USER MOD reduce.3.24.130724 H: found=0, std=0, add=1484, rem=0, adj=56 USER MOD reduce.3.24.130724 removed 1486 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 80 SER OG : rot 110:sc= -0.0589 USER MOD Set 1.2: B 80 SER OG : rot 160:sc= -0.0566 USER MOD Set 2.1: B 31 LYS NZ :NH3+ -133:sc= 0.371 (180deg=-0.287) USER MOD Set 2.2: B 56 GLN : amide:sc= -0.371 K(o=-0.54,f=-2.6!) USER MOD Set 2.3: B 68 ASN : amide:sc= -0.536 K(o=-0.54,f=-8.2!) USER MOD Set 3.1: B 28 LYS NZ :NH3+ -154:sc= -6.49! (180deg=-5.26!) USER MOD Set 3.2: B 65 ASN : amide:sc= -2.41! C(o=-8.9!,f=-5.3!) USER MOD Set 4.1: A 31 LYS NZ :NH3+ -132:sc= 0.438 (180deg=-0.263) USER MOD Set 4.2: A 56 GLN : amide:sc= -0.338 K(o=-0.62,f=-2.6!) USER MOD Set 4.3: A 68 ASN : amide:sc= -0.717 K(o=-0.62,f=-8!) USER MOD Set 5.1: A 28 LYS NZ :NH3+ -152:sc= -6.68! (180deg=-5.53!) USER MOD Set 5.2: A 65 ASN : amide:sc= -2.59! C(o=-9.3!,f=-5.6!) USER MOD Single : A 3 SER OG : rot 33:sc= 0.259 USER MOD Single : A 7 LYS NZ :NH3+ 176:sc= -1.16! (180deg=-1.17!) USER MOD Single : A 12 MET CE :methyl -150:sc= 0 (180deg=-0.0781) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 65:sc= 1.03 USER MOD Single : A 17 HIS : no HD1:sc= -2.88! K(o=-2.9!,f=-1.8) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 TYR OH : rot 68:sc= 1.25 USER MOD Single : A 20 SER OG : rot -152:sc= 1.38 USER MOD Single : A 22 LYS NZ :NH3+ -128:sc= 1.23 (180deg=-0.566) USER MOD Single : A 26 LYS NZ :NH3+ -118:sc= -0.0129 (180deg=-0.52) USER MOD Single : A 30 ASN : amide:sc= -5.22! C(o=-5.2!,f=-1.8!) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -158:sc= 0.252 (180deg=-0.477) USER MOD Single : A 39 THR OG1 : rot -74:sc= 0.207 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 158:sc= -0.102 (180deg=-0.505) USER MOD Single : A 59 MET CE :methyl -142:sc= -3.07! (180deg=-7.95!) USER MOD Single : A 60 SER OG : rot 25:sc= 1.01 USER MOD Single : A 61 ASN : amide:sc= -2.86! K(o=-2.9!,f=-1.7) USER MOD Single : A 64 SER OG : rot 54:sc= 0.789 USER MOD Single : A 73 GLN : amide:sc= -2.85! K(o=-2.9!,f=-0.49) USER MOD Single : A 75 TYR OH : rot 180:sc= -0.14 USER MOD Single : A 76 SER OG : rot 14:sc= -0.0569 USER MOD Single : A 81 SER OG : rot -16:sc= 1.28 USER MOD Single : A 84 MET CE :methyl -140:sc= -0.174 (180deg=-0.779) USER MOD Single : A 85 MET CE :methyl -161:sc= -0.257 (180deg=-0.988) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -8.11! C(o=-8.1!,f=-11!) USER MOD Single : A 96 LYS NZ :NH3+ -150:sc= 0.659 (180deg=-1.25!) USER MOD Single : B 3 SER OG : rot 34:sc= 0.261 USER MOD Single : B 7 LYS NZ :NH3+ 176:sc= -0.987! (180deg=-1.1!) USER MOD Single : B 12 MET CE :methyl -151:sc= 0 (180deg=-0.0793) USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 15 THR OG1 : rot 64:sc= 1.03 USER MOD Single : B 17 HIS : no HD1:sc= -2.96! K(o=-3!,f=-1.9) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 TYR OH : rot 67:sc= 1.23 USER MOD Single : B 20 SER OG : rot -158:sc= 1.38 USER MOD Single : B 22 LYS NZ :NH3+ -125:sc= 1.27 (180deg=-0.604) USER MOD Single : B 26 LYS NZ :NH3+ -120:sc=-0.00941 (180deg=-0.531) USER MOD Single : B 30 ASN : amide:sc= -5.13! K(o=-5.1!,f=-1.8) USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 35 LYS NZ :NH3+ -158:sc= 0.257 (180deg=-0.482) USER MOD Single : B 39 THR OG1 : rot -76:sc= 0.248 USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 THR OG1 : rot 180:sc= 0 USER MOD Single : B 57 LYS NZ :NH3+ 158:sc= -0.0985 (180deg=-0.522) USER MOD Single : B 59 MET CE :methyl -142:sc= -3.11! (180deg=-7.95!) USER MOD Single : B 60 SER OG : rot 17:sc= 0.94 USER MOD Single : B 61 ASN : amide:sc= -2.79! K(o=-2.8!,f=-1.8) USER MOD Single : B 64 SER OG : rot 53:sc= 0.768 USER MOD Single : B 73 GLN : amide:sc= -2.97! K(o=-3!,f=-0.51) USER MOD Single : B 75 TYR OH : rot 180:sc= -0.146 USER MOD Single : B 76 SER OG : rot 14:sc= -0.114 USER MOD Single : B 81 SER OG : rot -31:sc= 1.15 USER MOD Single : B 84 MET CE :methyl -144:sc= -0.135 (180deg=-0.715) USER MOD Single : B 85 MET CE :methyl -161:sc= -0.34 (180deg=-1.02) USER MOD Single : B 86 SER OG : rot 180:sc= 0 USER MOD Single : B 87 ASN : amide:sc= -8.16! C(o=-8.2!,f=-11!) USER MOD Single : B 96 LYS NZ :NH3+ -158:sc= 0.651 (180deg=-1.35!) USER MOD ----------------------------------------------------------------- ATOM 30 N SER A 3 -8.174 3.255 13.627 1.00 0.79 N ATOM 31 CA SER A 3 -7.586 4.268 14.487 1.00 0.78 C ATOM 32 C SER A 3 -6.091 4.020 14.495 1.00 0.65 C ATOM 33 O SER A 3 -5.711 2.854 14.428 1.00 0.83 O ATOM 34 CB SER A 3 -8.174 4.144 15.896 1.00 0.97 C ATOM 35 OG SER A 3 -9.588 4.053 15.847 1.00 1.18 O ATOM 0 HA SER A 3 -7.798 5.276 14.130 1.00 0.78 H new ATOM 0 HB2 SER A 3 -7.766 3.262 16.389 1.00 0.97 H new ATOM 0 HB3 SER A 3 -7.881 5.007 16.494 1.00 0.97 H new ATOM 0 HG SER A 3 -9.857 3.583 15.030 1.00 1.18 H new ATOM 41 N PRO A 4 -5.260 5.015 14.844 1.00 0.67 N ATOM 42 CA PRO A 4 -3.997 5.392 14.169 1.00 0.62 C ATOM 43 C PRO A 4 -3.336 4.418 13.153 1.00 0.46 C ATOM 44 O PRO A 4 -2.354 4.803 12.532 1.00 0.50 O ATOM 45 CB PRO A 4 -3.095 5.600 15.377 1.00 0.79 C ATOM 46 CG PRO A 4 -3.994 6.194 16.423 1.00 0.96 C ATOM 47 CD PRO A 4 -5.424 5.870 16.026 1.00 0.87 C ATOM 0 HA PRO A 4 -4.183 6.230 13.498 1.00 0.62 H new ATOM 0 HB2 PRO A 4 -2.662 4.659 15.715 1.00 0.79 H new ATOM 0 HB3 PRO A 4 -2.265 6.267 15.142 1.00 0.79 H new ATOM 0 HG2 PRO A 4 -3.765 5.782 17.406 1.00 0.96 H new ATOM 0 HG3 PRO A 4 -3.848 7.272 16.488 1.00 0.96 H new ATOM 0 HD2 PRO A 4 -5.956 5.354 16.825 1.00 0.87 H new ATOM 0 HD3 PRO A 4 -5.992 6.771 15.795 1.00 0.87 H new ATOM 55 N LEU A 5 -3.826 3.194 12.987 1.00 0.36 N ATOM 56 CA LEU A 5 -3.250 2.231 12.050 1.00 0.32 C ATOM 57 C LEU A 5 -3.152 2.824 10.654 1.00 0.30 C ATOM 58 O LEU A 5 -2.166 2.605 9.958 1.00 0.32 O ATOM 59 CB LEU A 5 -4.100 0.959 11.999 1.00 0.31 C ATOM 60 CG LEU A 5 -3.610 -0.126 11.032 1.00 0.30 C ATOM 61 CD1 LEU A 5 -3.274 -1.389 11.801 1.00 0.40 C ATOM 62 CD2 LEU A 5 -4.658 -0.420 9.962 1.00 0.27 C ATOM 0 H LEU A 5 -4.634 2.840 13.498 1.00 0.36 H new ATOM 0 HA LEU A 5 -2.248 1.984 12.402 1.00 0.32 H new ATOM 0 HB2 LEU A 5 -4.146 0.533 13.001 1.00 0.31 H new ATOM 0 HB3 LEU A 5 -5.118 1.234 11.723 1.00 0.31 H new ATOM 0 HG LEU A 5 -2.712 0.238 10.532 1.00 0.30 H new ATOM 0 HD11 LEU A 5 -2.927 -2.155 11.108 1.00 0.40 H new ATOM 0 HD12 LEU A 5 -2.490 -1.175 12.528 1.00 0.40 H new ATOM 0 HD13 LEU A 5 -4.163 -1.746 12.321 1.00 0.40 H new ATOM 0 HD21 LEU A 5 -4.285 -1.193 9.290 1.00 0.27 H new ATOM 0 HD22 LEU A 5 -5.576 -0.765 10.437 1.00 0.27 H new ATOM 0 HD23 LEU A 5 -4.862 0.487 9.394 1.00 0.27 H new ATOM 74 N GLU A 6 -4.169 3.581 10.250 1.00 0.34 N ATOM 75 CA GLU A 6 -4.137 4.240 8.953 1.00 0.42 C ATOM 76 C GLU A 6 -2.894 5.119 8.840 1.00 0.33 C ATOM 77 O GLU A 6 -2.173 5.121 7.838 1.00 0.31 O ATOM 78 CB GLU A 6 -5.381 5.103 8.726 1.00 0.62 C ATOM 79 CG GLU A 6 -5.750 6.014 9.888 1.00 1.80 C ATOM 80 CD GLU A 6 -6.152 7.414 9.440 1.00 2.84 C ATOM 81 OE1 GLU A 6 -6.070 7.715 8.226 1.00 3.32 O ATOM 82 OE2 GLU A 6 -6.518 8.237 10.304 1.00 3.61 O ATOM 0 H GLU A 6 -5.014 3.750 10.796 1.00 0.34 H new ATOM 0 HA GLU A 6 -4.114 3.459 8.193 1.00 0.42 H new ATOM 0 HB2 GLU A 6 -5.223 5.716 7.839 1.00 0.62 H new ATOM 0 HB3 GLU A 6 -6.226 4.448 8.514 1.00 0.62 H new ATOM 0 HG2 GLU A 6 -6.572 5.567 10.447 1.00 1.80 H new ATOM 0 HG3 GLU A 6 -4.903 6.086 10.570 1.00 1.80 H new ATOM 89 N LYS A 7 -2.642 5.846 9.907 1.00 0.35 N ATOM 90 CA LYS A 7 -1.535 6.769 9.967 1.00 0.36 C ATOM 91 C LYS A 7 -0.252 6.011 10.279 1.00 0.32 C ATOM 92 O LYS A 7 0.842 6.530 10.117 1.00 0.35 O ATOM 93 CB LYS A 7 -1.837 7.889 10.970 1.00 0.44 C ATOM 94 CG LYS A 7 -3.264 8.449 10.843 1.00 0.63 C ATOM 95 CD LYS A 7 -3.518 9.291 9.576 1.00 0.79 C ATOM 96 CE LYS A 7 -3.137 8.580 8.282 1.00 1.78 C ATOM 97 NZ LYS A 7 -3.943 9.043 7.125 1.00 2.82 N ATOM 0 H LYS A 7 -3.202 5.812 10.759 1.00 0.35 H new ATOM 0 HA LYS A 7 -1.391 7.251 9.000 1.00 0.36 H new ATOM 0 HB2 LYS A 7 -1.691 7.511 11.982 1.00 0.44 H new ATOM 0 HB3 LYS A 7 -1.122 8.699 10.826 1.00 0.44 H new ATOM 0 HG2 LYS A 7 -3.968 7.617 10.857 1.00 0.63 H new ATOM 0 HG3 LYS A 7 -3.478 9.062 11.719 1.00 0.63 H new ATOM 0 HD2 LYS A 7 -4.573 9.561 9.535 1.00 0.79 H new ATOM 0 HD3 LYS A 7 -2.954 10.221 9.649 1.00 0.79 H new ATOM 0 HE2 LYS A 7 -2.080 8.748 8.076 1.00 1.78 H new ATOM 0 HE3 LYS A 7 -3.270 7.506 8.408 1.00 1.78 H new ATOM 0 HZ1 LYS A 7 -3.602 8.581 6.258 1.00 2.82 H new ATOM 0 HZ2 LYS A 7 -4.942 8.799 7.278 1.00 2.82 H new ATOM 0 HZ3 LYS A 7 -3.850 10.074 7.028 1.00 2.82 H new ATOM 111 N ALA A 8 -0.405 4.791 10.773 1.00 0.29 N ATOM 112 CA ALA A 8 0.716 3.879 10.939 1.00 0.29 C ATOM 113 C ALA A 8 1.233 3.401 9.586 1.00 0.27 C ATOM 114 O ALA A 8 2.424 3.150 9.431 1.00 0.28 O ATOM 115 CB ALA A 8 0.330 2.699 11.805 1.00 0.32 C ATOM 0 H ALA A 8 -1.303 4.408 11.068 1.00 0.29 H new ATOM 0 HA ALA A 8 1.517 4.423 11.440 1.00 0.29 H new ATOM 0 HB1 ALA A 8 1.185 2.032 11.914 1.00 0.32 H new ATOM 0 HB2 ALA A 8 0.020 3.055 12.788 1.00 0.32 H new ATOM 0 HB3 ALA A 8 -0.494 2.159 11.338 1.00 0.32 H new ATOM 121 N LEU A 9 0.345 3.267 8.598 1.00 0.26 N ATOM 122 CA LEU A 9 0.808 3.034 7.227 1.00 0.26 C ATOM 123 C LEU A 9 1.554 4.282 6.773 1.00 0.26 C ATOM 124 O LEU A 9 2.538 4.225 6.046 1.00 0.26 O ATOM 125 CB LEU A 9 -0.339 2.747 6.244 1.00 0.26 C ATOM 126 CG LEU A 9 -1.648 2.268 6.858 1.00 0.25 C ATOM 127 CD1 LEU A 9 -2.747 2.252 5.812 1.00 0.33 C ATOM 128 CD2 LEU A 9 -1.493 0.891 7.481 1.00 0.27 C ATOM 0 H LEU A 9 -0.667 3.314 8.714 1.00 0.26 H new ATOM 0 HA LEU A 9 1.446 2.151 7.229 1.00 0.26 H new ATOM 0 HB2 LEU A 9 -0.539 3.656 5.677 1.00 0.26 H new ATOM 0 HB3 LEU A 9 0.001 1.995 5.532 1.00 0.26 H new ATOM 0 HG LEU A 9 -1.923 2.966 7.649 1.00 0.25 H new ATOM 0 HD11 LEU A 9 -3.676 1.908 6.266 1.00 0.33 H new ATOM 0 HD12 LEU A 9 -2.887 3.258 5.416 1.00 0.33 H new ATOM 0 HD13 LEU A 9 -2.468 1.579 5.001 1.00 0.33 H new ATOM 0 HD21 LEU A 9 -2.444 0.577 7.911 1.00 0.27 H new ATOM 0 HD22 LEU A 9 -1.187 0.178 6.716 1.00 0.27 H new ATOM 0 HD23 LEU A 9 -0.736 0.929 8.264 1.00 0.27 H new ATOM 140 N ASP A 10 1.080 5.424 7.230 1.00 0.27 N ATOM 141 CA ASP A 10 1.809 6.675 7.023 1.00 0.29 C ATOM 142 C ASP A 10 3.166 6.607 7.738 1.00 0.27 C ATOM 143 O ASP A 10 4.159 7.182 7.289 1.00 0.28 O ATOM 144 CB ASP A 10 0.991 7.869 7.521 1.00 0.33 C ATOM 145 CG ASP A 10 1.694 9.193 7.310 1.00 0.38 C ATOM 146 OD1 ASP A 10 1.537 9.784 6.224 1.00 1.18 O ATOM 147 OD2 ASP A 10 2.399 9.658 8.231 1.00 1.16 O ATOM 0 H ASP A 10 0.203 5.520 7.743 1.00 0.27 H new ATOM 0 HA ASP A 10 1.980 6.812 5.955 1.00 0.29 H new ATOM 0 HB2 ASP A 10 0.031 7.886 7.004 1.00 0.33 H new ATOM 0 HB3 ASP A 10 0.779 7.741 8.583 1.00 0.33 H new ATOM 152 N VAL A 11 3.207 5.860 8.842 1.00 0.27 N ATOM 153 CA VAL A 11 4.440 5.638 9.576 1.00 0.27 C ATOM 154 C VAL A 11 5.343 4.663 8.818 1.00 0.27 C ATOM 155 O VAL A 11 6.552 4.648 9.013 1.00 0.29 O ATOM 156 CB VAL A 11 4.155 5.110 11.004 1.00 0.28 C ATOM 157 CG1 VAL A 11 5.436 4.711 11.714 1.00 0.31 C ATOM 158 CG2 VAL A 11 3.412 6.158 11.818 1.00 0.31 C ATOM 0 H VAL A 11 2.391 5.398 9.245 1.00 0.27 H new ATOM 0 HA VAL A 11 4.954 6.595 9.668 1.00 0.27 H new ATOM 0 HB VAL A 11 3.530 4.222 10.910 1.00 0.28 H new ATOM 0 HG11 VAL A 11 5.199 4.345 12.713 1.00 0.31 H new ATOM 0 HG12 VAL A 11 5.936 3.924 11.148 1.00 0.31 H new ATOM 0 HG13 VAL A 11 6.094 5.577 11.791 1.00 0.31 H new ATOM 0 HG21 VAL A 11 3.219 5.772 12.819 1.00 0.31 H new ATOM 0 HG22 VAL A 11 4.018 7.061 11.888 1.00 0.31 H new ATOM 0 HG23 VAL A 11 2.465 6.393 11.331 1.00 0.31 H new ATOM 168 N MET A 12 4.757 3.848 7.946 1.00 0.26 N ATOM 169 CA MET A 12 5.545 2.976 7.076 1.00 0.29 C ATOM 170 C MET A 12 6.311 3.835 6.071 1.00 0.29 C ATOM 171 O MET A 12 7.420 3.499 5.659 1.00 0.34 O ATOM 172 CB MET A 12 4.644 1.949 6.364 1.00 0.32 C ATOM 173 CG MET A 12 4.249 2.321 4.940 1.00 0.98 C ATOM 174 SD MET A 12 2.843 1.362 4.335 1.00 2.23 S ATOM 175 CE MET A 12 2.608 2.082 2.714 1.00 2.75 C ATOM 0 H MET A 12 3.747 3.772 7.822 1.00 0.26 H new ATOM 0 HA MET A 12 6.258 2.412 7.677 1.00 0.29 H new ATOM 0 HB2 MET A 12 5.159 0.988 6.344 1.00 0.32 H new ATOM 0 HB3 MET A 12 3.737 1.813 6.953 1.00 0.32 H new ATOM 0 HG2 MET A 12 4.004 3.382 4.901 1.00 0.98 H new ATOM 0 HG3 MET A 12 5.101 2.166 4.278 1.00 0.98 H new ATOM 0 HE1 MET A 12 1.555 2.023 2.439 1.00 2.75 H new ATOM 0 HE2 MET A 12 2.921 3.126 2.731 1.00 2.75 H new ATOM 0 HE3 MET A 12 3.205 1.536 1.983 1.00 2.75 H new ATOM 185 N VAL A 13 5.710 4.965 5.699 1.00 0.29 N ATOM 186 CA VAL A 13 6.392 5.959 4.871 1.00 0.31 C ATOM 187 C VAL A 13 7.599 6.528 5.628 1.00 0.27 C ATOM 188 O VAL A 13 8.693 6.690 5.073 1.00 0.27 O ATOM 189 CB VAL A 13 5.444 7.118 4.470 1.00 0.37 C ATOM 190 CG1 VAL A 13 6.129 8.074 3.504 1.00 0.41 C ATOM 191 CG2 VAL A 13 4.157 6.581 3.862 1.00 0.42 C ATOM 0 H VAL A 13 4.755 5.214 5.957 1.00 0.29 H new ATOM 0 HA VAL A 13 6.723 5.460 3.960 1.00 0.31 H new ATOM 0 HB VAL A 13 5.192 7.670 5.376 1.00 0.37 H new ATOM 0 HG11 VAL A 13 5.442 8.878 3.239 1.00 0.41 H new ATOM 0 HG12 VAL A 13 7.016 8.496 3.977 1.00 0.41 H new ATOM 0 HG13 VAL A 13 6.421 7.534 2.603 1.00 0.41 H new ATOM 0 HG21 VAL A 13 3.509 7.413 3.589 1.00 0.42 H new ATOM 0 HG22 VAL A 13 4.391 5.996 2.972 1.00 0.42 H new ATOM 0 HG23 VAL A 13 3.648 5.948 4.589 1.00 0.42 H new ATOM 201 N SER A 14 7.392 6.816 6.905 1.00 0.26 N ATOM 202 CA SER A 14 8.462 7.308 7.763 1.00 0.26 C ATOM 203 C SER A 14 9.519 6.230 7.993 1.00 0.25 C ATOM 204 O SER A 14 10.715 6.520 8.043 1.00 0.26 O ATOM 205 CB SER A 14 7.876 7.786 9.089 1.00 0.31 C ATOM 206 OG SER A 14 6.808 8.691 8.861 1.00 1.18 O ATOM 0 H SER A 14 6.490 6.717 7.372 1.00 0.26 H new ATOM 0 HA SER A 14 8.951 8.147 7.269 1.00 0.26 H new ATOM 0 HB2 SER A 14 7.520 6.932 9.665 1.00 0.31 H new ATOM 0 HB3 SER A 14 8.651 8.271 9.683 1.00 0.31 H new ATOM 0 HG SER A 14 6.441 8.987 9.720 1.00 1.18 H new ATOM 212 N THR A 15 9.061 4.993 8.118 1.00 0.28 N ATOM 213 CA THR A 15 9.931 3.831 8.187 1.00 0.32 C ATOM 214 C THR A 15 10.949 3.876 7.046 1.00 0.28 C ATOM 215 O THR A 15 12.150 3.618 7.227 1.00 0.29 O ATOM 216 CB THR A 15 9.085 2.547 8.088 1.00 0.45 C ATOM 217 OG1 THR A 15 8.252 2.428 9.251 1.00 0.59 O ATOM 218 CG2 THR A 15 9.955 1.313 7.943 1.00 0.93 C ATOM 0 H THR A 15 8.068 4.767 8.175 1.00 0.28 H new ATOM 0 HA THR A 15 10.465 3.836 9.137 1.00 0.32 H new ATOM 0 HB THR A 15 8.463 2.619 7.195 1.00 0.45 H new ATOM 0 HG1 THR A 15 7.609 3.168 9.270 1.00 0.59 H new ATOM 0 HG21 THR A 15 9.323 0.428 7.876 1.00 0.93 H new ATOM 0 HG22 THR A 15 10.558 1.397 7.039 1.00 0.93 H new ATOM 0 HG23 THR A 15 10.610 1.226 8.810 1.00 0.93 H new ATOM 226 N PHE A 16 10.449 4.262 5.881 1.00 0.27 N ATOM 227 CA PHE A 16 11.253 4.350 4.684 1.00 0.27 C ATOM 228 C PHE A 16 12.377 5.364 4.820 1.00 0.29 C ATOM 229 O PHE A 16 13.549 5.006 4.693 1.00 0.37 O ATOM 230 CB PHE A 16 10.378 4.700 3.487 1.00 0.34 C ATOM 231 CG PHE A 16 11.158 4.800 2.219 1.00 0.83 C ATOM 232 CD1 PHE A 16 11.386 3.681 1.448 1.00 1.73 C ATOM 233 CD2 PHE A 16 11.685 6.010 1.811 1.00 1.65 C ATOM 234 CE1 PHE A 16 12.122 3.766 0.291 1.00 2.34 C ATOM 235 CE2 PHE A 16 12.426 6.099 0.659 1.00 2.27 C ATOM 236 CZ PHE A 16 12.645 4.975 -0.100 1.00 2.36 C ATOM 0 H PHE A 16 9.472 4.522 5.745 1.00 0.27 H new ATOM 0 HA PHE A 16 11.710 3.373 4.529 1.00 0.27 H new ATOM 0 HB2 PHE A 16 9.603 3.942 3.374 1.00 0.34 H new ATOM 0 HB3 PHE A 16 9.873 5.648 3.675 1.00 0.34 H new ATOM 0 HD1 PHE A 16 10.982 2.728 1.756 1.00 1.73 H new ATOM 0 HD2 PHE A 16 11.512 6.895 2.405 1.00 1.65 H new ATOM 0 HE1 PHE A 16 12.289 2.884 -0.310 1.00 2.34 H new ATOM 0 HE2 PHE A 16 12.836 7.049 0.350 1.00 2.27 H new ATOM 0 HZ PHE A 16 13.229 5.042 -1.006 1.00 2.36 H new ATOM 246 N HIS A 17 12.032 6.625 5.074 1.00 0.30 N ATOM 247 CA HIS A 17 13.047 7.681 5.096 1.00 0.40 C ATOM 248 C HIS A 17 14.078 7.438 6.188 1.00 0.36 C ATOM 249 O HIS A 17 15.180 7.984 6.146 1.00 0.42 O ATOM 250 CB HIS A 17 12.421 9.084 5.214 1.00 0.59 C ATOM 251 CG HIS A 17 11.675 9.390 6.488 1.00 0.81 C ATOM 252 ND1 HIS A 17 10.440 10.002 6.494 1.00 1.53 N ATOM 253 CD2 HIS A 17 12.012 9.230 7.792 1.00 1.78 C ATOM 254 CE1 HIS A 17 10.054 10.203 7.738 1.00 2.03 C ATOM 255 NE2 HIS A 17 10.987 9.743 8.545 1.00 2.20 N ATOM 0 H HIS A 17 11.080 6.938 5.264 1.00 0.30 H new ATOM 0 HA HIS A 17 13.565 7.644 4.138 1.00 0.40 H new ATOM 0 HB2 HIS A 17 13.216 9.821 5.100 1.00 0.59 H new ATOM 0 HB3 HIS A 17 11.736 9.222 4.378 1.00 0.59 H new ATOM 0 HD2 HIS A 17 12.920 8.782 8.168 1.00 1.78 H new ATOM 0 HE1 HIS A 17 9.128 10.667 8.044 1.00 2.03 H new ATOM 0 HE2 HIS A 17 10.953 9.765 9.564 1.00 2.20 H new ATOM 264 N LYS A 18 13.717 6.599 7.147 1.00 0.34 N ATOM 265 CA LYS A 18 14.620 6.204 8.210 1.00 0.39 C ATOM 266 C LYS A 18 15.764 5.360 7.662 1.00 0.37 C ATOM 267 O LYS A 18 16.935 5.687 7.858 1.00 0.47 O ATOM 268 CB LYS A 18 13.842 5.432 9.275 1.00 0.43 C ATOM 269 CG LYS A 18 14.712 4.782 10.340 1.00 0.55 C ATOM 270 CD LYS A 18 13.903 4.491 11.597 1.00 0.73 C ATOM 271 CE LYS A 18 12.666 3.659 11.301 1.00 0.80 C ATOM 272 NZ LYS A 18 11.726 3.643 12.452 1.00 1.28 N ATOM 0 H LYS A 18 12.791 6.175 7.208 1.00 0.34 H new ATOM 0 HA LYS A 18 15.053 7.097 8.660 1.00 0.39 H new ATOM 0 HB2 LYS A 18 13.142 6.112 9.760 1.00 0.43 H new ATOM 0 HB3 LYS A 18 13.249 4.659 8.786 1.00 0.43 H new ATOM 0 HG2 LYS A 18 15.137 3.856 9.953 1.00 0.55 H new ATOM 0 HG3 LYS A 18 15.547 5.438 10.584 1.00 0.55 H new ATOM 0 HD2 LYS A 18 14.530 3.965 12.317 1.00 0.73 H new ATOM 0 HD3 LYS A 18 13.605 5.431 12.061 1.00 0.73 H new ATOM 0 HE2 LYS A 18 12.159 4.060 10.423 1.00 0.80 H new ATOM 0 HE3 LYS A 18 12.963 2.638 11.060 1.00 0.80 H new ATOM 0 HZ1 LYS A 18 10.894 3.066 12.213 1.00 1.28 H new ATOM 0 HZ2 LYS A 18 12.202 3.237 13.283 1.00 1.28 H new ATOM 0 HZ3 LYS A 18 11.423 4.615 12.666 1.00 1.28 H new ATOM 286 N TYR A 19 15.426 4.289 6.957 1.00 0.29 N ATOM 287 CA TYR A 19 16.443 3.389 6.425 1.00 0.29 C ATOM 288 C TYR A 19 17.079 3.931 5.151 1.00 0.33 C ATOM 289 O TYR A 19 18.226 3.621 4.845 1.00 0.44 O ATOM 290 CB TYR A 19 15.860 2.005 6.177 1.00 0.31 C ATOM 291 CG TYR A 19 15.747 1.175 7.433 1.00 0.36 C ATOM 292 CD1 TYR A 19 14.823 1.489 8.417 1.00 1.28 C ATOM 293 CD2 TYR A 19 16.576 0.081 7.637 1.00 1.23 C ATOM 294 CE1 TYR A 19 14.725 0.735 9.566 1.00 1.35 C ATOM 295 CE2 TYR A 19 16.483 -0.681 8.783 1.00 1.26 C ATOM 296 CZ TYR A 19 15.556 -0.348 9.745 1.00 0.62 C ATOM 297 OH TYR A 19 15.446 -1.110 10.885 1.00 0.79 O ATOM 0 H TYR A 19 14.465 4.023 6.741 1.00 0.29 H new ATOM 0 HA TYR A 19 17.229 3.314 7.177 1.00 0.29 H new ATOM 0 HB2 TYR A 19 14.872 2.109 5.727 1.00 0.31 H new ATOM 0 HB3 TYR A 19 16.485 1.478 5.456 1.00 0.31 H new ATOM 0 HD1 TYR A 19 14.170 2.338 8.281 1.00 1.28 H new ATOM 0 HD2 TYR A 19 17.307 -0.178 6.885 1.00 1.23 H new ATOM 0 HE1 TYR A 19 13.999 0.992 10.323 1.00 1.35 H new ATOM 0 HE2 TYR A 19 17.132 -1.532 8.925 1.00 1.26 H new ATOM 0 HH TYR A 19 14.591 -1.589 10.877 1.00 0.79 H new ATOM 307 N SER A 20 16.339 4.728 4.407 1.00 0.29 N ATOM 308 CA SER A 20 16.864 5.320 3.190 1.00 0.32 C ATOM 309 C SER A 20 17.934 6.345 3.523 1.00 0.40 C ATOM 310 O SER A 20 18.983 6.388 2.890 1.00 0.60 O ATOM 311 CB SER A 20 15.732 5.976 2.414 1.00 0.35 C ATOM 312 OG SER A 20 14.687 5.052 2.196 1.00 0.86 O ATOM 0 H SER A 20 15.375 4.981 4.622 1.00 0.29 H new ATOM 0 HA SER A 20 17.313 4.538 2.577 1.00 0.32 H new ATOM 0 HB2 SER A 20 15.356 6.838 2.965 1.00 0.35 H new ATOM 0 HB3 SER A 20 16.104 6.347 1.459 1.00 0.35 H new ATOM 0 HG SER A 20 14.204 5.291 1.377 1.00 0.86 H new ATOM 318 N GLY A 21 17.684 7.132 4.565 1.00 0.37 N ATOM 319 CA GLY A 21 18.601 8.194 4.942 1.00 0.43 C ATOM 320 C GLY A 21 19.837 7.684 5.654 1.00 0.41 C ATOM 321 O GLY A 21 20.442 8.398 6.455 1.00 0.46 O ATOM 0 H GLY A 21 16.858 7.053 5.158 1.00 0.37 H new ATOM 0 HA2 GLY A 21 18.903 8.740 4.048 1.00 0.43 H new ATOM 0 HA3 GLY A 21 18.082 8.902 5.588 1.00 0.43 H new ATOM 325 N LYS A 22 20.206 6.450 5.369 1.00 0.40 N ATOM 326 CA LYS A 22 21.392 5.854 5.949 1.00 0.46 C ATOM 327 C LYS A 22 22.519 5.800 4.927 1.00 0.52 C ATOM 328 O LYS A 22 23.685 6.015 5.262 1.00 0.65 O ATOM 329 CB LYS A 22 21.092 4.452 6.443 1.00 0.47 C ATOM 330 CG LYS A 22 19.977 4.374 7.465 1.00 0.60 C ATOM 331 CD LYS A 22 19.862 2.970 8.030 1.00 0.56 C ATOM 332 CE LYS A 22 19.555 1.948 6.947 1.00 0.49 C ATOM 333 NZ LYS A 22 19.848 0.566 7.400 1.00 1.08 N ATOM 0 H LYS A 22 19.696 5.837 4.733 1.00 0.40 H new ATOM 0 HA LYS A 22 21.704 6.473 6.790 1.00 0.46 H new ATOM 0 HB2 LYS A 22 20.830 3.827 5.589 1.00 0.47 H new ATOM 0 HB3 LYS A 22 21.998 4.032 6.879 1.00 0.47 H new ATOM 0 HG2 LYS A 22 20.167 5.081 8.272 1.00 0.60 H new ATOM 0 HG3 LYS A 22 19.033 4.664 7.003 1.00 0.60 H new ATOM 0 HD2 LYS A 22 20.793 2.702 8.529 1.00 0.56 H new ATOM 0 HD3 LYS A 22 19.077 2.946 8.786 1.00 0.56 H new ATOM 0 HE2 LYS A 22 18.506 2.023 6.662 1.00 0.49 H new ATOM 0 HE3 LYS A 22 20.143 2.172 6.057 1.00 0.49 H new ATOM 0 HZ1 LYS A 22 20.460 0.095 6.704 1.00 1.08 H new ATOM 0 HZ2 LYS A 22 20.331 0.597 8.321 1.00 1.08 H new ATOM 0 HZ3 LYS A 22 18.958 0.035 7.494 1.00 1.08 H new ATOM 347 N GLU A 23 22.162 5.518 3.680 1.00 0.47 N ATOM 348 CA GLU A 23 23.141 5.374 2.613 1.00 0.55 C ATOM 349 C GLU A 23 22.504 5.727 1.272 1.00 0.58 C ATOM 350 O GLU A 23 21.287 5.653 1.127 1.00 0.64 O ATOM 351 CB GLU A 23 