOM 0 H GLY B 64 12.371 -7.977 10.478 1.00 0.00 H new ATOM 0 HA2 GLY B 64 14.483 -8.105 11.197 1.00 0.00 H new ATOM 0 HA3 GLY B 64 13.910 -9.296 12.349 1.00 0.00 H new ATOM 2475 N ASP B 65 14.537 -10.285 9.245 1.00 0.00 N ATOM 2476 CA ASP B 65 15.173 -11.294 8.406 1.00 0.00 C ATOM 2477 C ASP B 65 16.189 -10.627 7.475 1.00 0.00 C ATOM 2478 O ASP B 65 16.699 -11.245 6.544 1.00 0.00 O ATOM 2479 CB ASP B 65 14.072 -12.024 7.622 1.00 0.00 C ATOM 2480 CG ASP B 65 14.567 -13.253 6.859 1.00 0.00 C ATOM 2481 OD1 ASP B 65 15.471 -13.938 7.385 1.00 0.00 O ATOM 2482 OD2 ASP B 65 13.996 -13.512 5.778 1.00 0.00 O ATOM 0 H ASP B 65 13.895 -9.683 8.729 1.00 0.00 H new ATOM 0 HA ASP B 65 15.717 -12.020 9.010 1.00 0.00 H new ATOM 0 HB2 ASP B 65 13.288 -12.330 8.315 1.00 0.00 H new ATOM 0 HB3 ASP B 65 13.620 -11.328 6.916 1.00 0.00 H new ATOM 2487 N GLY B 66 16.455 -9.334 7.687 1.00 0.00 N ATOM 2488 CA GLY B 66 17.218 -8.509 6.777 1.00 0.00 C ATOM 2489 C GLY B 66 16.350 -8.192 5.567 1.00 0.00 C ATOM 2490 O GLY B 66 15.904 -7.063 5.389 1.00 0.00 O ATOM 0 H GLY B 66 16.135 -8.833 8.515 1.00 0.00 H new ATOM 0 HA2 GLY B 66 17.529 -7.589 7.271 1.00 0.00 H new ATOM 0 HA3 GLY B 66 18.125 -9.027 6.467 1.00 0.00 H new ATOM 2494 N GLU B 67 16.100 -9.211 4.746 1.00 0.00 N ATOM 2495 CA GLU B 67 15.284 -9.099 3.550 1.00 0.00 C ATOM 2496 C GLU B 67 13.858 -8.632 3.891 1.00 0.00 C ATOM 2497 O GLU B 67 13.180 -9.225 4.728 1.00 0.00 O ATOM 2498 CB GLU B 67 15.359 -10.383 2.705 1.00 0.00 C ATOM 2499 CG GLU B 67 15.076 -11.675 3.484 1.00 0.00 C ATOM 2500 CD GLU B 67 15.321 -12.921 2.638 1.00 0.00 C ATOM 2501 OE1 GLU B 67 14.390 -13.324 1.909 1.00 0.00 O ATOM 2502 OE2 GLU B 67 16.454 -13.443 2.716 1.00 0.00 O ATOM 0 H GLU B 67 16.467 -10.150 4.900 1.00 0.00 H new ATOM 0 HA GLU B 67 15.691 -8.316 2.911 1.00 0.00 H new ATOM 0 HB2 GLU B 67 14.646 -10.305 1.884 1.00 0.00 H new ATOM 0 HB3 GLU B 67 16.351 -10.452 2.260 1.00 0.00 H new ATOM 0 HG2 GLU B 67 15.709 -11.709 4.371 1.00 0.00 H new ATOM 0 HG3 GLU B 67 14.042 -11.670 3.830 1.00 0.00 H new ATOM 2509 N CYS B 68 13.423 -7.545 3.246 1.00 0.00 N ATOM 2510 CA CYS B 68 12.169 -6.846 3.515 1.00 0.00 C ATOM 2511 C CYS B 68 11.004 -7.627 2.915 1.00 0.00 C ATOM 2512 O CYS B 68 11.008 -7.820 1.702 1.00 0.00 O ATOM 2513 CB CYS B 68 12.225 -5.465 2.846 1.00 0.00 C ATOM 2514 SG CYS B 68 10.614 -4.669 3.029 1.00 0.00 S ATOM 0 H CYS B 68 13.958 -7.113 2.493 1.00 0.00 H new ATOM 0 HA CYS B 68 12.029 -6.749 4.592 1.00 0.00 H new ATOM 0 HB2 CYS B 68 13.003 -4.854 3.304 1.00 0.00 H new ATOM 0 HB3 CYS B 68 12.479 -5.566 1.791 1.00 0.00 H new ATOM 0 HG CYS B 68 9.687 -5.455 2.569 1.00 0.00 H new ATOM 2520 N ASP B 69 10.001 -8.049 3.697 1.00 0.00 N ATOM 2521 CA ASP B 69 8.920 -8.861 3.148 1.00 0.00 C ATOM 2522 C ASP B 69 7.944 -8.008 2.333 1.00 0.00 C ATOM 2523 O ASP B 69 7.890 -6.787 2.487 1.00 0.00 O ATOM 2524 CB ASP B 69 8.252 -9.671 4.266 1.00 0.00 C ATOM 2525 CG ASP B 69 7.032 -10.460 3.795 1.00 0.00 C ATOM 2526 OD1 ASP B 69 5.935 -9.859 3.770 1.00 0.00 O ATOM 2527 OD2 ASP B 69 7.225 -11.642 3.437 1.00 0.00 O ATOM 0 H ASP B 69 9.920 -7.844 4.693 1.00 0.00 H new ATOM 0 HA ASP B 69 9.330 -9.583 2.442 1.00 0.00 H new ATOM 0 HB2 ASP B 69 8.981 -10.362 4.690 1.00 0.00 H new ATOM 0 HB3 ASP B 69 7.952 -8.994 5.066 1.00 0.00 H new ATOM 2532 N PHE B 70 7.174 -8.655 1.452 1.00 0.00 N ATOM 2533 CA PHE B 70 6.172 -8.013 0.613 1.00 0.00 C ATOM 2534 C PHE B 70 5.243 -7.092 1.413 1.00 0.00 C ATOM 2535 O PHE B 70 4.961 -5.978 0.981 1.00 0.00 O ATOM 2536 CB PHE B 70 5.381 -9.068 -0.169 1.00 0.00 C ATOM 2537 CG PHE B 70 4.465 -8.444 -1.202 1.00 0.00 C ATOM 2538 CD1 PHE B 70 5.018 -7.979 -2.402 1.00 0.00 C ATOM 2539 CD2 PHE B 70 3.125 -8.147 -0.900 1.00 0.00 C ATOM 2540 CE1 PHE B 70 4.254 -7.221 -3.301 1.00 0.00 C ATOM 2541 CE2 PHE B 70 2.341 -7.430 -1.822 1.00 0.00 C ATOM 2542 CZ PHE B 70 2.913 -6.938 -3.009 1.00 0.00 C ATOM 0 H PHE B 70 7.236 -9.662 1.304 1.00 0.00 H new ATOM 0 HA PHE B 70 6.696 -7.374 -0.098 1.00 0.00 H new ATOM 0 HB2 PHE B 70 6.075 -9.748 -0.664 1.00 0.00 H new ATOM 0 HB3 PHE B 70 4.790 -9.666 0.525 1.00 0.00 H new ATOM 0 HD1 PHE B 70 6.047 -8.207 -2.638 1.00 0.00 H new ATOM 0 HD2 PHE B 70 2.698 -8.469 0.038 1.00 0.00 H new ATOM 0 HE1 PHE B 70 4.698 -6.856 -4.216 1.00 0.00 H new ATOM 0 HE2 PHE B 70 1.295 -7.256 -1.617 1.00 0.00 H new ATOM 0 HZ PHE B 70 2.322 -6.345 -3.692 1.00 0.00 H new ATOM 2552 N GLN B 71 4.787 -7.521 2.592 1.00 0.00 N ATOM 2553 CA GLN B 71 3.942 -6.697 3.451 1.00 0.00 C ATOM 2554 C GLN B 71 4.653 -5.394 3.856 1.00 0.00 C ATOM 2555 O GLN B 71 4.047 -4.324 3.899 1.00 0.00 O ATOM 2556 CB GLN B 71 3.522 -7.540 4.665 1.00 0.00 C ATOM 2557 CG GLN B 71 2.884 -6.744 5.810 1.00 0.00 C ATOM 2558 CD GLN B 71 1.515 -6.170 5.444 1.00 0.00 C ATOM 2559 OE1 GLN B 71 0.488 -6.758 5.763 1.00 0.00 O ATOM 2560 NE2 GLN B 71 1.475 -5.022 4.775 1.00 0.00 N ATOM 0 H GLN B 71 4.993 -8.444 2.974 1.00 0.00 H new ATOM 0 HA GLN B 71 3.048 -6.387 2.910 1.00 0.00 H new ATOM 0 HB2 GLN B 71 2.817 -8.302 4.334 1.00 0.00 H new ATOM 0 HB3 GLN B 71 4.399 -8.062 5.048 1.00 0.00 H new ATOM 0 HG2 GLN B 71 2.780 -7.390 6.682 1.00 0.00 H new ATOM 0 HG3 GLN B 71 3.550 -5.929 6.095 1.00 0.00 H new ATOM 0 HE21 GLN B 71 2.342 -4.550 4.520 1.00 0.00 H new ATOM 0 HE22 GLN B 71 0.577 -4.613 4.517 1.00 0.00 H new ATOM 2569 N GLU B 72 5.937 -5.477 4.189 1.00 0.00 N ATOM 2570 CA GLU B 72 6.742 -4.353 4.656 1.00 0.00 C ATOM 2571 C GLU B 72 6.962 -3.398 3.485 1.00 0.00 C ATOM 2572 O GLU B 72 6.778 -2.186 3.587 1.00 0.00 O ATOM 2573 CB GLU B 72 8.043 -4.920 5.215 1.00 0.00 C ATOM 2574 CG GLU B 72 7.862 -5.576 6.584 1.00 0.00 C ATOM 2575 CD GLU B 72 6.612 -6.426 6.773 1.00 0.00 C ATOM 2576 OE1 GLU B 72 6.540 -7.486 6.122 1.00 0.00 O ATOM 2577 OE2 GLU B 72 5.739 -5.993 7.559 1.00 0.00 O ATOM 0 H GLU B 72 6.461 -6.351 4.140 1.00 0.00 H new ATOM 0 HA GLU B 72 6.253 -3.785 5.448 1.00 0.00 H new ATOM 0 HB2 GLU B 72 8.445 -5.653 4.516 1.00 0.00 H new ATOM 0 HB3 GLU B 72 8.778 -4.120 5.295 1.00 0.00 H new ATOM 0 HG2 GLU B 72 8.733 -6.202 6.780 1.00 0.00 H new ATOM 0 HG3 GLU B 72 7.858 -4.791 7.340 1.00 0.00 H new ATOM 2584 N PHE B 73 7.294 -3.986 2.342 1.00 0.00 N ATOM 2585 CA PHE B 73 7.327 -3.271 1.070 1.00 0.00 C ATOM 2586 C PHE B 73 5.999 -2.524 0.846 1.00 0.00 C ATOM 2587 O PHE B 73 6.003 -1.320 0.595 1.00 0.00 O ATOM 2588 CB PHE B 73 7.658 -4.261 -0.054 1.00 0.00 C ATOM 2589 CG PHE B 73 7.222 -3.860 -1.450 1.00 0.00 C ATOM 2590 CD1 PHE B 73 8.048 -3.044 -2.243 1.00 0.00 C ATOM 2591 CD2 PHE B 73 6.029 -4.379 -1.992 1.00 0.00 C ATOM 2592 CE1 PHE B 73 7.697 -2.779 -3.578 1.00 0.00 C ATOM 2593 CE2 PHE B 73 5.664 -4.081 -3.316 1.00 0.00 C ATOM 2594 CZ PHE B 73 6.519 -3.312 -4.122 1.00 0.00 C ATOM 0 H PHE B 73 7.548 -4.971 2.270 1.00 0.00 