USER MOD reduce.3.24.130724 H: found=0, std=0, add=1218, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1215 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 117 ASN : amide:sc= 1.12 K(o=2.3,f=-6.2) USER MOD Set 1.2: A 118 LYS NZ :NH3+ -127:sc= 1.21 (180deg=0) USER MOD Set 2.1: A 110 SER OG : rot 150:sc= 0.071 USER MOD Set 2.2: A 124 SER OG : rot 69:sc= 0.434 USER MOD Set 3.1: A 100 ASN : amide:sc= 0.761 K(o=1.9,f=-6.8) USER MOD Set 3.2: A 102 LYS NZ :NH3+ 130:sc= 1.14 (180deg=0) USER MOD Set 4.1: A 99 ASN : amide:sc=-0.00411 K(o=0.55,f=-1.4) USER MOD Set 4.2: A 101 TYR OH : rot -136:sc= 0.558 USER MOD Set 5.1: A 25 SER OG : rot 180:sc= 0.346 USER MOD Set 5.2: A 26 LYS NZ :NH3+ -178:sc= 0.354 (180deg=0) USER MOD Single : A 3 SER OG : rot -30:sc= 0.117 USER MOD Single : A 4 TYR OH : rot 180:sc=-0.00346 USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 13 THR OG1 : rot 12:sc= 1.51 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0.0791 USER MOD Single : A 21 ASN : amide:sc= -0.429 K(o=-0.43,f=-0.94) USER MOD Single : A 24 ASN :FLIP amide:sc= 0.537 F(o=-0.47,f=0.54) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 CYS SG : rot -39:sc= -0.0215 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot -56:sc= 0.755 USER MOD Single : A 48 GLN : amide:sc= 0.85 K(o=0.85,f=-0.16) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 HIS : no HD1:sc= -0.0919 X(o=-0.092,f=0) USER MOD Single : A 67 HIS : no HD1:sc= -1.04 K(o=-1,f=-1.7) USER MOD Single : A 72 ASN : amide:sc= -1.28 K(o=-1.3,f=-2.9!) USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= 0.841 K(o=0.84,f=-1.6) USER MOD Single : A 89 TYR OH : rot -135:sc= 0.888 USER MOD Single : A 91 SER OG : rot 17:sc= 0.798 USER MOD Single : A 94 LYS NZ :NH3+ -100:sc= 1.08 (180deg=-1.06!) USER MOD Single : A 97 ASN : amide:sc= 0.417 X(o=0.42,f=-0.024) USER MOD Single : A 103 SER OG : rot 81:sc= 0.463 USER MOD Single : A 111 THR OG1 : rot 47:sc= 0.312 USER MOD Single : A 115 SER OG : rot 170:sc= 0.0341 USER MOD Single : A 122 THR OG1 : rot 180:sc= 0.011 USER MOD Single : A 123 GLN : amide:sc= -0.0492 K(o=-0.049,f=-2.2!) USER MOD Single : A 126 ASN : amide:sc= -0.0998 K(o=-0.1,f=-3.4!) USER MOD Single : A 127 HIS : no HD1:sc= -0.165 X(o=-0.16,f=0) USER MOD Single : A 130 THR OG1 : rot 66:sc= 0.474 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot -23:sc= 0.873 USER MOD Single : A 142 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 CYS SG : rot 46:sc= 0.156 USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 LYS NZ :NH3+ -173:sc=-0.00376 (180deg=-0.0641) USER MOD Single : A 150 MET CE :methyl -177:sc= 0 (180deg=-0.0117) USER MOD Single : A 151 THR OG1 : rot 83:sc= 0.566 USER MOD Single : A 153 LYS NZ :NH3+ -167:sc= -0.0588 (180deg=-0.37) USER MOD ----------------------------------------------------------------- ATOM 25 N SER A 3 -15.691 -9.529 2.437 1.00 1.94 N ATOM 26 CA SER A 3 -14.915 -10.047 1.318 1.00 1.47 C ATOM 27 C SER A 3 -13.933 -8.956 0.899 1.00 1.06 C ATOM 28 O SER A 3 -13.525 -8.142 1.729 1.00 1.10 O ATOM 29 CB SER A 3 -15.847 -10.505 0.181 1.00 2.49 C ATOM 30 OG SER A 3 -16.717 -9.464 -0.202 1.00 2.70 O ATOM 0 HA SER A 3 -14.347 -10.934 1.599 1.00 1.47 H new ATOM 0 HB2 SER A 3 -15.254 -10.823 -0.676 1.00 2.49 H new ATOM 0 HB3 SER A 3 -16.427 -11.369 0.506 1.00 2.49 H new ATOM 0 HG SER A 3 -16.897 -8.887 0.570 1.00 2.70 H new ATOM 36 N TYR A 4 -13.538 -8.958 -0.371 1.00 0.96 N ATOM 37 CA TYR A 4 -12.522 -8.095 -0.922 1.00 0.86 C ATOM 38 C TYR A 4 -13.069 -7.573 -2.248 1.00 0.84 C ATOM 39 O TYR A 4 -13.514 -8.367 -3.076 1.00 1.13 O ATOM 40 CB TYR A 4 -11.244 -8.917 -1.126 1.00 1.10 C ATOM 41 CG TYR A 4 -11.044 -10.044 -0.120 1.00 1.25 C ATOM 42 CD1 TYR A 4 -11.277 -11.382 -0.490 1.00 1.62 C ATOM 43 CD2 TYR A 4 -10.712 -9.747 1.214 1.00 2.41 C ATOM 44 CE1 TYR A 4 -11.136 -12.421 0.452 1.00 1.81 C ATOM 45 CE2 TYR A 4 -10.583 -10.772 2.166 1.00 2.71 C ATOM 46 CZ TYR A 4 -10.782 -12.119 1.790 1.00 1.93 C ATOM 47 OH TYR A 4 -10.625 -13.111 2.716 1.00 2.35 O ATOM 0 H TYR A 4 -13.939 -9.590 -1.064 1.00 0.96 H new ATOM 0 HA TYR A 4 -12.280 -7.258 -0.267 1.00 0.86 H new ATOM 0 HB2 TYR A 4 -11.258 -9.342 -2.129 1.00 1.10 H new ATOM 0 HB3 TYR A 4 -10.386 -8.247 -1.076 1.00 1.10 H new ATOM 0 HD1 TYR A 4 -11.566 -11.614 -1.504 1.00 1.62 H new ATOM 0 HD2 TYR A 4 -10.555 -8.720 1.510 1.00 2.41 H new ATOM 0 HE1 TYR A 4 -11.298 -13.446 0.154 1.00 1.81 H new ATOM 0 HE2 TYR A 4 -10.331 -10.530 3.188 1.00 2.71 H new ATOM 0 HH TYR A 4 -10.381 -12.717 3.579 1.00 2.35 H new ATOM 57 N HIS A 5 -13.051 -6.260 -2.458 1.00 0.82 N ATOM 58 CA HIS A 5 -13.724 -5.615 -3.571 1.00 0.85 C ATOM 59 C HIS A 5 -12.674 -4.922 -4.428 1.00 0.93 C ATOM 60 O HIS A 5 -12.177 -3.846 -4.111 1.00 1.52 O ATOM 61 CB HIS A 5 -14.788 -4.644 -3.052 1.00 0.87 C ATOM 62 CG HIS A 5 -15.971 -4.497 -3.974 1.00 0.96 C ATOM 63 ND1 HIS A 5 -17.288 -4.664 -3.608 1.00 1.23 N ATOM 64 CD2 HIS A 5 -15.944 -4.208 -5.314 1.00 0.97 C ATOM 65 CE1 HIS A 5 -18.038 -4.482 -4.709 1.00 1.34 C ATOM 66 NE2 HIS A 5 -17.265 -4.206 -5.770 1.00 1.15 N ATOM 0 H HIS A 5 -12.559 -5.608 -1.847 1.00 0.82 H new ATOM 0 HA HIS A 5 -14.245 -6.348 -4.187 1.00 0.85 H new ATOM 0 HB2 HIS A 5 -15.137 -4.987 -2.078 1.00 0.87 H new ATOM 0 HB3 HIS A 5 -14.332 -3.666 -2.900 1.00 0.87 H new ATOM 0 HD2 HIS A 5 -15.063 -4.017 -5.908 1.00 0.97 H new ATOM 0 HE1 HIS A 5 -19.116 -4.549 -4.736 1.00 1.34 H new ATOM 0 HE2 HIS A 5 -17.580 -4.029 -6.724 1.00 1.15 H new ATOM 74 N VAL A 6 -12.305 -5.577 -5.517 1.00 0.50 N ATOM 75 CA VAL A 6 -11.295 -5.081 -6.438 1.00 0.47 C ATOM 76 C VAL A 6 -11.961 -4.109 -7.416 1.00 0.50 C ATOM 77 O VAL A 6 -13.042 -4.393 -7.929 1.00 0.56 O ATOM 78 CB VAL A 6 -10.621 -6.294 -7.100 1.00 0.57 C ATOM 79 CG1 VAL A 6 -11.586 -7.163 -7.903 1.00 2.14 C ATOM 80 CG2 VAL A 6 -9.471 -5.916 -8.024 1.00 2.01 C ATOM 0 H VAL A 6 -12.702 -6.476 -5.789 1.00 0.50 H new ATOM 0 HA VAL A 6 -10.507 -4.516 -5.941 1.00 0.47 H new ATOM 0 HB VAL A 6 -10.240 -6.860 -6.250 1.00 0.57 H new ATOM 0 HG11 VAL A 6 -11.043 -8.000 -8.342 1.00 2.14 H new ATOM 0 HG12 VAL A 6 -12.367 -7.543 -7.245 1.00 2.14 H new ATOM 0 HG13 VAL A 6 -12.038 -6.568 -8.696 1.00 2.14 H new ATOM 0 HG21 VAL A 6 -9.041 -6.819 -8.457 1.00 2.01 H new ATOM 0 HG22 VAL A 6 -9.842 -5.272 -8.821 1.00 2.01 H new ATOM 0 HG23 VAL A 6 -8.706 -5.386 -7.456 1.00 2.01 H new ATOM 90 N VAL A 7 -11.356 -2.940 -7.643 1.00 0.51 N ATOM 91 CA VAL A 7 -11.949 -1.900 -8.487 1.00 0.60 C ATOM 92 C VAL A 7 -10.881 -1.239 -9.368 1.00 0.60 C ATOM 93 O VAL A 7 -9.858 -0.752 -8.891 1.00 0.79 O ATOM 94 CB VAL A 7 -12.775 -0.923 -7.627 1.00 0.89 C ATOM 95 CG1 VAL A 7 -12.020 -0.390 -6.408 1.00 1.90 C ATOM 96 CG2 VAL A 7 -13.307 0.245 -8.465 1.00 2.40 C ATOM 0 H VAL A 7 -10.449 -2.689 -7.250 1.00 0.51 H new ATOM 0 HA VAL A 7 -12.656 -2.344 -9.188 1.00 0.60 H new ATOM 0 HB VAL A 7 -13.613 -1.509 -7.249 1.00 0.89 H new ATOM 0 HG11 VAL A 7 -12.663 0.291 -5.851 1.00 1.90 H new ATOM 0 HG12 VAL A 7 -11.731 -1.222 -5.767 1.00 1.90 H new ATOM 0 HG13 VAL A 7 -11.127 0.142 -6.737 1.00 1.90 H new ATOM 0 HG21 VAL A 7 -13.885 0.915 -7.829 1.00 2.40 H new ATOM 0 HG22 VAL A 7 -12.470 0.790 -8.901 1.00 2.40 H new ATOM 0 HG23 VAL A 7 -13.945 -0.139 -9.261 1.00 2.40 H new ATOM 106 N ARG A 8 -11.073 -1.261 -10.692 1.00 0.58 N ATOM 107 CA ARG A 8 -10.015 -0.878 -11.622 1.00 0.59 C ATOM 108 C ARG A 8 -10.071 0.611 -11.943 1.00 0.70 C ATOM 109 O ARG A 8 -10.587 1.002 -12.992 1.00 1.15 O ATOM 110 CB ARG A 8 -10.098 -1.726 -12.898 1.00 0.82 C ATOM 111 CG ARG A 8 -8.825 -1.535 -13.737 1.00 2.40 C ATOM 112 CD ARG A 8 -9.122 -1.480 -15.237 1.00 3.05 C ATOM 113 NE ARG A 8 -9.813 -0.230 -15.589 1.00 4.04 N ATOM 114 CZ ARG A 8 -9.892 0.307 -16.812 1.00 5.38 C ATOM 115 NH1 ARG A 8 -10.539 1.458 -16.992 1.00 6.45 N ATOM 116 NH2 ARG A 8 -9.325 -0.307 -17.852 1.00 6.16 N ATOM 0 H ARG A 8 -11.947 -1.539 -11.138 1.00 0.58 H new ATOM 0 HA ARG A 8 -9.054 -1.069 -11.145 1.00 0.59 H new ATOM 0 HB2 ARG A 8 -10.219 -2.778 -12.639 1.00 0.82 H new ATOM 0 HB3 ARG A 8 -10.974 -1.439 -13.480 1.00 0.82 H new ATOM 0 HG2 ARG A 8 -8.327 -0.614 -13.433 1.00 2.40 H new ATOM 0 HG3 ARG A 8 -8.133 -2.353 -13.535 1.00 2.40 H new ATOM 0 HD2 ARG A 8 -8.191 -1.557 -15.799 1.00 3.05 H new ATOM 0 HD3 ARG A 8 -9.738 -2.333 -15.522 1.00 3.05 H new ATOM 0 HE ARG A 8 -10.274 0.274 -14.831 1.00 4.04 H new ATOM 0 HH11 ARG A 8 -10.973 1.929 -16.198 1.00 6.45 H new ATOM 0 HH12 ARG A 8 -10.600 1.868 -17.924 1.00 6.45 H new ATOM 0 HH21 ARG A 8 -8.830 -1.188 -17.716 1.00 6.16 H new ATOM 0 HH22 ARG A 8 -9.387 0.105 -18.783 1.00 6.16 H new ATOM 130 N GLY A 9 -9.449 1.423 -11.097 1.00 0.66 N ATOM 131 CA GLY A 9 -9.138 2.808 -11.400 1.00 0.77 C ATOM 132 C GLY A 9 -7.801 3.142 -10.757 1.00 0.59 C ATOM 133 O GLY A 9 -6.909 2.294 -10.739 1.00 0.68 O ATOM 0 H GLY A 9 -9.144 1.130 -10.169 1.00 0.66 H new ATOM 0 HA2 GLY A 9 -9.091 2.961 -12.478 1.00 0.77 H new ATOM 0 HA3 GLY A 9 -9.919 3.466 -11.019 1.00 0.77 H new ATOM 137 N ASP A 10 -7.655 4.359 -10.239 1.00 0.62 N ATOM 138 CA ASP A 10 -6.359 4.904 -9.878 1.00 0.60 C ATOM 139 C ASP A 10 -6.310 5.233 -8.387 1.00 0.58 C ATOM 140 O ASP A 10 -7.336 5.356 -7.719 1.00 0.58 O ATOM 141 CB ASP A 10 -6.079 6.140 -10.742 1.00 0.67 C ATOM 142 CG ASP A 10 -4.577 6.341 -10.913 1.00 1.44 C ATOM 143 OD1 ASP A 10 -3.959 6.805 -9.927 1.00 3.00 O ATOM 144 OD2 ASP A 10 -4.069 5.980 -11.996 1.00 1.96 O ATOM 0 H ASP A 10 -8.435 4.991 -10.060 1.00 0.62 H new ATOM 0 HA ASP A 10 -5.581 4.164 -10.066 1.00 0.60 H new ATOM 0 HB2 ASP A 10 -6.550 6.023 -11.718 1.00 0.67 H new ATOM 0 HB3 ASP A 10 -6.520 7.023 -10.279 1.00 0.67 H new ATOM 149 N ILE A 11 -5.104 5.408 -7.863 1.00 0.60 N ATOM 150 CA ILE A 11 -4.847 5.766 -6.477 1.00 0.61 C ATOM 151 C ILE A 11 -5.390 7.166 -6.209 1.00 0.55 C ATOM 152 O ILE A 11 -5.934 7.441 -5.143 1.00 0.55 O ATOM 153 CB ILE A 11 -3.335 5.663 -6.224 1.00 0.73 C ATOM 154 CG1 ILE A 11 -2.902 4.189 -6.371 1.00 1.82 C ATOM 155 CG2 ILE A 11 -2.955 6.176 -4.831 1.00 1.74 C ATOM 156 CD1 ILE A 11 -1.522 4.071 -7.015 1.00 3.07 C ATOM 0 H ILE A 11 -4.250 5.301 -8.411 1.00 0.60 H new ATOM 0 HA ILE A 11 -5.353 5.088 -5.790 1.00 0.61 H new ATOM 0 HB ILE A 11 -2.822 6.287 -6.956 1.00 0.73 H new ATOM 0 HG12 ILE A 11 -2.889 3.713 -5.390 1.00 1.82 H new ATOM 0 HG13 ILE A 11 -3.634 3.653 -6.975 1.00 1.82 H new ATOM 0 HG21 ILE A 11 -1.878 6.086 -4.692 1.00 1.74 H new ATOM 0 HG22 ILE A 11 -3.247 7.222 -4.736 1.00 1.74 H new ATOM 0 HG23 ILE A 11 -3.470 5.585 -4.073 1.00 1.74 H new ATOM 0 HD11 ILE A 11 -1.250 3.019 -7.102 1.00 3.07 H new ATOM 0 HD12 ILE A 11 -1.543 4.524 -8.006 1.00 3.07 H new ATOM 0 HD13 ILE A 11 -0.787 4.586 -6.397 1.00 3.07 H new ATOM 168 N ALA A 12 -5.298 8.051 -7.202 1.00 0.57 N ATOM 169 CA ALA A 12 -5.840 9.397 -7.087 1.00 0.62 C ATOM 170 C ALA A 12 -7.373 9.396 -7.011 1.00 0.67 C ATOM 171 O ALA A 12 -7.968 10.431 -6.722 1.00 0.84 O ATOM 172 CB ALA A 12 -5.353 10.266 -8.251 1.00 0.72 C ATOM 0 H ALA A 12 -4.850 7.855 -8.097 1.00 0.57 H new ATOM 0 HA ALA A 12 -5.474 9.821 -6.152 1.00 0.62 H new ATOM 0 HB1 ALA A 12 -5.766 11.270 -8.153 1.00 0.72 H new ATOM 0 HB2 ALA A 12 -4.264 10.318 -8.236 1.00 0.72 H new ATOM 0 HB3 ALA A 12 -5.682 9.829 -9.194 1.00 0.72 H new ATOM 178 N THR A 13 -8.020 8.254 -7.262 1.00 0.62 N ATOM 179 CA THR A 13 -9.465 8.109 -7.176 1.00 0.68 C ATOM 180 C THR A 13 -9.863 7.108 -6.088 1.00 0.66 C ATOM 181 O THR A 13 -11.054 6.848 -5.923 1.00 0.75 O ATOM 182 CB THR A 13 -10.015 7.703 -8.552 1.00 0.77 C ATOM 183 OG1 THR A 13 -9.322 6.592 -9.085 1.00 0.68 O ATOM 184 CG2 THR A 13 -9.860 8.853 -9.549 1.00 0.88 C ATOM 0 H THR A 13 -7.542 7.395 -7.534 1.00 0.62 H new ATOM 0 HA THR A 13 -9.904 9.065 -6.891 1.00 0.68 H new ATOM 0 HB THR A 13 -11.065 7.449 -8.405 1.00 0.77 H new ATOM 0 HG1 THR A 13 -8.760 6.193 -8.389 1.00 0.68 H new ATOM 0 HG21 THR A 13 -10.254 8.549 -10.519 1.00 0.88 H new ATOM 0 HG22 THR A 13 -10.410 9.723 -9.190 1.00 0.88 H new ATOM 0 HG23 THR A 13 -8.805 9.107 -9.650 1.00 0.88 H new ATOM 192 N ALA A 14 -8.895 6.573 -5.332 1.00 0.59 N ATOM 193 CA ALA A 14 -9.069 5.540 -4.323 1.00 0.58 C ATOM 194 C ALA A 14 -9.536 6.182 -3.020 1.00 0.69 C ATOM 195 O ALA A 14 -8.881 6.156 -1.985 1.00 0.73 O ATOM 196 CB ALA A 14 -7.750 4.783 -4.149 1.00 0.51 C ATOM 0 H ALA A 14 -7.923 6.870 -5.418 1.00 0.59 H new ATOM 0 HA ALA A 14 -9.830 4.823 -4.632 1.00 0.58 H new ATOM 0 HB1 ALA A 14 -7.873 4.007 -3.394 1.00 0.51 H new ATOM 0 HB2 ALA A 14 -7.465 4.326 -5.097 1.00 0.51 H new ATOM 0 HB3 ALA A 14 -6.971 5.477 -3.833 1.00 0.51 H new ATOM 202 N THR A 15 -10.698 6.805 -3.098 1.00 0.78 N ATOM 203 CA THR A 15 -11.287 7.647 -2.080 1.00 0.81 C ATOM 204 C THR A 15 -12.033 6.830 -1.014 1.00 0.83 C ATOM 205 O THR A 15 -12.965 7.331 -0.390 1.00 0.94 O ATOM 206 CB THR A 15 -12.178 8.676 -2.794 1.00 0.86 C ATOM 207 OG1 THR A 15 -12.982 8.083 -3.800 1.00 1.21 O ATOM 208 CG2 THR A 15 -11.312 9.750 -3.459 1.00 1.02 C ATOM 0 H THR A 15 -11.289 6.730 -3.926 1.00 0.78 H new ATOM 0 HA THR A 15 -10.512 8.171 -1.521 1.00 0.81 H new ATOM 0 HB THR A 15 -12.826 9.109 -2.032 1.00 0.86 H new ATOM 0 HG1 THR A 15 -13.533 8.772 -4.227 1.00 1.21 H new ATOM 0 HG21 THR A 15 -11.953 10.474 -3.962 1.00 1.02 H new ATOM 0 HG22 THR A 15 -10.716 10.258 -2.701 1.00 1.02 H new ATOM 0 HG23 THR A 15 -10.650 9.283 -4.188 1.00 1.02 H new ATOM 216 N GLU A 16 -11.570 5.612 -0.710 1.00 0.81 N ATOM 217 CA GLU A 16 -12.183 4.644 0.209 1.00 0.86 C ATOM 218 C GLU A 16 -12.116 5.038 1.691 1.00 0.99 C ATOM 219 O GLU A 16 -12.280 4.194 2.572 1.00 1.12 O ATOM 220 CB GLU A 16 -11.489 3.288 -0.008 1.00 0.82 C ATOM 221 CG GLU A 16 -12.151 2.480 -1.127 1.00 0.76 C ATOM 222 CD GLU A 16 -12.173 3.231 -2.453 1.00 1.77 C ATOM 223 OE1 GLU A 16 -11.116 3.806 -2.801 1.00 3.02 O ATOM 224 OE2 GLU A 16 -13.236 3.232 -3.107 1.00 2.62 O ATOM 0 H GLU A 16 -10.708 5.254 -1.122 1.00 0.81 H new ATOM 0 HA GLU A 16 -13.247 4.604 -0.023 1.00 0.86 H new ATOM 0 HB2 GLU A 16 -10.439 3.452 -0.251 1.00 0.82 H new ATOM 0 HB3 GLU A 16 -11.516 2.714 0.918 1.00 0.82 H new ATOM 0 HG2 GLU A 16 -11.618 1.538 -1.255 1.00 0.76 H new ATOM 0 HG3 GLU A 16 -13.172 2.231 -0.837 1.00 0.76 H new ATOM 231 N GLY A 17 -11.842 6.305 1.994 1.00 1.06 N ATOM 232 CA GLY A 17 -11.523 6.757 3.333 1.00 1.20 C ATOM 233 C GLY A 17 -10.013 6.899 3.451 1.00 1.04 C ATOM 234 O GLY A 17 -9.535 7.862 4.050 1.00 1.13 O ATOM 0 H GLY A 17 -11.837 7.053 1.300 1.00 1.06 H new ATOM 0 HA2 GLY A 17 -12.010 7.711 3.536 1.00 1.20 H new ATOM 0 HA3 GLY A 17 -11.895 6.046 4.071 1.00 1.20 H new ATOM 238 N VAL A 18 -9.277 5.940 2.878 1.00 0.86 N ATOM 239 CA VAL A 18 -7.866 5.729 3.147 1.00 0.86 C ATOM 240 C VAL A 18 -7.165 5.352 1.850 1.00 0.65 C ATOM 241 O VAL A 18 -7.670 4.516 1.102 1.00 0.74 O ATOM 242 CB VAL A 18 -7.705 4.578 4.148 1.00 1.12 C ATOM 243 CG1 VAL A 18 -6.256 4.465 4.643 1.00 0.91 C ATOM 244 CG2 VAL A 18 -8.616 4.757 5.358 1.00 1.73 C ATOM 0 H VAL A 18 -9.661 5.280 2.202 1.00 0.86 H new ATOM 0 HA VAL A 18 -7.432 6.640 3.558 1.00 0.86 H new ATOM 0 HB VAL A 18 -7.982 3.667 3.617 1.00 1.12 H new ATOM 0 HG11 VAL A 18 -6.177 3.640 5.351 1.00 0.91 H new ATOM 0 HG12 VAL A 18 -5.595 4.281 3.796 1.00 0.91 H new ATOM 0 HG13 VAL A 18 -5.966 5.394 5.134 1.00 0.91 H new ATOM 0 HG21 VAL A 18 -8.475 3.923 6.046 1.00 1.73 H new ATOM 0 HG22 VAL A 18 -8.370 5.690 5.864 1.00 1.73 H new ATOM 0 HG23 VAL A 18 -9.655 4.785 5.030 1.00 1.73 H new ATOM 254 N ILE A 19 -5.983 5.929 1.638 1.00 0.52 N ATOM 255 CA ILE A 19 -5.103 5.672 0.516 1.00 0.52 C ATOM 256 C ILE A 19 -3.749 5.300 1.102 1.00 0.51 C ATOM 257 O ILE A 19 -3.281 5.991 2.003 1.00 0.53 O ATOM 258 CB ILE A 19 -4.995 6.944 -0.345 1.00 0.58 C ATOM 259 CG1 ILE A 19 -6.342 7.227 -1.024 1.00 0.59 C ATOM 260 CG2 ILE A 19 -3.898 6.773 -1.404 1.00 0.89 C ATOM 261 CD1 ILE A 19 -6.479 8.644 -1.592 1.00 1.29 C ATOM 0 H ILE A 19 -5.601 6.622 2.281 1.00 0.52 H new ATOM 0 HA ILE A 19 -5.476 4.869 -0.119 1.00 0.52 H new ATOM 0 HB ILE A 19 -4.735 7.786 0.296 1.00 0.58 H new ATOM 0 HG12 ILE A 19 -6.486 6.509 -1.832 1.00 0.59 H new ATOM 0 HG13 ILE A 19 -7.141 7.059 -0.302 1.00 0.59 H new ATOM 0 HG21 ILE A 19 -3.830 7.678 -2.007 1.00 0.89 H new ATOM 0 HG22 ILE A 19 -2.942 6.592 -0.912 1.00 0.89 H new ATOM 0 HG23 ILE A 19 -4.141 5.927 -2.046 1.00 0.89 H new ATOM 0 HD11 ILE A 19 -7.460 8.758 -2.053 1.00 1.29 H new ATOM 0 HD12 ILE A 19 -6.370 9.371 -0.787 1.00 1.29 H new ATOM 0 HD13 ILE A 19 -5.704 8.813 -2.340 1.00 1.29 H new ATOM 273 N ILE A 20 -3.103 4.252 0.588 1.00 0.53 N ATOM 274 CA ILE A 20 -1.763 3.875 1.000 1.00 0.54 C ATOM 275 C ILE A 20 -0.889 3.945 -0.238 1.00 0.56 C ATOM 276 O ILE A 20 -1.285 3.492 -1.310 1.00 0.63 O ATOM 277 CB ILE A 20 -1.725 2.469 1.630 1.00 0.60 C ATOM 278 CG1 ILE A 20 -2.650 2.344 2.851 1.00 0.62 C ATOM 279 CG2 ILE A 20 -0.300 2.135 2.102 1.00 0.71 C ATOM 280 CD1 ILE A 20 -4.063 1.913 2.479 1.00 0.59 C ATOM 0 H ILE A 20 -3.501 3.643 -0.127 1.00 0.53 H new ATOM 0 HA ILE A 20 -1.402 4.553 1.773 1.00 0.54 H new ATOM 0 HB ILE A 20 -2.061 1.781 0.854 1.00 0.60 H new ATOM 0 HG12 ILE A 20 -2.227 1.622 3.549 1.00 0.62 H new ATOM 0 HG13 ILE A 20 -2.692 3.302 3.369 1.00 0.62 H new ATOM 0 HG21 ILE A 20 -0.287 1.139 2.545 1.00 0.71 H new ATOM 0 HG22 ILE A 20 0.381 2.162 1.251 1.00 0.71 H new ATOM 0 HG23 ILE A 20 0.018 2.867 2.845 1.00 0.71 H new ATOM 0 HD11 ILE A 20 -4.671 1.841 3.381 1.00 0.59 H new ATOM 0 HD12 ILE A 20 -4.501 2.647 1.803 1.00 0.59 H new ATOM 0 HD13 ILE A 20 -4.029 0.941 1.986 1.00 0.59 H new ATOM 292 N ASN A 21 0.314 4.484 -0.074 1.00 0.53 N ATOM 293 CA ASN A 21 1.306 4.575 -1.125 1.00 0.56 C ATOM 294 C ASN A 21 2.638 4.092 -0.578 1.00 0.54 C ATOM 295 O ASN A 21 2.994 4.403 0.559 1.00 0.61 O ATOM 296 CB ASN A 21 1.424 6.024 -1.600 1.00 0.61 C ATOM 297 CG ASN A 21 0.430 6.331 -2.707 1.00 1.25 C ATOM 298 OD1 ASN A 21 -0.620 6.911 -2.473 1.00 2.96 O ATOM 299 ND2 ASN A 21 0.749 5.945 -3.937 1.00 1.79 N ATOM 0 H ASN A 21 0.628 4.876 0.814 1.00 0.53 H new ATOM 0 HA ASN A 21 1.012 3.956 -1.972 1.00 0.56 H new ATOM 0 HB2 ASN A 21 1.254 6.698 -0.760 1.00 0.61 H new ATOM 0 HB3 ASN A 21 2.437 6.209 -1.958 1.00 0.61 H new ATOM 0 HD21 ASN A 21 0.112 6.131 -4.711 1.00 1.79 H new ATOM 0 HD22 ASN A 21 1.631 5.462 -4.107 1.00 1.79 H new ATOM 306 N ALA A 22 3.394 3.356 -1.397 1.00 0.63 N ATOM 307 CA ALA A 22 4.745 2.956 -1.053 1.00 0.73 C ATOM 308 C ALA A 22 5.681 4.143 -1.236 1.00 1.04 C ATOM 309 O ALA A 22 6.336 4.289 -2.269 1.00 2.24 O ATOM 310 CB ALA A 22 5.187 1.795 -1.929 1.00 1.03 C ATOM 0 H ALA A 22 3.082 3.026 -2.310 1.00 0.63 H new ATOM 0 HA ALA A 22 4.774 2.631 -0.013 1.00 0.73 H new ATOM 0 HB1 ALA A 22 6.203 1.504 -1.662 1.00 1.03 H new ATOM 0 HB2 ALA A 22 4.515 0.950 -1.779 1.00 1.03 H new ATOM 0 HB3 ALA A 22 5.160 2.098 -2.976 1.00 1.03 H new ATOM 316 N ALA A 23 5.704 5.003 -0.226 1.00 0.80 N ATOM 317 CA ALA A 23 6.463 6.236 -0.209 1.00 1.07 C ATOM 318 C ALA A 23 7.917 6.001 0.187 1.00 0.99 C ATOM 319 O ALA A 23 8.786 6.844 -0.042 1.00 1.08 O ATOM 320 CB ALA A 23 5.773 7.155 0.777 1.00 1.45 C ATOM 0 H ALA A 23 5.174 4.851 0.632 1.00 0.80 H new ATOM 0 HA ALA A 23 6.492 6.678 -1.205 1.00 1.07 H new ATOM 0 HB1 ALA A 23 6.309 8.103 0.827 1.00 1.45 H new ATOM 0 HB2 ALA A 23 4.748 7.334 0.452 1.00 1.45 H new ATOM 0 HB3 ALA A 23 5.765 6.690 1.763 1.00 1.45 H new ATOM 326 N ASN A 24 8.204 4.824 0.740 1.00 1.01 N ATOM 327 CA ASN A 24 9.544 4.417 1.129 1.00 1.01 C ATOM 328 C ASN A 24 10.086 5.330 2.227 1.00 0.97 C ATOM 329 O ASN A 24 9.437 6.279 2.664 1.00 1.03 O ATOM 330 CB ASN A 24 10.499 4.379 -0.074 1.00 1.16 C ATOM 331 CG ASN A 24 9.835 3.836 -1.335 1.00 1.68 C ATOM 332 OD1 ASN A 24 9.287 4.704 -2.178 1.00 1.97 O flip ATOM 333 ND2 ASN A 24 9.789 2.631 -1.535 1.00 2.40 N flip ATOM 0 H ASN A 24 7.495 4.116 0.932 1.00 1.01 H new ATOM 0 HA ASN A 24 9.479 3.403 1.523 1.00 1.01 H new ATOM 0 HB2 ASN A 24 10.872 5.385 -0.269 1.00 1.16 H new ATOM 0 HB3 ASN A 24 11.362 3.761 0.172 1.00 1.16 H new ATOM 0 HD21 ASN A 24 10.218 1.987 -0.871 1.00 2.40 H new ATOM 0 HD22 ASN A 24 9.321 2.269 -2.366 1.00 2.40 H new ATOM 340 N SER A 25 11.331 5.100 2.633 1.00 