23.679 3.938 2.597 1.00 0.67 C ATOM 352 CG GLU A 23 24.776 3.691 1.576 1.00 1.15 C ATOM 353 CD GLU A 23 25.949 4.629 1.759 1.00 1.59 C ATOM 354 OE1 GLU A 23 25.903 5.756 1.222 1.00 1.96 O ATOM 355 OE2 GLU A 23 26.916 4.250 2.452 1.00 2.38 O ATOM 0 H GLU A 23 21.195 5.384 3.383 1.00 0.47 H new ATOM 0 HA GLU A 23 23.973 6.056 2.789 1.00 0.55 H new ATOM 0 HB2 GLU A 23 24.061 3.695 3.589 1.00 0.67 H new ATOM 0 HB3 GLU A 23 22.853 3.256 2.397 1.00 0.67 H new ATOM 0 HG2 GLU A 23 25.121 2.660 1.658 1.00 1.15 H new ATOM 0 HG3 GLU A 23 24.369 3.812 0.572 1.00 1.15 H new ATOM 362 N GLY A 24 23.330 6.101 0.302 1.00 0.72 N ATOM 363 CA GLY A 24 22.826 6.475 -1.004 1.00 0.85 C ATOM 364 C GLY A 24 22.140 7.820 -0.970 1.00 0.79 C ATOM 365 O GLY A 24 22.771 8.837 -0.672 1.00 0.92 O ATOM 0 H GLY A 24 24.344 6.152 0.399 1.00 0.72 H new ATOM 0 HA2 GLY A 24 23.649 6.504 -1.718 1.00 0.85 H new ATOM 0 HA3 GLY A 24 22.126 5.717 -1.355 1.00 0.85 H new ATOM 369 N ASP A 25 20.852 7.835 -1.272 1.00 0.71 N ATOM 370 CA ASP A 25 20.064 9.053 -1.138 1.00 0.70 C ATOM 371 C ASP A 25 19.415 9.084 0.228 1.00 0.73 C ATOM 372 O ASP A 25 19.688 8.247 1.078 1.00 1.34 O ATOM 373 CB ASP A 25 18.962 9.149 -2.200 1.00 0.73 C ATOM 374 CG ASP A 25 19.492 9.227 -3.617 1.00 1.04 C ATOM 375 OD1 ASP A 25 20.429 10.015 -3.868 1.00 1.65 O ATOM 376 OD2 ASP A 25 18.956 8.526 -4.495 1.00 1.75 O ATOM 0 H ASP A 25 20.331 7.025 -1.609 1.00 0.71 H new ATOM 0 HA ASP A 25 20.743 9.895 -1.271 1.00 0.70 H new ATOM 0 HB2 ASP A 25 18.308 8.281 -2.113 1.00 0.73 H new ATOM 0 HB3 ASP A 25 18.352 10.030 -2.000 1.00 0.73 H new ATOM 381 N LYS A 26 18.562 10.062 0.433 1.00 0.61 N ATOM 382 CA LYS A 26 17.754 10.140 1.629 1.00 0.56 C ATOM 383 C LYS A 26 16.328 9.709 1.298 1.00 0.49 C ATOM 384 O LYS A 26 15.471 9.563 2.174 1.00 0.55 O ATOM 385 CB LYS A 26 17.784 11.576 2.147 1.00 0.71 C ATOM 386 CG LYS A 26 16.794 11.862 3.252 1.00 1.03 C ATOM 387 CD LYS A 26 17.174 11.167 4.547 1.00 0.70 C ATOM 388 CE LYS A 26 16.542 11.847 5.749 1.00 0.94 C ATOM 389 NZ LYS A 26 15.058 11.809 5.702 1.00 1.56 N ATOM 0 H LYS A 26 18.409 10.826 -0.225 1.00 0.61 H new ATOM 0 HA LYS A 26 18.144 9.478 2.402 1.00 0.56 H new ATOM 0 HB2 LYS A 26 18.788 11.798 2.509 1.00 0.71 H new ATOM 0 HB3 LYS A 26 17.588 12.253 1.316 1.00 0.71 H new ATOM 0 HG2 LYS A 26 16.738 12.938 3.420 1.00 1.03 H new ATOM 0 HG3 LYS A 26 15.801 11.536 2.943 1.00 1.03 H new ATOM 0 HD2 LYS A 26 16.857 10.125 4.509 1.00 0.70 H new ATOM 0 HD3 LYS A 26 18.259 11.166 4.656 1.00 0.70 H new ATOM 0 HE2 LYS A 26 16.887 11.361 6.662 1.00 0.94 H new ATOM 0 HE3 LYS A 26 16.876 12.884 5.794 1.00 0.94 H new ATOM 0 HZ1 LYS A 26 14.687 12.780 5.662 1.00 1.56 H new ATOM 0 HZ2 LYS A 26 14.751 11.286 4.857 1.00 1.56 H new ATOM 0 HZ3 LYS A 26 14.696 11.335 6.554 1.00 1.56 H new ATOM 403 N PHE A 27 16.101 9.455 0.021 1.00 0.45 N ATOM 404 CA PHE A 27 14.760 9.252 -0.486 1.00 0.44 C ATOM 405 C PHE A 27 14.675 7.922 -1.204 1.00 0.40 C ATOM 406 O PHE A 27 13.675 7.628 -1.861 1.00 0.40 O ATOM 407 CB PHE A 27 14.384 10.384 -1.451 1.00 0.50 C ATOM 408 CG PHE A 27 14.735 11.759 -0.950 1.00 0.78 C ATOM 409 CD1 PHE A 27 13.929 12.411 -0.029 1.00 1.76 C ATOM 410 CD2 PHE A 27 15.879 12.398 -1.402 1.00 1.28 C ATOM 411 CE1 PHE A 27 14.260 13.672 0.429 1.00 2.09 C ATOM 412 CE2 PHE A 27 16.214 13.658 -0.947 1.00 1.59 C ATOM 413 CZ PHE A 27 15.403 14.295 -0.029 1.00 1.65 C ATOM 0 H PHE A 27 16.834 9.385 -0.685 1.00 0.45 H new ATOM 0 HA PHE A 27 14.064 9.253 0.353 1.00 0.44 H new ATOM 0 HB2 PHE A 27 14.886 10.217 -2.404 1.00 0.50 H new ATOM 0 HB3 PHE A 27 13.312 10.342 -1.644 1.00 0.50 H new ATOM 0 HD1 PHE A 27 13.034 11.928 0.334 1.00 1.76 H new ATOM 0 HD2 PHE A 27 16.517 11.904 -2.120 1.00 1.28 H new ATOM 0 HE1 PHE A 27 13.624 14.170 1.146 1.00 2.09 H new ATOM 0 HE2 PHE A 27 17.108 14.144 -1.308 1.00 1.59 H new ATOM 0 HZ PHE A 27 15.663 15.280 0.330 1.00 1.65 H new ATOM 423 N LYS A 28 15.722 7.117 -1.067 1.00 0.39 N ATOM 424 CA LYS A 28 15.809 5.850 -1.775 1.00 0.36 C ATOM 425 C LYS A 28 16.646 4.834 -1.026 1.00 0.34 C ATOM 426 O LYS A 28 17.685 5.152 -0.449 1.00 0.38 O ATOM 427 CB LYS A 28 16.354 6.024 -3.194 1.00 0.40 C ATOM 428 CG LYS A 28 15.318 6.518 -4.184 1.00 0.49 C ATOM 429 CD LYS A 28 15.795 6.373 -5.619 1.00 0.56 C ATOM 430 CE LYS A 28 14.701 6.718 -6.625 1.00 0.86 C ATOM 431 NZ LYS A 28 13.723 5.603 -6.799 1.00 1.70 N ATOM 0 H LYS A 28 16.523 7.322 -0.470 1.00 0.39 H new ATOM 0 HA LYS A 28 14.789 5.472 -1.840 1.00 0.36 H new ATOM 0 HB2 LYS A 28 17.187 6.727 -3.171 1.00 0.40 H new ATOM 0 HB3 LYS A 28 16.751 5.070 -3.542 1.00 0.40 H new ATOM 0 HG2 LYS A 28 14.392 5.959 -4.051 1.00 0.49 H new ATOM 0 HG3 LYS A 28 15.091 7.564 -3.980 1.00 0.49 H new ATOM 0 HD2 LYS A 28 16.655 7.023 -5.782 1.00 0.56 H new ATOM 0 HD3 LYS A 28 16.132 5.350 -5.787 1.00 0.56 H new ATOM 0 HE2 LYS A 28 14.174 7.613 -6.294 1.00 0.86 H new ATOM 0 HE3 LYS A 28 15.156 6.954 -7.587 1.00 0.86 H new ATOM 0 HZ1 LYS A 28 13.314 5.646 -7.754 1.00 1.70 H new ATOM 0 HZ2 LYS A 28 14.208 4.692 -6.670 1.00 1.70 H new ATOM 0 HZ3 LYS A 28 12.964 5.694 -6.094 1.00 1.70 H new ATOM 445 N LEU A 29 16.160 3.610 -1.053 1.00 0.31 N ATOM 446 CA LEU A 29 16.826 2.483 -0.442 1.00 0.28 C ATOM 447 C LEU A 29 17.678 1.758 -1.459 1.00 0.31 C ATOM 448 O LEU A 29 17.165 1.093 -2.360 1.00 0.33 O ATOM 449 CB LEU A 29 15.810 1.494 0.118 1.00 0.26 C ATOM 450 CG LEU A 29 14.956 1.995 1.266 1.00 0.26 C ATOM 451 CD1 LEU A 29 13.720 1.129 1.389 1.00 0.28 C ATOM 452 CD2 LEU A 29 15.748 1.969 2.560 1.00 0.25 C ATOM 0 H LEU A 29 15.279 3.369 -1.507 1.00 0.31 H new ATOM 0 HA LEU A 29 17.450 2.868 0.364 1.00 0.28 H new ATOM 0 HB2 LEU A 29 15.149 1.185 -0.692 1.00 0.26 H new ATOM 0 HB3 LEU A 29 16.344 0.604 0.451 1.00 0.26 H new ATOM 0 HG LEU A 29 14.655 3.024 1.068 1.00 0.26 H new ATOM 0 HD11 LEU A 29 13.105 1.488 2.214 1.00 0.28 H new ATOM 0 HD12 LEU A 29 13.148 1.177 0.462 1.00 0.28 H new ATOM 0 HD13 LEU A 29 14.016 0.097 1.579 1.00 0.28 H new ATOM 0 HD21 LEU A 29 15.123 2.331 3.376 1.00 0.25 H new ATOM 0 HD22 LEU A 29 16.066 0.948 2.772 1.00 0.25 H new ATOM 0 HD23 LEU A 29 16.625 2.609 2.463 1.00 0.25 H new ATOM 464 N ASN A 30 18.971 1.888 -1.304 1.00 0.32 N ATOM 465 CA ASN A 30 19.919 1.088 -2.046 1.00 0.36 C ATOM 466 C ASN A 30 19.868 -0.320 -1.494 1.00 0.33 C ATOM 467 O ASN A 30 19.287 -0.530 -0.431 1.00 0.30 O ATOM 468 CB ASN A 30 21.313 1.692 -1.907 1.00 0.42 C ATOM 469 CG ASN A 30 21.635 2.017 -0.465 1.00 0.44 C ATOM 470 OD1 ASN A 30 22.323 1.260 0.219 1.00 0.56 O ATOM 471 ND2 ASN A 30 21.088 3.125 0.021 1.00 0.43 N ATOM 0 H ASN A 30 19.399 2.552 -0.659 1.00 0.32 H new ATOM 0 HA ASN A 30 19.673 1.067 -3.108 1.00 0.36 H new ATOM 0 HB2 ASN A 30 22.054 0.994 -2.298 1.00 0.42 H new ATOM 0 HB3 ASN A 30 21.380 2.598 -2.509 1.00 0.42 H new ATOM 0 HD21 ASN A 30 21.231 3.378 0.999 1.00 0.43 H new ATOM 0 HD22 ASN A 30 20.525 3.723 -0.583 1.00 0.43 H new ATOM 478 N LYS A 31 20.457 -1.274 -2.196 1.00 0.35 N ATOM 479 CA LYS A 31 20.294 -2.683 -1.843 1.00 0.34 C ATOM 480 C LYS A 31 20.612 -2.931 -0.376 1.00 0.31 C ATOM 481 O LYS A 31 19.904 -3.670 0.305 1.00 0.31 O ATOM 482 CB LYS A 31 21.205 -3.584 -2.665 1.00 0.41 C ATOM 483 CG LYS A 31 20.927 -3.619 -4.151 1.00 0.68 C ATOM 484 CD LYS A 31 21.667 -4.778 -4.797 1.00 0.71 C ATOM 485 CE LYS A 31 21.678 -4.663 -6.307 1.00 1.15 C ATOM 486 NZ LYS A 31 22.509 -3.519 -6.769 1.00 1.99 N ATOM 0 H LYS A 31 21.049 -1.105 -3.009 1.00 0.35 H new ATOM 0 HA LYS A 31 19.251 -2.920 -2.050 1.00 0.34 H new ATOM 0 HB2 LYS A 31 22.235 -3.262 -2.514 1.00 0.41 H new ATOM 0 HB3 LYS A 31 21.128 -4.599 -2.276 1.00 0.41 H new ATOM 0 HG2 LYS A 31 19.856 -3.720 -4.325 1.00 0.68 H new ATOM 0 HG3 LYS A 31 21.238 -2.680 -4.609 1.00 0.68 H new ATOM 0 HD2 LYS A 31 22.692 -4.807 -4.427 1.00 0.71 H new ATOM 0 HD3 LYS A 31 21.196 -5.717 -4.507 1.00 0.71 H new ATOM 0 HE2 LYS A 31 22.061 -5.588 -6.739 1.00 1.15 H new ATOM 0 HE3 LYS A 31 20.657 -4.540 -6.669 1.00 1.15 H new ATOM 0 HZ1 LYS A 31 21.978 -2.965 -7.471 1.00 1.99 H new ATOM 0 HZ2 LYS A 31 22.747 -2.913 -5.958 1.00 1.99 H new ATOM 0 HZ3 LYS A 31 23.384 -3.878 -7.202 1.00 1.99 H new ATOM 500 N SER A 32 21.682 -2.308 0.091 1.00 0.34 N ATOM 501 CA SER A 32 22.156 -2.503 1.449 1.00 0.37 C ATOM 502 C SER A 32 21.096 -2.076 2.460 1.00 0.34 C ATOM 503 O SER A 32 20.728 -2.842 3.359 1.00 0.38 O ATOM 504 CB SER A 32 23.451 -1.716 1.651 1.00 0.45 C ATOM 505 OG SER A 32 24.395 -2.025 0.637 1.00 1.33 O ATOM 0 H SER A 32 22.243 -1.657 -0.458 1.00 0.34 H new ATOM 0 HA SER A 32 22.355 -3.563 1.610 1.00 0.37 H new ATOM 0 HB2 SER A 32 23.237 -0.647 1.641 1.00 0.45 H new ATOM 0 HB3 SER A 32 23.873 -1.947 2.629 1.00 0.45 H new ATOM 0 HG SER A 32 25.215 -1.509 0.785 1.00 1.33 H new ATOM 511 N GLU A 33 20.582 -0.865 2.296 1.00 0.32 N ATOM 512 CA GLU A 33 19.589 -0.343 3.211 1.00 0.35 C ATOM 513 C GLU A 33 18.248 -1.034 2.989 1.00 0.30 C ATOM 514 O GLU A 33 17.496 -1.257 3.940 1.00 0.32 O ATOM 515 CB GLU A 33 19.443 1.164 3.034 1.00 0.45 C ATOM 516 CG GLU A 33 20.747 1.949 3.157 1.00 0.59 C ATOM 517 CD GLU A 33 21.812 1.285 4.018 1.00 1.50 C ATOM 518 OE1 GLU A 33 21.763 1.427 5.252 1.00 2.15 O ATOM 519 OE2 GLU A 33 22.728 0.653 3.458 1.00 2.32 O ATOM 0 H GLU A 33 20.838 -0.231 1.539 1.00 0.32 H new ATOM 0 HA GLU A 33 19.919 -0.542 4.231 1.00 0.35 H new ATOM 0 HB2 GLU A 33 19.007 1.361 2.055 1.00 0.45 H new ATOM 0 HB3 GLU A 33 18.738 1.537 3.777 1.00 0.45 H new ATOM 0 HG2 GLU A 33 21.154 2.109 2.159 1.00 0.59 H new ATOM 0 HG3 GLU A 33 20.525 2.932 3.572 1.00 0.59 H new ATOM 526 N LEU A 34 17.959 -1.371 1.729 1.00 0.30 N ATOM 527 CA LEU A 34 16.763 -2.115 1.382 1.00 0.33 C ATOM 528 C LEU A 34 16.729 -3.429 2.141 1.00 0.29 C ATOM 529 O LEU A 34 15.717 -3.779 2.729 1.00 0.30 O ATOM 530 CB LEU A 34 16.723 -2.402 -0.117 1.00 0.50 C ATOM 531 CG LEU A 34 15.476 -3.146 -0.590 1.00 0.51 C ATOM 532 CD1 LEU A 34 14.301 -2.188 -0.658 1.00 1.01 C ATOM 533 CD2 LEU A 34 15.717 -3.813 -1.935 1.00 0.55 C ATOM 0 H LEU A 34 18.549 -1.134 0.931 1.00 0.30 H new ATOM 0 HA LEU A 34 15.897 -1.511 1.653 1.00 0.33 H new ATOM 0 HB2 LEU A 34 16.793 -1.457 -0.656 1.00 0.50 H new ATOM 0 HB3 LEU A 34 17.603 -2.987 -0.385 1.00 0.50 H new ATOM 0 HG LEU A 34 15.244 -3.933 0.127 1.00 0.51 H new ATOM 0 HD11 LEU A 34 13.414 -2.724 -0.996 1.00 1.01 H new ATOM 0 HD12 LEU A 34 14.116 -1.768 0.331 1.00 1.01 H new ATOM 0 HD13 LEU A 34 14.528 -1.383 -1.358 1.00 1.01 H new ATOM 0 HD21 LEU A 34 14.814 -4.336 -2.249 1.00 0.55 H new ATOM 0 HD22 LEU A 34 15.974 -3.056 -2.676 1.00 0.55 H new ATOM 0 HD23 LEU A 34 16.536 -4.526 -1.846 1.00 0.55 H new ATOM 545 N LYS A 35 17.849 -4.150 2.109 1.00 0.29 N ATOM 546 CA LYS A 35 17.992 -5.393 2.860 1.00 0.29 C ATOM 547 C LYS A 35 17.566 -5.216 4.305 1.00 0.29 C ATOM 548 O LYS A 35 16.670 -5.905 4.788 1.00 0.31 O ATOM 549 CB LYS A 35 19.437 -5.880 2.839 1.00 0.32 C ATOM 550 CG LYS A 35 19.818 -6.668 1.601 1.00 0.39 C ATOM 551 CD LYS A 35 21.303 -6.976 1.596 1.00 0.52 C ATOM 552 CE LYS A 35 21.625 -8.216 0.779 1.00 0.70 C ATOM 553 NZ LYS A 35 23.085 -8.502 0.784 1.00 1.29 N ATOM 0 H LYS A 35 18.674 -3.891 1.567 1.00 0.29 H new ATOM 0 HA LYS A 35 17.347 -6.129 2.379 1.00 0.29 H new ATOM 0 HB2 LYS A 35 20.099 -5.018 2.923 1.00 0.32 H new ATOM 0 HB3 LYS A 35 19.610 -6.502 3.717 1.00 0.32 H new ATOM 0 HG2 LYS A 35 19.249 -7.597 1.566 1.00 0.39 H new ATOM 0 HG3 LYS A 35 19.557 -6.100 0.708 1.00 0.39 H new ATOM 0 HD2 LYS A 35 21.849 -6.124 1.191 1.00 0.52 H new ATOM 0 HD3 LYS A 35 21.647 -7.117 2.620 1.00 0.52 H new ATOM 0 HE2 LYS A 35 21.083 -9.071 1.183 1.00 0.70 H new ATOM 0 HE3 LYS A 35 21.283 -8.077 -0.247 1.00 0.70 H new ATOM 0 HZ1 LYS A 35 23.327 -9.088 -0.040 1.00 1.29 H new ATOM 0 HZ2 LYS A 35 23.614 -7.608 0.740 1.00 1.29 H new ATOM 0 HZ3 LYS A 35 23.336 -9.010 1.656 1.00 1.29 H new ATOM 567 N GLU A 36 18.213 -4.286 4.990 1.00 0.29 N ATOM 568 CA GLU A 36 17.958 -4.079 6.405 1.00 0.32 C ATOM 569 C GLU A 36 16.522 -3.674 6.649 1.00 0.31 C ATOM 570 O GLU A 36 15.886 -4.176 7.557 1.00 0.39 O ATOM 571 CB GLU A 36 18.898 -3.033 6.972 1.00 0.36 C ATOM 572 CG GLU A 36 20.341 -3.335 6.654 1.00 0.37 C ATOM 573 CD GLU A 36 21.291 -2.387 7.337 1.00 0.51 C ATOM 574 OE1 GLU A 36 21.590 -1.331 6.756 1.00 1.14 O ATOM 575 OE2 GLU A 36 21.723 -2.673 8.467 1.00 1.31 O ATOM 0 H GLU A 36 18.916 -3.665 4.590 1.00 0.29 H new ATOM 0 HA GLU A 36 18.137 -5.026 6.915 1.00 0.32 H new ATOM 0 HB2 GLU A 36 18.636 -2.054 6.570 1.00 0.36 H new ATOM 0 HB3 GLU A 36 18.769 -2.978 8.053 1.00 0.36 H new ATOM 0 HG2 GLU A 36 20.571 -4.356 6.957 1.00 0.37 H new ATOM 0 HG3 GLU A 36 20.491 -3.281 5.576 1.00 0.37 H new ATOM 582 N LEU A 37 16.009 -2.773 5.836 1.00 0.27 N ATOM 583 CA LEU A 37 14.627 -2.354 5.973 1.00 0.26 C ATOM 584 C LEU A 37 13.684 -3.536 5.758 1.00 0.27 C ATOM 585 O LEU A 37 12.783 -3.766 6.543 1.00 0.31 O ATOM 586 CB LEU A 37 14.319 -1.223 4.987 1.00 0.24 C ATOM 587 CG LEU A 37 12.900 -0.658 5.065 1.00 0.31 C ATOM 588 CD1 LEU A 37 12.885 0.814 4.693 1.00 0.29 C ATOM 589 CD2 LEU A 37 11.966 -1.437 4.159 1.00 0.50 C ATOM 0 H LEU A 37 16.522 -2.320 5.080 1.00 0.27 H new ATOM 0 HA LEU A 37 14.472 -1.980 6.985 1.00 0.26 H new ATOM 0 HB2 LEU A 37 15.026 -0.411 5.158 1.00 0.24 H new ATOM 0 HB3 LEU A 37 14.492 -1.588 3.975 1.00 0.24 H new ATOM 0 HG LEU A 37 12.552 -0.757 6.093 1.00 0.31 H new ATOM 0 HD11 LEU A 37 11.866 1.195 4.755 1.00 0.29 H new ATOM 0 HD12 LEU A 37 13.523 1.370 5.381 1.00 0.29 H new ATOM 0 HD13 LEU A 37 13.256 0.936 3.675 1.00 0.29 H new ATOM 0 HD21 LEU A 37 10.961 -1.021 4.228 1.00 0.50 H new ATOM 0 HD22 LEU A 37 12.317 -1.369 3.129 1.00 0.50 H new ATOM 0 HD23 LEU A 37 11.947 -2.482 4.468 1.00 0.50 H new ATOM 601 N LEU A 38 13.910 -4.291 4.703 1.00 0.27 N ATOM 602 CA LEU A 38 13.062 -5.432 4.387 1.00 0.29 C ATOM 603 C LEU A 38 13.104 -6.475 5.498 1.00 0.31 C ATOM 604 O LEU A 38 12.075 -6.950 5.953 1.00 0.40 O ATOM 605 CB LEU A 38 13.500 -6.051 3.064 1.00 0.32 C ATOM 606 CG LEU A 38 12.632 -5.703 1.853 1.00 0.34 C ATOM 607 CD1 LEU A 38 11.269 -6.358 1.978 1.00 0.31 C ATOM 608 CD2 LEU A 38 12.480 -4.200 1.707 1.00 0.43 C ATOM 0 H LEU A 38 14.675 -4.138 4.046 1.00 0.27 H new ATOM 0 HA LEU A 38 12.034 -5.081 4.297 1.00 0.29 H new ATOM 0 HB2 LEU A 38 14.523 -5.737 2.858 1.00 0.32 H new ATOM 0 HB3 LEU A 38 13.516 -7.135 3.178 1.00 0.32 H new ATOM 0 HG LEU A 38 13.127 -6.083 0.960 1.00 0.34 H new ATOM 0 HD11 LEU A 38 10.661 -6.102 1.110 1.00 0.31 H new ATOM 0 HD12 LEU A 38 11.389 -7.440 2.031 1.00 0.31 H new ATOM 0 HD13 LEU A 38 10.776 -6.003 2.883 1.00 0.31 H new ATOM 0 HD21 LEU A 38 11.859 -3.980 0.839 1.00 0.43 H new ATOM 0 HD22 LEU A 38 12.010 -3.793 2.602 1.00 0.43 H new ATOM 0 HD23 LEU A 38 13.462 -3.746 1.575 1.00 0.43 H new ATOM 620 N THR A 39 14.300 -6.823 5.923 1.00 0.32 N ATOM 621 CA THR A 39 14.487 -7.792 6.995 1.00 0.33 C ATOM 622 C THR A 39 13.931 -7.304 8.338 1.00 0.34 C ATOM 623 O THR A 39 13.393 -8.086 9.123 1.00 0.38 O ATOM 624 CB THR A 39 15.981 -8.110 7.172 1.00 0.33 C ATOM 625 OG1 THR A 39 16.713 -6.909 7.445 1.00 0.32 O ATOM 626 CG2 THR A 39 16.550 -8.752 5.921 1.00 0.35 C ATOM 0 H THR A 39 15.168 -6.448 5.541 1.00 0.32 H new ATOM 0 HA THR A 39 13.935 -8.685 6.702 1.00 0.33 H new ATOM 0 HB THR A 39 16.076 -8.803 8.008 1.00 0.33 H new ATOM 0 HG1 THR A 39 16.787 -6.378 6.625 1.00 0.32 H new ATOM 0 HG21 THR A 39 17.608 -8.967 6.071 1.00 0.35 H new ATOM 0 HG22 THR A 39 16.017 -9.680 5.713 1.00 0.35 H new ATOM 0 HG23 THR A 39 16.435 -8.071 5.078 1.00 0.35 H new ATOM 634 N ARG A 40 14.074 -6.014 8.594 1.00 0.34 N ATOM 635 CA ARG A 40 13.776 -5.445 9.908 1.00 0.37 C ATOM 636 C ARG A 40 12.374 -4.849 10.002 1.00 0.40 C ATOM 637 O ARG A 40 11.705 -4.977 11.032 1.00 0.47 O ATOM 638 CB ARG A 40 14.835 -4.394 10.234 1.00 0.37 C ATOM 639 CG ARG A 40 16.148 -5.005 10.683 1.00 0.63 C ATOM 640 CD ARG A 40 17.268 -3.988 10.656 1.00 0.56 C ATOM 641 NE ARG A 40 18.576 -4.611 10.844 1.00 1.16 N ATOM 642 CZ ARG A 40 19.682 -3.938 11.149 1.00 1.51 C ATOM 643 NH1 ARG A 40 19.625 -2.631 11.364 1.00 1.62 N ATOM 644 NH2 ARG A 40 20.841 -4.575 11.256 1.00 2.31 N ATOM 0 H ARG A 40 14.397 -5.333 7.907 1.00 0.34 H new ATOM 0 HA ARG A 40 13.801 -6.253 10.639 1.00 0.37 H new ATOM 0 HB2 ARG A 40 15.009 -3.775 9.354 1.00 0.37 H new ATOM 0 HB3 ARG A 40 14.459 -3.736 11.017 1.00 0.37 H new ATOM 0 HG2 ARG A 40 16.040 -5.403 11.692 1.00 0.63 H new ATOM 0 HG3 ARG A 40 16.401 -5.844 10.035 1.00 0.63 H new ATOM 0 HD2 ARG A 40 17.253 -3.457 9.704 1.00 0.56 H new ATOM 0 HD3 ARG A 40 17.104 -3.246 11.438 1.00 0.56 H new ATOM 0 HE ARG A 40 18.645 -5.623 10.735 1.00 1.16 H new ATOM 0 HH11 ARG A 40 18.733 -2.141 11.296 1.00 1.62 H new ATOM 0 HH12 ARG A 40 20.473 -2.115 11.598 1.00 1.62 H new ATOM 0 HH21 ARG A 40 20.885 -5.583 11.104 1.00 2.31 H new ATOM 0 HH22 ARG A 40 21.688 -4.057 11.490 1.00 2.31 H new ATOM 658 N GLU A 41 11.934 -4.202 8.943 1.00 0.40 N ATOM 659 CA GLU A 41 10.632 -3.556 8.921 1.00 0.46 C ATOM 660 C GLU A 41 9.596 -4.486 8.317 1.00 0.54 C ATOM 661 O GLU A 41 8.406 -4.257 8.455 1.00 0.85 O ATOM 662 CB GLU A 41 10.699 -2.266 8.100 1.00 0.52 C ATOM 663 CG GLU A 41 11.944 -1.421 8.351 1.00 0.53 C ATOM 664 CD GLU A 41 12.153 -1.061 9.803 1.00 0.51 C ATOM 665 OE1 GLU A 41 11.630 -0.019 10.249 1.00 1.30 O ATOM 666 OE2 GLU A 41 12.862 -1.799 10.511 1.00 1.02 O ATOM 0 H GLU A 41 12.463 -4.107 8.076 1.00 0.40 H new ATOM 0 HA GLU A 41 10.346 -3.317 9.945 1.00 0.46 H new ATOM 0 HB2 GLU A 41 10.656 -2.521 7.041 1.00 0.52 H new ATOM 0 HB3 GLU A 41 9.817 -1.665 8.319 1.00 0.52 H new ATOM 0 HG2 GLU A 41 12.818 -1.963 7.991 1.00 0.53 H new ATOM 0 HG3 GLU A 41 11.874 -0.504 7.765 1.00 0.53 H new ATOM 673 N LEU A 42 10.058 -5.528 7.635 1.00 0.40 N ATOM 674 CA LEU A 42 9.161 -6.530 7.068 1.00 0.41 C ATOM 675 C LEU A 42 9.626 -7.960 7.392 1.00 0.37 C ATOM 676 O LEU A 42 9.772 -8.786 6.483 1.00 0.36 O ATOM 677 CB LEU A 42 9.073 -6.339 5.551 1.00 0.44 C ATOM 678 CG LEU A 42 8.408 -5.040 5.099 1.00 0.50 C ATOM 679 CD1 LEU A 42 8.648 -4.794 3.624 1.00 0.65 C ATOM 680 CD2 LEU A 42 6.922 -5.085 5.388 1.00 0.74 C ATOM 0 H LEU A 42 11.048 -5.702 7.461 1.00 0.40 H new ATOM 0 HA LEU A 42 8.177 -6.394 7.516 1.00 0.41 H new ATOM 0 HB2 LEU A 42 10.080 -6.377 5.137 1.00 0.44 H new ATOM 0 HB3 LEU A 42 8.522 -7.178 5.126 1.00 0.44 H new ATOM 0 HG LEU A 42 8.853 -4.217 5.658 1.00 0.50 H new ATOM 0 HD11 LEU A 42 8.164 -3.863 3.327 1.00 0.65 H new ATOM 0 HD12 LEU A 42 9.719 -4.722 3.437 1.00 0.65 H new ATOM 0 HD13 LEU A 42 8.233 -5.619 3.045 1.00 0.65 H new ATOM 0 HD21 LEU A 42 6.459 -4.154 5.061 1.00 0.74 H new ATOM 0 HD22 LEU A 42 6.472 -5.921 4.852 1.00 0.74 H new ATOM 0 HD23 LEU A 42 6.763 -5.213 6.459 1.00 0.74 H new ATOM 692 N PRO A 43 9.864 -8.279 8.690 1.00 0.40 N ATOM 693 CA PRO A 43 10.331 -9.602 9.120 1.00 0.44 C ATOM 694 C PRO A 43 9.548 -10.764 8.542 1.00 0.45 C ATOM 695 O PRO A 43 10.125 -11.789 8.208 1.00 0.49 O ATOM 696 CB PRO A 43 10.140 -9.577 10.628 1.00 0.51 C ATOM 697 CG PRO A 43 10.288 -8.149 10.996 1.00 0.48 C ATOM 698 CD PRO A 43 9.730 -7.365 9.843 1.00 0.44 C ATOM 0 HA PRO A 43 11.354 -9.763 8.782 1.00 0.44 H new ATOM 0 HB2 PRO A 43 9.160 -9.960 10.911 1.00 0.51 H new ATOM 0 HB3 PRO A 43 10.882 -10.196 11.133 1.00 0.51 H new ATOM 0 HG2 PRO A 43 9.749 -7.925 11.917 1.00 0.48 H new ATOM 0 HG3 PRO A 43 11.334 -7.897 11.169 1.00 0.48 H new ATOM 0 HD2 PRO A 43 8.690 -7.089 10.015 1.00 0.44 H new ATOM 0 HD3 PRO A 43 10.283 -6.439 9.685 1.00 0.44 H new ATOM 706 N SER A 44 8.242 -10.629 8.451 1.00 0.45 N ATOM 707 CA SER A 44 7.427 -11.721 7.957 1.00 0.47 C ATOM 708 C SER A 44 7.593 -11.880 6.451 1.00 0.44 C ATOM 709 O SER A 44 7.837 -12.993 5.961 1.00 0.45 O ATOM 710 CB SER A 44 5.967 -11.494 8.307 1.00 0.51 C ATOM 711 OG SER A 44 5.150 -12.562 7.860 1.00 0.59 O ATOM 0 H SER A 44 7.727 -9.787 8.708 1.00 0.45 H new ATOM 0 HA SER A 44 7.761 -12.641 8.437 1.00 0.47 H new ATOM 0 HB2 SER A 44 5.864 -11.384 9.387 1.00 0.51 H new ATOM 0 HB3 SER A 44 5.626 -10.562 7.858 1.00 0.51 H new ATOM 0 HG SER A 44 4.217 -12.384 8.103 1.00 0.59 H new ATOM 717 N PHE A 45 7.501 -10.754 5.732 1.00 0.42 N ATOM 718 CA PHE A 45 7.525 -10.767 4.273 1.00 0.41 C ATOM 719 C PHE A 45 8.693 -11.587 3.757 1.00 0.42 C ATOM 720 O PHE A 45 8.508 -12.594 3.069 1.00 0.46 O ATOM 721 CB PHE A 45 7.599 -9.352 3.697 1.00 0.45 C ATOM 722 CG PHE A 45 7.457 -9.354 2.200 1.00 1.06 C ATOM 723 CD1 PHE A 45 6.255 -9.720 1.611 1.00 1.83 C ATOM 724 CD2 PHE A 45 8.522 -9.020 1.383 1.00 1.81 C ATOM 725 CE1 PHE A 45 6.122 -9.751 0.236 1.00 2.38 C ATOM 726 CE2 PHE A 45 8.394 -9.046 0.007 1.00 2.38 C ATOM 727 CZ PHE A 45 7.192 -9.414 -0.568 1.00 2.41 C ATOM 0 H PHE A 45 7.409 -9.825 6.142 1.00 0.42 H new ATOM 0 HA PHE A 45 6.592 -11.225 3.944 1.00 0.41 H new ATOM 0 HB2 PHE A 45 6.813 -8.738 4.137 1.00 0.45 H new ATOM 0 HB3 PHE A 45 8.550 -8.896 3.972 1.00 0.45 H new ATOM 0 HD1 PHE A 45 5.414 -9.984 2.235 1.00 1.83 H new ATOM 0 HD2 PHE A 45 9.465 -8.735 1.826 1.00 1.81 H new ATOM 0 HE1 PHE A 45 5.181 -10.039 -0.209 1.00 2.38 H new ATOM 0 HE2 PHE A 45 9.233 -8.779 -0.619 1.00 2.38 H new ATOM 0 HZ PHE A 45 7.091 -9.438 -1.643 1.00 2.41 H new ATOM 737 N LEU A 46 9.895 -11.166 4.098 1.00 0.45 N ATOM 738 CA LEU A 46 11.080 -11.863 3.631 1.00 0.57 C ATOM 739 C LEU A 46 11.539 -12.918 4.616 1.00 0.65 C ATOM 740 O LEU A 46 12.424 -13.704 