H new ATOM 0 HA PHE B 73 8.109 -2.511 1.078 1.00 0.00 H new ATOM 0 HB2 PHE B 73 8.736 -4.419 -0.064 1.00 0.00 H new ATOM 0 HB3 PHE B 73 7.197 -5.219 0.187 1.00 0.00 H new ATOM 0 HD1 PHE B 73 8.951 -2.622 -1.827 1.00 0.00 H new ATOM 0 HD2 PHE B 73 5.393 -5.008 -1.387 1.00 0.00 H new ATOM 0 HE1 PHE B 73 8.338 -2.161 -4.189 1.00 0.00 H new ATOM 0 HE2 PHE B 73 4.727 -4.443 -3.713 1.00 0.00 H new ATOM 0 HZ PHE B 73 6.270 -3.132 -5.157 1.00 0.00 H new ATOM 2604 N MET B 74 4.859 -3.205 0.997 1.00 0.00 N ATOM 2605 CA MET B 74 3.543 -2.584 0.897 1.00 0.00 C ATOM 2606 C MET B 74 3.381 -1.443 1.897 1.00 0.00 C ATOM 2607 O MET B 74 2.838 -0.399 1.552 1.00 0.00 O ATOM 2608 CB MET B 74 2.428 -3.624 1.045 1.00 0.00 C ATOM 2609 CG MET B 74 2.339 -4.521 -0.195 1.00 0.00 C ATOM 2610 SD MET B 74 0.872 -4.306 -1.236 1.00 0.00 S ATOM 2611 CE MET B 74 0.910 -2.543 -1.629 1.00 0.00 C ATOM 0 H MET B 74 4.827 -4.206 1.193 1.00 0.00 H new ATOM 0 HA MET B 74 3.460 -2.151 -0.100 1.00 0.00 H new ATOM 0 HB2 MET B 74 2.613 -4.236 1.928 1.00 0.00 H new ATOM 0 HB3 MET B 74 1.475 -3.119 1.201 1.00 0.00 H new ATOM 0 HG2 MET B 74 3.223 -4.346 -0.808 1.00 0.00 H new ATOM 0 HG3 MET B 74 2.378 -5.560 0.131 1.00 0.00 H new ATOM 0 HE1 MET B 74 0.090 -2.303 -2.306 1.00 0.00 H new ATOM 0 HE2 MET B 74 0.805 -1.963 -0.712 1.00 0.00 H new ATOM 0 HE3 MET B 74 1.858 -2.297 -2.107 1.00 0.00 H new ATOM 2621 N ALA B 75 3.854 -1.617 3.129 1.00 0.00 N ATOM 2622 CA ALA B 75 3.827 -0.552 4.127 1.00 0.00 C ATOM 2623 C ALA B 75 4.628 0.668 3.650 1.00 0.00 C ATOM 2624 O ALA B 75 4.178 1.805 3.792 1.00 0.00 O ATOM 2625 CB ALA B 75 4.321 -1.065 5.484 1.00 0.00 C ATOM 0 H ALA B 75 4.263 -2.491 3.461 1.00 0.00 H new ATOM 0 HA ALA B 75 2.794 -0.229 4.257 1.00 0.00 H new ATOM 0 HB1 ALA B 75 4.292 -0.254 6.212 1.00 0.00 H new ATOM 0 HB2 ALA B 75 3.679 -1.878 5.821 1.00 0.00 H new ATOM 0 HB3 ALA B 75 5.344 -1.428 5.385 1.00 0.00 H new ATOM 2631 N PHE B 76 5.801 0.448 3.051 1.00 0.00 N ATOM 2632 CA PHE B 76 6.593 1.533 2.478 1.00 0.00 C ATOM 2633 C PHE B 76 5.811 2.223 1.362 1.00 0.00 C ATOM 2634 O PHE B 76 5.606 3.439 1.396 1.00 0.00 O ATOM 2635 CB PHE B 76 7.957 1.007 2.019 1.00 0.00 C ATOM 2636 CG PHE B 76 8.732 1.917 1.090 1.00 0.00 C ATOM 2637 CD1 PHE B 76 9.634 2.880 1.586 1.00 0.00 C ATOM 2638 CD2 PHE B 76 8.573 1.755 -0.299 1.00 0.00 C ATOM 2639 CE1 PHE B 76 10.310 3.729 0.688 1.00 0.00 C ATOM 2640 CE2 PHE B 76 9.261 2.590 -1.190 1.00 0.00 C ATOM 2641 CZ PHE B 76 10.103 3.600 -0.699 1.00 0.00 C ATOM 0 H PHE B 76 6.222 -0.476 2.951 1.00 0.00 H new ATOM 0 HA PHE B 76 6.789 2.289 3.238 1.00 0.00 H new ATOM 0 HB2 PHE B 76 8.567 0.814 2.901 1.00 0.00 H new ATOM 0 HB3 PHE B 76 7.807 0.050 1.519 1.00 0.00 H new ATOM 0 HD1 PHE B 76 9.806 2.966 2.649 1.00 0.00 H new ATOM 0 HD2 PHE B 76 7.919 0.985 -0.680 1.00 0.00 H new ATOM 0 HE1 PHE B 76 10.988 4.480 1.064 1.00 0.00 H new ATOM 0 HE2 PHE B 76 9.143 2.456 -2.255 1.00 0.00 H new ATOM 0 HZ PHE B 76 10.591 4.277 -1.384 1.00 0.00 H new ATOM 2651 N VAL B 77 5.319 1.432 0.406 1.00 0.00 N ATOM 2652 CA VAL B 77 4.476 1.922 -0.673 1.00 0.00 C ATOM 2653 C VAL B 77 3.323 2.741 -0.091 1.00 0.00 C ATOM 2654 O VAL B 77 3.003 3.805 -0.616 1.00 0.00 O ATOM 2655 CB VAL B 77 3.980 0.737 -1.522 1.00 0.00 C ATOM 2656 CG1 VAL B 77 2.856 1.138 -2.488 1.00 0.00 C ATOM 2657 CG2 VAL B 77 5.130 0.144 -2.344 1.00 0.00 C ATOM 0 H VAL B 77 5.499 