USER MOD reduce.3.24.130724 H: found=0, std=0, add=1203, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1203 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 140 LYS NZ :NH3+ -171:sc= 2.34 (180deg=1.04) USER MOD Set 1.2: A 141 SER OG : rot -138:sc= 0.698 USER MOD Set 2.1: A 69 TYR OH : rot 49:sc= 0.271 USER MOD Set 2.2: A 113 SER OG : rot 180:sc= -0.0498 USER MOD Set 3.1: A 1 MET N :NH3+ -174:sc= -0.0586 (180deg=-0.125) USER MOD Set 3.2: A 108 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.3: A 112 SER OG : rot 78:sc= 0.962 USER MOD Set 4.1: A 96 GLN :FLIP amide:sc= -0.161 F(o=-1.4!,f=-0.26) USER MOD Set 4.2: A 110 TYR OH : rot 180:sc= -0.0949 USER MOD Set 5.1: A 77 THR OG1 : rot 96:sc= 1.1 USER MOD Set 5.2: A 88 THR OG1 : rot 180:sc= 1.01 USER MOD Set 6.1: A 23 GLN : amide:sc= -0.381 K(o=-2.1,f=-5!) USER MOD Set 6.2: A 24 HIS : no HD1:sc= -1.67! X(o=-2.1!,f=-1.7) USER MOD Set 7.1: A 19 HIS : no HE2:sc= 0.866 K(o=0.87,f=-6.6!) USER MOD Set 7.2: A 20 ASN : amide:sc= 0 X(o=0.87,f=0.51) USER MOD Single : A 1 MET CE :methyl 157:sc= -0.206 (180deg=-0.787) USER MOD Single : A 3 SER OG : rot 180:sc= 0.266 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 CYS SG : rot -7:sc= 0.551 USER MOD Single : A 12 LYS NZ :NH3+ 169:sc= 1.11 (180deg=0.919) USER MOD Single : A 13 ASN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 15 TYR OH : rot 102:sc= 0.734 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 HIS : no HD1:sc= -0.446 X(o=-0.45,f=-0.47) USER MOD Single : A 25 SER OG : rot -106:sc= 1.26 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 166:sc= 1.02 (180deg=0.754) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 THR OG1 : rot 19:sc= 0.636 USER MOD Single : A 42 LYS NZ :NH3+ -122:sc= 0.828 (180deg=-0.154) USER MOD Single : A 46 LYS NZ :NH3+ 165:sc= 1.25 (180deg=1.18) USER MOD Single : A 47 ASN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 MET CE :methyl 172:sc= -0.365 (180deg=-0.608) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 1.19 (180deg=1.19) USER MOD Single : A 59 LYS NZ :NH3+ -120:sc= 0.176 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 179:sc= 0.975 (180deg=0.973) USER MOD Single : A 67 CYS SG : rot 29:sc= -3.6! USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 GLN :FLIP amide:sc= -0.011 F(o=-1.3!,f=-0.011) USER MOD Single : A 86 THR OG1 : rot 48:sc= 0.0375 USER MOD Single : A 87 SER OG : rot 95:sc= 0.987 USER MOD Single : A 90 ASN : amide:sc= 0.896 K(o=0.9,f=-4.2!) USER MOD Single : A 91 LYS NZ :NH3+ -163:sc= 1.51 (180deg=1) USER MOD Single : A 97 TYR OH : rot -158:sc= 0.23 USER MOD Single : A 98 CYS SG : rot -32:sc= -0.462 USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 118 LYS NZ :NH3+ -159:sc= 1.82 (180deg=1.5) USER MOD Single : A 120 SER OG : rot 160:sc= 0 USER MOD Single : A 125 SER OG : rot 180:sc= -0.0678 USER MOD Single : A 128 GLN : amide:sc= -0.346 X(o=-0.35,f=-0.00078) USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 SER OG : rot -57:sc= 0.0322 USER MOD Single : A 134 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 143 LYS NZ :NH3+ 172:sc= 0.943 (180deg=0.613) USER MOD Single : A 144 SER OG : rot 115:sc= 1.27 USER MOD Single : A 147 MET CE :methyl 158:sc= -0.433 (180deg=-1.12) USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD Single : A 149 ASN : amide:sc= 0.366 X(o=0.37,f=0) USER MOD Single : A 150 GLN : amide:sc= -5.97! C(o=-6!,f=-9.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.182 -1.603 1.654 1.00 0.00 N ATOM 2 CA MET A 1 2.369 -1.380 0.201 1.00 52.33 C ATOM 3 C MET A 1 2.016 -2.630 -0.593 1.00 23.33 C ATOM 4 O MET A 1 1.899 -2.583 -1.819 1.00 63.20 O ATOM 5 CB MET A 1 3.805 -0.954 -0.103 1.00 4.41 C ATOM 6 CG MET A 1 4.149 0.430 0.423 1.00 24.25 C ATOM 7 SD MET A 1 5.801 0.973 -0.047 1.00 64.42 S ATOM 8 CE MET A 1 5.659 0.999 -1.834 1.00 33.30 C ATOM 0 H1 MET A 1 2.331 -0.709 2.164 1.00 0.00 H new ATOM 0 H2 MET A 1 1.216 -1.946 1.831 1.00 0.00 H new ATOM 0 H3 MET A 1 2.868 -2.310 1.988 1.00 0.00 H new ATOM 0 HA MET A 1 1.696 -0.578 -0.100 1.00 52.33 H new ATOM 0 HB2 MET A 1 4.491 -1.681 0.332 1.00 4.41 H new ATOM 0 HB3 MET A 1 3.961 -0.974 -1.182 1.00 4.41 H new ATOM 0 HG2 MET A 1 3.417 1.146 0.049 1.00 24.25 H new ATOM 0 HG3 MET A 1 4.069 0.430 1.510 1.00 24.25 H new ATOM 0 HE1 MET A 1 6.407 1.674 -2.249 1.00 33.30 H new ATOM 0 HE2 MET A 1 5.819 -0.005 -2.226 1.00 33.30 H new ATOM 0 HE3 MET A 1 4.664 1.344 -2.115 1.00 33.30 H new ATOM 20 N ALA A 2 1.845 -3.748 0.102 1.00 53.14 N ATOM 21 CA ALA A 2 1.403 -4.976 -0.536 1.00 44.44 C ATOM 22 C ALA A 2 0.547 -5.800 0.417 1.00 12.23 C ATOM 23 O ALA A 2 0.924 -6.019 1.569 1.00 22.15 O ATOM 24 CB ALA A 2 2.596 -5.786 -1.017 1.00 53.20 C ATOM 0 H ALA A 2 2.006 -3.827 1.106 1.00 53.14 H new ATOM 0 HA ALA A 2 0.794 -4.712 -1.401 1.00 44.44 H new ATOM 0 HB1 ALA A 2 2.246 -6.702 -1.492 1.00 53.20 H new ATOM 0 HB2 ALA A 2 3.168 -5.200 -1.736 1.00 53.20 H new ATOM 0 HB3 ALA A 2 3.231 -6.038 -0.168 1.00 53.20 H new ATOM 30 N SER A 3 -0.606 -6.242 -0.062 1.00 52.21 N ATOM 31 CA SER A 3 -1.502 -7.062 0.736 1.00 11.34 C ATOM 32 C SER A 3 -2.432 -7.847 -0.184 1.00 60.02 C ATOM 33 O SER A 3 -2.254 -7.837 -1.405 1.00 64.14 O ATOM 34 CB SER A 3 -2.307 -6.188 1.708 1.00 23.30 C ATOM 35 OG SER A 3 -2.988 -6.976 2.675 1.00 51.43 O ATOM 0 H SER A 3 -0.943 -6.045 -1.004 1.00 52.21 H new ATOM 0 HA SER A 3 -0.914 -7.765 1.326 1.00 11.34 H new ATOM 0 HB2 SER A 3 -1.638 -5.491 2.212 1.00 23.30 H new ATOM 0 HB3 SER A 3 -3.028 -5.591 1.150 1.00 23.30 H new ATOM 0 HG SER A 3 -3.490 -6.390 3.280 1.00 51.43 H new ATOM 41 N GLY A 4 -3.427 -8.507 0.399 1.00 72.02 N ATOM 42 CA GLY A 4 -4.331 -9.338 -0.374 1.00 21.45 C ATOM 43 C GLY A 4 -5.400 -8.538 -1.093 1.00 54.23 C ATOM 44 O GLY A 4 -6.591 -8.699 -0.828 1.00 70.21 O ATOM 0 H GLY A 4 -3.624 -8.481 1.399 1.00 72.02 H new ATOM 0 HA2 GLY A 4 -3.757 -9.907 -1.105 1.00 21.45 H new ATOM 0 HA3 GLY A 4 -4.809 -10.060 0.288 1.00 21.45 H new ATOM 48 N VAL A 5 -4.974 -7.674 -2.001 1.00 34.43 N ATOM 49 CA VAL A 5 -5.897 -6.902 -2.818 1.00 53.54 C ATOM 50 C VAL A 5 -6.255 -7.698 -4.067 1.00 24.22 C ATOM 51 O VAL A 5 -5.372 -8.157 -4.793 1.00 14.21 O ATOM 52 CB VAL A 5 -5.296 -5.538 -3.224 1.00 32.14 C ATOM 53 CG1 VAL A 5 -6.320 -4.698 -3.974 1.00 54.40 C ATOM 54 CG2 VAL A 5 -4.782 -4.790 -2.001 1.00 40.23 C ATOM 0 H VAL A 5 -3.989 -7.489 -2.191 1.00 34.43 H new ATOM 0 HA VAL A 5 -6.792 -6.709 -2.227 1.00 53.54 H new ATOM 0 HB VAL A 5 -4.454 -5.724 -3.890 1.00 32.14 H new ATOM 0 HG11 VAL A 5 -5.875 -3.742 -4.250 1.00 54.40 H new ATOM 0 HG12 VAL A 5 -6.634 -5.226 -4.875 1.00 54.40 H new ATOM 0 HG13 VAL A 5 -7.186 -4.524 -3.335 1.00 54.40 H new ATOM 0 HG21 VAL A 5 -4.363 -3.832 -2.310 1.00 40.23 H new ATOM 0 HG22 VAL A 5 -5.605 -4.619 -1.307 1.00 40.23 H new ATOM 0 HG23 VAL A 5 -4.010 -5.382 -1.510 1.00 40.23 H new ATOM 64 N LYS A 6 -7.544 -7.872 -4.307 1.00 71.12 N ATOM 65 CA LYS A 6 -8.003 -8.722 -5.392 1.00 53.24 C ATOM 66 C LYS A 6 -7.843 -8.029 -6.739 1.00 63.12 C ATOM 67 O LYS A 6 -8.229 -6.871 -6.903 1.00 10.53 O ATOM 68 CB LYS A 6 -9.469 -9.097 -5.178 1.00 44.14 C ATOM 69 CG LYS A 6 -9.830 -10.477 -5.701 1.00 2.24 C ATOM 70 CD LYS A 6 -9.043 -11.551 -4.972 1.00 40.22 C ATOM 71 CE LYS A 6 -9.567 -12.943 -5.270 1.00 4.43 C ATOM 72 NZ LYS A 6 -8.854 -13.970 -4.470 1.00 61.11 N ATOM 0 H LYS A 6 -8.290 -7.436 -3.765 1.00 71.12 H new ATOM 0 HA LYS A 6 -7.392 -9.624 -5.395 1.00 53.24 H new ATOM 0 HB2 LYS A 6 -9.694 -9.052 -4.113 1.00 44.14 H new ATOM 0 HB3 LYS A 6 -10.100 -8.356 -5.669 1.00 44.14 H new ATOM 0 HG2 LYS A 6 -10.898 -10.652 -5.573 1.00 2.24 H new ATOM 0 HG3 LYS A 6 -9.624 -10.531 -6.770 1.00 2.24 H new ATOM 0 HD2 LYS A 6 -7.994 -11.490 -5.260 1.00 40.22 H new ATOM 0 HD3 LYS A 6 -9.090 -11.369 -3.898 1.00 40.22 H new ATOM 0 HE2 LYS A 6 -10.634 -12.986 -5.053 1.00 4.43 H new ATOM 0 HE3 LYS A 6 -9.448 -13.159 -6.332 1.00 4.43 H new ATOM 0 HZ1 LYS A 6 -9.234 -14.911 -4.696 1.00 61.11 H new ATOM 0 HZ2 LYS A 6 -7.839 -13.943 -4.696 1.00 61.11 H new ATOM 0 HZ3 LYS A 6 -8.988 -13.776 -3.457 1.00 61.11 H new ATOM 86 N VAL A 7 -7.265 -8.739 -7.695 1.00 52.31 N ATOM 87 CA VAL A 7 -7.144 -8.228 -9.050 1.00 74.21 C ATOM 88 C VAL A 7 -8.264 -8.777 -9.929 1.00 23.15 C ATOM 89 O VAL A 7 -8.503 -9.987 -9.976 1.00 43.35 O ATOM 90 CB VAL A 7 -5.768 -8.558 -9.675 1.00 2.13 C ATOM 91 CG1 VAL A 7 -4.669 -7.747 -9.004 1.00 21.01 C ATOM 92 CG2 VAL A 7 -5.460 -10.045 -9.575 1.00 62.13 C ATOM 0 H VAL A 7 -6.873 -9.670 -7.557 1.00 52.31 H new ATOM 0 HA VAL A 7 -7.229 -7.143 -8.994 1.00 74.21 H new ATOM 0 HB VAL A 7 -5.809 -8.290 -10.731 1.00 2.13 H new ATOM 0 HG11 VAL A 7 -3.708 -7.992 -9.456 1.00 21.01 H new ATOM 0 HG12 VAL A 7 -4.871 -6.684 -9.134 1.00 21.01 H new ATOM 0 HG13 VAL A 7 -4.640 -7.983 -7.940 1.00 21.01 H new ATOM 0 HG21 VAL A 7 -4.487 -10.246 -10.023 1.00 62.13 H new ATOM 0 HG22 VAL A 7 -5.446 -10.344 -8.527 1.00 62.13 H new ATOM 0 HG23 VAL A 7 -6.226 -10.612 -10.104 1.00 62.13 H new ATOM 102 N ASP A 8 -8.962 -7.880 -10.603 1.00 33.20 N ATOM 103 CA ASP A 8 -10.093 -8.251 -11.445 1.00 44.45 C ATOM 104 C ASP A 8 -9.631 -8.656 -12.846 1.00 12.40 C ATOM 105 O ASP A 8 -8.754 -8.020 -13.429 1.00 44.11 O ATOM 106 CB ASP A 8 -11.083 -7.085 -11.516 1.00 31.51 C ATOM 107 CG ASP A 8 -12.029 -7.180 -12.687 1.00 13.02 C ATOM 108 OD1 ASP A 8 -12.987 -7.976 -12.622 1.00 11.04 O ATOM 109 OD2 ASP A 8 -11.813 -6.457 -13.677 1.00 22.12 O ATOM 0 H ASP A 8 -8.765 -6.879 -10.585 1.00 33.20 H new ATOM 0 HA ASP A 8 -10.589 -9.115 -11.003 1.00 44.45 H new ATOM 0 HB2 ASP A 8 -11.661 -7.050 -10.592 1.00 31.51 H new ATOM 0 HB3 ASP A 8 -10.528 -6.149 -11.580 1.00 31.51 H new ATOM 114 N PRO A 9 -10.198 -9.744 -13.390 1.00 72.45 N ATOM 115 CA PRO A 9 -9.851 -10.242 -14.727 1.00 51.31 C ATOM 116 C PRO A 9 -10.316 -9.313 -15.853 1.00 43.31 C ATOM 117 O PRO A 9 -9.664 -9.223 -16.896 1.00 42.12 O ATOM 118 CB PRO A 9 -10.579 -11.594 -14.816 1.00 42.31 C ATOM 119 CG PRO A 9 -11.007 -11.912 -13.423 1.00 42.33 C ATOM 120 CD PRO A 9 -11.204 -10.594 -12.741 1.00 5.12 C ATOM 0 HA PRO A 9 -8.771 -10.313 -14.853 1.00 51.31 H new ATOM 0 HB2 PRO A 9 -11.437 -11.534 -15.486 1.00 42.31 H new ATOM 0 HB3 PRO A 9 -9.921 -12.368 -15.210 1.00 42.31 H new ATOM 0 HG2 PRO A 9 -11.929 -12.494 -13.421 1.00 42.33 H new ATOM 0 HG3 PRO A 9 -10.253 -12.508 -12.910 1.00 42.33 H new ATOM 0 HD2 PRO A 9 -12.214 -10.210 -12.886 1.00 5.12 H new ATOM 0 HD3 PRO A 9 -11.041 -10.666 -11.666 1.00 5.12 H new ATOM 128 N SER A 10 -11.424 -8.611 -15.631 1.00 61.40 N ATOM 129 CA SER A 10 -12.020 -7.761 -16.659 1.00 43.12 C ATOM 130 C SER A 10 -11.108 -6.588 -17.007 1.00 22.03 C ATOM 131 O SER A 10 -10.872 -6.302 -18.182 1.00 22.32 O ATOM 132 CB SER A 10 -13.386 -7.248 -16.194 1.00 31.43 C ATOM 133 OG SER A 10 -14.240 -8.325 -15.837 1.00 2.02 O ATOM 0 H SER A 10 -11.929 -8.614 -14.745 1.00 61.40 H new ATOM 0 HA SER A 10 -12.151 -8.363 -17.558 1.00 43.12 H new ATOM 0 HB2 SER A 10 -13.257 -6.583 -15.340 1.00 31.43 H new ATOM 0 HB3 SER A 10 -13.848 -6.661 -16.988 1.00 31.43 H new ATOM 0 HG SER A 10 -15.105 -7.972 -15.542 1.00 2.02 H new ATOM 139 N CYS A 11 -10.586 -5.916 -15.991 1.00 41.33 N ATOM 140 CA CYS A 11 -9.700 -4.783 -16.213 1.00 1.41 C ATOM 141 C CYS A 11 -8.363 -5.242 -16.789 1.00 31.30 C ATOM 142 O CYS A 11 -7.733 -4.526 -17.568 1.00 44.45 O ATOM 143 CB CYS A 11 -9.498 -3.993 -14.918 1.00 74.15 C ATOM 144 SG CYS A 11 -8.967 -4.990 -13.508 1.00 75.23 S ATOM 0 H CYS A 11 -10.760 -6.134 -15.010 1.00 41.33 H new ATOM 0 HA CYS A 11 -10.168 -4.122 -16.942 1.00 1.41 H new ATOM 0 HB2 CYS A 11 -8.758 -3.213 -15.095 1.00 74.15 H new ATOM 0 HB3 CYS A 11 -10.432 -3.493 -14.662 1.00 74.15 H new ATOM 0 HG CYS A 11 -8.998 -6.249 -13.830 1.00 75.23 H new ATOM 150 N LYS A 12 -7.943 -6.447 -16.422 1.00 2.01 N ATOM 151 CA LYS A 12 -6.736 -7.029 -16.992 1.00 74.25 C ATOM 152 C LYS A 12 -6.959 -7.368 -18.461 1.00 75.23 C ATOM 153 O LYS A 12 -6.079 -7.161 -19.297 1.00 62.03 O ATOM 154 CB LYS A 12 -6.308 -8.274 -16.209 1.00 62.54 C ATOM 155 CG LYS A 12 -5.113 -8.999 -16.815 1.00 62.32 C ATOM 156 CD LYS A 12 -3.969 -8.040 -17.112 1.00 62.35 C ATOM 157 CE LYS A 12 -2.742 -8.770 -17.640 1.00 54.02 C ATOM 158 NZ LYS A 12 -3.019 -9.474 -18.922 1.00 72.23 N ATOM 0 H LYS A 12 -8.417 -7.036 -15.737 1.00 2.01 H new ATOM 0 HA LYS A 12 -5.933 -6.295 -16.921 1.00 74.25 H new ATOM 0 HB2 LYS A 12 -6.065 -7.984 -15.187 1.00 62.54 H new ATOM 0 HB3 LYS A 12 -7.150 -8.964 -16.153 1.00 62.54 H new ATOM 0 HG2 LYS A 12 -4.770 -9.774 -16.129 1.00 62.32 H new ATOM 0 HG3 LYS A 12 -5.418 -9.499 -17.734 1.00 62.32 H new ATOM 0 HD2 LYS A 12 -4.295 -7.301 -17.844 1.00 62.35 H new ATOM 0 HD3 LYS A 12 -3.706 -7.496 -16.205 1.00 62.35 H new ATOM 0 HE2 LYS A 12 -1.931 -8.057 -17.786 1.00 54.02 H new ATOM 0 HE3 LYS A 12 -2.402 -9.491 -16.897 1.00 54.02 H new ATOM 0 HZ1 LYS A 12 -2.124 -9.799 -19.340 1.00 72.23 H new ATOM 0 HZ2 LYS A 12 -3.634 -10.293 -18.742 1.00 72.23 H new ATOM 0 HZ3 LYS A 12 -3.493 -8.823 -19.580 1.00 72.23 H new ATOM 172 N ASN A 13 -8.143 -7.879 -18.774 1.00 61.21 N ATOM 173 CA ASN A 13 -8.512 -8.142 -20.158 1.00 62.45 C ATOM 174 C ASN A 13 -8.464 -6.842 -20.952 1.00 4.04 C ATOM 175 O ASN A 13 -7.984 -6.806 -22.084 1.00 51.30 O ATOM 176 CB ASN A 13 -9.914 -8.757 -20.240 1.00 41.54 C ATOM 177 CG ASN A 13 -10.323 -9.086 -21.664 1.00 54.25 C ATOM 178 OD1 ASN A 13 -9.493 -9.456 -22.495 1.00 22.13 O ATOM 179 ND2 ASN A 13 -11.607 -8.949 -21.958 1.00 23.44 N ATOM 0 H ASN A 13 -8.861 -8.119 -18.091 1.00 61.21 H new ATOM 0 HA ASN A 13 -7.803 -8.854 -20.581 1.00 62.45 H new ATOM 0 HB2 ASN A 13 -9.944 -9.665 -19.638 1.00 41.54 H new ATOM 0 HB3 ASN A 13 -10.637 -8.064 -19.809 1.00 41.54 H new ATOM 0 HD21 ASN A 13 -11.939 -9.153 -22.901 1.00 23.44 H new ATOM 0 HD22 ASN A 13 -12.264 -8.640 -21.242 1.00 23.44 H new ATOM 186 N ALA A 14 -8.919 -5.768 -20.317 1.00 71.23 N ATOM 187 CA ALA A 14 -8.956 -4.458 -20.948 1.00 44.04 C ATOM 188 C ALA A 14 -7.547 -3.949 -21.228 1.00 1.02 C ATOM 189 O ALA A 14 -7.321 -3.257 -22.221 1.00 13.41 O ATOM 190 CB ALA A 14 -9.722 -3.475 -20.076 1.00 30.25 C ATOM 0 H ALA A 14 -9.269 -5.782 -19.359 1.00 71.23 H new ATOM 0 HA ALA A 14 -9.474 -4.550 -21.903 1.00 44.04 H new ATOM 0 HB1 ALA A 14 -9.742 -2.498 -20.560 1.00 30.25 H new ATOM 0 HB2 ALA A 14 -10.742 -3.832 -19.936 1.00 30.25 H new ATOM 0 HB3 ALA A 14 -9.231 -3.389 -19.107 1.00 30.25 H new ATOM 196 N TYR A 15 -6.604 -4.312 -20.359 1.00 13.32 N ATOM 197 CA TYR A 15 -5.207 -3.928 -20.532 1.00 31.54 C ATOM 198 C TYR A 15 -4.679 -4.431 -21.871 1.00 12.11 C ATOM 199 O TYR A 15 -4.136 -3.664 -22.665 1.00 31.34 O ATOM 200 CB TYR A 15 -4.346 -4.474 -19.384 1.00 11.15 C ATOM 201 CG TYR A 15 -2.860 -4.273 -19.587 1.00 74.11 C ATOM 202 CD1 TYR A 15 -2.261 -3.045 -19.339 1.00 55.53 C ATOM 203 CD2 TYR A 15 -2.057 -5.317 -20.033 1.00 72.42 C ATOM 204 CE1 TYR A 15 -0.905 -2.862 -19.532 1.00 15.44 C ATOM 205 CE2 TYR A 15 -0.701 -5.141 -20.227 1.00 0.31 C ATOM 206 CZ TYR A 15 -0.130 -3.913 -19.974 1.00 3.30 C ATOM 207 OH TYR A 15 1.221 -3.735 -20.170 1.00 74.34 O ATOM 0 H TYR A 15 -6.785 -4.873 -19.527 1.00 13.32 H new ATOM 0 HA TYR A 15 -5.149 -2.840 -20.518 1.00 31.54 H new ATOM 0 HB2 TYR A 15 -4.645 -3.989 -18.455 1.00 11.15 H new ATOM 0 HB3 TYR A 15 -4.547 -5.539 -19.266 1.00 11.15 H new ATOM 0 HD1 TYR A 15 -2.864 -2.220 -18.990 1.00 55.53 H new ATOM 0 HD2 TYR A 15 -2.501 -6.281 -20.231 1.00 72.42 H new ATOM 0 HE1 TYR A 15 -0.454 -1.900 -19.337 1.00 15.44 H new ATOM 0 HE2 TYR A 15 -0.091 -5.962 -20.575 1.00 0.31 H new ATOM 0 HH TYR A 15 1.714 -4.116 -19.414 1.00 74.34 H new ATOM 217 N ASP A 16 -4.857 -5.720 -22.124 1.00 63.22 N ATOM 218 CA ASP A 16 -4.417 -6.312 -23.381 1.00 44.33 C ATOM 219 C ASP A 16 -5.195 -5.715 -24.544 1.00 53.31 C ATOM 220 O ASP A 16 -4.645 -5.488 -25.628 1.00 31.23 O ATOM 221 CB ASP A 16 -4.595 -7.832 -23.363 1.00 24.55 C ATOM 222 CG ASP A 16 -3.702 -8.517 -22.347 1.00 52.15 C ATOM 223 OD1 ASP A 16 -4.122 -8.658 -21.180 1.00 15.01 O ATOM 224 OD2 ASP A 16 -2.579 -8.924 -22.712 1.00 33.23 O ATOM 0 H ASP A 16 -5.301 -6.374 -21.479 1.00 63.22 H new ATOM 0 HA ASP A 16 -3.357 -6.090 -23.506 1.00 44.33 H new ATOM 0 HB2 ASP A 16 -5.636 -8.069 -23.143 1.00 24.55 H new ATOM 0 HB3 ASP A 16 -4.381 -8.230 -24.355 1.00 24.55 H new ATOM 229 N LEU A 17 -6.472 -5.440 -24.302 1.00 63.51 N ATOM 230 CA LEU A 17 -7.341 -4.860 -25.314 1.00 43.32 C ATOM 231 C LEU A 17 -6.857 -3.479 -25.743 1.00 41.12 C ATOM 232 O LEU A 17 -6.909 -3.148 -26.918 1.00 75.23 O ATOM 233 CB LEU A 17 -8.784 -4.773 -24.807 1.00 12.11 C ATOM 234 CG LEU A 17 -9.494 -6.118 -24.621 1.00 24.11 C ATOM 235 CD1 LEU A 17 -10.887 -5.913 -24.046 1.00 2.45 C ATOM 236 CD2 LEU A 17 -9.569 -6.873 -25.941 1.00 55.15 C ATOM 0 H LEU A 17 -6.929 -5.612 -23.406 1.00 63.51 H new ATOM 0 HA LEU A 17 -7.309 -5.517 -26.183 1.00 43.32 H new ATOM 0 HB2 LEU A 17 -8.786 -4.245 -23.853 1.00 12.11 H new ATOM 0 HB3 LEU A 17 -9.362 -4.169 -25.507 1.00 12.11 H new ATOM 0 HG LEU A 17 -8.915 -6.715 -23.916 1.00 24.11 H new ATOM 0 HD11 LEU A 17 -11.375 -6.880 -23.921 1.00 2.45 H new ATOM 0 HD12 LEU A 17 -10.812 -5.417 -23.078 1.00 2.45 H new ATOM 0 HD13 LEU A 17 -11.474 -5.295 -24.726 1.00 2.45 H new ATOM 0 HD21 LEU A 17 -10.077 -7.825 -25.787 1.00 55.15 H new ATOM 0 HD22 LEU A 17 -10.123 -6.280 -26.668 1.00 55.15 H new ATOM 0 HD23 LEU A 17 -8.561 -7.055 -26.314 1.00 55.15 H new ATOM 248 N LEU A 18 -6.401 -2.669 -24.797 1.00 54.21 N ATOM 249 CA LEU A 18 -5.926 -1.328 -25.127 1.00 35.45 C ATOM 250 C LEU A 18 -4.472 -1.335 -25.603 1.00 1.10 C ATOM 251 O LEU A 18 -4.129 -0.660 -26.569 1.00 54.11 O ATOM 252 CB LEU A 18 -6.125 -0.358 -23.944 1.00 61.33 C ATOM 253 CG LEU A 18 -5.505 -0.759 -22.598 1.00 42.02 C ATOM 254 CD1 LEU A 18 -4.066 -0.276 -22.482 1.00 73.12 C ATOM 255 CD2 LEU A 18 -6.340 -0.211 -21.454 1.00 63.33 C ATOM 0 H LEU A 18 -6.349 -2.910 -23.807 1.00 54.21 H new ATOM 0 HA LEU A 18 -6.532 -0.969 -25.959 1.00 35.45 H new ATOM 0 HB2 LEU A 18 -5.716 0.611 -24.229 1.00 61.33 H new ATOM 0 HB3 LEU A 18 -7.196 -0.221 -23.795 1.00 61.33 H new ATOM 0 HG LEU A 18 -5.495 -1.848 -22.543 1.00 42.02 H new ATOM 0 HD11 LEU A 18 -3.658 -0.577 -21.517 1.00 73.12 H new ATOM 0 HD12 LEU A 18 -3.469 -0.715 -23.281 1.00 73.12 H new ATOM 0 HD13 LEU A 18 -4.039 0.811 -22.564 1.00 73.12 H new ATOM 0 HD21 LEU A 18 -5.891 -0.501 -20.504 1.00 63.33 H new ATOM 0 HD22 LEU A 18 -6.378 0.876 -21.520 1.00 63.33 H new ATOM 0 HD23 LEU A 18 -7.351 -0.614 -21.516 1.00 63.33 H new ATOM 267 N HIS A 19 -3.630 -2.125 -24.950 1.00 14.34 N ATOM 268 CA HIS A 19 -2.194 -2.096 -25.215 1.00 5.34 C ATOM 269 C HIS A 19 -1.842 -2.780 -26.534 1.00 42.24 C ATOM 270 O HIS A 19 -1.037 -2.267 -27.309 1.00 21.22 O ATOM 271 CB HIS A 19 -1.431 -2.749 -24.055 1.00 42.12 C ATOM 272 CG HIS A 19 0.060 -2.769 -24.230 1.00 64.12 C ATOM 273 ND1 HIS A 19 0.816 -1.632 -24.418 1.00 23.23 N ATOM 274 CD2 HIS A 19 0.934 -3.802 -24.245 1.00 55.02 C ATOM 275 CE1 HIS A 19 2.086 -1.963 -24.540 1.00 3.22 C ATOM 276 NE2 HIS A 19 2.185 -3.274 -24.437 1.00 23.12 N ATOM 0 H HIS A 19 -3.914 -2.793 -24.234 1.00 14.34 H new ATOM 0 HA HIS A 19 -1.895 -1.051 -25.301 1.00 5.34 H new ATOM 0 HB2 HIS A 19 -1.670 -2.218 -23.134 1.00 42.12 H new ATOM 0 HB3 HIS A 19 -1.785 -3.773 -23.934 1.00 42.12 H new ATOM 0 HD1 HIS A 19 0.449 -0.681 -24.457 1.00 23.23 H new ATOM 0 HD2 HIS A 19 0.691 -4.848 -24.128 1.00 55.02 H new ATOM 0 HE1 HIS A 19 2.906 -1.278 -24.697 1.00 3.22 H new ATOM 285 N ASN A 20 -2.435 -3.936 -26.787 1.00 2.11 N ATOM 286 CA ASN A 20 -2.084 -4.716 -27.970 1.00 62.51 C ATOM 287 C ASN A 20 -3.157 -4.624 -29.044 1.00 72.21 C ATOM 288 O ASN A 20 -2.851 -4.485 -30.228 1.00 25.21 O ATOM 289 CB ASN A 20 -1.850 -6.183 -27.600 1.00 2.33 C ATOM 290 CG ASN A 20 -0.600 -6.387 -26.765 1.00 41.15 C ATOM 291 OD1 ASN A 20 -0.641 -6.322 -25.536 1.00 43.14 O ATOM 292 ND2 ASN A 20 0.520 -6.641 -27.427 1.00 13.34 N ATOM 0 H ASN A 20 -3.155 -4.354 -26.198 1.00 2.11 H new ATOM 0 HA ASN A 20 -1.163 -4.294 -28.372 1.00 62.51 H new ATOM 0 HB2 ASN A 20 -2.714 -6.556 -27.050 1.00 2.33 H new ATOM 0 HB3 ASN A 20 -1.773 -6.775 -28.512 1.00 2.33 H new ATOM 0 HD21 ASN A 20 1.391 -6.791 -26.917 1.00 13.34 H new ATOM 0 HD22 ASN A 20 0.511 -6.686 -28.446 1.00 13.34 H new ATOM 299 N LYS A 21 -4.414 -4.700 -28.632 1.00 25.31 N ATOM 300 CA LYS A 21 -5.527 -4.719 -29.579 1.00 11.30 C ATOM 301 C LYS A 21 -5.952 -3.303 -29.931 1.00 72.10 C ATOM 302 O LYS A 21 -6.704 -3.094 -30.880 1.00 15.11 O ATOM 303 CB LYS A 21 -6.717 -5.474 -28.983 1.00 51.12 C ATOM 304 CG LYS A 21 -6.319 -6.730 -28.231 1.00 4.50 C ATOM 305 CD LYS A 21 -5.597 -7.719 -29.124 1.00 12.34 C ATOM 306 CE LYS A 21 -4.839 -8.736 -28.296 1.00 51.51 C ATOM 307 NZ LYS A 21 -4.292 -9.841 -29.126 1.00 33.23 N ATOM 0 H LYS A 21 -4.692 -4.750 -27.652 1.00 25.31 H new ATOM 0 HA LYS A 21 -5.195 -5.226 -30.485 1.00 11.30 H new ATOM 0 HB2 LYS A 21 -7.257 -4.811 -28.307 1.00 51.12 H new ATOM 0 HB3 LYS A 21 -7.406 -5.742 -29.784 1.00 51.12 H new ATOM 0 HG2 LYS A 21 -5.677 -6.462 -27.392 1.00 4.50 H new ATOM 0 HG3 LYS A 21 -7.209 -7.201 -27.814 1.00 4.50 H new ATOM 0 HD2 LYS A 21 -6.316 -8.229 -29.766 1.00 12.34 H new ATOM 0 HD3 LYS A 21 -4.906 -7.188 -29.778 1.00 12.34 H new ATOM 0 HE2 LYS A 21 -4.023 -8.239 -27.772 1.00 51.51 H new ATOM 0 HE3 LYS A 21 -5.502 -9.149 -27.535 1.00 51.51 H new ATOM 0 HZ1 LYS A 21 -3.782 -10.512 -28.517 1.00 33.23 H new ATOM 0 HZ2 LYS A 21 -5.072 -10.333 -29.607 1.00 33.23 H new ATOM 0 HZ3 LYS A 21 -3.639 -9.452 -29.836 1.00 33.23 H new ATOM 321 N HIS A 22 -5.444 -2.348 -29.150 1.00 10.21 N ATOM 322 CA HIS A 22 -5.807 -0.923 -29.252 1.00 33.04 C ATOM 323 C HIS A 22 -7.312 -0.731 -29.447 1.00 30.14 C ATOM 324 O HIS A 22 -7.755 0.062 -30.277 1.00 40.11 O ATOM 325 CB HIS A 22 -4.991 -0.173 -30.331 1.00 23.15 C ATOM 326 CG HIS A 22 -4.981 -0.791 -31.696 1.00 73.22 C ATOM 327 ND1 HIS A 22 -5.927 -0.521 -32.657 1.00 75.30 N ATOM 328 CD2 HIS A 22 -4.110 -1.659 -32.262 1.00 53.12 C ATOM 329 CE1 HIS A 22 -5.641 -1.195 -33.754 1.00 74.13 C ATOM 330 NE2 HIS A 22 -4.541 -1.892 -33.543 1.00 32.33 N ATOM 0 H HIS A 22 -4.760 -2.539 -28.418 1.00 10.21 H new ATOM 0 HA HIS A 22 -5.541 -0.472 -28.296 1.00 33.04 H new ATOM 0 HB2 HIS A 22 -5.384 0.840 -30.416 1.00 23.15 H new ATOM 0 HB3 HIS A 22 -3.961 -0.088 -29.985 1.00 23.15 H new ATOM 0 HD2 HIS A 22 -3.238 -2.088 -31.792 1.00 53.12 H new ATOM 0 HE1 HIS A 22 -6.211 -1.179 -34.671 1.00 74.13 H new ATOM 0 HE2 HIS A 22 -4.086 -2.503 -34.221 1.00 32.33 H new ATOM 339 N GLN A 23 -8.088 -1.464 -28.658 1.00 0.20 N ATOM 340 CA GLN A 23 -9.538 -1.316 -28.637 1.00 23.23 C ATOM 341 C GLN A 23 -9.910 -0.076 -27.833 1.00 54.13 C ATOM 342 O GLN A 23 -10.876 0.627 -28.136 1.00 53.53 O ATOM 343 CB GLN A 23 -10.183 -2.555 -28.006 1.00 31.32 C ATOM 344 CG GLN A 23 -11.695 -2.467 -27.867 1.00 53.25 C ATOM 345 CD GLN A 23 -12.256 -3.534 -26.945 1.00 75.53 C ATOM 346 OE1 GLN A 23 -12.335 -3.334 -25.735 1.00 2.42 O ATOM 347 NE2 GLN A 23 -12.653 -4.666 -27.502 1.00 10.30 N ATOM 0 H GLN A 23 -7.732 -2.174 -28.018 1.00 0.20 H new ATOM 0 HA GLN A 23 -9.902 -1.210 -29.659 1.00 23.23 H new ATOM 0 HB2 GLN A 23 -9.935 -3.428 -28.610 1.00 31.32 H new ATOM 0 HB3 GLN A 23 -9.747 -2.716 -27.020 1.00 31.32 H new ATOM 0 HG2 GLN A 23 -11.965 -1.482 -27.485 1.00 53.25 H new ATOM 0 HG3 GLN A 23 -12.154 -2.564 -28.851 1.00 53.25 H new ATOM 0 HE21 GLN A 23 -12.571 -4.794 -28.511 1.00 10.30 H new ATOM 0 HE22 GLN A 23 -13.041 -5.411 -26.923 1.00 10.30 H new ATOM 356 N HIS A 24 -9.122 0.180 -26.804 1.00 51.24 N ATOM 357 CA HIS A 24 -9.328 1.324 -25.936 1.00 22.33 C ATOM 358 C HIS A 24 -8.031 2.103 -25.796 1.00 74.43 C ATOM 359 O HIS A 24 -6.982 1.640 -26.237 1.00 64.42 O ATOM 360 CB HIS A 24 -9.834 0.874 -24.559 1.00 4.52 C ATOM 361 CG HIS A 24 -11.283 0.491 -24.544 1.00 74.24 C ATOM 362 ND1 HIS A 24 -11.742 -0.737 -24.118 1.00 70.35 N ATOM 363 CD2 HIS A 24 -12.382 1.197 -24.892 1.00 63.20 C ATOM 364 CE1 HIS A 24 -13.061 -0.765 -24.207 1.00 54.30 C ATOM 365 NE2 HIS A 24 -13.473 0.396 -24.675 1.00 1.21 N ATOM 0 H HIS A 24 -8.322 -0.399 -26.547 1.00 51.24 H new ATOM 0 HA HIS A 24 -10.085 1.971 -26.380 1.00 22.33 H new ATOM 0 HB2 HIS A 24 -9.239 0.024 -24.223 1.00 4.52 H new ATOM 0 HB3 HIS A 24 -9.673 1.679 -23.842 1.00 4.52 H new ATOM 0 HD2 HIS A 24 -12.398 2.208 -25.272 1.00 63.20 H new ATOM 0 HE1 HIS A 24 -13.694 -1.599 -23.941 1.00 54.30 H new ATOM 0 HE2 HIS A 24 -14.444 0.656 -24.847 1.00 1.21 H new ATOM 374 N SER A 25 -8.108 3.281 -25.204 1.00 55.04 N ATOM 375 CA SER A 25 -6.925 4.095 -24.981 1.00 63.32 C ATOM 376 C SER A 25 -6.519 4.061 -23.513 1.00 64.42 C ATOM 377 O SER A 25 -5.428 3.607 -23.165 1.00 74.11 O ATOM 378 CB SER A 25 -7.193 5.533 -25.425 1.00 12.51 C ATOM 379 OG SER A 25 -8.405 6.015 -24.865 1.00 12.24 O ATOM 0 H SER A 25 -8.977 3.696 -24.869 1.00 55.04 H new ATOM 0 HA SER A 25 -6.104 3.688 -25.571 1.00 63.32 H new ATOM 0 HB2 SER A 25 -6.366 6.173 -25.119 1.00 12.51 H new ATOM 0 HB3 SER A 25 -7.246 5.579 -26.513 1.00 12.51 H new ATOM 0 HG SER A 25 -9.095 6.049 -25.560 1.00 12.24 H new ATOM 385 N TYR A 26 -7.408 4.537 -22.654 1.00 43.11 N ATOM 386 CA TYR A 26 -7.144 4.579 -21.228 1.00 13.51 C ATOM 387 C TYR A 26 -8.191 3.784 -20.465 1.00 22.31 C ATOM 388 O TYR A 26 -9.298 3.550 -20.961 1.00 53.53 O ATOM 389 CB TYR A 26 -7.132 6.030 -20.726 1.00 70.02 C ATOM 390 CG TYR A 26 -8.499 6.688 -20.682 1.00 4.13 C ATOM 391 CD1 TYR A 26 -9.289 6.608 -19.541 1.00 61.52 C ATOM 392 CD2 TYR A 26 -8.997 7.387 -21.776 1.00 45.22 C ATOM 393 CE1 TYR A 26 -10.535 7.200 -19.491 1.00 22.50 C ATOM 394 CE2 TYR A 26 -10.243 7.985 -21.732 1.00 51.53 C ATOM 395 CZ TYR A 26 -11.007 7.887 -20.588 1.00 22.14 C ATOM 396 OH TYR A 26 -12.251 8.475 -20.539 1.00 51.31 O ATOM 0 H TYR A 26 -8.322 4.901 -22.924 1.00 43.11 H new ATOM 0 HA TYR A 26 -6.165 4.133 -21.053 1.00 13.51 H new ATOM 0 HB2 TYR A 26 -6.699 6.052 -19.726 1.00 70.02 H new ATOM 0 HB3 TYR A 26 -6.479 6.619 -21.370 1.00 70.02 H new ATOM 0 HD1 TYR A 26 -8.921 6.073 -18.678 1.00 61.52 H new ATOM 0 HD2 TYR A 26 -8.402 7.464 -22.674 1.00 45.22 H new ATOM 0 HE1 TYR A 26 -11.136 7.125 -18.597 1.00 22.50 H new ATOM 0 HE2 TYR A 26 -10.616 8.526 -22.589 1.00 51.53 H new ATOM 0 HH TYR A 26 -12.436 8.921 -21.392 1.00 51.31 H new ATOM 406 N ILE A 27 -7.828 3.363 -19.271 1.00 10.33 N ATOM 407 CA ILE A 27 -8.774 2.773 -18.350 1.00 20.23 C ATOM 408 C ILE A 27 -8.460 3.220 -16.926 1.00 43.20 C ATOM 409 O ILE A 27 -7.309 3.174 -16.484 1.00 42.31 O ATOM 410 CB ILE A 27 -8.790 1.230 -18.436 1.00 64.54 C ATOM 411 CG1 ILE A 27 -9.755 0.641 -17.400 1.00 45.12 C ATOM 412 CG2 ILE A 27 -7.392 0.665 -18.256 1.00 34.21 C ATOM 413 CD1 ILE A 27 -9.849 -0.870 -17.447 1.00 62.44 C ATOM 0 H ILE A 27 -6.874 3.420 -18.914 1.00 10.33 H new ATOM 0 HA ILE A 27 -9.768 3.121 -18.632 1.00 20.23 H new ATOM 0 HB ILE A 27 -9.142 0.947 -19.428 1.00 64.54 H new ATOM 0 HG12 ILE A 27 -9.435 0.946 -16.404 1.00 45.12 H new ATOM 0 HG13 ILE A 27 -10.747 1.063 -17.559 1.00 45.12 H new ATOM 0 HG21 ILE A 27 -7.428 -0.423 -18.320 1.00 34.21 H new ATOM 0 HG22 ILE A 27 -6.739 1.053 -19.038 1.00 34.21 H new ATOM 0 HG23 ILE A 27 -7.004 0.958 -17.280 1.00 34.21 H new ATOM 0 HD11 ILE A 27 -10.550 -1.215 -16.686 1.00 62.44 H new ATOM 0 HD12 ILE A 27 -10.199 -1.182 -18.431 1.00 62.44 H new ATOM 0 HD13 ILE A 27 -8.866 -1.302 -17.257 1.00 62.44 H new ATOM 425 N ILE A 28 -9.477 3.698 -16.235 1.00 50.42 N ATOM 426 CA ILE A 28 -9.336 4.127 -14.856 1.00 52.01 C ATOM 427 C ILE A 28 -9.722 2.985 -13.918 1.00 13.01 C ATOM 428 O ILE A 28 -10.641 2.225 -14.214 1.00 73.24 O ATOM 429 CB ILE A 28 -10.214 5.369 -14.572 1.00 44.24 C ATOM 430 CG1 ILE A 28 -9.912 6.469 -15.597 1.00 75.42 C ATOM 431 CG2 ILE A 28 -9.979 5.887 -13.158 1.00 1.42 C ATOM 432 CD1 ILE A 28 -10.755 7.719 -15.429 1.00 54.34 C ATOM 0 H ILE A 28 -10.420 3.800 -16.611 1.00 50.42 H new ATOM 0 HA ILE A 28 -8.295 4.400 -14.683 1.00 52.01 H new ATOM 0 HB ILE A 28 -11.261 5.079 -14.658 1.00 44.24 H new ATOM 0 HG12 ILE A 28 -8.859 6.741 -15.523 1.00 75.42 H new ATOM 0 HG13 ILE A 28 -10.068 6.070 -16.599 1.00 75.42 H new ATOM 0 HG21 ILE A 28 -10.607 6.760 -12.981 1.00 1.42 H new ATOM 0 HG22 ILE A 28 -10.230 5.108 -12.439 1.00 1.42 H new ATOM 0 HG23 ILE A 28 -8.931 6.164 -13.041 1.00 1.42 H new ATOM 0 HD11 ILE A 28 -10.481 8.448 -16.192 1.00 54.34 H new ATOM 0 HD12 ILE A 28 -11.809 7.464 -15.534 1.00 54.34 H new ATOM 0 HD13 ILE A 28 -10.581 8.145 -14.441 1.00 54.34 H new ATOM 444 N PHE A 29 -9.010 2.857 -12.808 1.00 44.30 N ATOM 445 CA PHE A 29 -9.257 1.787 -11.852 1.00 42.32 C ATOM 446 C PHE A 29 -9.649 2.360 -10.496 1.00 75.25 C ATOM 447 O PHE A 29 -9.197 3.445 -10.119 1.00 5.11 O ATOM 448 CB PHE A 29 -8.004 0.924 -11.669 1.00 13.54 C ATOM 449 CG PHE A 29 -7.425 0.376 -12.941 1.00 62.50 C ATOM 450 CD1 PHE A 29 -7.919 -0.791 -13.495 1.00 42.55 C ATOM 451 CD2 PHE A 29 -6.377 1.024 -13.573 1.00 31.01 C ATOM 452 CE1 PHE A 29 -7.378 -1.303 -14.658 1.00 23.23 C ATOM 453 CE2 PHE A 29 -5.831 0.516 -14.735 1.00 60.34 C ATOM 454 CZ PHE A 29 -6.333 -0.649 -15.279 1.00 34.14 C ATOM 0 H PHE A 29 -8.251 3.486 -12.546 1.00 44.30 H new ATOM 0 HA PHE A 29 -10.070 1.177 -12.245 1.00 42.32 H new ATOM 0 HB2 PHE A 29 -7.241 1.518 -11.166 1.00 13.54 H new ATOM 0 HB3 PHE A 29 -8.247 0.091 -11.009 1.00 13.54 H new ATOM 0 HD1 PHE A 29 -8.736 -1.307 -13.013 1.00 42.55 H new ATOM 0 HD2 PHE A 29 -5.982 1.937 -13.152 1.00 31.01 H new ATOM 0 HE1 PHE A 29 -7.772 -2.215 -15.081 1.00 23.23 H new ATOM 0 HE2 PHE A 29 -5.012 1.029 -15.217 1.00 60.34 H new ATOM 0 HZ PHE A 29 -5.909 -1.048 -16.189 1.00 34.14 H new ATOM 464 N LYS A 30 -10.482 1.631 -9.767 1.00 4.34 N ATOM 465 CA LYS A 30 -10.790 1.971 -8.387 1.00 61.44 C ATOM 466 C LYS A 30 -11.040 0.707 -7.577 1.00 42.54 C ATOM 467 O LYS A 30 -11.289 -0.359 -8.146 1.00 64.25 O ATOM 468 CB LYS A 30 -11.980 2.947 -8.285 1.00 32.15 C ATOM 469 CG LYS A 30 -13.230 2.573 -9.083 1.00 12.02 C ATOM 470 CD LYS A 30 -13.969 1.373 -8.506 1.00 72.41 C ATOM 471 CE LYS A 30 -15.427 1.337 -8.950 1.00 2.24 C ATOM 472 NZ LYS A 30 -15.582 1.537 -10.416 1.00 0.22 N ATOM 0 H LYS A 30 -10.958 0.797 -10.111 1.00 4.34 H new ATOM 0 HA LYS A 30 -9.926 2.486 -7.968 1.00 61.44 H new ATOM 0 HB2 LYS A 30 -12.259 3.039 -7.235 1.00 32.15 H new ATOM 0 HB3 LYS A 30 -11.645 3.931 -8.614 1.00 32.15 H new ATOM 0 HG2 LYS A 30 -13.905 3.428 -9.112 1.00 12.02 H new ATOM 0 HG3 LYS A 30 -12.945 2.356 -10.113 1.00 12.02 H new ATOM 0 HD2 LYS A 30 -13.471 0.455 -8.819 1.00 72.41 H new ATOM 0 HD3 LYS A 30 -13.922 1.406 -7.418 1.00 72.41 H new ATOM 0 HE2 LYS A 30 -15.865 0.379 -8.669 1.00 2.24 H new ATOM 0 HE3 LYS A 30 -15.984 2.110 -8.420 1.00 2.24 H new ATOM 0 HZ1 LYS A 30 -16.546 1.272 -10.703 1.00 0.22 H new ATOM 0 HZ2 LYS A 30 -15.414 2.536 -10.650 1.00 0.22 H new ATOM 0 HZ3 LYS A 30 -14.895 0.943 -10.922 1.00 0.22 H new ATOM 486 N ILE A 31 -10.954 0.827 -6.259 1.00 14.00 N ATOM 487 CA ILE A 31 -11.180 -0.302 -5.371 1.00 2.13 C ATOM 488 C ILE A 31 -12.674 -0.493 -5.147 1.00 62.44 C ATOM 489 O ILE A 31 -13.356 0.396 -4.636 1.00 75.11 O ATOM 490 CB ILE A 31 -10.473 -0.124 -4.000 1.00 64.51 C ATOM 491 CG1 ILE A 31 -8.948 -0.020 -4.160 1.00 53.22 C ATOM 492 CG2 ILE A 31 -10.818 -1.276 -3.067 1.00 14.25 C ATOM 493 CD1 ILE A 31 -8.456 1.346 -4.600 1.00 65.43 C ATOM 0 H ILE A 31 -10.728 1.699 -5.781 1.00 14.00 H new ATOM 0 HA ILE A 31 -10.754 -1.182 -5.853 1.00 2.13 H new ATOM 0 HB ILE A 31 -10.833 0.809 -3.566 1.00 64.51 H new ATOM 0 HG12 ILE A 31 -8.477 -0.274 -3.210 1.00 53.22 H new ATOM 0 HG13 ILE A 31 -8.620 -0.763 -4.887 1.00 53.22 H new ATOM 0 HG21 ILE A 31 -10.313 -1.134 -2.111 1.00 14.25 H new ATOM 0 HG22 ILE A 31 -11.896 -1.305 -2.908 1.00 14.25 H new ATOM 0 HG23 ILE A 31 -10.492 -2.216 -3.513 1.00 14.25 H new ATOM 0 HD11 ILE A 31 -7.370 1.331 -4.688 1.00 65.43 H new ATOM 0 HD12 ILE A 31 -8.895 1.597 -5.566 1.00 65.43 H new ATOM 0 HD13 ILE A 31 -8.750 2.093 -3.863 1.00 65.43 H new ATOM 505 N ASP A 32 -13.176 -1.645 -5.553 1.00 21.30 N ATOM 506 CA ASP A 32 -14.591 -1.953 -5.426 1.00 1.44 C ATOM 507 C ASP A 32 -14.811 -2.981 -4.323 1.00 43.31 C ATOM 508 O ASP A 32 -13.895 -3.742 -4.000 1.00 31.42 O ATOM 509 CB ASP A 32 -15.137 -2.474 -6.761 1.00 1.14 C ATOM 510 CG ASP A 32 -16.640 -2.670 -6.754 1.00 63.22 C ATOM 511 OD1 ASP A 32 -17.354 -1.816 -6.188 1.00 44.44 O ATOM 512 OD2 ASP A 32 -17.118 -3.663 -7.342 1.00 61.43 O ATOM 0 H ASP A 32 -12.621 -2.389 -5.977 1.00 21.30 H new ATOM 0 HA ASP A 32 -15.128 -1.042 -5.160 1.00 1.44 H new ATOM 0 HB2 ASP A 32 -14.872 -1.774 -7.553 1.00 1.14 H new ATOM 0 HB3 ASP A 32 -14.654 -3.422 -6.999 1.00 1.14 H new ATOM 517 N LYS A 33 -16.026 -2.966 -3.756 1.00 12.21 N ATOM 518 CA LYS A 33 -16.472 -3.868 -2.674 1.00 35.55 C ATOM 519 C LYS A 33 -15.577 -3.795 -1.431 1.00 35.12 C ATOM 520 O LYS A 33 -14.455 -3.291 -1.464 1.00 45.03 O ATOM 521 CB LYS A 33 -16.628 -5.329 -3.156 1.00 75.31 C ATOM 522 CG LYS A 33 -15.325 -6.089 -3.361 1.00 3.24 C ATOM 523 CD LYS A 33 -15.566 -7.543 -3.738 1.00 45.14 C ATOM 524 CE LYS A 33 -16.334 -7.672 -5.043 1.00 23.43 C ATOM 525 NZ LYS A 33 -16.462 -9.091 -5.472 1.00 0.41 N ATOM 0 H LYS A 33 -16.750 -2.308 -4.043 1.00 12.21 H new ATOM 0 HA LYS A 33 -17.458 -3.508 -2.381 1.00 35.55 H new ATOM 0 HB2 LYS A 33 -17.235 -5.871 -2.431 1.00 75.31 H new ATOM 0 HB3 LYS A 33 -17.180 -5.327 -4.096 1.00 75.31 H new ATOM 0 HG2 LYS A 33 -14.742 -5.604 -4.143 1.00 3.24 H new ATOM 0 HG3 LYS A 33 -14.732 -6.045 -2.447 1.00 3.24 H new ATOM 0 HD2 LYS A 33 -14.609 -8.058 -3.828 1.00 45.14 H new ATOM 0 HD3 LYS A 33 -16.121 -8.037 -2.940 1.00 45.14 H new ATOM 0 HE2 LYS A 33 -17.327 -7.237 -4.925 1.00 23.43 H new ATOM 0 HE3 LYS A 33 -15.827 -7.102 -5.821 1.00 23.43 H new ATOM 0 HZ1 LYS A 33 -16.992 -9.137 -6.366 1.00 0.41 H new ATOM 0 HZ2 LYS A 33 -15.515 -9.499 -5.609 1.00 0.41 H new ATOM 0 HZ3 LYS A 33 -16.969 -9.630 -4.741 1.00 0.41 H new ATOM 539 N ASN A 34 -16.092 -4.298 -0.317 1.00 2.33 N ATOM 540 CA ASN A 34 -15.352 -4.284 0.942 1.00 3.45 C ATOM 541 C ASN A 34 -14.287 -5.371 0.946 1.00 65.32 C ATOM 542 O ASN A 34 -13.328 -5.315 1.715 1.00 33.44 O ATOM 543 CB ASN A 34 -16.296 -4.464 2.135 1.00 73.01 C ATOM 544 CG ASN A 34 -17.127 -3.225 2.421 1.00 44.14 C ATOM 545 OD1 ASN A 34 -16.722 -2.358 3.196 1.00 61.35 O ATOM 546 ND2 ASN A 34 -18.291 -3.129 1.799 1.00 4.44 N ATOM 0 H ASN A 34 -17.018 -4.721 -0.257 1.00 2.33 H new ATOM 0 HA ASN A 34 -14.864 -3.314 1.035 1.00 3.45 H new ATOM 0 HB2 ASN A 34 -16.961 -5.305 1.942 1.00 73.01 H new ATOM 0 HB3 ASN A 34 -15.712 -4.716 3.020 1.00 73.01 H new ATOM 0 HD21 ASN A 34 -18.887 -2.316 1.955 1.00 4.44 H new ATOM 0 HD22 ASN A 34 -18.592 -3.868 1.164 1.00 4.44 H new ATOM 553 N ASP A 35 -14.457 -6.353 0.068 1.00 75.22 N ATOM 554 CA ASP A 35 -13.489 -7.439 -0.089 1.00 30.42 C ATOM 555 C ASP A 35 -12.282 -6.960 -0.907 1.00 74.01 C ATOM 556 O ASP A 35 -11.372 -7.731 -1.210 1.00 74.30 O ATOM 557 CB ASP A 35 -14.172 -8.638 -0.764 1.00 3.14 C ATOM 558 CG ASP A 35 -13.320 -9.893 -0.781 1.00 2.45 C ATOM 559 OD1 ASP A 35 -13.123 -10.498 0.293 1.00 2.43 O ATOM 560 OD2 ASP A 35 -12.868 -10.295 -1.875 1.00 10.41 O ATOM 0 H ASP A 35 -15.263 -6.422 -0.553 1.00 