4.310 1.00 0.66 O ATOM 741 CB LEU A 46 12.218 -10.905 3.335 1.00 0.67 C ATOM 742 CG LEU A 46 12.021 -10.008 2.119 1.00 0.57 C ATOM 743 CD1 LEU A 46 13.312 -9.288 1.828 1.00 0.71 C ATOM 744 CD2 LEU A 46 11.566 -10.807 0.897 1.00 0.55 C ATOM 0 H LEU A 46 10.078 -10.355 4.689 1.00 0.45 H new ATOM 0 HA LEU A 46 10.797 -12.359 2.703 1.00 0.57 H new ATOM 0 HB2 LEU A 46 12.375 -10.273 4.209 1.00 0.67 H new ATOM 0 HB3 LEU A 46 13.130 -11.485 3.193 1.00 0.67 H new ATOM 0 HG LEU A 46 11.235 -9.286 2.341 1.00 0.57 H new ATOM 0 HD11 LEU A 46 13.181 -8.643 0.959 1.00 0.71 H new ATOM 0 HD12 LEU A 46 13.593 -8.683 2.690 1.00 0.71 H new ATOM 0 HD13 LEU A 46 14.097 -10.016 1.624 1.00 0.71 H new ATOM 0 HD21 LEU A 46 11.436 -10.134 0.050 1.00 0.55 H new ATOM 0 HD22 LEU A 46 12.318 -11.557 0.652 1.00 0.55 H new ATOM 0 HD23 LEU A 46 10.619 -11.300 1.117 1.00 0.55 H new ATOM 756 N GLY A 47 10.942 -12.947 5.796 1.00 0.74 N ATOM 757 CA GLY A 47 11.248 -14.009 6.737 1.00 0.90 C ATOM 758 C GLY A 47 10.974 -15.356 6.120 1.00 0.89 C ATOM 759 O GLY A 47 11.587 -16.362 6.474 1.00 0.99 O ATOM 0 H GLY A 47 10.258 -12.263 6.120 1.00 0.74 H new ATOM 0 HA2 GLY A 47 12.294 -13.946 7.038 1.00 0.90 H new ATOM 0 HA3 GLY A 47 10.649 -13.887 7.639 1.00 0.90 H new ATOM 763 N LYS A 48 10.046 -15.355 5.179 1.00 0.79 N ATOM 764 CA LYS A 48 9.744 -16.534 4.391 1.00 0.82 C ATOM 765 C LYS A 48 10.680 -16.693 3.192 1.00 0.78 C ATOM 766 O LYS A 48 10.853 -17.800 2.680 1.00 0.87 O ATOM 767 CB LYS A 48 8.320 -16.441 3.883 1.00 0.82 C ATOM 768 CG LYS A 48 7.269 -16.577 4.974 1.00 1.08 C ATOM 769 CD LYS A 48 5.873 -16.259 4.460 1.00 1.51 C ATOM 770 CE LYS A 48 5.420 -17.251 3.405 1.00 2.27 C ATOM 771 NZ LYS A 48 4.028 -16.991 2.955 1.00 3.17 N ATOM 0 H LYS A 48 9.483 -14.539 4.941 1.00 0.79 H new ATOM 0 HA LYS A 48 9.879 -17.400 5.038 1.00 0.82 H new ATOM 0 HB2 LYS A 48 8.186 -15.484 3.379 1.00 0.82 H new ATOM 0 HB3 LYS A 48 8.159 -17.219 3.137 1.00 0.82 H new ATOM 0 HG2 LYS A 48 7.287 -17.592 5.371 1.00 1.08 H new ATOM 0 HG3 LYS A 48 7.513 -15.908 5.799 1.00 1.08 H new ATOM 0 HD2 LYS A 48 5.169 -16.267 5.292 1.00 1.51 H new ATOM 0 HD3 LYS A 48 5.861 -15.253 4.041 1.00 1.51 H new ATOM 0 HE2 LYS A 48 6.093 -17.201 2.549 1.00 2.27 H new ATOM 0 HE3 LYS A 48 5.488 -18.262 3.806 1.00 2.27 H new ATOM 0 HZ1 LYS A 48 3.759 -17.691 2.235 1.00 3.17 H new ATOM 0 HZ2 LYS A 48 3.382 -17.064 3.766 1.00 3.17 H new ATOM 0 HZ3 LYS A 48 3.967 -16.036 2.548 1.00 3.17 H new ATOM 785 N ARG A 49 11.280 -15.599 2.742 1.00 0.73 N ATOM 786 CA ARG A 49 12.021 -15.609 1.487 1.00 0.81 C ATOM 787 C ARG A 49 13.133 -14.557 1.489 1.00 0.74 C ATOM 788 O ARG A 49 13.022 -13.515 0.850 1.00 1.00 O ATOM 789 CB ARG A 49 11.043 -15.379 0.325 1.00 0.95 C ATOM 790 CG ARG A 49 11.558 -15.807 -1.043 1.00 1.17 C ATOM 791 CD ARG A 49 12.223 -14.666 -1.791 1.00 1.02 C ATOM 792 NE ARG A 49 12.600 -15.049 -3.150 1.00 1.61 N ATOM 793 CZ ARG A 49 12.476 -14.253 -4.211 1.00 1.87 C ATOM 794 NH1 ARG A 49 11.960 -13.036 -4.083 1.00 2.14 N ATOM 795 NH2 ARG A 49 12.862 -14.679 -5.406 1.00 2.50 N ATOM 0 H ARG A 49 11.269 -14.699 3.223 1.00 0.73 H new ATOM 0 HA ARG A 49 12.502 -16.579 1.365 1.00 0.81 H new ATOM 0 HB2 ARG A 49 10.120 -15.919 0.534 1.00 0.95 H new ATOM 0 HB3 ARG A 49 10.791 -14.319 0.286 1.00 0.95 H new ATOM 0 HG2 ARG A 49 12.270 -16.623 -0.922 1.00 1.17 H new ATOM 0 HG3 ARG A 49 10.729 -16.193 -1.636 1.00 1.17 H new ATOM 0 HD2 ARG A 49 11.545 -13.814 -1.829 1.00 1.02 H new ATOM 0 HD3 ARG A 49 13.110 -14.343 -1.246 1.00 1.02 H new ATOM 0 HE ARG A 49 12.982 -15.984 -3.295 1.00 1.61 H new ATOM 0 HH11 ARG A 49 11.655 -12.705 -3.168 1.00 2.14 H new ATOM 0 HH12 ARG A 49 11.868 -12.432 -4.900 1.00 2.14 H new ATOM 0 HH21 ARG A 49 13.253 -15.615 -5.512 1.00 2.50 H new ATOM 0 HH22 ARG A 49 12.768 -14.071 -6.219 1.00 2.50 H new ATOM 809 N THR A 50 14.199 -14.828 2.226 1.00 0.76 N ATOM 810 CA THR A 50 15.361 -13.945 2.227 1.00 0.73 C ATOM 811 C THR A 50 16.487 -14.516 1.382 1.00 0.82 C ATOM 812 O THR A 50 16.835 -15.692 1.500 1.00 1.33 O ATOM 813 CB THR A 50 15.913 -13.672 3.642 1.00 0.74 C ATOM 814 OG1 THR A 50 15.880 -14.871 4.429 1.00 0.84 O ATOM 815 CG2 THR A 50 15.135 -12.572 4.340 1.00 0.63 C ATOM 0 H THR A 50 14.286 -15.646 2.829 1.00 0.76 H new ATOM 0 HA THR A 50 15.007 -13.004 1.806 1.00 0.73 H new ATOM 0 HB THR A 50 16.946 -13.339 3.536 1.00 0.74 H new ATOM 0 HG1 THR A 50 16.234 -14.685 5.324 1.00 0.84 H new ATOM 0 HG21 THR A 50 15.551 -12.406 5.334 1.00 0.63 H new ATOM 0 HG22 THR A 50 15.205 -11.652 3.759 1.00 0.63 H new ATOM 0 HG23 THR A 50 14.089 -12.866 4.429 1.00 0.63 H new ATOM 823 N ASP A 51 17.043 -13.675 0.529 1.00 0.57 N ATOM 824 CA ASP A 51 18.204 -14.029 -0.269 1.00 0.62 C ATOM 825 C ASP A 51 18.708 -12.786 -0.972 1.00 0.58 C ATOM 826 O ASP A 51 17.913 -11.917 -1.312 1.00 0.55 O ATOM 827 CB ASP A 51 17.863 -15.111 -1.299 1.00 0.69 C ATOM 828 CG ASP A 51 19.098 -15.677 -1.966 1.00 1.26 C ATOM 829 OD1 ASP A 51 19.708 -16.608 -1.400 1.00 2.01 O ATOM 830 OD2 ASP A 51 19.469 -15.195 -3.054 1.00 1.78 O ATOM 0 H ASP A 51 16.703 -12.727 0.369 1.00 0.57 H new ATOM 0 HA ASP A 51 18.975 -14.430 0.388 1.00 0.62 H new ATOM 0 HB2 ASP A 51 17.316 -15.916 -0.809 1.00 0.69 H new ATOM 0 HB3 ASP A 51 17.202 -14.692 -2.058 1.00 0.69 H new ATOM 835 N GLU A 52 20.010 -12.682 -1.174 1.00 0.67 N ATOM 836 CA GLU A 52 20.575 -11.516 -1.852 1.00 0.71 C ATOM 837 C GLU A 52 19.988 -11.363 -3.244 1.00 0.67 C ATOM 838 O GLU A 52 19.686 -10.253 -3.683 1.00 0.63 O ATOM 839 CB GLU A 52 22.093 -11.606 -1.924 1.00 0.87 C ATOM 840 CG GLU A 52 22.724 -11.668 -0.554 1.00 0.95 C ATOM 841 CD GLU A 52 24.228 -11.559 -0.591 1.00 1.31 C ATOM 842 OE1 GLU A 52 24.899 -12.575 -0.844 1.00 1.91 O ATOM 843 OE2 GLU A 52 24.745 -10.450 -0.346 1.00 1.81 O ATOM 0 H GLU A 52 20.694 -13.380 -0.884 1.00 0.67 H new ATOM 0 HA GLU A 52 20.313 -10.634 -1.268 1.00 0.71 H new ATOM 0 HB2 GLU A 52 22.377 -12.491 -2.494 1.00 0.87 H new ATOM 0 HB3 GLU A 52 22.482 -10.742 -2.463 1.00 0.87 H new ATOM 0 HG2 GLU A 52 22.322 -10.863 0.062 1.00 0.95 H new ATOM 0 HG3 GLU A 52 22.445 -12.606 -0.074 1.00 0.95 H new ATOM 850 N ALA A 53 19.801 -12.485 -3.921 1.00 0.71 N ATOM 851 CA ALA A 53 19.161 -12.482 -5.227 1.00 0.76 C ATOM 852 C ALA A 53 17.701 -12.066 -5.090 1.00 0.66 C ATOM 853 O ALA A 53 17.156 -11.383 -5.952 1.00 0.69 O ATOM 854 CB ALA A 53 19.274 -13.847 -5.887 1.00 0.91 C ATOM 0 H ALA A 53 20.083 -13.407 -3.589 1.00 0.71 H new ATOM 0 HA ALA A 53 19.672 -11.760 -5.865 1.00 0.76 H new ATOM 0 HB1 ALA A 53 18.788 -13.821 -6.862 1.00 0.91 H new ATOM 0 HB2 ALA A 53 20.326 -14.105 -6.012 1.00 0.91 H new ATOM 0 HB3 ALA A 53 18.789 -14.595 -5.260 1.00 0.91 H new ATOM 860 N ALA A 54 17.083 -12.457 -3.980 1.00 0.60 N ATOM 861 CA ALA A 54 15.705 -12.085 -3.700 1.00 0.59 C ATOM 862 C ALA A 54 15.603 -10.583 -3.499 1.00 0.48 C ATOM 863 O ALA A 54 14.680 -9.950 -3.994 1.00 0.46 O ATOM 864 CB ALA A 54 15.188 -12.823 -2.477 1.00 0.64 C ATOM 0 H ALA A 54 17.518 -13.033 -3.259 1.00 0.60 H new ATOM 0 HA ALA A 54 15.087 -12.368 -4.552 1.00 0.59 H new ATOM 0 HB1 ALA A 54 14.156 -12.530 -2.285 1.00 0.64 H new ATOM 0 HB2 ALA A 54 15.234 -13.898 -2.654 1.00 0.64 H new ATOM 0 HB3 ALA A 54 15.803 -12.571 -1.613 1.00 0.64 H new ATOM 870 N PHE A 55 16.566 -10.021 -2.776 1.00 0.46 N ATOM 871 CA PHE A 55 16.646 -8.578 -2.590 1.00 0.42 C ATOM 872 C PHE A 55 16.875 -7.876 -3.916 1.00 0.44 C ATOM 873 O PHE A 55 16.254 -6.862 -4.204 1.00 0.45 O ATOM 874 CB PHE A 55 17.774 -8.213 -1.629 1.00 0.44 C ATOM 875 CG PHE A 55 17.477 -8.534 -0.193 1.00 1.06 C ATOM 876 CD1 PHE A 55 16.592 -7.759 0.536 1.00 1.98 C ATOM 877 CD2 PHE A 55 18.086 -9.610 0.429 1.00 1.87 C ATOM 878 CE1 PHE A 55 16.323 -8.053 1.858 1.00 2.77 C ATOM 879 CE2 PHE A 55 17.820 -9.909 1.750 1.00 2.70 C ATOM 880 CZ PHE A 55 16.938 -9.130 2.465 1.00 2.95 C ATOM 0 H PHE A 55 17.305 -10.546 -2.308 1.00 0.46 H new ATOM 0 HA PHE A 55 15.696 -8.250 -2.167 1.00 0.42 H new ATOM 0 HB2 PHE A 55 18.679 -8.741 -1.929 1.00 0.44 H new ATOM 0 HB3 PHE A 55 17.983 -7.147 -1.717 1.00 0.44 H new ATOM 0 HD1 PHE A 55 16.107 -6.916 0.066 1.00 1.98 H new ATOM 0 HD2 PHE A 55 18.779 -10.224 -0.127 1.00 1.87 H new ATOM 0 HE1 PHE A 55 15.631 -7.440 2.417 1.00 2.77 H new ATOM 0 HE2 PHE A 55 18.303 -10.752 2.222 1.00 2.70 H new ATOM 0 HZ PHE A 55 16.728 -9.361 3.499 1.00 2.95 H new ATOM 890 N GLN A 56 17.783 -8.422 -4.711 1.00 0.49 N ATOM 891 CA GLN A 56 18.076 -7.895 -6.036 1.00 0.54 C ATOM 892 C GLN A 56 16.821 -7.875 -6.904 1.00 0.53 C ATOM 893 O GLN A 56 16.497 -6.854 -7.517 1.00 0.57 O ATOM 894 CB GLN A 56 19.158 -8.747 -6.697 1.00 0.62 C ATOM 895 CG GLN A 56 19.395 -8.421 -8.160 1.00 0.76 C ATOM 896 CD GLN A 56 19.964 -7.032 -8.383 1.00 0.98 C ATOM 897 OE1 GLN A 56 21.180 -6.845 -8.387 1.00 1.69 O ATOM 898 NE2 GLN A 56 19.093 -6.053 -8.575 1.00 0.87 N ATOM 0 H GLN A 56 18.336 -9.240 -4.457 1.00 0.49 H new ATOM 0 HA GLN A 56 18.432 -6.870 -5.933 1.00 0.54 H new ATOM 0 HB2 GLN A 56 20.092 -8.617 -6.151 1.00 0.62 H new ATOM 0 HB3 GLN A 56 18.882 -9.798 -6.610 1.00 0.62 H new ATOM 0 HG2 GLN A 56 20.078 -9.158 -8.583 1.00 0.76 H new ATOM 0 HG3 GLN A 56 18.454 -8.511 -8.702 1.00 0.76 H new ATOM 0 HE21 GLN A 56 18.092 -6.251 -8.564 1.00 0.87 H new ATOM 0 HE22 GLN A 56 19.423 -5.101 -8.734 1.00 0.87 H new ATOM 907 N LYS A 57 16.119 -9.000 -6.949 1.00 0.51 N ATOM 908 CA LYS A 57 14.899 -9.098 -7.733 1.00 0.52 C ATOM 909 C LYS A 57 13.820 -8.191 -7.166 1.00 0.48 C ATOM 910 O LYS A 57 13.179 -7.454 -7.911 1.00 0.48 O ATOM 911 CB LYS A 57 14.397 -10.540 -7.803 1.00 0.55 C ATOM 912 CG LYS A 57 14.656 -11.205 -9.148 1.00 0.76 C ATOM 913 CD LYS A 57 16.141 -11.384 -9.421 1.00 1.01 C ATOM 914 CE LYS A 57 16.722 -12.548 -8.633 1.00 0.87 C ATOM 915 NZ LYS A 57 16.117 -13.847 -9.030 1.00 1.60 N ATOM 0 H LYS A 57 16.374 -9.854 -6.453 1.00 0.51 H new ATOM 0 HA LYS A 57 15.132 -8.772 -8.747 1.00 0.52 H new ATOM 0 HB2 LYS A 57 14.879 -11.123 -7.019 1.00 0.55 H new ATOM 0 HB3 LYS A 57 13.326 -10.555 -7.599 1.00 0.55 H new ATOM 0 HG2 LYS A 57 14.164 -12.177 -9.172 1.00 0.76 H new ATOM 0 HG3 LYS A 57 14.212 -10.603 -9.941 1.00 0.76 H new ATOM 0 HD2 LYS A 57 16.297 -11.552 -10.487 1.00 1.01 H new ATOM 0 HD3 LYS A 57 16.672 -10.468 -9.161 1.00 1.01 H new ATOM 0 HE2 LYS A 57 17.800 -12.588 -8.788 1.00 0.87 H new ATOM 0 HE3 LYS A 57 16.559 -12.382 -7.568 1.00 0.87 H new ATOM 0 HZ1 LYS A 57 16.760 -14.623 -8.772 1.00 1.60 H new ATOM 0 HZ2 LYS A 57 15.209 -13.972 -8.538 1.00 1.60 H new ATOM 0 HZ3 LYS A 57 15.958 -13.856 -10.058 1.00 1.60 H new ATOM 929 N LEU A 58 13.639 -8.229 -5.849 1.00 0.46 N ATOM 930 CA LEU A 58 12.657 -7.389 -5.189 1.00 0.43 C ATOM 931 C LEU A 58 12.928 -5.932 -5.493 1.00 0.43 C ATOM 932 O LEU A 58 12.016 -5.170 -5.791 1.00 0.42 O ATOM 933 CB LEU A 58 12.681 -7.600 -3.679 1.00 0.43 C ATOM 934 CG LEU A 58 11.505 -6.979 -2.937 1.00 0.39 C ATOM 935 CD1 LEU A 58 10.198 -7.565 -3.443 1.00 0.40 C ATOM 936 CD2 LEU A 58 11.651 -7.196 -1.445 1.00 0.41 C ATOM 0 H LEU A 58 14.164 -8.836 -5.220 1.00 0.46 H new ATOM 0 HA LEU A 58 11.673 -7.667 -5.567 1.00 0.43 H new ATOM 0 HB2 LEU A 58 12.699 -8.670 -3.474 1.00 0.43 H new ATOM 0 HB3 LEU A 58 13.606 -7.184 -3.281 1.00 0.43 H new ATOM 0 HG LEU A 58 11.496 -5.905 -3.126 1.00 0.39 H new ATOM 0 HD11 LEU A 58 9.364 -7.113 -2.905 1.00 0.40 H new ATOM 0 HD12 LEU A 58 10.096 -7.360 -4.509 1.00 0.40 H new ATOM 0 HD13 LEU A 58 10.195 -8.643 -3.279 1.00 0.40 H new ATOM 0 HD21 LEU A 58 10.803 -6.747 -0.927 1.00 0.41 H new ATOM 0 HD22 LEU A 58 11.680 -8.265 -1.234 1.00 0.41 H new ATOM 0 HD23 LEU A 58 12.575 -6.732 -1.099 1.00 0.41 H new ATOM 948 N MET A 59 14.194 -5.560 -5.420 1.00 0.46 N ATOM 949 CA MET A 59 14.619 -4.221 -5.761 1.00 0.48 C ATOM 950 C MET A 59 14.132 -3.858 -7.148 1.00 0.48 C ATOM 951 O MET A 59 13.333 -2.956 -7.296 1.00 0.49 O ATOM 952 CB MET A 59 16.141 -4.113 -5.674 1.00 0.54 C ATOM 953 CG MET A 59 16.706 -2.852 -6.299 1.00 0.57 C ATOM 954 SD MET A 59 18.279 -2.373 -5.578 1.00 1.64 S ATOM 955 CE MET A 59 17.735 -1.738 -3.997 1.00 2.39 C ATOM 0 H MET A 59 14.950 -6.177 -5.124 1.00 0.46 H new ATOM 0 HA MET A 59 14.185 -3.518 -5.050 1.00 0.48 H new ATOM 0 HB2 MET A 59 16.439 -4.152 -4.626 1.00 0.54 H new ATOM 0 HB3 MET A 59 16.585 -4.980 -6.164 1.00 0.54 H new ATOM 0 HG2 MET A 59 16.833 -3.007 -7.370 1.00 0.57 H new ATOM 0 HG3 MET A 59 15.991 -2.038 -6.177 1.00 0.57 H new ATOM 0 HE1 MET A 59 18.332 -0.866 -3.730 1.00 2.39 H new ATOM 0 HE2 MET A 59 16.685 -1.453 -4.061 1.00 2.39 H new ATOM 0 HE3 MET A 59 17.857 -2.507 -3.235 1.00 2.39 H new ATOM 965 N SER A 60 14.564 -4.614 -8.142 1.00 0.50 N ATOM 966 CA SER A 60 14.163 -4.376 -9.530 1.00 0.53 C ATOM 967 C SER A 60 12.635 -4.425 -9.710 1.00 0.52 C ATOM 968 O SER A 60 12.098 -3.867 -10.660 1.00 0.56 O ATOM 969 CB SER A 60 14.852 -5.379 -10.457 1.00 0.56 C ATOM 970 OG SER A 60 14.762 -6.700 -9.947 1.00 1.35 O ATOM 0 H SER A 60 15.197 -5.404 -8.019 1.00 0.50 H new ATOM 0 HA SER A 60 14.481 -3.368 -9.797 1.00 0.53 H new ATOM 0 HB2 SER A 60 14.395 -5.337 -11.446 1.00 0.56 H new ATOM 0 HB3 SER A 60 15.900 -5.105 -10.578 1.00 0.56 H new ATOM 0 HG SER A 60 13.983 -6.770 -9.357 1.00 1.35 H new ATOM 976 N ASN A 61 11.949 -5.110 -8.805 1.00 0.49 N ATOM 977 CA ASN A 61 10.486 -5.168 -8.822 1.00 0.51 C ATOM 978 C ASN A 61 9.903 -3.804 -8.480 1.00 0.50 C ATOM 979 O ASN A 61 9.031 -3.283 -9.176 1.00 0.57 O ATOM 980 CB ASN A 61 9.953 -6.193 -7.811 1.00 0.49 C ATOM 981 CG ASN A 61 10.210 -7.634 -8.215 1.00 0.58 C ATOM 982 OD1 ASN A 61 10.288 -7.958 -9.399 1.00 0.80 O ATOM 983 ND2 ASN A 61 10.330 -8.517 -7.230 1.00 0.58 N ATOM 0 H ASN A 61 12.380 -5.637 -8.045 1.00 0.49 H new ATOM 0 HA ASN A 61 10.184 -5.468 -9.825 1.00 0.51 H new ATOM 0 HB2 ASN A 61 10.415 -6.008 -6.841 1.00 0.49 H new ATOM 0 HB3 ASN A 61 8.880 -6.045 -7.687 1.00 0.49 H new ATOM 0 HD21 ASN A 61 10.493 -9.501 -7.444 1.00 0.58 H new ATOM 0 HD22 ASN A 61 10.260 -8.211 -6.259 1.00 0.58 H new ATOM 990 N LEU A 62 10.410 -3.237 -7.400 1.00 0.44 N ATOM 991 CA LEU A 62 9.895 -1.987 -6.862 1.00 0.44 C ATOM 992 C LEU A 62 10.541 -0.815 -7.577 1.00 0.49 C ATOM 993 O LEU A 62 9.860 0.098 -8.042 1.00 0.55 O ATOM 994 CB LEU A 62 10.206 -1.914 -5.367 1.00 0.38 C ATOM 995 CG LEU A 62 10.191 -3.262 -4.641 1.00 0.35 C ATOM 996 CD1 LEU A 62 10.528 -3.089 -3.168 1.00 0.31 C ATOM 997 CD2 LEU A 62 8.851 -3.964 -4.826 1.00 0.35 C ATOM 0 H LEU A 62 11.189 -3.628 -6.871 1.00 0.44 H new ATOM 0 HA LEU A 62 8.816 -1.944 -7.012 1.00 0.44 H new ATOM 0 HB2 LEU A 62 11.187 -1.458 -5.236 1.00 0.38 H new ATOM 0 HB3 LEU A 62 9.481 -1.253 -4.891 1.00 0.38 H new ATOM 0 HG LEU A 62 10.960 -3.895 -5.084 1.00 0.35 H new ATOM 0 HD11 LEU A 62 10.511 -4.061 -2.674 1.00 0.31 H new ATOM 0 HD12 LEU A 62 11.521 -2.650 -3.071 1.00 0.31 H new ATOM 0 HD13 LEU A 62 9.794 -2.432 -2.702 1.00 0.31 H new ATOM 0 HD21 LEU A 62 8.865 -4.919 -4.301 1.00 0.35 H new ATOM 0 HD22 LEU A 62 8.054 -3.340 -4.422 1.00 0.35 H new ATOM 0 HD23 LEU A 62 8.674 -4.136 -5.888 1.00 0.35 H new ATOM 1009 N ASP A 63 11.865 -0.882 -7.648 1.00 0.48 N ATOM 1010 CA ASP A 63 12.709 0.078 -8.350 1.00 0.54 C ATOM 1011 C ASP A 63 12.310 0.142 -9.823 1.00 0.57 C ATOM 1012 O ASP A 63 12.902 -0.501 -10.685 1.00 0.63 O ATOM 1013 CB ASP A 63 14.178 -0.357 -8.155 1.00 0.56 C ATOM 1014 CG ASP A 63 15.197 0.356 -9.017 1.00 0.67 C ATOM 1015 OD1 ASP A 63 15.376 1.578 -8.865 1.00 1.24 O ATOM 1016 OD2 ASP A 63 15.868 -0.327 -9.825 1.00 1.34 O ATOM 0 H ASP A 63 12.398 -1.630 -7.204 1.00 0.48 H new ATOM 0 HA ASP A 63 12.584 1.084 -7.950 1.00 0.54 H new ATOM 0 HB2 ASP A 63 14.446 -0.206 -7.109 1.00 0.56 H new ATOM 0 HB3 ASP A 63 14.249 -1.427 -8.351 1.00 0.56 H new ATOM 1021 N SER A 64 11.261 0.905 -10.085 1.00 0.59 N ATOM 1022 CA SER A 64 10.700 1.047 -11.413 1.00 0.64 C ATOM 1023 C SER A 64 11.534 2.028 -12.213 1.00 0.66 C ATOM 1024 O SER A 64 11.614 1.950 -13.438 1.00 0.76 O ATOM 1025 CB SER A 64 9.254 1.529 -11.307 1.00 0.72 C ATOM 1026 OG SER A 64 8.515 0.706 -10.413 1.00 1.37 O ATOM 0 H SER A 64 10.772 1.447 -9.373 1.00 0.59 H new ATOM 0 HA SER A 64 10.710 0.084 -11.924 1.00 0.64 H new ATOM 0 HB2 SER A 64 9.234 2.562 -10.959 1.00 0.72 H new ATOM 0 HB3 SER A 64 8.787 1.515 -12.292 1.00 0.72 H new ATOM 0 HG SER A 64 8.976 0.665 -9.549 1.00 1.37 H new ATOM 1032 N ASN A 65 12.160 2.944 -11.494 1.00 0.63 N ATOM 1033 CA ASN A 65 13.083 3.895 -12.091 1.00 0.72 C ATOM 1034 C ASN A 65 14.357 3.170 -12.537 1.00 0.69 C ATOM 1035 O ASN A 65 15.140 3.672 -13.346 1.00 0.77 O ATOM 1036 CB ASN A 65 13.416 5.001 -11.086 1.00 0.79 C ATOM 1037 CG ASN A 65 14.428 4.542 -10.065 1.00 1.01 C ATOM 1038 OD1 ASN A 65 15.614 4.819 -10.191 1.00 1.65 O ATOM 1039 ND2 ASN A 65 13.976 3.831 -9.051 1.00 1.16 N ATOM 0 H ASN A 65 12.044 3.050 -10.486 1.00 0.63 H new ATOM 0 HA ASN A 65 12.617 4.351 -12.965 1.00 0.72 H new ATOM 0 HB2 ASN A 65 13.804 5.870 -11.617 1.00 0.79 H new ATOM 0 HB3 ASN A 65 12.505 5.318 -10.578 1.00 0.79 H new ATOM 0 HD21 ASN A 65 14.622 3.492 -8.338 1.00 1.16 H new ATOM 0 HD22 ASN A 65 12.981 3.620 -8.980 1.00 1.16 H new ATOM 1046 N ARG A 66 14.512 1.960 -11.983 1.00 0.60 N ATOM 1047 CA ARG A 66 15.581 1.025 -12.306 1.00 0.60 C ATOM 1048 C ARG A 66 16.968 1.620 -12.129 1.00 0.61 C ATOM 1049 O ARG A 66 17.815 1.526 -13.017 1.00 0.69 O ATOM 1050 CB ARG A 66 15.423 0.490 -13.711 1.00 0.67 C ATOM 1051 CG ARG A 66 14.117 -0.251 -13.956 1.00 0.71 C ATOM 1052 CD ARG A 66 14.054 -1.598 -13.243 1.00 0.71 C ATOM 1053 NE ARG A 66 13.100 -2.486 -13.903 1.00 0.78 N ATOM 1054 CZ ARG A 66 11.818 -2.594 -13.562 1.00 1.20 C ATOM 1055 NH1 ARG A 66 11.346 -1.942 -12.505 1.00 2.24 N ATOM 1056 NH2 ARG A 66 11.014 -3.373 -14.270 1.00 1.15 N ATOM 0 H ARG A 66 13.872 1.600 -11.275 1.00 0.60 H new ATOM 0 HA ARG A 66 15.491 0.205 -11.593 1.00 0.60 H new ATOM 0 HB2 ARG A 66 15.493 1.321 -14.413 1.00 0.67 H new ATOM 0 HB3 ARG A 66 16.254 -0.181 -13.927 1.00 0.67 H new ATOM 0 HG2 ARG A 66 13.285 0.370 -13.623 1.00 0.71 H new ATOM 0 HG3 ARG A 66 13.989 -0.407 -15.027 1.00 0.71 H new ATOM 0 HD2 ARG A 66 15.042 -2.058 -13.236 1.00 0.71 H new ATOM 0 HD3 ARG A 66 13.763 -1.452 -12.203 1.00 0.71 H new ATOM 0 HE ARG A 66 13.438 -3.060 -14.675 1.00 0.78 H new ATOM 0 HH11 ARG A 66 11.967 -1.354 -11.949 1.00 2.24 H new ATOM 0 HH12 ARG A 66 10.362 -2.029 -12.249 1.00 2.24 H new ATOM 0 HH21 ARG A 66 11.378 -3.887 -15.072 1.00 1.15 H new ATOM 0 HH22 ARG A 66 10.031 -3.459 -14.013 1.00 1.15 H new ATOM 1070 N ASP A 67 17.205 2.205 -10.974 1.00 0.58 N ATOM 1071 CA ASP A 67 18.530 2.708 -10.639 1.00 0.62 C ATOM 1072 C ASP A 67 19.093 1.874 -9.501 1.00 0.56 C ATOM 1073 O ASP A 67 20.203 2.106 -9.024 1.00 0.57 O ATOM 1074 CB ASP A 67 18.476 4.183 -10.234 1.00 0.70 C ATOM 1075 CG ASP A 67 19.746 4.928 -10.590 1.00 1.07 C ATOM 1076 OD1 ASP A 67 19.892 5.330 -11.764 1.00 1.72 O ATOM 1077 OD2 ASP A 67 20.596 5.136 -9.702 1.00 1.64 O ATOM 0 H ASP A 67 16.502 2.346 -10.249 1.00 0.58 H new ATOM 0 HA ASP A 67 19.173 2.630 -11.516 1.00 0.62 H new ATOM 0 HB2 ASP A 67 17.628 4.661 -10.725 1.00 0.70 H new ATOM 0 HB3 ASP A 67 18.305 4.256 -9.160 1.00 0.70 H new ATOM 1082 N ASN A 68 18.292 0.896 -9.087 1.00 0.53 N ATOM 1083 CA ASN A 68 18.629 -0.019 -8.002 1.00 0.51 C ATOM 1084 C ASN A 68 18.664 0.691 -6.661 1.00 0.47 C ATOM 1085 O ASN A 68 19.507 0.408 -5.808 1.00 0.48 O ATOM 1086 CB ASN A 68 19.933 -0.768 -8.277 1.00 0.58 C ATOM 1087 CG ASN A 68 19.685 -2.132 -8.900 1.00 0.73 C ATOM 1088 OD1 ASN A 68 20.504 -3.040 -8.777 1.00 1.08 O ATOM 1089 ND2 ASN A 68 18.535 -2.302 -9.538 1.00 0.66 N ATOM 0 H ASN A 68 17.378 0.715 -9.502 1.00 0.53 H new ATOM 0 HA ASN A 68 17.835 -0.764 -7.953 1.00 0.51 H new ATOM 0 HB2 ASN A 68 20.559 -0.174 -8.943 1.00 0.58 H new ATOM 0 HB3 ASN A 68 20.485 -0.890 -7.345 1.00 0.58 H new ATOM 0 HD21 ASN A 68 18.307 -3.209 -9.946 1.00 0.66 H new ATOM 0 HD22 ASN A 68 17.878 -1.526 -9.621 1.00 0.66 H new ATOM 1096 N GLU A 69 17.740 1.623 -6.496 1.00 0.46 N ATOM 1097 CA GLU A 69 17.434 2.197 -5.199 1.00 0.42 C ATOM 1098 C GLU A 69 15.941 2.487 -5.156 1.00 0.41 C ATOM 1099 O GLU A 69 15.432 3.289 -5.941 1.00 0.44 O ATOM 1100 CB GLU A 69 18.217 3.486 -4.922 1.00 0.46 C ATOM 1101 CG GLU A 69 19.724 3.356 -5.057 1.00 0.50 C ATOM 1102 CD GLU A 69 20.463 4.603 -4.612 1.00 0.65 C ATOM 1103 OE1 GLU A 69 20.807 4.704 -3.416 1.00 1.31 O ATOM 1104 OE2 GLU A 69 20.716 5.485 -5.460 1.00 1.29 O ATOM 0 H GLU A 69 17.181 2.003 -7.260 1.00 0.46 H new ATOM 0 HA GLU A 69 17.726 1.483 -4.429 1.00 0.42 H new ATOM 0 HB2 GLU A 69 17.870 4.260 -5.607 1.00 0.46 H new ATOM 0 HB3 GLU A 69 17.985 3.826 -3.913 1.00 0.46 H new ATOM 0 HG2 GLU A 69 20.065 2.506 -4.466 1.00 0.50 H new ATOM 0 HG3 GLU A 69 19.974 3.142 -6.096 1.00 0.50 H new ATOM 1111 N VAL A 70 15.248 1.827 -4.254 1.00 0.37 N ATOM 1112 CA VAL A 70 13.790 1.939 -4.173 1.00 0.36 C ATOM 1113 C VAL A 70 13.373 3.211 -3.446 1.00 0.35 C ATOM 1114 O VAL A 70 13.819 3.458 -2.340 1.00 0.36 O ATOM 1115 CB VAL A 70 13.178 0.732 -3.438 1.00 0.34 C ATOM 1116 CG1 VAL A 70 11.701 0.963 -3.182 1.00 0.34 C ATOM 1117 CG2 VAL A 70 13.383 -0.539 -4.240 1.00 0.37 C ATOM 0 H VAL A 70 15.662 1.204 -3.561 1.00 0.37 H new ATOM 0 HA VAL A 70 13.420 1.968 -5.198 1.00 0.36 H new ATOM 0 HB VAL A 70 13.684 0.620 -2.479 1.00 0.34 H new ATOM 0 HG11 VAL A 70 11.283 0.101 -2.662 1.00 0.34 H new ATOM 0 HG12 VAL A 