0.429 0.364 1.00 0.00 H new ATOM 0 HA VAL B 77 5.047 2.579 -1.330 1.00 0.00 H new ATOM 0 HB VAL B 77 3.591 0.000 -0.819 1.00 0.00 H new ATOM 0 HG11 VAL B 77 2.542 0.267 -3.063 1.00 0.00 H new ATOM 0 HG12 VAL B 77 2.009 1.523 -1.921 1.00 0.00 H new ATOM 0 HG13 VAL B 77 3.218 1.910 -3.167 1.00 0.00 H new ATOM 0 HG21 VAL B 77 4.760 -0.692 -2.937 1.00 0.00 H new ATOM 0 HG22 VAL B 77 5.535 0.908 -3.007 1.00 0.00 H new ATOM 0 HG23 VAL B 77 5.914 -0.206 -1.673 1.00 0.00 H new ATOM 2667 N ALA B 78 2.711 2.274 0.999 1.00 0.00 N ATOM 2668 CA ALA B 78 1.588 2.948 1.616 1.00 0.00 C ATOM 2669 C ALA B 78 1.957 4.360 2.055 1.00 0.00 C ATOM 2670 O ALA B 78 1.287 5.312 1.653 1.00 0.00 O ATOM 2671 CB ALA B 78 1.052 2.127 2.793 1.00 0.00 C ATOM 0 H ALA B 78 2.988 1.414 1.473 1.00 0.00 H new ATOM 0 HA ALA B 78 0.798 3.037 0.870 1.00 0.00 H new ATOM 0 HB1 ALA B 78 0.208 2.648 3.246 1.00 0.00 H new ATOM 0 HB2 ALA B 78 0.726 1.150 2.437 1.00 0.00 H new ATOM 0 HB3 ALA B 78 1.840 1.998 3.536 1.00 0.00 H new ATOM 2677 N MET B 79 3.024 4.519 2.846 1.00 0.00 N ATOM 2678 CA MET B 79 3.401 5.858 3.297 1.00 0.00 C ATOM 2679 C MET B 79 3.800 6.746 2.118 1.00 0.00 C ATOM 2680 O MET B 79 3.375 7.899 2.050 1.00 0.00 O ATOM 2681 CB MET B 79 4.442 5.861 4.426 1.00 0.00 C ATOM 2682 CG MET B 79 5.649 4.938 4.259 1.00 0.00 C ATOM 2683 SD MET B 79 6.826 5.076 5.629 1.00 0.00 S ATOM 2684 CE MET B 79 7.761 3.551 5.404 1.00 0.00 C ATOM 0 H MET B 79 3.623 3.763 3.177 1.00 0.00 H new ATOM 0 HA MET B 79 2.509 6.294 3.748 1.00 0.00 H new ATOM 0 HB2 MET B 79 4.809 6.880 4.546 1.00 0.00 H new ATOM 0 HB3 MET B 79 3.936 5.593 5.354 1.00 0.00 H new ATOM 0 HG2 MET B 79 5.305 3.906 4.183 1.00 0.00 H new ATOM 0 HG3 MET B 79 6.156 5.175 3.324 1.00 0.00 H new ATOM 0 HE1 MET B 79 8.496 3.454 6.203 1.00 0.00 H new ATOM 0 HE2 MET B 79 7.081 2.700 5.432 1.00 0.00 H new ATOM 0 HE3 MET B 79 8.272 3.576 4.441 1.00 0.00 H new ATOM 2694 N ILE B 80 4.570 6.209 1.168 1.00 0.00 N ATOM 2695 CA ILE B 80 4.984 6.951 -0.020 1.00 0.00 C ATOM 2696 C ILE B 80 3.744 7.479 -0.753 1.00 0.00 C ATOM 2697 O ILE B 80 3.604 8.679 -1.005 1.00 0.00 O ATOM 2698 CB ILE B 80 5.819 6.022 -0.921 1.00 0.00 C ATOM 2699 CG1 ILE B 80 7.141 5.613 -0.245 1.00 0.00 C ATOM 2700 CG2 ILE B 80 6.058 6.618 -2.317 1.00 0.00 C ATOM 2701 CD1 ILE B 80 8.288 6.602 -0.461 1.00 0.00 C ATOM 0 H ILE B 80 4.921 5.252 1.202 1.00 0.00 H new ATOM 0 HA ILE B 80 5.598 7.808 0.259 1.00 0.00 H new ATOM 0 HB ILE B 80 5.230 5.116 -1.065 1.00 0.00 H new ATOM 0 HG12 ILE B 80 6.969 5.501 0.826 1.00 0.00 H new ATOM 0 HG13 ILE B 80 7.442 4.636 -0.623 1.00 0.00 H new ATOM 0 HG21 ILE B 80 6.651 5.924 -2.912 1.00 0.00 H new ATOM 0 HG22 ILE B 80 5.100 6.790 -2.808 1.00 0.00 H new ATOM 0 HG23 ILE B 80 6.592 7.563 -2.222 1.00 0.00 H new ATOM 0 HD11 ILE B 80 9.182 6.240 0.047 1.00 0.00 H new ATOM 0 HD12 ILE B 80 8.491 6.697 -1.528 1.00 0.00 H new ATOM 0 HD13 ILE B 80 8.010 7.575 -0.057 1.00 0.00 H new ATOM 2713 N THR B 81 2.842 6.561 -1.096 1.00 0.00 N ATOM 2714 CA THR B 81 1.637 6.864 -1.847 1.00 0.00 C ATOM 2715 C THR B 81 0.765 7.850 -1.074 1.00 0.00 C ATOM 2716 O THR B 81 0.243 8.789 -1.666 1.00 0.00 O ATOM 2717 CB THR B 81 0.870 5.570 -2.142 1.00 0.00 C ATOM 2718 OG1 THR B 81 1.704 4.667 -2.835 1.00 0.00 O ATOM 2719 CG2 THR B 81 -0.364 5.830 -3.005 1.00 0.00 C ATOM 0 H THR B 81 2.934 5.574 -0.854 1.00 0.00 H new ATOM 0 HA THR