0.98 N ATOM 341 CA SER A 25 12.010 5.982 3.567 1.00 1.09 C ATOM 342 C SER A 25 12.263 7.381 2.993 1.00 1.17 C ATOM 343 O SER A 25 12.778 8.247 3.689 1.00 1.25 O ATOM 344 CB SER A 25 13.310 5.315 4.005 1.00 1.16 C ATOM 345 OG SER A 25 14.063 4.811 2.907 1.00 1.87 O ATOM 0 H SER A 25 11.890 4.304 2.326 1.00 0.98 H new ATOM 0 HA SER A 25 11.361 6.138 4.429 1.00 1.09 H new ATOM 0 HB2 SER A 25 13.915 6.034 4.556 1.00 1.16 H new ATOM 0 HB3 SER A 25 13.082 4.498 4.690 1.00 1.16 H new ATOM 0 HG SER A 25 14.886 4.395 3.238 1.00 1.87 H new ATOM 351 N LYS A 26 11.916 7.629 1.727 1.00 1.30 N ATOM 352 CA LYS A 26 12.098 8.902 1.061 1.00 1.51 C ATOM 353 C LYS A 26 10.815 9.733 1.126 1.00 1.52 C ATOM 354 O LYS A 26 10.814 10.885 0.706 1.00 1.72 O ATOM 355 CB LYS A 26 12.508 8.643 -0.397 1.00 1.59 C ATOM 356 CG LYS A 26 13.805 7.823 -0.536 1.00 1.71 C ATOM 357 CD LYS A 26 13.637 6.299 -0.424 1.00 2.32 C ATOM 358 CE LYS A 26 14.987 5.594 -0.556 1.00 2.28 C ATOM 359 NZ LYS A 26 14.918 4.223 -0.007 1.00 3.76 N ATOM 0 H LYS A 26 11.489 6.923 1.128 1.00 1.30 H new ATOM 0 HA LYS A 26 12.882 9.469 1.563 1.00 1.51 H new ATOM 0 HB2 LYS A 26 11.699 8.118 -0.905 1.00 1.59 H new ATOM 0 HB3 LYS A 26 12.636 9.599 -0.905 1.00 1.59 H new ATOM 0 HG2 LYS A 26 14.258 8.052 -1.501 1.00 1.71 H new ATOM 0 HG3 LYS A 26 14.506 8.151 0.231 1.00 1.71 H new ATOM 0 HD2 LYS A 26 13.183 6.048 0.534 1.00 2.32 H new ATOM 0 HD3 LYS A 26 12.959 5.945 -1.201 1.00 2.32 H new ATOM 0 HE2 LYS A 26 15.282 5.556 -1.605 1.00 2.28 H new ATOM 0 HE3 LYS A 26 15.753 6.163 -0.030 1.00 2.28 H new ATOM 0 HZ1 LYS A 26 15.854 3.774 -0.076 1.00 3.76 H new ATOM 0 HZ2 LYS A 26 14.625 4.263 0.990 1.00 3.76 H new ATOM 0 HZ3 LYS A 26 14.226 3.666 -0.549 1.00 3.76 H new ATOM 373 N GLY A 27 9.703 9.144 1.580 1.00 1.37 N ATOM 374 CA GLY A 27 8.423 9.827 1.638 1.00 1.44 C ATOM 375 C GLY A 27 7.872 10.155 0.252 1.00 1.47 C ATOM 376 O GLY A 27 6.919 10.926 0.149 1.00 1.63 O ATOM 0 H GLY A 27 9.674 8.181 1.915 1.00 1.37 H new ATOM 0 HA2 GLY A 27 7.706 9.204 2.172 1.00 1.44 H new ATOM 0 HA3 GLY A 27 8.532 10.749 2.210 1.00 1.44 H new ATOM 380 N GLN A 28 8.429 9.554 -0.804 1.00 1.42 N ATOM 381 CA GLN A 28 8.073 9.810 -2.184 1.00 1.51 C ATOM 382 C GLN A 28 7.600 8.487 -2.767 1.00 1.43 C ATOM 383 O GLN A 28 8.345 7.504 -2.747 1.00 1.42 O ATOM 384 CB GLN A 28 9.286 10.353 -2.951 1.00 1.67 C ATOM 385 CG GLN A 28 8.984 10.435 -4.454 1.00 1.43 C ATOM 386 CD GLN A 28 10.099 11.143 -5.215 1.00 1.76 C ATOM 387 OE1 GLN A 28 10.351 12.324 -5.017 1.00 2.73 O ATOM 388 NE2 GLN A 28 10.795 10.436 -6.097 1.00 1.91 N ATOM 0 H GLN A 28 9.164 8.854 -0.707 1.00 1.42 H new ATOM 0 HA GLN A 28 7.287 10.561 -2.260 1.00 1.51 H new ATOM 0 HB2 GLN A 28 9.549 11.341 -2.573 1.00 1.67 H new ATOM 0 HB3 GLN A 28 10.148 9.707 -2.783 1.00 1.67 H new ATOM 0 HG2 GLN A 28 8.852 9.430 -4.854 1.00 1.43 H new ATOM 0 HG3 GLN A 28 8.044 10.966 -4.608 1.00 1.43 H new ATOM 0 HE21 GLN A 28 10.573 9.452 -6.251 1.00 1.91 H new ATOM 0 HE22 GLN A 28 11.552 10.876 -6.621 1.00 1.91 H new ATOM 397 N PRO A 29 6.368 8.436 -3.280 1.00 1.43 N ATOM 398 CA PRO A 29 5.836 7.228 -3.867 1.00 1.41 C ATOM 399 C PRO A 29 6.562 6.910 -5.168 1.00 1.56 C ATOM 400 O PRO A 29 7.155 7.786 -5.796 1.00 1.73 O ATOM 401 CB PRO A 29 4.353 7.513 -4.075 1.00 1.44 C ATOM 402 CG PRO A 29 4.323 9.017 -4.315 1.00 1.53 C ATOM 403 CD PRO A 29 5.409 9.524 -3.369 1.00 1.51 C ATOM 0 HA PRO A 29 5.974 6.349 -3.237 1.00 1.41 H new ATOM 0 HB2 PRO A 29 3.951 6.961 -4.925 1.00 1.44 H new ATOM 0 HB3 PRO A 29 3.762 7.232 -3.204 1.00 1.44 H new ATOM 0 HG2 PRO A 29 4.540 9.267 -5.353 1.00 1.53 H new ATOM 0 HG3 PRO A 29 3.349 9.446 -4.081 1.00 1.53 H new ATOM 0 HD2 PRO A 29 5.876 10.431 -3.754 1.00 1.51 H new ATOM 0 HD3 PRO A 29 4.997 9.768 -2.390 1.00 1.51 H new ATOM 411 N GLY A 30 6.493 5.642 -5.574 1.00 1.80 N ATOM 412 CA GLY A 30 7.080 5.190 -6.827 1.00 2.02 C ATOM 413 C GLY A 30 6.714 6.102 -8.006 1.00 2.62 C ATOM 414 O GLY A 30 5.603 6.638 -8.089 1.00 3.72 O ATOM 0 H GLY A 30 6.030 4.905 -5.043 1.00 1.80 H new ATOM 0 HA2 GLY A 30 8.164 5.151 -6.724 1.00 2.02 H new ATOM 0 HA3 GLY A 30 6.743 4.175 -7.038 1.00 2.02 H new ATOM 418 N GLY A 31 7.671 6.271 -8.924 1.00 2.21 N ATOM 419 CA GLY A 31 7.493 7.074 -10.120 1.00 2.99 C ATOM 420 C GLY A 31 6.275 6.589 -10.898 1.00 1.87 C ATOM 421 O GLY A 31 6.034 5.387 -10.996 1.00 2.06 O ATOM 0 H GLY A 31 8.596 5.847 -8.850 1.00 2.21 H new ATOM 0 HA2 GLY A 31 7.368 8.122 -9.849 1.00 2.99 H new ATOM 0 HA3 GLY A 31 8.383 7.011 -10.746 1.00 2.99 H new ATOM 425 N GLY A 32 5.487 7.524 -11.425 1.00 2.06 N ATOM 426 CA GLY A 32 4.206 7.218 -12.036 1.00 1.93 C ATOM 427 C GLY A 32 3.126 7.854 -11.180 1.00 1.61 C ATOM 428 O GLY A 32 2.721 8.987 -11.434 1.00 1.64 O ATOM 0 H GLY A 32 5.724 8.516 -11.438 1.00 2.06 H new ATOM 0 HA2 GLY A 32 4.165 7.605 -13.054 1.00 1.93 H new ATOM 0 HA3 GLY A 32 4.059 6.140 -12.099 1.00 1.93 H new ATOM 432 N VAL A 33 2.696 7.166 -10.120 1.00 1.35 N ATOM 433 CA VAL A 33 1.698 7.736 -9.224 1.00 1.10 C ATOM 434 C VAL A 33 2.226 8.996 -8.548 1.00 0.95 C ATOM 435 O VAL A 33 1.438 9.893 -8.276 1.00 0.96 O ATOM 436 CB VAL A 33 1.150 6.703 -8.227 1.00 1.09 C ATOM 437 CG1 VAL A 33 2.243 6.103 -7.338 1.00 2.50 C ATOM 438 CG2 VAL A 33 0.073 7.346 -7.342 1.00 2.98 C ATOM 0 H VAL A 33 3.018 6.232 -9.867 1.00 1.35 H new ATOM 0 HA VAL A 33 0.843 8.036 -9.829 1.00 1.10 H new ATOM 0 HB VAL A 33 0.722 5.892 -8.816 1.00 1.09 H new ATOM 0 HG11 VAL A 33 1.799 5.380 -6.654 1.00 2.50 H new ATOM 0 HG12 VAL A 33 2.986 5.604 -7.961 1.00 2.50 H new ATOM 0 HG13 VAL A 33 2.723 6.897 -6.766 1.00 2.50 H new ATOM 0 HG21 VAL A 33 -0.309 6.606 -6.639 1.00 2.98 H new ATOM 0 HG22 VAL A 33 0.506 8.181 -6.791 1.00 2.98 H new ATOM 0 HG23 VAL A 33 -0.743 7.708 -7.967 1.00 2.98 H new ATOM 448 N CYS A 34 3.538 9.134 -8.337 1.00 0.99 N ATOM 449 CA CYS A 34 4.099 10.382 -7.840 1.00 1.06 C ATOM 450 C CYS A 34 3.608 11.613 -8.611 1.00 1.05 C ATOM 451 O CYS A 34 3.518 12.692 -8.036 1.00 1.17 O ATOM 452 CB CYS A 34 5.627 10.263 -7.879 1.00 1.31 C ATOM 453 SG CYS A 34 6.407 11.565 -6.894 1.00 2.02 S ATOM 0 H CYS A 34 4.224 8.398 -8.503 1.00 0.99 H new ATOM 0 HA CYS A 34 3.757 10.537 -6.817 1.00 1.06 H new ATOM 0 HB2 CYS A 34 5.929 9.286 -7.501 1.00 1.31 H new ATOM 0 HB3 CYS A 34 5.974 10.326 -8.911 1.00 1.31 H new ATOM 0 HG CYS A 34 5.755 12.679 -7.053 1.00 2.02 H new ATOM 459 N GLY A 35 3.279 11.466 -9.895 1.00 1.12 N ATOM 460 CA GLY A 35 2.710 12.547 -10.683 1.00 1.25 C ATOM 461 C GLY A 35 1.209 12.701 -10.439 1.00 1.13 C ATOM 462 O GLY A 35 0.718 13.815 -10.282 1.00 1.23 O ATOM 0 H GLY A 35 3.401 10.595 -10.412 1.00 1.12 H new ATOM 0 HA2 GLY A 35 3.216 13.481 -10.437 1.00 1.25 H new ATOM 0 HA3 GLY A 35 2.888 12.357 -11.741 1.00 1.25 H new ATOM 466 N ALA A 36 0.452 11.603 -10.434 1.00 1.00 N ATOM 467 CA ALA A 36 -1.004 11.664 -10.358 1.00 0.94 C ATOM 468 C ALA A 36 -1.450 12.160 -8.990 1.00 0.87 C ATOM 469 O ALA A 36 -2.261 13.081 -8.881 1.00 0.93 O ATOM 470 CB ALA A 36 -1.596 10.281 -10.644 1.00 0.87 C ATOM 0 H ALA A 36 0.828 10.656 -10.482 1.00 1.00 H new ATOM 0 HA ALA A 36 -1.366 12.367 -11.108 1.00 0.94 H new ATOM 0 HB1 ALA A 36 -2.683 10.332 -10.586 1.00 0.87 H new ATOM 0 HB2 ALA A 36 -1.300 9.958 -11.642 1.00 0.87 H new ATOM 0 HB3 ALA A 36 -1.226 9.568 -9.908 1.00 0.87 H new ATOM 476 N LEU A 37 -0.910 11.552 -7.937 1.00 0.79 N ATOM 477 CA LEU A 37 -1.240 11.919 -6.578 1.00 0.75 C ATOM 478 C LEU A 37 -0.807 13.350 -6.314 1.00 0.83 C ATOM 479 O LEU A 37 -1.497 14.060 -5.607 1.00 0.96 O ATOM 480 CB LEU A 37 -0.588 10.937 -5.603 1.00 0.72 C ATOM 481 CG LEU A 37 -1.026 11.170 -4.145 1.00 0.70 C ATOM 482 CD1 LEU A 37 -2.474 10.722 -3.913 1.00 0.92 C ATOM 483 CD2 LEU A 37 -0.143 10.314 -3.240 1.00 0.68 C ATOM 0 H LEU A 37 -0.233 10.793 -8.010 1.00 0.79 H new ATOM 0 HA LEU A 37 -2.319 11.865 -6.430 1.00 0.75 H new ATOM 0 HB2 LEU A 37 -0.841 9.918 -5.896 1.00 0.72 H new ATOM 0 HB3 LEU A 37 0.496 11.028 -5.672 1.00 0.72 H new ATOM 0 HG LEU A 37 -0.939 12.235 -3.930 1.00 0.70 H new ATOM 0 HD11 LEU A 37 -2.748 10.901 -2.873 1.00 0.92 H new ATOM 0 HD12 LEU A 37 -3.139 11.287 -4.566 1.00 0.92 H new ATOM 0 HD13 LEU A 37 -2.566 9.659 -4.134 1.00 0.92 H new ATOM 0 HD21 LEU A 37 -0.435 10.463 -2.200 1.00 0.68 H new ATOM 0 HD22 LEU A 37 -0.262 9.263 -3.504 1.00 0.68 H new ATOM 0 HD23 LEU A 37 0.900 10.604 -3.369 1.00 0.68 H new ATOM 495 N TYR A 38 0.287 13.811 -6.909 1.00 0.84 N ATOM 496 CA TYR A 38 0.653 15.217 -6.854 1.00 0.95 C ATOM 497 C TYR A 38 -0.356 16.095 -7.596 1.00 1.07 C ATOM 498 O TYR A 38 -0.633 17.210 -7.170 1.00 1.16 O ATOM 499 CB TYR A 38 2.042 15.350 -7.461 1.00 1.02 C ATOM 500 CG TYR A 38 2.550 16.754 -7.707 1.00 1.30 C ATOM 501 CD1 TYR A 38 2.852 17.601 -6.624 1.00 2.33 C ATOM 502 CD2 TYR A 38 2.758 17.195 -9.027 1.00 1.95 C ATOM 503 CE1 TYR A 38 3.355 18.893 -6.858 1.00 2.67 C ATOM 504 CE2 TYR A 38 3.269 18.483 -9.268 1.00 2.34 C ATOM 505 CZ TYR A 38 3.569 19.337 -8.185 1.00 2.25 C ATOM 506 OH TYR A 38 4.071 20.579 -8.434 1.00 2.78 O ATOM 0 H TYR A 38 0.937 13.227 -7.436 1.00 0.84 H new ATOM 0 HA TYR A 38 0.651 15.560 -5.819 1.00 0.95 H new ATOM 0 HB2 TYR A 38 2.749 14.844 -6.804 1.00 1.02 H new ATOM 0 HB3 TYR A 38 2.050 14.815 -8.411 1.00 1.02 H new ATOM 0 HD1 TYR A 38 2.697 17.258 -5.612 1.00 2.33 H new ATOM 0 HD2 TYR A 38 2.525 16.543 -9.856 1.00 1.95 H new ATOM 0 HE1 TYR A 38 3.578 19.546 -6.027 1.00 2.67 H new ATOM 0 HE2 TYR A 38 3.432 18.819 -10.282 1.00 2.34 H new ATOM 0 HH TYR A 38 4.152 20.711 -9.402 1.00 2.78 H new ATOM 516 N LYS A 39 -0.914 15.634 -8.718 1.00 1.13 N ATOM 517 CA LYS A 39 -1.743 16.478 -9.565 1.00 1.31 C ATOM 518 C LYS A 39 -3.068 16.762 -8.872 1.00 1.37 C ATOM 519 O LYS A 39 -3.646 17.833 -9.031 1.00 1.57 O ATOM 520 CB LYS A 39 -1.945 15.787 -10.919 1.00 1.44 C ATOM 521 CG LYS A 39 -2.417 16.783 -11.979 1.00 1.58 C ATOM 522 CD LYS A 39 -2.514 16.096 -13.345 1.00 1.81 C ATOM 523 CE LYS A 39 -2.766 17.143 -14.434 1.00 2.06 C ATOM 524 NZ LYS A 39 -2.834 16.531 -15.780 1.00 2.48 N ATOM 0 H LYS A 39 -0.803 14.678 -9.057 