70 11.573 1.855 -2.568 1.00 0.34 H new ATOM 0 HG13 VAL A 70 11.184 1.099 -4.132 1.00 0.34 H new ATOM 0 HG21 VAL A 70 12.944 -1.381 -3.705 1.00 0.37 H new ATOM 0 HG22 VAL A 70 12.902 -0.437 -5.213 1.00 0.37 H new ATOM 0 HG23 VAL A 70 14.450 -0.714 -4.379 1.00 0.37 H new ATOM 1127 N ASP A 71 12.507 4.008 -4.054 1.00 0.38 N ATOM 1128 CA ASP A 71 12.085 5.259 -3.422 1.00 0.39 C ATOM 1129 C ASP A 71 10.767 5.093 -2.671 1.00 0.37 C ATOM 1130 O ASP A 71 10.156 4.028 -2.729 1.00 0.35 O ATOM 1131 CB ASP A 71 12.003 6.401 -4.436 1.00 0.45 C ATOM 1132 CG ASP A 71 10.789 6.377 -5.338 1.00 0.77 C ATOM 1133 OD1 ASP A 71 9.678 6.683 -4.867 1.00 1.35 O ATOM 1134 OD2 ASP A 71 10.968 6.104 -6.537 1.00 1.43 O ATOM 0 H ASP A 71 12.088 3.821 -4.965 1.00 0.38 H new ATOM 0 HA ASP A 71 12.849 5.522 -2.690 1.00 0.39 H new ATOM 0 HB2 ASP A 71 12.015 7.347 -3.895 1.00 0.45 H new ATOM 0 HB3 ASP A 71 12.898 6.378 -5.058 1.00 0.45 H new ATOM 1139 N PHE A 72 10.354 6.145 -1.943 1.00 0.41 N ATOM 1140 CA PHE A 72 9.145 6.102 -1.106 1.00 0.44 C ATOM 1141 C PHE A 72 7.975 5.512 -1.868 1.00 0.40 C ATOM 1142 O PHE A 72 7.260 4.644 -1.371 1.00 0.42 O ATOM 1143 CB PHE A 72 8.710 7.496 -0.656 1.00 0.54 C ATOM 1144 CG PHE A 72 9.631 8.229 0.273 1.00 0.94 C ATOM 1145 CD1 PHE A 72 10.741 8.895 -0.212 1.00 1.69 C ATOM 1146 CD2 PHE A 72 9.350 8.293 1.626 1.00 1.70 C ATOM 1147 CE1 PHE A 72 11.560 9.606 0.639 1.00 2.18 C ATOM 1148 CE2 PHE A 72 10.169 8.998 2.484 1.00 2.17 C ATOM 1149 CZ PHE A 72 11.277 9.658 1.989 1.00 2.15 C ATOM 0 H PHE A 72 10.844 7.039 -1.919 1.00 0.41 H new ATOM 0 HA PHE A 72 9.406 5.489 -0.243 1.00 0.44 H new ATOM 0 HB2 PHE A 72 8.567 8.110 -1.545 1.00 0.54 H new ATOM 0 HB3 PHE A 72 7.738 7.407 -0.170 1.00 0.54 H new ATOM 0 HD1 PHE A 72 10.969 8.858 -1.267 1.00 1.69 H new ATOM 0 HD2 PHE A 72 8.480 7.785 2.015 1.00 1.70 H new ATOM 0 HE1 PHE A 72 12.424 10.123 0.249 1.00 2.18 H new ATOM 0 HE2 PHE A 72 9.944 9.034 3.540 1.00 2.17 H new ATOM 0 HZ PHE A 72 11.920 10.213 2.656 1.00 2.15 H new ATOM 1159 N GLN A 73 7.784 6.012 -3.074 1.00 0.38 N ATOM 1160 CA GLN A 73 6.664 5.606 -3.903 1.00 0.37 C ATOM 1161 C GLN A 73 6.784 4.140 -4.281 1.00 0.36 C ATOM 1162 O GLN A 73 5.838 3.372 -4.128 1.00 0.37 O ATOM 1163 CB GLN A 73 6.581 6.475 -5.161 1.00 0.41 C ATOM 1164 CG GLN A 73 5.378 6.170 -6.038 1.00 0.50 C ATOM 1165 CD GLN A 73 5.703 5.301 -7.240 1.00 0.42 C ATOM 1166 OE1 GLN A 73 5.936 5.798 -8.340 1.00 0.63 O ATOM 1167 NE2 GLN A 73 5.735 3.996 -7.031 1.00 0.41 N ATOM 0 H GLN A 73 8.395 6.706 -3.505 1.00 0.38 H new ATOM 0 HA GLN A 73 5.748 5.742 -3.329 1.00 0.37 H new ATOM 0 HB2 GLN A 73 6.547 7.524 -4.865 1.00 0.41 H new ATOM 0 HB3 GLN A 73 7.490 6.338 -5.747 1.00 0.41 H new ATOM 0 HG2 GLN A 73 4.618 5.672 -5.436 1.00 0.50 H new ATOM 0 HG3 GLN A 73 4.946 7.108 -6.386 1.00 0.50 H new ATOM 0 HE21 GLN A 73 5.535 3.623 -6.103 1.00 0.41 H new ATOM 0 HE22 GLN A 73 5.959 3.362 -7.798 1.00 0.41 H new ATOM 1176 N GLU A 74 7.944 3.759 -4.772 1.00 0.37 N ATOM 1177 CA GLU A 74 8.185 2.383 -5.181 1.00 0.40 C ATOM 1178 C GLU A 74 8.040 1.440 -3.987 1.00 0.38 C ATOM 1179 O GLU A 74 7.553 0.318 -4.117 1.00 0.41 O ATOM 1180 CB GLU A 74 9.579 2.270 -5.794 1.00 0.45 C ATOM 1181 CG GLU A 74 9.799 3.222 -6.958 1.00 0.59 C ATOM 1182 CD GLU A 74 11.224 3.210 -7.470 1.00 1.40 C ATOM 1183 OE1 GLU A 74 12.160 3.238 -6.642 1.00 2.18 O ATOM 1184 OE2 GLU A 74 11.414 3.178 -8.708 1.00 2.04 O ATOM 0 H GLU A 74 8.741 4.383 -4.900 1.00 0.37 H new ATOM 0 HA GLU A 74 7.446 2.095 -5.929 1.00 0.40 H new ATOM 0 HB2 GLU A 74 10.325 2.469 -5.024 1.00 0.45 H new ATOM 0 HB3 GLU A 74 9.737 1.247 -6.135 1.00 0.45 H new ATOM 0 HG2 GLU A 74 9.124 2.955 -7.771 1.00 0.59 H new ATOM 0 HG3 GLU A 74 9.539 4.234 -6.647 1.00 0.59 H new ATOM 1191 N TYR A 75 8.437 1.929 -2.821 1.00 0.34 N ATOM 1192 CA TYR A 75 8.366 1.167 -1.586 1.00 0.37 C ATOM 1193 C TYR A 75 6.920 1.049 -1.089 1.00 0.34 C ATOM 1194 O TYR A 75 6.509 0.010 -0.579 1.00 0.34 O ATOM 1195 CB TYR A 75 9.238 1.835 -0.523 1.00 0.43 C ATOM 1196 CG TYR A 75 9.067 1.251 0.863 1.00 0.86 C ATOM 1197 CD1 TYR A 75 9.487 -0.039 1.149 1.00 1.72 C ATOM 1198 CD2 TYR A 75 8.483 1.994 1.882 1.00 1.50 C ATOM 1199 CE1 TYR A 75 9.328 -0.576 2.411 1.00 2.09 C ATOM 1200 CE2 TYR A 75 8.325 1.465 3.148 1.00 1.86 C ATOM 1201 CZ TYR A 75 8.748 0.181 3.407 1.00 1.84 C ATOM 1202 OH TYR A 75 8.586 -0.350 4.666 1.00 2.33 O ATOM 0 H TYR A 75 8.818 2.868 -2.706 1.00 0.34 H new ATOM 0 HA TYR A 75 8.735 0.160 -1.779 1.00 0.37 H new ATOM 0 HB2 TYR A 75 10.284 1.748 -0.817 1.00 0.43 H new ATOM 0 HB3 TYR A 75 9.004 2.899 -0.490 1.00 0.43 H new ATOM 0 HD1 TYR A 75 9.946 -0.633 0.372 1.00 1.72 H new ATOM 0 HD2 TYR A 75 8.148 3.001 1.681 1.00 1.50 H new ATOM 0 HE1 TYR A 75 9.656 -1.584 2.617 1.00 2.09 H new ATOM 0 HE2 TYR A 75 7.872 2.056 3.931 1.00 1.86 H new ATOM 0 HH TYR A 75 8.163 0.314 5.249 1.00 2.33 H new ATOM 1212 N SER A 76 6.151 2.119 -1.236 1.00 0.35 N ATOM 1213 CA SER A 76 4.758 2.114 -0.804 1.00 0.37 C ATOM 1214 C SER A 76 3.907 1.274 -1.751 1.00 0.36 C ATOM 1215 O SER A 76 2.990 0.570 -1.322 1.00 0.41 O ATOM 1216 CB SER A 76 4.224 3.546 -0.704 1.00 0.41 C ATOM 1217 OG SER A 76 4.568 4.305 -1.844 1.00 1.21 O ATOM 0 H SER A 76 6.465 2.998 -1.649 1.00 0.35 H new ATOM 0 HA SER A 76 4.702 1.663 0.187 1.00 0.37 H new ATOM 0 HB2 SER A 76 3.140 3.525 -0.593 1.00 0.41 H new ATOM 0 HB3 SER A 76 4.627 4.025 0.189 1.00 0.41 H new ATOM 0 HG SER A 76 4.876 3.705 -2.556 1.00 1.21 H new ATOM 1223 N VAL A 77 4.241 1.328 -3.037 1.00 0.35 N ATOM 1224 CA VAL A 77 3.590 0.489 -4.037 1.00 0.36 C ATOM 1225 C VAL A 77 3.952 -0.965 -3.767 1.00 0.33 C ATOM 1226 O VAL A 77 3.213 -1.897 -4.085 1.00 0.33 O ATOM 1227 CB VAL A 77 4.013 0.877 -5.470 1.00 0.40 C ATOM 1228 CG1 VAL A 77 3.488 -0.127 -6.486 1.00 0.43 C ATOM 1229 CG2 VAL A 77 3.514 2.271 -5.795 1.00 0.44 C ATOM 0 H VAL A 77 4.961 1.946 -3.412 1.00 0.35 H new ATOM 0 HA VAL A 77 2.512 0.634 -3.963 1.00 0.36 H new ATOM 0 HB VAL A 77 5.102 0.867 -5.523 1.00 0.40 H new ATOM 0 HG11 VAL A 77 3.801 0.171 -7.487 1.00 0.43 H new ATOM 0 HG12 VAL A 77 3.887 -1.116 -6.260 1.00 0.43 H new ATOM 0 HG13 VAL A 77 2.399 -0.156 -6.440 1.00 0.43 H new ATOM 0 HG21 VAL A 77 3.816 2.539 -6.808 1.00 0.44 H new ATOM 0 HG22 VAL A 77 2.427 2.294 -5.722 1.00 0.44 H new ATOM 0 HG23 VAL A 77 3.940 2.984 -5.089 1.00 0.44 H new ATOM 1239 N PHE A 78 5.100 -1.128 -3.151 1.00 0.32 N ATOM 1240 CA PHE A 78 5.585 -2.434 -2.745 1.00 0.29 C ATOM 1241 C PHE A 78 4.730 -2.999 -1.617 1.00 0.27 C ATOM 1242 O PHE A 78 4.194 -4.099 -1.723 1.00 0.28 O ATOM 1243 CB PHE A 78 7.041 -2.330 -2.298 1.00 0.27 C ATOM 1244 CG PHE A 78 7.556 -3.547 -1.584 1.00 0.28 C ATOM 1245 CD1 PHE A 78 7.301 -4.821 -2.065 1.00 1.22 C ATOM 1246 CD2 PHE A 78 8.300 -3.409 -0.428 1.00 1.18 C ATOM 1247 CE1 PHE A 78 7.778 -5.931 -1.405 1.00 1.24 C ATOM 1248 CE2 PHE A 78 8.779 -4.515 0.236 1.00 1.19 C ATOM 1249 CZ PHE A 78 8.518 -5.777 -0.252 1.00 0.37 C ATOM 0 H PHE A 78 5.728 -0.359 -2.915 1.00 0.32 H new ATOM 0 HA PHE A 78 5.519 -3.110 -3.597 1.00 0.29 H new ATOM 0 HB2 PHE A 78 7.665 -2.145 -3.172 1.00 0.27 H new ATOM 0 HB3 PHE A 78 7.147 -1.466 -1.642 1.00 0.27 H new ATOM 0 HD1 PHE A 78 6.721 -4.945 -2.968 1.00 1.22 H new ATOM 0 HD2 PHE A 78 8.508 -2.422 -0.041 1.00 1.18 H new ATOM 0 HE1 PHE A 78 7.573 -6.919 -1.789 1.00 1.24 H new ATOM 0 HE2 PHE A 78 9.359 -4.394 1.139 1.00 1.19 H new ATOM 0 HZ PHE A 78 8.893 -6.646 0.269 1.00 0.37 H new ATOM 1259 N LEU A 79 4.599 -2.240 -0.544 1.00 0.27 N ATOM 1260 CA LEU A 79 3.878 -2.710 0.632 1.00 0.26 C ATOM 1261 C LEU A 79 2.429 -3.046 0.300 1.00 0.31 C ATOM 1262 O LEU A 79 1.829 -3.929 0.914 1.00 0.33 O ATOM 1263 CB LEU A 79 3.953 -1.680 1.754 1.00 0.29 C ATOM 1264 CG LEU A 79 5.375 -1.280 2.151 1.00 0.29 C ATOM 1265 CD1 LEU A 79 5.373 -0.547 3.472 1.00 0.40 C ATOM 1266 CD2 LEU A 79 6.276 -2.500 2.219 1.00 0.30 C ATOM 0 H LEU A 79 4.980 -1.298 -0.460 1.00 0.27 H new ATOM 0 HA LEU A 79 4.358 -3.627 0.973 1.00 0.26 H new ATOM 0 HB2 LEU A 79 3.410 -0.786 1.447 1.00 0.29 H new ATOM 0 HB3 LEU A 79 3.442 -2.078 2.631 1.00 0.29 H new ATOM 0 HG LEU A 79 5.766 -0.608 1.387 1.00 0.29 H new ATOM 0 HD11 LEU A 79 6.394 -0.271 3.737 1.00 0.40 H new ATOM 0 HD12 LEU A 79 4.764 0.353 3.388 1.00 0.40 H new ATOM 0 HD13 LEU A 79 4.960 -1.193 4.246 1.00 0.40 H new ATOM 0 HD21 LEU A 79 7.283 -2.193 2.503 1.00 0.30 H new ATOM 0 HD22 LEU A 79 5.887 -3.199 2.960 1.00 0.30 H new ATOM 0 HD23 LEU A 79 6.306 -2.985 1.243 1.00 0.30 H new ATOM 1278 N SER A 80 1.873 -2.362 -0.684 1.00 0.36 N ATOM 1279 CA SER A 80 0.536 -2.681 -1.139 1.00 0.47 C ATOM 1280 C SER A 80 0.540 -3.940 -1.972 1.00 0.37 C ATOM 1281 O SER A 80 -0.317 -4.790 -1.782 1.00 0.38 O ATOM 1282 CB SER A 80 -0.056 -1.553 -1.949 1.00 0.66 C ATOM 1283 OG SER A 80 0.856 -1.104 -2.931 1.00 0.84 O ATOM 0 H SER A 80 2.322 -1.591 -1.177 1.00 0.36 H new ATOM 0 HA SER A 80 -0.077 -2.834 -0.251 1.00 0.47 H new ATOM 0 HB2 SER A 80 -0.976 -1.888 -2.428 1.00 0.66 H new ATOM 0 HB3 SER A 80 -0.322 -0.727 -1.289 1.00 0.66 H new ATOM 0 HG SER A 80 0.533 -1.362 -3.820 1.00 0.84 H new ATOM 1289 N SER A 81 1.501 -4.064 -2.894 1.00 0.33 N ATOM 1290 CA SER A 81 1.595 -5.260 -3.719 1.00 0.30 C ATOM 1291 C SER A 81 1.703 -6.488 -2.822 1.00 0.24 C ATOM 1292 O SER A 81 1.234 -7.560 -3.175 1.00 0.26 O ATOM 1293 CB SER A 81 2.767 -5.185 -4.710 1.00 0.37 C ATOM 1294 OG SER A 81 4.025 -5.169 -4.058 1.00 1.22 O ATOM 0 H SER A 81 2.213 -3.358 -3.082 1.00 0.33 H new ATOM 0 HA SER A 81 0.689 -5.336 -4.320 1.00 0.30 H new ATOM 0 HB2 SER A 81 2.722 -6.038 -5.387 1.00 0.37 H new ATOM 0 HB3 SER A 81 2.666 -4.288 -5.321 1.00 0.37 H new ATOM 0 HG SER A 81 3.899 -4.958 -3.109 1.00 1.22 H new ATOM 1300 N ILE A 82 2.290 -6.301 -1.640 1.00 0.23 N ATOM 1301 CA ILE A 82 2.297 -7.331 -0.611 1.00 0.23 C ATOM 1302 C ILE A 82 0.876 -7.655 -0.173 1.00 0.27 C ATOM 1303 O ILE A 82 0.444 -8.800 -0.211 1.00 0.30 O ATOM 1304 CB ILE A 82 3.070 -6.882 0.642 1.00 0.24 C ATOM 1305 CG1 ILE A 82 4.534 -6.584 0.308 1.00 0.21 C ATOM 1306 CG2 ILE A 82 2.952 -7.939 1.732 1.00 0.28 C ATOM 1307 CD1 ILE A 82 5.337 -6.097 1.495 1.00 0.23 C ATOM 0 H ILE A 82 2.768 -5.440 -1.374 1.00 0.23 H new ATOM 0 HA ILE A 82 2.781 -8.204 -1.049 1.00 0.23 H new ATOM 0 HB ILE A 82 2.629 -5.956 1.012 1.00 0.24 H new ATOM 0 HG12 ILE A 82 4.999 -7.486 -0.089 1.00 0.21 H new ATOM 0 HG13 ILE A 82 4.573 -5.832 -0.480 1.00 0.21 H new ATOM 0 HG21 ILE A 82 3.502 -7.614 2.615 1.00 0.28 H new ATOM 0 HG22 ILE A 82 1.902 -8.080 1.990 1.00 0.28 H new ATOM 0 HG23 ILE A 82 3.367 -8.880 1.372 1.00 0.28 H new ATOM 0 HD11 ILE A 82 6.364 -5.906 1.185 1.00 0.23 H new ATOM 0 HD12 ILE A 82 4.897 -5.177 1.879 1.00 0.23 H new ATOM 0 HD13 ILE A 82 5.329 -6.857 2.276 1.00 0.23 H new ATOM 1319 N ALA A 83 0.160 -6.626 0.250 1.00 0.30 N ATOM 1320 CA ALA A 83 -1.184 -6.782 0.781 1.00 0.36 C ATOM 1321 C ALA A 83 -2.150 -7.350 -0.265 1.00 0.37 C ATOM 1322 O ALA A 83 -2.993 -8.188 0.053 1.00 0.42 O ATOM 1323 CB ALA A 83 -1.678 -5.449 1.324 1.00 0.40 C ATOM 0 H ALA A 83 0.493 -5.662 0.235 1.00 0.30 H new ATOM 0 HA ALA A 83 -1.148 -7.505 1.596 1.00 0.36 H new ATOM 0 HB1 ALA A 83 -2.686 -5.569 1.721 1.00 0.40 H new ATOM 0 HB2 ALA A 83 -1.013 -5.111 2.118 1.00 0.40 H new ATOM 0 HB3 ALA A 83 -1.690 -4.711 0.522 1.00 0.40 H new ATOM 1329 N MET A 84 -2.019 -6.915 -1.515 1.00 0.37 N ATOM 1330 CA MET A 84 -2.878 -7.419 -2.585 1.00 0.43 C ATOM 1331 C MET A 84 -2.417 -8.778 -3.091 1.00 0.34 C ATOM 1332 O MET A 84 -3.241 -9.588 -3.499 1.00 0.37 O ATOM 1333 CB MET A 84 -3.014 -6.429 -3.750 1.00 0.64 C ATOM 1334 CG MET A 84 -1.750 -5.679 -4.114 1.00 0.44 C ATOM 1335 SD MET A 84 -1.627 -5.323 -5.878 1.00 1.00 S ATOM 1336 CE MET A 84 -1.424 -6.977 -6.536 1.00 1.26 C ATOM 0 H MET A 84 -1.333 -6.221 -1.812 1.00 0.37 H new ATOM 0 HA MET A 84 -3.867 -7.538 -2.142 1.00 0.43 H new ATOM 0 HB2 MET A 84 -3.360 -6.973 -4.629 1.00 0.64 H new ATOM 0 HB3 MET A 84 -3.788 -5.703 -3.500 1.00 0.64 H new ATOM 0 HG2 MET A 84 -1.716 -4.743 -3.557 1.00 0.44 H new ATOM 0 HG3 MET A 84 -0.884 -6.265 -3.806 1.00 0.44 H new ATOM 0 HE1 MET A 84 -0.689 -6.961 -7.341 1.00 1.26 H new ATOM 0 HE2 MET A 84 -1.081 -7.644 -5.745 1.00 1.26 H new ATOM 0 HE3 MET A 84 -2.378 -7.334 -6.923 1.00 1.26 H new ATOM 1346 N MET A 85 -1.118 -9.054 -3.059 1.00 0.34 N ATOM 1347 CA MET A 85 -0.654 -10.394 -3.405 1.00 0.35 C ATOM 1348 C MET A 85 -1.078 -11.359 -2.305 1.00 0.35 C ATOM 1349 O MET A 85 -1.390 -12.517 -2.564 1.00 0.42 O ATOM 1350 CB MET A 85 0.862 -10.445 -3.635 1.00 0.39 C ATOM 1351 CG MET A 85 1.674 -10.567 -2.366 1.00 1.36 C ATOM 1352 SD MET A 85 3.439 -10.774 -2.673 1.00 2.66 S ATOM 1353 CE MET A 85 3.440 -12.267 -3.664 1.00 3.35 C ATOM 0 H MET A 85 -0.386 -8.391 -2.805 1.00 0.34 H new ATOM 0 HA MET A 85 -1.112 -10.687 -4.350 1.00 0.35 H new ATOM 0 HB2 MET A 85 1.092 -11.290 -4.284 1.00 0.39 H new ATOM 0 HB3 MET A 85 1.169 -9.543 -4.165 1.00 0.39 H new ATOM 0 HG2 MET A 85 1.519 -9.677 -1.756 1.00 1.36 H new ATOM 0 HG3 MET A 85 1.310 -11.417 -1.789 1.00 1.36 H new ATOM 0 HE1 MET A 85 4.435 -12.711 -3.652 1.00 3.35 H new ATOM 0 HE2 MET A 85 2.721 -12.976 -3.254 1.00 3.35 H new ATOM 0 HE3 MET A 85 3.164 -12.023 -4.690 1.00 3.35 H new ATOM 1363 N SER A 86 -1.117 -10.859 -1.073 1.00 0.33 N ATOM 1364 CA SER A 86 -1.671 -11.607 0.039 1.00 0.39 C ATOM 1365 C SER A 86 -3.156 -11.855 -0.205 1.00 0.43 C ATOM 1366 O SER A 86 -3.674 -12.913 0.118 1.00 0.57 O ATOM 1367 CB SER A 86 -1.463 -10.840 1.353 1.00 0.43 C ATOM 1368 OG SER A 86 -1.880 -11.602 2.473 1.00 1.24 O ATOM 0 H SER A 86 -0.768 -9.933 -0.824 1.00 0.33 H new ATOM 0 HA SER A 86 -1.158 -12.566 0.119 1.00 0.39 H new ATOM 0 HB2 SER A 86 -0.410 -10.580 1.461 1.00 0.43 H new ATOM 0 HB3 SER A 86 -2.021 -9.904 1.321 1.00 0.43 H new ATOM 0 HG SER A 86 -1.733 -11.086 3.293 1.00 1.24 H new ATOM 1374 N ASN A 87 -3.817 -10.872 -0.805 1.00 0.40 N ATOM 1375 CA ASN A 87 -5.243 -10.953 -1.122 1.00 0.51 C ATOM 1376 C ASN A 87 -5.531 -11.993 -2.200 1.00 0.44 C ATOM 1377 O ASN A 87 -6.282 -12.952 -1.982 1.00 0.53 O ATOM 1378 CB ASN A 87 -5.726 -9.593 -1.623 1.00 0.69 C ATOM 1379 CG ASN A 87 -7.108 -9.653 -2.245 1.00 1.43 C ATOM 1380 OD1 ASN A 87 -7.390 -8.971 -3.226 1.00 2.36 O ATOM 1381 ND2 ASN A 87 -7.985 -10.447 -1.661 1.00 1.49 N ATOM 0 H ASN A 87 -3.381 -9.994 -1.087 1.00 0.40 H new ATOM 0 HA ASN A 87 -5.766 -11.247 -0.212 1.00 0.51 H new ATOM 0 HB2 ASN A 87 -5.737 -8.888 -0.792 1.00 0.69 H new ATOM 0 HB3 ASN A 87 -5.018 -9.209 -2.358 1.00 0.69 H new ATOM 0 HD21 ASN A 87 -8.936 -10.510 -2.023 1.00 1.49 H new ATOM 0 HD22 ASN A 87 -7.712 -10.998 -0.847 1.00 1.49 H new ATOM 1388 N GLU A 88 -4.944 -11.782 -3.366 1.00 0.37 N ATOM 1389 CA GLU A 88 -5.204 -12.622 -4.522 1.00 0.43 C ATOM 1390 C GLU A 88 -4.833 -14.071 -4.228 1.00 0.52 C ATOM 1391 O GLU A 88 -5.509 -15.002 -4.665 1.00 0.66 O ATOM 1392 CB GLU A 88 -4.430 -12.085 -5.725 1.00 0.48 C ATOM 1393 CG GLU A 88 -4.717 -10.615 -6.007 1.00 0.51 C ATOM 1394 CD GLU A 88 -3.947 -10.082 -7.195 1.00 0.90 C ATOM 1395 OE1 GLU A 88 -2.726 -9.879 -7.075 1.00 1.73 O ATOM 1396 OE2 GLU A 88 -4.560 -9.861 -8.259 1.00 1.49 O ATOM 0 H GLU A 88 -4.278 -11.029 -3.537 1.00 0.37 H new ATOM 0 HA GLU A 88 -6.269 -12.598 -4.753 1.00 0.43 H new ATOM 0 HB2 GLU A 88 -3.362 -12.214 -5.551 1.00 0.48 H new ATOM 0 HB3 GLU A 88 -4.683 -12.675 -6.606 1.00 0.48 H new ATOM 0 HG2 GLU A 88 -5.785 -10.486 -6.185 1.00 0.51 H new ATOM 0 HG3 GLU A 88 -4.468 -10.026 -5.125 1.00 0.51 H new ATOM 1403 N PHE A 89 -3.773 -14.252 -3.454 1.00 0.50 N ATOM 1404 CA PHE A 89 -3.349 -15.581 -3.051 1.00 0.63 C ATOM 1405 C PHE A 89 -4.041 -16.023 -1.763 1.00 0.66 C ATOM 1406 O PHE A 89 -3.890 -17.169 -1.340 1.00 0.79 O ATOM 1407 CB PHE A 89 -1.829 -15.630 -2.884 1.00 0.73 C ATOM 1408 CG PHE A 89 -1.072 -15.598 -4.185 1.00 1.19 C ATOM 1409 CD1 PHE A 89 -0.829 -14.399 -4.837 1.00 1.71 C ATOM 1410 CD2 PHE A 89 -0.605 -16.770 -4.755 1.00 2.16 C ATOM 1411 CE1 PHE A 89 -0.135 -14.371 -6.031 1.00 2.38 C ATOM 1412 CE2 PHE A 89 0.090 -16.748 -5.949 1.00 2.80 C ATOM 1413 CZ PHE A 89 0.325 -15.547 -6.588 1.00 2.70 C ATOM 0 H PHE A 89 -3.192 -13.495 -3.094 1.00 0.50 H new ATOM 0 HA PHE A 89 -3.639 -16.275 -3.840 1.00 0.63 H new ATOM 0 HB2 PHE A 89 -1.513 -14.786 -2.270 1.00 0.73 H new ATOM 0 HB3 PHE A 89 -1.562 -16.537 -2.341 1.00 0.73 H new ATOM 0 HD1 PHE A 89 -1.187 -13.476 -4.406 1.00 1.71 H new ATOM 0 HD2 PHE A 89 -0.786 -17.713 -4.260 1.00 2.16 H new ATOM 0 HE1 PHE A 89 0.047 -13.430 -6.528 1.00 2.38 H new ATOM 0 HE2 PHE A 89 0.449 -17.670 -6.382 1.00 2.80 H new ATOM 0 HZ PHE A 89 0.868 -15.528 -7.522 1.00 2.70 H new ATOM 1423 N PHE A 90 -4.800 -15.121 -1.139 1.00 0.60 N ATOM 1424 CA PHE A 90 -5.575 -15.482 0.041 1.00 0.68 C ATOM 1425 C PHE A 90 -6.689 -16.417 -0.374 1.00 0.68 C ATOM 1426 O PHE A 90 -6.939 -17.434 0.275 1.00 0.80 O ATOM 1427 CB PHE A 90 -6.163 -14.246 0.732 1.00 0.69 C ATOM 1428 CG PHE A 90 -6.733 -14.525 2.093 1.00 0.85 C ATOM 1429 CD1 PHE A 90 -5.918 -14.508 3.213 1.00 1.46 C ATOM 1430 CD2 PHE A 90 -8.081 -14.805 2.254 1.00 1.53 C ATOM 1431 CE1 PHE A 90 -6.436 -14.764 4.468 1.00 1.59 C ATOM 1432 CE2 PHE A 90 -8.603 -15.061 3.507 1.00 1.64 C ATOM 1433 CZ PHE A 90 -7.780 -15.040 4.615 1.00 1.21 C ATOM 0 H PHE A 90 -4.892 -14.147 -1.429 1.00 0.60 H new ATOM 0 HA PHE A 90 -4.913 -15.973 0.754 1.00 0.68 H new ATOM 0 HB2 PHE A 90 -5.385 -13.488 0.823 1.00 0.69 H new ATOM 0 HB3 PHE A 90 -6.945 -13.826 0.100 1.00 0.69 H new ATOM 0 HD1 PHE A 90 -4.865 -14.292 3.104 1.00 1.46 H new ATOM 0 HD2 PHE A 90 -8.730 -14.823 1.391 1.00 1.53 H new ATOM 0 HE1 PHE A 90 -5.790 -14.748 5.333 1.00 1.59 H new ATOM 0 HE2 PHE A 90 -9.655 -15.278 3.620 1.00 1.64 H new ATOM 0 HZ PHE A 90 -8.187 -15.239 5.595 1.00 1.21 H new ATOM 1443 N GLU A 91 -7.369 -16.067 -1.461 1.00 0.61 N ATOM 1444 CA GLU A 91 -8.354 -16.968 -2.032 1.00 0.72 C ATOM 1445 C GLU A 91 -7.669 -18.016 -2.884 1.00 0.77 C ATOM 1446 O GLU A 91 -8.155 -19.134 -3.031 1.00 0.96 O ATOM 1447 CB GLU A 91 -9.355 -16.197 -2.870 1.00 0.83 C ATOM 1448 CG GLU A 91 -9.940 -15.011 -2.146 1.00 0.92 C ATOM 1449 CD GLU A 91 -10.903 -14.248 -3.007 1.00 1.57 C ATOM 1450 OE1 GLU A 91 -10.504 -13.827 -4.106 1.00 2.25 O ATOM 1451 OE2 GLU A 91 -12.060 -14.049 -2.586 1.00 2.23 O ATOM 0 H GLU A 91 -7.257 -15.181 -1.954 1.00 0.61 H new ATOM 0 HA GLU A 91 -8.885 -17.461 -1.218 1.00 0.72 H new ATOM 0 HB2 GLU A 91 -8.868 -15.854 -3.783 1.00 0.83 H new ATOM 0 HB3 GLU A 91 -10.161 -16.866 -3.170 1.00 0.83 H new ATOM 0 HG2 GLU A 91 -10.450 -15.351 -1.245 1.00 0.92 H new ATOM 0 HG3 GLU A 91 -9.136 -14.348 -1.826 1.00 0.92 H new ATOM 1458 N GLY A 92 -6.537 -17.638 -3.451 1.00 0.71 N ATOM 1459 CA GLY A 92 -5.781 -18.552 -4.277 1.00 0.82 C ATOM 1460 C GLY A 92 -5.892 -18.191 -5.738 1.00 0.81 C ATOM 1461 O GLY A 92 -5.053 -18.579 -6.551 1.00 0.92 O ATOM 0 H GLY A 92 -6.126 -16.710 -3.353 1.00 0.71 H new ATOM 0 HA2 GLY A 92 -4.734 -18.537 -3.975 1.00 0.82 H new ATOM 0 HA3 GLY A 92 -6.143 -19.569 -4.123 1.00 0.82 H new ATOM 1465 N PHE A 93 -6.927 -17.437 -6.063 1.00 0.76 N ATOM 1466 CA PHE A 93 -7.144 -16.974 -7.418 1.00 0.78 C ATOM 1467 C PHE A 93 -7.933 -15.677 -7.386 1.00 0.69 C ATOM 1468 O PHE A 93 -9.039 -15.636 -6.846 1.00 0.82 O ATOM 1469 CB PHE A 93 -7.891 -18.026 -8.246 1.00 1.00 C ATOM 1470 CG PHE A 93 -8.081 -17.626 -9.684 1.00 1.68 C ATOM 1471 CD1 PHE A 93 -7.034 -17.719 -10.586 1.00 2.41 C ATOM 1472 CD2 PHE A 93 -9.305 -17.151 -10.130 1.00 2.59 C ATOM 1473 CE1 PHE A 93 -7.203 -17.347 -11.906 1.00 3.46 C ATOM 1474 CE2 PHE A 93 -9.480 -16.777 -11.448 1.00 3.60 C ATOM 1475 CZ PHE A 93 -8.427 -16.875 -12.337 1.00 3.91 C ATOM 0 H PHE A 93 -7.636 -17.131 -5.397 1.00 0.76 H new ATOM 0 HA PHE A 93 -6.176 -16.803 -7.889 1.00 0.78 H new ATOM 0 HB2 PHE A 93 -7.341 -18.966 -8.207 1.00 1.00 H new ATOM 0 HB3 PHE A 93 -8.866 -18.208 -7.795 1.00 1.00 H new ATOM 0 HD1 PHE A 93 -6.074 -18.087 -10.254 1.00 2.41 H new ATOM 0 HD2 PHE A 93 -10.131 -17.073 -9.439 1.00 2.59 H new ATOM 0 HE1 PHE A 93 -6.379 -17.425 -12.600 1.00 3.46 H new ATOM 0 HE2 PHE A 93 -10.438 -16.409 -11.783 1.00 3.60 H new ATOM 0 HZ PHE A 93 -8.561 -16.583 -13.368 1.00 3.91 H new ATOM 1485 N PRO A 94 -7.362 -14.598 -7.931 1.00 0.64 N ATOM 1486 CA PRO A 94 -8.028 -13.297 -7.980 1.00 0.61 C ATOM 1487 C PRO A 94 -9.318 -13.340 -8.795 1.00 0.71 C ATOM 1488 O PRO A 94 -9.293 -13.458 -10.018 1.00 0.90 O ATOM 1489 CB PRO A 94 -7.001 -12.382 -8.648 1.00 0.65 C ATOM 1490 CG PRO A 94 -6.047 -13.293 -9.341 1.00 0.84 C ATOM 1491 CD PRO A 94 -6.022 -14.560 -8.538 1.00 0.83 C ATOM 0 HA PRO A 94 -8.327 -12.959 -6.988 1.00 0.61 H new ATOM 0 HB2 PRO A 94 -7.480 -11.704 -9.355 1.00 0.65 H new ATOM 0 HB3 PRO A 94 -6.488 -11.764 -7.911 1.00 0.65 H new ATOM 0 HG2 PRO A 94 -6.367 -13.487 -10.365 1.00 0.84 H new ATOM 0 HG3 PRO A 94 -5.054 -12.848 -9.397 1.00 0.84 H new ATOM 0 HD2 PRO A 94 -5.839 -15.432 -9.166 1.00 0.83 H new ATOM 0 HD3 PRO A 94 -5.237 -14.542 -7.782 1.00 0.83 H new ATOM 1499 N ASP A 95 -10.441 -13.229 -8.105 1.00 0.71 N ATOM 1500 CA ASP A 95 -11.757 -13.311 -8.742 1.00 0.88 C ATOM 1501 C ASP A 95 -12.360 -11.929 -8.792 1.00 0.84 C ATOM 1502 O ASP A 95 -13.282 -11.639 -9.551 1.00 0.96 O ATOM 1503 CB ASP A 95 -12.684 -14.224 -7.943 1.00 1.12 C ATOM 1504 CG ASP A 95 -13.268 -13.533 -6.718 1.00 1.70 C ATOM 1505 OD1 ASP A 95 -12.497 -12.969 -5.915 1.00 2.16 O ATOM 1506 OD2 ASP A 95 -14.504 -13.555 -6.548 1.00 2.40 O ATOM 0 H ASP A 95 -10.473 -13.081 -7.096 1.00 0.71 H new ATOM 0 HA ASP A 95 -11.640 -13.717 -9.747 1.00 0.88 H new ATOM 0 HB2 ASP A 95 -13.496 -14.565 -8.586 1.00 1.12 H new ATOM 0 HB3 ASP A 95 -12.133 -15.110 -7.628 1.00 1.12 H new ATOM 1511 N LYS A 96 -11.802 -11.091 -7.952 1.00 0.81 N ATOM 1512 CA LYS A 96 -12.253 -9.736 -7.766 1.00 0.86 C ATOM 1513 C LYS A 96 -11.574 -8.834 -8.777 1.00 0.84 C ATOM 1514 O LYS A 96 -11.992 -7.700 -9.008 1.00 0.95 O ATOM 1515 CB LYS A 96 -11.957 -9.306 -6.326 1.00 0.97 C ATOM 1516 CG LYS A 96 -10.675 -9.910 -5.743 1.00 0.94 C ATOM 1517 CD LYS A 96 -10.515 -9.571 -4.279 1.00 0.65 C ATOM 1518 CE LYS A 96 -10.625 -10.823 -3.436 1.00 0.84 C ATOM 1519 NZ LYS A 96 -11.912 -11.542 -3.668 1.00 1.86 N ATOM 0 H LYS A 96 -11.004 -11.339 -7.367 1.00 0.81 H new ATOM 0 HA LYS A 96 -13.328 -9.663 -7.928 1.00 0.86 H new ATOM 0 HB2 LYS A 96 -11.882 -8.219 -6.291 1.00 0.97 H new ATOM 0 HB3 LYS A 96 -12.799 -9.588 -5.694 1.00 0.97 H new ATOM 0 HG2 LYS A 96 -10.694 -10.993 -5.866 1.00 0.94 H new ATOM 0 HG3 LYS A 96 -9.813 -9.541 -6.299 1.00 0.94 H new ATOM 0 HD2 LYS A 96 -9.548 -9.096 -4.112 1.00 0.65 H new ATOM 0 HD3 LYS A 96 -11.279 -8.854 -3.979 1.00 0.65 H new ATOM 0 HE2 LYS A 96 -9.792 -11.488 -3.664 1.00 0.84 H new ATOM 0 HE3 LYS A 96 -10.542 -10.559 -2.382 1.00 0.84 H new ATOM 0 HZ1 LYS A 96 -12.192 -12.042 -2.800 1.00 1.86 H new ATOM 0 HZ2 LYS A 96 -12.651 -10.857 -3.927 1.00 1.86 H new ATOM 0 HZ3 LYS A 96 -11.792 -12.229 -4.439 1.00 1.86 H new ATOM 1663 N SER B 3 8.576 -3.413 13.429 1.00 0.80 N ATOM 1664 CA SER B 3 8.003 -4.443 14.279 1.00 0.78 C ATOM 1665 C SER B 3 6.508 -4.193 14.315 1.00 0.65 C ATOM 1666 O SER B 3 6.130 -3.025 14.277 1.00 0.83 O ATOM 1667 CB SER B 3 8.619 -4.345 15.677 1.00 0.97 C ATOM 1668 OG SER B 3 10.032 -4.249 15.596 1.00 1.18 O ATOM 0 HA SER B 3 8.205 -5.446 13.903 1.00 0.78 H new ATOM 0 HB2 SER B 3 8.219 -3.474 16.196 1.00 0.97 H new ATOM 0 HB3 SER B 3 8.342 -5.220 16.264 1.00 0.97 H new ATOM 0 HG SER B 3 10.280 -3.749 14.791 1.00 1.18 H new ATOM 1674 N PRO B 4 5.682 -5.193 14.658 1.00 0.67 N ATOM 1675 CA PRO B 4 4.409 -5.559 13.997 1.00 0.62 C ATOM 1676 C PRO B 4 3.732 -4.567 13.011 1.00 0.47 C ATOM 1677 O PRO B 4 2.746 -4.942 12.395 1.00 0.50 O ATOM 1678 CB PRO B 4 3.526 -5.787 15.217 1.00 0.79 C ATOM 1679 CG PRO B 4 4.443 -6.398 16.234 1.00 0.97 C ATOM 1680 CD PRO B 4 5.864 -6.070 15.819 1.00 0.88 C ATOM 0 HA PRO B 4 4.584 -6.386 13.308 1.00 0.62 H new ATOM 0 HB2 PRO B 4 3.099 -4.852 15.579 1.00 0.79 H new ATOM 0 HB3 PRO B 4 2.692 -6.450 14.985 1.00 0.79 H new ATOM 0 HG2 PRO B 4 4.232 -6.002 17.228 1.00 0.97 H new ATOM 0 HG3 PRO B 4 4.297 -7.477 16.283 1.00 0.97 H new ATOM 0 HD2 PRO B 4 6.412 -5.571 16.618 1.00 0.88 H new ATOM 0 HD3 PRO B 4 6.425 -6.968 15.561 1.00 0.88 H new ATOM 1688 N LEU B 5 4.218 -3.341 12.861 1.00 0.36 N ATOM 1689 CA LEU B 5 3.630 -2.363 11.948 1.00 0.32 C ATOM 1690 C LEU B 5 3.508 -2.933 10.544 1.00 0.30 C ATOM 1691 O LEU B 5 2.513 -2.699 9.865 1.00 0.32 O ATOM 1692 CB LEU B 5 4.480 -1.093 11.906 1.00 0.32 C ATOM 1693 CG LEU B 5 3.975 0.008 10.965 1.00 0.30 C ATOM 1694 CD1 LEU B 5 3.651 1.259 11.758 1.00 0.41 C ATOM 1695 CD2 LEU B 5 5.005 0.320 9.883 1.00 0.27 C ATOM 0 H LEU B 5 5.032 -2.994 13.369 1.00 0.36 H new ATOM 0 HA LEU B 5 2.634 -2.121 12.318 1.00 0.32 H new ATOM 0 HB2 LEU B 5 4.542 -0.685 12.915 1.00 0.32 H new ATOM 0 HB3 LEU B 5 5.493 -1.364 11.609 1.00 0.32 H new ATOM 0 HG LEU B 5 3.069 -0.349 10.475 1.00 0.30 H new ATOM 0 HD11 LEU B 5 3.293 2.036 11.082 1.00 0.41 H new ATOM 0 HD12 LEU B 5 2.879 1.034 12.493 1.00 0.41 H new ATOM 0 HD13 LEU B 5 4.548 1.608 12.269 1.00 0.41 H new ATOM 0 HD21 LEU B 5 4.621 1.104 9.230 1.00 0.27 H new ATOM 0 HD22 LEU B 5 5.931 0.657 10.349 1.00 0.27 H new ATOM 0 HD23 LEU B 5 5.200 -0.578 9.296 1.00 0.27 H new ATOM 1707 N GLU B 6 4.518 -3.685 10.110 1.00 0.35 N ATOM 1708 CA GLU B 6 4.464 -4.321 8.803 1.00 0.42 C ATOM 1709 C GLU B 6 3.220 -5.197 8.693 1.00 0.34 C ATOM 1710 O GLU B 6 2.487 -5.185 7.699 1.00 0.32 O ATOM 1711 CB GLU B 6 5.704 -5.179 8.543 1.00 0.62 C ATOM 1712 CG GLU B 6 6.090 -6.102 9.689 1.00 1.80 C ATOM 1713 CD GLU B 6 6.485 -7.497 9.226 1.00 2.84 C ATOM 1714 OE1 GLU B 6 6.381 -7.793 8.012 1.00 3.32 O ATOM 1715 OE2 GLU B 6 6.870 -8.321 10.083 1.00 3.61 O ATOM 0 H GLU B 6 5.371 -3.865 10.639 1.00 0.35 H new ATOM 0 HA GLU B 6 4.428 -3.528 8.056 1.00 0.42 H new ATOM 0 HB2 GLU B 6 5.532 -5.782 7.651 1.00 0.62 H new ATOM 0 HB3 GLU B 6 6.545 -4.521 8.325 1.00 0.62 H new ATOM 0 HG2 GLU B 6 6.920 -5.660 10.240 1.00 1.80 H new ATOM 0 HG3 GLU B 6 5.253 -6.180 10.383 1.00 1.80 H new ATOM 1722 N LYS B 7 2.983 -5.942 9.750 1.00 0.35 N ATOM 1723 CA LYS B 7 1.879 -6.866 9.814 1.00 0.36 C ATOM 1724 C LYS B 7 0.601 -6.114 10.158 1.00 0.32 C ATOM 1725 O LYS B 7 -0.495 -6.627 9.997 1.00 0.35 O ATOM 1726 CB LYS B 7 2.197 -8.002 10.792 1.00 0.44 C ATOM 1727 CG LYS B 7 3.622 -8.558 10.633 1.00 0.64 C ATOM 1728 CD LYS B 7 3.855 -9.380 9.348 1.00 0.80 C ATOM 1729 CE LYS B 7 3.451 -8.647 8.074 1.00 1.78 C ATOM 1730 NZ LYS B 7 4.243 -9.086 6.899 1.00 2.82 N ATOM 0 H LYS B 7 3.556 -5.921 10.593 1.00 0.35 H new ATOM 0 HA LYS B 7 1.720 -7.333 8.842 1.00 0.36 H new ATOM 0 HB2 LYS B 7 2.067 -7.641 11.812 1.00 0.44 H new ATOM 0 HB3 LYS B 7 1.480 -8.810 10.645 1.00 0.44 H new ATOM 0 HG2 LYS B 7 4.326 -7.726 10.648 1.00 0.64 H new ATOM 0 HG3 LYS B 7 3.851 -9.184 11.495 1.00 0.64 H new ATOM 0 HD2 LYS B 7 4.910 -9.648 9.284 1.00 0.80 H new ATOM 0 HD3 LYS B 7 3.293 -10.311 9.415 1.00 0.80 H new ATOM 0 HE2 LYS B 7 2.392 -8.816 7.880 1.00 1.78 H new ATOM 0 HE3 LYS B 7 3.581 -7.574 8.217 1.00 1.78 H new ATOM 0 HZ1 LYS B 7 3.889 -8.611 6.044 1.00 2.82 H new ATOM 0 HZ2 LYS B 7 5.243 -8.839 7.043 1.00 2.82 H new ATOM 0 HZ3 LYS B 7 4.153 -10.116 6.785 1.00 2.82 H new ATOM 1744 N ALA B 8 0.762 -4.904 10.675 1.00 0.29 N ATOM 1745 CA ALA B 8 -0.357 -3.997 10.874 1.00 0.29 C ATOM 1746 C ALA B 8 -0.894 -3.495 9.537 1.00 0.27 C ATOM 1747 O ALA B 8 -2.087 -3.238 9.407 1.00 0.28 O ATOM 1748 CB ALA B 8 0.042 -2.830 11.750 1.00 0.32 C ATOM 0 H ALA B 8 1.664 -4.527 10.966 1.00 0.29 H new ATOM 0 HA ALA B 8 -1.149 -4.551 11.378 1.00 0.29 H new ATOM 0 HB1 ALA B 8 -0.812 -2.166 11.884 1.00 0.32 H new ATOM 0 HB2 ALA B 8 0.370 -3.200 12.722 1.00 0.32 H new ATOM 0 HB3 ALA B 8 0.857 -2.282 11.277 1.00 0.32 H new ATOM 1754 N LEU B 9 -0.023 -3.342 8.539 1.00 0.25 N ATOM 1755 CA LEU B 9 -0.506 -3.085 7.180 1.00 0.25 C ATOM 1756 C LEU B 9 -1.262 -4.322 6.717 1.00 0.25 C ATOM 1757 O LEU B 9 -2.257 -4.253 6.008 1.00 0.26 O ATOM 1758 CB LEU B 9 0.625 -2.783 6.184 1.00 0.26 C ATOM 1759 CG LEU B 9 1.945 -2.314 6.786 1.00 0.25 C ATOM 1760 CD1 LEU B 9 3.027 -2.279 5.721 1.00 0.33 C ATOM 1761 CD2 LEU B 9 1.800 -0.947 7.433 1.00 0.27 C ATOM 0 H LEU B 9 0.991 -3.389 8.638 1.00 0.25 H new ATOM 0 HA LEU B 9 -1.142 -2.200 7.207 1.00 0.25 H new ATOM 0 HB2 LEU B 9 0.816 -3.683 5.599 1.00 0.26 H new ATOM 0 HB3 LEU B 9 0.275 -2.020 5.489 1.00 0.26 H new ATOM 0 HG LEU B 9 2.232 -3.025 7.561 1.00 0.25 H new ATOM 0 HD11 LEU B 9 3.964 -1.942 6.165 1.00 0.33 H new ATOM 0 HD12 LEU B 9 3.161 -3.278 5.305 1.00 0.33 H new ATOM 0 HD13 LEU B 9 2.734 -1.592 4.927 1.00 0.33 H new ATOM 0 HD21 LEU B 9 2.758 -0.640 7.853 1.00 0.27 H new ATOM 0 HD22 LEU B 9 1.483 -0.222 6.684 1.00 0.27 H new ATOM 0 HD23 LEU B 9 1.055 -0.997 8.227 1.00 0.27 H new ATOM 1773 N ASP B 10 -0.780 -5.473 7.146 1.00 0.27 N ATOM 1774 CA ASP B 10 -1.511 -6.719 6.927 1.00 0.28 C ATOM 1775 C ASP B 10 -2.855 -6.667 7.668 1.00 0.27 C ATOM 1776 O ASP B 10 -3.854 -7.242 7.227 1.00 0.28 O ATOM 1777 CB ASP B 10 -0.686 -7.922 7.391 1.00 0.33 C ATOM 1778 CG ASP B 10 -1.390 -9.240 7.158 1.00 0.37 C ATOM 1779 OD1 ASP B 10 -1.251 -9.800 6.051 1.00 1.18 O ATOM 1780 OD2 ASP B 10 -2.071 -9.730 8.085 1.00 1.15 O ATOM 0 H ASP B 10 0.104 -5.577 7.643 1.00 0.27 H new ATOM 0 HA ASP B 10 -1.698 -6.834 5.859 1.00 0.28 H new ATOM 0 HB2 ASP B 10 0.268 -7.927 6.865 1.00 0.33 H new ATOM 0 HB3 ASP B 10 -0.464 -7.817 8.453 1.00 0.33 H new ATOM 1785 N VAL B 11 -2.879 -5.936 8.780 1.00 0.27 N ATOM 1786 CA VAL B 11 -4.100 -5.728 9.540 1.00 0.27 C ATOM 1787 C VAL B 11 -5.016 -4.741 8.814 1.00 0.27 C ATOM 1788 O VAL B 11 -6.222 -4.732 9.027 1.00 0.28 O ATOM 1789 CB VAL B 11 -3.792 -5.226 10.971 1.00 0.28 C ATOM 1790 CG1 VAL B 11 -5.063 -4.842 11.708 1.00 0.30 C ATOM 1791 CG2 VAL B 11 -3.035 -6.287 11.753 1.00 0.31 C ATOM 0 H VAL B 11 -2.058 -5.476 9.174 1.00 0.27 H new ATOM 0 HA VAL B 11 -4.611 -6.687 9.625 1.00 0.27 H new ATOM 0 HB VAL B 11 -3.169 -4.335 10.884 1.00 0.28 H new ATOM 0 HG11 VAL B 11 -4.812 -4.494 12.710 1.00 0.30 H new ATOM 0 HG12 VAL B 11 -5.573 -4.046 11.164 1.00 0.30 H new ATOM 0 HG13 VAL B 11 -5.718 -5.710 11.779 1.00 0.30 H new ATOM 0 HG21 VAL B 11 -2.826 -5.919 12.757 1.00 0.31 H new ATOM 0 HG22 VAL B 11 -3.639 -7.192 11.817 1.00 0.31 H new ATOM 0 HG23 VAL B 11 -2.097 -6.512 11.246 1.00 0.31 H new ATOM 1801 N MET B 12 -4.443 -3.912 7.947 1.00 0.26 N ATOM 1802 CA MET B 12 -5.244 -3.024 7.106 1.00 0.29 C ATOM 1803 C MET B 12 -6.027 -3.866 6.100 1.00 0.29 C ATOM 1804 O MET B 12 -7.143 -3.522 5.711 1.00 0.33 O ATOM 1805 CB MET B 12 -4.355 -1.987 6.395 1.00 0.32 C ATOM 1806 CG MET B 12 -3.981 -2.335 4.959 1.00 0.98 C ATOM 1807 SD MET B 12 -2.587 -1.363 4.349 1.00 2.23 S ATOM 1808 CE MET B 12 -2.378 -2.055 2.713 1.00 2.75 C ATOM 0 H MET B 12 -3.436 -3.835 7.808 1.00 0.26 H new ATOM 0 HA MET B 12 -5.945 -2.469 7.729 1.00 0.29 H new ATOM 0 HB2 MET B 12 -4.870 -1.026 6.398 1.00 0.32 H new ATOM 0 HB3 MET B 12 -3.439 -1.859 6.972 1.00 0.32 H new ATOM 0 HG2 MET B 12 -3.734 -3.395 4.899 1.00 0.98 H new ATOM 0 HG3 MET B 12 -4.844 -2.171 4.313 1.00 0.98 H new ATOM 0 HE1 MET B 12 -1.333 -1.974 2.414 1.00 2.75 H new ATOM 0 HE2 MET B 12 -2.672 -3.104 2.722 1.00 2.75 H new ATOM 0 HE3 MET B 12 -3.001 -1.509 2.005 1.00 2.75 H new ATOM 1818 N VAL B 13 -5.433 -4.988 5.699 1.00 0.29 N ATOM 1819 CA VAL B 13 -6.127 -5.969 4.864 1.00 0.31 C ATOM 1820 C VAL B 13 -7.322 -6.549 5.630 1.00 0.27 C ATOM 1821 O VAL B 13 -8.426 -6.702 5.091 1.00 0.27 O ATOM 1822 CB VAL B 13 -5.188 -7.122 4.430 1.00 0.37 C ATOM 1823 CG1 VAL B 13 -5.888 -8.061 3.458 1.00 0.42 C ATOM 1824 CG2 VAL B 13 -3.911 -6.575 3.809 1.00 0.42 C ATOM 0 H VAL B 13 -4.474 -5.241 5.938 1.00 0.29 H new ATOM 0 HA VAL B 13 -6.469 -5.455 3.966 1.00 0.31 H new ATOM 0 HB VAL B 13 -4.924 -7.689 5.323 1.00 0.37 H new ATOM 0 HG11 VAL B 13 -5.206 -8.861 3.170 1.00 0.42 H new ATOM 0 HG12 VAL B 13 -6.769 -8.490 3.937 1.00 0.42 H new ATOM 0 HG13 VAL B 13 -6.192 -7.506 2.571 1.00 0.42 H new ATOM 0 HG21 VAL B 13 -3.267 -7.403 3.512 1.00 0.42 H new ATOM 0 HG22 VAL B 13 -4.160 -5.976 2.933 1.00 0.42 H new ATOM 0 HG23 VAL B 13 -3.390 -5.953 4.537 1.00 0.42 H new ATOM 1834 N SER B 14 -7.095 -6.860 6.899 1.00 0.26 N ATOM 1835 CA SER B 14 -8.152 -7.367 7.764 1.00 0.26 C ATOM 1836 C SER B 14 -9.205 -6.293 8.029 1.00 0.25 C ATOM 1837 O SER B 14 -10.402 -6.584 8.089 1.00 0.25 O ATOM 1838 CB SER B 14 -7.548 -7.869 9.072 1.00 0.31 C ATOM 1839 OG SER B 14 -6.492 -8.780 8.813 1.00 1.18 O ATOM 0 H SER B 14 -6.186 -6.770 7.353 1.00 0.26 H new ATOM 0 HA SER B 14 -8.649 -8.197 7.262 1.00 0.26 H new ATOM 0 HB2 SER B 14 -7.175 -7.026 9.654 1.00 0.31 H new ATOM 0 HB3 SER B 14 -8.317 -8.355 9.672 1.00 0.31 H new ATOM 0 HG SER B 14 -6.114 -9.092 9.661 1.00 1.18 H new ATOM 1845 N THR B 15 -8.745 -5.059 8.168 1.00 0.28 N ATOM 1846 CA THR B 15 -9.612 -3.897 8.272 1.00 0.32 C ATOM 1847 C THR B 15 -10.649 -3.922 7.148 1.00 0.28 C ATOM 1848 O THR B 15 -11.847 -3.666 7.351 1.00 0.29 O ATOM 1849 CB THR B 15 -8.768 -2.611 8.180 1.00 0.45 C ATOM 1850 OG1 THR B 15 -7.913 -2.511 9.331 1.00 0.59 O ATOM 1851 CG2 THR B 15 -9.640 -1.374 8.073 1.00 0.93 C ATOM 0 H THR B 15 -7.751 -4.835 8.212 1.00 0.28 H new ATOM 0 HA THR B 15 -10.129 -3.918 9.232 1.00 0.32 H new ATOM 0 HB THR B 15 -8.164 -2.669 7.275 1.00 0.45 H new ATOM 0 HG1 THR B 15 -7.272 -3.252 9.327 1.00 0.59 H new ATOM 0 HG21 THR B 15 -9.008 -0.488 8.010 1.00 0.93 H new ATOM 0 HG22 THR B 15 -10.260 -1.442 7.179 1.00 0.93 H new ATOM 0 HG23 THR B 15 -10.279 -1.302 8.953 1.00 0.93 H new ATOM 1859 N PHE B 16 -10.170 -4.289 5.969 1.00 0.27 N ATOM 1860 CA PHE B 16 -10.993 -4.356 4.784 1.00 0.27 C ATOM 1861 C PHE B 16 -12.114 -5.372 4.919 1.00 0.29 C ATOM 1862 O PHE B 16 -13.289 -5.014 4.817 1.00 0.37 O ATOM 1863 CB PHE B 16 -10.136 -4.685 3.568 1.00 0.34 C ATOM 1864 CG PHE B 16 -10.936 -4.764 2.309 1.00 0.83 C ATOM 1865 CD1 PHE B 16 -11.175 -3.632 1.562 1.00 1.73 C ATOM 1866 CD2 PHE B 16 -11.470 -5.966 1.890 1.00 1.65 C ATOM 1867 CE1 PHE B 16 -11.931 -3.697 0.416 1.00 2.34 C ATOM 1868 CE2 PHE B 16 -12.231 -6.035 0.749 1.00 2.27 C ATOM 1869 CZ PHE B 16 -12.460 -4.899 0.013 1.00 2.36 C ATOM 0 H PHE B 16 -9.196 -4.548 5.813 1.00 0.27 H new ATOM 0 HA PHE B 16 -11.454 -3.377 4.654 1.00 0.27 H new ATOM 0 HB2 PHE B 16 -9.363 -3.925 3.456 1.00 0.34 H new ATOM 0 HB3 PHE B 16 -9.628 -5.635 3.732 1.00 0.34 H new ATOM 0 HD1 PHE B 16 -10.765 -2.685 1.880 1.00 1.73 H new ATOM 0 HD2 PHE B 16 -11.287 -6.861 2.466 1.00 1.65 H new ATOM 0 HE1 PHE B 16 -12.109 -2.805 -0.166 1.00 2.34 H new ATOM 0 HE2 PHE B 16 -12.648 -6.979 0.432 1.00 2.27 H new ATOM 0 HZ PHE B 16 -13.058 -4.950 -0.885 1.00 2.36 H new ATOM 1879 N HIS B 17 -11.766 -6.637 5.146 1.00 0.31 N ATOM 1880 CA HIS B 17 -12.781 -7.694 5.168 1.00 0.40 C ATOM 1881 C HIS B 17 -13.794 -7.471 6.284 1.00 0.36 C ATOM 1882 O HIS B 17 -14.891 -8.024 6.256 1.00 0.42 O ATOM 1883 CB HIS B 17 -12.154 -9.098 5.250 1.00 0.59 C ATOM 1884 CG HIS B 17 -11.386 -9.426 6.506 1.00 0.81 C ATOM 1885 ND1 HIS B 17 -10.156 -10.048 6.477 1.00 1.54 N ATOM 1886 CD2 HIS B 17 -11.694 -9.280 7.819 1.00 1.77 C ATOM 1887 CE1 HIS B 17 -9.743 -10.266 7.711 1.00 2.03 C ATOM 1888 NE2 HIS B 17 -10.658 -9.810 8.545 1.00 2.20 N ATOM 0 H HIS B 17 -10.811 -6.953 5.314 1.00 0.31 H new ATOM 0 HA HIS B 17 -13.316 -7.640 4.220 1.00 0.40 H new ATOM 0 HB2 HIS B 17 -12.951 -9.833 5.137 1.00 0.59 H new ATOM 0 HB3 HIS B 17 -11.483 -9.221 4.400 1.00 0.59 H new ATOM 0 HD2 HIS B 17 -12.590 -8.829 8.219 1.00 1.77 H new ATOM 0 HE1 HIS B 17 -8.813 -10.738 7.991 1.00 2.03 H new ATOM 0 HE2 HIS B 17 -10.604 -9.846 9.563 1.00 2.20 H new ATOM 1897 N LYS B 18 -13.417 -6.644 7.247 1.00 0.34 N ATOM 1898 CA LYS B 18 -14.303 -6.271 8.333 1.00 0.39 C ATOM 1899 C LYS B 18 -15.457 -5.417 7.819 1.00 0.37 C ATOM 1900 O LYS B 18 -16.626 -5.741 8.033 1.00 0.47 O ATOM 1901 CB LYS B 18 -13.508 -5.517 9.396 1.00 0.43 C ATOM 1902 CG LYS B 18 -14.359 -4.886 10.488 1.00 0.54 C ATOM 1903 CD LYS B 18 -13.532 -4.617 11.736 1.00 0.73 C ATOM 1904 CE LYS B 18 -12.296 -3.780 11.437 1.00 0.79 C ATOM 1905 NZ LYS B 18 -11.339 -3.783 12.576 1.00 1.28 N ATOM 0 H LYS B 18 -12.493 -6.216 7.296 1.00 0.34 H new ATOM 0 HA LYS B 18 -14.727 -7.173 8.774 1.00 0.39 H new ATOM 0 HB2 LYS B 18 -12.798 -6.204 9.857 1.00 0.43 H new ATOM 0 HB3 LYS B 18 -12.925 -4.735 8.910 1.00 0.43 H new ATOM 0 HG2 LYS B 18 -14.790 -3.953 10.125 1.00 0.54 H new ATOM 0 HG3 LYS B 18 -15.190 -5.547 10.734 1.00 0.54 H new ATOM 0 HD2 LYS B 18 -14.148 -4.102 12.474 1.00 0.73 H new ATOM 0 HD3 LYS B 18 -13.228 -5.565 12.180 1.00 0.73 H new ATOM 0 HE2 LYS B 18 -11.802 -4.167 10.546 1.00 0.79 H new ATOM 0 HE3 LYS B 18 -12.595 -2.755 11.216 1.00 0.79 H new ATOM 0 HZ1 LYS B 18 -10.510 -3.203 12.335 1.00 1.28 H new ATOM 0 HZ2 LYS B 18 -11.803 -3.391 13.420 1.00 1.28 H new ATOM 0 HZ3 LYS B 18 -11.034 -4.758 12.770 1.00 1.28 H new ATOM 1919 N TYR B 19 -15.129 -4.336 7.123 1.00 0.29 N ATOM 1920 CA TYR B 19 -16.152 -3.425 6.623 1.00 0.29 C ATOM 1921 C TYR B 19 -16.810 -3.947 5.351 1.00 0.33 C ATOM 1922 O TYR B 19 -17.964 -3.636 5.073 1.00 0.44 O ATOM 1923 CB TYR B 19 -15.572 -2.038 6.389 1.00 0.31 C ATOM 1924 CG TYR B 19 -15.440 -1.228 7.654 1.00 0.36 C ATOM 1925 CD1 TYR B 19 -14.500 -1.557 8.619 1.00 1.28 C ATOM 1926 CD2 TYR B 19 -16.264 -0.135 7.886 1.00 1.23 C ATOM 1927 CE1 TYR B 19 -14.385 -0.820 9.778 1.00 1.35 C ATOM 1928 CE2 TYR B 19 -16.152 0.609 9.042 1.00 1.26 C ATOM 1929 CZ TYR B 19 -15.213 0.262 9.984 1.00 0.62 C ATOM 1930 OH TYR B 19 -15.087 1.011 11.130 1.00 0.79 O ATOM 0 H TYR B 19 -14.172 -4.070 6.893 1.00 0.29 H new ATOM 0 HA TYR B 19 -16.925 -3.359 7.389 1.00 0.29 H new ATOM 0 HB2 TYR B 19 -14.591 -2.135 5.924 1.00 0.31 H new ATOM 0 HB3 TYR B 19 -16.207 -1.500 5.685 1.00 0.31 H new ATOM 0 HD1 TYR B 19 -13.848 -2.403 8.460 1.00 1.28 H new ATOM 0 HD2 TYR B 19 -17.005 0.137 7.149 1.00 1.23 H new ATOM 0 HE1 TYR B 19 -13.649 -1.089 10.521 1.00 1.35 H new ATOM 0 HE2 TYR B 19 -16.798 1.459 9.206 1.00 1.26 H new ATOM 0 HH TYR B 19 -14.229 1.484 11.119 1.00 0.79 H new ATOM 1940 N SER B 20 -16.081 -4.730 4.582 1.00 0.29 N ATOM 1941 CA SER B 20 -16.626 -5.300 3.362 1.00 0.32 C ATOM 1942 C SER B 20 -17.693 -6.329 3.695 1.00 0.40 C ATOM 1943 O SER B 20 -18.753 -6.358 3.080 1.00 0.60 O ATOM 1944 CB SER B 20 -15.507 -5.943 2.557 1.00 0.35 C ATOM 1945 OG SER B 20 -14.466 -5.015 2.340 1.00 0.86 O ATOM 0 H SER B 20 -15.113 -4.987 4.777 1.00 0.29 H new ATOM 0 HA SER B 20 -17.083 -4.508 2.769 1.00 0.32 H new ATOM 0 HB2 SER B 20 -15.122 -6.814 3.087 1.00 0.35 H new ATOM 0 HB3 SER B 20 -15.894 -6.296 1.601 1.00 0.35 H new ATOM 0 HG SER B 20 -13.936 -5.293 1.564 1.00 0.86 H new ATOM 1951 N GLY B 21 -17.427 -7.133 4.721 1.00 0.37 N ATOM 1952 CA GLY B 21 -18.338 -8.202 5.093 1.00 0.43 C ATOM 1953 C GLY B 21 -19.561 -7.706 5.833 1.00 0.41 C ATOM 1954 O GLY B 21 -20.156 -8.434 6.628 1.00 0.46 O ATOM 0 H GLY B 21 -16.593 -7.063 5.304 1.00 0.37 H new ATOM 0 HA2 GLY B 21 -18.654 -8.732 4.194 1.00 0.43 H new ATOM 0 HA3 GLY B 21 -17.809 -8.922 5.718 1.00 0.43 H new ATOM 1958 N LYS B 22 -19.932 -6.466 5.577 1.00 0.41 N ATOM 1959 CA LYS B 22 -21.107 -5.878 6.184 1.00 0.46 C ATOM 1960 C LYS B 22 -22.249 -5.808 5.180 1.00 0.52 C ATOM 1961 O LYS B 22 -23.409 -6.039 5.525 1.00 0.65 O ATOM 1962 CB LYS B 22 -20.801 -4.485 6.697 1.00 0.47 C ATOM 1963 CG LYS B 22 -19.668 -4.427 7.701 1.00 0.60 C ATOM 1964 CD LYS B 22 -19.545 -3.035 8.290 1.00 0.57 C ATOM 1965 CE LYS B 22 -19.255 -1.991 7.221 1.00 0.49 C ATOM 1966 NZ LYS B 22 -19.541 -0.621 7.707 1.00 1.08 N ATOM 0 H LYS B 22 -19.429 -5.842 4.946 1.00 0.41 H new ATOM 0 HA LYS B 22 -21.405 -6.510 7.021 1.00 0.46 H new ATOM 0 HB2 LYS B 22 -20.554 -3.844 5.850 1.00 0.47 H new ATOM 0 HB3 LYS B 22 -21.700 -4.074 7.156 1.00 0.47 H new ATOM 0 HG2 LYS B 22 -19.844 -5.150 8.497 1.00 0.60 H new ATOM 0 HG3 LYS B 22 -18.732 -4.707 7.217 1.00 0.60 H new ATOM 0 HD2 LYS B 22 -20.468 -2.777 8.808 1.00 0.57 H new ATOM 0 HD3 LYS B 22 -18.748 -3.024 9.034 1.00 0.57 H new ATOM 0 HE2 LYS B 22 -18.210 -2.060 6.918 1.00 0.49 H new ATOM 0 HE3 LYS B 22 -19.858 -2.197 6.337 1.00 0.49 H new ATOM 0 HZ1 LYS B 22 -20.205 -0.154 7.057 1.00 1.08 H new ATOM 0 HZ2 LYS B 22 -19.963 -0.670 8.656 1.00 1.08 H new ATOM 0 HZ3 LYS B 22 -18.656 -0.076 7.749 1.00 1.08 H new ATOM 1980 N GLU B 23 -21.914 -5.500 3.934 1.00 0.47 N ATOM 1981 CA GLU B 23 -22.912 -5.339 2.888 1.00 0.54 C ATOM 1982 C GLU B 23 -22.297 -5.669 1.530 1.00 0.58 C ATOM 1983 O GLU B 23 -21.080 -5.604 1.371 1.00 0.64 O ATOM 1984 CB GLU B 23 -23.451 -3.903 2.906 1.00 0.67 C ATOM 1985 CG GLU B 23 -24.567 -3.641 1.910 1.00 1.15 C ATOM 1986 CD GLU B 23 -25.736 -4.583 2.096 1.00 1.60 C ATOM 1987 OE1 GLU B 23 -25.690 -5.706 1.554 1.00 1.96 O ATOM 1988 OE2 GLU B 23 -26.704 -4.212 2.788 1.00 2.38 O ATOM 0 H GLU B 23 -20.953 -5.356 3.623 1.00 0.47 H new ATOM 0 HA GLU B 23 -23.741 -6.024 3.066 1.00 0.54 H new ATOM 0 HB2 GLU B 23 -23.814 -3.676 3.908 1.00 0.67 H new ATOM 0 HB3 GLU B 23 -22.629 -3.217 2.702 1.00 0.67 H new ATOM 0 HG2 GLU B 23 -24.912 -2.612 2.016 1.00 1.15 H new ATOM 0 HG3 GLU B 23 -24.178 -3.744 0.897 1.00 1.15 H new ATOM 1995 N GLY B 24 -23.136 -6.026 0.566 1.00 0.72 N ATOM 1996 CA GLY B 24 -22.652 -6.376 -0.755 1.00 0.85 C ATOM 1997 C GLY B 24 -21.969 -7.724 -0.758 1.00 0.79 C ATOM 1998 O GLY B 24 -22.599 -8.744 -0.471 1.00 0.92 O ATOM 0 H GLY B 24 -24.149 -6.079 0.677 1.00 0.72 H new ATOM 0 HA2 GLY B 24 -23.486 -6.388 -1.457 1.00 0.85 H new ATOM 0 HA3 GLY B 24 -21.955 -5.613 -1.102 1.00 0.85 H new ATOM 2002 N ASP B 25 -20.685 -7.735 -1.078 1.00 0.71 N ATOM 2003 CA ASP B 25 -19.895 -8.953 -0.977 1.00 0.70 C ATOM 2004 C ASP B 25 -19.217 -9.004 0.374 1.00 0.73 C ATOM 2005 O ASP B 25 -19.461 -8.170 1.235 1.00 1.34 O ATOM 2006 CB ASP B 25 -18.810 -9.035 -2.056 1.00 0.72 C ATOM 2007 CG ASP B 25 -19.360 -9.088 -3.466 1.00 1.04 C ATOM 2008 OD1 ASP B 25 -20.305 -9.869 -3.719 1.00 1.64 O ATOM 2009 OD2 ASP B 25 -18.827 -8.380 -4.340 1.00 1.75 O ATOM 0 H ASP B 25 -20.169 -6.919 -1.408 1.00 0.71 H new ATOM 0 HA ASP B 25 -20.580 -9.790 -1.111 1.00 0.70 H new ATOM 0 HB2 ASP B 25 -18.152 -8.171 -1.964 1.00 0.72 H new ATOM 0 HB3 ASP B 25 -18.200 -9.921 -1.879 1.00 0.72 H new ATOM 2014 N LYS B 26 -18.371 -9.991 0.552 1.00 0.61 N ATOM 2015 CA LYS B 26 -17.544 -10.091 1.733 1.00 0.56 C ATOM 2016 C LYS B 26 -16.124 -9.655 1.389 1.00 0.49 C ATOM 2017 O LYS B 26 -15.254 -9.520 2.254 1.00 0.55 O ATOM 2018 CB LYS B 26 -17.570 -11.536 2.227 1.00 0.71 C ATOM 2019 CG LYS B 26 -16.562 -11.843 3.310 1.00 1.03 C ATOM 2020 CD LYS B 26 -16.919 -11.169 4.624 1.00 0.70 C ATOM 2021 CE LYS B 26 -16.267 -11.871 5.804 1.00 0.94 C