B 81 1.912 7.328 -2.794 1.00 0.00 H new ATOM 0 HB THR B 81 0.555 5.155 -1.185 1.00 0.00 H new ATOM 0 HG1 THR B 81 2.217 4.135 -2.191 1.00 0.00 H new ATOM 0 HG21 THR B 81 -0.881 4.889 -3.193 1.00 0.00 H new ATOM 0 HG22 THR B 81 -1.034 6.515 -2.485 1.00 0.00 H new ATOM 0 HG23 THR B 81 -0.058 6.271 -3.954 1.00 0.00 H new ATOM 2727 N THR B 82 0.593 7.649 0.235 1.00 0.00 N ATOM 2728 CA THR B 82 -0.221 8.548 1.039 1.00 0.00 C ATOM 2729 C THR B 82 0.394 9.949 1.024 1.00 0.00 C ATOM 2730 O THR B 82 -0.292 10.914 0.694 1.00 0.00 O ATOM 2731 CB THR B 82 -0.412 7.990 2.457 1.00 0.00 C ATOM 2732 OG1 THR B 82 -0.973 6.696 2.374 1.00 0.00 O ATOM 2733 CG2 THR B 82 -1.372 8.860 3.275 1.00 0.00 C ATOM 0 H THR B 82 1.007 6.874 0.754 1.00 0.00 H new ATOM 0 HA THR B 82 -1.219 8.626 0.608 1.00 0.00 H new ATOM 0 HB THR B 82 0.563 7.973 2.943 1.00 0.00 H new ATOM 0 HG1 THR B 82 -0.286 6.060 2.085 1.00 0.00 H new ATOM 0 HG21 THR B 82 -1.485 8.437 4.273 1.00 0.00 H new ATOM 0 HG22 THR B 82 -0.971 9.871 3.352 1.00 0.00 H new ATOM 0 HG23 THR B 82 -2.344 8.892 2.782 1.00 0.00 H new ATOM 2741 N ALA B 83 1.690 10.073 1.333 1.00 0.00 N ATOM 2742 CA ALA B 83 2.369 11.364 1.316 1.00 0.00 C ATOM 2743 C ALA B 83 2.178 12.046 -0.039 1.00 0.00 C ATOM 2744 O ALA B 83 1.824 13.223 -0.103 1.00 0.00 O ATOM 2745 CB ALA B 83 3.855 11.174 1.633 1.00 0.00 C ATOM 0 H ALA B 83 2.287 9.290 1.598 1.00 0.00 H new ATOM 0 HA ALA B 83 1.934 12.008 2.080 1.00 0.00 H new ATOM 0 HB1 ALA B 83 4.357 12.142 1.619 1.00 0.00 H new ATOM 0 HB2 ALA B 83 3.962 10.724 2.620 1.00 0.00 H new ATOM 0 HB3 ALA B 83 4.306 10.521 0.886 1.00 0.00 H new ATOM 2751 N CYS B 84 2.356 11.292 -1.129 1.00 0.00 N ATOM 2752 CA CYS B 84 2.088 11.810 -2.463 1.00 0.00 C ATOM 2753 C CYS B 84 0.644 12.296 -2.590 1.00 0.00 C ATOM 2754 O CYS B 84 0.424 13.460 -2.904 1.00 0.00 O ATOM 2755 CB CYS B 84 2.422 10.776 -3.537 1.00 0.00 C ATOM 2756 SG CYS B 84 2.043 11.531 -5.137 1.00 0.00 S ATOM 0 H CYS B 84 2.683 10.326 -1.108 1.00 0.00 H new ATOM 0 HA CYS B 84 2.740 12.670 -2.620 1.00 0.00 H new ATOM 0 HB2 CYS B 84 3.473 10.492 -3.484 1.00 0.00 H new ATOM 0 HB3 CYS B 84 1.838 9.867 -3.392 1.00 0.00 H new ATOM 0 HG CYS B 84 2.736 10.946 -6.068 1.00 0.00 H new ATOM 2762 N HIS B 85 -0.337 11.431 -2.318 1.00 0.00 N ATOM 2763 CA HIS B 85 -1.762 11.739 -2.390 1.00 0.00 C ATOM 2764 C HIS B 85 -2.078 13.052 -1.675 1.00 0.00 C ATOM 2765 O HIS B 85 -2.749 13.914 -2.239 1.00 0.00 O ATOM 2766 CB HIS B 85 -2.580 10.580 -1.806 1.00 0.00 C ATOM 2767 CG HIS B 85 -4.020 10.930 -1.531 1.00 0.00 C ATOM 2768 ND1 HIS B 85 -4.940 11.408 -2.439 1.00 0.00 N ATOM 2769 CD2 HIS B 85 -4.611 10.944 -0.296 1.00 0.00 C ATOM 2770 CE1 HIS B 85 -6.070 11.671 -1.761 1.00 0.00 C ATOM 2771 NE2 HIS B 85 -5.916 11.420 -0.451 1.00 0.00 N ATOM 0 H HIS B 85 -0.153 10.469 -2.033 1.00 0.00 H new ATOM 0 HA HIS B 85 -2.038 11.864 -3.437 1.00 0.00 H new ATOM 0 HB2 HIS B 85 -2.546 9.739 -2.498 1.00 0.00 H new ATOM 0 HB3 HIS B 85 -2.113 10.249 -0.879 1.00 0.00 H new ATOM 0 HD1 HIS B 85 -4.791 11.538 -3.440 1.00 0.00 H new ATOM 0 HD2 HIS B 85 -4.151 10.641 0.633 1.00 0.00 H new ATOM 0 HE1 HIS B 85 -6.982 12.036 -2.210 1.00 0.00 H new ATOM 2779 N GLU B 86 -1.587 13.207 -0.444 1.00 0.00 N ATOM 2780 CA GLU B 86 -1.776 14.428 0.320 1.00 0.00 C ATOM 2781 C GLU B 86 -1.352 15.661 -0.498 1.00 0.00 C ATOM 2782 O GLU B 86 -2.117 16.623 -0.607 1.00 0.00 