1.00 1.13 H new ATOM 0 HA LYS A 39 -1.252 17.435 -9.740 1.00 1.31 H new ATOM 0 HB2 LYS A 39 -1.010 15.326 -11.239 1.00 1.44 H new ATOM 0 HB3 LYS A 39 -2.677 14.986 -10.817 1.00 1.44 H new ATOM 0 HG2 LYS A 39 -3.389 17.190 -11.699 1.00 1.58 H new ATOM 0 HG3 LYS A 39 -1.724 17.622 -12.034 1.00 1.58 H new ATOM 0 HD2 LYS A 39 -1.593 15.553 -13.556 1.00 1.81 H new ATOM 0 HD3 LYS A 39 -3.321 15.364 -13.338 1.00 1.81 H new ATOM 0 HE2 LYS A 39 -3.699 17.667 -14.225 1.00 2.06 H new ATOM 0 HE3 LYS A 39 -1.970 17.888 -14.413 1.00 2.06 H new ATOM 0 HZ1 LYS A 39 -3.006 17.272 -16.490 1.00 2.48 H new ATOM 0 HZ2 LYS A 39 -1.935 16.052 -15.990 1.00 2.48 H new ATOM 0 HZ3 LYS A 39 -3.609 15.839 -15.808 1.00 2.48 H new ATOM 538 N LYS A 40 -3.579 15.773 -8.139 1.00 1.22 N ATOM 539 CA LYS A 40 -4.859 15.875 -7.451 1.00 1.28 C ATOM 540 C LYS A 40 -4.666 16.244 -5.980 1.00 1.27 C ATOM 541 O LYS A 40 -5.505 16.925 -5.398 1.00 1.47 O ATOM 542 CB LYS A 40 -5.566 14.530 -7.620 1.00 1.17 C ATOM 543 CG LYS A 40 -7.036 14.545 -7.163 1.00 1.35 C ATOM 544 CD LYS A 40 -8.039 14.698 -8.308 1.00 1.57 C ATOM 545 CE LYS A 40 -7.732 15.919 -9.175 1.00 1.98 C ATOM 546 NZ LYS A 40 -8.882 16.262 -10.041 1.00 2.44 N ATOM 0 H LYS A 40 -3.112 14.876 -8.007 1.00 1.22 H new ATOM 0 HA LYS A 40 -5.469 16.671 -7.878 1.00 1.28 H new ATOM 0 HB2 LYS A 40 -5.523 14.236 -8.669 1.00 1.17 H new ATOM 0 HB3 LYS A 40 -5.026 13.771 -7.054 1.00 1.17 H new ATOM 0 HG2 LYS A 40 -7.249 13.620 -6.627 1.00 1.35 H new ATOM 0 HG3 LYS A 40 -7.178 15.363 -6.456 1.00 1.35 H new ATOM 0 HD2 LYS A 40 -8.024 13.801 -8.926 1.00 1.57 H new ATOM 0 HD3 LYS A 40 -9.046 14.787 -7.899 1.00 1.57 H new ATOM 0 HE2 LYS A 40 -7.487 16.769 -8.538 1.00 1.98 H new ATOM 0 HE3 LYS A 40 -6.856 15.720 -9.792 1.00 1.98 H new ATOM 0 HZ1 LYS A 40 -8.646 17.094 -10.618 1.00 2.44 H new ATOM 0 HZ2 LYS A 40 -9.099 15.458 -10.664 1.00 2.44 H new ATOM 0 HZ3 LYS A 40 -9.711 16.475 -9.450 1.00 2.44 H new ATOM 560 N PHE A 41 -3.566 15.796 -5.382 1.00 1.12 N ATOM 561 CA PHE A 41 -3.255 15.969 -3.965 1.00 1.24 C ATOM 562 C PHE A 41 -1.808 16.451 -3.806 1.00 0.92 C ATOM 563 O PHE A 41 -1.004 15.784 -3.153 1.00 0.94 O ATOM 564 CB PHE A 41 -3.449 14.663 -3.159 1.00 1.51 C ATOM 565 CG PHE A 41 -4.743 13.900 -3.352 1.00 1.05 C ATOM 566 CD1 PHE A 41 -4.904 13.125 -4.506 1.00 1.01 C ATOM 567 CD2 PHE A 41 -5.737 13.870 -2.357 1.00 1.56 C ATOM 568 CE1 PHE A 41 -6.065 12.362 -4.697 1.00 0.86 C ATOM 569 CE2 PHE A 41 -6.912 13.122 -2.556 1.00 2.08 C ATOM 570 CZ PHE A 41 -7.079 12.369 -3.728 1.00 1.64 C ATOM 0 H PHE A 41 -2.842 15.285 -5.887 1.00 1.12 H new ATOM 0 HA PHE A 41 -3.948 16.711 -3.570 1.00 1.24 H new ATOM 0 HB2 PHE A 41 -2.625 13.993 -3.404 1.00 1.51 H new ATOM 0 HB3 PHE A 41 -3.358 14.906 -2.100 1.00 1.51 H new ATOM 0 HD1 PHE A 41 -4.127 13.114 -5.256 1.00 1.01 H new ATOM 0 HD2 PHE A 41 -5.598 14.422 -1.439 1.00 1.56 H new ATOM 0 HE1 PHE A 41 -6.179 11.768 -5.592 1.00 0.86 H new ATOM 0 HE2 PHE A 41 -7.688 13.128 -1.804 1.00 2.08 H new ATOM 0 HZ PHE A 41 -7.983 11.798 -3.883 1.00 1.64 H new ATOM 580 N PRO A 42 -1.457 17.652 -4.286 1.00 0.95 N ATOM 581 CA PRO A 42 -0.103 18.185 -4.153 1.00 0.98 C ATOM 582 C PRO A 42 0.287 18.444 -2.695 1.00 0.93 C ATOM 583 O PRO A 42 1.439 18.735 -2.400 1.00 1.17 O ATOM 584 CB PRO A 42 -0.093 19.478 -4.977 1.00 1.40 C ATOM 585 CG PRO A 42 -1.558 19.915 -4.977 1.00 1.54 C ATOM 586 CD PRO A 42 -2.332 18.598 -4.956 1.00 1.28 C ATOM 0 HA PRO A 42 0.635 17.467 -4.512 1.00 0.98 H new ATOM 0 HB2 PRO A 42 0.551 20.234 -4.528 1.00 1.40 H new ATOM 0 HB3 PRO A 42 0.274 19.306 -5.989 1.00 1.40 H new ATOM 0 HG2 PRO A 42 -1.792 20.530 -4.108 1.00 1.54 H new ATOM 0 HG3 PRO A 42 -1.799 20.506 -5.860 1.00 1.54 H new ATOM 0 HD2 PRO A 42 -3.277 18.705 -4.424 1.00 1.28 H new ATOM 0 HD3 PRO A 42 -2.571 18.266 -5.966 1.00 1.28 H new ATOM 594 N GLU A 43 -0.665 18.325 -1.774 1.00 0.88 N ATOM 595 CA GLU A 43 -0.460 18.526 -0.352 1.00 1.02 C ATOM 596 C GLU A 43 0.113 17.265 0.295 1.00 1.03 C ATOM 597 O GLU A 43 0.798 17.349 1.305 1.00 1.32 O ATOM 598 CB GLU A 43 -1.810 18.923 0.256 1.00 1.20 C ATOM 599 CG GLU A 43 -1.874 20.433 0.490 1.00 1.65 C ATOM 600 CD GLU A 43 -1.219 20.806 1.819 1.00 3.38 C ATOM 601 OE1 GLU A 43 -1.780 20.371 2.850 1.00 4.56 O ATOM 602 OE2 GLU A 43 -0.187 21.507 1.782 1.00 4.44 O ATOM 0 H GLU A 43 -1.627 18.079 -2.008 1.00 0.88 H new ATOM 0 HA GLU A 43 0.267 19.318 -0.172 1.00 1.02 H new ATOM 0 HB2 GLU A 43 -2.618 18.618 -0.409 1.00 1.20 H new ATOM 0 HB3 GLU A 43 -1.959 18.397 1.199 1.00 1.20 H new ATOM 0 HG2 GLU A 43 -1.373 20.953 -0.326 1.00 1.65 H new ATOM 0 HG3 GLU A 43 -2.913 20.762 0.487 1.00 1.65 H new ATOM 609 N SER A 44 -0.116 16.082 -0.287 1.00 0.90 N ATOM 610 CA SER A 44 0.463 14.853 0.245 1.00 1.02 C ATOM 611 C SER A 44 1.940 14.697 -0.155 1.00 1.11 C ATOM 612 O SER A 44 2.562 13.680 0.153 1.00 1.34 O ATOM 613 CB SER A 44 -0.358 13.650 -0.228 1.00 1.16 C ATOM 614 OG SER A 44 -0.268 13.435 -1.625 1.00 1.98 O ATOM 0 H SER A 44 -0.693 15.955 -1.118 1.00 0.90 H new ATOM 0 HA SER A 44 0.431 14.905 1.333 1.00 1.02 H new ATOM 0 HB2 SER A 44 -0.017 12.756 0.295 1.00 1.16 H new ATOM 0 HB3 SER A 44 -1.403 13.800 0.045 1.00 1.16 H new ATOM 0 HG SER A 44 -0.542 14.248 -2.099 1.00 1.98 H new ATOM 620 N PHE A 45 2.517 15.687 -0.848 1.00 1.18 N ATOM 621 CA PHE A 45 3.899 15.730 -1.289 1.00 1.42 C ATOM 622 C PHE A 45 4.750 16.179 -0.099 1.00 1.47 C ATOM 623 O PHE A 45 5.364 17.240 -0.098 1.00 2.03 O ATOM 624 CB PHE A 45 3.970 16.670 -2.514 1.00 2.12 C ATOM 625 CG PHE A 45 4.700 16.125 -3.718 1.00 2.24 C ATOM 626 CD1 PHE A 45 4.330 14.876 -4.243 1.00 2.26 C ATOM 627 CD2 PHE A 45 5.668 16.903 -4.382 1.00 3.48 C ATOM 628 CE1 PHE A 45 4.940 14.393 -5.411 1.00 3.43 C ATOM 629 CE2 PHE A 45 6.276 16.422 -5.554 1.00 4.20 C ATOM 630 CZ PHE A 45 5.912 15.166 -6.069 1.00 4.16 C ATOM 0 H PHE A 45 1.997 16.519 -1.126 1.00 1.18 H new ATOM 0 HA PHE A 45 4.287 14.763 -1.609 1.00 1.42 H new ATOM 0 HB2 PHE A 45 2.953 16.924 -2.813 1.00 2.12 H new ATOM 0 HB3 PHE A 45 4.453 17.598 -2.209 1.00 2.12 H new ATOM 0 HD1 PHE A 45 3.574 14.286 -3.747 1.00 2.26 H new ATOM 0 HD2 PHE A 45 5.944 17.871 -3.990 1.00 3.48 H new ATOM 0 HE1 PHE A 45 4.662 13.426 -5.805 1.00 3.43 H new ATOM 0 HE2 PHE A 45 7.023 17.017 -6.059 1.00 4.20 H new ATOM 0 HZ PHE A 45 6.379 14.795 -6.970 1.00 4.16 H new ATOM 640 N ASP A 46 4.754 15.345 0.940 1.00 1.23 N ATOM 641 CA ASP A 46 5.449 15.568 2.195 1.00 1.71 C ATOM 642 C ASP A 46 6.920 15.239 1.971 1.00 1.81 C ATOM 643 O ASP A 46 7.796 15.916 2.498 1.00 2.64 O ATOM 644 CB ASP A 46 4.803 14.666 3.262 1.00 1.97 C ATOM 645 CG ASP A 46 5.026 15.117 4.710 1.00 2.78 C ATOM 646 OD1 ASP A 46 5.429 16.275 4.937 1.00 3.73 O ATOM 647 OD2 ASP A 46 4.752 14.293 5.614 1.00 3.22 O ATOM 0 H ASP A 46 4.249 14.459 0.923 1.00 1.23 H new ATOM 0 HA ASP A 46 5.377 16.600 2.539 1.00 1.71 H new ATOM 0 HB2 ASP A 46 3.731 14.616 3.074 1.00 1.97 H new ATOM 0 HB3 ASP A 46 5.194 13.655 3.147 1.00 1.97 H new ATOM 652 N LEU A 47 7.177 14.196 1.157 1.00 1.17 N ATOM 653 CA LEU A 47 8.491 13.743 0.690 1.00 1.20 C ATOM 654 C LEU A 47 9.571 13.878 1.762 1.00 1.11 C ATOM 655 O LEU A 47 10.711 14.260 1.506 1.00 1.27 O ATOM 656 CB LEU A 47 8.820 14.293 -0.710 1.00 1.36 C ATOM 657 CG LEU A 47 8.482 15.770 -0.972 1.00 1.84 C ATOM 658 CD1 LEU A 47 9.543 16.719 -0.424 1.00 2.32 C ATOM 659 CD2 LEU A 47 8.315 15.974 -2.477 1.00 2.28 C ATOM 0 H LEU A 47 6.423 13.616 0.789 1.00 1.17 H new ATOM 0 HA LEU A 47 8.456 12.665 0.531 1.00 1.20 H new ATOM 0 HB2 LEU A 47 9.886 14.152 -0.889 1.00 1.36 H new ATOM 0 HB3 LEU A 47 8.291 13.688 -1.446 1.00 1.36 H new ATOM 0 HG LEU A 47 7.555 16.006 -0.449 1.00 1.84 H new ATOM 0 HD11 LEU A 47 9.255 17.749 -0.636 1.00 2.32 H new ATOM 0 HD12 LEU A 47 9.632 16.582 0.654 1.00 2.32 H new ATOM 0 HD13 LEU A 47 10.501 16.506 -0.897 1.00 2.32 H new ATOM 0 HD21 LEU A 47 8.075 17.018 -2.678 1.00 2.28 H new ATOM 0 HD22 LEU A 47 9.243 15.711 -2.985 1.00 2.28 H new ATOM 0 HD23 LEU A 47 7.508 15.339 -2.843 1.00 2.28 H new ATOM 671 N GLN A 48 9.178 13.509 2.984 1.00 0.96 N ATOM 672 CA GLN A 48 10.035 13.553 4.156 1.00 0.97 C ATOM 673 C GLN A 48 10.807 12.239 4.308 1.00 0.94 C ATOM 674 O GLN A 48 10.318 11.181 3.911 1.00 0.92 O ATOM 675 CB GLN A 48 9.200 13.839 5.417 1.00 1.01 C ATOM 676 CG GLN A 48 8.040 12.850 5.631 1.00 2.47 C ATOM 677 CD GLN A 48 7.684 12.666 7.112 1.00 3.20 C ATOM 678 OE1 GLN A 48 8.370 11.980 7.871 1.00 3.73 O ATOM 679 NE2 GLN A 48 6.584 13.250 7.559 1.00 3.91 N ATOM 0 H GLN A 48 8.238 13.166 3.183 1.00 0.96 H new ATOM 0 HA GLN A 48 10.757 14.360 4.028 1.00 0.97 H new ATOM 0 HB2 GLN A 48 9.854 13.812 6.289 1.00 1.01 H new ATOM 0 HB3 GLN A 48 8.797 14.850 5.353 1.00 1.01 H new ATOM 0 HG2 GLN A 48 7.162 13.205 5.092 1.00 2.47 H new ATOM 0 HG3 GLN A 48 8.308 11.884 5.203 1.00 2.47 H new ATOM 0 HE21 GLN A 48 6.016 13.818 6.930 1.00 3.91 H new ATOM 0 HE22 GLN A 48 6.304 13.132 8.533 1.00 3.91 H new ATOM 688 N PRO A 49 11.985 12.272 4.942 1.00 1.00 N ATOM 689 CA PRO A 49 12.710 11.067 5.290 1.00 1.04 C ATOM 690 C PRO A 49 11.954 10.311 6.388 1.00 1.03 C ATOM 691 O PRO A 49 11.955 10.724 7.547 1.00 1.46 O ATOM 692 CB PRO A 49 14.094 11.542 5.741 1.00 1.15 C ATOM 693 CG PRO A 49 13.836 12.958 6.262 1.00 1.16 C ATOM 694 CD PRO A 49 12.707 13.461 5.363 1.00 1.07 C ATOM 0 HA PRO A 49 12.807 10.368 4.459 1.00 1.04 H new ATOM 0 HB2 PRO A 49 14.506 10.898 6.518 1.00 1.15 H new ATOM 0 HB3 PRO A 49 14.807 11.542 4.916 1.00 1.15 H new ATOM 0 HG2 PRO A 49 13.543 12.954 7.312 1.00 1.16 H new ATOM 0 HG3 PRO A 49 14.724 13.585 6.182 1.00 1.16 H new ATOM 0 HD2 PRO A 49 12.053 14.147 5.901 1.00 1.07 H new ATOM 0 HD3 PRO A 49 13.102 14.005 4.505 1.00 1.07 H new ATOM 702 N ILE A 50 11.305 9.202 6.030 1.00 0.79 N ATOM 703 CA ILE A 50 10.624 8.321 6.967 1.00 0.75 C ATOM 704 C ILE A 50 11.577 7.169 7.302 1.00 0.75 C ATOM 705 O ILE A 50 12.535 6.895 6.581 1.00 0.77 O ATOM 706 CB ILE A 50 9.255 7.887 6.386 1.00 0.78 C ATOM 707 CG1 ILE A 50 8.330 9.117 6.367 1.00 1.02 C ATOM 708 CG2 ILE A 50 8.571 6.778 