ATOM 2022 NZ LYS B 26 -14.782 -11.840 5.730 1.00 1.56 N ATOM 0 H LYS B 26 -18.236 -10.748 -0.118 1.00 0.61 H new ATOM 0 HA LYS B 26 -17.920 -9.442 2.524 1.00 0.56 H new ATOM 0 HB2 LYS B 26 -18.568 -11.761 2.602 1.00 0.71 H new ATOM 0 HB3 LYS B 26 -17.390 -12.200 1.381 1.00 0.71 H new ATOM 0 HG2 LYS B 26 -16.506 -12.921 3.459 1.00 1.03 H new ATOM 0 HG3 LYS B 26 -15.574 -11.514 2.990 1.00 1.03 H new ATOM 0 HD2 LYS B 26 -16.601 -10.127 4.598 1.00 0.70 H new ATOM 0 HD3 LYS B 26 -18.001 -11.169 4.752 1.00 0.70 H new ATOM 0 HE2 LYS B 26 -16.592 -11.397 6.730 1.00 0.94 H new ATOM 0 HE3 LYS B 26 -16.605 -12.907 5.840 1.00 0.94 H new ATOM 0 HZ1 LYS B 26 -14.415 -12.813 5.703 1.00 1.56 H new ATOM 0 HZ2 LYS B 26 -14.488 -11.335 4.870 1.00 1.56 H new ATOM 0 HZ3 LYS B 26 -14.403 -11.351 6.566 1.00 1.56 H new ATOM 2036 N PHE B 27 -15.914 -9.382 0.112 1.00 0.45 N ATOM 2037 CA PHE B 27 -14.583 -9.170 -0.413 1.00 0.43 C ATOM 2038 C PHE B 27 -14.510 -7.825 -1.111 1.00 0.39 C ATOM 2039 O PHE B 27 -13.524 -7.522 -1.783 1.00 0.40 O ATOM 2040 CB PHE B 27 -14.223 -10.284 -1.405 1.00 0.49 C ATOM 2041 CG PHE B 27 -14.567 -11.667 -0.922 1.00 0.77 C ATOM 2042 CD1 PHE B 27 -13.750 -12.334 -0.024 1.00 1.76 C ATOM 2043 CD2 PHE B 27 -15.717 -12.299 -1.370 1.00 1.28 C ATOM 2044 CE1 PHE B 27 -14.073 -13.603 0.417 1.00 2.08 C ATOM 2045 CE2 PHE B 27 -16.044 -13.567 -0.933 1.00 1.59 C ATOM 2046 CZ PHE B 27 -15.221 -14.219 -0.037 1.00 1.65 C ATOM 0 H PHE B 27 -16.657 -9.302 -0.582 1.00 0.45 H new ATOM 0 HA PHE B 27 -13.874 -9.186 0.414 1.00 0.43 H new ATOM 0 HB2 PHE B 27 -14.741 -10.100 -2.346 1.00 0.49 H new ATOM 0 HB3 PHE B 27 -13.154 -10.239 -1.615 1.00 0.49 H new ATOM 0 HD1 PHE B 27 -12.850 -11.857 0.336 1.00 1.76 H new ATOM 0 HD2 PHE B 27 -16.365 -11.793 -2.070 1.00 1.28 H new ATOM 0 HE1 PHE B 27 -13.427 -14.112 1.117 1.00 2.08 H new ATOM 0 HE2 PHE B 27 -16.942 -14.048 -1.292 1.00 1.59 H new ATOM 0 HZ PHE B 27 -15.475 -15.210 0.308 1.00 1.65 H new ATOM 2056 N LYS B 28 -15.554 -7.023 -0.943 1.00 0.38 N ATOM 2057 CA LYS B 28 -15.651 -5.745 -1.628 1.00 0.36 C ATOM 2058 C LYS B 28 -16.476 -4.741 -0.846 1.00 0.34 C ATOM 2059 O LYS B 28 -17.505 -5.070 -0.253 1.00 0.37 O ATOM 2060 CB LYS B 28 -16.220 -5.893 -3.040 1.00 0.40 C ATOM 2061 CG LYS B 28 -15.201 -6.373 -4.056 1.00 0.49 C ATOM 2062 CD LYS B 28 -15.700 -6.201 -5.481 1.00 0.56 C ATOM 2063 CE LYS B 28 -14.622 -6.528 -6.510 1.00 0.86 C ATOM 2064 NZ LYS B 28 -13.645 -5.409 -6.681 1.00 1.70 N ATOM 0 H LYS B 28 -16.346 -7.238 -0.337 1.00 0.38 H new ATOM 0 HA LYS B 28 -14.631 -5.368 -1.705 1.00 0.36 H new ATOM 0 HB2 LYS B 28 -17.054 -6.594 -3.015 1.00 0.40 H new ATOM 0 HB3 LYS B 28 -16.620 -4.932 -3.364 1.00 0.40 H new ATOM 0 HG2 LYS B 28 -14.271 -5.819 -3.927 1.00 0.49 H new ATOM 0 HG3 LYS B 28 -14.974 -7.424 -3.875 1.00 0.49 H new ATOM 0 HD2 LYS B 28 -16.563 -6.847 -5.643 1.00 0.56 H new ATOM 0 HD3 LYS B 28 -16.038 -5.175 -5.625 1.00 0.56 H new ATOM 0 HE2 LYS B 28 -14.090 -7.428 -6.203 1.00 0.86 H new ATOM 0 HE3 LYS B 28 -15.092 -6.747 -7.469 1.00 0.86 H new ATOM 0 HZ1 LYS B 28 -13.227 -5.456 -7.632 1.00 1.70 H new ATOM 0 HZ2 LYS B 28 -14.135 -4.499 -6.562 1.00 1.70 H new ATOM 0 HZ3 LYS B 28 -12.893 -5.493 -5.968 1.00 1.70 H new ATOM 2078 N LEU B 29 -15.991 -3.516 -0.861 1.00 0.31 N ATOM 2079 CA LEU B 29 -16.647 -2.400 -0.220 1.00 0.28 C ATOM 2080 C LEU B 29 -17.515 -1.658 -1.212 1.00 0.30 C ATOM 2081 O LEU B 29 -17.018 -0.979 -2.109 1.00 0.33 O ATOM 2082 CB LEU B 29 -15.620 -1.420 0.340 1.00 0.26 C ATOM 2083 CG LEU B 29 -14.747 -1.942 1.464 1.00 0.26 C ATOM 2084 CD1 LEU B 29 -13.510 -1.078 1.581 1.00 0.28 C ATOM 2085 CD2 LEU B 29 -15.520 -1.937 2.770 1.00 0.25 C ATOM 0 H LEU B 29 -15.118 -3.267 -1.326 1.00 0.31 H new ATOM 0 HA LEU B 29 -17.259 -2.798 0.590 1.00 0.28 H new ATOM 0 HB2 LEU B 29 -14.973 -1.097 -0.476 1.00 0.26 H new ATOM 0 HB3 LEU B 29 -16.148 -0.536 0.697 1.00 0.26 H new ATOM 0 HG LEU B 29 -14.448 -2.967 1.245 1.00 0.26 H new ATOM 0 HD11 LEU B 29 -12.880 -1.451 2.389 1.00 0.28 H new ATOM 0 HD12 LEU B 29 -12.954 -1.109 0.644 1.00 0.28 H new ATOM 0 HD13 LEU B 29 -13.803 -0.050 1.795 1.00 0.28 H new ATOM 0 HD21 LEU B 29 -14.884 -2.314 3.571 1.00 0.25 H new ATOM 0 HD22 LEU B 29 -15.833 -0.919 3.004 1.00 0.25 H new ATOM 0 HD23 LEU B 29 -16.399 -2.574 2.675 1.00 0.25 H new ATOM 2097 N ASN B 30 -18.806 -1.792 -1.039 1.00 0.31 N ATOM 2098 CA ASN B 30 -19.764 -0.979 -1.752 1.00 0.35 C ATOM 2099 C ASN B 30 -19.701 0.420 -1.178 1.00 0.32 C ATOM 2100 O ASN B 30 -19.104 0.613 -0.122 1.00 0.30 O ATOM 2101 CB ASN B 30 -21.156 -1.584 -1.599 1.00 0.41 C ATOM 2102 CG ASN B 30 -21.452 -1.932 -0.157 1.00 0.43 C ATOM 2103 OD1 ASN B 30 -22.121 -1.181 0.552 1.00 0.55 O ATOM 2104 ND2 ASN B 30 -20.902 -3.052 0.301 1.00 0.42 N ATOM 0 H ASN B 30 -19.225 -2.468 -0.400 1.00 0.31 H new ATOM 0 HA ASN B 30 -19.537 -0.941 -2.817 1.00 0.35 H new ATOM 0 HB2 ASN B 30 -21.903 -0.879 -1.965 1.00 0.41 H new ATOM 0 HB3 ASN B 30 -21.234 -2.480 -2.214 1.00 0.41 H new ATOM 0 HD21 ASN B 30 -21.027 -3.319 1.277 1.00 0.42 H new ATOM 0 HD22 ASN B 30 -20.355 -3.644 -0.324 1.00 0.42 H new ATOM 2111 N LYS B 31 -20.298 1.387 -1.854 1.00 0.35 N ATOM 2112 CA LYS B 31 -20.129 2.790 -1.479 1.00 0.34 C ATOM 2113 C LYS B 31 -20.421 3.012 -0.003 1.00 0.31 C ATOM 2114 O LYS B 31 -19.702 3.737 0.681 1.00 0.30 O ATOM 2115 CB LYS B 31 -21.053 3.705 -2.269 1.00 0.41 C ATOM 2116 CG LYS B 31 -20.800 3.764 -3.758 1.00 0.68 C ATOM 2117 CD LYS B 31 -21.550 4.934 -4.371 1.00 0.71 C ATOM 2118 CE LYS B 31 -21.591 4.840 -5.882 1.00 1.15 C ATOM 2119 NZ LYS B 31 -22.431 3.702 -6.345 1.00 1.99 N ATOM 0 H LYS B 31 -20.902 1.233 -2.662 1.00 0.35 H new ATOM 0 HA LYS B 31 -19.089 3.031 -1.700 1.00 0.34 H new ATOM 0 HB2 LYS B 31 -22.081 3.381 -2.106 1.00 0.41 H new ATOM 0 HB3 LYS B 31 -20.969 4.714 -1.864 1.00 0.41 H new ATOM 0 HG2 LYS B 31 -19.732 3.867 -3.949 1.00 0.68 H new ATOM 0 HG3 LYS B 31 -21.119 2.833 -4.226 1.00 0.68 H new ATOM 0 HD2 LYS B 31 -22.567 4.960 -3.980 1.00 0.71 H new ATOM 0 HD3 LYS B 31 -21.071 5.868 -4.077 1.00 0.71 H new ATOM 0 HE2 LYS B 31 -21.982 5.771 -6.293 1.00 1.15 H new ATOM 0 HE3 LYS B 31 -20.578 4.723 -6.266 1.00 1.15 H new ATOM 0 HZ1 LYS B 31 -21.920 3.169 -7.077 1.00 1.99 H new ATOM 0 HZ2 LYS B 31 -22.639 3.075 -5.542 1.00 1.99 H new ATOM 0 HZ3 LYS B 31 -23.322 4.066 -6.740 1.00 1.99 H new ATOM 2133 N SER B 32 -21.482 2.380 0.469 1.00 0.34 N ATOM 2134 CA SER B 32 -21.940 2.553 1.835 1.00 0.37 C ATOM 2135 C SER B 32 -20.867 2.110 2.824 1.00 0.34 C ATOM 2136 O SER B 32 -20.484 2.864 3.728 1.00 0.37 O ATOM 2137 CB SER B 32 -23.230 1.757 2.034 1.00 0.45 C ATOM 2138 OG SER B 32 -24.164 2.045 1.003 1.00 1.33 O ATOM 0 H SER B 32 -22.048 1.735 -0.082 1.00 0.34 H new ATOM 0 HA SER B 32 -22.139 3.609 2.020 1.00 0.37 H new ATOM 0 HB2 SER B 32 -23.007 0.690 2.041 1.00 0.45 H new ATOM 0 HB3 SER B 32 -23.666 1.998 3.004 1.00 0.45 H new ATOM 0 HG SER B 32 -24.982 1.525 1.148 1.00 1.33 H new ATOM 2144 N GLU B 33 -20.355 0.902 2.633 1.00 0.32 N ATOM 2145 CA GLU B 33 -19.349 0.363 3.523 1.00 0.34 C ATOM 2146 C GLU B 33 -18.012 1.057 3.292 1.00 0.30 C ATOM 2147 O GLU B 33 -17.242 1.263 4.234 1.00 0.32 O ATOM 2148 CB GLU B 33 -19.205 -1.141 3.317 1.00 0.44 C ATOM 2149 CG GLU B 33 -20.507 -1.926 3.448 1.00 0.59 C ATOM 2150 CD GLU B 33 -21.553 -1.273 4.339 1.00 1.49 C ATOM 2151 OE1 GLU B 33 -21.473 -1.430 5.566 1.00 2.15 O ATOM 2152 OE2 GLU B 33 -22.476 -0.626 3.808 1.00 2.32 O ATOM 0 H GLU B 33 -20.623 0.281 1.869 1.00 0.32 H new ATOM 0 HA GLU B 33 -19.664 0.544 4.551 1.00 0.34 H new ATOM 0 HB2 GLU B 33 -18.785 -1.321 2.327 1.00 0.44 H new ATOM 0 HB3 GLU B 33 -18.488 -1.527 4.042 1.00 0.44 H new ATOM 0 HG2 GLU B 33 -20.932 -2.067 2.454 1.00 0.59 H new ATOM 0 HG3 GLU B 33 -20.281 -2.917 3.842 1.00 0.59 H new ATOM 2159 N LEU B 34 -17.743 1.415 2.033 1.00 0.30 N ATOM 2160 CA LEU B 34 -16.551 2.165 1.680 1.00 0.33 C ATOM 2161 C LEU B 34 -16.503 3.466 2.461 1.00 0.29 C ATOM 2162 O LEU B 34 -15.480 3.807 3.036 1.00 0.30 O ATOM 2163 CB LEU B 34 -16.535 2.478 0.185 1.00 0.50 C ATOM 2164 CG LEU B 34 -15.296 3.232 -0.295 1.00 0.50 C ATOM 2165 CD1 LEU B 34 -14.124 2.275 -0.398 1.00 1.01 C ATOM 2166 CD2 LEU B 34 -15.559 3.923 -1.624 1.00 0.54 C ATOM 0 H LEU B 34 -18.345 1.191 1.241 1.00 0.30 H new ATOM 0 HA LEU B 34 -15.681 1.556 1.927 1.00 0.33 H new ATOM 0 HB2 LEU B 34 -16.612 1.543 -0.369 1.00 0.50 H new ATOM 0 HB3 LEU B 34 -17.419 3.067 -0.059 1.00 0.50 H new ATOM 0 HG LEU B 34 -15.052 4.007 0.431 1.00 0.50 H new ATOM 0 HD11 LEU B 34 -13.242 2.816 -0.741 1.00 1.01 H new ATOM 0 HD12 LEU B 34 -13.924 1.838 0.580 1.00 1.01 H new ATOM 0 HD13 LEU B 34 -14.362 1.483 -1.108 1.00 1.01 H new ATOM 0 HD21 LEU B 34 -14.661 4.452 -1.943 1.00 0.54 H new ATOM 0 HD22 LEU B 34 -15.827 3.179 -2.374 1.00 0.54 H new ATOM 0 HD23 LEU B 34 -16.377 4.634 -1.509 1.00 0.54 H new ATOM 2178 N LYS B 35 -17.622 4.188 2.460 1.00 0.28 N ATOM 2179 CA LYS B 35 -17.754 5.417 3.235 1.00 0.29 C ATOM 2180 C LYS B 35 -17.307 5.215 4.670 1.00 0.29 C ATOM 2181 O LYS B 35 -16.404 5.896 5.151 1.00 0.31 O ATOM 2182 CB LYS B 35 -19.199 5.905 3.243 1.00 0.32 C ATOM 2183 CG LYS B 35 -19.601 6.715 2.024 1.00 0.39 C ATOM 2184 CD LYS B 35 -21.085 7.020 2.048 1.00 0.51 C ATOM 2185 CE LYS B 35 -21.427 8.277 1.266 1.00 0.70 C ATOM 2186 NZ LYS B 35 -22.891 8.548 1.296 1.00 1.29 N ATOM 0 H LYS B 35 -18.455 3.939 1.927 1.00 0.28 H new ATOM 0 HA LYS B 35 -17.116 6.161 2.758 1.00 0.29 H new ATOM 0 HB2 LYS B 35 -19.859 5.042 3.323 1.00 0.32 H new ATOM 0 HB3 LYS B 35 -19.359 6.512 4.134 1.00 0.32 H new ATOM 0 HG2 LYS B 35 -19.034 7.646 1.997 1.00 0.39 H new ATOM 0 HG3 LYS B 35 -19.353 6.164 1.117 1.00 0.39 H new ATOM 0 HD2 LYS B 35 -21.634 6.175 1.632 1.00 0.51 H new ATOM 0 HD3 LYS B 35 -21.413 7.136 3.081 1.00 0.51 H new ATOM 0 HE2 LYS B 35 -20.888 9.127 1.685 1.00 0.70 H new ATOM 0 HE3 LYS B 35 -21.096 8.167 0.233 1.00 0.70 H new ATOM 0 HZ1 LYS B 35 -23.149 9.152 0.490 1.00 1.29 H new ATOM 0 HZ2 LYS B 35 -23.412 7.650 1.236 1.00 1.29 H new ATOM 0 HZ3 LYS B 35 -23.136 9.031 2.184 1.00 1.29 H new ATOM 2200 N GLU B 36 -17.944 4.273 5.350 1.00 0.29 N ATOM 2201 CA GLU B 36 -17.666 4.042 6.757 1.00 0.32 C ATOM 2202 C GLU B 36 -16.224 3.633 6.970 1.00 0.31 C ATOM 2203 O GLU B 36 -15.573 4.124 7.874 1.00 0.39 O ATOM 2204 CB GLU B 36 -18.597 2.984 7.321 1.00 0.36 C ATOM 2205 CG GLU B 36 -20.045 3.292 7.028 1.00 0.37 C ATOM 2206 CD GLU B 36 -20.995 2.344 7.719 1.00 0.51 C ATOM 2207 OE1 GLU B 36 -21.307 1.290 7.143 1.00 1.14 O ATOM 2208 OE2 GLU B 36 -21.424 2.644 8.851 1.00 1.31 O ATOM 0 H GLU B 36 -18.654 3.659 4.951 1.00 0.29 H new ATOM 0 HA GLU B 36 -17.837 4.979 7.286 1.00 0.32 H new ATOM 0 HB2 GLU B 36 -18.340 2.013 6.899 1.00 0.36 H new ATOM 0 HB3 GLU B 36 -18.453 2.911 8.399 1.00 0.36 H new ATOM 0 HG2 GLU B 36 -20.265 4.313 7.341 1.00 0.37 H new ATOM 0 HG3 GLU B 36 -20.211 3.246 5.952 1.00 0.37 H new ATOM 2215 N LEU B 37 -15.725 2.746 6.134 1.00 0.27 N ATOM 2216 CA LEU B 37 -14.342 2.324 6.240 1.00 0.26 C ATOM 2217 C LEU B 37 -13.402 3.510 6.029 1.00 0.27 C ATOM 2218 O LEU B 37 -12.487 3.726 6.802 1.00 0.31 O ATOM 2219 CB LEU B 37 -14.051 1.213 5.229 1.00 0.24 C ATOM 2220 CG LEU B 37 -12.632 0.644 5.275 1.00 0.31 C ATOM 2221 CD1 LEU B 37 -12.622 -0.819 4.877 1.00 0.29 C ATOM 2222 CD2 LEU B 37 -11.711 1.440 4.367 1.00 0.50 C ATOM 0 H LEU B 37 -16.251 2.306 5.379 1.00 0.27 H new ATOM 0 HA LEU B 37 -14.171 1.932 7.243 1.00 0.26 H new ATOM 0 HB2 LEU B 37 -14.757 0.399 5.395 1.00 0.24 H new ATOM 0 HB3 LEU B 37 -14.238 1.598 4.227 1.00 0.24 H new ATOM 0 HG LEU B 37 -12.270 0.723 6.300 1.00 0.31 H new ATOM 0 HD11 LEU B 37 -11.602 -1.200 4.918 1.00 0.29 H new ATOM 0 HD12 LEU B 37 -13.249 -1.387 5.564 1.00 0.29 H new ATOM 0 HD13 LEU B 37 -13.008 -0.923 3.863 1.00 0.29 H new ATOM 0 HD21 LEU B 37 -10.705 1.022 4.412 1.00 0.50 H new ATOM 0 HD22 LEU B 37 -12.079 1.391 3.342 1.00 0.50 H new ATOM 0 HD23 LEU B 37 -11.687 2.479 4.694 1.00 0.50 H new ATOM 2234 N LEU B 38 -13.642 4.282 4.991 1.00 0.27 N ATOM 2235 CA LEU B 38 -12.801 5.428 4.683 1.00 0.29 C ATOM 2236 C LEU B 38 -12.825 6.451 5.811 1.00 0.30 C ATOM 2237 O LEU B 38 -11.789 6.920 6.257 1.00 0.40 O ATOM 2238 CB LEU B 38 -13.259 6.070 3.376 1.00 0.31 C ATOM 2239 CG LEU B 38 -12.411 5.744 2.147 1.00 0.34 C ATOM 2240 CD1 LEU B 38 -11.048 6.398 2.261 1.00 0.31 C ATOM 2241 CD2 LEU B 38 -12.262 4.243 1.972 1.00 0.43 C ATOM 0 H LEU B 38 -14.415 4.139 4.341 1.00 0.27 H new ATOM 0 HA LEU B 38 -11.774 5.079 4.573 1.00 0.29 H new ATOM 0 HB2 LEU B 38 -14.285 5.760 3.180 1.00 0.31 H new ATOM 0 HB3 LEU B 38 -13.273 7.152 3.509 1.00 0.31 H new ATOM 0 HG LEU B 38 -12.920 6.140 1.268 1.00 0.34 H new ATOM 0 HD11 LEU B 38 -10.454 6.158 1.379 1.00 0.31 H new ATOM 0 HD12 LEU B 38 -11.168 7.479 2.334 1.00 0.31 H new ATOM 0 HD13 LEU B 38 -10.540 6.028 3.152 1.00 0.31 H new ATOM 0 HD21 LEU B 38 -11.654 4.038 1.091 1.00 0.43 H new ATOM 0 HD22 LEU B 38 -11.778 3.820 2.853 1.00 0.43 H new ATOM 0 HD23 LEU B 38 -13.246 3.792 1.847 1.00 0.43 H new ATOM 2253 N THR B 39 -14.014 6.792 6.262 1.00 0.31 N ATOM 2254 CA THR B 39 -14.184 7.743 7.351 1.00 0.33 C ATOM 2255 C THR B 39 -13.606 7.236 8.677 1.00 0.34 C ATOM 2256 O THR B 39 -13.058 8.012 9.465 1.00 0.38 O ATOM 2257 CB THR B 39 -15.674 8.059 7.558 1.00 0.33 C ATOM 2258 OG1 THR B 39 -16.401 6.853 7.823 1.00 0.32 O ATOM 2259 CG2 THR B 39 -16.262 8.725 6.329 1.00 0.34 C ATOM 0 H THR B 39 -14.889 6.422 5.889 1.00 0.31 H new ATOM 0 HA THR B 39 -13.636 8.640 7.061 1.00 0.33 H new ATOM 0 HB THR B 39 -15.757 8.738 8.407 1.00 0.33 H new ATOM 0 HG1 THR B 39 -16.517 6.351 6.989 1.00 0.32 H new ATOM 0 HG21 THR B 39 -17.317 8.938 6.500 1.00 0.34 H new ATOM 0 HG22 THR B 39 -15.731 9.656 6.131 1.00 0.34 H new ATOM 0 HG23 THR B 39 -16.161 8.060 5.471 1.00 0.34 H new ATOM 2267 N ARG B 40 -13.745 5.943 8.916 1.00 0.34 N ATOM 2268 CA ARG B 40 -13.424 5.348 10.212 1.00 0.36 C ATOM 2269 C ARG B 40 -12.023 4.749 10.271 1.00 0.40 C ATOM 2270 O ARG B 40 -11.339 4.855 11.288 1.00 0.48 O ATOM 2271 CB ARG B 40 -14.478 4.291 10.535 1.00 0.37 C ATOM 2272 CG ARG B 40 -15.781 4.892 11.017 1.00 0.63 C ATOM 2273 CD ARG B 40 -16.903 3.876 10.988 1.00 0.56 C ATOM 2274 NE ARG B 40 -18.206 4.497 11.203 1.00 1.16 N ATOM 2275 CZ ARG B 40 -19.307 3.821 11.516 1.00 1.51 C ATOM 2276 NH1 ARG B 40 -19.252 2.509 11.713 1.00 1.62 N ATOM 2277 NH2 ARG B 40 -20.463 4.457 11.645 1.00 2.31 N ATOM 0 H ARG B 40 -14.082 5.274 8.223 1.00 0.34 H new ATOM 0 HA ARG B 40 -13.435 6.143 10.958 1.00 0.36 H new ATOM 0 HB2 ARG B 40 -14.667 3.689 9.646 1.00 0.37 H new ATOM 0 HB3 ARG B 40 -14.089 3.618 11.299 1.00 0.37 H new ATOM 0 HG2 ARG B 40 -15.656 5.269 12.032 1.00 0.63 H new ATOM 0 HG3 ARG B 40 -16.044 5.744 10.391 1.00 0.63 H new ATOM 0 HD2 ARG B 40 -16.901 3.360 10.028 1.00 0.56 H new ATOM 0 HD3 ARG B 40 -16.729 3.122 11.755 1.00 0.56 H new ATOM 0 HE ARG B 40 -18.276 5.510 11.107 1.00 1.16 H new ATOM 0 HH11 ARG B 40 -18.363 2.017 11.624 1.00 1.62 H new ATOM 0 HH12 ARG B 40 -20.099 1.993 11.953 1.00 1.62 H new ATOM 0 HH21 ARG B 40 -20.508 5.466 11.504 1.00 2.31 H new ATOM 0 HH22 ARG B 40 -21.307 3.937 11.885 1.00 2.31 H new ATOM 2291 N GLU B 41 -11.601 4.120 9.193 1.00 0.40 N ATOM 2292 CA GLU B 41 -10.300 3.474 9.141 1.00 0.46 C ATOM 2293 C GLU B 41 -9.273 4.412 8.534 1.00 0.54 C ATOM 2294 O GLU B 41 -8.082 4.176 8.644 1.00 0.85 O ATOM 2295 CB GLU B 41 -10.379 2.198 8.302 1.00 0.52 C ATOM 2296 CG GLU B 41 -11.620 1.350 8.561 1.00 0.53 C ATOM 2297 CD GLU B 41 -11.801 0.966 10.013 1.00 0.51 C ATOM 2298 OE1 GLU B 41 -11.269 -0.081 10.433 1.00 1.30 O ATOM 2299 OE2 GLU B 41 -12.496 1.694 10.745 1.00 1.02 O ATOM 0 H GLU B 41 -12.144 4.041 8.333 1.00 0.40 H new ATOM 0 HA GLU B 41 -9.999 3.220 10.157 1.00 0.46 H new ATOM 0 HB2 GLU B 41 -10.353 2.469 7.247 1.00 0.52 H new ATOM 0 HB3 GLU B 41 -9.493 1.594 8.498 1.00 0.52 H new ATOM 0 HG2 GLU B 41 -12.501 1.899 8.227 1.00 0.53 H new ATOM 0 HG3 GLU B 41 -11.562 0.443 7.959 1.00 0.53 H new ATOM 2306 N LEU B 42 -9.745 5.467 7.883 1.00 0.40 N ATOM 2307 CA LEU B 42 -8.857 6.479 7.320 1.00 0.41 C ATOM 2308 C LEU B 42 -9.318 7.902 7.677 1.00 0.37 C ATOM 2309 O LEU B 42 -9.480 8.742 6.784 1.00 0.35 O ATOM 2310 CB LEU B 42 -8.793 6.315 5.799 1.00 0.44 C ATOM 2311 CG LEU B 42 -8.136 5.024 5.313 1.00 0.50 C ATOM 2312 CD1 LEU B 42 -8.399 4.804 3.838 1.00 0.65 C ATOM 2313 CD2 LEU B 42 -6.645 5.065 5.576 1.00 0.74 C ATOM 0 H LEU B 42 -10.738 5.645 7.731 1.00 0.40 H new ATOM 0 HA LEU B 42 -7.865 6.336 7.750 1.00 0.41 H new ATOM 0 HB2 LEU B 42 -9.807 6.360 5.401 1.00 0.44 H new ATOM 0 HB3 LEU B 42 -8.248 7.161 5.381 1.00 0.44 H new ATOM 0 HG LEU B 42 -8.572 4.192 5.865 1.00 0.50 H new ATOM 0 HD11 LEU B 42 -7.921 3.879 3.517 1.00 0.65 H new ATOM 0 HD12 LEU B 42 -9.473 4.736 3.666 1.00 0.65 H new ATOM 0 HD13 LEU B 42 -7.993 5.639 3.267 1.00 0.65 H new ATOM 0 HD21 LEU B 42 -6.188 4.140 5.225 1.00 0.74 H new ATOM 0 HD22 LEU B 42 -6.205 5.910 5.046 1.00 0.74 H new ATOM 0 HD23 LEU B 42 -6.467 5.175 6.646 1.00 0.74 H new ATOM 2325 N PRO B 43 -9.535 8.198 8.983 1.00 0.40 N ATOM 2326 CA PRO B 43 -9.994 9.512 9.443 1.00 0.43 C ATOM 2327 C PRO B 43 -9.224 10.683 8.867 1.00 0.45 C ATOM 2328 O PRO B 43 -9.812 11.704 8.539 1.00 0.49 O ATOM 2329 CB PRO B 43 -9.774 9.460 10.948 1.00 0.50 C ATOM 2330 CG PRO B 43 -9.919 8.028 11.295 1.00 0.48 C ATOM 2331 CD PRO B 43 -9.382 7.264 10.119 1.00 0.44 C ATOM 0 HA PRO B 43 -11.024 9.680 9.128 1.00 0.43 H new ATOM 0 HB2 PRO B 43 -8.787 9.836 11.218 1.00 0.50 H new ATOM 0 HB3 PRO B 43 -10.504 10.072 11.477 1.00 0.50 H new ATOM 0 HG2 PRO B 43 -9.365 7.788 12.203 1.00 0.48 H new ATOM 0 HG3 PRO B 43 -10.963 7.775 11.482 1.00 0.48 H new ATOM 0 HD2 PRO B 43 -8.339 6.984 10.268 1.00 0.44 H new ATOM 0 HD3 PRO B 43 -9.939 6.342 9.955 1.00 0.44 H new ATOM 2339 N SER B 44 -7.916 10.553 8.759 1.00 0.45 N ATOM 2340 CA SER B 44 -7.109 11.653 8.272 1.00 0.47 C ATOM 2341 C SER B 44 -7.298 11.841 6.772 1.00 0.44 C ATOM 2342 O SER B 44 -7.544 12.967 6.306 1.00 0.45 O ATOM 2343 CB SER B 44 -5.643 11.419 8.594 1.00 0.51 C ATOM 2344 OG SER B 44 -4.835 12.496 8.154 1.00 0.59 O ATOM 0 H SER B 44 -7.396 9.709 8.998 1.00 0.45 H new ATOM 0 HA SER B 44 -7.436 12.563 8.775 1.00 0.47 H new ATOM 0 HB2 SER B 44 -5.522 11.288 9.669 1.00 0.51 H new ATOM 0 HB3 SER B 44 -5.309 10.496 8.121 1.00 0.51 H new ATOM 0 HG SER B 44 -3.898 12.315 8.378 1.00 0.59 H new ATOM 2350 N PHE B 45 -7.218 10.728 6.031 1.00 0.41 N ATOM 2351 CA PHE B 45 -7.267 10.766 4.574 1.00 0.41 C ATOM 2352 C PHE B 45 -8.443 11.595 4.090 1.00 0.41 C ATOM 2353 O PHE B 45 -8.267 12.613 3.419 1.00 0.46 O ATOM 2354 CB PHE B 45 -7.349 9.362 3.973 1.00 0.45 C ATOM 2355 CG PHE B 45 -7.230 9.390 2.474 1.00 1.06 C ATOM 2356 CD1 PHE B 45 -6.038 9.764 1.872 1.00 1.83 C ATOM 2357 CD2 PHE B 45 -8.308 9.070 1.669 1.00 1.81 C ATOM 2358 CE1 PHE B 45 -5.927 9.819 0.496 1.00 2.38 C ATOM 2359 CE2 PHE B 45 -8.202 9.119 0.292 1.00 2.37 C ATOM 2360 CZ PHE B 45 -7.010 9.495 -0.295 1.00 2.40 C ATOM 0 H PHE B 45 -7.119 9.791 6.423 1.00 0.41 H new ATOM 0 HA PHE B 45 -6.340 11.230 4.239 1.00 0.41 H new ATOM 0 HB2 PHE B 45 -6.556 8.741 4.389 1.00 0.45 H new ATOM 0 HB3 PHE B 45 -8.296 8.901 4.254 1.00 0.45 H new ATOM 0 HD1 PHE B 45 -5.186 10.015 2.486 1.00 1.83 H new ATOM 0 HD2 PHE B 45 -9.244 8.778 2.122 1.00 1.81 H new ATOM 0 HE1 PHE B 45 -4.994 10.115 0.040 1.00 2.38 H new ATOM 0 HE2 PHE B 45 -9.051 8.863 -0.325 1.00 2.37 H new ATOM 0 HZ PHE B 45 -6.926 9.535 -1.371 1.00 2.40 H new ATOM 2370 N LEU B 46 -9.639 11.168 4.442 1.00 0.45 N ATOM 2371 CA LEU B 46 -10.832 11.873 4.006 1.00 0.57 C ATOM 2372 C LEU B 46 -11.273 12.914 5.016 1.00 0.65 C ATOM 2373 O LEU B 46 -12.162 13.706 4.736 1.00 0.66 O ATOM 2374 CB LEU B 46 -11.974 10.919 3.710 1.00 0.67 C ATOM 2375 CG LEU B 46 -11.795 10.044 2.476 1.00 0.57 C ATOM 2376 CD1 LEU B 46 -13.090 9.328 2.194 1.00 0.71 C ATOM 2377 CD2 LEU B 46 -11.361 10.863 1.261 1.00 0.54 C ATOM 0 H LEU B 46 -9.812 10.347 5.022 1.00 0.45 H new ATOM 0 HA LEU B 46 -10.565 12.385 3.082 1.00 0.57 H new ATOM 0 HB2 LEU B 46 -12.117 10.272 4.575 1.00 0.67 H new ATOM 0 HB3 LEU B 46 -12.889 11.500 3.592 1.00 0.67 H new ATOM 0 HG LEU B 46 -11.004 9.320 2.672 1.00 0.57 H new ATOM 0 HD11 LEU B 46 -12.973 8.698 1.312 1.00 0.71 H new ATOM 0 HD12 LEU B 46 -13.357 8.708 3.050 1.00 0.71 H new ATOM 0 HD13 LEU B 46 -13.879 10.059 2.016 1.00 0.71 H new ATOM 0 HD21 LEU B 46 -11.244 10.204 0.401 1.00 0.54 H new ATOM 0 HD22 LEU B 46 -12.118 11.616 1.041 1.00 0.54 H new ATOM 0 HD23 LEU B 46 -10.411 11.354 1.474 1.00 0.54 H new ATOM 2389 N GLY B 47 -10.658 12.924 6.186 1.00 0.74 N ATOM 2390 CA GLY B 47 -10.944 13.971 7.151 1.00 0.90 C ATOM 2391 C GLY B 47 -10.674 15.327 6.550 1.00 0.89 C ATOM 2392 O GLY B 47 -11.271 16.334 6.934 1.00 0.99 O ATOM 0 H GLY B 47 -9.970 12.233 6.487 1.00 0.74 H new ATOM 0 HA2 GLY B 47 -11.985 13.907 7.468 1.00 0.90 H new ATOM 0 HA3 GLY B 47 -10.330 13.832 8.041 1.00 0.90 H new ATOM 2396 N LYS B 48 -9.766 15.338 5.590 1.00 0.79 N ATOM 2397 CA LYS B 48 -9.475 16.528 4.816 1.00 0.82 C ATOM 2398 C LYS B 48 -10.431 16.709 3.637 1.00 0.78 C ATOM 2399 O LYS B 48 -10.609 17.822 3.146 1.00 0.87 O ATOM 2400 CB LYS B 48 -8.060 16.445 4.285 1.00 0.81 C ATOM 2401 CG LYS B 48 -6.993 16.569 5.361 1.00 1.08 C ATOM 2402 CD LYS B 48 -5.604 16.263 4.824 1.00 1.51 C ATOM 2403 CE LYS B 