75.22 H new ATOM 0 HA ASP A 35 -13.127 -7.749 0.891 1.00 30.42 H new ATOM 0 HB2 ASP A 35 -15.107 -8.851 -0.246 1.00 3.14 H new ATOM 0 HB3 ASP A 35 -14.429 -8.369 -1.789 1.00 3.14 H new ATOM 565 N THR A 36 -12.301 -5.667 -1.249 1.00 5.03 N ATOM 566 CA THR A 36 -11.206 -4.978 -1.943 1.00 23.24 C ATOM 567 C THR A 36 -10.804 -5.648 -3.256 1.00 61.40 C ATOM 568 O THR A 36 -9.971 -6.557 -3.285 1.00 33.33 O ATOM 569 CB THR A 36 -9.960 -4.785 -1.041 1.00 1.22 C ATOM 570 OG1 THR A 36 -9.538 -6.027 -0.465 1.00 4.33 O ATOM 571 CG2 THR A 36 -10.253 -3.786 0.067 1.00 21.43 C ATOM 0 H THR A 36 -13.094 -5.058 -1.047 1.00 5.03 H new ATOM 0 HA THR A 36 -11.609 -3.995 -2.188 1.00 23.24 H new ATOM 0 HB THR A 36 -9.156 -4.402 -1.670 1.00 1.22 H new ATOM 0 HG1 THR A 36 -9.919 -6.771 -0.977 1.00 4.33 H new ATOM 0 HG21 THR A 36 -9.367 -3.663 0.690 1.00 21.43 H new ATOM 0 HG22 THR A 36 -10.524 -2.826 -0.371 1.00 21.43 H new ATOM 0 HG23 THR A 36 -11.078 -4.152 0.678 1.00 21.43 H new ATOM 579 N ALA A 37 -11.414 -5.195 -4.338 1.00 74.30 N ATOM 580 CA ALA A 37 -11.056 -5.655 -5.668 1.00 3.21 C ATOM 581 C ALA A 37 -10.786 -4.471 -6.582 1.00 31.04 C ATOM 582 O ALA A 37 -11.594 -3.547 -6.659 1.00 24.41 O ATOM 583 CB ALA A 37 -12.163 -6.520 -6.245 1.00 54.54 C ATOM 0 H ALA A 37 -12.164 -4.504 -4.320 1.00 74.30 H new ATOM 0 HA ALA A 37 -10.148 -6.254 -5.594 1.00 3.21 H new ATOM 0 HB1 ALA A 37 -11.879 -6.857 -7.242 1.00 54.54 H new ATOM 0 HB2 ALA A 37 -12.322 -7.385 -5.601 1.00 54.54 H new ATOM 0 HB3 ALA A 37 -13.084 -5.940 -6.306 1.00 54.54 H new ATOM 589 N ILE A 38 -9.649 -4.487 -7.260 1.00 2.45 N ATOM 590 CA ILE A 38 -9.340 -3.448 -8.229 1.00 5.45 C ATOM 591 C ILE A 38 -10.163 -3.694 -9.480 1.00 61.44 C ATOM 592 O ILE A 38 -10.040 -4.745 -10.098 1.00 24.50 O ATOM 593 CB ILE A 38 -7.845 -3.450 -8.608 1.00 0.51 C ATOM 594 CG1 ILE A 38 -6.968 -3.447 -7.353 1.00 23.42 C ATOM 595 CG2 ILE A 38 -7.518 -2.250 -9.486 1.00 73.33 C ATOM 596 CD1 ILE A 38 -5.497 -3.658 -7.648 1.00 4.21 C ATOM 0 H ILE A 38 -8.930 -5.203 -7.158 1.00 2.45 H new ATOM 0 HA ILE A 38 -9.576 -2.481 -7.785 1.00 5.45 H new ATOM 0 HB ILE A 38 -7.636 -4.360 -9.170 1.00 0.51 H new ATOM 0 HG12 ILE A 38 -7.094 -2.498 -6.832 1.00 23.42 H new ATOM 0 HG13 ILE A 38 -7.311 -4.230 -6.677 1.00 23.42 H new ATOM 0 HG21 ILE A 38 -6.459 -2.266 -9.745 1.00 73.33 H new ATOM 0 HG22 ILE A 38 -8.115 -2.292 -10.397 1.00 73.33 H new ATOM 0 HG23 ILE A 38 -7.746 -1.331 -8.946 1.00 73.33 H new ATOM 0 HD11 ILE A 38 -4.933 -3.645 -6.715 1.00 4.21 H new ATOM 0 HD12 ILE A 38 -5.359 -4.620 -8.142 1.00 4.21 H new ATOM 0 HD13 ILE A 38 -5.139 -2.861 -8.300 1.00 4.21 H new ATOM 608 N VAL A 39 -10.986 -2.732 -9.860 1.00 62.44 N ATOM 609 CA VAL A 39 -11.884 -2.924 -10.983 1.00 31.24 C ATOM 610 C VAL A 39 -11.987 -1.650 -11.819 1.00 20.44 C ATOM 611 O VAL A 39 -11.526 -0.582 -11.402 1.00 74.24 O ATOM 612 CB VAL A 39 -13.289 -3.361 -10.495 1.00 42.03 C ATOM 613 CG1 VAL A 39 -14.085 -2.176 -9.965 1.00 42.30 C ATOM 614 CG2 VAL A 39 -14.053 -4.087 -11.595 1.00 62.05 C ATOM 0 H VAL A 39 -11.050 -1.818 -9.411 1.00 62.44 H new ATOM 0 HA VAL A 39 -11.474 -3.716 -11.609 1.00 31.24 H new ATOM 0 HB VAL A 39 -13.148 -4.060 -9.670 1.00 42.03 H new ATOM 0 HG11 VAL A 39 -15.065 -2.516 -9.631 1.00 42.30 H new ATOM 0 HG12 VAL A 39 -13.552 -1.725 -9.128 1.00 42.30 H new ATOM 0 HG13 VAL A 39 -14.208 -1.437 -10.757 1.00 42.30 H new ATOM 0 HG21 VAL A 39 -15.034 -4.381 -11.223 1.00 62.05 H new ATOM 0 HG22 VAL A 39 -14.173 -3.425 -12.452 1.00 62.05 H new ATOM 0 HG23 VAL A 39 -13.499 -4.975 -11.898 1.00 62.05 H new ATOM 624 N VAL A 40 -12.591 -1.779 -12.992 1.00 15.24 N ATOM 625 CA VAL A 40 -12.760 -0.666 -13.916 1.00 51.34 C ATOM 626 C VAL A 40 -13.576 0.465 -13.294 1.00 44.04 C ATOM 627 O VAL A 40 -14.624 0.235 -12.689 1.00 41.42 O ATOM 628 CB VAL A 40 -13.464 -1.126 -15.210 1.00 22.53 C ATOM 629 CG1 VAL A 40 -13.569 0.017 -16.206 1.00 53.03 C ATOM 630 CG2 VAL A 40 -12.737 -2.308 -15.829 1.00 53.11 C ATOM 0 H VAL A 40 -12.978 -2.660 -13.330 1.00 15.24 H new ATOM 0 HA VAL A 40 -11.761 -0.298 -14.148 1.00 51.34 H new ATOM 0 HB VAL A 40 -14.473 -1.444 -14.948 1.00 22.53 H new ATOM 0 HG11 VAL A 40 -14.069 -0.332 -17.109 1.00 53.03 H new ATOM 0 HG12 VAL A 40 -14.144 0.832 -15.766 1.00 53.03 H new ATOM 0 HG13 VAL A 40 -12.570 0.373 -16.458 1.00 53.03 H new ATOM 0 HG21 VAL A 40 -13.251 -2.615 -16.740 1.00 53.11 H new ATOM 0 HG22 VAL A 40 -11.714 -2.020 -16.069 1.00 53.11 H new ATOM 0 HG23 VAL A 40 -12.724 -3.138 -15.122 1.00 53.11 H new ATOM 640 N GLU A 41 -13.066 1.676 -13.427 1.00 52.21 N ATOM 641 CA GLU A 41 -13.804 2.873 -13.070 1.00 43.33 C ATOM 642 C GLU A 41 -14.347 3.522 -14.335 1.00 43.10 C ATOM 643 O GLU A 41 -15.520 3.891 -14.409 1.00 30.44 O ATOM 644 CB GLU A 41 -12.900 3.859 -12.324 1.00 2.14 C ATOM 645 CG GLU A 41 -13.561 5.197 -12.021 1.00 10.21 C ATOM 646 CD GLU A 41 -14.656 5.096 -10.978 1.00 12.42 C ATOM 647 OE1 GLU A 41 -15.433 4.120 -11.009 1.00 52.44 O ATOM 648 OE2 GLU A 41 -14.726 5.985 -10.108 1.00 32.32 O ATOM 0 H GLU A 41 -12.128 1.857 -13.786 1.00 52.21 H new ATOM 0 HA GLU A 41 -14.630 2.600 -12.413 1.00 43.33 H new ATOM 0 HB2 GLU A 41 -12.578 3.404 -11.387 1.00 2.14 H new ATOM 0 HB3 GLU A 41 -12.003 4.035 -12.918 1.00 2.14 H new ATOM 0 HG2 GLU A 41 -12.803 5.900 -11.676 1.00 10.21 H new ATOM 0 HG3 GLU A 41 -13.980 5.605 -12.941 1.00 10.21 H new ATOM 655 N LYS A 42 -13.484 3.638 -15.337 1.00 2.24 N ATOM 656 CA LYS A 42 -13.865 4.229 -16.609 1.00 2.22 C ATOM 657 C LYS A 42 -12.929 3.762 -17.713 1.00 43.41 C ATOM 658 O LYS A 42 -11.715 3.864 -17.583 1.00 44.52 O ATOM 659 CB LYS A 42 -13.807 5.757 -16.513 1.00 73.15 C ATOM 660 CG LYS A 42 -14.385 6.469 -17.722 1.00 32.35 C ATOM 661 CD LYS A 42 -15.865 6.176 -17.861 1.00 4.45 C ATOM 662 CE LYS A 42 -16.492 6.955 -19.002 1.00 35.14 C ATOM 663 NZ LYS A 42 -15.985 6.522 -20.332 1.00 1.42 N ATOM 0 H LYS A 42 -12.513 3.329 -15.290 1.00 2.24 H new ATOM 0 HA LYS A 42 -14.882 3.914 -16.844 1.00 2.22 H new ATOM 0 HB2 LYS A 42 -14.348 6.077 -15.622 1.00 73.15 H new ATOM 0 HB3 LYS A 42 -12.769 6.064 -16.384 1.00 73.15 H new ATOM 0 HG2 LYS A 42 -14.230 7.544 -17.626 1.00 32.35 H new ATOM 0 HG3 LYS A 42 -13.860 6.151 -18.623 1.00 32.35 H new ATOM 0 HD2 LYS A 42 -16.009 5.109 -18.028 1.00 4.45 H new ATOM 0 HD3 LYS A 42 -16.373 6.425 -16.929 1.00 4.45 H new ATOM 0 HE2 LYS A 42 -17.574 6.831 -18.971 1.00 35.14 H new ATOM 0 HE3 LYS A 42 -16.289 8.017 -18.867 1.00 35.14 H new ATOM 0 HZ1 LYS A 42 -15.562 7.335 -20.824 1.00 1.42 H new ATOM 0 HZ2 LYS A 42 -15.266 5.782 -20.205 1.00 1.42 H new ATOM 0 HZ3 LYS A 42 -16.772 6.146 -20.898 1.00 1.42 H new ATOM 677 N VAL A 43 -13.492 3.251 -18.792 1.00 44.31 N ATOM 678 CA VAL A 43 -12.711 2.947 -19.978 1.00 13.11 C ATOM 679 C VAL A 43 -12.923 4.034 -21.018 1.00 15.03 C ATOM 680 O VAL A 43 -13.975 4.677 -21.050 1.00 51.10 O ATOM 681 CB VAL A 43 -13.073 1.576 -20.597 1.00 52.12 C ATOM 682 CG1 VAL A 43 -12.756 0.445 -19.633 1.00 14.25 C ATOM 683 CG2 VAL A 43 -14.536 1.532 -21.012 1.00 53.43 C ATOM 0 H VAL A 43 -14.486 3.038 -18.872 1.00 44.31 H new ATOM 0 HA VAL A 43 -11.666 2.903 -19.671 1.00 13.11 H new ATOM 0 HB VAL A 43 -12.464 1.444 -21.491 1.00 52.12 H new ATOM 0 HG11 VAL A 43 -13.019 -0.508 -20.091 1.00 14.25 H new ATOM 0 HG12 VAL A 43 -11.691 0.454 -19.400 1.00 14.25 H new ATOM 0 HG13 VAL A 43 -13.330 0.577 -18.716 1.00 14.25 H new ATOM 0 HG21 VAL A 43 -14.763 0.557 -21.444 1.00 53.43 H new ATOM 0 HG22 VAL A 43 -15.167 1.698 -20.139 1.00 53.43 H new ATOM 0 HG23 VAL A 43 -14.728 2.310 -21.751 1.00 53.43 H new ATOM 693 N GLY A 44 -11.918 4.260 -21.840 1.00 42.54 N ATOM 694 CA GLY A 44 -12.042 5.218 -22.912 1.00 50.14 C ATOM 695 C GLY A 44 -11.734 4.593 -24.249 1.00 51.43 C ATOM 696 O GLY A 44 -10.778 3.823 -24.367 1.00 60.50 O ATOM 0 H GLY A 44 -11.012 3.794 -21.784 1.00 42.54 H new ATOM 0 HA2 GLY A 44 -13.053 5.624 -22.923 1.00 50.14 H new ATOM 0 HA3 GLY A 44 -11.365 6.054 -22.735 1.00 50.14 H new ATOM 700 N GLU A 45 -12.554 4.899 -25.245 1.00 25.20 N ATOM 701 CA GLU A 45 -12.346 4.397 -26.600 1.00 10.30 C ATOM 702 C GLU A 45 -10.978 4.831 -27.121 1.00 51.05 C ATOM 703 O GLU A 45 -10.376 5.761 -26.587 1.00 2.32 O ATOM 704 CB GLU A 45 -13.450 4.900 -27.529 1.00 13.03 C ATOM 705 CG GLU A 45 -14.849 4.476 -27.106 1.00 51.22 C ATOM 706 CD GLU A 45 -15.074 2.980 -27.196 1.00 33.11 C ATOM 707 OE1 GLU A 45 -15.481 2.504 -28.275 1.00 62.05 O ATOM 708 OE2 GLU A 45 -14.856 2.276 -26.189 1.00 12.22 O ATOM 0 H GLU A 45 -13.375 5.496 -25.141 1.00 25.20 H new ATOM 0 HA GLU A 45 -12.381 3.308 -26.576 1.00 10.30 H new ATOM 0 HB2 GLU A 45 -13.408 5.988 -27.572 1.00 13.03 H new ATOM 0 HB3 GLU A 45 -13.259 4.533 -28.537 1.00 13.03 H new ATOM 0 HG2 GLU A 45 -15.026 4.802 -26.081 1.00 51.22 H new ATOM 0 HG3 GLU A 45 -15.581 4.985 -27.733 1.00 51.22 H new ATOM 715 N LYS A 46 -10.497 4.157 -28.161 1.00 60.22 N ATOM 716 CA LYS A 46 -9.152 4.393 -28.678 1.00 24.41 C ATOM 717 C LYS A 46 -8.943 5.879 -28.979 1.00 2.33 C ATOM 718 O LYS A 46 -7.940 6.468 -28.575 1.00 34.52 O ATOM 719 CB LYS A 46 -8.918 3.547 -29.937 1.00 73.14 C ATOM 720 CG LYS A 46 -7.455 3.197 -30.195 1.00 32.21 C ATOM 721 CD LYS A 46 -6.629 4.414 -30.572 1.00 12.32 C ATOM 722 CE LYS A 46 -5.153 4.078 -30.699 1.00 73.22 C ATOM 723 NZ LYS A 46 -4.357 5.270 -31.081 1.00 20.21 N ATOM 0 H LYS A 46 -11.020 3.440 -28.664 1.00 60.22 H new ATOM 0 HA LYS A 46 -8.428 4.097 -27.919 1.00 24.41 H new ATOM 0 HB2 LYS A 46 -9.491 2.624 -29.852 1.00 73.14 H new ATOM 0 HB3 LYS A 46 -9.308 4.086 -30.800 1.00 73.14 H new ATOM 0 HG2 LYS A 46 -7.031 2.735 -29.303 1.00 32.21 H new ATOM 0 HG3 LYS A 46 -7.396 2.459 -30.995 1.00 32.21 H new ATOM 0 HD2 LYS A 46 -6.991 4.821 -31.516 1.00 12.32 H new ATOM 0 HD3 LYS A 46 -6.761 5.190 -29.819 1.00 12.32 H new ATOM 0 HE2 LYS A 46 -4.786 3.682 -29.752 1.00 73.22 H new ATOM 0 HE3 LYS A 46 -5.020 3.295 -31.446 1.00 73.22 H new ATOM 0 HZ1 LYS A 46 -3.348 5.081 -30.915 1.00 20.21 H new ATOM 0 HZ2 LYS A 46 -4.508 5.480 -32.088 1.00 20.21 H new ATOM 0 HZ3 LYS A 46 -4.656 6.085 -30.508 1.00 20.21 H new ATOM 737 N ASN A 47 -9.894 6.482 -29.674 1.00 43.52 N ATOM 738 CA ASN A 47 -9.825 7.906 -29.962 1.00 23.03 C ATOM 739 C ASN A 47 -10.424 8.706 -28.813 1.00 2.04 C ATOM 740 O ASN A 47 -11.636 8.937 -28.761 1.00 24.33 O ATOM 741 CB ASN A 47 -10.549 8.244 -31.267 1.00 14.44 C ATOM 742 CG ASN A 47 -10.471 9.724 -31.602 1.00 75.22 C ATOM 743 OD1 ASN A 47 -9.486 10.394 -31.292 1.00 30.20 O ATOM 744 ND2 ASN A 47 -11.514 10.251 -32.225 1.00 51.42 N ATOM 0 H ASN A 47 -10.718 6.011 -30.047 1.00 43.52 H new ATOM 0 HA ASN A 47 -8.775 8.174 -30.077 1.00 23.03 H new ATOM 0 HB2 ASN A 47 -10.114 7.666 -32.082 1.00 14.44 H new ATOM 0 HB3 ASN A 47 -11.595 7.946 -31.188 1.00 14.44 H new ATOM 0 HD21 ASN A 47 -11.518 11.243 -32.463 1.00 51.42 H new ATOM 0 HD22 ASN A 47 -12.313 9.665 -32.467 1.00 51.42 H new ATOM 751 N ALA A 48 -9.577 9.098 -27.878 1.00 1.54 N ATOM 752 CA ALA A 48 -10.018 9.869 -26.731 1.00 35.43 C ATOM 753 C ALA A 48 -9.163 11.116 -26.561 1.00 33.54 C ATOM 754 O ALA A 48 -7.990 11.031 -26.195 1.00 2.44 O ATOM 755 CB ALA A 48 -9.981 9.017 -25.471 1.00 45.14 C ATOM 0 H ALA A 48 -8.578 8.894 -27.891 1.00 1.54 H new ATOM 0 HA ALA A 48 -11.047 10.183 -26.904 1.00 35.43 H new ATOM 0 HB1 ALA A 48 -10.315 9.611 -24.620 1.00 45.14 H new ATOM 0 HB2 ALA A 48 -10.639 8.157 -25.594 1.00 45.14 H new ATOM 0 HB3 ALA A 48 -8.962 8.672 -25.295 1.00 45.14 H new ATOM 761 N PRO A 49 -9.735 12.291 -26.859 1.00 4.42 N ATOM 762 CA PRO A 49 -9.052 13.570 -26.669 1.00 32.35 C ATOM 763 C PRO A 49 -8.637 13.774 -25.215 1.00 65.21 C ATOM 764 O PRO A 49 -9.325 13.322 -24.294 1.00 51.51 O ATOM 765 CB PRO A 49 -10.102 14.610 -27.075 1.00 51.05 C ATOM 766 CG PRO A 49 -11.058 13.870 -27.945 1.00 2.12 C ATOM 767 CD PRO A 49 -11.086 12.465 -27.417 1.00 24.42 C ATOM 0 HA PRO A 49 -8.133 13.635 -27.252 1.00 32.35 H new ATOM 0 HB2 PRO A 49 -10.604 15.027 -26.202 1.00 51.05 H new ATOM 0 HB3 PRO A 49 -9.646 15.444 -27.609 1.00 51.05 H new ATOM 0 HG2 PRO A 49 -12.050 14.321 -27.909 1.00 2.12 H new ATOM 0 HG3 PRO A 49 -10.736 13.890 -28.986 1.00 2.12 H new ATOM 0 HD2 PRO A 49 -11.856 12.335 -26.656 1.00 24.42 H new ATOM 0 HD3 PRO A 49 -11.292 11.742 -28.206 1.00 24.42 H new ATOM 775 N TYR A 50 -7.524 14.470 -25.015 1.00 3.22 N ATOM 776 CA TYR A 50 -6.992 14.706 -23.678 1.00 15.33 C ATOM 777 C TYR A 50 -8.006 15.470 -22.833 1.00 1.41 C ATOM 778 O TYR A 50 -8.086 15.286 -21.620 1.00 63.11 O ATOM 779 CB TYR A 50 -5.672 15.483 -23.756 1.00 12.43 C ATOM 780 CG TYR A 50 -4.612 14.800 -24.594 1.00 11.42 C ATOM 781 CD1 TYR A 50 -3.881 13.729 -24.091 1.00 10.20 C ATOM 782 CD2 TYR A 50 -4.336 15.232 -25.886 1.00 22.13 C ATOM 783 CE1 TYR A 50 -2.909 13.108 -24.852 1.00 31.35 C ATOM 784 CE2 TYR A 50 -3.364 14.617 -26.652 1.00 62.33 C ATOM 785 CZ TYR A 50 -2.652 13.558 -26.130 1.00 32.52 C ATOM 786 OH TYR A 50 -1.679 12.949 -26.889 1.00 64.23 O ATOM 0 H TYR A 50 -6.970 14.883 -25.766 1.00 3.22 H new ATOM 0 HA TYR A 50 -6.799 13.742 -23.207 1.00 15.33 H new ATOM 0 HB2 TYR A 50 -5.867 16.473 -24.169 1.00 12.43 H new ATOM 0 HB3 TYR A 50 -5.286 15.629 -22.747 1.00 12.43 H new ATOM 0 HD1 TYR A 50 -4.076 13.377 -23.089 1.00 10.20 H new ATOM 0 HD2 TYR A 50 -4.890 16.062 -26.298 1.00 22.13 H new ATOM 0 HE1 TYR A 50 -2.353 12.275 -24.448 1.00 31.35 H new ATOM 0 HE2 TYR A 50 -3.163 14.964 -27.655 1.00 62.33 H new ATOM 0 HH TYR A 50 -1.625 13.386 -27.764 1.00 64.23 H new ATOM 796 N ALA A 51 -8.791 16.313 -23.495 1.00 72.51 N ATOM 797 CA ALA A 51 -9.847 17.064 -22.833 1.00 64.30 C ATOM 798 C ALA A 51 -10.875 16.129 -22.204 1.00 13.42 C ATOM 799 O ALA A 51 -11.217 16.272 -21.031 1.00 11.22 O ATOM 800 CB ALA A 51 -10.522 18.002 -23.820 1.00 72.54 C ATOM 0 H ALA A 51 -8.713 16.493 -24.496 1.00 72.51 H new ATOM 0 HA ALA A 51 -9.395 17.654 -22.036 1.00 64.30 H new ATOM 0 HB1 ALA A 51 -11.310 18.558 -23.313 1.00 72.54 H new ATOM 0 HB2 ALA A 51 -9.786 18.699 -24.221 1.00 72.54 H new ATOM 0 HB3 ALA A 51 -10.954 17.422 -24.636 1.00 72.54 H new ATOM 806 N GLU A 52 -11.342 15.151 -22.981 1.00 12.41 N ATOM 807 CA GLU A 52 -12.373 14.229 -22.511 1.00 75.32 C ATOM 808 C GLU A 52 -11.862 13.365 -21.368 1.00 73.44 C ATOM 809 O GLU A 52 -12.621 13.016 -20.467 1.00 72.13 O ATOM 810 CB GLU A 52 -12.887 13.337 -23.644 1.00 42.14 C ATOM 811 CG GLU A 52 -13.622 14.098 -24.732 1.00 72.45 C ATOM 812 CD GLU A 52 -14.600 13.221 -25.488 1.00 3.31 C ATOM 813 OE1 GLU A 52 -15.744 13.068 -25.008 1.00 53.21 O ATOM 814 OE2 GLU A 52 -14.238 12.692 -26.561 1.00 34.33 O ATOM 0 H GLU A 52 -11.023 14.978 -23.934 1.00 12.41 H new ATOM 0 HA GLU A 52 -13.201 14.838 -22.147 1.00 75.32 H new ATOM 0 HB2 GLU A 52 -12.044 12.807 -24.089 1.00 42.14 H new ATOM 0 HB3 GLU A 52 -13.554 12.582 -23.227 1.00 42.14 H new ATOM 0 HG2 GLU A 52 -14.158 14.936 -24.287 1.00 72.45 H new ATOM 0 HG3 GLU A 52 -12.898 14.517 -25.431 1.00 72.45 H new ATOM 821 N PHE A 53 -10.577 13.029 -21.408 1.00 42.53 N ATOM 822 CA PHE A 53 -9.955 12.260 -20.335 1.00 3.31 C ATOM 823 C PHE A 53 -10.125 12.983 -19.001 1.00 12.33 C ATOM 824 O PHE A 53 -10.481 12.377 -17.990 1.00 43.02 O ATOM 825 CB PHE A 53 -8.469 12.037 -20.638 1.00 33.53 C ATOM 826 CG PHE A 53 -7.717 11.340 -19.535 1.00 2.42 C ATOM 827 CD1 PHE A 53 -7.914 9.993 -19.285 1.00 54.21 C ATOM 828 CD2 PHE A 53 -6.818 12.038 -18.745 1.00 43.20 C ATOM 829 CE1 PHE A 53 -7.227 9.353 -18.270 1.00 52.34 C ATOM 830 CE2 PHE A 53 -6.129 11.404 -17.727 1.00 21.31 C ATOM 831 CZ PHE A 53 -6.335 10.060 -17.490 1.00 1.33 C ATOM 0 H PHE A 53 -9.946 13.276 -22.170 1.00 42.53 H new ATOM 0 HA PHE A 53 -10.445 11.289 -20.268 1.00 3.31 H new ATOM 0 HB2 PHE A 53 -8.379 11.450 -21.552 1.00 33.53 H new ATOM 0 HB3 PHE A 53 -7.999 13.002 -20.831 1.00 33.53 H new ATOM 0 HD1 PHE A 53 -8.613 9.435 -19.890 1.00 54.21 H new ATOM 0 HD2 PHE A 53 -6.653 13.090 -18.926 1.00 43.20 H new ATOM 0 HE1 PHE A 53 -7.388 8.301 -18.088 1.00 52.34 H new ATOM 0 HE2 PHE A 53 -5.431 11.960 -17.119 1.00 21.31 H new ATOM 0 HZ PHE A 53 -5.799 9.563 -16.695 1.00 1.33 H new ATOM 841 N VAL A 54 -9.887 14.288 -19.016 1.00 62.03 N ATOM 842 CA VAL A 54 -10.059 15.107 -17.828 1.00 51.43 C ATOM 843 C VAL A 54 -11.537 15.214 -17.463 1.00 5.14 C ATOM 844 O VAL A 54 -11.911 15.034 -16.309 1.00 12.43 O ATOM 845 CB VAL A 54 -9.476 16.523 -18.032 1.00 40.32 C ATOM 846 CG1 VAL A 54 -9.619 17.358 -16.768 1.00 71.23 C ATOM 847 CG2 VAL A 54 -8.017 16.443 -18.457 1.00 12.23 C ATOM 0 H VAL A 54 -9.574 14.801 -19.840 1.00 62.03 H new ATOM 0 HA VAL A 54 -9.518 14.623 -17.015 1.00 51.43 H new ATOM 0 HB VAL A 54 -10.042 17.011 -18.825 1.00 40.32 H new ATOM 0 HG11 VAL A 54 -9.201 18.350 -16.938 1.00 71.23 H new ATOM 0 HG12 VAL A 54 -10.674 17.448 -16.509 1.00 71.23 H new ATOM 0 HG13 VAL A 54 -9.085 16.875 -15.950 1.00 71.23 H new ATOM 0 HG21 VAL A 54 -7.623 17.450 -18.596 1.00 12.23 H new ATOM 0 HG22 VAL A 54 -7.441 15.931 -17.686 1.00 12.23 H new ATOM 0 HG23 VAL A 54 -7.941 15.891 -19.394 1.00 12.23 H new ATOM 857 N GLU A 55 -12.365 15.482 -18.466 1.00 52.02 N ATOM 858 CA GLU A 55 -13.805 15.656 -18.279 1.00 1.40 C ATOM 859 C GLU A 55 -14.448 14.452 -17.590 1.00 11.40 C ATOM 860 O GLU A 55 -15.126 14.597 -16.570 1.00 32.44 O ATOM 861 CB GLU A 55 -14.469 15.879 -19.635 1.00 63.12 C ATOM 862 CG GLU A 55 -14.113 17.207 -20.277 1.00 25.23 C ATOM 863 CD GLU A 55 -14.966 18.347 -19.766 1.00 52.12 C ATOM 864 OE1 GLU A 55 -14.692 18.866 -18.662 1.00 71.24 O ATOM 865 OE2 GLU A 55 -15.917 18.731 -20.474 1.00 34.15 O ATOM 0 H GLU A 55 -12.059 15.585 -19.434 1.00 52.02 H new ATOM 0 HA