7.197 1.00 0.71 C ATOM 709 CD1 ILE A 50 7.112 8.965 5.450 1.00 1.07 C ATOM 0 H ILE A 50 11.239 8.889 5.061 1.00 0.79 H new ATOM 0 HA ILE A 50 10.382 8.821 7.905 1.00 0.75 H new ATOM 0 HB ILE A 50 9.437 7.488 5.388 1.00 0.78 H new ATOM 0 HG12 ILE A 50 7.986 9.316 7.382 1.00 1.02 H new ATOM 0 HG13 ILE A 50 8.905 9.987 6.049 1.00 1.02 H new ATOM 0 HG21 ILE A 50 7.618 6.524 6.734 1.00 0.71 H new ATOM 0 HG22 ILE A 50 9.211 5.896 7.219 1.00 0.71 H new ATOM 0 HG23 ILE A 50 8.398 7.126 8.215 1.00 0.71 H new ATOM 0 HD11 ILE A 50 6.510 9.873 5.491 1.00 1.07 H new ATOM 0 HD12 ILE A 50 7.446 8.798 4.426 1.00 1.07 H new ATOM 0 HD13 ILE A 50 6.512 8.116 5.779 1.00 1.07 H new ATOM 721 N GLU A 51 11.317 6.523 8.437 1.00 0.75 N ATOM 722 CA GLU A 51 12.018 5.359 8.952 1.00 0.72 C ATOM 723 C GLU A 51 11.780 4.162 8.011 1.00 0.73 C ATOM 724 O GLU A 51 11.188 4.314 6.945 1.00 1.03 O ATOM 725 CB GLU A 51 11.470 5.177 10.376 1.00 0.75 C ATOM 726 CG GLU A 51 12.247 4.262 11.324 1.00 1.13 C ATOM 727 CD GLU A 51 11.731 4.458 12.756 1.00 1.84 C ATOM 728 OE1 GLU A 51 10.512 4.252 12.969 1.00 2.83 O ATOM 729 OE2 GLU A 51 12.548 4.854 13.614 1.00 2.44 O ATOM 0 H GLU A 51 10.563 6.821 9.057 1.00 0.75 H new ATOM 0 HA GLU A 51 13.102 5.462 8.994 1.00 0.72 H new ATOM 0 HB2 GLU A 51 11.404 6.162 10.839 1.00 0.75 H new ATOM 0 HB3 GLU A 51 10.453 4.793 10.298 1.00 0.75 H new ATOM 0 HG2 GLU A 51 12.128 3.221 11.022 1.00 1.13 H new ATOM 0 HG3 GLU A 51 13.312 4.489 11.275 1.00 1.13 H new ATOM 736 N VAL A 52 12.238 2.958 8.359 1.00 0.63 N ATOM 737 CA VAL A 52 12.199 1.825 7.439 1.00 0.76 C ATOM 738 C VAL A 52 11.467 0.670 8.108 1.00 0.86 C ATOM 739 O VAL A 52 11.990 0.036 9.018 1.00 0.95 O ATOM 740 CB VAL A 52 13.620 1.434 6.979 1.00 0.92 C ATOM 741 CG1 VAL A 52 13.546 0.684 5.645 1.00 1.49 C ATOM 742 CG2 VAL A 52 14.534 2.650 6.779 1.00 1.01 C ATOM 0 H VAL A 52 12.640 2.745 9.272 1.00 0.63 H new ATOM 0 HA VAL A 52 11.654 2.101 6.536 1.00 0.76 H new ATOM 0 HB VAL A 52 14.039 0.810 7.768 1.00 0.92 H new ATOM 0 HG11 VAL A 52 14.551 0.411 5.325 1.00 1.49 H new ATOM 0 HG12 VAL A 52 12.946 -0.218 5.767 1.00 1.49 H new ATOM 0 HG13 VAL A 52 13.088 1.325 4.892 1.00 1.49 H new ATOM 0 HG21 VAL A 52 15.520 2.315 6.456 1.00 1.01 H new ATOM 0 HG22 VAL A 52 14.107 3.306 6.020 1.00 1.01 H new ATOM 0 HG23 VAL A 52 14.626 3.195 7.719 1.00 1.01 H new ATOM 752 N GLY A 53 10.223 0.443 7.685 1.00 0.91 N ATOM 753 CA GLY A 53 9.326 -0.554 8.251 1.00 1.04 C ATOM 754 C GLY A 53 8.069 0.139 8.755 1.00 1.02 C ATOM 755 O GLY A 53 6.955 -0.352 8.597 1.00 1.55 O ATOM 0 H GLY A 53 9.803 0.966 6.916 1.00 0.91 H new ATOM 0 HA2 GLY A 53 9.069 -1.299 7.498 1.00 1.04 H new ATOM 0 HA3 GLY A 53 9.818 -1.082 9.068 1.00 1.04 H new ATOM 759 N LYS A 54 8.249 1.322 9.338 1.00 0.58 N ATOM 760 CA LYS A 54 7.206 2.095 9.965 1.00 0.51 C ATOM 761 C LYS A 54 6.475 2.833 8.854 1.00 0.46 C ATOM 762 O LYS A 54 7.110 3.411 7.973 1.00 0.47 O ATOM 763 CB LYS A 54 7.919 3.072 10.908 1.00 0.68 C ATOM 764 CG LYS A 54 7.023 4.132 11.549 1.00 1.48 C ATOM 765 CD LYS A 54 6.628 3.817 12.994 1.00 1.72 C ATOM 766 CE LYS A 54 7.878 3.869 13.882 1.00 2.90 C ATOM 767 NZ LYS A 54 7.547 3.987 15.315 1.00 3.32 N ATOM 0 H LYS A 54 9.162 1.775 9.383 1.00 0.58 H new ATOM 0 HA LYS A 54 6.486 1.499 10.525 1.00 0.51 H new ATOM 0 HB2 LYS A 54 8.401 2.500 11.701 1.00 0.68 H new ATOM 0 HB3 LYS A 54 8.710 3.576 10.352 1.00 0.68 H new ATOM 0 HG2 LYS A 54 7.538 5.092 11.524 1.00 1.48 H new ATOM 0 HG3 LYS A 54 6.118 4.240 10.950 1.00 1.48 H new ATOM 0 HD2 LYS A 54 5.887 4.535 13.346 1.00 1.72 H new ATOM 0 HD3 LYS A 54 6.168 2.831 13.051 1.00 1.72 H new ATOM 0 HE2 LYS A 54 8.471 2.969 13.722 1.00 2.90 H new ATOM 0 HE3 LYS A 54 8.497 4.716 13.584 1.00 2.90 H new ATOM 0 HZ1 LYS A 54 8.424 4.018 15.873 1.00 3.32 H new ATOM 0 HZ2 LYS A 54 7.004 4.859 15.475 1.00 3.32 H new ATOM 0 HZ3 LYS A 54 6.979 3.167 15.609 1.00 3.32 H new ATOM 781 N ALA A 55 5.149 2.863 8.923 1.00 0.45 N ATOM 782 CA ALA A 55 4.350 3.738 8.077 1.00 0.37 C ATOM 783 C ALA A 55 3.979 4.992 8.869 1.00 0.39 C ATOM 784 O ALA A 55 3.735 4.919 10.072 1.00 0.49 O ATOM 785 CB ALA A 55 3.091 3.004 7.604 1.00 0.40 C ATOM 0 H ALA A 55 4.602 2.286 9.562 1.00 0.45 H new ATOM 0 HA ALA A 55 4.924 4.027 7.197 1.00 0.37 H new ATOM 0 HB1 ALA A 55 2.500 3.666 6.972 1.00 0.40 H new ATOM 0 HB2 ALA A 55 3.378 2.120 7.035 1.00 0.40 H new ATOM 0 HB3 ALA A 55 2.499 2.703 8.468 1.00 0.40 H new ATOM 791 N ARG A 56 3.907 6.142 8.197 1.00 0.36 N ATOM 792 CA ARG A 56 3.440 7.396 8.772 1.00 0.39 C ATOM 793 C ARG A 56 2.381 7.960 7.839 1.00 0.35 C ATOM 794 O ARG A 56 2.600 8.026 6.634 1.00 0.40 O ATOM 795 CB ARG A 56 4.611 8.381 8.893 1.00 0.52 C ATOM 796 CG ARG A 56 5.305 8.276 10.252 1.00 1.42 C ATOM 797 CD ARG A 56 6.549 9.171 10.241 1.00 1.99 C ATOM 798 NE ARG A 56 7.038 9.441 11.598 1.00 2.66 N ATOM 799 CZ ARG A 56 8.161 10.114 11.880 1.00 3.41 C ATOM 800 NH1 ARG A 56 8.513 10.298 13.154 1.00 3.96 N ATOM 801 NH2 ARG A 56 8.923 10.605 10.898 1.00 4.24 N ATOM 0 H ARG A 56 4.178 6.225 7.217 1.00 0.36 H new ATOM 0 HA ARG A 56 3.026 7.234 9.767 1.00 0.39 H new ATOM 0 HB2 ARG A 56 5.333 8.186 8.100 1.00 0.52 H new ATOM 0 HB3 ARG A 56 4.247 9.398 8.749 1.00 0.52 H new ATOM 0 HG2 ARG A 56 4.626 8.583 11.047 1.00 1.42 H new ATOM 0 HG3 ARG A 56 5.585 7.242 10.454 1.00 1.42 H new ATOM 0 HD2 ARG A 56 7.337 8.692 9.660 1.00 1.99 H new ATOM 0 HD3 ARG A 56 6.315 10.113 9.745 1.00 1.99 H new ATOM 0 HE ARG A 56 6.484 9.092 12.380 1.00 2.66 H new ATOM 0 HH11 ARG A 56 7.928 9.927 13.903 1.00 3.96 H new ATOM 0 HH12 ARG A 56 9.367 10.809 13.379 1.00 3.96 H new ATOM 0 HH21 ARG A 56 8.651 10.468 9.925 1.00 4.24 H new ATOM 0 HH22 ARG A 56 9.777 11.116 11.122 1.00 4.24 H new ATOM 815 N LEU A 57 1.232 8.370 8.369 1.00 0.37 N ATOM 816 CA LEU A 57 0.279 9.118 7.570 1.00 0.43 C ATOM 817 C LEU A 57 0.818 10.519 7.337 1.00 0.56 C ATOM 818 O LEU A 57 1.388 11.123 8.246 1.00 0.61 O ATOM 819 CB LEU A 57 -1.123 9.094 8.199 1.00 0.54 C ATOM 820 CG LEU A 57 -1.318 9.963 9.451 1.00 0.88 C ATOM 821 CD1 LEU A 57 -1.963 11.305 9.085 1.00 1.94 C ATOM 822 CD2 LEU A 57 -2.245 9.234 10.428 1.00 1.36 C ATOM 0 H LEU A 57 0.945 8.198 9.333 1.00 0.37 H new ATOM 0 HA LEU A 57 0.159 8.645 6.595 1.00 0.43 H new ATOM 0 HB2 LEU A 57 -1.843 9.413 7.445 1.00 0.54 H new ATOM 0 HB3 LEU A 57 -1.366 8.063 8.456 1.00 0.54 H new ATOM 0 HG LEU A 57 -0.342 10.144 9.902 1.00 0.88 H new ATOM 0 HD11 LEU A 57 -2.092 11.904 9.986 1.00 1.94 H new ATOM 0 HD12 LEU A 57 -1.321 11.838 8.383 1.00 1.94 H new ATOM 0 HD13 LEU A 57 -2.935 11.128 8.625 1.00 1.94 H new ATOM 0 HD21 LEU A 57 -2.388 9.845 11.319 1.00 1.36 H new ATOM 0 HD22 LEU A 57 -3.209 9.057 9.951 1.00 1.36 H new ATOM 0 HD23 LEU A 57 -1.799 8.280 10.710 1.00 1.36 H new ATOM 834 N VAL A 58 0.645 11.034 6.123 1.00 0.81 N ATOM 835 CA VAL A 58 0.994 12.397 5.798 1.00 0.95 C ATOM 836 C VAL A 58 -0.305 13.184 5.815 1.00 0.98 C ATOM 837 O VAL A 58 -1.331 12.750 5.283 1.00 0.93 O ATOM 838 CB VAL A 58 1.743 12.479 4.460 1.00 1.06 C ATOM 839 CG1 VAL A 58 3.001 11.613 4.534 1.00 1.63 C ATOM 840 CG2 VAL A 58 0.929 12.017 3.250 1.00 0.96 C ATOM 0 H VAL A 58 0.257 10.508 5.340 1.00 0.81 H new ATOM 0 HA VAL A 58 1.689 12.822 6.522 1.00 0.95 H new ATOM 0 HB VAL A 58 1.969 13.535 4.312 1.00 1.06 H new ATOM 0 HG11 VAL A 58 3.537 11.668 3.586 1.00 1.63 H new ATOM 0 HG12 VAL A 58 3.645 11.974 5.336 1.00 1.63 H new ATOM 0 HG13 VAL A 58 2.720 10.579 4.733 1.00 1.63 H new ATOM 0 HG21 VAL A 58 1.534 12.108 2.348 1.00 0.96 H new ATOM 0 HG22 VAL A 58 0.634 10.976 3.386 1.00 0.96 H new ATOM 0 HG23 VAL A 58 0.038 12.637 3.153 1.00 0.96 H new ATOM 850 N LYS A 59 -0.280 14.340 6.471 1.00 1.17 N ATOM 851 CA LYS A 59 -1.400 15.247 6.368 1.00 1.27 C ATOM 852 C LYS A 59 -1.367 15.800 4.949 1.00 1.32 C ATOM 853 O LYS A 59 -0.299 16.142 4.452 1.00 2.31 O ATOM 854 CB LYS A 59 -1.330 16.361 7.434 1.00 1.78 C ATOM 855 CG LYS A 59 -0.003 17.141 7.488 1.00 3.38 C ATOM 856 CD LYS A 59 1.011 16.578 8.496 1.00 4.12 C ATOM 857 CE LYS A 59 2.417 17.004 8.052 1.00 5.72 C ATOM 858 NZ LYS A 59 3.467 16.550 8.986 1.00 6.70 N ATOM 0 H LYS A 59 0.486 14.659 7.064 1.00 1.17 H new ATOM 0 HA LYS A 59 -2.343 14.735 6.558 1.00 1.27 H new ATOM 0 HB2 LYS A 59 -2.140 17.067 7.251 1.00 1.78 H new ATOM 0 HB3 LYS A 59 -1.510 15.916 8.413 1.00 1.78 H new ATOM 0 HG2 LYS A 59 0.448 17.140 6.496 1.00 3.38 H new ATOM 0 HG3 LYS A 59 -0.214 18.180 7.742 1.00 3.38 H new ATOM 0 HD2 LYS A 59 0.799 16.952 9.498 1.00 4.12 H new ATOM 0 HD3 LYS A 59 0.939 15.491 8.540 1.00 4.12 H new ATOM 0 HE2 LYS A 59 2.619 16.601 7.060 1.00 5.72 H new ATOM 0 HE3 LYS A 59 2.455 18.090 7.968 1.00 5.72 H new ATOM 0 HZ1 LYS A 59 4.397 16.863 8.641 1.00 6.70 H new ATOM 0 HZ2 LYS A 59 3.293 16.955 9.928 1.00 6.70 H new ATOM 0 HZ3 LYS A 59 3.452 15.512 9.047 1.00 6.70 H new ATOM 872 N GLY A 60 -2.521 15.893 4.303 1.00 0.85 N ATOM 873 CA GLY A 60 -2.673 16.686 3.107 1.00 0.93 C ATOM 874 C GLY A 60 -4.049 17.323 3.179 1.00 0.82 C ATOM 875 O GLY A 60 -5.028 16.628 3.444 1.00 0.81 O ATOM 0 H GLY A 60 -3.374 15.418 4.599 1.00 0.85 H new ATOM 0 HA2 GLY A 60 -1.896 17.448 3.047 1.00 0.93 H new ATOM 0 HA3 GLY A 60 -2.580 16.065 2.216 1.00 0.93 H new ATOM 879 N ALA A 61 -4.137 18.635 2.955 1.00 0.85 N ATOM 880 CA ALA A 61 -5.394 19.368 3.020 1.00 0.88 C ATOM 881 C ALA A 61 -6.427 18.788 2.053 1.00 0.81 C ATOM 882 O ALA A 61 -7.622 18.822 2.325 1.00 0.85 O ATOM 883 CB ALA A 61 -5.142 20.849 2.725 1.00 1.01 C ATOM 0 H ALA A 61 -3.333 19.218 2.723 1.00 0.85 H new ATOM 0 HA ALA A 61 -5.801 19.270 4.026 1.00 0.88 H new ATOM 0 HB1 ALA A 61 -6.084 21.395 2.774 1.00 1.01 H new ATOM 0 HB2 ALA A 61 -4.449 21.254 3.462 1.00 1.01 H new ATOM 0 HB3 ALA A 61 -4.714 20.954 1.728 1.00 1.01 H new ATOM 889 N ALA A 62 -5.963 18.248 0.922 1.00 0.77 N ATOM 890 CA ALA A 62 -6.824 17.583 -0.041 1.00 0.78 C ATOM 891 C ALA A 62 -7.449 16.330 0.582 1.00 0.79 C ATOM 892 O ALA A 62 -8.662 16.148 0.525 1.00 0.88 O ATOM 893 CB ALA A 62 -6.009 17.244 -1.296 1.00 0.81 C ATOM 0 H ALA A 62 -4.979 18.263 0.655 1.00 0.77 