O ATOM 2783 CB GLU B 86 -1.033 14.313 1.659 1.00 0.00 C ATOM 2784 CG GLU B 86 -1.613 13.236 2.599 1.00 0.00 C ATOM 2785 CD GLU B 86 -3.078 13.441 2.969 1.00 0.00 C ATOM 2786 OE1 GLU B 86 -3.933 12.935 2.208 1.00 0.00 O ATOM 2787 OE2 GLU B 86 -3.316 14.070 4.022 1.00 0.00 O ATOM 0 H GLU B 86 -1.051 12.490 0.044 1.00 0.00 H new ATOM 0 HA GLU B 86 -2.835 14.564 0.541 1.00 0.00 H new ATOM 0 HB2 GLU B 86 0.015 14.087 1.465 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -1.062 15.278 2.165 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -1.505 12.261 2.124 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -1.020 13.213 3.514 1.00 0.00 H new ATOM 2794 N PHE B 87 -0.172 15.605 -1.125 1.00 0.00 N ATOM 2795 CA PHE B 87 0.292 16.659 -2.031 1.00 0.00 C ATOM 2796 C PHE B 87 -0.647 16.780 -3.227 1.00 0.00 C ATOM 2797 O PHE B 87 -1.011 17.874 -3.643 1.00 0.00 O ATOM 2798 CB PHE B 87 1.745 16.397 -2.479 1.00 0.00 C ATOM 2799 CG PHE B 87 2.055 16.510 -3.970 1.00 0.00 C ATOM 2800 CD1 PHE B 87 1.970 17.748 -4.635 1.00 0.00 C ATOM 2801 CD2 PHE B 87 2.409 15.359 -4.702 1.00 0.00 C ATOM 2802 CE1 PHE B 87 2.253 17.838 -6.008 1.00 0.00 C ATOM 2803 CE2 PHE B 87 2.685 15.447 -6.078 1.00 0.00 C ATOM 2804 CZ PHE B 87 2.609 16.688 -6.732 1.00 0.00 C ATOM 0 H PHE B 87 0.485 14.832 -1.019 1.00 0.00 H new ATOM 0 HA PHE B 87 0.281 17.609 -1.496 1.00 0.00 H new ATOM 0 HB2 PHE B 87 2.392 17.095 -1.947 1.00 0.00 H new ATOM 0 HB3 PHE B 87 2.022 15.394 -2.153 1.00 0.00 H new ATOM 0 HD1 PHE B 87 1.686 18.634 -4.086 1.00 0.00 H new ATOM 0 HD2 PHE B 87 2.469 14.403 -4.203 1.00 0.00 H new ATOM 0 HE1 PHE B 87 2.197 18.794 -6.508 1.00 0.00 H new ATOM 0 HE2 PHE B 87 2.955 14.560 -6.632 1.00 0.00 H new ATOM 0 HZ PHE B 87 2.824 16.758 -7.788 1.00 0.00 H new ATOM 2814 N PHE B 88 -1.026 15.640 -3.794 1.00 0.00 N ATOM 2815 CA PHE B 88 -1.786 15.564 -5.025 1.00 0.00 C ATOM 2816 C PHE B 88 -3.110 16.307 -4.863 1.00 0.00 C ATOM 2817 O PHE B 88 -3.558 16.976 -5.791 1.00 0.00 O ATOM 2818 CB PHE B 88 -1.992 14.084 -5.364 1.00 0.00 C ATOM 2819 CG PHE B 88 -2.298 13.788 -6.818 1.00 0.00 C ATOM 2820 CD1 PHE B 88 -3.594 14.003 -7.326 1.00 0.00 C ATOM 2821 CD2 PHE B 88 -1.305 13.233 -7.644 1.00 0.00 C ATOM 2822 CE1 PHE B 88 -3.888 13.674 -8.660 1.00 0.00 C ATOM 2823 CE2 PHE B 88 -1.611 12.871 -8.968 1.00 0.00 C ATOM 2824 CZ PHE B 88 -2.903 13.089 -9.475 1.00 0.00 C ATOM 0 H PHE B 88 -0.806 14.726 -3.398 1.00 0.00 H new ATOM 0 HA PHE B 88 -1.252 16.041 -5.847 1.00 0.00 H new ATOM 0 HB2 PHE B 88 -1.094 13.535 -5.080 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -2.808 13.699 -4.753 1.00 0.00 H new ATOM 0 HD1 PHE B 88 -4.361 14.420 -6.691 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -0.306 13.084 -7.261 1.00 0.00 H new ATOM 0 HE1 PHE B 88 -4.872 13.871 -9.060 1.00 0.00 H new ATOM 0 HE2 PHE B 88 -0.853 12.425 -9.595 1.00 0.00 H new ATOM 0 HZ PHE B 88 -3.139 12.807 -10.490 1.00 0.00 H new ATOM 3136 N PHE C 76 -18.680 -11.790 -3.226 1.00 0.00 N ATOM 3137 CA PHE C 76 -17.554 -10.987 -3.680 1.00 0.00 C ATOM 3138 C PHE C 76 -16.251 -11.527 -3.085 1.00 0.00 C ATOM 3139 O PHE C 76 -15.242 -11.620 -3.779 1.00 0.00 O ATOM 3140 CB PHE C 76 -17.765 -9.497 -3.346 1.00 0.00 C ATOM 3141 CG PHE C 76 -19.207 -9.102 -3.071 1.00 0.00 C ATOM 3142 CD1 PHE C 76 -20.203 -9.399 -4.023 1.00 0.00 C ATOM 3143 CD2 PHE C 76 -19.584 -8.728 -1.769 1.00 0.00 C