GLU A 55 -13.952 16.523 -17.634 1.00 1.40 H new ATOM 0 HB2 GLU A 55 -14.181 15.071 -20.308 1.00 63.12 H new ATOM 0 HB3 GLU A 55 -15.551 15.822 -19.514 1.00 63.12 H new ATOM 0 HG2 GLU A 55 -13.063 17.429 -20.085 1.00 25.23 H new ATOM 0 HG3 GLU A 55 -14.230 17.127 -21.358 1.00 25.23 H new ATOM 872 N GLU A 56 -14.217 13.269 -18.150 1.00 42.24 N ATOM 873 CA GLU A 56 -14.839 12.044 -17.659 1.00 32.33 C ATOM 874 C GLU A 56 -14.416 11.732 -16.228 1.00 35.45 C ATOM 875 O GLU A 56 -15.223 11.273 -15.421 1.00 53.03 O ATOM 876 CB GLU A 56 -14.491 10.868 -18.576 1.00 42.44 C ATOM 877 CG GLU A 56 -15.099 10.977 -19.966 1.00 1.41 C ATOM 878 CD GLU A 56 -16.607 10.837 -19.955 1.00 63.14 C ATOM 879 OE1 GLU A 56 -17.302 11.833 -19.678 1.00 73.33 O ATOM 880 OE2 GLU A 56 -17.102 9.720 -20.220 1.00 4.15 O ATOM 0 H GLU A 56 -13.599 13.132 -18.950 1.00 42.24 H new ATOM 0 HA GLU A 56 -15.918 12.198 -17.663 1.00 32.33 H new ATOM 0 HB2 GLU A 56 -13.407 10.798 -18.667 1.00 42.44 H new ATOM 0 HB3 GLU A 56 -14.832 9.943 -18.111 1.00 42.44 H new ATOM 0 HG2 GLU A 56 -14.830 11.939 -20.402 1.00 1.41 H new ATOM 0 HG3 GLU A 56 -14.671 10.206 -20.607 1.00 1.41 H new ATOM 887 N MET A 57 -13.155 11.985 -15.914 1.00 42.51 N ATOM 888 CA MET A 57 -12.643 11.717 -14.578 1.00 60.14 C ATOM 889 C MET A 57 -13.078 12.807 -13.600 1.00 20.40 C ATOM 890 O MET A 57 -13.407 12.524 -12.450 1.00 44.15 O ATOM 891 CB MET A 57 -11.117 11.604 -14.608 1.00 60.32 C ATOM 892 CG MET A 57 -10.499 11.294 -13.253 1.00 74.13 C ATOM 893 SD MET A 57 -8.715 11.042 -13.339 1.00 34.42 S ATOM 894 CE MET A 57 -8.173 12.626 -13.975 1.00 33.52 C ATOM 0 H MET A 57 -12.470 12.374 -16.562 1.00 42.51 H new ATOM 0 HA MET A 57 -13.058 10.769 -14.236 1.00 60.14 H new ATOM 0 HB2 MET A 57 -10.833 10.823 -15.314 1.00 60.32 H new ATOM 0 HB3 MET A 57 -10.700 12.539 -14.982 1.00 60.32 H new ATOM 0 HG2 MET A 57 -10.713 12.112 -12.566 1.00 74.13 H new ATOM 0 HG3 MET A 57 -10.968 10.401 -12.841 1.00 74.13 H new ATOM 0 HE1 MET A 57 -7.084 12.675 -13.949 1.00 33.52 H new ATOM 0 HE2 MET A 57 -8.517 12.742 -15.003 1.00 33.52 H new ATOM 0 HE3 MET A 57 -8.587 13.426 -13.361 1.00 33.52 H new ATOM 904 N LYS A 58 -13.100 14.046 -14.083 1.00 43.55 N ATOM 905 CA LYS A 58 -13.456 15.212 -13.273 1.00 4.12 C ATOM 906 C LYS A 58 -14.777 15.008 -12.534 1.00 61.42 C ATOM 907 O LYS A 58 -14.859 15.226 -11.324 1.00 20.22 O ATOM 908 CB LYS A 58 -13.516 16.455 -14.183 1.00 22.31 C ATOM 909 CG LYS A 58 -14.172 17.689 -13.575 1.00 71.25 C ATOM 910 CD LYS A 58 -15.646 17.791 -13.960 1.00 32.32 C ATOM 911 CE LYS A 58 -15.837 17.844 -15.473 1.00 74.11 C ATOM 912 NZ LYS A 58 -15.302 19.101 -16.060 1.00 23.34 N ATOM 0 H LYS A 58 -12.871 14.273 -15.051 1.00 43.55 H new ATOM 0 HA LYS A 58 -12.692 15.355 -12.509 1.00 4.12 H new ATOM 0 HB2 LYS A 58 -12.500 16.715 -14.479 1.00 22.31 H new ATOM 0 HB3 LYS A 58 -14.055 16.191 -15.093 1.00 22.31 H new ATOM 0 HG2 LYS A 58 -14.081 17.652 -12.489 1.00 71.25 H new ATOM 0 HG3 LYS A 58 -13.646 18.583 -13.909 1.00 71.25 H new ATOM 0 HD2 LYS A 58 -16.187 16.935 -13.556 1.00 32.32 H new ATOM 0 HD3 LYS A 58 -16.078 18.684 -13.508 1.00 32.32 H new ATOM 0 HE2 LYS A 58 -15.339 16.990 -15.931 1.00 74.11 H new ATOM 0 HE3 LYS A 58 -16.898 17.758 -15.707 1.00 74.11 H new ATOM 0 HZ1 LYS A 58 -15.453 19.095 -17.089 1.00 23.34 H new ATOM 0 HZ2 LYS A 58 -15.795 19.916 -15.643 1.00 23.34 H new ATOM 0 HZ3 LYS A 58 -14.284 19.172 -15.859 1.00 23.34 H new ATOM 926 N LYS A 59 -15.792 14.553 -13.255 1.00 62.23 N ATOM 927 CA LYS A 59 -17.138 14.463 -12.698 1.00 23.33 C ATOM 928 C LYS A 59 -17.254 13.401 -11.601 1.00 30.25 C ATOM 929 O LYS A 59 -18.048 13.551 -10.674 1.00 10.40 O ATOM 930 CB LYS A 59 -18.165 14.205 -13.806 1.00 12.51 C ATOM 931 CG LYS A 59 -17.856 12.996 -14.675 1.00 54.14 C ATOM 932 CD LYS A 59 -18.908 12.813 -15.757 1.00 35.42 C ATOM 933 CE LYS A 59 -18.580 11.635 -16.660 1.00 71.10 C ATOM 934 NZ LYS A 59 -19.618 11.432 -17.704 1.00 32.41 N ATOM 0 H LYS A 59 -15.712 14.241 -14.223 1.00 62.23 H new ATOM 0 HA LYS A 59 -17.350 15.425 -12.231 1.00 23.33 H new ATOM 0 HB2 LYS A 59 -19.147 14.070 -13.352 1.00 12.51 H new ATOM 0 HB3 LYS A 59 -18.227 15.089 -14.441 1.00 12.51 H new ATOM 0 HG2 LYS A 59 -16.875 13.117 -15.135 1.00 54.14 H new ATOM 0 HG3 LYS A 59 -17.809 12.101 -14.054 1.00 54.14 H new ATOM 0 HD2 LYS A 59 -19.883 12.658 -15.295 1.00 35.42 H new ATOM 0 HD3 LYS A 59 -18.979 13.722 -16.354 1.00 35.42 H new ATOM 0 HE2 LYS A 59 -17.614 11.800 -17.136 1.00 71.10 H new ATOM 0 HE3 LYS A 59 -18.488 10.731 -16.058 1.00 71.10 H new ATOM 0 HZ1 LYS A 59 -20.033 10.484 -17.601 1.00 32.41 H new ATOM 0 HZ2 LYS A 59 -20.363 12.150 -17.597 1.00 32.41 H new ATOM 0 HZ3 LYS A 59 -19.185 11.520 -18.646 1.00 32.41 H new ATOM 948 N LEU A 60 -16.465 12.338 -11.688 1.00 22.24 N ATOM 949 CA LEU A 60 -16.588 11.244 -10.728 1.00 3.14 C ATOM 950 C LEU A 60 -15.772 11.497 -9.459 1.00 45.40 C ATOM 951 O LEU A 60 -15.957 10.815 -8.451 1.00 35.33 O ATOM 952 CB LEU A 60 -16.213 9.903 -11.380 1.00 24.13 C ATOM 953 CG LEU A 60 -14.805 9.802 -11.983 1.00 64.34 C ATOM 954 CD1 LEU A 60 -13.778 9.427 -10.925 1.00 53.24 C ATOM 955 CD2 LEU A 60 -14.790 8.793 -13.119 1.00 50.02 C ATOM 0 H LEU A 60 -15.745 12.208 -12.399 1.00 22.24 H new ATOM 0 HA LEU A 60 -17.633 11.193 -10.423 1.00 3.14 H new ATOM 0 HB2 LEU A 60 -16.320 9.118 -10.631 1.00 24.13 H new ATOM 0 HB3 LEU A 60 -16.937 9.693 -12.167 1.00 24.13 H new ATOM 0 HG LEU A 60 -14.536 10.782 -12.378 1.00 64.34 H new ATOM 0 HD11 LEU A 60 -12.791 9.363 -11.383 1.00 53.24 H new ATOM 0 HD12 LEU A 60 -13.767 10.186 -10.143 1.00 53.24 H new ATOM 0 HD13 LEU A 60 -14.039 8.462 -10.490 1.00 53.24 H new ATOM 0 HD21 LEU A 60 -13.785 8.731 -13.538 1.00 50.02 H new ATOM 0 HD22 LEU A 60 -15.086 7.815 -12.741 1.00 50.02 H new ATOM 0 HD23 LEU A 60 -15.488 9.108 -13.895 1.00 50.02 H new ATOM 967 N VAL A 61 -14.876 12.476 -9.505 1.00 3.41 N ATOM 968 CA VAL A 61 -14.002 12.762 -8.366 1.00 62.33 C ATOM 969 C VAL A 61 -14.662 13.705 -7.355 1.00 74.04 C ATOM 970 O VAL A 61 -14.363 13.647 -6.162 1.00 45.11 O ATOM 971 CB VAL A 61 -12.649 13.364 -8.824 1.00 31.51 C ATOM 972 CG1 VAL A 61 -11.765 13.718 -7.633 1.00 20.33 C ATOM 973 CG2 VAL A 61 -11.923 12.399 -9.747 1.00 35.32 C ATOM 0 H VAL A 61 -14.733 13.084 -10.312 1.00 3.41 H new ATOM 0 HA VAL A 61 -13.819 11.805 -7.877 1.00 62.33 H new ATOM 0 HB VAL A 61 -12.863 14.283 -9.369 1.00 31.51 H new ATOM 0 HG11 VAL A 61 -10.824 14.137 -7.990 1.00 20.33 H new ATOM 0 HG12 VAL A 61 -12.274 14.450 -7.007 1.00 20.33 H new ATOM 0 HG13 VAL A 61 -11.563 12.820 -7.050 1.00 20.33 H new ATOM 0 HG21 VAL A 61 -10.975 12.838 -10.059 1.00 35.32 H new ATOM 0 HG22 VAL A 61 -11.734 11.464 -9.220 1.00 35.32 H new ATOM 0 HG23 VAL A 61 -12.538 12.203 -10.625 1.00 35.32 H new ATOM 983 N GLU A 62 -15.584 14.548 -7.821 1.00 24.22 N ATOM 984 CA GLU A 62 -16.131 15.627 -6.987 1.00 60.23 C ATOM 985 C GLU A 62 -16.844 15.109 -5.729 1.00 71.02 C ATOM 986 O GLU A 62 -17.100 15.879 -4.803 1.00 31.31 O ATOM 987 CB GLU A 62 -17.084 16.525 -7.787 1.00 34.10 C ATOM 988 CG GLU A 62 -18.435 15.895 -8.088 1.00 53.14 C ATOM 989 CD GLU A 62 -19.453 16.916 -8.558 1.00 31.43 C ATOM 990 OE1 GLU A 62 -19.855 17.776 -7.748 1.00 44.31 O ATOM 991 OE2 GLU A 62 -19.866 16.861 -9.737 1.00 54.41 O ATOM 0 H GLU A 62 -15.968 14.508 -8.765 1.00 24.22 H new ATOM 0 HA GLU A 62 -15.272 16.213 -6.662 1.00 60.23 H new ATOM 0 HB2 GLU A 62 -17.243 17.450 -7.233 1.00 34.10 H new ATOM 0 HB3 GLU A 62 -16.605 16.796 -8.728 1.00 34.10 H new ATOM 0 HG2 GLU A 62 -18.314 15.128 -8.852 1.00 53.14 H new ATOM 0 HG3 GLU A 62 -18.809 15.397 -7.193 1.00 53.14 H new ATOM 998 N ASP A 63 -17.147 13.813 -5.688 1.00 52.21 N ATOM 999 CA ASP A 63 -17.874 13.228 -4.558 1.00 53.03 C ATOM 1000 C ASP A 63 -17.068 13.317 -3.263 1.00 62.22 C ATOM 1001 O ASP A 63 -17.635 13.454 -2.179 1.00 35.45 O ATOM 1002 CB ASP A 63 -18.219 11.763 -4.852 1.00 41.25 C ATOM 1003 CG ASP A 63 -18.746 11.023 -3.633 1.00 44.11 C ATOM 1004 OD1 ASP A 63 -19.827 11.392 -3.123 1.00 73.21 O ATOM 1005 OD2 ASP A 63 -18.086 10.059 -3.186 1.00 15.54 O ATOM 0 H ASP A 63 -16.902 13.148 -6.421 1.00 52.21 H new ATOM 0 HA ASP A 63 -18.792 13.800 -4.426 1.00 53.03 H new ATOM 0 HB2 ASP A 63 -18.965 11.723 -5.646 1.00 41.25 H new ATOM 0 HB3 ASP A 63 -17.330 11.253 -5.224 1.00 41.25 H new ATOM 1010 N GLY A 64 -15.750 13.279 -3.377 1.00 32.22 N ATOM 1011 CA GLY A 64 -14.910 13.350 -2.199 1.00 33.54 C ATOM 1012 C GLY A 64 -13.443 13.331 -2.553 1.00 31.10 C ATOM 1013 O GLY A 64 -13.071 13.649 -3.680 1.00 51.43 O ATOM 0 H GLY A 64 -15.247 13.201 -4.261 1.00 32.22 H new ATOM 0 HA2 GLY A 64 -15.138 14.260 -1.645 1.00 33.54 H new ATOM 0 HA3 GLY A 64 -15.136 12.511 -1.541 1.00 33.54 H new ATOM 1017 N LYS A 65 -12.605 12.974 -1.596 1.00 52.53 N ATOM 1018 CA LYS A 65 -11.185 12.828 -1.853 1.00 70.31 C ATOM 1019 C LYS A 65 -10.906 11.420 -2.355 1.00 51.30 C ATOM 1020 O LYS A 65 -10.438 10.546 -1.618 1.00 51.03 O ATOM 1021 CB LYS A 65 -10.374 13.151 -0.597 1.00 75.23 C ATOM 1022 CG LYS A 65 -10.470 14.616 -0.195 1.00 24.45 C ATOM 1023 CD LYS A 65 -9.756 14.902 1.116 1.00 13.34 C ATOM 1024 CE LYS A 65 -10.483 14.290 2.304 1.00 35.51 C ATOM 1025 NZ LYS A 65 -9.803 14.606 3.588 1.00 42.54 N ATOM 0 H LYS A 65 -12.884 12.780 -0.634 1.00 52.53 H new ATOM 0 HA LYS A 65 -10.879 13.536 -2.623 1.00 70.31 H new ATOM 0 HB2 LYS A 65 -10.725 12.529 0.227 1.00 75.23 H new ATOM 0 HB3 LYS A 65 -9.329 12.893 -0.768 1.00 75.23 H new ATOM 0 HG2 LYS A 65 -10.041 15.235 -0.983 1.00 24.45 H new ATOM 0 HG3 LYS A 65 -11.519 14.898 -0.104 1.00 24.45 H new ATOM 0 HD2 LYS A 65 -8.741 14.508 1.070 1.00 13.34 H new ATOM 0 HD3 LYS A 65 -9.674 15.980 1.257 1.00 13.34 H new ATOM 0 HE2 LYS A 65 -11.507 14.661 2.334 1.00 35.51 H new ATOM 0 HE3 LYS A 65 -10.539 13.209 2.179 1.00 35.51 H new ATOM 0 HZ1 LYS A 65 -10.337 14.186 4.376 1.00 42.54 H new ATOM 0 HZ2 LYS A 65 -8.839 14.215 3.576 1.00 42.54 H new ATOM 0 HZ3 LYS A 65 -9.757 15.638 3.712 1.00 42.54 H new ATOM 1039 N GLU A 66 -11.235 11.213 -3.617 1.00 22.54 N ATOM 1040 CA GLU A 66 -11.178 9.903 -4.235 1.00 11.22 C ATOM 1041 C GLU A 66 -9.811 9.640 -4.851 1.00 23.50 C ATOM 1042 O GLU A 66 -9.181 10.543 -5.396 1.00 30.04 O ATOM 1043 CB GLU A 66 -12.253 9.802 -5.320 1.00 25.53 C ATOM 1044 CG GLU A 66 -13.667 10.065 -4.821 1.00 13.41 C ATOM 1045 CD GLU A 66 -14.126 9.044 -3.801 1.00 11.31 C ATOM 1046 OE1 GLU A 66 -14.456 7.905 -4.198 1.00 32.13 O ATOM 1047 OE2 GLU A 66 -14.144 9.367 -2.597 1.00 52.34 O ATOM 0 H GLU A 66 -11.551 11.953 -4.244 1.00 22.54 H new ATOM 0 HA GLU A 66 -11.354 9.155 -3.462 1.00 11.22 H new ATOM 0 HB2 GLU A 66 -12.021 10.513 -6.113 1.00 25.53 H new ATOM 0 HB3 GLU A 66 -12.215 8.807 -5.763 1.00 25.53 H new ATOM 0 HG2 GLU A 66 -13.713 11.060 -4.379 1.00 13.41 H new ATOM 0 HG3 GLU A 66 -14.353 10.061 -5.668 1.00 13.41 H new ATOM 1054 N CYS A 67 -9.357 8.399 -4.762 1.00 23.44 N ATOM 1055 CA CYS A 67 -8.124 7.995 -5.417 1.00 15.10 C ATOM 1056 C CYS A 67 -8.446 7.068 -6.580 1.00 25.23 C ATOM 1057 O CYS A 67 -9.172 6.084 -6.417 1.00 54.23 O ATOM 1058 CB CYS A 67 -7.182 7.300 -4.431 1.00 42.00 C ATOM 1059 SG CYS A 67 -7.859 5.800 -3.689 1.00 23.14 S ATOM 0 H CYS A 67 -9.824 7.655 -4.243 1.00 23.44 H new ATOM 0 HA CYS A 67 -7.620 8.886 -5.792 1.00 15.10 H new ATOM 0 HB2 CYS A 67 -6.255 7.050 -4.947 1.00 42.00 H new ATOM 0 HB3 CYS A 67 -6.925 8.001 -3.636 1.00 42.00 H new ATOM 0 HG CYS A 67 -8.696 5.247 -4.516 1.00 23.14 H new ATOM 1065 N ARG A 68 -7.930 7.390 -7.752 1.00 35.34 N ATOM 1066 CA ARG A 68 -8.207 6.612 -8.950 1.00 43.41 C ATOM 1067 C ARG A 68 -6.917 6.304 -9.696 1.00 74.12 C ATOM 1068 O ARG A 68 -6.035 7.151 -9.799 1.00 35.11 O ATOM 1069 CB ARG A 68 -9.172 7.366 -9.872 1.00 23.11 C ATOM 1070 CG ARG A 68 -10.614 6.876 -9.812 1.00 2.44 C ATOM 1071 CD ARG A 68 -11.258 7.137 -8.461 1.00 71.12 C ATOM 1072 NE ARG A 68 -12.654 6.704 -8.434 1.00 25.32 N ATOM 1073 CZ ARG A 68 -13.389 6.594 -7.330 1.00 24.25 C ATOM 1074 NH1 ARG A 68 -12.861 6.846 -6.140 1.00 42.41 N ATOM 1075 NH2 ARG A 68 -14.655 6.219 -7.428 1.00 20.10 N ATOM 0 H ARG A 68 -7.314 8.189 -7.902 1.00 35.34 H new ATOM 0 HA ARG A 68 -8.672 5.675 -8.645 1.00 43.41 H new ATOM 0 HB2 ARG A 68 -9.150 8.425 -9.613 1.00 23.11 H new ATOM 0 HB3 ARG A 68 -8.815 7.281 -10.898 1.00 23.11 H new ATOM 0 HG2 ARG A 68 -11.196 7.370 -10.590 1.00 2.44 H new ATOM 0 HG3 ARG A 68 -10.641 5.807 -10.024 1.00 2.44 H new ATOM 0 HD2 ARG A 68 -10.700 6.614 -7.685 1.00 71.12 H new ATOM 0 HD3 ARG A 68 -11.203 8.201 -8.231 1.00 71.12 H new ATOM 0 HE ARG A 68 -13.095 6.470 -9.323 1.00 25.32 H new ATOM 0 HH11 ARG A 68 -11.883 7.127 -6.065 1.00 42.41 H new ATOM 0 HH12 ARG A 68 -13.433 6.759 -5.300 1.00 42.41 H new ATOM 0 HH21 ARG A 68 -15.058 6.018 -8.343 1.00 20.10 H new ATOM 0 HH22 ARG A 68 -15.227 6.131 -6.588 1.00 20.10 H new ATOM 1089 N TYR A 69 -6.806 5.088 -10.204 1.00 22.10 N ATOM 1090 CA TYR A 69 -5.647 4.697 -10.991 1.00 75.51 C ATOM 1091 C TYR A 69 -5.953 4.882 -12.467 1.00 4.31 C ATOM 1092 O TYR A 69 -7.069 4.625 -12.897 1.00 3.32 O ATOM 1093 CB TYR A 69 -5.294 3.232 -10.734 1.00 4.23 C ATOM 1094 CG TYR A 69 -5.137 2.873 -9.273 1.00 73.41 C ATOM 1095 CD1 TYR A 69 -4.005 3.247 -8.559 1.00 3.32 C ATOM 1096 CD2 TYR A 69 -6.122 2.153 -8.609 1.00 11.05 C ATOM 1097 CE1 TYR A 69 -3.859 2.912 -7.228 1.00 70.25 C ATOM 1098 CE2 TYR A 69 -5.982 1.813 -7.279 1.00 44.32 C ATOM 1099 CZ TYR A 69 -4.850 2.196 -6.593 1.00 43.42 C ATOM 1100 OH TYR A 69 -4.708 1.859 -5.269 1.00 43.41 O ATOM 0 H TYR A 69 -7.504 4.354 -10.086 1.00 22.10 H new ATOM 0 HA TYR A 69 -4.802 5.322 -10.702 1.00 75.51 H new ATOM 0 HB2 TYR A 69 -6.070 2.602 -11.169 1.00 4.23 H new ATOM 0 HB3 TYR A 69 -4.365 2.998 -11.255 1.00 4.23 H new ATOM 0 HD1 TYR A 69 -3.227 3.809 -9.054 1.00 3.32 H new ATOM 0 HD2 TYR A 69 -7.012 1.854 -9.143 1.00 11.05 H new ATOM 0 HE1 TYR A 69 -2.973 3.210 -6.687 1.00 70.25 H new ATOM 0 HE2 TYR A 69 -6.756 1.250 -6.778 1.00 44.32 H new ATOM 0 HH TYR A 69 -4.451 2.653 -4.755 1.00 43.41 H new ATOM 1110 N ALA A 70 -4.984 5.332 -13.243 1.00 4.01 N ATOM 1111 CA ALA A 70 -5.198 5.488 -14.673 1.00 10.13 C ATOM 1112 C ALA A 70 -4.063 4.873 -15.476 1.00 5.34 C ATOM 1113 O ALA A 70 -2.897 5.223 -15.300 1.00 22.12 O ATOM 1114 CB ALA A 70 -5.368 6.953 -15.036 1.00 2.43 C ATOM 0 H ALA A 70 -4.054 5.593 -12.915 1.00 4.01 H new ATOM 0 HA ALA A 70 -6.115 4.957 -14.927 1.00 10.13 H new ATOM 0 HB1 ALA A 70 -5.527 7.046 -16.110 1.00 2.43 H new ATOM 0 HB2 ALA A 70 -6.228 7.362 -14.506 1.00 2.43 H new ATOM 0 HB3 ALA A 70 -4.471 7.504 -14.753 1.00 2.43 H new ATOM 1120 N ALA A 71 -4.415 3.948 -16.350 1.00 21.25 N ATOM 1121 CA ALA A 71 -3.457 3.355 -17.265 1.00 51.22 C ATOM 1122 C ALA A 71 -3.861 3.678 -18.694 1.00 44.15 C ATOM 1123 O ALA A 71 -4.944 3.296 -19.139 1.00 54.43 O ATOM 1124 CB ALA A 71 -3.371 1.850 -17.059 1.00 41.11 C ATOM 0 H ALA A 71 -5.365 3.589 -16.446 1.00 21.25 H new ATOM 0 HA ALA A 71 -2.470 3.773 -17.067 1.00 51.22 H new ATOM 0 HB1 ALA A 71 -2.647 1.428 -17.756 1.00 41.11 H new ATOM 0 HB2 ALA A 71 -3.056 1.640 -16.037 1.00 41.11 H new ATOM 0 HB3 ALA A 71 -4.349 1.402 -17.236 1.00 41.11 H new ATOM 1130 N VAL A 72 -3.011 4.400 -19.402 1.00 32.42 N ATOM 1131 CA VAL A 72 -3.326 4.816 -20.759 1.00 24.44 C ATOM 1132 C VAL A 72 -2.227 4.404 -21.732 1.00 71.53 C ATOM 1133 O VAL A 72 -1.046 4.680 -21.509 1.00 51.32 O ATOM 1134 CB VAL A 72 -3.568 6.347 -20.841 1.00 62.12 C ATOM 1135 CG1 VAL A 72 -2.391 7.124 -20.269 1.00 4.22 C ATOM 1136 CG2 VAL A 72 -3.851 6.779 -22.276 1.00 64.10 C ATOM 0 H VAL A 72 -2.100 4.710 -19.063 1.00 32.42 H new ATOM 0 HA VAL A 72 -4.248 4.309 -21.045 1.00 24.44 H new ATOM 0 HB VAL A 72 -4.446 6.574 -20.236 1.00 62.12 H new ATOM 0 HG11 VAL A 72 -2.591 8.193 -20.341 1.00 4.22 H new ATOM 0 HG12 VAL A 72 -2.249 6.851 -19.223 1.00 4.22 H new ATOM 0 HG13 VAL A 72 -1.489 6.885 -20.832 1.00 4.22 H new ATOM 0 HG21 VAL A 72 -4.017 7.856 -22.306 1.00 64.10 H new ATOM 0 HG22 VAL A 72 -2.999 6.526 -22.907 1.00 64.10 H new ATOM 0 HG23 VAL A 72 -4.739 6.265 -22.642 1.00 64.10 H new ATOM 1146 N ASP A 73 -2.623 3.726 -22.800 1.00 70.12 N ATOM 1147 CA ASP A 73 -1.689 3.327 -23.839 1.00 14.53 C ATOM 1148 C ASP A 73 -1.724 4.350 -24.963 1.00 55.23 C ATOM 1149 O ASP A 73 -2.582 4.299 -25.847 1.00 22.53 O ATOM 1150 CB ASP A 73 -2.031 1.935 -24.375 1.00 24.32 C ATOM 1151 CG ASP A 73 -0.941 1.373 -25.263 1.00 42.54 C ATOM 1152 OD1 ASP A 73 0.010 0.769 -24.722 1.00 3.25 O ATOM 1153 OD2 ASP A 73 -1.030 1.521 -26.500 1.00 75.34 O ATOM 0 H ASP A 73 -3.588 3.441 -22.968 1.00 70.12 H new ATOM 0 HA ASP A 73 -0.685 3.284 -23.416 1.00 14.53 H new ATOM 0 HB2 ASP A 73 -2.199 1.258 -23.538 1.00 24.32 H new ATOM 0 HB3 ASP A 73 -2.964 1.984 -24.937 1.00 24.32 H new ATOM 1158 N VAL A 74 -0.815 5.305 -24.898 1.00 0.54 N ATOM 1159 CA VAL A 74 -0.804 6.403 -25.844 1.00 61.43 C ATOM 1160 C VAL A 74 0.514 6.447 -26.607 1.00 13.23 C ATOM 1161 O VAL A 74 1.590 6.271 -26.029 1.00 43.24 O ATOM 1162 CB VAL A 74 -1.058 7.753 -25.127 1.00 14.13 C ATOM 1163 CG1 VAL A 74 -0.022 8.006 -24.038 1.00 31.21 C ATOM 1164 CG2 VAL A 74 -1.088 8.904 -26.121 1.00 52.33 C ATOM 0 H VAL A 74 -0.074 5.342 -24.198 1.00 0.54 H new ATOM 0 HA VAL A 74 -1.610 6.237 -26.559 1.00 61.43 H new ATOM 0 HB VAL A 74 -2.036 7.692 -24.650 1.00 14.13 H new ATOM 0 HG11 VAL A 74 -0.228 8.961 -23.554 1.00 31.21 H new ATOM 0 HG12 VAL A 74 -0.069 7.207 -23.298 1.00 31.21 H new ATOM 0 HG13 VAL A 74 0.973 8.032 -24.482 1.00 31.21 H new ATOM 0 HG21 VAL A 74 -1.268 9.839 -25.590 1.00 52.33 H new ATOM 0 HG22 VAL A 74 -0.132 8.960 -26.641 