48 -5.168 17.266 3.768 1.00 2.27 C ATOM 2404 NZ LYS B 48 -3.787 16.998 3.285 1.00 3.17 N ATOM 0 H LYS B 48 -9.212 14.523 5.327 1.00 0.79 H new ATOM 0 HA LYS B 48 -9.598 17.384 5.480 1.00 0.82 H new ATOM 0 HB2 LYS B 48 -7.931 15.495 3.767 1.00 0.81 H new ATOM 0 HB3 LYS B 48 -7.912 17.233 3.547 1.00 0.81 H new ATOM 0 HG2 LYS B 48 -7.008 17.578 5.772 1.00 1.08 H new ATOM 0 HG3 LYS B 48 -7.223 15.888 6.180 1.00 1.08 H new ATOM 0 HD2 LYS B 48 -4.888 16.268 5.646 1.00 1.51 H new ATOM 0 HD3 LYS B 48 -5.593 15.260 4.398 1.00 1.51 H new ATOM 0 HE2 LYS B 48 -5.860 17.231 2.927 1.00 2.27 H new ATOM 0 HE3 LYS B 48 -5.219 18.273 4.181 1.00 2.27 H new ATOM 0 HZ1 LYS B 48 -3.528 17.704 2.566 1.00 3.17 H new ATOM 0 HZ2 LYS B 48 -3.123 17.056 4.083 1.00 3.17 H new ATOM 0 HZ3 LYS B 48 -3.744 16.046 2.867 1.00 3.17 H new ATOM 2418 N ARG B 49 -11.039 15.623 3.180 1.00 0.73 N ATOM 2419 CA ARG B 49 -11.802 15.655 1.940 1.00 0.81 C ATOM 2420 C ARG B 49 -12.913 14.604 1.940 1.00 0.74 C ATOM 2421 O ARG B 49 -12.814 13.575 1.279 1.00 1.00 O ATOM 2422 CB ARG B 49 -10.840 15.447 0.759 1.00 0.95 C ATOM 2423 CG ARG B 49 -11.378 15.899 -0.592 1.00 1.17 C ATOM 2424 CD ARG B 49 -12.059 14.770 -1.347 1.00 1.01 C ATOM 2425 NE ARG B 49 -12.461 15.177 -2.691 1.00 1.61 N ATOM 2426 CZ ARG B 49 -12.353 14.401 -3.768 1.00 1.86 C ATOM 2427 NH1 ARG B 49 -11.829 13.184 -3.670 1.00 2.13 N ATOM 2428 NH2 ARG B 49 -12.760 14.848 -4.948 1.00 2.50 N ATOM 0 H ARG B 49 -11.019 14.715 3.645 1.00 0.73 H new ATOM 0 HA ARG B 49 -12.288 16.626 1.844 1.00 0.81 H new ATOM 0 HB2 ARG B 49 -9.914 15.985 0.964 1.00 0.95 H new ATOM 0 HB3 ARG B 49 -10.587 14.389 0.697 1.00 0.95 H new ATOM 0 HG2 ARG B 49 -12.087 16.714 -0.444 1.00 1.17 H new ATOM 0 HG3 ARG B 49 -10.559 16.294 -1.193 1.00 1.17 H new ATOM 0 HD2 ARG B 49 -11.383 13.918 -1.413 1.00 1.01 H new ATOM 0 HD3 ARG B 49 -12.936 14.439 -0.791 1.00 1.01 H new ATOM 0 HE ARG B 49 -12.848 16.113 -2.812 1.00 1.61 H new ATOM 0 HH11 ARG B 49 -11.507 12.839 -2.766 1.00 2.13 H new ATOM 0 HH12 ARG B 49 -11.749 12.595 -4.499 1.00 2.13 H new ATOM 0 HH21 ARG B 49 -13.155 15.785 -5.030 1.00 2.50 H new ATOM 0 HH22 ARG B 49 -12.678 14.255 -5.774 1.00 2.50 H new ATOM 2442 N THR B 50 -13.966 14.859 2.701 1.00 0.75 N ATOM 2443 CA THR B 50 -15.132 13.977 2.701 1.00 0.72 C ATOM 2444 C THR B 50 -16.264 14.567 1.883 1.00 0.82 C ATOM 2445 O THR B 50 -16.592 15.746 2.016 1.00 1.33 O ATOM 2446 CB THR B 50 -15.666 13.682 4.117 1.00 0.73 C ATOM 2447 OG1 THR B 50 -15.636 14.873 4.915 1.00 0.83 O ATOM 2448 CG2 THR B 50 -14.873 12.577 4.791 1.00 0.63 C ATOM 0 H THR B 50 -14.041 15.663 3.324 1.00 0.75 H new ATOM 0 HA THR B 50 -14.787 13.042 2.259 1.00 0.72 H new ATOM 0 HB THR B 50 -16.697 13.341 4.022 1.00 0.73 H new ATOM 0 HG1 THR B 50 -15.979 14.675 5.811 1.00 0.83 H new ATOM 0 HG21 THR B 50 -15.277 12.395 5.787 1.00 0.63 H new ATOM 0 HG22 THR B 50 -14.944 11.665 4.199 1.00 0.63 H new ATOM 0 HG23 THR B 50 -13.828 12.876 4.872 1.00 0.63 H new ATOM 2456 N ASP B 51 -16.843 13.738 1.032 1.00 0.57 N ATOM 2457 CA ASP B 51 -18.018 14.107 0.262 1.00 0.61 C ATOM 2458 C ASP B 51 -18.530 12.875 -0.457 1.00 0.58 C ATOM 2459 O ASP B 51 -17.739 12.016 -0.825 1.00 0.54 O ATOM 2460 CB ASP B 51 -17.694 15.209 -0.754 1.00 0.68 C ATOM 2461 CG ASP B 51 -18.938 15.777 -1.403 1.00 1.25 C ATOM 2462 OD1 ASP B 51 -19.581 16.663 -0.801 1.00 2.01 O ATOM 2463 OD2 ASP B 51 -19.280 15.343 -2.519 1.00 1.77 O ATOM 0 H ASP B 51 -16.512 12.790 0.855 1.00 0.57 H new ATOM 0 HA ASP B 51 -18.779 14.495 0.939 1.00 0.61 H new ATOM 0 HB2 ASP B 51 -17.149 16.011 -0.256 1.00 0.68 H new ATOM 0 HB3 ASP B 51 -17.036 14.807 -1.525 1.00 0.68 H new ATOM 2468 N GLU B 52 -19.832 12.771 -0.639 1.00 0.67 N ATOM 2469 CA GLU B 52 -20.409 11.617 -1.331 1.00 0.71 C ATOM 2470 C GLU B 52 -19.844 11.491 -2.735 1.00 0.66 C ATOM 2471 O GLU B 52 -19.549 10.390 -3.200 1.00 0.63 O ATOM 2472 CB GLU B 52 -21.927 11.711 -1.377 1.00 0.87 C ATOM 2473 CG GLU B 52 -22.541 11.746 0.002 1.00 0.95 C ATOM 2474 CD GLU B 52 -24.046 11.644 -0.019 1.00 1.31 C ATOM 2475 OE1 GLU B 52 -24.716 12.670 -0.267 1.00 1.90 O ATOM 2476 OE2 GLU B 52 -24.564 10.536 0.226 1.00 1.82 O ATOM 0 H GLU B 52 -20.513 13.462 -0.323 1.00 0.67 H new ATOM 0 HA GLU B 52 -20.139 10.723 -0.769 1.00 0.71 H new ATOM 0 HB2 GLU B 52 -22.217 12.608 -1.924 1.00 0.87 H new ATOM 0 HB3 GLU B 52 -22.325 10.859 -1.928 1.00 0.87 H new ATOM 0 HG2 GLU B 52 -22.135 10.926 0.595 1.00 0.95 H new ATOM 0 HG3 GLU B 52 -22.252 12.672 0.499 1.00 0.95 H new ATOM 2483 N ALA B 53 -19.671 12.624 -3.395 1.00 0.71 N ATOM 2484 CA ALA B 53 -19.053 12.643 -4.710 1.00 0.76 C ATOM 2485 C ALA B 53 -17.590 12.229 -4.603 1.00 0.66 C ATOM 2486 O ALA B 53 -17.056 11.564 -5.488 1.00 0.68 O ATOM 2487 CB ALA B 53 -19.180 14.016 -5.350 1.00 0.91 C ATOM 0 H ALA B 53 -19.949 13.540 -3.043 1.00 0.71 H new ATOM 0 HA ALA B 53 -19.573 11.930 -5.349 1.00 0.76 H new ATOM 0 HB1 ALA B 53 -18.710 14.004 -6.333 1.00 0.91 H new ATOM 0 HB2 ALA B 53 -20.234 14.272 -5.455 1.00 0.91 H new ATOM 0 HB3 ALA B 53 -18.687 14.758 -4.721 1.00 0.91 H new ATOM 2493 N ALA B 54 -16.955 12.598 -3.497 1.00 0.59 N ATOM 2494 CA ALA B 54 -15.574 12.222 -3.246 1.00 0.58 C ATOM 2495 C ALA B 54 -15.467 10.716 -3.071 1.00 0.48 C ATOM 2496 O ALA B 54 -14.550 10.092 -3.588 1.00 0.45 O ATOM 2497 CB ALA B 54 -15.035 12.940 -2.020 1.00 0.64 C ATOM 0 H ALA B 54 -17.379 13.160 -2.758 1.00 0.59 H new ATOM 0 HA ALA B 54 -14.972 12.520 -4.105 1.00 0.58 H new ATOM 0 HB1 ALA B 54 -14.000 12.644 -1.851 1.00 0.64 H new ATOM 0 HB2 ALA B 54 -15.083 14.017 -2.179 1.00 0.64 H new ATOM 0 HB3 ALA B 54 -15.635 12.675 -1.150 1.00 0.64 H new ATOM 2503 N PHE B 55 -16.420 10.142 -2.342 1.00 0.46 N ATOM 2504 CA PHE B 55 -16.496 8.696 -2.178 1.00 0.42 C ATOM 2505 C PHE B 55 -16.748 8.018 -3.513 1.00 0.44 C ATOM 2506 O PHE B 55 -16.130 7.010 -3.829 1.00 0.45 O ATOM 2507 CB PHE B 55 -17.607 8.314 -1.205 1.00 0.43 C ATOM 2508 CG PHE B 55 -17.286 8.612 0.230 1.00 1.06 C ATOM 2509 CD1 PHE B 55 -16.391 7.823 0.931 1.00 1.97 C ATOM 2510 CD2 PHE B 55 -17.884 9.677 0.880 1.00 1.87 C ATOM 2511 CE1 PHE B 55 -16.101 8.094 2.254 1.00 2.77 C ATOM 2512 CE2 PHE B 55 -17.597 9.953 2.200 1.00 2.69 C ATOM 2513 CZ PHE B 55 -16.705 9.161 2.888 1.00 2.95 C ATOM 0 H PHE B 55 -17.152 10.659 -1.855 1.00 0.46 H new ATOM 0 HA PHE B 55 -15.540 8.361 -1.776 1.00 0.42 H new ATOM 0 HB2 PHE B 55 -18.518 8.845 -1.482 1.00 0.43 H new ATOM 0 HB3 PHE B 55 -17.816 7.249 -1.307 1.00 0.43 H new ATOM 0 HD1 PHE B 55 -15.915 6.988 0.439 1.00 1.97 H new ATOM 0 HD2 PHE B 55 -18.585 10.301 0.346 1.00 1.87 H new ATOM 0 HE1 PHE B 55 -15.402 7.471 2.792 1.00 2.77 H new ATOM 0 HE2 PHE B 55 -18.071 10.789 2.693 1.00 2.69 H new ATOM 0 HZ PHE B 55 -16.478 9.374 3.922 1.00 2.95 H new ATOM 2523 N GLN B 56 -17.670 8.577 -4.283 1.00 0.48 N ATOM 2524 CA GLN B 56 -17.982 8.073 -5.614 1.00 0.54 C ATOM 2525 C GLN B 56 -16.741 8.067 -6.500 1.00 0.53 C ATOM 2526 O GLN B 56 -16.425 7.057 -7.131 1.00 0.56 O ATOM 2527 CB GLN B 56 -19.076 8.936 -6.244 1.00 0.62 C ATOM 2528 CG GLN B 56 -19.336 8.632 -7.708 1.00 0.76 C ATOM 2529 CD GLN B 56 -19.907 7.247 -7.936 1.00 0.97 C ATOM 2530 OE1 GLN B 56 -21.121 7.059 -7.921 1.00 1.69 O ATOM 2531 NE2 GLN B 56 -19.040 6.273 -8.159 1.00 0.87 N ATOM 0 H GLN B 56 -18.221 9.389 -4.005 1.00 0.48 H new ATOM 0 HA GLN B 56 -18.336 7.046 -5.524 1.00 0.54 H new ATOM 0 HB2 GLN B 56 -20.001 8.797 -5.685 1.00 0.62 H new ATOM 0 HB3 GLN B 56 -18.799 9.985 -6.145 1.00 0.62 H new ATOM 0 HG2 GLN B 56 -20.026 9.374 -8.110 1.00 0.76 H new ATOM 0 HG3 GLN B 56 -18.404 8.730 -8.264 1.00 0.76 H new ATOM 0 HE21 GLN B 56 -18.040 6.472 -8.163 1.00 0.87 H new ATOM 0 HE22 GLN B 56 -19.372 5.323 -8.327 1.00 0.87 H new ATOM 2540 N LYS B 57 -16.039 9.194 -6.541 1.00 0.51 N ATOM 2541 CA LYS B 57 -14.832 9.304 -7.344 1.00 0.51 C ATOM 2542 C LYS B 57 -13.744 8.389 -6.809 1.00 0.47 C ATOM 2543 O LYS B 57 -13.109 7.667 -7.574 1.00 0.47 O ATOM 2544 CB LYS B 57 -14.330 10.748 -7.398 1.00 0.55 C ATOM 2545 CG LYS B 57 -14.609 11.435 -8.727 1.00 0.76 C ATOM 2546 CD LYS B 57 -16.098 11.620 -8.973 1.00 1.00 C ATOM 2547 CE LYS B 57 -16.666 12.770 -8.156 1.00 0.86 C ATOM 2548 NZ LYS B 57 -16.062 14.074 -8.536 1.00 1.60 N ATOM 0 H LYS B 57 -16.286 10.041 -6.028 1.00 0.51 H new ATOM 0 HA LYS B 57 -15.082 8.994 -8.359 1.00 0.51 H new ATOM 0 HB2 LYS B 57 -14.800 11.318 -6.597 1.00 0.55 H new ATOM 0 HB3 LYS B 57 -13.256 10.759 -7.210 1.00 0.55 H new ATOM 0 HG2 LYS B 57 -14.116 12.407 -8.743 1.00 0.76 H new ATOM 0 HG3 LYS B 57 -14.179 10.846 -9.537 1.00 0.76 H new ATOM 0 HD2 LYS B 57 -16.271 11.807 -10.033 1.00 1.00 H new ATOM 0 HD3 LYS B 57 -16.625 10.700 -8.721 1.00 1.00 H new ATOM 0 HE2 LYS B 57 -17.746 12.816 -8.296 1.00 0.86 H new ATOM 0 HE3 LYS B 57 -16.490 12.584 -7.097 1.00 0.86 H new ATOM 0 HZ1 LYS B 57 -16.699 14.847 -8.256 1.00 1.60 H new ATOM 0 HZ2 LYS B 57 -15.148 14.187 -8.053 1.00 1.60 H new ATOM 0 HZ3 LYS B 57 -15.916 14.102 -9.565 1.00 1.60 H new ATOM 2562 N LEU B 58 -13.545 8.403 -5.494 1.00 0.45 N ATOM 2563 CA LEU B 58 -12.551 7.552 -4.863 1.00 0.43 C ATOM 2564 C LEU B 58 -12.827 6.100 -5.189 1.00 0.42 C ATOM 2565 O LEU B 58 -11.919 5.344 -5.511 1.00 0.41 O ATOM 2566 CB LEU B 58 -12.551 7.736 -3.350 1.00 0.43 C ATOM 2567 CG LEU B 58 -11.362 7.103 -2.639 1.00 0.39 C ATOM 2568 CD1 LEU B 58 -10.063 7.697 -3.156 1.00 0.39 C ATOM 2569 CD2 LEU B 58 -11.484 7.292 -1.141 1.00 0.40 C ATOM 0 H LEU B 58 -14.062 8.997 -4.846 1.00 0.45 H new ATOM 0 HA LEU B 58 -11.573 7.837 -5.250 1.00 0.43 H new ATOM 0 HB2 LEU B 58 -12.567 8.803 -3.126 1.00 0.43 H new ATOM 0 HB3 LEU B 58 -13.469 7.311 -2.945 1.00 0.43 H new ATOM 0 HG LEU B 58 -11.355 6.033 -2.848 1.00 0.39 H new ATOM 0 HD11 LEU B 58 -9.221 7.236 -2.640 1.00 0.39 H new ATOM 0 HD12 LEU B 58 -9.978 7.510 -4.227 1.00 0.39 H new ATOM 0 HD13 LEU B 58 -10.056 8.772 -2.973 1.00 0.39 H new ATOM 0 HD21 LEU B 58 -10.628 6.835 -0.646 1.00 0.40 H new ATOM 0 HD22 LEU B 58 -11.511 8.357 -0.910 1.00 0.40 H new ATOM 0 HD23 LEU B 58 -12.401 6.821 -0.788 1.00 0.40 H new ATOM 2581 N MET B 59 -14.092 5.728 -5.104 1.00 0.45 N ATOM 2582 CA MET B 59 -14.522 4.393 -5.459 1.00 0.48 C ATOM 2583 C MET B 59 -14.058 4.054 -6.859 1.00 0.48 C ATOM 2584 O MET B 59 -13.262 3.154 -7.036 1.00 0.48 O ATOM 2585 CB MET B 59 -16.042 4.284 -5.350 1.00 0.54 C ATOM 2586 CG MET B 59 -16.616 3.033 -5.987 1.00 0.57 C ATOM 2587 SD MET B 59 -18.178 2.541 -5.251 1.00 1.64 S ATOM 2588 CE MET B 59 -17.610 1.880 -3.689 1.00 2.39 C ATOM 0 H MET B 59 -14.844 6.341 -4.789 1.00 0.45 H new ATOM 0 HA MET B 59 -14.077 3.679 -4.766 1.00 0.48 H new ATOM 0 HB2 MET B 59 -16.323 4.306 -4.297 1.00 0.54 H new ATOM 0 HB3 MET B 59 -16.494 5.158 -5.819 1.00 0.54 H new ATOM 0 HG2 MET B 59 -16.759 3.205 -7.054 1.00 0.57 H new ATOM 0 HG3 MET B 59 -15.899 2.218 -5.889 1.00 0.57 H new ATOM 0 HE1 MET B 59 -18.202 1.003 -3.428 1.00 2.39 H new ATOM 0 HE2 MET B 59 -16.561 1.597 -3.774 1.00 2.39 H new ATOM 0 HE3 MET B 59 -17.720 2.636 -2.912 1.00 2.39 H new ATOM 2598 N SER B 60 -14.506 4.827 -7.832 1.00 0.49 N ATOM 2599 CA SER B 60 -14.130 4.614 -9.231 1.00 0.52 C ATOM 2600 C SER B 60 -12.606 4.668 -9.437 1.00 0.51 C ATOM 2601 O SER B 60 -12.087 4.132 -10.411 1.00 0.55 O ATOM 2602 CB SER B 60 -14.840 5.631 -10.126 1.00 0.55 C ATOM 2603 OG SER B 60 -14.755 6.940 -9.585 1.00 1.34 O ATOM 0 H SER B 60 -15.136 5.616 -7.684 1.00 0.49 H new ATOM 0 HA SER B 60 -14.450 3.610 -9.512 1.00 0.52 H new ATOM 0 HB2 SER B 60 -14.395 5.617 -11.121 1.00 0.55 H new ATOM 0 HB3 SER B 60 -15.887 5.350 -10.241 1.00 0.55 H new ATOM 0 HG SER B 60 -14.045 6.970 -8.910 1.00 1.34 H new ATOM 2609 N ASN B 61 -11.901 5.335 -8.529 1.00 0.48 N ATOM 2610 CA ASN B 61 -10.439 5.392 -8.571 1.00 0.50 C ATOM 2611 C ASN B 61 -9.849 4.026 -8.263 1.00 0.49 C ATOM 2612 O ASN B 61 -8.985 3.523 -8.984 1.00 0.56 O ATOM 2613 CB ASN B 61 -9.885 6.398 -7.549 1.00 0.49 C ATOM 2614 CG ASN B 61 -10.143 7.841 -7.923 1.00 0.58 C ATOM 2615 OD1 ASN B 61 -10.234 8.184 -9.101 1.00 0.79 O ATOM 2616 ND2 ASN B 61 -10.252 8.705 -6.923 1.00 0.57 N ATOM 0 H ASN B 61 -12.318 5.846 -7.751 1.00 0.48 H new ATOM 0 HA ASN B 61 -10.159 5.710 -9.575 1.00 0.50 H new ATOM 0 HB2 ASN B 61 -10.332 6.198 -6.575 1.00 0.49 H new ATOM 0 HB3 ASN B 61 -8.811 6.244 -7.445 1.00 0.49 H new ATOM 0 HD21 ASN B 61 -10.417 9.692 -7.118 1.00 0.57 H new ATOM 0 HD22 ASN B 61 -10.171 8.382 -5.959 1.00 0.57 H new ATOM 2623 N LEU B 62 -10.338 3.438 -7.185 1.00 0.44 N ATOM 2624 CA LEU B 62 -9.815 2.179 -6.674 1.00 0.43 C ATOM 2625 C LEU B 62 -10.472 1.019 -7.397 1.00 0.48 C ATOM 2626 O LEU B 62 -9.798 0.114 -7.886 1.00 0.55 O ATOM 2627 CB LEU B 62 -10.102 2.082 -5.176 1.00 0.38 C ATOM 2628 CG LEU B 62 -10.076 3.416 -4.428 1.00 0.34 C ATOM 2629 CD1 LEU B 62 -10.390 3.216 -2.954 1.00 0.31 C ATOM 2630 CD2 LEU B 62 -8.740 4.120 -4.621 1.00 0.35 C ATOM 0 H LEU B 62 -11.110 3.819 -6.637 1.00 0.44 H new ATOM 0 HA LEU B 62 -8.739 2.139 -6.841 1.00 0.43 H new ATOM 0 HB2 LEU B 62 -11.081 1.623 -5.037 1.00 0.38 H new ATOM 0 HB3 LEU B 62 -9.370 1.414 -4.723 1.00 0.38 H new ATOM 0 HG LEU B 62 -10.851 4.057 -4.847 1.00 0.34 H new ATOM 0 HD11 LEU B 62 -10.366 4.178 -2.443 1.00 0.31 H new ATOM 0 HD12 LEU B 62 -11.381 2.775 -2.850 1.00 0.31 H new ATOM 0 HD13 LEU B 62 -9.649 2.551 -2.511 1.00 0.31 H new ATOM 0 HD21 LEU B 62 -8.746 5.066 -4.080 1.00 0.35 H new ATOM 0 HD22 LEU B 62 -7.938 3.489 -4.240 1.00 0.35 H new ATOM 0 HD23 LEU B 62 -8.579 4.310 -5.682 1.00 0.35 H new ATOM 2642 N ASP B 63 -11.798 1.087 -7.445 1.00 0.48 N ATOM 2643 CA ASP B 63 -12.651 0.137 -8.150 1.00 0.53 C ATOM 2644 C ASP B 63 -12.276 0.101 -9.632 1.00 0.57 C ATOM 2645 O ASP B 63 -12.878 0.765 -10.471 1.00 0.62 O ATOM 2646 CB ASP B 63 -14.117 0.566 -7.923 1.00 0.56 C ATOM 2647 CG ASP B 63 -15.152 -0.136 -8.775 1.00 0.67 C ATOM 2648 OD1 ASP B 63 -15.328 -1.360 -8.638 1.00 1.24 O ATOM 2649 OD2 ASP B 63 -15.839 0.556 -9.554 1.00 1.34 O ATOM 0 H ASP B 63 -12.325 1.827 -6.981 1.00 0.48 H new ATOM 0 HA ASP B 63 -12.518 -0.876 -7.771 1.00 0.53 H new ATOM 0 HB2 ASP B 63 -14.365 0.401 -6.875 1.00 0.56 H new ATOM 0 HB3 ASP B 63 -14.193 1.638 -8.103 1.00 0.56 H new ATOM 2654 N SER B 64 -11.235 -0.661 -9.923 1.00 0.58 N ATOM 2655 CA SER B 64 -10.694 -0.779 -11.261 1.00 0.64 C ATOM 2656 C SER B 64 -11.547 -1.739 -12.065 1.00 0.65 C ATOM 2657 O SER B 64 -11.668 -1.626 -13.284 1.00 0.75 O ATOM 2658 CB SER B 64 -9.248 -1.270 -11.187 1.00 0.72 C ATOM 2659 OG SER B 64 -8.493 -0.482 -10.274 1.00 1.38 O ATOM 0 H SER B 64 -10.739 -1.219 -9.228 1.00 0.58 H new ATOM 0 HA SER B 64 -10.704 0.194 -11.753 1.00 0.64 H new ATOM 0 HB2 SER B 64 -9.229 -2.314 -10.875 1.00 0.72 H new ATOM 0 HB3 SER B 64 -8.793 -1.225 -12.176 1.00 0.72 H new ATOM 0 HG SER B 64 -8.954 -0.452 -9.410 1.00 1.38 H new ATOM 2665 N ASN B 65 -12.156 -2.676 -11.353 1.00 0.63 N ATOM 2666 CA ASN B 65 -13.092 -3.614 -11.949 1.00 0.72 C ATOM 2667 C ASN B 65 -14.372 -2.878 -12.360 1.00 0.69 C ATOM 2668 O ASN B 65 -15.164 -3.361 -13.170 1.00 0.77 O ATOM 2669 CB ASN B 65 -13.408 -4.740 -10.961 1.00 0.79 C ATOM 2670 CG ASN B 65 -14.404 -4.302 -9.916 1.00 1.01 C ATOM 2671 OD1 ASN B 65 -15.591 -4.578 -10.029 1.00 1.65 O ATOM 2672 ND2 ASN B 65 -13.935 -3.607 -8.900 1.00 1.16 N ATOM 0 H ASN B 65 -12.015 -2.806 -10.351 1.00 0.63 H new ATOM 0 HA ASN B 65 -12.643 -4.055 -12.839 1.00 0.72 H new ATOM 0 HB2 ASN B 65 -13.803 -5.599 -11.503 1.00 0.79 H new ATOM 0 HB3 ASN B 65 -12.489 -5.065 -10.474 1.00 0.79 H new ATOM 0 HD21 ASN B 65 -14.568 -3.278 -8.171 1.00 1.16 H new ATOM 0 HD22 ASN B 65 -12.938 -3.398 -8.842 1.00 1.16 H new ATOM 2679 N ARG B 66 -14.517 -1.678 -11.784 1.00 0.60 N ATOM 2680 CA ARG B 66 -15.592 -0.736 -12.073 1.00 0.60 C ATOM 2681 C ARG B 66 -16.977 -1.331 -11.887 1.00 0.60 C ATOM 2682 O ARG B 66 -17.839 -1.207 -12.759 1.00 0.69 O ATOM 2683 CB ARG B 66 -15.457 -0.177 -13.471 1.00 0.67 C ATOM 2684 CG ARG B 66 -14.158 0.571 -13.724 1.00 0.70 C ATOM 2685 CD ARG B 66 -14.089 1.905 -12.986 1.00 0.70 C ATOM 2686 NE ARG B 66 -13.141 2.804 -13.642 1.00 0.78 N ATOM 2687 CZ ARG B 66 -11.852 2.895 -13.325 1.00 1.20 C ATOM 2688 NH1 ARG B 66 -11.363 2.218 -12.294 1.00 2.23 N ATOM 2689 NH2 ARG B 66 -11.054 3.680 -14.031 1.00 1.15 N ATOM 0 H ARG B 66 -13.865 -1.330 -11.081 1.00 0.60 H new ATOM 0 HA ARG B 66 -15.489 0.069 -11.345 1.00 0.60 H new ATOM 0 HB2 ARG B 66 -15.536 -0.996 -14.186 1.00 0.67 H new ATOM 0 HB3 ARG B 66 -16.293 0.496 -13.663 1.00 0.67 H new ATOM 0 HG2 ARG B 66 -13.319 -0.053 -13.416 1.00 0.70 H new ATOM 0 HG3 ARG B 66 -14.048 0.747 -14.794 1.00 0.70 H new ATOM 0 HD2 ARG B 66 -15.077 2.365 -12.960 1.00 0.70 H new ATOM 0 HD3 ARG B 66 -13.787 1.740 -11.952 1.00 0.70 H new ATOM 0 HE ARG B 66 -13.491 3.401 -14.392 1.00 0.78 H new ATOM 0 HH11 ARG B 66 -11.976 1.622 -11.738 1.00 2.23 H new ATOM 0 HH12 ARG B 66 -10.374 2.293 -12.058 1.00 2.23 H new ATOM 0 HH21 ARG B 66 -11.428 4.213 -14.816 1.00 1.15 H new ATOM 0 HH22 ARG B 66 -10.065 3.752 -13.790 1.00 1.15 H new ATOM 2703 N ASP B 67 -17.198 -1.944 -10.741 1.00 0.58 N ATOM 2704 CA ASP B 67 -18.521 -2.449 -10.394 1.00 0.61 C ATOM 2705 C ASP B 67 -19.064 -1.630 -9.235 1.00 0.56 C ATOM 2706 O ASP B 67 -20.176 -1.856 -8.749 1.00 0.57 O ATOM 2707 CB ASP B 67 -18.470 -3.930 -10.018 1.00 0.69 C ATOM 2708 CG ASP B 67 -19.748 -4.661 -10.376 1.00 1.07 C ATOM 2709 OD1 ASP B 67 -19.909 -5.036 -11.558 1.00 1.72 O ATOM 2710 OD2 ASP B 67 -20.588 -4.893 -9.483 1.00 1.63 O ATOM 0 H ASP B 67 -16.483 -2.107 -10.032 1.00 0.58 H new ATOM 0 HA ASP B 67 -19.176 -2.355 -11.260 1.00 0.61 H new ATOM 0 HB2 ASP B 67 -17.630 -4.402 -10.527 1.00 0.69 H new ATOM 0 HB3 ASP B 67 -18.288 -4.024 -8.947 1.00 0.69 H new ATOM 2715 N ASN B 68 -18.250 -0.664 -8.813 1.00 0.53 N ATOM 2716 CA ASN B 68 -18.564 0.234 -7.708 1.00 0.51 C ATOM 2717 C ASN B 68 -18.578 -0.499 -6.378 1.00 0.46 C ATOM 2718 O ASN B 68 -19.402 -0.226 -5.505 1.00 0.47 O ATOM 2719 CB ASN B 68 -19.871 0.992 -7.950 1.00 0.58 C ATOM 2720 CG ASN B 68 -19.632 2.364 -8.560 1.00 0.73 C ATOM 2721 OD1 ASN B 68 -20.450 3.270 -8.408 1.00 1.08 O ATOM 2722 ND2 ASN B 68 -18.492 2.541 -9.219 1.00 0.66 N ATOM 0 H ASN B 68 -17.340 -0.482 -9.237 1.00 0.53 H new ATOM 0 HA ASN B 68 -17.767 0.976 -7.659 1.00 0.51 H new ATOM 0 HB2 ASN B 68 -20.511 0.408 -8.612 1.00 0.58 H new ATOM 0 HB3 ASN B 68 -20.405 1.103 -7.006 1.00 0.58 H new ATOM 0 HD21 ASN B 68 -18.271 3.453 -9.619 1.00 0.66 H new ATOM 0 HD22 ASN B 68 -17.838 1.765 -9.324 1.00 0.66 H new ATOM 2729 N GLU B 69 -17.656 -1.436 -6.244 1.00 0.46 N ATOM 2730 CA GLU B 69 -17.331 -2.034 -4.962 1.00 0.42 C ATOM 2731 C GLU B 69 -15.837 -2.326 -4.947 1.00 0.40 C ATOM 2732 O GLU B 69 -15.341 -3.116 -5.752 1.00 0.44 O ATOM 2733 CB GLU B 69 -18.109 -3.327 -4.695 1.00 0.46 C ATOM 2734 CG GLU B 69 -19.619 -3.196 -4.802 1.00 0.50 C ATOM 2735 CD GLU B 69 -20.349 -4.450 -4.359 1.00 0.64 C ATOM 2736 OE1 GLU B 69 -20.672 -4.566 -3.157 1.00 1.31 O ATOM 2737 OE2 GLU B 69 -20.619 -5.322 -5.213 1.00 1.29 O ATOM 0 H GLU B 69 -17.111 -1.804 -7.023 1.00 0.46 H new ATOM 0 HA GLU B 69 -17.612 -1.333 -4.176 1.00 0.42 H new ATOM 0 HB2 GLU B 69 -17.774 -4.088 -5.399 1.00 0.46 H new ATOM 0 HB3 GLU B 69 -17.859 -3.685 -3.696 1.00 0.46 H new ATOM 0 HG2 GLU B 69 -19.950 -2.354 -4.194 1.00 0.50 H new ATOM 0 HG3 GLU B 69 -19.888 -2.970 -5.834 1.00 0.50 H new ATOM 2744 N VAL B 70 -15.129 -1.681 -4.045 1.00 0.37 N ATOM 2745 CA VAL B 70 -13.669 -1.793 -3.990 1.00 0.36 C ATOM 2746 C VAL B 70 -13.240 -3.077 -3.292 1.00 0.35 C ATOM 2747 O VAL B 70 -13.667 -3.342 -2.183 1.00 0.36 O ATOM 2748 CB VAL B 70 -13.046 -0.600 -3.247 1.00 0.33 C ATOM 2749 CG1 VAL B 70 -11.564 -0.833 -3.017 1.00 0.33 C ATOM 2750 CG2 VAL B 70 -13.263 0.683 -4.023 1.00 0.36 C ATOM 0 H VAL B 70 -15.532 -1.070 -3.334 1.00 0.37 H new ATOM 0 HA VAL B 70 -13.316 -1.804 -5.021 1.00 0.36 H new ATOM 0 HB VAL B 70 -13.537 -0.505 -2.279 1.00 0.33 H new ATOM 0 HG11 VAL B 70 -11.139 0.021 -2.490 1.00 0.33 H new ATOM 0 HG12 VAL B 70 -11.426 -1.734 -2.419 1.00 0.33 H new ATOM 0 HG13 VAL B 70 -11.061 -0.954 -3.977 1.00 0.33 H new ATOM 0 HG21 VAL B 70 -12.815 1.516 -3.481 1.00 0.36 H new ATOM 0 HG22 VAL B 70 -12.798 0.597 -5.005 1.00 0.36 H new ATOM 0 HG23 VAL B 70 -14.332 0.860 -4.142 1.00 0.36 H new ATOM 2760 N ASP B 71 -12.385 -3.865 -3.927 1.00 0.37 N ATOM 2761 CA ASP B 71 -11.954 -5.127 -3.321 1.00 0.39 C ATOM 2762 C ASP B 71 -10.624 -4.973 -2.588 1.00 0.37 C ATOM 2763 O ASP B 71 -10.014 -3.907 -2.634 1.00 0.35 O ATOM 2764 CB ASP B 71 -11.891 -6.252 -4.354 1.00 0.45 C ATOM 2765 CG ASP B 71 -10.690 -6.216 -5.270 1.00 0.77 C ATOM 2766 OD1 ASP B 71 -9.571 -6.527 -4.817 1.00 1.35 O ATOM 2767 OD2 ASP B 71 -10.887 -5.929 -6.462 1.00 1.42 O ATOM 0 H ASP B 71 -11.980 -3.664 -4.842 1.00 0.37 H new ATOM 0 HA ASP B 71 -12.705 -5.402 -2.581 1.00 0.39 H new ATOM 0 HB2 ASP B 71 -11.899 -7.207 -3.829 1.00 0.45 H new ATOM 0 HB3 ASP B 71 -12.794 -6.216 -4.963 1.00 0.45 H new ATOM 2772 N PHE B 72 -10.199 -6.040 -1.887 1.00 0.41 N ATOM 2773 CA PHE B 72 -8.977 -6.009 -1.068 1.00 0.44 C ATOM 2774 C PHE B 72 -7.820 -5.406 -1.839 1.00 0.40 C ATOM 2775 O PHE B 72 -7.096 -4.547 -1.339 1.00 0.42 O ATOM 2776 CB PHE B 72 -8.535 -7.411 -0.651 1.00 0.54 C ATOM 2777 CG PHE B 72 -9.441 -8.159 0.279 1.00 0.94 C ATOM 2778 CD1 PHE B 72 -10.562 -8.813 -0.198 1.00 1.69 C ATOM 2779 CD2 PHE B 72 -9.139 -8.247 