H new ATOM 0 HA ALA A 62 -7.641 18.246 -0.328 1.00 0.78 H new ATOM 0 HB1 ALA A 62 -6.650 16.745 -2.022 1.00 0.81 H new ATOM 0 HB2 ALA A 62 -5.613 18.161 -1.732 1.00 0.81 H new ATOM 0 HB3 ALA A 62 -5.184 16.585 -1.027 1.00 0.81 H new ATOM 899 N LYS A 63 -6.627 15.447 1.159 1.00 0.74 N ATOM 900 CA LYS A 63 -7.081 14.294 1.929 1.00 0.80 C ATOM 901 C LYS A 63 -5.879 13.773 2.715 1.00 0.76 C ATOM 902 O LYS A 63 -4.742 13.937 2.276 1.00 0.69 O ATOM 903 CB LYS A 63 -7.628 13.211 0.981 1.00 0.88 C ATOM 904 CG LYS A 63 -8.286 12.002 1.663 1.00 1.73 C ATOM 905 CD LYS A 63 -9.544 12.357 2.462 1.00 2.68 C ATOM 906 CE LYS A 63 -10.126 11.062 3.044 1.00 3.55 C ATOM 907 NZ LYS A 63 -11.339 11.309 3.850 1.00 4.36 N ATOM 0 H LYS A 63 -5.611 15.519 1.100 1.00 0.74 H new ATOM 0 HA LYS A 63 -7.886 14.569 2.611 1.00 0.80 H new ATOM 0 HB2 LYS A 63 -8.358 13.671 0.315 1.00 0.88 H new ATOM 0 HB3 LYS A 63 -6.809 12.852 0.357 1.00 0.88 H new ATOM 0 HG2 LYS A 63 -8.544 11.264 0.904 1.00 1.73 H new ATOM 0 HG3 LYS A 63 -7.562 11.534 2.330 1.00 1.73 H new ATOM 0 HD2 LYS A 63 -9.301 13.057 3.261 1.00 2.68 H new ATOM 0 HD3 LYS A 63 -10.276 12.847 1.820 1.00 2.68 H new ATOM 0 HE2 LYS A 63 -10.365 10.376 2.232 1.00 3.55 H new ATOM 0 HE3 LYS A 63 -9.374 10.573 3.663 1.00 3.55 H new ATOM 0 HZ1 LYS A 63 -11.698 10.407 4.223 1.00 4.36 H new ATOM 0 HZ2 LYS A 63 -11.107 11.943 4.641 1.00 4.36 H new ATOM 0 HZ3 LYS A 63 -12.068 11.751 3.254 1.00 4.36 H new ATOM 921 N HIS A 64 -6.123 13.118 3.851 1.00 0.95 N ATOM 922 CA HIS A 64 -5.088 12.372 4.549 1.00 0.93 C ATOM 923 C HIS A 64 -4.618 11.233 3.650 1.00 0.82 C ATOM 924 O HIS A 64 -5.448 10.547 3.058 1.00 0.83 O ATOM 925 CB HIS A 64 -5.656 11.782 5.844 1.00 1.06 C ATOM 926 CG HIS A 64 -6.025 12.795 6.901 1.00 1.36 C ATOM 927 ND1 HIS A 64 -6.466 12.492 8.171 1.00 1.84 N ATOM 928 CD2 HIS A 64 -6.004 14.162 6.785 1.00 1.27 C ATOM 929 CE1 HIS A 64 -6.705 13.654 8.804 1.00 2.01 C ATOM 930 NE2 HIS A 64 -6.438 14.695 8.001 1.00 1.67 N ATOM 0 H HIS A 64 -7.036 13.092 4.305 1.00 0.95 H new ATOM 0 HA HIS A 64 -4.258 13.036 4.789 1.00 0.93 H new ATOM 0 HB2 HIS A 64 -6.542 11.195 5.600 1.00 1.06 H new ATOM 0 HB3 HIS A 64 -4.923 11.093 6.263 1.00 1.06 H new ATOM 0 HD2 HIS A 64 -5.706 14.724 5.912 1.00 1.27 H new ATOM 0 HE1 HIS A 64 -7.063 13.738 9.820 1.00 2.01 H new ATOM 0 HE2 HIS A 64 -6.533 15.684 8.233 1.00 1.67 H new ATOM 938 N ILE A 65 -3.311 10.993 3.590 1.00 0.74 N ATOM 939 CA ILE A 65 -2.741 9.888 2.830 1.00 0.61 C ATOM 940 C ILE A 65 -1.887 9.076 3.799 1.00 0.56 C ATOM 941 O ILE A 65 -1.480 9.592 4.837 1.00 0.71 O ATOM 942 CB ILE A 65 -1.964 10.443 1.615 1.00 0.60 C ATOM 943 CG1 ILE A 65 -2.840 11.264 0.648 1.00 0.99 C ATOM 944 CG2 ILE A 65 -1.230 9.348 0.832 1.00 0.48 C ATOM 945 CD1 ILE A 65 -3.962 10.480 -0.032 1.00 1.31 C ATOM 0 H ILE A 65 -2.615 11.564 4.070 1.00 0.74 H new ATOM 0 HA ILE A 65 -3.500 9.227 2.411 1.00 0.61 H new ATOM 0 HB ILE A 65 -1.227 11.116 2.053 1.00 0.60 H new ATOM 0 HG12 ILE A 65 -3.280 12.096 1.198 1.00 0.99 H new ATOM 0 HG13 ILE A 65 -2.200 11.694 -0.122 1.00 0.99 H new ATOM 0 HG21 ILE A 65 -0.702 9.795 -0.010 1.00 0.48 H new ATOM 0 HG22 ILE A 65 -0.515 8.850 1.486 1.00 0.48 H new ATOM 0 HG23 ILE A 65 -1.951 8.619 0.462 1.00 0.48 H new ATOM 0 HD11 ILE A 65 -4.521 11.143 -0.692 1.00 1.31 H new ATOM 0 HD12 ILE A 65 -3.534 9.664 -0.615 1.00 1.31 H new ATOM 0 HD13 ILE A 65 -4.632 10.072 0.725 1.00 1.31 H new ATOM 957 N ILE A 66 -1.617 7.807 3.498 1.00 0.43 N ATOM 958 CA ILE A 66 -0.774 6.964 4.326 1.00 0.43 C ATOM 959 C ILE A 66 0.472 6.657 3.510 1.00 0.44 C ATOM 960 O ILE A 66 0.379 6.225 2.362 1.00 0.51 O ATOM 961 CB ILE A 66 -1.485 5.674 4.761 1.00 0.52 C ATOM 962 CG1 ILE A 66 -2.952 5.853 5.207 1.00 0.58 C ATOM 963 CG2 ILE A 66 -0.682 4.980 5.871 1.00 0.56 C ATOM 964 CD1 ILE A 66 -3.137 6.708 6.460 1.00 0.57 C ATOM 0 H ILE A 66 -1.981 7.338 2.668 1.00 0.43 H new ATOM 0 HA ILE A 66 -0.522 7.482 5.251 1.00 0.43 H new ATOM 0 HB ILE A 66 -1.529 5.054 3.865 1.00 0.52 H new ATOM 0 HG12 ILE A 66 -3.514 6.304 4.389 1.00 0.58 H new ATOM 0 HG13 ILE A 66 -3.386 4.869 5.387 1.00 0.58 H new ATOM 0 HG21 ILE A 66 -1.194 4.066 6.173 1.00 0.56 H new ATOM 0 HG22 ILE A 66 0.313 4.733 5.500 1.00 0.56 H new ATOM 0 HG23 ILE A 66 -0.595 5.647 6.728 1.00 0.56 H new ATOM 0 HD11 ILE A 66 -4.198 6.779 6.699 1.00 0.57 H new ATOM 0 HD12 ILE A 66 -2.607 6.249 7.295 1.00 0.57 H new ATOM 0 HD13 ILE A 66 -2.738 7.706 6.281 1.00 0.57 H new ATOM 976 N HIS A 67 1.640 6.880 4.101 1.00 0.45 N ATOM 977 CA HIS A 67 2.919 6.647 3.453 1.00 0.54 C ATOM 978 C HIS A 67 3.583 5.484 4.173 1.00 0.51 C ATOM 979 O HIS A 67 4.010 5.604 5.318 1.00 0.76 O ATOM 980 CB HIS A 67 3.775 7.924 3.478 1.00 0.62 C ATOM 981 CG HIS A 67 3.530 8.860 2.313 1.00 1.09 C ATOM 982 ND1 HIS A 67 4.357 9.890 1.916 1.00 1.83 N ATOM 983 CD2 HIS A 67 2.514 8.780 1.395 1.00 1.64 C ATOM 984 CE1 HIS A 67 3.841 10.418 0.792 1.00 2.38 C ATOM 985 NE2 HIS A 67 2.725 9.767 0.433 1.00 2.35 N ATOM 0 H HIS A 67 1.723 7.232 5.055 1.00 0.45 H new ATOM 0 HA HIS A 67 2.792 6.393 2.401 1.00 0.54 H new ATOM 0 HB2 HIS A 67 3.580 8.460 4.407 1.00 0.62 H new ATOM 0 HB3 HIS A 67 4.828 7.642 3.487 1.00 0.62 H new ATOM 0 HD2 HIS A 67 1.695 8.076 1.414 1.00 1.64 H new ATOM 0 HE1 HIS A 67 4.267 11.251 0.253 1.00 2.38 H new ATOM 0 HE2 HIS A 67 2.144 9.957 -0.384 1.00 2.35 H new ATOM 993 N ALA A 68 3.645 4.338 3.501 1.00 0.36 N ATOM 994 CA ALA A 68 4.259 3.145 4.040 1.00 0.38 C ATOM 995 C ALA A 68 5.596 2.934 3.348 1.00 0.41 C ATOM 996 O ALA A 68 5.793 3.340 2.199 1.00 0.50 O ATOM 997 CB ALA A 68 3.326 1.954 3.835 1.00 0.44 C ATOM 0 H ALA A 68 3.266 4.218 2.562 1.00 0.36 H new ATOM 0 HA ALA A 68 4.433 3.249 5.111 1.00 0.38 H new ATOM 0 HB1 ALA A 68 3.789 1.055 4.241 1.00 0.44 H new ATOM 0 HB2 ALA A 68 2.382 2.139 4.347 1.00 0.44 H new ATOM 0 HB3 ALA A 68 3.140 1.817 2.770 1.00 0.44 H new ATOM 1003 N VAL A 69 6.517 2.279 4.048 1.00 0.50 N ATOM 1004 CA VAL A 69 7.830 2.014 3.548 1.00 0.61 C ATOM 1005 C VAL A 69 7.890 0.530 3.239 1.00 0.57 C ATOM 1006 O VAL A 69 7.909 -0.297 4.146 1.00 0.77 O ATOM 1007 CB VAL A 69 8.826 2.482 4.610 1.00 0.83 C ATOM 1008 CG1 VAL A 69 10.233 2.134 4.148 1.00 1.72 C ATOM 1009 CG2 VAL A 69 8.620 3.985 4.831 1.00 1.58 C ATOM 0 H VAL A 69 6.354 1.919 4.989 1.00 0.50 H new ATOM 0 HA VAL A 69 8.079 2.546 2.630 1.00 0.61 H new ATOM 0 HB VAL A 69 8.670 1.983 5.566 1.00 0.83 H new ATOM 0 HG11 VAL A 69 10.954 2.463 4.897 1.00 1.72 H new ATOM 0 HG12 VAL A 69 10.316 1.055 4.014 1.00 1.72 H new ATOM 0 HG13 VAL A 69 10.439 2.634 3.202 1.00 1.72 H new ATOM 0 HG21 VAL A 69 9.321 4.341 5.586 1.00 1.58 H new ATOM 0 HG22 VAL A 69 8.793 4.517 3.896 1.00 1.58 H new ATOM 0 HG23 VAL A 69 7.600 4.167 5.169 1.00 1.58 H new ATOM 1019 N GLY A 70 7.869 0.196 1.950 1.00 0.69 N ATOM 1020 CA GLY A 70 7.988 -1.185 1.536 1.00 0.81 C ATOM 1021 C GLY A 70 9.455 -1.599 1.606 1.00 0.96 C ATOM 1022 O GLY A 70 10.336 -0.761 1.399 1.00 1.26 O ATOM 0 H GLY A 70 7.771 0.864 1.185 1.00 0.69 H new ATOM 0 HA2 GLY A 70 7.385 -1.825 2.180 1.00 0.81 H new ATOM 0 HA3 GLY A 70 7.610 -1.308 0.521 1.00 0.81 H new ATOM 1026 N PRO A 71 9.730 -2.882 1.864 1.00 1.36 N ATOM 1027 CA PRO A 71 11.052 -3.446 1.677 1.00 1.65 C ATOM 1028 C PRO A 71 11.370 -3.512 0.186 1.00 1.08 C ATOM 1029 O PRO A 71 10.580 -3.086 -0.654 1.00 1.08 O ATOM 1030 CB PRO A 71 10.983 -4.839 2.301 1.00 2.40 C ATOM 1031 CG PRO A 71 9.512 -5.231 2.153 1.00 2.44 C ATOM 1032 CD PRO A 71 8.767 -3.900 2.247 1.00 1.88 C ATOM 0 HA PRO A 71 11.840 -2.851 2.139 1.00 1.65 H new ATOM 0 HB2 PRO A 71 11.638 -5.541 1.786 1.00 2.40 H new ATOM 0 HB3 PRO A 71 11.290 -4.825 3.347 1.00 2.40 H new ATOM 0 HG2 PRO A 71 9.325 -5.728 1.201 1.00 2.44 H new ATOM 0 HG3 PRO A 71 9.201 -5.920 2.939 1.00 2.44 H new ATOM 0 HD2 PRO A 71 7.901 -3.889 1.585 1.00 1.88 H new ATOM 0 HD3 PRO A 71 8.398 -3.729 3.258 1.00 1.88 H new ATOM 1040 N ASN A 72 12.524 -4.074 -0.165 1.00 1.17 N ATOM 1041 CA ASN A 72 12.913 -4.236 -1.548 1.00 0.87 C ATOM 1042 C ASN A 72 13.612 -5.587 -1.609 1.00 0.85 C ATOM 1043 O ASN A 72 14.810 -5.650 -1.352 1.00 0.95 O ATOM 1044 CB ASN A 72 13.800 -3.041 -1.937 1.00 1.12 C ATOM 1045 CG ASN A 72 13.829 -2.840 -3.441 1.00 2.03 C ATOM 1046 OD1 ASN A 72 14.162 -3.745 -4.186 1.00 3.83 O ATOM 1047 ND2 ASN A 72 13.458 -1.664 -3.926 1.00 2.29 N ATOM 0 H ASN A 72 13.208 -4.426 0.505 1.00 1.17 H new ATOM 0 HA ASN A 72 12.089 -4.238 -2.261 1.00 0.87 H new ATOM 0 HB2 ASN A 72 13.428 -2.137 -1.455 1.00 1.12 H new ATOM 0 HB3 ASN A 72 14.814 -3.204 -1.570 1.00 1.12 H new ATOM 0 HD21 ASN A 72 13.449 -1.508 -4.934 1.00 2.29 H new ATOM 0 HD22 ASN A 72 13.182 -0.915 -3.291 1.00 2.29 H new ATOM 1054 N PHE A 73 12.859 -6.671 -1.846 1.00 0.82 N ATOM 1055 CA PHE A 73 13.369 -8.048 -1.816 1.00 0.96 C ATOM 1056 C PHE A 73 14.560 -8.208 -2.754 1.00 1.03 C ATOM 1057 O PHE A 73 15.419 -9.048 -2.514 1.00 1.23 O ATOM 1058 CB PHE A 73 12.272 -9.061 -2.160 1.00 1.03 C ATOM 1059 CG PHE A 73 11.550 -9.686 -0.982 1.00 2.00 C ATOM 1060 CD1 PHE A 73 11.596 -11.081 -0.803 1.00 2.70 C ATOM 1061 CD2 PHE A 73 10.779 -8.896 -0.108 1.00 3.79 C ATOM 1062 CE1 PHE A 73 10.875 -11.681 0.240 1.00 3.75 C ATOM 1063 CE2 PHE A 73 10.057 -9.500 0.938 1.00 5.06 C ATOM 1064 CZ PHE A 73 10.109 -10.894 1.115 1.00 4.69 C ATOM 0 H PHE A 73 11.865 -6.614 -2.067 1.00 0.82 H new ATOM 0 HA PHE A 73 13.702 -8.251 -0.798 1.00 0.96 H new ATOM 0 HB2 PHE A 73 11.534 -8.567 -2.792 1.00 1.03 H new ATOM 0 HB3 PHE A 73 12.716 -9.860 -2.754 1.00 1.03 H new ATOM 0 HD1 PHE A 73 12.187 -11.691 -1.470 1.00 2.70 H new ATOM 0 HD2 PHE A 73 10.742 -7.825 -0.241 1.00 3.79 H new ATOM 0 HE1 PHE A 73 10.909 -12.753 0.371 1.00 3.75 H new ATOM 0 HE2 PHE A 73 9.463 -8.893 1.605 1.00 5.06 H new ATOM 0 HZ PHE A 73 9.561 -11.358 1.922 1.00 4.69 H new ATOM 1074 N ASN A 74 14.666 -7.365 -3.781 1.00 0.96 N ATOM 1075 CA ASN A 74 15.824 -7.343 -4.658 1.00 1.11 C ATOM 1076 C ASN A 74 17.137 -7.327 -3.878 1.00 1.41 C ATOM 1077 O ASN A 74 18.101 -7.973 -4.283 1.00 1.77 O ATOM 1078 CB ASN A 74 15.730 -6.113 -5.560 1.00 1.06 