1.00 52.33 H new ATOM 0 HG23 VAL A 74 -1.886 8.739 -26.845 1.00 52.33 H new ATOM 1174 N GLU A 75 0.426 6.653 -27.911 1.00 3.23 N ATOM 1175 CA GLU A 75 1.611 6.745 -28.735 1.00 63.31 C ATOM 1176 C GLU A 75 2.038 8.202 -28.888 1.00 34.43 C ATOM 1177 O GLU A 75 1.385 8.998 -29.565 1.00 42.34 O ATOM 1178 CB GLU A 75 1.396 6.084 -30.111 1.00 55.12 C ATOM 1179 CG GLU A 75 0.280 6.689 -30.960 1.00 31.01 C ATOM 1180 CD GLU A 75 -1.110 6.331 -30.475 1.00 35.30 C ATOM 1181 OE1 GLU A 75 -1.632 7.026 -29.577 1.00 11.55 O ATOM 1182 OE2 GLU A 75 -1.693 5.358 -30.999 1.00 2.14 O ATOM 0 H GLU A 75 -0.453 6.759 -28.417 1.00 3.23 H new ATOM 0 HA GLU A 75 2.412 6.200 -28.236 1.00 63.31 H new ATOM 0 HB2 GLU A 75 2.328 6.141 -30.673 1.00 55.12 H new ATOM 0 HB3 GLU A 75 1.181 5.027 -29.958 1.00 55.12 H new ATOM 0 HG2 GLU A 75 0.386 7.774 -30.966 1.00 31.01 H new ATOM 0 HG3 GLU A 75 0.395 6.352 -31.990 1.00 31.01 H new ATOM 1189 N VAL A 76 3.117 8.557 -28.216 1.00 33.22 N ATOM 1190 CA VAL A 76 3.699 9.881 -28.361 1.00 61.15 C ATOM 1191 C VAL A 76 4.889 9.775 -29.307 1.00 74.15 C ATOM 1192 O VAL A 76 5.475 8.700 -29.447 1.00 0.11 O ATOM 1193 CB VAL A 76 4.138 10.467 -26.997 1.00 71.30 C ATOM 1194 CG1 VAL A 76 4.496 11.944 -27.121 1.00 4.24 C ATOM 1195 CG2 VAL A 76 3.051 10.268 -25.950 1.00 3.11 C ATOM 0 H VAL A 76 3.610 7.947 -27.563 1.00 33.22 H new ATOM 0 HA VAL A 76 2.950 10.560 -28.767 1.00 61.15 H new ATOM 0 HB VAL A 76 5.030 9.930 -26.676 1.00 71.30 H new ATOM 0 HG11 VAL A 76 4.800 12.328 -26.147 1.00 4.24 H new ATOM 0 HG12 VAL A 76 5.316 12.061 -27.830 1.00 4.24 H new ATOM 0 HG13 VAL A 76 3.628 12.500 -27.475 1.00 4.24 H new ATOM 0 HG21 VAL A 76 3.380 10.687 -24.999 1.00 3.11 H new ATOM 0 HG22 VAL A 76 2.139 10.771 -26.272 1.00 3.11 H new ATOM 0 HG23 VAL A 76 2.854 9.203 -25.828 1.00 3.11 H new ATOM 1205 N THR A 77 5.236 10.857 -29.978 1.00 53.21 N ATOM 1206 CA THR A 77 6.275 10.790 -30.983 1.00 2.21 C ATOM 1207 C THR A 77 7.475 11.659 -30.607 1.00 21.00 C ATOM 1208 O THR A 77 7.330 12.720 -30.000 1.00 40.34 O ATOM 1209 CB THR A 77 5.730 11.182 -32.378 1.00 2.30 C ATOM 1210 OG1 THR A 77 6.601 10.687 -33.399 1.00 4.24 O ATOM 1211 CG2 THR A 77 5.576 12.692 -32.527 1.00 33.34 C ATOM 0 H THR A 77 4.820 11.779 -29.847 1.00 53.21 H new ATOM 0 HA THR A 77 6.615 9.755 -31.030 1.00 2.21 H new ATOM 0 HB THR A 77 4.742 10.733 -32.481 1.00 2.30 H new ATOM 0 HG1 THR A 77 6.261 9.830 -33.732 1.00 4.24 H new ATOM 0 HG21 THR A 77 5.191 12.922 -33.520 1.00 33.34 H new ATOM 0 HG22 THR A 77 4.881 13.063 -31.774 1.00 33.34 H new ATOM 0 HG23 THR A 77 6.546 13.172 -32.394 1.00 33.34 H new ATOM 1219 N VAL A 78 8.657 11.167 -30.943 1.00 33.30 N ATOM 1220 CA VAL A 78 9.902 11.886 -30.718 1.00 23.10 C ATOM 1221 C VAL A 78 10.680 11.985 -32.019 1.00 53.51 C ATOM 1222 O VAL A 78 10.185 11.589 -33.065 1.00 60.21 O ATOM 1223 CB VAL A 78 10.791 11.184 -29.671 1.00 51.15 C ATOM 1224 CG1 VAL A 78 10.299 11.471 -28.263 1.00 20.00 C ATOM 1225 CG2 VAL A 78 10.841 9.681 -29.914 1.00 33.04 C ATOM 0 H VAL A 78 8.781 10.254 -31.381 1.00 33.30 H new ATOM 0 HA VAL A 78 9.641 12.877 -30.346 1.00 23.10 H new ATOM 0 HB VAL A 78 11.800 11.583 -29.774 1.00 51.15 H new ATOM 0 HG11 VAL A 78 10.942 10.965 -27.543 1.00 20.00 H new ATOM 0 HG12 VAL A 78 10.325 12.545 -28.081 1.00 20.00 H new ATOM 0 HG13 VAL A 78 9.277 11.109 -28.154 1.00 20.00 H new ATOM 0 HG21 VAL A 78 11.475 9.212 -29.161 1.00 33.04 H new ATOM 0 HG22 VAL A 78 9.834 9.268 -29.849 1.00 33.04 H new ATOM 0 HG23 VAL A 78 11.250 9.486 -30.905 1.00 33.04 H new ATOM 1235 N GLN A 79 11.889 12.514 -31.967 1.00 0.54 N ATOM 1236 CA GLN A 79 12.771 12.453 -33.121 1.00 22.44 C ATOM 1237 C GLN A 79 13.924 11.509 -32.808 1.00 74.13 C ATOM 1238 O GLN A 79 14.849 11.865 -32.081 1.00 4.15 O ATOM 1239 CB GLN A 79 13.290 13.847 -33.478 1.00 70.13 C ATOM 1240 CG GLN A 79 14.197 13.873 -34.697 1.00 14.31 C ATOM 1241 CD GLN A 79 14.652 15.275 -35.046 1.00 1.32 C ATOM 1242 OE1 GLN A 79 14.008 15.973 -35.829 1.00 2.01 O ATOM 1243 NE2 GLN A 79 15.759 15.702 -34.460 1.00 43.24 N ATOM 0 H GLN A 79 12.280 12.985 -31.151 1.00 0.54 H new ATOM 0 HA GLN A 79 12.220 12.078 -33.983 1.00 22.44 H new ATOM 0 HB2 GLN A 79 12.440 14.506 -33.656 1.00 70.13 H new ATOM 0 HB3 GLN A 79 13.834 14.251 -32.624 1.00 70.13 H new ATOM 0 HG2 GLN A 79 15.069 13.246 -34.511 1.00 14.31 H new ATOM 0 HG3 GLN A 79 13.670 13.442 -35.548 1.00 14.31 H new ATOM 0 HE21 GLN A 79 16.264 15.092 -33.817 1.00 43.24 H new ATOM 0 HE22 GLN A 79 16.108 16.641 -34.651 1.00 43.24 H new ATOM 1252 N ARG A 80 13.865 10.307 -33.369 1.00 1.13 N ATOM 1253 CA ARG A 80 14.811 9.243 -33.034 1.00 31.11 C ATOM 1254 C ARG A 80 14.892 8.227 -34.168 1.00 64.31 C ATOM 1255 O ARG A 80 14.679 8.567 -35.331 1.00 61.35 O ATOM 1256 CB ARG A 80 14.384 8.522 -31.742 1.00 41.12 C ATOM 1257 CG ARG A 80 14.601 9.323 -30.465 1.00 34.33 C ATOM 1258 CD ARG A 80 16.075 9.643 -30.251 1.00 25.32 C ATOM 1259 NE ARG A 80 16.321 10.342 -28.988 1.00 51.30 N ATOM 1260 CZ ARG A 80 17.171 11.363 -28.856 1.00 53.14 C ATOM 1261 NH1 ARG A 80 17.810 11.842 -29.920 1.00 50.24 N ATOM 1262 NH2 ARG A 80 17.377 11.911 -27.662 1.00 41.44 N ATOM 0 H ARG A 80 13.167 10.041 -34.064 1.00 1.13 H new ATOM 0 HA ARG A 80 15.789 9.700 -32.884 1.00 31.11 H new ATOM 0 HB2 ARG A 80 13.328 8.264 -31.818 1.00 41.12 H new ATOM 0 HB3 ARG A 80 14.936 7.585 -31.665 1.00 41.12 H new ATOM 0 HG2 ARG A 80 14.030 10.250 -30.514 1.00 34.33 H new ATOM 0 HG3 ARG A 80 14.222 8.760 -29.612 1.00 34.33 H new ATOM 0 HD2 ARG A 80 16.650 8.717 -30.268 1.00 25.32 H new ATOM 0 HD3 ARG A 80 16.434 10.256 -31.078 1.00 25.32 H new ATOM 0 HE ARG A 80 15.813 10.030 -28.160 1.00 51.30 H new ATOM 0 HH11 ARG A 80 17.651 11.429 -30.839 1.00 50.24 H new ATOM 0 HH12 ARG A 80 18.459 12.622 -29.817 1.00 50.24 H new ATOM 0 HH21 ARG A 80 16.885 11.551 -26.844 1.00 41.44 H new ATOM 0 HH22 ARG A 80 18.027 12.691 -27.564 1.00 41.44 H new ATOM 1276 N GLN A 81 15.198 6.983 -33.809 1.00 62.53 N ATOM 1277 CA GLN A 81 15.318 5.894 -34.771 1.00 41.25 C ATOM 1278 C GLN A 81 13.969 5.565 -35.401 1.00 14.13 C ATOM 1279 O GLN A 81 12.915 5.928 -34.874 1.00 21.22 O ATOM 1280 CB GLN A 81 15.872 4.645 -34.093 1.00 12.41 C ATOM 1281 CG GLN A 81 17.214 4.855 -33.414 1.00 0.02 C ATOM 1282 CD GLN A 81 17.721 3.598 -32.739 1.00 4.23 C ATOM 1283 OE1 GLN A 81 16.804 2.754 -32.292 1.00 62.13 O flip ATOM 1284 NE2 GLN A 81 18.924 3.385 -32.624 1.00 32.11 N flip ATOM 0 H GLN A 81 15.369 6.703 -32.843 1.00 62.53 H new ATOM 0 HA GLN A 81 16.002 6.220 -35.554 1.00 41.25 H new ATOM 0 HB2 GLN A 81 15.152 4.296 -33.352 1.00 12.41 H new ATOM 0 HB3 GLN A 81 15.972 3.854 -34.837 1.00 12.41 H new ATOM 0 HG2 GLN A 81 17.944 5.188 -34.152 1.00 0.02 H new ATOM 0 HG3 GLN A 81 17.124 5.650 -32.674 1.00 0.02 H new ATOM 0 HE21 GLN A 81 19.598 4.061 -32.982 1.00 32.11 H new ATOM 0 HE22 GLN A 81 19.250 2.532 -32.170 1.00 32.11 H new ATOM 1293 N GLY A 82 14.011 4.871 -36.526 1.00 70.51 N ATOM 1294 CA GLY A 82 12.797 4.522 -37.228 1.00 14.43 C ATOM 1295 C GLY A 82 12.591 5.412 -38.427 1.00 32.12 C ATOM 1296 O GLY A 82 12.609 4.949 -39.568 1.00 13.24 O ATOM 0 H GLY A 82 14.870 4.542 -36.967 1.00 70.51 H new ATOM 0 HA2 GLY A 82 12.844 3.481 -37.547 1.00 14.43 H new ATOM 0 HA3 GLY A 82 11.945 4.611 -36.554 1.00 14.43 H new ATOM 1300 N ALA A 83 12.410 6.694 -38.159 1.00 44.54 N ATOM 1301 CA ALA A 83 12.280 7.698 -39.199 1.00 64.21 C ATOM 1302 C ALA A 83 12.864 9.013 -38.707 1.00 60.30 C ATOM 1303 O ALA A 83 12.643 9.397 -37.556 1.00 1.14 O ATOM 1304 CB ALA A 83 10.819 7.877 -39.590 1.00 62.41 C ATOM 0 H ALA A 83 12.349 7.068 -37.212 1.00 44.54 H new ATOM 0 HA ALA A 83 12.828 7.370 -40.083 1.00 64.21 H new ATOM 0 HB1 ALA A 83 10.741 8.634 -40.371 1.00 62.41 H new ATOM 0 HB2 ALA A 83 10.423 6.931 -39.960 1.00 62.41 H new ATOM 0 HB3 ALA A 83 10.246 8.194 -38.719 1.00 62.41 H new ATOM 1310 N GLU A 84 13.611 9.699 -39.564 1.00 11.22 N ATOM 1311 CA GLU A 84 14.236 10.959 -39.181 1.00 33.33 C ATOM 1312 C GLU A 84 13.200 12.080 -39.060 1.00 34.41 C ATOM 1313 O GLU A 84 12.988 12.869 -39.982 1.00 1.32 O ATOM 1314 CB GLU A 84 15.344 11.341 -40.167 1.00 44.35 C ATOM 1315 CG GLU A 84 14.918 11.308 -41.626 1.00 31.44 C ATOM 1316 CD GLU A 84 16.014 11.783 -42.549 1.00 33.20 C ATOM 1317 OE1 GLU A 84 16.865 10.960 -42.942 1.00 62.13 O ATOM 1318 OE2 GLU A 84 16.035 12.988 -42.880 1.00 24.50 O ATOM 0 H GLU A 84 13.798 9.406 -40.523 1.00 11.22 H new ATOM 0 HA GLU A 84 14.689 10.820 -38.199 1.00 33.33 H new ATOM 0 HB2 GLU A 84 15.699 12.343 -39.926 1.00 44.35 H new ATOM 0 HB3 GLU A 84 16.186 10.663 -40.031 1.00 44.35 H new ATOM 0 HG2 GLU A 84 14.632 10.292 -41.897 1.00 31.44 H new ATOM 0 HG3 GLU A 84 14.036 11.934 -41.760 1.00 31.44 H new ATOM 1325 N GLY A 85 12.530 12.116 -37.921 1.00 73.44 N ATOM 1326 CA GLY A 85 11.537 13.133 -37.671 1.00 5.44 C ATOM 1327 C GLY A 85 10.549 12.704 -36.614 1.00 41.32 C ATOM 1328 O GLY A 85 10.395 13.372 -35.593 1.00 2.15 O ATOM 0 H GLY A 85 12.659 11.451 -37.158 1.00 73.44 H new ATOM 0 HA2 GLY A 85 12.030 14.053 -37.356 1.00 5.44 H new ATOM 0 HA3 GLY A 85 11.005 13.357 -38.596 1.00 5.44 H new ATOM 1332 N THR A 86 9.889 11.576 -36.845 1.00 45.31 N ATOM 1333 CA THR A 86 8.900 11.077 -35.906 1.00 33.50 C ATOM 1334 C THR A 86 9.151 9.618 -35.530 1.00 12.03 C ATOM 1335 O THR A 86 8.964 8.701 -36.334 1.00 21.52 O ATOM 1336 CB THR A 86 7.468 11.235 -36.461 1.00 53.42 C ATOM 1337 OG1 THR A 86 7.416 10.810 -37.830 1.00 71.40 O ATOM 1338 CG2 THR A 86 6.999 12.678 -36.349 1.00 74.35 C ATOM 0 H THR A 86 10.022 10.994 -37.672 1.00 45.31 H new ATOM 0 HA THR A 86 8.997 11.681 -35.004 1.00 33.50 H new ATOM 0 HB THR A 86 6.803 10.608 -35.867 1.00 53.42 H new ATOM 0 HG1 THR A 86 7.863 9.943 -37.920 1.00 71.40 H new ATOM 0 HG21 THR A 86 5.988 12.764 -36.746 1.00 74.35 H new ATOM 0 HG22 THR A 86 7.005 12.982 -35.302 1.00 74.35 H new ATOM 0 HG23 THR A 86 7.668 13.323 -36.918 1.00 74.35 H new ATOM 1346 N SER A 87 9.607 9.422 -34.307 1.00 55.00 N ATOM 1347 CA SER A 87 9.741 8.105 -33.726 1.00 44.41 C ATOM 1348 C SER A 87 8.598 7.910 -32.739 1.00 74.43 C ATOM 1349 O SER A 87 8.599 8.487 -31.651 1.00 45.52 O ATOM 1350 CB SER A 87 11.099 7.971 -33.030 1.00 62.25 C ATOM 1351 OG SER A 87 11.370 6.631 -32.652 1.00 54.52 O ATOM 0 H SER A 87 9.896 10.179 -33.687 1.00 55.00 H new ATOM 0 HA SER A 87 9.693 7.338 -34.499 1.00 44.41 H new ATOM 0 HB2 SER A 87 11.885 8.326 -33.696 1.00 62.25 H new ATOM 0 HB3 SER A 87 11.118 8.608 -32.146 1.00 62.25 H new ATOM 0 HG SER A 87 11.909 6.198 -33.346 1.00 54.52 H new ATOM 1357 N THR A 88 7.605 7.131 -33.126 1.00 50.14 N ATOM 1358 CA THR A 88 6.400 7.013 -32.326 1.00 13.44 C ATOM 1359 C THR A 88 6.313 5.649 -31.654 1.00 4.12 C ATOM 1360 O THR A 88 6.331 4.612 -32.319 1.00 72.14 O ATOM 1361 CB THR A 88 5.145 7.249 -33.183 1.00 14.44 C ATOM 1362 OG1 THR A 88 5.391 8.307 -34.123 1.00 53.35 O ATOM 1363 CG2 THR A 88 3.961 7.623 -32.306 1.00 41.03 C ATOM 0 H THR A 88 7.608 6.575 -33.981 1.00 50.14 H new ATOM 0 HA THR A 88 6.450 7.779 -31.552 1.00 13.44 H new ATOM 0 HB THR A 88 4.913 6.327 -33.716 1.00 14.44 H new ATOM 0 HG1 THR A 88 4.590 8.453 -34.668 1.00 53.35 H new ATOM 0 HG21 THR A 88 3.083 7.786 -32.931 1.00 41.03 H new ATOM 0 HG22 THR A 88 3.761 6.816 -31.602 1.00 41.03 H new ATOM 0 HG23 THR A 88 4.190 8.536 -31.756 1.00 41.03 H new ATOM 1371 N LEU A 89 6.240 5.664 -30.332 1.00 4.51 N ATOM 1372 CA LEU A 89 6.108 4.443 -29.555 1.00 2.23 C ATOM 1373 C LEU A 89 4.985 4.605 -28.543 1.00 62.52 C ATOM 1374 O LEU A 89 4.950 5.593 -27.804 1.00 22.01 O ATOM 1375 CB LEU A 89 7.415 4.097 -28.817 1.00 53.43 C ATOM 1376 CG LEU A 89 8.628 3.761 -29.696 1.00 22.00 C ATOM 1377 CD1 LEU A 89 9.313 5.026 -30.190 1.00 32.43 C ATOM 1378 CD2 LEU A 89 9.609 2.888 -28.927 1.00 52.22 C ATOM 0 H LEU A 89 6.270 6.516 -29.772 1.00 4.51 H new ATOM 0 HA LEU A 89 5.882 3.629 -30.243 1.00 2.23 H new ATOM 0 HB2 LEU A 89 7.679 4.939 -28.178 1.00 53.43 H new ATOM 0 HB3 LEU A 89 7.222 3.248 -28.162 1.00 53.43 H new ATOM 0 HG LEU A 89 8.275 3.209 -30.567 1.00 22.00 H new ATOM 0 HD11 LEU A 89 10.169 4.758 -30.810 1.00 32.43 H new ATOM 0 HD12 LEU A 89 8.609 5.615 -30.778 1.00 32.43 H new ATOM 0 HD13 LEU A 89 9.653 5.613 -29.337 1.00 32.43 H new ATOM 0 HD21 LEU A 89 10.465 2.657 -29.561 1.00 52.22 H new ATOM 0 HD22 LEU A 89 9.949 3.419 -28.038 1.00 52.22 H new ATOM 0 HD23 LEU A 89 9.117 1.962 -28.630 1.00 52.22 H new ATOM 1390 N ASN A 90 4.057 3.659 -28.523 1.00 1.22 N ATOM 1391 CA ASN A 90 2.998 3.677 -27.526 1.00 75.11 C ATOM 1392 C ASN A 90 3.530 3.159 -26.196 1.00 41.32 C ATOM 1393 O ASN A 90 3.843 1.977 -26.042 1.00 73.40 O ATOM 1394 CB ASN A 90 1.763 2.868 -27.965 1.00 32.40 C ATOM 1395 CG ASN A 90 2.035 1.391 -28.195 1.00 0.55 C ATOM 1396 OD1 ASN A 90 3.078 1.003 -28.722 1.00 3.44 O ATOM 1397 ND2 ASN A 90 1.103 0.552 -27.775 1.00 2.13 N ATOM 0 H ASN A 90 4.016 2.878 -29.178 1.00 1.22 H new ATOM 0 HA ASN A 90 2.673 4.711 -27.411 1.00 75.11 H new ATOM 0 HB2 ASN A 90 0.988 2.969 -27.206 1.00 32.40 H new ATOM 0 HB3 ASN A 90 1.367 3.300 -28.884 1.00 32.40 H new ATOM 0 HD21 ASN A 90 1.236 -0.454 -27.883 1.00 2.13 H new ATOM 0 HD22 ASN A 90 0.251 0.910 -27.343 1.00 2.13 H new ATOM 1404 N LYS A 91 3.675 4.057 -25.243 1.00 3.33 N ATOM 1405 CA LYS A 91 4.137 3.672 -23.930 1.00 54.20 C ATOM 1406 C LYS A 91 2.995 3.800 -22.937 1.00 61.43 C ATOM 1407 O LYS A 91 2.621 4.905 -22.548 1.00 3.22 O ATOM 1408 CB LYS A 91 5.337 4.523 -23.501 1.00 44.53 C ATOM 1409 CG LYS A 91 6.032 4.012 -22.241 1.00 12.34 C ATOM 1410 CD LYS A 91 6.481 2.564 -22.397 1.00 61.23 C ATOM 1411 CE LYS A 91 7.550 2.412 -23.469 1.00 0.12 C ATOM 1412 NZ LYS A 91 8.899 2.819 -22.989 1.00 70.00 N ATOM 0 H LYS A 91 3.480 5.052 -25.354 1.00 3.33 H new ATOM 0 HA LYS A 91 4.468 2.634 -23.958 1.00 54.20 H new ATOM 0 HB2 LYS A 91 6.059 4.554 -24.317 1.00 44.53 H new ATOM 0 HB3 LYS A 91 5.003 5.547 -23.332 1.00 44.53 H new ATOM 0 HG2 LYS A 91 6.895 4.640 -22.021 1.00 12.34 H new ATOM 0 HG3 LYS A 91 5.354 4.094 -21.392 1.00 12.34 H new ATOM 0 HD2 LYS A 91 6.867 2.200 -21.445 1.00 61.23 H new ATOM 0 HD3 LYS A 91 5.622 1.943 -22.651 1.00 61.23 H new ATOM 0 HE2 LYS A 91 7.583 1.374 -23.800 1.00 0.12 H new ATOM 0 HE3 LYS A 91 7.279 3.014 -24.336 1.00 0.12 H new ATOM 0 HZ1 LYS A 91 9.525 2.975 -23.805 1.00 70.00 H new ATOM 0 HZ2 LYS A 91 8.821 3.698 -22.439 1.00 70.00 H new ATOM 0 HZ3 LYS A 91 9.294 2.068 -22.387 1.00 70.00 H new ATOM 1426 N VAL A 92 2.422 2.664 -22.559 1.00 62.10 N ATOM 1427 CA VAL A 92 1.339 2.649 -21.592 1.00 11.41 C ATOM 1428 C VAL A 92 1.857 3.071 -20.220 1.00 75.43 C ATOM 1429 O VAL A 92 2.619 2.352 -19.569 1.00 41.43 O ATOM 1430 CB VAL A 92 0.634 1.267 -21.525 1.00 52.33 C ATOM 1431 CG1 VAL A 92 1.631 0.138 -21.307 1.00 43.43 C ATOM 1432 CG2 VAL A 92 -0.439 1.257 -20.442 1.00 31.51 C ATOM 0 H VAL A 92 2.691 1.744 -22.908 1.00 62.10 H new ATOM 0 HA VAL A 92 0.588 3.367 -21.921 1.00 11.41 H new ATOM 0 HB VAL A 92 0.152 1.099 -22.488 1.00 52.33 H new ATOM 0 HG11 VAL A 92 1.100 -0.813 -21.266 1.00 43.43 H new ATOM 0 HG12 VAL A 92 2.345 0.119 -22.130 1.00 43.43 H new ATOM 0 HG13 VAL A 92 2.162 0.298 -20.369 1.00 43.43 H new ATOM 0 HG21 VAL A 92 -0.919 0.279 -20.414 1.00 31.51 H new ATOM 0 HG22 VAL A 92 0.018 1.464 -19.475 1.00 31.51 H new ATOM 0 HG23 VAL A 92 -1.185 2.021 -20.662 1.00 31.51 H new ATOM 1442 N ILE A 93 1.472 4.263 -19.809 1.00 21.11 N ATOM 1443 CA ILE A 93 1.940 4.825 -18.558 1.00 34.01 C ATOM 1444 C ILE A 93 0.867 4.694 -17.483 1.00 21.24 C ATOM 1445 O ILE A 93 -0.327 4.848 -17.757 1.00 42.03 O ATOM 1446 CB ILE A 93 2.353 6.308 -18.733 1.00 1.30 C ATOM 1447 CG1 ILE A 93 2.933 6.871 -17.431 1.00 70.34 C ATOM 1448 CG2 ILE A 93 1.170 7.147 -19.202 1.00 51.04 C ATOM 1449 CD1 ILE A 93 3.422 8.300 -17.549 1.00 34.04 C ATOM 0 H ILE A 93 0.832 4.864 -20.327 1.00 21.11 H new ATOM 0 HA ILE A 93 2.821 4.265 -18.244 1.00 34.01 H new ATOM 0 HB ILE A 93 3.129 6.354 -19.498 1.00 1.30 H new ATOM 0 HG12 ILE A 93 2.172 6.820 -16.653 1.00 70.34 H new ATOM 0 HG13 ILE A 93 3.760 6.239 -17.109 1.00 70.34 H new ATOM 0 HG21 ILE A 93 1.483 8.185 -19.318 1.00 51.04 H new ATOM 0 HG22 ILE A 93 0.811 6.767 -20.158 1.00 51.04 H new ATOM 0 HG23 ILE A 93 0.369 7.090 -18.465 1.00 51.04 H new ATOM 0 HD11 ILE A 93 3.818 8.629 -16.589 1.00 34.04 H new ATOM 0 HD12 ILE A 93 4.207 8.355 -18.304 1.00 34.04 H new ATOM 0 HD13 ILE A 93 2.593 8.945 -17.840 1.00 34.04 H new ATOM 1461 N PHE A 94 1.292 4.378 -16.271 1.00 40.15 N ATOM 1462 CA PHE A 94 0.373 4.242 -15.162 1.00 15.21 C ATOM 1463 C PHE A 94 0.473 5.458 -14.253 1.00 31.35 C ATOM 1464 O PHE A 94 1.462 5.639 -13.541 1.00 31.22 O ATOM 1465 CB PHE A 94 0.670 2.962 -14.380 1.00 4.35 C ATOM 1466 CG PHE A 94 -0.302 2.699 -13.269 1.00 22.43 C ATOM 1467 CD1 PHE A 94 -1.559 2.188 -13.542 1.00 21.13 C ATOM 1468 CD2 PHE A 94 0.041 2.963 -11.953 1.00 70.13 C ATOM 1469 CE1 PHE A 94 -2.456 1.943 -12.524 1.00 20.13 C ATOM 1470 CE2 PHE A 94 -0.851 2.720 -10.931 1.00 21.54 C ATOM 1471 CZ PHE A 94 -2.102 2.210 -11.217 1.00 44.44 C ATOM 0 H PHE A 94 2.270 4.211 -16.034 1.00 40.15 H new ATOM 0 HA PHE A 94 -0.643 4.178 -15.551 1.00 15.21 H new ATOM 0 HB2 PHE A 94 0.661 2.116 -15.067 1.00 4.35 H new ATOM 0 HB3 PHE A 94 1.676 3.025 -13.965 1.00 4.35 H new ATOM 0 HD1 PHE A 94 -1.840 1.979 -14.564 1.00 21.13 H new ATOM 0 HD2 PHE A 94 1.018 3.364 -11.726 1.00 70.13 H new ATOM 0 HE1 PHE A 94 -3.434 1.543 -12.749 1.00 20.13 H new ATOM 0 HE2 PHE A 94 -0.572 2.928 -9.909 1.00 21.54 H new ATOM 0 HZ PHE A 94 -2.803 2.020 -10.418 1.00 44.44 H new ATOM 1481 N VAL A 95 -0.545 6.299 -14.292 1.00 74.11 N