ATOM 3144 CE1 PHE C 76 -21.557 -9.420 -3.646 1.00 0.00 C ATOM 3145 CE2 PHE C 76 -20.939 -8.695 -1.410 1.00 0.00 C ATOM 3146 CZ PHE C 76 -21.922 -9.076 -2.333 1.00 0.00 C ATOM 0 HA PHE C 76 -17.484 -11.061 -4.765 1.00 0.00 H new ATOM 0 HB2 PHE C 76 -17.162 -9.246 -2.473 1.00 0.00 H new ATOM 0 HB3 PHE C 76 -17.391 -8.897 -4.175 1.00 0.00 H new ATOM 0 HD1 PHE C 76 -19.925 -9.611 -5.045 1.00 0.00 H new ATOM 0 HD2 PHE C 76 -18.828 -8.466 -1.044 1.00 0.00 H new ATOM 0 HE1 PHE C 76 -22.315 -9.700 -4.363 1.00 0.00 H new ATOM 0 HE2 PHE C 76 -21.226 -8.375 -0.419 1.00 0.00 H new ATOM 0 HZ PHE C 76 -22.960 -9.105 -2.036 1.00 0.00 H new ATOM 3156 N LEU C 77 -16.285 -11.889 -1.797 1.00 0.00 N ATOM 3157 CA LEU C 77 -15.139 -12.401 -1.061 1.00 0.00 C ATOM 3158 C LEU C 77 -14.944 -13.902 -1.298 1.00 0.00 C ATOM 3159 O LEU C 77 -13.839 -14.401 -1.106 1.00 0.00 O ATOM 3160 CB LEU C 77 -15.295 -12.096 0.436 1.00 0.00 C ATOM 3161 CG LEU C 77 -15.350 -10.591 0.759 1.00 0.00 C ATOM 3162 CD1 LEU C 77 -15.680 -10.411 2.244 1.00 0.00 C ATOM 3163 CD2 LEU C 77 -14.023 -9.882 0.452 1.00 0.00 C ATOM 0 H LEU C 77 -17.132 -11.830 -1.231 1.00 0.00 H new ATOM 0 HA LEU C 77 -14.245 -11.898 -1.430 1.00 0.00 H new ATOM 0 HB2 LEU C 77 -16.206 -12.570 0.801 1.00 0.00 H new ATOM 0 HB3 LEU C 77 -14.462 -12.545 0.978 1.00 0.00 H new ATOM 0 HG LEU C 77 -16.119 -10.144 0.130 1.00 0.00 H new ATOM 0 HD11 LEU C 77 -15.721 -9.348 2.481 1.00 0.00 H new ATOM 0 HD12 LEU C 77 -16.645 -10.868 2.460 1.00 0.00 H new ATOM 0 HD13 LEU C 77 -14.909 -10.888 2.849 1.00 0.00 H new ATOM 0 HD21 LEU C 77 -14.111 -8.823 0.696 1.00 0.00 H new ATOM 0 HD22 LEU C 77 -13.226 -10.327 1.048 1.00 0.00 H new ATOM 0 HD23 LEU C 77 -13.788 -9.992 -0.607 1.00 0.00 H new ATOM 3588 N THR D 74 17.805 11.948 4.852 1.00 0.00 N ATOM 3589 CA THR D 74 17.043 13.177 4.658 1.00 0.00 C ATOM 3590 C THR D 74 17.029 13.609 3.189 1.00 0.00 C ATOM 3591 O THR D 74 15.976 13.996 2.685 1.00 0.00 O ATOM 3592 CB THR D 74 17.598 14.292 5.558 1.00 0.00 C ATOM 3593 OG1 THR D 74 17.646 13.835 6.892 1.00 0.00 O ATOM 3594 CG2 THR D 74 16.722 15.547 5.530 1.00 0.00 C ATOM 0 HA THR D 74 16.009 12.981 4.943 1.00 0.00 H new ATOM 0 HB THR D 74 18.589 14.545 5.182 1.00 0.00 H new ATOM 0 HG1 THR D 74 17.700 12.857 6.901 1.00 0.00 H new ATOM 0 HG21 THR D 74 17.154 16.307 6.181 1.00 0.00 H new ATOM 0 HG22 THR D 74 16.668 15.930 4.511 1.00 0.00 H new ATOM 0 HG23 THR D 74 15.719 15.299 5.878 1.00 0.00 H new ATOM 3602 N GLU D 75 18.174 13.515 2.499 1.00 0.00 N ATOM 3603 CA GLU D 75 18.289 13.890 1.096 1.00 0.00 C ATOM 3604 C GLU D 75 17.165 13.267 0.262 1.00 0.00 C ATOM 3605 O GLU D 75 16.589 13.938 -0.590 1.00 0.00 O ATOM 3606 CB GLU D 75 19.665 13.494 0.536 1.00 0.00 C ATOM 3607 CG GLU D 75 20.833 14.220 1.229 1.00 0.00 C ATOM 3608 CD GLU D 75 20.753 15.740 1.119 1.00 0.00 C ATOM 3609 OE1 GLU D 75 20.529 16.224 -0.012 1.00 0.00 O ATOM 3610 OE2 GLU D 75 20.935 16.394 2.170 1.00 0.00 O ATOM 0 H GLU D 75 19.045 13.175 2.906 1.00 0.00 H new ATOM 0 HA GLU D 75 18.192 14.974 1.032 1.00 0.00 H new ATOM 0 HB2 GLU D 75 19.799 12.418 0.645 1.00 0.00 H new ATOM 0 HB3 GLU D 75 19.692 13.712 -0.532 1.00 0.00 H new ATOM 0 HG2 GLU D 75 20.851 13.940 2.282 1.00 0.00 H new ATOM 0 HG3 GLU D 75 21.772 13.881 0.792 1.00 0.00 H new ATOM 3617 N PHE D 76 16.841 11.999 0.517 1.00 0.00 N ATOM 3618 CA PHE D 76 15.807 11.281 -0.215 1.00 0.00 