C ATOM 1079 CG ASN A 74 16.898 -6.007 -6.530 1.00 1.42 C ATOM 1080 OD1 ASN A 74 17.803 -5.204 -6.334 1.00 2.23 O ATOM 1081 ND2 ASN A 74 16.898 -6.795 -7.596 1.00 2.45 N ATOM 0 H ASN A 74 13.949 -6.681 -4.024 1.00 0.96 H new ATOM 0 HA ASN A 74 15.823 -8.255 -5.255 1.00 1.11 H new ATOM 0 HB2 ASN A 74 14.797 -6.150 -6.123 1.00 1.06 H new ATOM 0 HB3 ASN A 74 15.693 -5.216 -4.942 1.00 1.06 H new ATOM 0 HD21 ASN A 74 17.661 -6.740 -8.271 1.00 2.45 H new ATOM 0 HD22 ASN A 74 16.135 -7.457 -7.741 1.00 2.45 H new ATOM 1088 N LYS A 75 17.175 -6.585 -2.768 1.00 1.32 N ATOM 1089 CA LYS A 75 18.338 -6.454 -1.901 1.00 1.54 C ATOM 1090 C LYS A 75 17.916 -6.625 -0.441 1.00 1.40 C ATOM 1091 O LYS A 75 18.490 -6.007 0.451 1.00 1.42 O ATOM 1092 CB LYS A 75 18.974 -5.086 -2.167 1.00 1.70 C ATOM 1093 CG LYS A 75 19.774 -5.105 -3.478 1.00 1.99 C ATOM 1094 CD LYS A 75 19.810 -3.742 -4.166 1.00 1.92 C ATOM 1095 CE LYS A 75 20.558 -2.714 -3.316 1.00 2.61 C ATOM 1096 NZ LYS A 75 20.678 -1.423 -4.026 1.00 3.34 N ATOM 0 H LYS A 75 16.373 -6.046 -2.443 1.00 1.32 H new ATOM 0 HA LYS A 75 19.076 -7.228 -2.109 1.00 1.54 H new ATOM 0 HB2 LYS A 75 18.198 -4.323 -2.220 1.00 1.70 H new ATOM 0 HB3 LYS A 75 19.630 -4.817 -1.339 1.00 1.70 H new ATOM 0 HG2 LYS A 75 20.794 -5.431 -3.272 1.00 1.99 H new ATOM 0 HG3 LYS A 75 19.336 -5.838 -4.156 1.00 1.99 H new ATOM 0 HD2 LYS A 75 20.294 -3.835 -5.138 1.00 1.92 H new ATOM 0 HD3 LYS A 75 18.792 -3.396 -4.348 1.00 1.92 H new ATOM 0 HE2 LYS A 75 20.033 -2.566 -2.372 1.00 2.61 H new ATOM 0 HE3 LYS A 75 21.551 -3.092 -3.072 1.00 2.61 H new ATOM 0 HZ1 LYS A 75 21.189 -0.744 -3.427 1.00 3.34 H new ATOM 0 HZ2 LYS A 75 21.200 -1.563 -4.915 1.00 3.34 H new ATOM 0 HZ3 LYS A 75 19.729 -1.053 -4.236 1.00 3.34 H new ATOM 1110 N VAL A 76 16.939 -7.493 -0.197 1.00 1.33 N ATOM 1111 CA VAL A 76 16.494 -7.868 1.143 1.00 1.38 C ATOM 1112 C VAL A 76 16.378 -9.390 1.197 1.00 1.35 C ATOM 1113 O VAL A 76 15.927 -10.011 0.241 1.00 1.40 O ATOM 1114 CB VAL A 76 15.178 -7.140 1.472 1.00 1.51 C ATOM 1115 CG1 VAL A 76 14.311 -7.846 2.507 1.00 1.37 C ATOM 1116 CG2 VAL A 76 15.473 -5.732 1.985 1.00 1.51 C ATOM 0 H VAL A 76 16.423 -7.965 -0.940 1.00 1.33 H new ATOM 0 HA VAL A 76 17.210 -7.563 1.907 1.00 1.38 H new ATOM 0 HB VAL A 76 14.619 -7.123 0.536 1.00 1.51 H new ATOM 0 HG11 VAL A 76 13.405 -7.266 2.679 1.00 1.37 H new ATOM 0 HG12 VAL A 76 14.043 -8.838 2.142 1.00 1.37 H new ATOM 0 HG13 VAL A 76 14.864 -7.941 3.441 1.00 1.37 H new ATOM 0 HG21 VAL A 76 14.536 -5.225 2.215 1.00 1.51 H new ATOM 0 HG22 VAL A 76 16.083 -5.793 2.886 1.00 1.51 H new ATOM 0 HG23 VAL A 76 16.011 -5.171 1.220 1.00 1.51 H new ATOM 1126 N SER A 77 16.803 -10.007 2.303 1.00 1.30 N ATOM 1127 CA SER A 77 16.692 -11.442 2.475 1.00 1.31 C ATOM 1128 C SER A 77 15.257 -11.758 2.869 1.00 1.30 C ATOM 1129 O SER A 77 14.598 -10.909 3.462 1.00 1.23 O ATOM 1130 CB SER A 77 17.655 -11.881 3.580 1.00 1.28 C ATOM 1131 OG SER A 77 17.643 -13.286 3.720 1.00 3.11 O ATOM 0 H SER A 77 17.229 -9.523 3.093 1.00 1.30 H new ATOM 0 HA SER A 77 16.945 -11.970 1.556 1.00 1.31 H new ATOM 0 HB2 SER A 77 18.664 -11.542 3.346 1.00 1.28 H new ATOM 0 HB3 SER A 77 17.372 -11.414 4.523 1.00 1.28 H new ATOM 0 HG SER A 77 18.266 -13.549 4.430 1.00 3.11 H new ATOM 1137 N GLU A 78 14.804 -12.992 2.644 1.00 1.37 N ATOM 1138 CA GLU A 78 13.487 -13.478 3.052 1.00 1.42 C ATOM 1139 C GLU A 78 13.190 -13.122 4.509 1.00 1.21 C ATOM 1140 O GLU A 78 12.065 -12.790 4.853 1.00 1.09 O ATOM 1141 CB GLU A 78 13.432 -15.002 2.852 1.00 1.60 C ATOM 1142 CG GLU A 78 13.050 -15.392 1.418 1.00 1.81 C ATOM 1143 CD GLU A 78 11.533 -15.466 1.229 1.00 1.80 C ATOM 1144 OE1 GLU A 78 11.087 -16.381 0.502 1.00 2.68 O ATOM 1145 OE2 GLU A 78 10.844 -14.603 1.814 1.00 2.82 O ATOM 0 H GLU A 78 15.358 -13.699 2.160 1.00 1.37 H new ATOM 0 HA GLU A 78 12.727 -12.996 2.436 1.00 1.42 H new ATOM 0 HB2 GLU A 78 14.403 -15.433 3.096 1.00 1.60 H new ATOM 0 HB3 GLU A 78 12.710 -15.431 3.547 1.00 1.60 H new ATOM 0 HG2 GLU A 78 13.467 -14.665 0.721 1.00 1.81 H new ATOM 0 HG3 GLU A 78 13.493 -16.358 1.175 1.00 1.81 H new ATOM 1152 N VAL A 79 14.193 -13.173 5.386 1.00 1.20 N ATOM 1153 CA VAL A 79 13.954 -12.957 6.810 1.00 1.14 C ATOM 1154 C VAL A 79 13.627 -11.488 7.070 1.00 1.00 C ATOM 1155 O VAL A 79 12.785 -11.148 7.902 1.00 0.93 O ATOM 1156 CB VAL A 79 15.185 -13.402 7.618 1.00 1.26 C ATOM 1157 CG1 VAL A 79 14.942 -13.276 9.127 1.00 1.38 C ATOM 1158 CG2 VAL A 79 15.545 -14.860 7.307 1.00 1.27 C ATOM 0 H VAL A 79 15.165 -13.359 5.139 1.00 1.20 H new ATOM 0 HA VAL A 79 13.100 -13.555 7.129 1.00 1.14 H new ATOM 0 HB VAL A 79 16.005 -12.746 7.328 1.00 1.26 H new ATOM 0 HG11 VAL A 79 15.832 -13.599 9.667 1.00 1.38 H new ATOM 0 HG12 VAL A 79 14.724 -12.237 9.375 1.00 1.38 H new ATOM 0 HG13 VAL A 79 14.097 -13.902 9.413 1.00 1.38 H new ATOM 0 HG21 VAL A 79 16.418 -15.151 7.890 1.00 1.27 H new ATOM 0 HG22 VAL A 79 14.705 -15.505 7.564 1.00 1.27 H new ATOM 0 HG23 VAL A 79 15.768 -14.961 6.245 1.00 1.27 H new ATOM 1168 N GLU A 80 14.348 -10.592 6.403 1.00 0.98 N ATOM 1169 CA GLU A 80 14.238 -9.177 6.698 1.00 0.87 C ATOM 1170 C GLU A 80 13.063 -8.574 5.939 1.00 0.70 C ATOM 1171 O GLU A 80 12.433 -7.644 6.423 1.00 0.56 O ATOM 1172 CB GLU A 80 15.580 -8.502 6.416 1.00 1.03 C ATOM 1173 CG GLU A 80 15.602 -7.070 6.950 1.00 1.05 C ATOM 1174 CD GLU A 80 17.038 -6.556 6.995 1.00 1.68 C ATOM 1175 OE1 GLU A 80 17.689 -6.805 8.034 1.00 2.37 O ATOM 1176 OE2 GLU A 80 17.469 -5.966 5.981 1.00 3.03 O ATOM 0 H GLU A 80 15.009 -10.823 5.661 1.00 0.98 H new ATOM 0 HA GLU A 80 14.021 -9.012 7.753 1.00 0.87 H new ATOM 0 HB2 GLU A 80 16.383 -9.077 6.877 1.00 1.03 H new ATOM 0 HB3 GLU A 80 15.768 -8.495 5.342 1.00 1.03 H new ATOM 0 HG2 GLU A 80 14.995 -6.426 6.314 1.00 1.05 H new ATOM 0 HG3 GLU A 80 15.163 -7.037 7.947 1.00 1.05 H new ATOM 1183 N GLY A 81 12.727 -9.133 4.779 1.00 0.79 N ATOM 1184 CA GLY A 81 11.576 -8.745 3.993 1.00 0.72 C ATOM 1185 C GLY A 81 10.300 -9.363 4.526 1.00 0.67 C ATOM 1186 O GLY A 81 9.252 -8.767 4.341 1.00 0.60 O ATOM 0 H GLY A 81 13.267 -9.888 4.355 1.00 0.79 H new ATOM 0 HA2 GLY A 81 11.483 -7.659 3.995 1.00 0.72 H new ATOM 0 HA3 GLY A 81 11.723 -9.050 2.957 1.00 0.72 H new ATOM 1190 N ASP A 82 10.353 -10.515 5.197 1.00 0.72 N ATOM 1191 CA ASP A 82 9.195 -11.025 5.919 1.00 0.70 C ATOM 1192 C ASP A 82 8.844 -10.024 7.008 1.00 0.60 C ATOM 1193 O ASP A 82 7.721 -9.529 7.068 1.00 0.54 O ATOM 1194 CB ASP A 82 9.491 -12.399 6.528 1.00 0.84 C ATOM 1195 CG ASP A 82 8.432 -12.787 7.561 1.00 0.99 C ATOM 1196 OD1 ASP A 82 7.361 -13.270 7.136 1.00 1.83 O ATOM 1197 OD2 ASP A 82 8.713 -12.584 8.763 1.00 1.64 O ATOM 0 H ASP A 82 11.182 -11.107 5.253 1.00 0.72 H new ATOM 0 HA ASP A 82 8.356 -11.149 5.234 1.00 0.70 H new ATOM 0 HB2 ASP A 82 9.525 -13.150 5.739 1.00 0.84 H new ATOM 0 HB3 ASP A 82 10.474 -12.387 6.998 1.00 0.84 H new ATOM 1202 N LYS A 83 9.833 -9.665 7.828 1.00 0.61 N ATOM 1203 CA LYS A 83 9.613 -8.712 8.901 1.00 0.51 C ATOM 1204 C LYS A 83 9.128 -7.402 8.333 1.00 0.47 C ATOM 1205 O LYS A 83 8.089 -6.932 8.753 1.00 0.49 O ATOM 1206 CB LYS A 83 10.869 -8.497 9.743 1.00 0.53 C ATOM 1207 CG LYS A 83 10.994 -9.581 10.818 1.00 0.64 C ATOM 1208 CD LYS A 83 12.146 -9.236 11.766 1.00 1.25 C ATOM 1209 CE LYS A 83 13.489 -9.456 11.060 1.00 2.21 C ATOM 1210 NZ LYS A 83 14.551 -8.591 11.617 1.00 3.01 N ATOM 0 H LYS A 83 10.787 -10.021 7.765 1.00 0.61 H new ATOM 0 HA LYS A 83 8.850 -9.125 9.561 1.00 0.51 H new ATOM 0 HB2 LYS A 83 11.750 -8.512 9.101 1.00 0.53 H new ATOM 0 HB3 LYS A 83 10.834 -7.514 10.213 1.00 0.53 H new ATOM 0 HG2 LYS A 83 10.062 -9.662 11.377 1.00 0.64 H new ATOM 0 HG3 LYS A 83 11.171 -10.550 10.352 1.00 0.64 H new ATOM 0 HD2 LYS A 83 12.062 -8.199 12.091 1.00 1.25 H new ATOM 0 HD3 LYS A 83 12.090 -9.856 12.661 1.00 1.25 H new ATOM 0 HE2 LYS A 83 13.783 -10.501 11.157 1.00 2.21 H new ATOM 0 HE3 LYS A 83 13.377 -9.254 9.995 1.00 2.21 H new ATOM 0 HZ1 LYS A 83 15.443 -8.769 11.114 1.00 3.01 H new ATOM 0 HZ2 LYS A 83 14.282 -7.593 11.502 1.00 3.01 H new ATOM 0 HZ3 LYS A 83 14.676 -8.802 12.628 1.00 3.01 H new ATOM 1224 N GLN A 84 9.835 -6.815 7.376 1.00 0.46 N ATOM 1225 CA GLN A 84 9.487 -5.506 6.850 1.00 0.45 C ATOM 1226 C GLN A 84 8.118 -5.557 6.175 1.00 0.44 C ATOM 1227 O GLN A 84 7.364 -4.592 6.247 1.00 0.46 O ATOM 1228 CB GLN A 84 10.553 -5.047 5.861 1.00 0.53 C ATOM 1229 CG GLN A 84 11.833 -4.588 6.568 1.00 1.59 C ATOM 1230 CD GLN A 84 11.742 -3.135 7.027 1.00 2.35 C ATOM 1231 OE1 GLN A 84 11.685 -2.231 6.202 1.00 2.21 O ATOM 1232 NE2 GLN A 84 11.743 -2.878 8.326 1.00 3.50 N ATOM 0 H GLN A 84 10.661 -7.232 6.946 1.00 0.46 H new ATOM 0 HA GLN A 84 9.439 -4.792 7.672 1.00 0.45 H new ATOM 0 HB2 GLN A 84 10.789 -5.863 5.178 1.00 0.53 H new ATOM 0 HB3 GLN A 84 10.159 -4.229 5.257 1.00 0.53 H new ATOM 0 HG2 GLN A 84 12.022 -5.229 7.429 1.00 1.59 H new ATOM 0 HG3 GLN A 84 12.681 -4.703 5.893 1.00 1.59 H new ATOM 0 HE21 GLN A 84 11.791 -3.644 8.997 1.00 3.50 H new ATOM 0 HE22 GLN A 84 11.696 -1.914 8.655 1.00 3.50 H new ATOM 1241 N LEU A 85 7.771 -6.672 5.526 1.00 0.46 N ATOM 1242 CA LEU A 85 6.447 -6.792 4.919 1.00 0.46 C ATOM 1243 C LEU A 85 5.396 -6.785 6.029 1.00 0.43 C ATOM 1244 O LEU A 85 4.358 -6.136 5.909 1.00 0.44 O ATOM 1245 CB LEU A 85 6.398 -8.044 4.022 1.00 0.51 C ATOM 1246 CG LEU A 85 5.135 -8.243 3.164 1.00 0.55 C ATOM 1247 CD1 LEU A 85 4.751 -6.945 2.452 1.00 0.79 C ATOM 1248 CD2 LEU A 85 5.424 -9.307 2.100 1.00 0.85 C ATOM 0 H LEU A 85 8.374 -7.486 5.410 1.00 0.46 H new ATOM 0 HA LEU A 85 6.229 -5.946 4.267 1.00 0.46 H new ATOM 0 HB2 LEU A 85 7.259 -8.016 3.355 1.00 0.51 H new ATOM 0 HB3 LEU A 85 6.516 -8.921 4.658 1.00 0.51 H new ATOM 0 HG LEU A 85 4.316 -8.549 3.815 1.00 0.55 H new ATOM 0 HD11 LEU A 85 3.856 -7.110 1.852 1.00 0.79 H new ATOM 0 HD12 LEU A 85 4.554 -6.169 3.192 1.00 0.79 H new ATOM 0 HD13 LEU A 85 5.569 -6.630 1.804 1.00 0.79 H new ATOM 0 HD21 LEU A 85 4.537 -9.457 1.485 1.00 0.85 H new ATOM 0 HD22 LEU A 85 6.250 -8.977 1.470 1.00 0.85 H new ATOM 0 HD23 LEU A 85 5.691 -10.245 