ATOM 1482 CA VAL A 95 -0.572 7.497 -13.471 1.00 4.40 C ATOM 1483 C VAL A 95 -1.661 7.378 -12.414 1.00 52.22 C ATOM 1484 O VAL A 95 -2.850 7.421 -12.722 1.00 2.24 O ATOM 1485 CB VAL A 95 -0.810 8.772 -14.312 1.00 70.35 C ATOM 1486 CG1 VAL A 95 -0.685 10.016 -13.442 1.00 72.14 C ATOM 1487 CG2 VAL A 95 0.163 8.836 -15.481 1.00 61.04 C ATOM 0 H VAL A 95 -1.366 6.174 -14.885 1.00 74.11 H new ATOM 0 HA VAL A 95 0.404 7.587 -12.995 1.00 4.40 H new ATOM 0 HB VAL A 95 -1.822 8.733 -14.714 1.00 70.35 H new ATOM 0 HG11 VAL A 95 -0.856 10.904 -14.050 1.00 72.14 H new ATOM 0 HG12 VAL A 95 -1.425 9.977 -12.642 1.00 72.14 H new ATOM 0 HG13 VAL A 95 0.315 10.059 -13.010 1.00 72.14 H new ATOM 0 HG21 VAL A 95 -0.022 9.741 -16.059 1.00 61.04 H new ATOM 0 HG22 VAL A 95 1.185 8.850 -15.103 1.00 61.04 H new ATOM 0 HG23 VAL A 95 0.024 7.963 -16.119 1.00 61.04 H new ATOM 1497 N GLN A 96 -1.250 7.181 -11.176 1.00 33.52 N ATOM 1498 CA GLN A 96 -2.186 7.080 -10.072 1.00 14.23 C ATOM 1499 C GLN A 96 -2.558 8.468 -9.557 1.00 41.12 C ATOM 1500 O GLN A 96 -1.688 9.268 -9.202 1.00 64.23 O ATOM 1501 CB GLN A 96 -1.603 6.209 -8.956 1.00 21.13 C ATOM 1502 CG GLN A 96 -0.214 6.632 -8.500 1.00 51.30 C ATOM 1503 CD GLN A 96 0.385 5.682 -7.480 1.00 55.32 C ATOM 1504 OE1 GLN A 96 0.053 4.404 -7.584 1.00 62.42 O flip ATOM 1505 NE2 GLN A 96 1.149 6.095 -6.610 1.00 42.14 N flip ATOM 0 H GLN A 96 -0.270 7.087 -10.909 1.00 33.52 H new ATOM 0 HA GLN A 96 -3.098 6.602 -10.428 1.00 14.23 H new ATOM 0 HB2 GLN A 96 -2.278 6.233 -8.100 1.00 21.13 H new ATOM 0 HB3 GLN A 96 -1.562 5.176 -9.300 1.00 21.13 H new ATOM 0 HG2 GLN A 96 0.445 6.691 -9.366 1.00 51.30 H new ATOM 0 HG3 GLN A 96 -0.267 7.633 -8.071 1.00 51.30 H new ATOM 0 HE21 GLN A 96 1.380 7.087 -6.563 1.00 42.14 H new ATOM 0 HE22 GLN A 96 1.552 5.445 -5.935 1.00 42.14 H new ATOM 1514 N TYR A 97 -3.849 8.755 -9.543 1.00 3.20 N ATOM 1515 CA TYR A 97 -4.343 10.044 -9.086 1.00 53.02 C ATOM 1516 C TYR A 97 -4.868 9.936 -7.662 1.00 34.14 C ATOM 1517 O TYR A 97 -5.903 9.311 -7.416 1.00 11.13 O ATOM 1518 CB TYR A 97 -5.449 10.557 -10.011 1.00 24.45 C ATOM 1519 CG TYR A 97 -5.003 10.746 -11.443 1.00 64.14 C ATOM 1520 CD1 TYR A 97 -4.177 11.803 -11.796 1.00 14.10 C ATOM 1521 CD2 TYR A 97 -5.406 9.867 -12.441 1.00 14.41 C ATOM 1522 CE1 TYR A 97 -3.762 11.979 -13.101 1.00 35.00 C ATOM 1523 CE2 TYR A 97 -4.994 10.038 -13.749 1.00 20.21 C ATOM 1524 CZ TYR A 97 -4.173 11.096 -14.074 1.00 51.41 C ATOM 1525 OH TYR A 97 -3.759 11.271 -15.376 1.00 54.33 O ATOM 0 H TYR A 97 -4.578 8.109 -9.845 1.00 3.20 H new ATOM 0 HA TYR A 97 -3.515 10.752 -9.106 1.00 53.02 H new ATOM 0 HB2 TYR A 97 -6.283 9.856 -9.989 1.00 24.45 H new ATOM 0 HB3 TYR A 97 -5.821 11.507 -9.627 1.00 24.45 H new ATOM 0 HD1 TYR A 97 -3.853 12.500 -11.037 1.00 14.10 H new ATOM 0 HD2 TYR A 97 -6.051 9.038 -12.191 1.00 14.41 H new ATOM 0 HE1 TYR A 97 -3.117 12.807 -13.358 1.00 35.00 H new ATOM 0 HE2 TYR A 97 -5.314 9.345 -14.513 1.00 20.21 H new ATOM 0 HH TYR A 97 -4.382 10.817 -15.981 1.00 54.33 H new ATOM 1535 N CYS A 98 -4.148 10.537 -6.730 1.00 0.11 N ATOM 1536 CA CYS A 98 -4.519 10.485 -5.328 1.00 23.31 C ATOM 1537 C CYS A 98 -3.810 11.572 -4.537 1.00 51.44 C ATOM 1538 O CYS A 98 -2.578 11.599 -4.465 1.00 41.33 O ATOM 1539 CB CYS A 98 -4.179 9.116 -4.734 1.00 53.04 C ATOM 1540 SG CYS A 98 -4.526 8.964 -2.962 1.00 31.44 S ATOM 0 H CYS A 98 -3.299 11.069 -6.921 1.00 0.11 H new ATOM 0 HA CYS A 98 -5.595 10.648 -5.262 1.00 23.31 H new ATOM 0 HB2 CYS A 98 -4.742 8.351 -5.269 1.00 53.04 H new ATOM 0 HB3 CYS A 98 -3.122 8.912 -4.904 1.00 53.04 H new ATOM 0 HG CYS A 98 -4.361 10.118 -2.387 1.00 31.44 H new ATOM 1546 N PRO A 99 -4.575 12.497 -3.946 1.00 1.54 N ATOM 1547 CA PRO A 99 -4.032 13.461 -3.000 1.00 14.03 C ATOM 1548 C PRO A 99 -3.680 12.777 -1.687 1.00 20.41 C ATOM 1549 O PRO A 99 -4.228 11.718 -1.365 1.00 50.21 O ATOM 1550 CB PRO A 99 -5.170 14.464 -2.803 1.00 62.24 C ATOM 1551 CG PRO A 99 -6.413 13.721 -3.155 1.00 13.34 C ATOM 1552 CD PRO A 99 -6.019 12.676 -4.165 1.00 33.33 C ATOM 0 HA PRO A 99 -3.115 13.933 -3.354 1.00 14.03 H new ATOM 0 HB2 PRO A 99 -5.204 14.823 -1.774 1.00 62.24 H new ATOM 0 HB3 PRO A 99 -5.040 15.338 -3.442 1.00 62.24 H new ATOM 0 HG2 PRO A 99 -6.852 13.259 -2.271 1.00 13.34 H new ATOM 0 HG3 PRO A 99 -7.163 14.395 -3.568 1.00 13.34 H new ATOM 0 HD2 PRO A 99 -6.565 11.745 -4.010 1.00 33.33 H new ATOM 0 HD3 PRO A 99 -6.231 13.004 -5.183 1.00 33.33 H new ATOM 1560 N ASP A 100 -2.769 13.365 -0.932 1.00 1.41 N ATOM 1561 CA ASP A 100 -2.331 12.763 0.323 1.00 10.22 C ATOM 1562 C ASP A 100 -3.420 12.875 1.380 1.00 50.11 C ATOM 1563 O ASP A 100 -3.492 12.070 2.307 1.00 52.42 O ATOM 1564 CB ASP A 100 -1.049 13.427 0.822 1.00 51.24 C ATOM 1565 CG ASP A 100 -0.460 12.717 2.025 1.00 30.35 C ATOM 1566 OD1 ASP A 100 0.343 11.779 1.830 1.00 43.34 O ATOM 1567 OD2 ASP A 100 -0.789 13.097 3.168 1.00 12.52 O ATOM 0 H ASP A 100 -2.319 14.252 -1.160 1.00 1.41 H new ATOM 0 HA ASP A 100 -2.129 11.708 0.138 1.00 10.22 H new ATOM 0 HB2 ASP A 100 -0.314 13.442 0.017 1.00 51.24 H new ATOM 0 HB3 ASP A 100 -1.258 14.465 1.083 1.00 51.24 H new ATOM 1572 N ASN A 101 -4.289 13.860 1.206 1.00 75.23 N ATOM 1573 CA ASN A 101 -5.360 14.128 2.162 1.00 64.42 C ATOM 1574 C ASN A 101 -6.489 13.106 2.056 1.00 53.41 C ATOM 1575 O ASN A 101 -7.511 13.233 2.733 1.00 30.52 O ATOM 1576 CB ASN A 101 -5.922 15.538 1.955 1.00 30.45 C ATOM 1577 CG ASN A 101 -4.915 16.627 2.274 1.00 20.22 C ATOM 1578 OD1 ASN A 101 -4.157 17.065 1.406 1.00 43.25 O ATOM 1579 ND2 ASN A 101 -4.898 17.071 3.522 1.00 13.20 N ATOM 0 H ASN A 101 -4.275 14.493 0.406 1.00 75.23 H new ATOM 0 HA ASN A 101 -4.927 14.050 3.159 1.00 64.42 H new ATOM 0 HB2 ASN A 101 -6.250 15.645 0.921 1.00 30.45 H new ATOM 0 HB3 ASN A 101 -6.803 15.669 2.584 1.00 30.45 H new ATOM 0 HD21 ASN A 101 -4.241 17.802 3.794 1.00 13.20 H new ATOM 0 HD22 ASN A 101 -5.542 16.682 4.211 1.00 13.20 H new ATOM 1586 N ALA A 102 -6.310 12.100 1.206 1.00 64.23 N ATOM 1587 CA ALA A 102 -7.296 11.038 1.057 1.00 13.14 C ATOM 1588 C ALA A 102 -7.461 10.276 2.373 1.00 23.52 C ATOM 1589 O ALA A 102 -6.507 10.158 3.146 1.00 21.04 O ATOM 1590 CB ALA A 102 -6.881 10.093 -0.064 1.00 53.53 C ATOM 0 H ALA A 102 -5.489 11.999 0.609 1.00 64.23 H new ATOM 0 HA ALA A 102 -8.257 11.483 0.798 1.00 13.14 H new ATOM 0 HB1 ALA A 102 -7.624 9.303 -0.168 1.00 53.53 H new ATOM 0 HB2 ALA A 102 -6.809 10.648 -0.999 1.00 53.53 H new ATOM 0 HB3 ALA A 102 -5.913 9.652 0.172 1.00 53.53 H new ATOM 1596 N PRO A 103 -8.676 9.765 2.648 1.00 32.25 N ATOM 1597 CA PRO A 103 -8.969 9.022 3.880 1.00 51.05 C ATOM 1598 C PRO A 103 -7.978 7.885 4.119 1.00 13.13 C ATOM 1599 O PRO A 103 -7.780 7.038 3.250 1.00 65.41 O ATOM 1600 CB PRO A 103 -10.382 8.461 3.649 1.00 21.01 C ATOM 1601 CG PRO A 103 -10.674 8.680 2.200 1.00 20.33 C ATOM 1602 CD PRO A 103 -9.860 9.869 1.786 1.00 75.43 C ATOM 0 HA PRO A 103 -8.895 9.660 4.761 1.00 51.05 H new ATOM 0 HB2 PRO A 103 -10.428 7.402 3.902 1.00 21.01 H new ATOM 0 HB3 PRO A 103 -11.113 8.971 4.277 1.00 21.01 H new ATOM 0 HG2 PRO A 103 -10.408 7.802 1.612 1.00 20.33 H new ATOM 0 HG3 PRO A 103 -11.737 8.861 2.040 1.00 20.33 H new ATOM 0 HD2 PRO A 103 -9.596 9.831 0.729 1.00 75.43 H new ATOM 0 HD3 PRO A 103 -10.397 10.804 1.947 1.00 75.43 H new ATOM 1610 N VAL A 104 -7.372 7.877 5.307 1.00 63.40 N ATOM 1611 CA VAL A 104 -6.316 6.921 5.656 1.00 51.42 C ATOM 1612 C VAL A 104 -6.753 5.469 5.440 1.00 12.53 C ATOM 1613 O VAL A 104 -5.946 4.622 5.058 1.00 14.25 O ATOM 1614 CB VAL A 104 -5.861 7.103 7.123 1.00 64.31 C ATOM 1615 CG1 VAL A 104 -4.770 6.107 7.489 1.00 0.52 C ATOM 1616 CG2 VAL A 104 -5.373 8.523 7.356 1.00 54.24 C ATOM 0 H VAL A 104 -7.598 8.532 6.055 1.00 63.40 H new ATOM 0 HA VAL A 104 -5.481 7.131 4.987 1.00 51.42 H new ATOM 0 HB VAL A 104 -6.722 6.915 7.765 1.00 64.31 H new ATOM 0 HG11 VAL A 104 -4.471 6.260 8.526 1.00 0.52 H new ATOM 0 HG12 VAL A 104 -5.148 5.092 7.366 1.00 0.52 H new ATOM 0 HG13 VAL A 104 -3.909 6.255 6.837 1.00 0.52 H new ATOM 0 HG21 VAL A 104 -5.057 8.633 8.393 1.00 54.24 H new ATOM 0 HG22 VAL A 104 -4.531 8.731 6.696 1.00 54.24 H new ATOM 0 HG23 VAL A 104 -6.181 9.224 7.146 1.00 54.24 H new ATOM 1626 N ARG A 105 -8.033 5.199 5.660 1.00 40.34 N ATOM 1627 CA ARG A 105 -8.573 3.850 5.509 1.00 53.44 C ATOM 1628 C ARG A 105 -8.378 3.380 4.069 1.00 50.34 C ATOM 1629 O ARG A 105 -7.753 2.350 3.812 1.00 72.43 O ATOM 1630 CB ARG A 105 -10.066 3.807 5.884 1.00 24.20 C ATOM 1631 CG ARG A 105 -10.381 4.166 7.338 1.00 64.00 C ATOM 1632 CD ARG A 105 -10.124 5.639 7.624 1.00 73.35 C ATOM 1633 NE ARG A 105 -10.529 6.047 8.969 1.00 20.14 N ATOM 1634 CZ ARG A 105 -9.689 6.557 9.873 1.00 32.40 C ATOM 1635 NH1 ARG A 105 -8.377 6.501 9.674 1.00 13.21 N ATOM 1636 NH2 ARG A 105 -10.162 7.077 10.997 1.00 1.31 N ATOM 0 H ARG A 105 -8.720 5.897 5.945 1.00 40.34 H new ATOM 0 HA ARG A 105 -8.037 3.183 6.185 1.00 53.44 H new ATOM 0 HB2 ARG A 105 -10.608 4.491 5.231 1.00 24.20 H new ATOM 0 HB3 ARG A 105 -10.447 2.806 5.683 1.00 24.20 H new ATOM 0 HG2 ARG A 105 -11.423 3.930 7.553 1.00 64.00 H new ATOM 0 HG3 ARG A 105 -9.772 3.555 8.004 1.00 64.00 H new ATOM 0 HD2 ARG A 105 -9.062 5.847 7.493 1.00 73.35 H new ATOM 0 HD3 ARG A 105 -10.660 6.243 6.892 1.00 73.35 H new ATOM 0 HE ARG A 105 -11.508 5.936 9.231 1.00 20.14 H new ATOM 0 HH11 ARG A 105 -8.008 6.067 8.828 1.00 13.21 H new ATOM 0 HH12 ARG A 105 -7.739 6.892 10.367 1.00 13.21 H new ATOM 0 HH21 ARG A 105 -11.167 7.087 11.171 1.00 1.31 H new ATOM 0 HH22 ARG A 105 -9.521 7.467 11.688 1.00 1.31 H new ATOM 1650 N ARG A 106 -8.904 4.166 3.136 1.00 10.44 N ATOM 1651 CA ARG A 106 -8.716 3.921 1.711 1.00 23.43 C ATOM 1652 C ARG A 106 -7.244 4.081 1.323 1.00 53.10 C ATOM 1653 O ARG A 106 -6.737 3.367 0.465 1.00 63.44 O ATOM 1654 CB ARG A 106 -9.584 4.896 0.909 1.00 30.34 C ATOM 1655 CG ARG A 106 -9.298 4.904 -0.581 1.00 3.34 C ATOM 1656 CD ARG A 106 -10.073 6.003 -1.288 1.00 52.41 C ATOM 1657 NE ARG A 106 -11.493 5.685 -1.430 1.00 5.34 N ATOM 1658 CZ ARG A 106 -12.440 6.590 -1.676 1.00 35.43 C ATOM 1659 NH1 ARG A 106 -12.151 7.887 -1.667 1.00 42.43 N ATOM 1660 NH2 ARG A 106 -13.686 6.199 -1.901 1.00 74.23 N ATOM 0 H ARG A 106 -9.471 4.988 3.345 1.00 10.44 H new ATOM 0 HA ARG A 106 -9.016 2.898 1.485 1.00 23.43 H new ATOM 0 HB2 ARG A 106 -10.633 4.643 1.065 1.00 30.34 H new ATOM 0 HB3 ARG A 106 -9.437 5.902 1.301 1.00 30.34 H new ATOM 0 HG2 ARG A 106 -8.230 5.045 -0.747 1.00 3.34 H new ATOM 0 HG3 ARG A 106 -9.562 3.937 -1.009 1.00 3.34 H new ATOM 0 HD2 ARG A 106 -9.966 6.934 -0.731 1.00 52.41 H new ATOM 0 HD3 ARG A 106 -9.641 6.171 -2.275 1.00 52.41 H new ATOM 0 HE ARG A 106 -11.777 4.710 -1.335 1.00 5.34 H new ATOM 0 HH11 ARG A 106 -11.199 8.196 -1.471 1.00 42.43 H new ATOM 0 HH12 ARG A 106 -12.881 8.574 -1.856 1.00 42.43 H new ATOM 0 HH21 ARG A 106 -13.920 5.206 -1.886 1.00 74.23 H new ATOM 0 HH22 ARG A 106 -14.411 6.891 -2.089 1.00 74.23 H new ATOM 1674 N ARG A 107 -6.575 5.024 1.978 1.00 31.04 N ATOM 1675 CA ARG A 107 -5.163 5.318 1.730 1.00 65.41 C ATOM 1676 C ARG A 107 -4.299 4.073 1.943 1.00 51.02 C ATOM 1677 O ARG A 107 -3.384 3.804 1.166 1.00 71.54 O ATOM 1678 CB ARG A 107 -4.712 6.439 2.672 1.00 40.33 C ATOM 1679 CG ARG A 107 -3.317 6.989 2.412 1.00 11.41 C ATOM 1680 CD ARG A 107 -3.255 7.801 1.125 1.00 45.14 C ATOM 1681 NE ARG A 107 -2.062 8.649 1.080 1.00 34.34 N ATOM 1682 CZ ARG A 107 -1.462 9.048 -0.042 1.00 35.25 C ATOM 1683 NH1 ARG A 107 -1.923 8.658 -1.227 1.00 45.33 N ATOM 1684 NH2 ARG A 107 -0.401 9.845 0.023 1.00 44.10 N ATOM 0 H ARG A 107 -6.996 5.610 2.699 1.00 31.04 H new ATOM 0 HA ARG A 107 -5.044 5.635 0.694 1.00 65.41 H new ATOM 0 HB2 ARG A 107 -5.426 7.259 2.601 1.00 40.33 H new ATOM 0 HB3 ARG A 107 -4.753 6.068 3.696 1.00 40.33 H new ATOM 0 HG2 ARG A 107 -3.012 7.615 3.251 1.00 11.41 H new ATOM 0 HG3 ARG A 107 -2.607 6.164 2.355 1.00 11.41 H new ATOM 0 HD2 ARG A 107 -3.256 7.127 0.268 1.00 45.14 H new ATOM 0 HD3 ARG A 107 -4.147 8.422 1.043 1.00 45.14 H new ATOM 0 HE ARG A 107 -1.663 8.955 1.967 1.00 34.34 H new ATOM 0 HH11 ARG A 107 -2.740 8.050 -1.281 1.00 45.33 H new ATOM 0 HH12 ARG A 107 -1.459 8.967 -2.081 1.00 45.33 H new ATOM 0 HH21 ARG A 107 -0.047 10.150 0.930 1.00 44.10 H new ATOM 0 HH22 ARG A 107 0.060 10.152 -0.834 1.00 44.10 H new ATOM 1698 N MET A 108 -4.599 3.320 2.996 1.00 54.32 N ATOM 1699 CA MET A 108 -3.875 2.088 3.296 1.00 74.43 C ATOM 1700 C MET A 108 -4.117 1.035 2.218 1.00 24.04 C ATOM 1701 O MET A 108 -3.180 0.377 1.757 1.00 2.22 O ATOM 1702 CB MET A 108 -4.293 1.556 4.670 1.00 5.12 C ATOM 1703 CG MET A 108 -3.742 0.176 4.992 1.00 11.51 C ATOM 1704 SD MET A 108 -1.941 0.105 4.913 1.00 52.12 S ATOM 1705 CE MET A 108 -1.656 -1.603 5.371 1.00 74.51 C ATOM 0 H MET A 108 -5.342 3.542 3.659 1.00 54.32 H new ATOM 0 HA MET A 108 -2.808 2.311 3.313 1.00 74.43 H new ATOM 0 HB2 MET A 108 -3.961 2.257 5.436 1.00 5.12 H new ATOM 0 HB3 MET A 108 -5.381 1.522 4.720 1.00 5.12 H new ATOM 0 HG2 MET A 108 -4.069 -0.117 5.990 1.00 11.51 H new ATOM 0 HG3 MET A 108 -4.160 -0.549 4.294 1.00 11.51 H new ATOM 0 HE1 MET A 108 -0.585 -1.806 5.369 1.00 74.51 H new ATOM 0 HE2 MET A 108 -2.058 -1.784 6.368 1.00 74.51 H new ATOM 0 HE3 MET A 108 -2.151 -2.259 4.655 1.00 74.51 H new ATOM 1715 N LEU A 109 -5.373 0.882 1.816 1.00 30.54 N ATOM 1716 CA LEU A 109 -5.726 -0.047 0.748 1.00 34.12 C ATOM 1717 C LEU A 109 -5.040 0.368 -0.548 1.00 50.34 C ATOM 1718 O LEU A 109 -4.501 -0.464 -1.278 1.00 12.44 O ATOM 1719 CB LEU A 109 -7.244 -0.073 0.549 1.00 63.14 C ATOM 1720 CG LEU A 109 -8.061 -0.445 1.790 1.00 11.32 C ATOM 1721 CD1 LEU A 109 -9.552 -0.337 1.499 1.00 61.25 C ATOM 1722 CD2 LEU A 109 -7.709 -1.850 2.258 1.00 3.02 C ATOM 0 H LEU A 109 -6.164 1.389 2.213 1.00 30.54 H new ATOM 0 HA LEU A 109 -5.391 -1.046 1.026 1.00 34.12 H new ATOM 0 HB2 LEU A 109 -7.565 0.910 0.204 1.00 63.14 H new ATOM 0 HB3 LEU A 109 -7.478 -0.782 -0.245 1.00 63.14 H new ATOM 0 HG LEU A 109 -7.815 0.256 2.588 1.00 11.32 H new ATOM 0 HD11 LEU A 109 -10.117 -0.605 2.392 1.00 61.25 H new ATOM 0 HD12 LEU A 109 -9.793 0.686 1.210 1.00 61.25 H new ATOM 0 HD13 LEU A 109 -9.814 -1.015 0.687 1.00 61.25 H new ATOM 0 HD21 LEU A 109 -8.299 -2.098 3.141 1.00 3.02 H new ATOM 0 HD22 LEU A 109 -7.927 -2.564 1.463 1.00 3.02 H new ATOM 0 HD23 LEU A 109 -6.648 -1.896 2.506 1.00 3.02 H new ATOM 1734 N TYR A 110 -5.065 1.669 -0.804 1.00 53.22 N ATOM 1735 CA TYR A 110 -4.403 2.274 -1.954 1.00 71.44 C ATOM 1736 C TYR A 110 -2.914 1.937 -1.967 1.00 14.50 C ATOM 1737 O TYR A 110 -2.383 1.457 -2.970 1.00 33.12 O ATOM 1738 CB TYR A 110 -4.617 3.794 -1.902 1.00 23.25 C ATOM 1739 CG TYR A 110 -3.787 4.599 -2.878 1.00 50.24 C ATOM 1740 CD1 TYR A 110 -4.229 4.835 -4.173 1.00 53.53 C ATOM 1741 CD2 TYR A 110 -2.573 5.149 -2.489 1.00 4.11 C ATOM 1742 CE1 TYR A 110 -3.481 5.594 -5.053 1.00 71.41 C ATOM 1743 CE2 TYR A 110 -1.819 5.903 -3.362 1.00 31.34 C ATOM 1744 CZ TYR A 110 -2.277 6.126 -4.641 1.00 55.34 C ATOM 1745 OH TYR A 110 -1.535 6.890 -5.509 1.00 25.44 O ATOM 0 H TYR A 110 -5.551 2.343 -0.212 1.00 53.22 H new ATOM 0 HA TYR A 110 -4.834 1.875 -2.872 1.00 71.44 H new ATOM 0 HB2 TYR A 110 -5.670 4.002 -2.089 1.00 23.25 H new ATOM 0 HB3 TYR A 110 -4.398 4.141 -0.892 1.00 23.25 H new ATOM 0 HD1 TYR A 110 -5.171 4.419 -4.497 1.00 53.53 H new ATOM 0 HD2 TYR A 110 -2.213 4.983 -1.484 1.00 4.11 H new ATOM 0 HE1 TYR A 110 -3.837 5.770 -6.057 1.00 71.41 H new ATOM 0 HE2 TYR A 110 -0.873 6.317 -3.044 1.00 31.34 H new ATOM 0 HH TYR A 110 -0.715 7.189 -5.063 1.00 25.44 H new ATOM 1755 N ALA A 111 -2.254 2.171 -0.842 1.00 34.33 N ATOM 1756 CA ALA A 111 -0.823 1.930 -0.730 1.00 24.42 C ATOM 1757 C ALA A 111 -0.497 0.447 -0.901 1.00 42.41 C ATOM 1758 O ALA A 111 0.520 0.092 -1.490 1.00 55.13 O ATOM 1759 CB ALA A 111 -0.306 2.440 0.605 1.00 31.53 C ATOM 0 H ALA A 111 -2.688 2.529 0.009 1.00 34.33 H new ATOM 0 HA ALA A 111 -0.324 2.475 -1.531 1.00 24.42 H new ATOM 0 HB1 ALA A 111 0.766 2.253 0.676 1.00 31.53 H new ATOM 0 HB2 ALA A 111 -0.494 3.511 0.683 1.00 31.53 H new ATOM 0 HB3 ALA A 111 -0.819 1.922 1.416 1.00 31.53 H new ATOM 1765 N SER A 112 -1.375 -0.413 -0.400 1.00 43.32 N ATOM 1766 CA SER A 112 -1.171 -1.855 -0.473 1.00 74.53 C ATOM 1767 C SER A 112 -1.562 -2.399 -1.844 1.00 43.45 C ATOM 1768 O SER A 112 -1.267 -3.546 -2.180 1.00 40.23 O ATOM 1769 CB SER A 112 -1.978 -2.544 0.627 1.00 73.34 C ATOM 1770 OG SER A 112 -1.662 -1.992 1.896 1.00 44.44 O ATOM 0 H SER A 112 -2.240 -0.135 0.064 1.00 43.32 H new ATOM 0 HA SER A 112 -0.111 -2.063 -0.325 1.00 74.53 H new ATOM 0 HB2 SER A 112 -3.044 -2.430 0.430 1.00 73.34 H new ATOM 0 HB3 SER A 112 -1.766 -3.613 0.626 1.00 73.34 H new ATOM 0 HG SER A 112 -2.126 -1.136 2.005 1.00 44.44 H new ATOM 1776 N SER A 113 -2.214 -1.562 -2.633 1.00 71.21 N ATOM 1777 CA SER A 113 -2.658 -1.945 -3.961 1.00 55.41 C ATOM 1778 C SER A 113 -1.554 -1.714 -4.988 1.00 1.04 C ATOM 1779 O SER A 113 -1.572 -2.306 -6.069 1.00 33.12 O ATOM 1780 CB SER A 113 -3.911 -1.142 -4.333 1.00 25.11 C ATOM 1781 OG SER A 113 -4.376 -1.464 -5.630 1.00 14.31 O ATOM 0 H SER A 113 -2.449 -0.604 -2.373 1.00 71.21 H new ATOM 0 HA SER A 113 -2.899 -3.008 -3.960 1.00 55.41 H new ATOM 0 HB2 SER A 113 -4.698 -1.339 -3.605 1.00 25.11 H new ATOM 0 HB3 SER A 113 -3.688 -0.076 -4.281 1.00 25.11 H new ATOM 0 HG SER A 113 -5.176 -0.934 -5.832 1.00 14.31 H new ATOM 1787 N VAL A 114 -0.586 -0.874 -4.628 1.00 42.33 N ATOM 1788 CA VAL A 114 0.476 -0.465 -5.546 1.00 1.33 C ATOM 1789 C VAL A 114 1.256 -1.659 -6.094 1.00 52.25 C ATOM 1790 O VAL A 114 1.309 -1.862 -7.306 1.00 22.44 O ATOM 1791 