C ATOM 3619 C PHE D 76 14.445 11.518 0.439 1.00 0.00 C ATOM 3620 O PHE D 76 13.453 11.767 -0.242 1.00 0.00 O ATOM 3621 CB PHE D 76 16.151 9.786 -0.263 1.00 0.00 C ATOM 3622 CG PHE D 76 17.633 9.491 -0.416 1.00 0.00 C ATOM 3623 CD1 PHE D 76 18.367 10.058 -1.476 1.00 0.00 C ATOM 3624 CD2 PHE D 76 18.306 8.772 0.588 1.00 0.00 C ATOM 3625 CE1 PHE D 76 19.766 9.933 -1.513 1.00 0.00 C ATOM 3626 CE2 PHE D 76 19.702 8.625 0.535 1.00 0.00 C ATOM 3627 CZ PHE D 76 20.431 9.209 -0.510 1.00 0.00 C ATOM 0 H PHE D 76 17.293 11.442 1.242 1.00 0.00 H new ATOM 0 HA PHE D 76 15.757 11.652 -1.239 1.00 0.00 H new ATOM 0 HB2 PHE D 76 15.790 9.313 0.650 1.00 0.00 H new ATOM 0 HB3 PHE D 76 15.614 9.328 -1.093 1.00 0.00 H new ATOM 0 HD1 PHE D 76 17.853 10.590 -2.263 1.00 0.00 H new ATOM 0 HD2 PHE D 76 17.748 8.332 1.401 1.00 0.00 H new ATOM 0 HE1 PHE D 76 20.329 10.393 -2.312 1.00 0.00 H new ATOM 0 HE2 PHE D 76 20.214 8.061 1.301 1.00 0.00 H new ATOM 0 HZ PHE D 76 21.505 9.102 -0.544 1.00 0.00 H new ATOM 3637 N LEU D 77 14.394 11.431 1.774 1.00 0.00 N ATOM 3638 CA LEU D 77 13.149 11.535 2.531 1.00 0.00 C ATOM 3639 C LEU D 77 12.480 12.909 2.356 1.00 0.00 C ATOM 3640 O LEU D 77 11.261 13.015 2.508 1.00 0.00 O ATOM 3641 CB LEU D 77 13.394 11.218 4.013 1.00 0.00 C ATOM 3642 CG LEU D 77 14.004 9.826 4.273 1.00 0.00 C ATOM 3643 CD1 LEU D 77 14.500 9.753 5.718 1.00 0.00 C ATOM 3644 CD2 LEU D 77 13.018 8.680 4.032 1.00 0.00 C ATOM 0 H LEU D 77 15.218 11.286 2.357 1.00 0.00 H new ATOM 0 HA LEU D 77 12.456 10.795 2.130 1.00 0.00 H new ATOM 0 HB2 LEU D 77 14.058 11.976 4.429 1.00 0.00 H new ATOM 0 HB3 LEU D 77 12.448 11.293 4.549 1.00 0.00 H new ATOM 0 HG LEU D 77 14.823 9.704 3.564 1.00 0.00 H new ATOM 0 HD11 LEU D 77 14.932 8.770 5.905 1.00 0.00 H new ATOM 0 HD12 LEU D 77 15.258 10.519 5.882 1.00 0.00 H new ATOM 0 HD13 LEU D 77 13.664 9.918 6.398 1.00 0.00 H new ATOM 0 HD21 LEU D 77 13.510 7.728 4.233 1.00 0.00 H new ATOM 0 HD22 LEU D 77 12.161 8.792 4.696 1.00 0.00 H new ATOM 0 HD23 LEU D 77 12.680 8.702 2.996 1.00 0.00 H new ATOM 3656 N ARG D 78 13.257 13.935 1.982 1.00 0.00 N ATOM 3657 CA ARG D 78 12.807 15.309 1.760 1.00 0.00 C ATOM 3658 C ARG D 78 11.470 15.347 1.024 1.00 0.00 C ATOM 3659 O ARG D 78 10.546 16.042 1.450 1.00 0.00 O ATOM 3660 CB ARG D 78 13.829 16.021 0.859 1.00 0.00 C ATOM 3661 CG ARG D 78 14.840 16.887 1.612 1.00 0.00 C ATOM 3662 CD ARG D 78 15.978 17.287 0.666 1.00 0.00 C ATOM 3663 NE ARG D 78 15.480 17.916 -0.570 1.00 0.00 N ATOM 3664 CZ ARG D 78 15.375 17.341 -1.782 1.00 0.00 C ATOM 3665 NH1 ARG D 78 15.730 16.069 -2.003 1.00 0.00 N ATOM 3666 NH2 ARG D 78 14.890 18.061 -2.799 1.00 0.00 N ATOM 0 H ARG D 78 14.258 13.821 1.820 1.00 0.00 H new ATOM 0 HA ARG D 78 12.704 15.788 2.734 1.00 0.00 H new ATOM 0 HB2 ARG D 78 14.370 15.272 0.281 1.00 0.00 H new ATOM 0 HB3 ARG D 78 13.293 16.647 0.146 1.00 0.00 H new ATOM 0 HG2 ARG D 78 14.350 17.778 2.005 1.00 0.00 H new ATOM 0 HG3 ARG D 78 15.239 16.339 2.466 1.00 0.00 H new ATOM 0 HD2 ARG D 78 16.648 17.977 1.178 1.00 0.00 H new ATOM 0 HD3 ARG D 78 16.564 16.404 0.411 1.00 0.00 H new ATOM 0 HE ARG D 78 15.184 18.889 -0.499 1.00 0.00 H new ATOM 0 HH11 ARG D 78 16.095 15.501 -1.238 1.00 0.00 H new ATOM 0 HH12 ARG D 78 15.636 15.668 -2.936 1.00 0.00 H new ATOM 0 HH21 ARG D 78 14.607 19.029 -2.649 1.00 0.00 H new ATOM 0 HH22 ARG D 78 14.803 17.642 -3.725 1.00 0.00 H new