1.627 1.00 1.70 C ATOM 2780 CE1 PHE B 72 -11.369 -9.537 0.654 1.00 2.18 C ATOM 2781 CE2 PHE B 72 -9.946 -8.964 2.485 1.00 2.17 C ATOM 2782 CZ PHE B 72 -11.063 -9.613 1.996 1.00 2.15 C ATOM 0 H PHE B 72 -10.687 -6.936 -1.873 1.00 0.41 H new ATOM 0 HA PHE B 72 -9.223 -5.411 -0.191 1.00 0.44 H new ATOM 0 HB2 PHE B 72 -8.407 -8.009 -1.553 1.00 0.54 H new ATOM 0 HB3 PHE B 72 -7.555 -7.332 -0.179 1.00 0.54 H new ATOM 0 HD1 PHE B 72 -10.808 -8.756 -1.248 1.00 1.69 H new ATOM 0 HD2 PHE B 72 -8.261 -7.748 2.011 1.00 1.70 H new ATOM 0 HE1 PHE B 72 -12.241 -10.045 0.270 1.00 2.18 H new ATOM 0 HE2 PHE B 72 -9.705 -9.018 3.536 1.00 2.17 H new ATOM 0 HZ PHE B 72 -11.695 -10.179 2.664 1.00 2.15 H new ATOM 2792 N GLN B 73 -7.649 -5.886 -3.057 1.00 0.38 N ATOM 2793 CA GLN B 73 -6.542 -5.465 -3.898 1.00 0.37 C ATOM 2794 C GLN B 73 -6.667 -3.994 -4.248 1.00 0.36 C ATOM 2795 O GLN B 73 -5.719 -3.227 -4.098 1.00 0.36 O ATOM 2796 CB GLN B 73 -6.479 -6.313 -5.174 1.00 0.41 C ATOM 2797 CG GLN B 73 -5.288 -5.995 -6.062 1.00 0.50 C ATOM 2798 CD GLN B 73 -5.625 -5.101 -7.243 1.00 0.42 C ATOM 2799 OE1 GLN B 73 -5.859 -5.573 -8.353 1.00 0.62 O ATOM 2800 NE2 GLN B 73 -5.659 -3.803 -7.005 1.00 0.41 N ATOM 0 H GLN B 73 -8.267 -6.573 -3.489 1.00 0.38 H new ATOM 0 HA GLN B 73 -5.617 -5.611 -3.341 1.00 0.37 H new ATOM 0 HB2 GLN B 73 -6.443 -7.367 -4.898 1.00 0.41 H new ATOM 0 HB3 GLN B 73 -7.396 -6.164 -5.744 1.00 0.41 H new ATOM 0 HG2 GLN B 73 -4.517 -5.512 -5.461 1.00 0.50 H new ATOM 0 HG3 GLN B 73 -4.864 -6.928 -6.434 1.00 0.50 H new ATOM 0 HE21 GLN B 73 -5.458 -3.451 -6.069 1.00 0.41 H new ATOM 0 HE22 GLN B 73 -5.886 -3.152 -7.757 1.00 0.41 H new ATOM 2809 N GLU B 74 -7.835 -3.603 -4.717 1.00 0.37 N ATOM 2810 CA GLU B 74 -8.082 -2.221 -5.098 1.00 0.39 C ATOM 2811 C GLU B 74 -7.917 -1.299 -3.889 1.00 0.38 C ATOM 2812 O GLU B 74 -7.431 -0.175 -4.008 1.00 0.41 O ATOM 2813 CB GLU B 74 -9.486 -2.096 -5.684 1.00 0.44 C ATOM 2814 CG GLU B 74 -9.727 -3.028 -6.863 1.00 0.59 C ATOM 2815 CD GLU B 74 -11.164 -3.007 -7.346 1.00 1.40 C ATOM 2816 OE1 GLU B 74 -12.082 -3.063 -6.499 1.00 2.18 O ATOM 2817 OE2 GLU B 74 -11.381 -2.925 -8.576 1.00 2.04 O ATOM 0 H GLU B 74 -8.634 -4.224 -4.845 1.00 0.37 H new ATOM 0 HA GLU B 74 -7.356 -1.921 -5.854 1.00 0.39 H new ATOM 0 HB2 GLU B 74 -10.218 -2.309 -4.905 1.00 0.44 H new ATOM 0 HB3 GLU B 74 -9.650 -1.067 -6.003 1.00 0.44 H new ATOM 0 HG2 GLU B 74 -9.069 -2.745 -7.684 1.00 0.59 H new ATOM 0 HG3 GLU B 74 -9.460 -4.045 -6.576 1.00 0.59 H new ATOM 2824 N TYR B 75 -8.294 -1.807 -2.725 1.00 0.34 N ATOM 2825 CA TYR B 75 -8.204 -1.065 -1.478 1.00 0.36 C ATOM 2826 C TYR B 75 -6.750 -0.958 -1.002 1.00 0.34 C ATOM 2827 O TYR B 75 -6.331 0.072 -0.480 1.00 0.34 O ATOM 2828 CB TYR B 75 -9.059 -1.751 -0.412 1.00 0.43 C ATOM 2829 CG TYR B 75 -8.866 -1.191 0.980 1.00 0.86 C ATOM 2830 CD1 TYR B 75 -9.279 0.096 1.294 1.00 1.72 C ATOM 2831 CD2 TYR B 75 -8.266 -1.951 1.977 1.00 1.50 C ATOM 2832 CE1 TYR B 75 -9.101 0.610 2.563 1.00 2.09 C ATOM 2833 CE2 TYR B 75 -8.088 -1.443 3.249 1.00 1.86 C ATOM 2834 CZ TYR B 75 -8.506 -0.162 3.536 1.00 1.84 C ATOM 2835 OH TYR B 75 -8.324 0.348 4.801 1.00 2.33 O ATOM 0 H TYR B 75 -8.672 -2.748 -2.619 1.00 0.34 H new ATOM 0 HA TYR B 75 -8.576 -0.055 -1.648 1.00 0.36 H new ATOM 0 HB2 TYR B 75 -10.110 -1.659 -0.688 1.00 0.43 H new ATOM 0 HB3 TYR B 75 -8.824 -2.815 -0.401 1.00 0.43 H new ATOM 0 HD1 TYR B 75 -9.747 0.705 0.534 1.00 1.72 H new ATOM 0 HD2 TYR B 75 -7.934 -2.954 1.754 1.00 1.50 H new ATOM 0 HE1 TYR B 75 -9.427 1.614 2.792 1.00 2.09 H new ATOM 0 HE2 TYR B 75 -7.624 -2.047 4.015 1.00 1.86 H new ATOM 0 HH TYR B 75 -7.891 -0.326 5.366 1.00 2.33 H new ATOM 2845 N SER B 76 -5.983 -2.024 -1.180 1.00 0.35 N ATOM 2846 CA SER B 76 -4.585 -2.028 -0.770 1.00 0.36 C ATOM 2847 C SER B 76 -3.748 -1.171 -1.715 1.00 0.36 C ATOM 2848 O SER B 76 -2.823 -0.477 -1.289 1.00 0.41 O ATOM 2849 CB SER B 76 -4.049 -3.461 -0.705 1.00 0.41 C ATOM 2850 OG SER B 76 -4.410 -4.198 -1.854 1.00 1.21 O ATOM 0 H SER B 76 -6.303 -2.895 -1.604 1.00 0.35 H new ATOM 0 HA SER B 76 -4.514 -1.596 0.228 1.00 0.36 H new ATOM 0 HB2 SER B 76 -2.963 -3.441 -0.610 1.00 0.41 H new ATOM 0 HB3 SER B 76 -4.438 -3.957 0.184 1.00 0.41 H new ATOM 0 HG SER B 76 -4.731 -3.585 -2.548 1.00 1.21 H new ATOM 2856 N VAL B 77 -4.102 -1.203 -2.998 1.00 0.35 N ATOM 2857 CA VAL B 77 -3.468 -0.348 -3.993 1.00 0.36 C ATOM 2858 C VAL B 77 -3.823 1.102 -3.693 1.00 0.33 C ATOM 2859 O VAL B 77 -3.088 2.040 -4.003 1.00 0.32 O ATOM 2860 CB VAL B 77 -3.915 -0.711 -5.425 1.00 0.40 C ATOM 2861 CG1 VAL B 77 -3.403 0.308 -6.434 1.00 0.43 C ATOM 2862 CG2 VAL B 77 -3.422 -2.100 -5.786 1.00 0.43 C ATOM 0 H VAL B 77 -4.827 -1.815 -3.372 1.00 0.35 H new ATOM 0 HA VAL B 77 -2.389 -0.495 -3.939 1.00 0.36 H new ATOM 0 HB VAL B 77 -5.004 -0.698 -5.456 1.00 0.40 H new ATOM 0 HG11 VAL B 77 -3.733 0.027 -7.434 1.00 0.43 H new ATOM 0 HG12 VAL B 77 -3.795 1.294 -6.186 1.00 0.43 H new ATOM 0 HG13 VAL B 77 -2.314 0.333 -6.405 1.00 0.43 H new ATOM 0 HG21 VAL B 77 -3.742 -2.348 -6.798 1.00 0.43 H new ATOM 0 HG22 VAL B 77 -2.334 -2.125 -5.733 1.00 0.43 H new ATOM 0 HG23 VAL B 77 -3.836 -2.826 -5.086 1.00 0.43 H new ATOM 2872 N PHE B 78 -4.964 1.256 -3.055 1.00 0.32 N ATOM 2873 CA PHE B 78 -5.441 2.554 -2.620 1.00 0.29 C ATOM 2874 C PHE B 78 -4.570 3.100 -1.496 1.00 0.27 C ATOM 2875 O PHE B 78 -4.037 4.205 -1.592 1.00 0.28 O ATOM 2876 CB PHE B 78 -6.891 2.443 -2.153 1.00 0.27 C ATOM 2877 CG PHE B 78 -7.392 3.647 -1.409 1.00 0.28 C ATOM 2878 CD1 PHE B 78 -7.144 4.930 -1.873 1.00 1.23 C ATOM 2879 CD2 PHE B 78 -8.118 3.489 -0.243 1.00 1.18 C ATOM 2880 CE1 PHE B 78 -7.610 6.028 -1.184 1.00 1.24 C ATOM 2881 CE2 PHE B 78 -8.585 4.584 0.447 1.00 1.19 C ATOM 2882 CZ PHE B 78 -8.331 5.855 -0.023 1.00 0.37 C ATOM 0 H PHE B 78 -5.589 0.484 -2.822 1.00 0.32 H new ATOM 0 HA PHE B 78 -5.386 3.244 -3.462 1.00 0.29 H new ATOM 0 HB2 PHE B 78 -7.529 2.275 -3.021 1.00 0.27 H new ATOM 0 HB3 PHE B 78 -6.988 1.567 -1.512 1.00 0.27 H new ATOM 0 HD1 PHE B 78 -6.580 5.070 -2.783 1.00 1.23 H new ATOM 0 HD2 PHE B 78 -8.321 2.496 0.130 1.00 1.18 H new ATOM 0 HE1 PHE B 78 -7.410 7.023 -1.553 1.00 1.24 H new ATOM 0 HE2 PHE B 78 -9.151 4.448 1.357 1.00 1.19 H new ATOM 0 HZ PHE B 78 -8.697 6.715 0.519 1.00 0.37 H new ATOM 2892 N LEU B 79 -4.419 2.322 -0.438 1.00 0.27 N ATOM 2893 CA LEU B 79 -3.679 2.772 0.734 1.00 0.27 C ATOM 2894 C LEU B 79 -2.237 3.114 0.385 1.00 0.31 C ATOM 2895 O LEU B 79 -1.627 3.988 1.004 1.00 0.33 O ATOM 2896 CB LEU B 79 -3.736 1.723 1.839 1.00 0.29 C ATOM 2897 CG LEU B 79 -5.152 1.318 2.252 1.00 0.29 C ATOM 2898 CD1 LEU B 79 -5.130 0.562 3.561 1.00 0.40 C ATOM 2899 CD2 LEU B 79 -6.050 2.536 2.356 1.00 0.30 C ATOM 0 H LEU B 79 -4.797 1.378 -0.364 1.00 0.27 H new ATOM 0 HA LEU B 79 -4.153 3.683 1.098 1.00 0.27 H new ATOM 0 HB2 LEU B 79 -3.199 0.834 1.508 1.00 0.29 H new ATOM 0 HB3 LEU B 79 -3.211 2.105 2.714 1.00 0.29 H new ATOM 0 HG LEU B 79 -5.556 0.660 1.482 1.00 0.29 H new ATOM 0 HD11 LEU B 79 -6.147 0.283 3.837 1.00 0.40 H new ATOM 0 HD12 LEU B 79 -4.524 -0.337 3.452 1.00 0.40 H new ATOM 0 HD13 LEU B 79 -4.703 1.195 4.339 1.00 0.40 H new ATOM 0 HD21 LEU B 79 -7.052 2.225 2.651 1.00 0.30 H new ATOM 0 HD22 LEU B 79 -5.648 3.221 3.102 1.00 0.30 H new ATOM 0 HD23 LEU B 79 -6.096 3.038 1.390 1.00 0.30 H new ATOM 2911 N SER B 80 -1.699 2.448 -0.621 1.00 0.36 N ATOM 2912 CA SER B 80 -0.368 2.774 -1.093 1.00 0.47 C ATOM 2913 C SER B 80 -0.386 4.047 -1.904 1.00 0.37 C ATOM 2914 O SER B 80 0.473 4.895 -1.713 1.00 0.38 O ATOM 2915 CB SER B 80 0.212 1.659 -1.931 1.00 0.66 C ATOM 2916 OG SER B 80 -0.711 1.224 -2.909 1.00 0.84 O ATOM 0 H SER B 80 -2.158 1.687 -1.121 1.00 0.36 H new ATOM 0 HA SER B 80 0.260 2.912 -0.213 1.00 0.47 H new ATOM 0 HB2 SER B 80 1.126 2.002 -2.416 1.00 0.66 H new ATOM 0 HB3 SER B 80 0.487 0.822 -1.289 1.00 0.66 H new ATOM 0 HG SER B 80 -0.233 0.753 -3.624 1.00 0.84 H new ATOM 2922 N SER B 81 -1.360 4.185 -2.810 1.00 0.33 N ATOM 2923 CA SER B 81 -1.466 5.397 -3.611 1.00 0.30 C ATOM 2924 C SER B 81 -1.558 6.608 -2.691 1.00 0.24 C ATOM 2925 O SER B 81 -1.097 7.688 -3.034 1.00 0.26 O ATOM 2926 CB SER B 81 -2.653 5.340 -4.584 1.00 0.37 C ATOM 2927 OG SER B 81 -3.900 5.324 -3.911 1.00 1.22 O ATOM 0 H SER B 81 -2.073 3.481 -3.001 1.00 0.33 H new ATOM 0 HA SER B 81 -0.569 5.485 -4.224 1.00 0.30 H new ATOM 0 HB2 SER B 81 -2.614 6.201 -5.252 1.00 0.37 H new ATOM 0 HB3 SER B 81 -2.567 4.449 -5.207 1.00 0.37 H new ATOM 0 HG SER B 81 -3.801 4.868 -3.049 1.00 1.22 H new ATOM 2933 N ILE B 82 -2.126 6.399 -1.503 1.00 0.23 N ATOM 2934 CA ILE B 82 -2.117 7.411 -0.455 1.00 0.23 C ATOM 2935 C ILE B 82 -0.689 7.727 -0.036 1.00 0.27 C ATOM 2936 O ILE B 82 -0.258 8.873 -0.066 1.00 0.30 O ATOM 2937 CB ILE B 82 -2.870 6.940 0.802 1.00 0.24 C ATOM 2938 CG1 ILE B 82 -4.339 6.650 0.485 1.00 0.21 C ATOM 2939 CG2 ILE B 82 -2.734 7.981 1.906 1.00 0.28 C ATOM 2940 CD1 ILE B 82 -5.122 6.142 1.676 1.00 0.23 C ATOM 0 H ILE B 82 -2.599 5.533 -1.245 1.00 0.23 H new ATOM 0 HA ILE B 82 -2.609 8.291 -0.869 1.00 0.23 H new ATOM 0 HB ILE B 82 -2.426 6.008 1.151 1.00 0.24 H new ATOM 0 HG12 ILE B 82 -4.809 7.560 0.112 1.00 0.21 H new ATOM 0 HG13 ILE B 82 -4.391 5.913 -0.316 1.00 0.21 H new ATOM 0 HG21 ILE B 82 -3.269 7.642 2.793 1.00 0.28 H new ATOM 0 HG22 ILE B 82 -1.680 8.119 2.148 1.00 0.28 H new ATOM 0 HG23 ILE B 82 -3.155 8.928 1.567 1.00 0.28 H new ATOM 0 HD11 ILE B 82 -6.155 5.957 1.380 1.00 0.23 H new ATOM 0 HD12 ILE B 82 -4.676 5.215 2.036 1.00 0.23 H new ATOM 0 HD13 ILE B 82 -5.100 6.888 2.471 1.00 0.23 H new ATOM 2952 N ALA B 83 0.034 6.690 0.358 1.00 0.30 N ATOM 2953 CA ALA B 83 1.386 6.839 0.871 1.00 0.36 C ATOM 2954 C ALA B 83 2.336 7.424 -0.181 1.00 0.37 C ATOM 2955 O ALA B 83 3.186 8.253 0.140 1.00 0.42 O ATOM 2956 CB ALA B 83 1.888 5.496 1.384 1.00 0.40 C ATOM 0 H ALA B 83 -0.298 5.726 0.331 1.00 0.30 H new ATOM 0 HA ALA B 83 1.363 7.549 1.698 1.00 0.36 H new ATOM 0 HB1 ALA B 83 2.902 5.609 1.768 1.00 0.40 H new ATOM 0 HB2 ALA B 83 1.234 5.144 2.182 1.00 0.40 H new ATOM 0 HB3 ALA B 83 1.888 4.772 0.569 1.00 0.40 H new ATOM 2962 N MET B 84 2.183 7.013 -1.436 1.00 0.37 N ATOM 2963 CA MET B 84 3.027 7.535 -2.512 1.00 0.43 C ATOM 2964 C MET B 84 2.558 8.902 -2.985 1.00 0.34 C ATOM 2965 O MET B 84 3.377 9.720 -3.388 1.00 0.37 O ATOM 2966 CB MET B 84 3.142 6.565 -3.694 1.00 0.64 C ATOM 2967 CG MET B 84 1.870 5.824 -4.050 1.00 0.44 C ATOM 2968 SD MET B 84 1.714 5.494 -5.815 1.00 1.00 S ATOM 2969 CE MET B 84 1.508 7.158 -6.447 1.00 1.26 C ATOM 0 H MET B 84 1.490 6.327 -1.734 1.00 0.37 H new ATOM 0 HA MET B 84 4.024 7.646 -2.085 1.00 0.43 H new ATOM 0 HB2 MET B 84 3.475 7.123 -4.569 1.00 0.64 H new ATOM 0 HB3 MET B 84 3.918 5.833 -3.468 1.00 0.64 H new ATOM 0 HG2 MET B 84 1.842 4.880 -3.506 1.00 0.44 H new ATOM 0 HG3 MET B 84 1.011 6.408 -3.718 1.00 0.44 H new ATOM 0 HE1 MET B 84 0.812 7.145 -7.286 1.00 1.26 H new ATOM 0 HE2 MET B 84 1.114 7.800 -5.659 1.00 1.26 H new ATOM 0 HE3 MET B 84 2.472 7.542 -6.781 1.00 1.26 H new ATOM 2979 N MET B 85 1.259 9.178 -2.929 1.00 0.33 N ATOM 2980 CA MET B 85 0.791 10.522 -3.245 1.00 0.35 C ATOM 2981 C MET B 85 1.234 11.468 -2.135 1.00 0.35 C ATOM 2982 O MET B 85 1.543 12.631 -2.380 1.00 0.42 O ATOM 2983 CB MET B 85 -0.730 10.578 -3.448 1.00 0.39 C ATOM 2984 CG MET B 85 -1.519 10.678 -2.165 1.00 1.36 C ATOM 2985 SD MET B 85 -3.289 10.890 -2.440 1.00 2.66 S ATOM 2986 CE MET B 85 -3.306 12.407 -3.394 1.00 3.35 C ATOM 0 H MET B 85 0.530 8.511 -2.676 1.00 0.33 H new ATOM 0 HA MET B 85 1.233 10.831 -4.192 1.00 0.35 H new ATOM 0 HB2 MET B 85 -0.971 11.435 -4.078 1.00 0.39 H new ATOM 0 HB3 MET B 85 -1.047 9.686 -3.988 1.00 0.39 H new ATOM 0 HG2 MET B 85 -1.354 9.778 -1.573 1.00 1.36 H new ATOM 0 HG3 MET B 85 -1.145 11.518 -1.579 1.00 1.36 H new ATOM 0 HE1 MET B 85 -4.301 12.850 -3.356 1.00 3.35 H new ATOM 0 HE2 MET B 85 -2.581 13.107 -2.978 1.00 3.35 H new ATOM 0 HE3 MET B 85 -3.046 12.188 -4.430 1.00 3.35 H new ATOM 2996 N SER B 86 1.289 10.948 -0.912 1.00 0.33 N ATOM 2997 CA SER B 86 1.862 11.679 0.202 1.00 0.39 C ATOM 2998 C SER B 86 3.343 11.932 -0.064 1.00 0.43 C ATOM 2999 O SER B 86 3.865 12.987 0.264 1.00 0.57 O ATOM 3000 CB SER B 86 1.678 10.894 1.507 1.00 0.43 C ATOM 3001 OG SER B 86 2.122 11.640 2.629 1.00 1.25 O ATOM 0 H SER B 86 0.941 10.020 -0.672 1.00 0.33 H new ATOM 0 HA SER B 86 1.349 12.635 0.305 1.00 0.39 H new ATOM 0 HB2 SER B 86 0.626 10.637 1.633 1.00 0.43 H new ATOM 0 HB3 SER B 86 2.231 9.956 1.450 1.00 0.43 H new ATOM 0 HG SER B 86 1.990 11.113 3.445 1.00 1.25 H new ATOM 3007 N ASN B 87 3.993 10.956 -0.688 1.00 0.40 N ATOM 3008 CA ASN B 87 5.413 11.040 -1.027 1.00 0.51 C ATOM 3009 C ASN B 87 5.688 12.099 -2.092 1.00 0.44 C ATOM 3010 O ASN B 87 6.448 13.050 -1.869 1.00 0.53 O ATOM 3011 CB ASN B 87 5.887 9.689 -1.561 1.00 0.69 C ATOM 3012 CG ASN B 87 7.261 9.759 -2.201 1.00 1.43 C ATOM 3013 OD1 ASN B 87 7.531 9.095 -3.196 1.00 2.36 O ATOM 3014 ND2 ASN B 87 8.145 10.545 -1.616 1.00 1.49 N ATOM 0 H ASN B 87 3.552 10.082 -0.974 1.00 0.40 H new ATOM 0 HA ASN B 87 5.949 11.316 -0.119 1.00 0.51 H new ATOM 0 HB2 ASN B 87 5.908 8.968 -0.744 1.00 0.69 H new ATOM 0 HB3 ASN B 87 5.169 9.320 -2.293 1.00 0.69 H new ATOM 0 HD21 ASN B 87 9.091 10.616 -1.990 1.00 1.49 H new ATOM 0 HD22 ASN B 87 7.882 11.082 -0.790 1.00 1.49 H new ATOM 3021 N GLU B 88 5.081 11.910 -3.250 1.00 0.37 N ATOM 3022 CA GLU B 88 5.323 12.769 -4.395 1.00 0.42 C ATOM 3023 C GLU B 88 4.959 14.213 -4.069 1.00 0.51 C ATOM 3024 O GLU B 88 5.633 15.152 -4.497 1.00 0.66 O ATOM 3025 CB GLU B 88 4.527 12.255 -5.595 1.00 0.48 C ATOM 3026 CG GLU B 88 4.807 10.789 -5.913 1.00 0.51 C ATOM 3027 CD GLU B 88 4.016 10.282 -7.102 1.00 0.91 C ATOM 3028 OE1 GLU B 88 2.799 10.067 -6.963 1.00 1.74 O ATOM 3029 OE2 GLU B 88 4.612 10.092 -8.184 1.00 1.49 O ATOM 0 H GLU B 88 4.410 11.161 -3.423 1.00 0.37 H new ATOM 0 HA GLU B 88 6.384 12.747 -4.644 1.00 0.42 H new ATOM 0 HB2 GLU B 88 3.462 12.381 -5.399 1.00 0.48 H new ATOM 0 HB3 GLU B 88 4.764 12.862 -6.468 1.00 0.48 H new ATOM 0 HG2 GLU B 88 5.871 10.662 -6.110 1.00 0.51 H new ATOM 0 HG3 GLU B 88 4.570 10.181 -5.040 1.00 0.51 H new ATOM 3036 N PHE B 89 3.911 14.382 -3.278 1.00 0.50 N ATOM 3037 CA PHE B 89 3.492 15.705 -2.845 1.00 0.63 C ATOM 3038 C PHE B 89 4.206 16.125 -1.562 1.00 0.66 C ATOM 3039 O PHE B 89 4.070 17.268 -1.119 1.00 0.79 O ATOM 3040 CB PHE B 89 1.975 15.751 -2.651 1.00 0.73 C ATOM 3041 CG PHE B 89 1.198 15.739 -3.939 1.00 1.18 C ATOM 3042 CD1 PHE B 89 0.946 14.550 -4.608 1.00 1.70 C ATOM 3043 CD2 PHE B 89 0.718 16.920 -4.481 1.00 2.16 C ATOM 3044 CE1 PHE B 89 0.232 14.540 -5.791 1.00 2.37 C ATOM 3045 CE2 PHE B 89 0.003 16.916 -5.665 1.00 2.79 C ATOM 3046 CZ PHE B 89 -0.240 15.725 -6.320 1.00 2.70 C ATOM 0 H PHE B 89 3.335 13.619 -2.923 1.00 0.50 H new ATOM 0 HA PHE B 89 3.768 16.412 -3.627 1.00 0.63 H new ATOM 0 HB2 PHE B 89 1.669 14.898 -2.045 1.00 0.73 H new ATOM 0 HB3 PHE B 89 1.717 16.649 -2.090 1.00 0.73 H new ATOM 0 HD1 PHE B 89 1.313 13.620 -4.199 1.00 1.70 H new ATOM 0 HD2 PHE B 89 0.904 17.855 -3.973 1.00 2.16 H new ATOM 0 HE1 PHE B 89 0.043 13.607 -6.301 1.00 2.37 H new ATOM 0 HE2 PHE B 89 -0.365 17.844 -6.077 1.00 2.79 H new ATOM 0 HZ PHE B 89 -0.798 15.720 -7.244 1.00 2.70 H new ATOM 3056 N PHE B 90 4.971 15.211 -0.965 1.00 0.60 N ATOM 3057 CA PHE B 90 5.766 15.548 0.209 1.00 0.68 C ATOM 3058 C PHE B 90 6.871 16.491 -0.210 1.00 0.68 C ATOM 3059 O PHE B 90 7.116 17.503 0.445 1.00 0.79 O ATOM 3060 CB PHE B 90 6.366 14.301 0.868 1.00 0.70 C ATOM 3061 CG PHE B 90 6.960 14.556 2.225 1.00 0.85 C ATOM 3062 CD1 PHE B 90 6.163 14.521 3.359 1.00 1.46 C ATOM 3063 CD2 PHE B 90 8.310 14.832 2.370 1.00 1.53 C ATOM 3064 CE1 PHE B 90 6.701 14.753 4.609 1.00 1.59 C ATOM 3065 CE2 PHE B 90 8.853 15.066 3.618 1.00 1.64 C ATOM 3066 CZ PHE B 90 8.048 15.027 4.739 1.00 1.21 C ATOM 0 H PHE B 90 5.055 14.242 -1.273 1.00 0.60 H new ATOM 0 HA PHE B 90 5.116 16.022 0.944 1.00 0.68 H new ATOM 0 HB2 PHE B 90 5.590 13.541 0.959 1.00 0.70 H new ATOM 0 HB3 PHE B 90 7.138 13.893 0.215 1.00 0.70 H new ATOM 0 HD1 PHE B 90 5.108 14.310 3.263 1.00 1.46 H new ATOM 0 HD2 PHE B 90 8.945 14.865 1.497 1.00 1.53 H new ATOM 0 HE1 PHE B 90 6.069 14.720 5.484 1.00 1.59 H new ATOM 0 HE2 PHE B 90 9.907 15.279 3.717 1.00 1.64 H new ATOM 0 HZ PHE B 90 8.471 15.210 5.716 1.00 1.21 H new ATOM 3076 N GLU B 91 7.538 16.160 -1.312 1.00 0.61 N ATOM 3077 CA GLU B 91 8.516 17.071 -1.879 1.00 0.72 C ATOM 3078 C GLU B 91 7.818 18.132 -2.709 1.00 0.77 C ATOM 3079 O GLU B 91 8.308 19.249 -2.856 1.00 0.95 O ATOM 3080 CB GLU B 91 9.507 16.313 -2.743 1.00 0.82 C ATOM 3081 CG GLU B 91 10.105 15.115 -2.046 1.00 0.92 C ATOM 3082 CD GLU B 91 11.047 14.360 -2.939 1.00 1.57 C ATOM 3083 OE1 GLU B 91 10.619 13.956 -4.034 1.00 2.25 O ATOM 3084 OE2 GLU B 91 12.218 14.150 -2.552 1.00 2.22 O ATOM 0 H GLU B 91 7.420 15.283 -1.820 1.00 0.61 H new ATOM 0 HA GLU B 91 9.056 17.552 -1.063 1.00 0.72 H new ATOM 0 HB2 GLU B 91 9.008 15.984 -3.654 1.00 0.82 H new ATOM 0 HB3 GLU B 91 10.308 16.988 -3.044 1.00 0.82 H new ATOM 0 HG2 GLU B 91 10.636 15.443 -1.152 1.00 0.92 H new ATOM 0 HG3 GLU B 91 9.306 14.451 -1.716 1.00 0.92 H new ATOM 3091 N GLY B 92 6.676 17.764 -3.261 1.00 0.71 N ATOM 3092 CA GLY B 92 5.905 18.690 -4.061 1.00 0.82 C ATOM 3093 C GLY B 92 5.995 18.359 -5.530 1.00 0.81 C ATOM 3094 O GLY B 92 5.152 18.769 -6.329 1.00 0.91 O ATOM 0 H GLY B 92 6.266 16.835 -3.169 1.00 0.71 H new ATOM 0 HA2 GLY B 92 4.862 18.665 -3.745 1.00 0.82 H new ATOM 0 HA3 GLY B 92 6.265 19.705 -3.893 1.00 0.82 H new ATOM 3098 N PHE B 93 7.020 17.607 -5.883 1.00 0.76 N ATOM 3099 CA PHE B 93 7.215 17.168 -7.249 1.00 0.78 C ATOM 3100 C PHE B 93 8.006 15.873 -7.253 1.00 0.69 C ATOM 3101 O PHE B 93 9.123 15.826 -6.741 1.00 0.82 O ATOM 3102 CB PHE B 93 7.945 18.236 -8.073 1.00 1.00 C ATOM 3103 CG PHE B 93 8.115 17.861 -9.518 1.00 1.67 C ATOM 3104 CD1 PHE B 93 7.055 17.968 -10.402 1.00 2.41 C ATOM 3105 CD2 PHE B 93 9.332 17.394 -9.990 1.00 2.58 C ATOM 3106 CE1 PHE B 93 7.203 17.618 -11.729 1.00 3.46 C ATOM 3107 CE2 PHE B 93 9.487 17.041 -11.317 1.00 3.59 C ATOM 3108 CZ PHE B 93 8.422 17.155 -12.187 1.00 3.90 C ATOM 0 H PHE B 93 7.737 17.285 -5.233 1.00 0.76 H new ATOM 0 HA PHE B 93 6.239 17.003 -7.706 1.00 0.78 H new ATOM 0 HB2 PHE B 93 7.392 19.173 -8.011 1.00 1.00 H new ATOM 0 HB3 PHE B 93 8.926 18.415 -7.634 1.00 1.00 H new ATOM 0 HD1 PHE B 93 6.101 18.330 -10.049 1.00 2.41 H new ATOM 0 HD2 PHE B 93 10.169 17.305 -9.313 1.00 2.58 H new ATOM 0 HE1 PHE B 93 6.368 17.706 -12.408 1.00 3.46 H new ATOM 0 HE2 PHE B 93 10.440 16.677 -11.672 1.00 3.59 H new ATOM 0 HZ PHE B 93 8.541 16.883 -13.225 1.00 3.90 H new ATOM 3118 N PRO B 94 7.426 14.803 -7.807 1.00 0.64 N ATOM 3119 CA PRO B 94 8.089 13.504 -7.886 1.00 0.61 C ATOM 3120 C PRO B 94 9.365 13.560 -8.722 1.00 0.71 C ATOM 3121 O PRO B 94 9.321 13.695 -9.944 1.00 0.90 O ATOM 3122 CB PRO B 94 7.052 12.600 -8.553 1.00 0.65 C ATOM 3123 CG PRO B 94 6.088 13.522 -9.216 1.00 0.84 C ATOM 3124 CD PRO B 94 6.076 14.774 -8.391 1.00 0.83 C ATOM 0 HA PRO B 94 8.402 13.150 -6.904 1.00 0.61 H new ATOM 0 HB2 PRO B 94 7.520 11.934 -9.278 1.00 0.65 H new ATOM 0 HB3 PRO B 94 6.551 11.970 -7.819 1.00 0.65 H new ATOM 0 HG2 PRO B 94 6.393 13.733 -10.241 1.00 0.84 H new ATOM 0 HG3 PRO B 94 5.094 13.078 -9.264 1.00 0.84 H new ATOM 0 HD2 PRO B 94 5.882 15.656 -9.001 1.00 0.83 H new ATOM 0 HD3 PRO B 94 5.305 14.742 -7.621 1.00 0.83 H new ATOM 3132 N ASP B 95 10.498 13.441 -8.051 1.00 0.71 N ATOM 3133 CA ASP B 95 11.805 13.536 -8.706 1.00 0.87 C ATOM 3134 C ASP B 95 12.411 12.154 -8.788 1.00 0.84 C ATOM 3135 O ASP B 95 13.327 11.884 -9.565 1.00 0.96 O ATOM 3136 CB ASP B 95 12.744 14.441 -7.903 1.00 1.12 C ATOM 3137 CG ASP B 95 13.344 13.726 -6.704 1.00 1.70 C ATOM 3138 OD1 ASP B 95 12.582 13.164 -5.893 1.00 2.16 O ATOM 3139 OD2 ASP B 95 14.585 13.717 -6.566 1.00 2.40 O ATOM 0 H ASP B 95 10.546 13.277 -7.045 1.00 0.71 H new ATOM 0 HA ASP B 95 11.673 13.958 -9.702 1.00 0.87 H new ATOM 0 HB2 ASP B 95 13.546 14.796 -8.551 1.00 1.12 H new ATOM 0 HB3 ASP B 95 12.196 15.320 -7.563 1.00 1.12 H new ATOM 3144 N LYS B 96 11.866 11.298 -7.958 1.00 0.81 N ATOM 3145 CA LYS B 96 12.320 9.939 -7.806 1.00 0.86 C ATOM 3146 C LYS B 96 11.621 9.054 -8.819 1.00 0.83 C ATOM 3147 O LYS B 96 12.029 7.921 -9.075 1.00 0.94 O ATOM 3148 CB LYS B 96 12.047 9.483 -6.365 1.00 0.97 C ATOM 3149 CG LYS B 96 10.775 10.078 -5.753 1.00 0.93 C ATOM 3150 CD LYS B 96 10.638 9.714 -4.292 1.00 0.65 C ATOM 3151 CE LYS B 96 10.759 10.951 -3.429 1.00 0.84 C ATOM 3152 NZ LYS B 96 12.042 11.674 -3.667 1.00 1.85 N ATOM 0 H LYS B 96 11.077 11.533 -7.356 1.00 0.81 H new ATOM 0 HA LYS B 96 13.392 9.869 -7.991 1.00 0.86 H new ATOM 0 HB2 LYS B 96 11.972 8.396 -6.347 1.00 0.97 H new ATOM 0 HB3 LYS B 96 12.899 9.754 -5.742 1.00 0.97 H new ATOM 0 HG2 LYS B 96 10.793 11.163 -5.858 1.00 0.93 H new ATOM 0 HG3 LYS B 96 9.904 9.719 -6.301 1.00 0.93 H new ATOM 0 HD2 LYS B 96 9.675 9.234 -4.119 1.00 0.65 H new ATOM 0 HD3 LYS B 96 11.408 8.993 -4.016 1.00 0.65 H new ATOM 0 HE2 LYS B 96 9.923 11.619 -3.634 1.00 0.84 H new ATOM 0 HE3 LYS B 96 10.691 10.668 -2.378 1.00 0.84 H new ATOM 0 HZ1 LYS B 96 12.265 12.266 -2.842 1.00 1.85 H new ATOM 0 HZ2 LYS B 96 12.807 10.985 -3.815 1.00 1.85 H new ATOM 0 HZ3 LYS B 96 11.950 12.276 -4.510 1.00 1.85 H new