CB VAL A 114 1.455 0.528 -4.879 1.00 43.45 C ATOM 1792 CG1 VAL A 114 2.570 0.927 -5.837 1.00 54.13 C ATOM 1793 CG2 VAL A 114 0.709 1.760 -4.392 1.00 20.20 C ATOM 0 H VAL A 114 -0.515 -0.460 -3.699 1.00 42.33 H new ATOM 0 HA VAL A 114 -0.020 0.033 -6.379 1.00 1.33 H new ATOM 0 HB VAL A 114 1.909 0.030 -4.022 1.00 43.45 H new ATOM 0 HG11 VAL A 114 3.243 1.626 -5.341 1.00 54.13 H new ATOM 0 HG12 VAL A 114 3.126 0.039 -6.138 1.00 54.13 H new ATOM 0 HG13 VAL A 114 2.140 1.402 -6.719 1.00 54.13 H new ATOM 0 HG21 VAL A 114 1.412 2.450 -3.925 1.00 20.20 H new ATOM 0 HG22 VAL A 114 0.226 2.251 -5.237 1.00 20.20 H new ATOM 0 HG23 VAL A 114 -0.047 1.464 -3.665 1.00 20.20 H new ATOM 1803 N ARG A 115 1.844 -2.456 -5.206 1.00 22.30 N ATOM 1804 CA ARG A 115 2.671 -3.582 -5.634 1.00 44.41 C ATOM 1805 C ARG A 115 1.824 -4.620 -6.365 1.00 75.11 C ATOM 1806 O ARG A 115 2.281 -5.242 -7.325 1.00 3.42 O ATOM 1807 CB ARG A 115 3.392 -4.212 -4.428 1.00 64.51 C ATOM 1808 CG ARG A 115 4.474 -5.228 -4.797 1.00 55.30 C ATOM 1809 CD ARG A 115 3.902 -6.618 -5.045 1.00 62.21 C ATOM 1810 NE ARG A 115 4.894 -7.527 -5.625 1.00 52.52 N ATOM 1811 CZ ARG A 115 4.748 -8.851 -5.698 1.00 21.20 C ATOM 1812 NH1 ARG A 115 3.676 -9.439 -5.180 1.00 55.43 N ATOM 1813 NH2 ARG A 115 5.674 -9.594 -6.292 1.00 51.14 N ATOM 0 H ARG A 115 1.765 -2.346 -4.195 1.00 22.30 H new ATOM 0 HA ARG A 115 3.428 -3.213 -6.326 1.00 44.41 H new ATOM 0 HB2 ARG A 115 3.845 -3.417 -3.835 1.00 64.51 H new ATOM 0 HB3 ARG A 115 2.653 -4.701 -3.794 1.00 64.51 H new ATOM 0 HG2 ARG A 115 4.998 -4.889 -5.690 1.00 55.30 H new ATOM 0 HG3 ARG A 115 5.210 -5.278 -3.995 1.00 55.30 H new ATOM 0 HD2 ARG A 115 3.537 -7.032 -4.105 1.00 62.21 H new ATOM 0 HD3 ARG A 115 3.045 -6.543 -5.714 1.00 62.21 H new ATOM 0 HE ARG A 115 5.752 -7.121 -5.997 1.00 52.52 H new ATOM 0 HH11 ARG A 115 2.957 -8.878 -4.723 1.00 55.43 H new ATOM 0 HH12 ARG A 115 3.571 -10.452 -5.240 1.00 55.43 H new ATOM 0 HH21 ARG A 115 6.501 -9.153 -6.695 1.00 51.14 H new ATOM 0 HH22 ARG A 115 5.559 -10.606 -6.346 1.00 51.14 H new ATOM 1827 N ALA A 116 0.583 -4.779 -5.922 1.00 62.23 N ATOM 1828 CA ALA A 116 -0.316 -5.771 -6.496 1.00 4.35 C ATOM 1829 C ALA A 116 -0.548 -5.519 -7.983 1.00 12.40 C ATOM 1830 O ALA A 116 -0.286 -6.387 -8.813 1.00 34.02 O ATOM 1831 CB ALA A 116 -1.638 -5.783 -5.744 1.00 15.22 C ATOM 0 H ALA A 116 0.176 -4.231 -5.164 1.00 62.23 H new ATOM 0 HA ALA A 116 0.155 -6.749 -6.396 1.00 4.35 H new ATOM 0 HB1 ALA A 116 -2.300 -6.529 -6.184 1.00 15.22 H new ATOM 0 HB2 ALA A 116 -1.459 -6.029 -4.697 1.00 15.22 H new ATOM 0 HB3 ALA A 116 -2.104 -4.800 -5.811 1.00 15.22 H new ATOM 1837 N LEU A 117 -1.014 -4.323 -8.320 1.00 65.22 N ATOM 1838 CA LEU A 117 -1.335 -3.998 -9.707 1.00 65.45 C ATOM 1839 C LEU A 117 -0.074 -3.762 -10.538 1.00 2.54 C ATOM 1840 O LEU A 117 -0.097 -3.903 -11.760 1.00 41.51 O ATOM 1841 CB LEU A 117 -2.287 -2.789 -9.783 1.00 74.02 C ATOM 1842 CG LEU A 117 -1.870 -1.530 -9.008 1.00 43.41 C ATOM 1843 CD1 LEU A 117 -0.786 -0.756 -9.743 1.00 11.51 C ATOM 1844 CD2 LEU A 117 -3.079 -0.641 -8.763 1.00 43.30 C ATOM 0 H LEU A 117 -1.178 -3.565 -7.658 1.00 65.22 H new ATOM 0 HA LEU A 117 -1.848 -4.859 -10.136 1.00 65.45 H new ATOM 0 HB2 LEU A 117 -2.409 -2.518 -10.832 1.00 74.02 H new ATOM 0 HB3 LEU A 117 -3.265 -3.103 -9.419 1.00 74.02 H new ATOM 0 HG LEU A 117 -1.459 -1.848 -8.050 1.00 43.41 H new ATOM 0 HD11 LEU A 117 -0.516 0.128 -9.166 1.00 11.51 H new ATOM 0 HD12 LEU A 117 0.092 -1.390 -9.869 1.00 11.51 H new ATOM 0 HD13 LEU A 117 -1.157 -0.451 -10.722 1.00 11.51 H new ATOM 0 HD21 LEU A 117 -2.771 0.248 -8.213 1.00 43.30 H new ATOM 0 HD22 LEU A 117 -3.512 -0.345 -9.718 1.00 43.30 H new ATOM 0 HD23 LEU A 117 -3.821 -1.188 -8.182 1.00 43.30 H new ATOM 1856 N LYS A 118 1.019 -3.417 -9.864 1.00 60.01 N ATOM 1857 CA LYS A 118 2.272 -3.086 -10.532 1.00 65.03 C ATOM 1858 C LYS A 118 2.722 -4.224 -11.444 1.00 21.23 C ATOM 1859 O LYS A 118 2.907 -4.034 -12.646 1.00 41.33 O ATOM 1860 CB LYS A 118 3.355 -2.789 -9.489 1.00 51.11 C ATOM 1861 CG LYS A 118 4.273 -1.633 -9.860 1.00 12.11 C ATOM 1862 CD LYS A 118 5.248 -1.993 -10.969 1.00 2.30 C ATOM 1863 CE LYS A 118 5.262 -0.925 -12.048 1.00 62.05 C ATOM 1864 NZ LYS A 118 6.456 -1.032 -12.930 1.00 11.42 N ATOM 0 H LYS A 118 1.061 -3.359 -8.846 1.00 60.01 H new ATOM 0 HA LYS A 118 2.110 -2.201 -11.147 1.00 65.03 H new ATOM 0 HB2 LYS A 118 2.875 -2.567 -8.536 1.00 51.11 H new ATOM 0 HB3 LYS A 118 3.958 -3.685 -9.341 1.00 51.11 H new ATOM 0 HG2 LYS A 118 3.670 -0.781 -10.174 1.00 12.11 H new ATOM 0 HG3 LYS A 118 4.831 -1.320 -8.978 1.00 12.11 H new ATOM 0 HD2 LYS A 118 6.249 -2.109 -10.554 1.00 2.30 H new ATOM 0 HD3 LYS A 118 4.970 -2.952 -11.405 1.00 2.30 H new ATOM 0 HE2 LYS A 118 4.358 -1.009 -12.651 1.00 62.05 H new ATOM 0 HE3 LYS A 118 5.244 0.060 -11.582 1.00 62.05 H new ATOM 0 HZ1 LYS A 118 6.621 -0.120 -13.402 1.00 11.42 H new ATOM 0 HZ2 LYS A 118 7.288 -1.282 -12.359 1.00 11.42 H new ATOM 0 HZ3 LYS A 118 6.294 -1.768 -13.646 1.00 11.42 H new ATOM 1878 N ALA A 119 2.899 -5.403 -10.869 1.00 22.53 N ATOM 1879 CA ALA A 119 3.352 -6.554 -11.633 1.00 74.23 C ATOM 1880 C ALA A 119 2.189 -7.284 -12.299 1.00 35.05 C ATOM 1881 O ALA A 119 2.281 -7.684 -13.460 1.00 14.23 O ATOM 1882 CB ALA A 119 4.133 -7.503 -10.737 1.00 74.24 C ATOM 0 H ALA A 119 2.736 -5.588 -9.879 1.00 22.53 H new ATOM 0 HA ALA A 119 4.007 -6.191 -12.425 1.00 74.23 H new ATOM 0 HB1 ALA A 119 4.467 -8.361 -11.320 1.00 74.24 H new ATOM 0 HB2 ALA A 119 4.999 -6.985 -10.325 1.00 74.24 H new ATOM 0 HB3 ALA A 119 3.493 -7.844 -9.923 1.00 74.24 H new ATOM 1888 N SER A 120 1.087 -7.424 -11.568 1.00 61.42 N ATOM 1889 CA SER A 120 -0.018 -8.282 -11.989 1.00 31.31 C ATOM 1890 C SER A 120 -0.725 -7.750 -13.238 1.00 45.52 C ATOM 1891 O SER A 120 -1.280 -8.529 -14.014 1.00 52.54 O ATOM 1892 CB SER A 120 -1.023 -8.445 -10.840 1.00 72.42 C ATOM 1893 OG SER A 120 -1.965 -9.475 -11.102 1.00 2.45 O ATOM 0 H SER A 120 0.934 -6.952 -10.677 1.00 61.42 H new ATOM 0 HA SER A 120 0.404 -9.253 -12.248 1.00 31.31 H new ATOM 0 HB2 SER A 120 -0.487 -8.669 -9.918 1.00 72.42 H new ATOM 0 HB3 SER A 120 -1.549 -7.504 -10.682 1.00 72.42 H new ATOM 0 HG SER A 120 -2.370 -9.770 -10.260 1.00 2.45 H new ATOM 1899 N LEU A 121 -0.694 -6.438 -13.453 1.00 35.15 N ATOM 1900 CA LEU A 121 -1.414 -5.849 -14.582 1.00 44.35 C ATOM 1901 C LEU A 121 -0.526 -5.754 -15.816 1.00 52.40 C ATOM 1902 O LEU A 121 -0.885 -5.108 -16.799 1.00 21.31 O ATOM 1903 CB LEU A 121 -1.968 -4.465 -14.224 1.00 13.41 C ATOM 1904 CG LEU A 121 -3.378 -4.451 -13.616 1.00 73.14 C ATOM 1905 CD1 LEU A 121 -3.436 -5.261 -12.329 1.00 14.12 C ATOM 1906 CD2 LEU A 121 -3.827 -3.020 -13.363 1.00 32.13 C ATOM 0 H LEU A 121 -0.187 -5.770 -12.872 1.00 35.15 H new ATOM 0 HA LEU A 121 -2.251 -6.509 -14.811 1.00 44.35 H new ATOM 0 HB2 LEU A 121 -1.284 -3.991 -13.520 1.00 13.41 H new ATOM 0 HB3 LEU A 121 -1.974 -3.852 -15.125 1.00 13.41 H new ATOM 0 HG LEU A 121 -4.057 -4.915 -14.331 1.00 73.14 H new ATOM 0 HD11 LEU A 121 -4.448 -5.230 -11.925 1.00 14.12 H new ATOM 0 HD12 LEU A 121 -3.160 -6.295 -12.537 1.00 14.12 H new ATOM 0 HD13 LEU A 121 -2.742 -4.839 -11.602 1.00 14.12 H new ATOM 0 HD21 LEU A 121 -4.828 -3.024 -12.932 1.00 32.13 H new ATOM 0 HD22 LEU A 121 -3.136 -2.539 -12.671 1.00 32.13 H new ATOM 0 HD23 LEU A 121 -3.839 -2.471 -14.304 1.00 32.13 H new ATOM 1918 N GLY A 122 0.630 -6.406 -15.766 1.00 42.33 N ATOM 1919 CA GLY A 122 1.537 -6.392 -16.900 1.00 53.12 C ATOM 1920 C GLY A 122 2.277 -5.077 -17.025 1.00 73.44 C ATOM 1921 O GLY A 122 2.893 -4.790 -18.049 1.00 1.11 O ATOM 0 H GLY A 122 0.956 -6.943 -14.962 1.00 42.33 H new ATOM 0 HA2 GLY A 122 2.257 -7.204 -16.797 1.00 53.12 H new ATOM 0 HA3 GLY A 122 0.975 -6.579 -17.815 1.00 53.12 H new ATOM 1925 N LEU A 123 2.220 -4.278 -15.971 1.00 10.43 N ATOM 1926 CA LEU A 123 2.880 -2.982 -15.951 1.00 12.01 C ATOM 1927 C LEU A 123 4.269 -3.113 -15.345 1.00 63.10 C ATOM 1928 O LEU A 123 4.852 -2.135 -14.881 1.00 51.43 O ATOM 1929 CB LEU A 123 2.045 -1.986 -15.146 1.00 22.42 C ATOM 1930 CG LEU A 123 0.659 -1.690 -15.722 1.00 62.43 C ATOM 1931 CD1 LEU A 123 -0.163 -0.879 -14.736 1.00 72.42 C ATOM 1932 CD2 LEU A 123 0.781 -0.950 -17.046 1.00 71.15 C ATOM 0 H LEU A 123 1.719 -4.507 -15.112 1.00 10.43 H new ATOM 0 HA LEU A 123 2.977 -2.617 -16.973 1.00 12.01 H new ATOM 0 HB2 LEU A 123 1.926 -2.370 -14.133 1.00 22.42 H new ATOM 0 HB3 LEU A 123 2.598 -1.050 -15.070 1.00 22.42 H new ATOM 0 HG LEU A 123 0.150 -2.637 -15.900 1.00 62.43 H new ATOM 0 HD11 LEU A 123 -1.146 -0.677 -15.161 1.00 72.42 H new ATOM 0 HD12 LEU A 123 -0.277 -1.441 -13.809 1.00 72.42 H new ATOM 0 HD13 LEU A 123 0.343 0.064 -14.529 1.00 72.42 H new ATOM 0 HD21 LEU A 123 -0.214 -0.747 -17.442 1.00 71.15 H new ATOM 0 HD22 LEU A 123 1.308 -0.009 -16.890 1.00 71.15 H new ATOM 0 HD23 LEU A 123 1.336 -1.563 -17.756 1.00 71.15 H new ATOM 1944 N GLU A 124 4.795 -4.331 -15.385 1.00 71.44 N ATOM 1945 CA GLU A 124 6.072 -4.666 -14.765 1.00 12.54 C ATOM 1946 C GLU A 124 7.186 -3.699 -15.179 1.00 30.42 C ATOM 1947 O GLU A 124 7.812 -3.074 -14.326 1.00 74.12 O ATOM 1948 CB GLU A 124 6.450 -6.111 -15.111 1.00 31.52 C ATOM 1949 CG GLU A 124 6.454 -6.402 -16.604 1.00 24.41 C ATOM 1950 CD GLU A 124 6.719 -7.855 -16.926 1.00 11.23 C ATOM 1951 OE1 GLU A 124 7.750 -8.393 -16.476 1.00 12.31 O ATOM 1952 OE2 GLU A 124 5.907 -8.458 -17.659 1.00 11.43 O ATOM 0 H GLU A 124 4.345 -5.119 -15.851 1.00 71.44 H new ATOM 0 HA GLU A 124 5.957 -4.570 -13.685 1.00 12.54 H new ATOM 0 HB2 GLU A 124 7.439 -6.325 -14.706 1.00 31.52 H new ATOM 0 HB3 GLU A 124 5.751 -6.788 -14.620 1.00 31.52 H new ATOM 0 HG2 GLU A 124 5.492 -6.112 -17.027 1.00 24.41 H new ATOM 0 HG3 GLU A 124 7.213 -5.785 -17.086 1.00 24.41 H new ATOM 1959 N SER A 125 7.399 -3.550 -16.479 1.00 50.32 N ATOM 1960 CA SER A 125 8.481 -2.717 -16.987 1.00 63.33 C ATOM 1961 C SER A 125 7.983 -1.308 -17.299 1.00 34.15 C ATOM 1962 O SER A 125 8.727 -0.470 -17.808 1.00 2.41 O ATOM 1963 CB SER A 125 9.067 -3.353 -18.247 1.00 53.50 C ATOM 1964 OG SER A 125 9.238 -4.750 -18.076 1.00 45.34 O ATOM 0 H SER A 125 6.836 -3.996 -17.203 1.00 50.32 H new ATOM 0 HA SER A 125 9.253 -2.644 -16.221 1.00 63.33 H new ATOM 0 HB2 SER A 125 8.408 -3.164 -19.095 1.00 53.50 H new ATOM 0 HB3 SER A 125 10.026 -2.891 -18.480 1.00 53.50 H new ATOM 0 HG SER A 125 9.612 -5.136 -18.895 1.00 45.34 H new ATOM 1970 N LEU A 126 6.723 -1.049 -16.987 1.00 61.42 N ATOM 1971 CA LEU A 126 6.118 0.237 -17.296 1.00 52.41 C ATOM 1972 C LEU A 126 6.299 1.210 -16.139 1.00 32.15 C ATOM 1973 O LEU A 126 6.525 0.800 -14.995 1.00 75.30 O ATOM 1974 CB LEU A 126 4.631 0.080 -17.637 1.00 13.22 C ATOM 1975 CG LEU A 126 4.322 -0.574 -18.993 1.00 72.14 C ATOM 1976 CD1 LEU A 126 5.097 0.109 -20.110 1.00 44.40 C ATOM 1977 CD2 LEU A 126 4.617 -2.068 -18.975 1.00 23.13 C ATOM 0 H LEU A 126 6.101 -1.710 -16.521 1.00 61.42 H new ATOM 0 HA LEU A 126 6.625 0.643 -18.171 1.00 52.41 H new ATOM 0 HB2 LEU A 126 4.158 -0.512 -16.853 1.00 13.22 H new ATOM 0 HB3 LEU A 126 4.167 1.066 -17.616 1.00 13.22 H new ATOM 0 HG LEU A 126 3.256 -0.448 -19.182 1.00 72.14 H new ATOM 0 HD11 LEU A 126 4.863 -0.370 -21.061 1.00 44.40 H new ATOM 0 HD12 LEU A 126 4.818 1.162 -20.156 1.00 44.40 H new ATOM 0 HD13 LEU A 126 6.166 0.025 -19.915 1.00 44.40 H new ATOM 0 HD21 LEU A 126 4.386 -2.496 -19.951 1.00 23.13 H new ATOM 0 HD22 LEU A 126 5.671 -2.228 -18.748 1.00 23.13 H new ATOM 0 HD23 LEU A 126 4.005 -2.551 -18.213 1.00 23.13 H new ATOM 1989 N PHE A 127 6.191 2.494 -16.442 1.00 64.43 N ATOM 1990 CA PHE A 127 6.455 3.538 -15.466 1.00 33.33 C ATOM 1991 C PHE A 127 5.201 3.892 -14.682 1.00 11.32 C ATOM 1992 O PHE A 127 4.085 3.834 -15.204 1.00 70.22 O ATOM 1993 CB PHE A 127 7.014 4.781 -16.160 1.00 44.05 C ATOM 1994 CG PHE A 127 8.316 4.527 -16.862 1.00 13.12 C ATOM 1995 CD1 PHE A 127 9.517 4.626 -16.177 1.00 1.45 C ATOM 1996 CD2 PHE A 127 8.340 4.175 -18.201 1.00 20.52 C ATOM 1997 CE1 PHE A 127 10.717 4.384 -16.817 1.00 11.32 C ATOM 1998 CE2 PHE A 127 9.535 3.931 -18.844 1.00 34.10 C ATOM 1999 CZ PHE A 127 10.725 4.034 -18.152 1.00 73.43 C ATOM 0 H PHE A 127 5.920 2.839 -17.363 1.00 64.43 H new ATOM 0 HA PHE A 127 7.196 3.160 -14.761 1.00 33.33 H new ATOM 0 HB2 PHE A 127 6.284 5.146 -16.882 1.00 44.05 H new ATOM 0 HB3 PHE A 127 7.154 5.570 -15.421 1.00 44.05 H new ATOM 0 HD1 PHE A 127 9.515 4.895 -15.131 1.00 1.45 H new ATOM 0 HD2 PHE A 127 7.412 4.091 -18.748 1.00 20.52 H new ATOM 0 HE1 PHE A 127 11.647 4.468 -16.274 1.00 11.32 H new ATOM 0 HE2 PHE A 127 9.540 3.659 -19.889 1.00 34.10 H new ATOM 0 HZ PHE A 127 11.661 3.841 -18.655 1.00 73.43 H new ATOM 2009 N GLN A 128 5.402 4.251 -13.424 1.00 22.33 N ATOM 2010 CA GLN A 128 4.311 4.591 -12.530 1.00 25.22 C ATOM 2011 C GLN A 128 4.520 5.995 -11.974 1.00 62.32 C ATOM 2012 O GLN A 128 5.511 6.264 -11.293 1.00 41.33 O ATOM 2013 CB GLN A 128 4.235 3.545 -11.409 1.00 24.45 C ATOM 2014 CG GLN A 128 3.117 3.758 -10.397 1.00 21.12 C ATOM 2015 CD GLN A 128 3.591 4.429 -9.120 1.00 24.11 C ATOM 2016 OE1 GLN A 128 4.054 3.763 -8.195 1.00 1.51 O ATOM 2017 NE2 GLN A 128 3.456 5.745 -9.046 1.00 14.50 N ATOM 0 H GLN A 128 6.326 4.314 -12.996 1.00 22.33 H new ATOM 0 HA GLN A 128 3.364 4.585 -13.070 1.00 25.22 H new ATOM 0 HB2 GLN A 128 4.112 2.561 -11.860 1.00 24.45 H new ATOM 0 HB3 GLN A 128 5.187 3.535 -10.878 1.00 24.45 H new ATOM 0 HG2 GLN A 128 2.335 4.366 -10.851 1.00 21.12 H new ATOM 0 HG3 GLN A 128 2.670 2.795 -10.150 1.00 21.12 H new ATOM 0 HE21 GLN A 128 3.068 6.263 -9.834 1.00 14.50 H new ATOM 0 HE22 GLN A 128 3.740 6.240 -8.201 1.00 14.50 H new ATOM 2026 N VAL A 129 3.590 6.884 -12.281 1.00 11.52 N ATOM 2027 CA VAL A 129 3.681 8.275 -11.859 1.00 43.33 C ATOM 2028 C VAL A 129 2.553 8.594 -10.884 1.00 65.45 C ATOM 2029 O VAL A 129 1.476 8.004 -10.967 1.00 10.15 O ATOM 2030 CB VAL A 129 3.608 9.229 -13.079 1.00 33.32 C ATOM 2031 CG1 VAL A 129 3.768 10.682 -12.659 1.00 75.55 C ATOM 2032 CG2 VAL A 129 4.663 8.857 -14.109 1.00 34.23 C ATOM 0 H VAL A 129 2.756 6.666 -12.826 1.00 11.52 H new ATOM 0 HA VAL A 129 4.641 8.423 -11.365 1.00 43.33 H new ATOM 0 HB VAL A 129 2.621 9.118 -13.529 1.00 33.32 H new ATOM 0 HG11 VAL A 129 3.712 11.323 -13.539 1.00 75.55 H new ATOM 0 HG12 VAL A 129 2.972 10.949 -11.964 1.00 75.55 H new ATOM 0 HG13 VAL A 129 4.735 10.816 -12.173 1.00 75.55 H new ATOM 0 HG21 VAL A 129 4.598 9.537 -14.959 1.00 34.23 H new ATOM 0 HG22 VAL A 129 5.653 8.932 -13.659 1.00 34.23 H new ATOM 0 HG23 VAL A 129 4.496 7.835 -14.448 1.00 34.23 H new ATOM 2042 N GLN A 130 2.810 9.496 -9.947 1.00 72.03 N ATOM 2043 CA GLN A 130 1.803 9.889 -8.972 1.00 24.42 C ATOM 2044 C GLN A 130 1.365 11.335 -9.199 1.00 61.51 C ATOM 2045 O GLN A 130 2.187 12.203 -9.495 1.00 31.21 O ATOM 2046 CB GLN A 130 2.333 9.713 -7.541 1.00 23.33 C ATOM 2047 CG GLN A 130 3.603 10.500 -7.246 1.00 54.41 C ATOM 2048 CD GLN A 130 4.059 10.358 -5.805 1.00 54.21 C ATOM 2049 OE1 GLN A 130 4.820 9.449 -5.468 1.00 62.51 O ATOM 2050 NE2 GLN A 130 3.617 11.264 -4.948 1.00 33.24 N ATOM 0 H GLN A 130 3.707 9.969 -9.842 1.00 72.03 H new ATOM 0 HA GLN A 130 0.937 9.240 -9.103 1.00 24.42 H new ATOM 0 HB2 GLN A 130 1.558 10.018 -6.838 1.00 23.33 H new ATOM 0 HB3 GLN A 130 2.525 8.655 -7.364 1.00 23.33 H new ATOM 0 HG2 GLN A 130 4.398 10.160 -7.910 1.00 54.41 H new ATOM 0 HG3 GLN A 130 3.432 11.554 -7.467 1.00 54.41 H new ATOM 0 HE21 GLN A 130 2.988 12.002 -5.265 1.00 33.24 H new ATOM 0 HE22 GLN A 130 3.905 11.225 -3.970 1.00 33.24 H new ATOM 2059 N ALA A 131 0.067 11.578 -9.085 1.00 32.23 N ATOM 2060 CA ALA A 131 -0.480 12.923 -9.192 1.00 13.32 C ATOM 2061 C ALA A 131 -1.516 13.147 -8.098 1.00 0.42 C ATOM 2062 O ALA A 131 -2.390 12.310 -7.885 1.00 41.32 O ATOM 2063 CB ALA A 131 -1.093 13.144 -10.566 1.00 23.15 C ATOM 0 H ALA A 131 -0.632 10.854 -8.917 1.00 32.23 H new ATOM 0 HA ALA A 131 0.328 13.644 -9.064 1.00 13.32 H new ATOM 0 HB1 ALA A 131 -1.496 14.155 -10.626 1.00 23.15 H new ATOM 0 HB2 ALA A 131 -0.328 13.012 -11.331 1.00 23.15 H new ATOM 0 HB3 ALA A 131 -1.895 12.423 -10.727 1.00 23.15 H new ATOM 2069 N SER A 132 -1.406 14.263 -7.396 1.00 21.32 N ATOM 2070 CA SER A 132 -2.284 14.541 -6.271 1.00 73.14 C ATOM 2071 C SER A 132 -3.301 15.632 -6.602 1.00 75.04 C ATOM 2072 O SER A 132 -4.402 15.651 -6.050 1.00 53.21 O ATOM 2073 CB SER A 132 -1.449 14.948 -5.060 1.00 50.45 C ATOM 2074 OG SER A 132 -0.437 13.987 -4.798 1.00 54.32 O ATOM 0 H SER A 132 -0.717 14.991 -7.585 1.00 21.32 H new ATOM 0 HA SER A 132 -2.842 13.633 -6.044 1.00 73.14 H new ATOM 0 HB2 SER A 132 -0.994 15.922 -5.238 1.00 50.45 H new ATOM 0 HB3 SER A 132 -2.093 15.051 -4.187 1.00 50.45 H new ATOM 0 HG SER A 132 -0.848 13.107 -4.664 1.00 54.32 H new ATOM 2080 N GLU A 133 -2.938 16.543 -7.494 1.00 72.14 N ATOM 2081 CA GLU A 133 -3.831 17.632 -7.859 1.00 60.04 C ATOM 2082 C GLU A 133 -4.133 17.605 -9.352 1.00 43.15 C ATOM 2083 O GLU A 133 -3.353 17.072 -10.144 1.00 54.44 O ATOM 2084 CB GLU A 133 -3.230 18.983 -7.455 1.00 72.01 C ATOM 2085 CG GLU A 133 -1.910 19.302 -8.132 1.00 15.34 C ATOM 2086 CD GLU A 133 -1.344 20.634 -7.693 1.00 1.34 C ATOM 2087 OE1 GLU A 133 -1.739 21.672 -8.264 1.00 1.35 O ATOM 2088 OE2 GLU A 133 -0.501 20.652 -6.774 1.00 51.55 O ATOM 0 H GLU A 133 -2.038 16.550 -7.975 1.00 72.14 H new ATOM 0 HA GLU A 133 -4.768 17.498 -7.319 1.00 60.04 H new ATOM 0 HB2 GLU A 133 -3.946 19.771 -7.689 1.00 72.01 H new ATOM 0 HB3 GLU A 133 -3.084 18.995 -6.375 1.00 72.01 H new ATOM 0 HG2 GLU A 133 -1.191 18.514 -7.910 1.00 15.34 H new ATOM 0 HG3 GLU A 133 -2.051 19.309 -9.213 1.00 15.34 H new ATOM 2095 N MET A 134 -5.260 18.196 -9.732 1.00 35.54 N ATOM 2096 CA MET A 134 -5.704 18.182 -11.123 1.00 54.54 C ATOM 2097 C MET A 134 -4.851 19.115 -11.978 1.00 23.10 C ATOM 2098 O MET A 134 -4.860 19.035 -13.202 1.00 71.11 O ATOM 2099 CB MET A 134 -7.180 18.583 -11.224 1.00 32.41 C ATOM 2100 CG MET A 134 -7.448 20.043 -10.888 1.00 31.53 C ATOM 2101 SD MET A 134 -9.200 20.462 -10.954 1.00 52.33 S ATOM 2102 CE MET A 134 -9.141 22.217 -10.601 1.00 11.55 C ATOM 0 H MET A 134 -5.885 18.692 -9.096 1.00 35.54 H new ATOM 0 HA MET A 134 -5.589 17.165 -11.499 1.00 54.54 H new ATOM 0 HB2 MET A 134 -7.532 18.383 -12.236 1.00 32.41 H new ATOM 0 HB3 MET A 134 -7.764 17.953 -10.553 1.00 32.41 H new ATOM 0 HG2 MET A 134 -7.065 20.258 -9.891 1.00 31.53 H new ATOM 0 HG3 MET A 134 -6.900 20.678 -11.584 1.00 31.53 H new ATOM 0 HE1 MET A 134 -10.152 22.623 -10.606 1.00 11.55 H new ATOM 0 HE2 MET A 134 -8.691 22.376 -9.621 1.00 11.55 H new ATOM 0 HE3 MET A 134 -8.543 22.721 -11.361 1.00 11.55 H new ATOM 2112 N SER A 135 -4.110 19.990 -11.322 1.00 40.24 N ATOM 2113 CA SER A 135 -3.257 20.935 -12.018 1.00 33.31 C ATOM 2114 C SER A 135 -1.957 20.262 -12.447 1.00 53.41 C ATOM 2115 O SER A 135 -1.314 20.671 -13.415 1.00 22.42 O ATOM 2116 CB SER A 135 -2.952 22.114 -11.098 1.00 24.02 C ATOM 2117 OG SER A 135 -4.107 22.492 -10.365 1.00 42.13 O ATOM 0 H SER A 135 -4.082 20.065 -10.305 1.00 40.24 H new ATOM 0 HA SER A 135 -3.773 21.291 -12.909 1.00 33.31 H new ATOM 0 HB2 SER A 135 -2.150 21.846 -10.410 1.00 24.02 H new ATOM 0 HB3 SER A 135 -2.597 22.959 -11.688 1.00 24.02 H new ATOM 0 HG SER A 135 -3.890 23.248 -9.780 1.00 42.13 H new ATOM 2123 N ASP A 136 -1.583 19.219 -11.718 1.00 60.51 N ATOM 2124 CA ASP A 136 -0.305 18.555 -11.931 1.00 72.05 C ATOM 2125 C ASP A 136 -0.397 17.501 -13.030 1.00 41.53 C ATOM 2126 O ASP A 136 0.605 17.155 -13.656 1.00 31.40 O ATOM 2127 CB ASP A 136 0.177 17.922 -10.628 1.00 74.30 C ATOM 2128 CG ASP A 136 1.580 17.369 -10.736 1.00 34.33 C ATOM 2129 OD1 ASP A 136 2.504 18.148 -11.060 1.00 61.30 O ATOM 2130 OD2 ASP A 136 1.767 16.164 -10.483 1.00 10.41 O ATOM 0 H ASP A 136 -2.149 18.814 -10.972 1.00 60.51 H new ATOM 0 HA ASP A 136 0.415 19.307 -12.254 1.00 72.05 H new ATOM 0 HB2 ASP A 136 0.144 18.666 -9.832 1.00 74.30 H new ATOM 0 HB3 ASP A 136 -0.505 17.121 -10.343 1.00 74.30 H new ATOM 2135 N LEU A 137 -1.610 17.017 -13.286 1.00 71.52 N ATOM 2136 CA LEU A 137 -1.818 15.968 -14.281 1.00 11.45 C ATOM 2137 C LEU A 137 -1.819 16.544 -15.693 1.00 40.12 C ATOM 2138 O LEU A 137 -1.993 15.820 -16.675 1.00 23.35 O ATOM 2139 CB LEU A 137 -3.116 15.193 -13.993 1.00 63.11 C ATOM 2140 CG LEU A 137 -4.405 16.021 -13.886 1.00 74.15 C ATOM 2141 CD1 LEU A 137 -4.948 16.387 -15.260 1.00 73.55 C ATOM 2142 CD2 LEU A 137 -5.453 15.261 -13.088 1.00 43.42 C ATOM 0 H LEU A 137 -2.461 17.333 -12.820 1.00 71.52 H new ATOM 0 HA LEU A 137 -0.987 15.266 -14.213 1.00 11.45 H new ATOM 0 HB2 LEU A 137 -3.252 14.452 -14.781 1.00 63.11 H new ATOM 0 HB3 LEU A 137 -2.985 14.645 -13.060 1.00 63.11 H new ATOM 0 HG LEU A 137 -4.165 16.948 -13.366 1.00 74.15 H new ATOM 0 HD11 LEU A 137 -5.860 16.973 -15.147 1.00 73.55 H new ATOM 0 HD12 LEU A 137 -4.205 16.974 -15.800 1.00 73.55 H new ATOM 0 HD13 LEU A 137 -5.168 15.477 -15.818 1.00 73.55 H new ATOM 0 HD21 LEU A 137 -6.362 15.859 -13.019 1.00 43.42 H new ATOM 0 HD22 LEU A 137 -5.676 14.317 -13.586 1.00 43.42 H new ATOM 0 HD23 LEU A 137 -5.073 15.062 -12.086 1.00 43.42 H new ATOM 2154 N ASP A 138 -1.627 17.853 -15.784 1.00 22.05 N ATOM 2155 CA ASP A 138 -1.506 18.524 -17.069 1.00 12.43 C ATOM 2156 C ASP A 138 -0.293 17.990 -17.824 1.00 34.35 C ATOM 2157 O ASP A 138 0.726 17.637 -17.215 1.00 44.20 O ATOM 2158 CB ASP A 138 -1.404 20.042 -16.891 1.00 54.14 C ATOM 2159 CG ASP A 138 -1.387 20.784 -18.216 1.00 12.53 C ATOM 2160 OD1 ASP A 138 -2.463 20.927 -18.838 1.00 72.22 O ATOM 2161 OD2 ASP A 138 -0.302 21.241 -18.634 1.00 31.11 O ATOM 0 H ASP A 138 -1.552 18.473 -14.978 1.00 22.05 H new ATOM 0 HA ASP A 138 -2.404 18.317 -17.651 1.00 12.43 H new ATOM 0 HB2 ASP A 138 -2.246 20.392 -16.293 1.00 54.14 H new ATOM 0 HB3 ASP A 138 -0.497 20.279 -16.334 1.00 54.14 H new ATOM 2166 N GLU A 139 -0.428 17.902 -19.141 1.00 54.14 N ATOM 2167 CA GLU A 139 0.594 17.333 -20.014 1.00 72.32 C ATOM 2168 C GLU A 139 1.989 17.921 -19.759 1.00 2.24 C ATOM 2169 O GLU A 139 2.993 17.282 -20.080 1.00 54.20 O ATOM 2170 CB GLU A 139 0.173 17.498 -21.480 1.00 41.34 C ATOM 2171 CG GLU A 139 0.123 18.936 -21.968 1.00 42.33 C ATOM 2172 CD GLU A 139 1.341 19.301 -22.782 1.00 5.22 C ATOM 2173 OE1 GLU A 139 1.359 19.008 -23.997 1.00 12.30 O ATOM 2174 OE2 GLU A 139 2.296 19.861 -22.217 1.00 24.42 O ATOM 0 H GLU A 139 -1.257 18.226 -19.639 1.00 54.14 H new ATOM 0 HA GLU A 139 0.674 16.271 -19.783 1.00 72.32 H new ATOM 0 HB2 GLU A 139 0.867 16.939 -22.108 1.00 41.34 H new ATOM 0 HB3 GLU A 139 -0.811 17.049 -21.614 1.00 41.34 H new ATOM 0 HG2 GLU A 139 -0.773 19.083 -22.571 1.00 42.33 H new ATOM 0 HG3 GLU A 139 0.045 19.607 -21.112 1.00 42.33 H new ATOM 2181 N LYS A 140 2.046 19.125 -19.182 1.00 34.23 N ATOM 2182 CA LYS A 140 3.316 19.776 -18.845 1.00 4.13 C ATOM 2183 C LYS A 140 4.296 18.813 -18.153 1.00 70.41 C ATOM 2184 O LYS A 140 5.502 18.883 -18.383 1.00 23.55 O ATOM 2185 CB LYS A 140 3.065 21.027 -17.979 1.00 70.10 C ATOM 2186 CG LYS A 140 2.267 20.775 -16.701 1.00 61.13 C ATOM 2187 CD LYS A 140 3.168 20.474 -15.513 1.00 54.11 C ATOM 2188 CE LYS A 140 2.366 20.056 -14.289 1.00 3.10 C ATOM 2189 NZ LYS A 140 3.247 19.734 -13.133 1.00 44.25 N ATOM 0 H LYS A 140 1.221 19.672 -18.937 1.00 34.23 H new ATOM 0 HA LYS A 140 3.784 20.085 -19.779 1.00 4.13 H new ATOM 0 HB2 LYS A 140 4.027 21.463 -17.709 1.00 70.10 H new ATOM 0 HB3 LYS A 140 2.537 21.767 -18.580 1.00 70.10 H new ATOM 0 HG2 LYS A 140 1.655 21.649 -16.479 1.00 61.13 H new ATOM 0 HG3 LYS A 140 1.585 19.940 -16.859 1.00 61.13 H new ATOM 0 HD2 LYS A 140 3.867 19.681 -15.778 1.00 54.11 H new ATOM 0 HD3 LYS A 140 3.762 21.356 -15.275 1.00 54.11 H new ATOM 0 HE2 LYS A 140 1.682 20.858 -14.012 1.00 3.10 H new ATOM 0 HE3 LYS A 140 1.756 19.187 -14.534 1.00 3.10 H new ATOM 0 HZ1 LYS A 140 2.680 19.310 -12.372 1.00 44.25 H new ATOM 0 HZ2 LYS A 140 3.981 19.062 -13.433 1.00 44.25 H new ATOM 0 HZ3 LYS A 140 3.696 20.605 -12.786 1.00 44.25 H new ATOM 2203 N SER A 141 3.779 17.902 -17.332 1.00 62.42 N ATOM 2204 CA SER A 141 4.618 16.887 -16.703 1.00 73.30 C ATOM 2205 C SER A 141 4.448 15.535 -17.390 1.00 65.51 C ATOM 2206 O SER A 141 5.418 14.956 -17.876 1.00 51.11 O ATOM 2207 CB SER A 141 4.299 16.752 -15.210 1.00 32.31 C ATOM 2208 OG SER A 141 4.734 17.891 -14.486 1.00 52.42 O ATOM 0 H SER A 141 2.790 17.846 -17.088 1.00 62.42 H new ATOM 0 HA SER A 141 5.654 17.210 -16.811 1.00 73.30 H new ATOM 0 HB2 SER A 141 3.225 16.621 -15.076 1.00 32.31 H new ATOM 0 HB3 SER A 141 4.781 15.859 -14.812 1.00 32.31 H new ATOM 0 HG SER A 141 5.146 17.606 -13.644 1.00 52.42 H new ATOM 2214 N VAL A 142 3.207 15.057 -17.449 1.00 62.24 N ATOM 2215 CA VAL A 142 2.912 13.714 -17.951 1.00 43.22 C ATOM 2216 C VAL A 142 3.432 13.511 -19.375 1.00 40.10 C ATOM 2217 O VAL A 142 4.133 12.539 -19.656 1.00 15.01 O ATOM 2218 CB VAL A 142 1.395 13.429 -17.914 1.00 74.33 C ATOM 2219 CG1 VAL A 142 1.101 12.002 -18.355 1.00 1.34 C ATOM 2220 CG2 VAL A 142 0.835 13.685 -16.523 1.00 73.11 C ATOM 0 H VAL A 142 2.384 15.582 -17.154 1.00 62.24 H new ATOM 0 HA VAL A 142 3.427 13.014 -17.293 1.00 43.22 H new ATOM 0 HB VAL A 142 0.906 14.108 -18.612 1.00 74.33 H new ATOM 0 HG11 VAL A 142 0.026 11.825 -18.321 1.00 1.34 H new ATOM 0 HG12 VAL A 142 1.461 11.854 -19.373 1.00 1.34 H new ATOM 0 HG13 VAL A 142 1.605 11.304 -17.687 1.00 1.34 H new ATOM 0 HG21 VAL A 142 -0.235 13.478 -16.518 1.00 73.11 H new ATOM 0 HG22 VAL A 142 1.334 13.034 -15.805 1.00 73.11 H new ATOM 0 HG23 VAL A 142 1.005 14.726 -16.248 1.00 73.11 H new ATOM 2230 N LYS A 143 3.103 14.443 -20.258 1.00 71.24 N ATOM 2231 CA LYS A 143 3.506 14.362 -21.656 1.00 51.22 C ATOM 2232 C LYS A 143 5.029 14.430 -21.769 1.00 13.51 C ATOM 2233 O LYS A 143 5.643 13.646 -22.487 1.00 15.23 O ATOM 2234 CB LYS A 143 2.824 15.501 -22.440 1.00 50.14 C ATOM 2235 CG LYS A 143 3.072 15.529 -23.947 1.00 12.32 C ATOM 2236 CD LYS A 143 4.442 16.102 -24.303 1.00 1.50 C ATOM 2237 CE LYS A 143 4.688 17.458 -23.646 1.00 72.32 C ATOM 2238 NZ LYS A 143 3.949 18.564 -24.309 1.00 74.21 N ATOM 0 H LYS A 143 2.553 15.271 -20.029 1.00 71.24 H new ATOM 0 HA LYS A 143 3.191 13.410 -22.084 1.00 51.22 H new ATOM 0 HB2 LYS A 143 1.749 15.436 -22.271 1.00 50.14 H new ATOM 0 HB3 LYS A 143 3.156 16.451 -22.021 1.00 50.14 H new ATOM 0 HG2 LYS A 143 2.990 14.517 -24.344 1.00 12.32 H new ATOM 0 HG3 LYS A 143 2.296 16.124 -24.429 1.00 12.32 H new ATOM 0 HD2 LYS A 143 5.218 15.403 -23.992 1.00 1.50 H new ATOM 0 HD3 LYS A 143 4.521 16.205 -25.385 1.00 1.50 H new ATOM 0 HE2 LYS A 143 4.393 17.407 -22.598 1.00 72.32 H new ATOM 0 HE3 LYS A 143 5.755 17.678 -23.666 1.00 72.32 H new ATOM 0 HZ1 LYS A 143 4.044 19.432 -23.744 1.00 74.21 H new ATOM 0 HZ2 LYS A 143 4.342 18.724 -25.259 1.00 74.21 H new ATOM 0 HZ3 LYS A 143 2.943 18.311 -24.389 1.00 74.21 H new ATOM 2252 N SER A 144 5.628 15.358 -21.035 1.00 1.32 N ATOM 2253 CA SER A 144 7.068 15.583 -21.095 1.00 32.03 C ATOM 2254 C SER A 144 7.849 14.374 -20.578 1.00 70.21 C ATOM 2255 O SER A 144 8.816 13.934 -21.204 1.00 64.32 O ATOM 2256 CB SER A 144 7.429 16.824 -20.276 1.00 31.45 C ATOM 2257 OG SER A 144 6.618 17.927 -20.645 1.00 40.52 O ATOM 0 H SER A 144 5.136 15.972 -20.386 1.00 1.32 H new ATOM 0 HA SER A 144 7.343 15.736 -22.139 1.00 32.03 H new ATOM 0 HB2 SER A 144 7.302 16.613 -19.214 1.00 31.45 H new ATOM 0 HB3 SER A 144 8.479 17.073 -20.429 1.00 31.45 H new ATOM 0 HG SER A 144 6.048 18.181 -19.889 1.00 40.52 H new ATOM 2263 N ASP A 145 7.421 13.839 -19.442 1.00 42.35 N ATOM 2264 CA ASP A 145 8.124 12.734 -18.798 1.00 2.01 C ATOM 2265 C ASP A 145 8.021 11.462 -19.634 1.00 4.00 C ATOM 2266 O ASP A 145 9.023 10.789 -19.888 1.00 2.31 O ATOM 2267 CB ASP A 145 7.557 12.498 -17.394 1.00 75.43 C ATOM 2268 CG ASP A 145 8.358 11.487 -16.598 1.00 41.04 C ATOM 2269 OD1 ASP A 145 9.591 11.651 -16.493 1.00 62.43 O ATOM 2270 OD2 ASP A 145 7.757 10.532 -16.062 1.00 1.12 O ATOM 0 H ASP A 145 6.587 14.153 -18.945 1.00 42.35 H new ATOM 0 HA ASP A 145 9.178 12.998 -18.714 1.00 2.01 H new ATOM 0 HB2 ASP A 145 7.535 13.444 -16.853 1.00 75.43 H new ATOM 0 HB3 ASP A 145 6.526 12.154 -17.477 1.00 75.43 H new ATOM 2275 N LEU A 146 6.811 11.158 -20.091 1.00 3.35 N ATOM 2276 CA LEU A 146 6.565 9.951 -20.873 1.00 73.30 C ATOM 2277 C LEU A 146 7.282 10.012 -22.220 1.00 21.13 C ATOM 2278 O LEU A 146 7.810 9.006 -22.697 1.00 55.34 O ATOM 2279 CB LEU A 146 5.063 9.755 -21.093 1.00 12.32 C ATOM 2280 CG LEU A 146 4.676 8.468 -21.824 1.00 13.20 C ATOM 2281 CD1 LEU A 146 5.061 7.251 -20.996 1.00 31.34 C ATOM 2282 CD2 LEU A 146 3.188 8.458 -22.130 1.00 54.44 C ATOM 0 H LEU A 146 5.983 11.732 -19.933 1.00 3.35 H new ATOM 0 HA LEU A 146 6.958 9.104 -20.311 1.00 73.30 H new ATOM 0 HB2 LEU A 146 4.565 9.767 -20.123 1.00 12.32 H new ATOM 0 HB3 LEU A 146 4.681 10.605 -21.659 1.00 12.32 H new ATOM 0 HG LEU A 146 5.220 8.428 -22.767 1.00 13.20 H new ATOM 0 HD11 LEU A 146 4.779 6.344 -21.530 1.00 31.34 H new ATOM 0 HD12 LEU A 146 6.138 7.252 -20.826 1.00 31.34 H new ATOM 0 HD13 LEU A 146 4.543 7.284 -20.038 1.00 31.34 H new ATOM 0 HD21 LEU A 146 2.930 7.536 -22.650 1.00 54.44 H new ATOM 0 HD22 LEU A 146 2.625 8.520 -21.199 1.00 54.44 H new ATOM 0 HD23 LEU A 146 2.941 9.312 -22.761 1.00 54.44 H new ATOM 2294 N MET A 147 7.305 11.203 -22.817 1.00 65.11 N ATOM 2295 CA MET A 147 7.922 11.410 -24.128 1.00 22.10 C ATOM 2296 C MET A 147 9.390 10.988 -24.123 1.00 72.20 C ATOM 2297 O MET A 147 9.907 10.473 -25.114 1.00 72.34 O ATOM 2298 CB MET A 147 7.806 12.883 -24.537 1.00 55.11 C ATOM 2299 CG MET A 147 8.371 13.187 -25.915 1.00 22.15 C ATOM 2300 SD MET A 147 8.265 14.939 -26.338 1.00 54.10 S ATOM 2301 CE MET A 147 9.012 14.938 -27.967 1.00 60.11 C ATOM 0 H MET A 147 6.900 12.046 -22.410 1.00 65.11 H new ATOM 0 HA MET A 147 7.392 10.789 -24.850 1.00 22.10 H new ATOM 0 HB2 MET A 147 6.756 13.175 -24.513 1.00 55.11 H new ATOM 0 HB3 MET A 147 8.324 13.496 -23.800 1.00 55.11 H new ATOM 0 HG2 MET A 147 9.413 12.870 -25.954 1.00 22.15 H new ATOM 0 HG3 MET A 147 7.832 12.604 -26.661 1.00 22.15 H new ATOM 0 HE1 MET A 147 8.685 15.820 -28.518 1.00 60.11 H new ATOM 0 HE2 MET A 147 10.098 14.953 -27.869 1.00 60.11 H new ATOM 0 HE3 MET A 147 8.708 14.041 -28.506 1.00 60.11 H new ATOM 2311 N SER A 148 10.053 11.196 -22.997 1.00 42.05 N ATOM 2312 CA SER A 148 11.464 10.872 -22.875 1.00 41.44 C ATOM 2313 C SER A 148 11.663 9.359 -22.781 1.00 64.10 C ATOM 2314 O SER A 148 12.447 8.772 -23.529 1.00 43.52 O ATOM 2315 CB SER A 148 12.053 11.572 -21.644 1.00 61.53 C ATOM 2316 OG SER A 148 13.449 11.350 -21.536 1.00 2.25 O ATOM 0 H SER A 148 9.635 11.589 -22.153 1.00 42.05 H new ATOM 0 HA SER A 148 11.985 11.226 -23.765 1.00 41.44 H new ATOM 0 HB2 SER A 148 11.858 12.643 -21.705 1.00 61.53 H new ATOM 0 HB3 SER A 148 11.555 11.208 -20.745 1.00 61.53 H new ATOM 0 HG SER A 148 13.793 11.811 -20.743 1.00 2.25 H new ATOM 2322 N ASN A 149 10.908 8.724 -21.895 1.00 22.23 N ATOM 2323 CA ASN A 149 11.103 7.310 -21.598 1.00 64.40 C ATOM 2324 C ASN A 149 10.367 6.400 -22.574 1.00 12.20 C ATOM 2325 O ASN A 149 10.190 5.212 -22.307 1.00 40.13 O ATOM 2326 CB ASN A 149 10.685 6.991 -20.164 1.00 62.51 C ATOM 2327 CG ASN A 149 11.663 7.546 -19.146 1.00 53.01 C ATOM 2328 OD1 ASN A 149 11.490 8.656 -18.636 1.00 12.35 O ATOM 2329 ND2 ASN A 149 12.707 6.785 -18.853 1.00 34.10 N ATOM 0 H ASN A 149 10.154 9.165 -21.369 1.00 22.23 H new ATOM 0 HA ASN A 149 12.169 7.114 -21.711 1.00 64.40 H new ATOM 0 HB2 ASN A 149 9.694 7.404 -19.976 1.00 62.51 H new ATOM 0 HB3 ASN A 149 10.609 5.911 -20.041 1.00 62.51 H new ATOM 0 HD21 ASN A 149 13.404 7.111 -18.184 1.00 34.10 H new ATOM 0 HD22 ASN A 149 12.814 5.873 -19.297 1.00 34.10 H new ATOM 2336 N GLN A 150 9.931 6.951 -23.699 1.00 61.32 N ATOM 2337 CA GLN A 150 9.337 6.143 -24.760 1.00 65.44 C ATOM 2338 C GLN A 150 10.284 5.029 -25.188 1.00 35.52 C ATOM 2339 O GLN A 150 9.880 3.875 -25.320 1.00 13.35 O ATOM 2340 CB GLN A 150 8.998 7.005 -25.969 1.00 0.02 C ATOM 2341 CG GLN A 150 7.729 7.817 -25.806 1.00 2.34 C ATOM 2342 CD GLN A 150 7.584 8.876 -26.878 1.00 11.24 C ATOM 2343 OE1 GLN A 150 7.017 9.935 -26.646 1.00 54.12 O ATOM 2344 NE2 GLN A 150 8.099 8.594 -28.064 1.00 13.24 N ATOM 0 H GLN A 150 9.976 7.950 -23.902 1.00 61.32 H new ATOM 0 HA GLN A 150 8.422 5.702 -24.365 1.00 65.44 H new ATOM 0 HB2 GLN A 150 9.829 7.683 -26.165 1.00 0.02 H new ATOM 0 HB3 GLN A 150 8.897 6.363 -26.844 1.00 0.02 H new ATOM 0 HG2 GLN A 150 6.867 7.151 -25.838 1.00 2.34 H new ATOM 0 HG3 GLN A 150 7.728 8.293 -24.825 1.00 2.34 H new ATOM 0 HE21 GLN A 150 8.564 7.700 -28.218 1.00 13.24 H new ATOM 0 HE22 GLN A 150 8.031 9.271 -28.824 1.00 13.24 H new ATOM 2353 N ARG A 151 11.547 5.377 -25.386 1.00 41.20 N ATOM 2354 CA ARG A 151 12.538 4.408 -25.831 1.00 21.53 C ATOM 2355 C ARG A 151 13.658 4.262 -24.802 1.00 71.20 C ATOM 2356 O ARG A 151 14.686 3.643 -25.068 1.00 22.14 O ATOM 2357 CB ARG A 151 13.092 4.815 -27.207 1.00 70.24 C ATOM 2358 CG ARG A 151 13.815 6.154 -27.225 1.00 4.41 C ATOM 2359 CD ARG A 151 15.323 5.981 -27.108 1.00 3.33 C ATOM 2360 NE ARG A 151 15.888 5.288 -28.266 1.00 24.22 N ATOM 2361 CZ ARG A 151 17.081 4.688 -28.269 1.00 12.21 C ATOM 2362 NH1 ARG A 151 17.806 4.623 -27.155 1.00 3.41 N ATOM 2363 NH2 ARG A 151 17.536 4.124 -29.381 1.00 0.04 N ATOM 0 H ARG A 151 11.909 6.320 -25.246 1.00 41.20 H new ATOM 0 HA ARG A 151 12.057 3.435 -25.930 1.00 21.53 H new ATOM 0 HB2 ARG A 151 13.778 4.041 -27.552 1.00 70.24 H new ATOM 0 HB3 ARG A 151 12.268 4.851 -27.920 1.00 70.24 H new ATOM 0 HG2 ARG A 151 13.580 6.682 -28.149 1.00 4.41 H new ATOM 0 HG3 ARG A 151 13.455 6.773 -26.403 1.00 4.41 H new ATOM 0 HD2 ARG A 151 15.793 6.959 -27.006 1.00 3.33 H new ATOM 0 HD3 ARG A 151 15.554 5.421 -26.202 1.00 3.33 H new ATOM 0 HE ARG A 151 15.337 5.262 -29.124 1.00 24.22 H new ATOM 0 HH11 ARG A 151 17.451 5.033 -26.291 1.00 3.41 H new ATOM 0 HH12 ARG A 151 18.716 4.163 -27.165 1.00 3.41 H new ATOM 0 HH21 ARG A 151 16.975 4.149 -30.232 1.00 0.04 H new ATOM 0 HH22 ARG A 151 18.447 3.665 -29.384 1.00 0.04 H new ATOM 2377 N ILE A 152 13.449 4.820 -23.620 1.00 34.12 N ATOM 2378 CA ILE A 152 14.435 4.729 -22.556 1.00 55.22 C ATOM 2379 C ILE A 152 13.922 3.821 -21.444 1.00 50.02 C ATOM 2380 O ILE A 152 13.149 4.297 -20.586 1.00 74.50 O ATOM 2381 CB ILE A 152 14.793 6.119 -21.981 1.00 11.41 C ATOM 2382 CG1 ILE A 152 15.301 7.038 -23.099 1.00 64.25 C ATOM 2383 CG2 ILE A 152 15.842 5.988 -20.882 1.00 70.11 C ATOM 2384 CD1 ILE A 152 15.657 8.432 -22.632 1.00 20.14 C ATOM 2385 OXT ILE A 152 14.273 2.623 -21.451 1.00 0.00 O ATOM 0 H ILE A 152 12.607 5.340 -23.374 1.00 34.12 H new ATOM 0 HA ILE A 152 15.343 4.305 -22.984 1.00 55.22 H new ATOM 0 HB ILE A 152 13.895 6.559 -21.548 1.00 11.41 H new ATOM 0 HG12 ILE A 152 16.179 6.584 -23.558 1.00 64.25 H new ATOM 0 HG13 ILE A 152 14.537 7.109 -23.873 1.00 64.25 H new ATOM 0 HG21 ILE A 152 16.082 6.976 -20.489 1.00 70.11 H new ATOM 0 HG22 ILE A 152 15.452 5.363 -20.079 1.00 70.11 H new ATOM 0 HG23 ILE A 152 16.743 5.532 -21.292 1.00 70.11 H new ATOM 0 HD11 ILE A 152 16.008 9.021 -23.479 1.00 20.14 H new ATOM 0 HD12 ILE A 152 14.776 8.907 -22.200 1.00 20.14 H new ATOM 0 HD13 ILE A 152 16.444 8.374 -21.880 1.00 20.14 H new TER 2397 ILE A 152