2.587 1.00 0.85 H new ATOM 1260 N ALA A 86 5.690 -7.446 7.148 1.00 0.40 N ATOM 1261 CA ALA A 86 4.811 -7.491 8.302 1.00 0.38 C ATOM 1262 C ALA A 86 4.862 -6.192 9.105 1.00 0.33 C ATOM 1263 O ALA A 86 3.933 -5.920 9.848 1.00 0.34 O ATOM 1264 CB ALA A 86 5.210 -8.669 9.191 1.00 0.41 C ATOM 0 H ALA A 86 6.556 -7.969 7.274 1.00 0.40 H new ATOM 0 HA ALA A 86 3.788 -7.617 7.947 1.00 0.38 H new ATOM 0 HB1 ALA A 86 4.553 -8.708 10.060 1.00 0.41 H new ATOM 0 HB2 ALA A 86 5.121 -9.597 8.627 1.00 0.41 H new ATOM 0 HB3 ALA A 86 6.241 -8.543 9.521 1.00 0.41 H new ATOM 1270 N GLU A 87 5.917 -5.391 8.985 1.00 0.36 N ATOM 1271 CA GLU A 87 6.063 -4.103 9.648 1.00 0.38 C ATOM 1272 C GLU A 87 5.190 -3.090 8.920 1.00 0.38 C ATOM 1273 O GLU A 87 4.503 -2.280 9.537 1.00 0.39 O ATOM 1274 CB GLU A 87 7.528 -3.659 9.642 1.00 0.42 C ATOM 1275 CG GLU A 87 8.330 -4.346 10.751 1.00 0.54 C ATOM 1276 CD GLU A 87 9.774 -3.844 10.768 1.00 1.22 C ATOM 1277 OE1 GLU A 87 10.663 -4.602 10.313 1.00 2.55 O ATOM 1278 OE2 GLU A 87 9.979 -2.690 11.204 1.00 1.58 O ATOM 0 H GLU A 87 6.720 -5.631 8.403 1.00 0.36 H new ATOM 0 HA GLU A 87 5.748 -4.182 10.689 1.00 0.38 H new ATOM 0 HB2 GLU A 87 7.974 -3.888 8.674 1.00 0.42 H new ATOM 0 HB3 GLU A 87 7.582 -2.578 9.770 1.00 0.42 H new ATOM 0 HG2 GLU A 87 7.862 -4.154 11.717 1.00 0.54 H new ATOM 0 HG3 GLU A 87 8.317 -5.425 10.600 1.00 0.54 H new ATOM 1285 N ALA A 88 5.153 -3.180 7.591 1.00 0.40 N ATOM 1286 CA ALA A 88 4.267 -2.341 6.810 1.00 0.42 C ATOM 1287 C ALA A 88 2.840 -2.704 7.202 1.00 0.37 C ATOM 1288 O ALA A 88 2.046 -1.852 7.583 1.00 0.38 O ATOM 1289 CB ALA A 88 4.527 -2.551 5.315 1.00 0.48 C ATOM 0 H ALA A 88 5.725 -3.823 7.043 1.00 0.40 H new ATOM 0 HA ALA A 88 4.439 -1.283 7.009 1.00 0.42 H new ATOM 0 HB1 ALA A 88 3.856 -1.916 4.736 1.00 0.48 H new ATOM 0 HB2 ALA A 88 5.560 -2.291 5.085 1.00 0.48 H new ATOM 0 HB3 ALA A 88 4.350 -3.595 5.058 1.00 0.48 H new ATOM 1295 N TYR A 89 2.521 -3.992 7.135 1.00 0.36 N ATOM 1296 CA TYR A 89 1.211 -4.524 7.429 1.00 0.38 C ATOM 1297 C TYR A 89 0.811 -4.352 8.885 1.00 0.35 C ATOM 1298 O TYR A 89 -0.378 -4.222 9.144 1.00 0.37 O ATOM 1299 CB TYR A 89 1.206 -5.988 6.985 1.00 0.42 C ATOM 1300 CG TYR A 89 1.259 -6.206 5.479 1.00 0.48 C ATOM 1301 CD1 TYR A 89 1.062 -5.147 4.567 1.00 1.53 C ATOM 1302 CD2 TYR A 89 1.539 -7.495 4.990 1.00 1.88 C ATOM 1303 CE1 TYR A 89 1.137 -5.370 3.184 1.00 1.53 C ATOM 1304 CE2 TYR A 89 1.611 -7.724 3.606 1.00 1.96 C ATOM 1305 CZ TYR A 89 1.397 -6.665 2.699 1.00 0.71 C ATOM 1306 OH TYR A 89 1.428 -6.881 1.357 1.00 0.83 O ATOM 0 H TYR A 89 3.193 -4.710 6.866 1.00 0.36 H new ATOM 0 HA TYR A 89 0.454 -3.963 6.881 1.00 0.38 H new ATOM 0 HB2 TYR A 89 2.059 -6.492 7.440 1.00 0.42 H new ATOM 0 HB3 TYR A 89 0.307 -6.467 7.374 1.00 0.42 H new ATOM 0 HD1 TYR A 89 0.851 -4.155 4.938 1.00 1.53 H new ATOM 0 HD2 TYR A 89 1.699 -8.310 5.680 1.00 1.88 H new ATOM 0 HE1 TYR A 89 0.996 -4.551 2.494 1.00 1.53 H new ATOM 0 HE2 TYR A 89 1.831 -8.714 3.235 1.00 1.96 H new ATOM 0 HH TYR A 89 0.920 -7.692 1.144 1.00 0.83 H new ATOM 1316 N GLU A 90 1.735 -4.316 9.843 1.00 0.34 N ATOM 1317 CA GLU A 90 1.337 -4.126 11.236 1.00 0.36 C ATOM 1318 C GLU A 90 1.110 -2.653 11.503 1.00 0.34 C ATOM 1319 O GLU A 90 0.198 -2.304 12.244 1.00 0.36 O ATOM 1320 CB GLU A 90 2.291 -4.781 12.248 1.00 0.54 C ATOM 1321 CG GLU A 90 3.647 -4.083 12.354 1.00 1.97 C ATOM 1322 CD GLU A 90 3.703 -2.982 13.415 1.00 2.95 C ATOM 1323 OE1 GLU A 90 3.753 -1.790 13.036 1.00 4.38 O ATOM 1324 OE2 GLU A 90 3.684 -3.343 14.615 1.00 2.81 O ATOM 0 H GLU A 90 2.738 -4.413 9.688 1.00 0.34 H new ATOM 0 HA GLU A 90 0.395 -4.654 11.386 1.00 0.36 H new ATOM 0 HB2 GLU A 90 1.817 -4.787 13.230 1.00 0.54 H new ATOM 0 HB3 GLU A 90 2.449 -5.822 11.964 1.00 0.54 H new ATOM 0 HG2 GLU A 90 4.410 -4.828 12.579 1.00 1.97 H new ATOM 0 HG3 GLU A 90 3.898 -3.652 11.385 1.00 1.97 H new ATOM 1331 N SER A 91 1.879 -1.780 10.859 1.00 0.32 N ATOM 1332 CA SER A 91 1.647 -0.358 10.977 1.00 0.33 C ATOM 1333 C SER A 91 0.295 -0.042 10.352 1.00 0.33 C ATOM 1334 O SER A 91 -0.498 0.678 10.942 1.00 0.37 O ATOM 1335 CB SER A 91 2.787 0.421 10.322 1.00 0.38 C ATOM 1336 OG SER A 91 3.948 0.364 11.129 1.00 0.89 O ATOM 0 H SER A 91 2.661 -2.037 10.256 1.00 0.32 H new ATOM 0 HA SER A 91 1.626 -0.055 12.024 1.00 0.33 H new ATOM 0 HB2 SER A 91 3.000 0.007 9.336 1.00 0.38 H new ATOM 0 HB3 SER A 91 2.489 1.459 10.174 1.00 0.38 H new ATOM 0 HG SER A 91 3.857 -0.361 11.782 1.00 0.89 H new ATOM 1342 N ILE A 92 -0.012 -0.604 9.182 1.00 0.32 N ATOM 1343 CA ILE A 92 -1.273 -0.352 8.508 1.00 0.34 C ATOM 1344 C ILE A 92 -2.404 -0.932 9.351 1.00 0.35 C ATOM 1345 O ILE A 92 -3.411 -0.273 9.572 1.00 0.38 O ATOM 1346 CB ILE A 92 -1.210 -0.917 7.068 1.00 0.39 C ATOM 1347 CG1 ILE A 92 -0.782 0.163 6.053 1.00 0.48 C ATOM 1348 CG2 ILE A 92 -2.539 -1.517 6.602 1.00 0.46 C ATOM 1349 CD1 ILE A 92 0.642 -0.051 5.542 1.00 0.93 C ATOM 0 H ILE A 92 0.607 -1.242 8.682 1.00 0.32 H new ATOM 0 HA ILE A 92 -1.468 0.716 8.407 1.00 0.34 H new ATOM 0 HB ILE A 92 -0.465 -1.711 7.106 1.00 0.39 H new ATOM 0 HG12 ILE A 92 -1.472 0.159 5.210 1.00 0.48 H new ATOM 0 HG13 ILE A 92 -0.854 1.145 6.520 1.00 0.48 H new ATOM 0 HG21 ILE A 92 -2.431 -1.896 5.586 1.00 0.46 H new ATOM 0 HG22 ILE A 92 -2.822 -2.334 7.266 1.00 0.46 H new ATOM 0 HG23 ILE A 92 -3.312 -0.749 6.622 1.00 0.46 H new ATOM 0 HD11 ILE A 92 0.895 0.735 4.831 1.00 0.93 H new ATOM 0 HD12 ILE A 92 1.338 -0.020 6.380 1.00 0.93 H new ATOM 0 HD13 ILE A 92 0.710 -1.021 5.050 1.00 0.93 H new ATOM 1361 N ALA A 93 -2.260 -2.169 9.817 1.00 0.37 N ATOM 1362 CA ALA A 93 -3.348 -2.899 10.450 1.00 0.40 C ATOM 1363 C ALA A 93 -3.699 -2.244 11.781 1.00 0.40 C ATOM 1364 O ALA A 93 -4.868 -2.005 12.083 1.00 0.42 O ATOM 1365 CB ALA A 93 -2.966 -4.370 10.628 1.00 0.47 C ATOM 0 H ALA A 93 -1.385 -2.691 9.765 1.00 0.37 H new ATOM 0 HA ALA A 93 -4.231 -2.865 9.812 1.00 0.40 H new ATOM 0 HB1 ALA A 93 -3.789 -4.905 11.103 1.00 0.47 H new ATOM 0 HB2 ALA A 93 -2.760 -4.813 9.654 1.00 0.47 H new ATOM 0 HB3 ALA A 93 -2.077 -4.442 11.255 1.00 0.47 H new ATOM 1371 N LYS A 94 -2.691 -1.915 12.585 1.00 0.39 N ATOM 1372 CA LYS A 94 -2.926 -1.163 13.804 1.00 0.40 C ATOM 1373 C LYS A 94 -3.538 0.183 13.454 1.00 0.39 C ATOM 1374 O LYS A 94 -4.535 0.540 14.063 1.00 0.43 O ATOM 1375 CB LYS A 94 -1.644 -1.001 14.622 1.00 0.43 C ATOM 1376 CG LYS A 94 -1.169 -2.357 15.156 1.00 1.06 C ATOM 1377 CD LYS A 94 0.079 -2.157 16.015 1.00 1.57 C ATOM 1378 CE LYS A 94 0.901 -3.445 16.030 1.00 2.55 C ATOM 1379 NZ LYS A 94 2.215 -3.234 16.664 1.00 3.48 N ATOM 0 H LYS A 94 -1.715 -2.157 12.413 1.00 0.39 H new ATOM 0 HA LYS A 94 -3.625 -1.717 14.430 1.00 0.40 H new ATOM 0 HB2 LYS A 94 -0.865 -0.555 14.003 1.00 0.43 H new ATOM 0 HB3 LYS A 94 -1.821 -0.318 15.453 1.00 0.43 H new ATOM 0 HG2 LYS A 94 -1.958 -2.825 15.745 1.00 1.06 H new ATOM 0 HG3 LYS A 94 -0.949 -3.030 14.327 1.00 1.06 H new ATOM 0 HD2 LYS A 94 0.677 -1.336 15.620 1.00 1.57 H new ATOM 0 HD3 LYS A 94 -0.206 -1.883 17.031 1.00 1.57 H new ATOM 0 HE2 LYS A 94 0.356 -4.221 16.568 1.00 2.55 H new ATOM 0 HE3 LYS A 94 1.040 -3.802 15.010 1.00 2.55 H new ATOM 0 HZ1 LYS A 94 2.941 -3.117 15.928 1.00 3.48 H new ATOM 0 HZ2 LYS A 94 2.182 -2.380 17.256 1.00 3.48 H new ATOM 0 HZ3 LYS A 94 2.451 -4.056 17.255 1.00 3.48 H new ATOM 1393 N ILE A 95 -3.029 0.887 12.438 1.00 0.37 N ATOM 1394 CA ILE A 95 -3.564 2.198 12.063 1.00 0.42 C ATOM 1395 C ILE A 95 -5.040 2.084 11.689 1.00 0.44 C ATOM 1396 O ILE A 95 -5.817 2.995 11.950 1.00 0.51 O ATOM 1397 CB ILE A 95 -2.713 2.841 10.944 1.00 0.42 C ATOM 1398 CG1 ILE A 95 -1.436 3.430 11.576 1.00 0.67 C ATOM 1399 CG2 ILE A 95 -3.458 3.947 10.182 1.00 0.76 C ATOM 1400 CD1 ILE A 95 -0.376 3.827 10.538 1.00 0.66 C ATOM 0 H ILE A 95 -2.249 0.571 11.862 1.00 0.37 H new ATOM 0 HA ILE A 95 -3.503 2.866 12.922 1.00 0.42 H new ATOM 0 HB ILE A 95 -2.477 2.061 10.220 1.00 0.42 H new ATOM 0 HG12 ILE A 95 -1.702 4.306 12.168 1.00 0.67 H new ATOM 0 HG13 ILE A 95 -1.008 2.700 12.262 1.00 0.67 H new ATOM 0 HG21 ILE A 95 -2.808 4.359 9.410 1.00 0.76 H new ATOM 0 HG22 ILE A 95 -4.352 3.531 9.719 1.00 0.76 H new ATOM 0 HG23 ILE A 95 -3.743 4.738 10.876 1.00 0.76 H new ATOM 0 HD11 ILE A 95 0.497 4.234 11.047 1.00 0.66 H new ATOM 0 HD12 ILE A 95 -0.084 2.949 9.962 1.00 0.66 H new ATOM 0 HD13 ILE A 95 -0.788 4.580 9.866 1.00 0.66 H new ATOM 1412 N VAL A 96 -5.447 0.971 11.085 1.00 0.44 N ATOM 1413 CA VAL A 96 -6.815 0.732 10.662 1.00 0.50 C ATOM 1414 C VAL A 96 -7.714 0.621 11.883 1.00 0.56 C ATOM 1415 O VAL A 96 -8.844 1.102 11.868 1.00 0.60 O ATOM 1416 CB VAL A 96 -6.845 -0.515 9.758 1.00 0.54 C ATOM 1417 CG1 VAL A 96 -8.220 -1.188 9.657 1.00 0.69 C ATOM 1418 CG2 VAL A 96 -6.411 -0.109 8.350 1.00 0.55 C ATOM 0 H VAL A 96 -4.818 0.196 10.874 1.00 0.44 H new ATOM 0 HA VAL A 96 -7.200 1.565 10.073 1.00 0.50 H new ATOM 0 HB VAL A 96 -6.170 -1.240 10.214 1.00 0.54 H new ATOM 0 HG11 VAL A 96 -8.153 -2.057 9.002 1.00 0.69 H new ATOM 0 HG12 VAL A 96 -8.544 -1.505 10.648 1.00 0.69 H new ATOM 0 HG13 VAL A 96 -8.942 -0.481 9.249 1.00 0.69 H new ATOM 0 HG21 VAL A 96 -6.427 -0.982 7.698 1.00 0.55 H new ATOM 0 HG22 VAL A 96 -7.095 0.646 7.962 1.00 0.55 H new ATOM 0 HG23 VAL A 96 -5.401 0.299 8.384 1.00 0.55 H new ATOM 1428 N ASN A 97 -7.224 0.003 12.953 1.00 0.60 N ATOM 1429 CA ASN A 97 -8.012 -0.145 14.163 1.00 0.74 C ATOM 1430 C ASN A 97 -8.014 1.168 14.931 1.00 0.78 C ATOM 1431 O ASN A 97 -9.039 1.546 15.488 1.00 0.89 O ATOM 1432 CB ASN A 97 -7.462 -1.277 15.039 1.00 0.81 C ATOM 1433 CG ASN A 97 -7.842 -2.648 14.497 1.00 0.79 C ATOM 1434 OD1 ASN A 97 -8.880 -3.192 14.850 1.00 1.37 O ATOM 1435 ND2 ASN A 97 -7.026 -3.229 13.630 1.00 1.83 N ATOM 0 H ASN A 97 -6.289 -0.401 13.003 1.00 0.60 H new ATOM 0 HA ASN A 97 -9.035 -0.403 13.887 1.00 0.74 H new ATOM 0 HB2 ASN A 97 -6.376 -1.197 15.097 1.00 0.81 H new ATOM 0 HB3 ASN A 97 -7.844 -1.169 16.054 1.00 0.81 H new ATOM 0 HD21 ASN A 97 -7.259 -4.145 13.245 1.00 1.83 H new ATOM 0 HD22 ASN A 97 -6.165 -2.761 13.347 1.00 1.83 H new ATOM 1442 N ASP A 98 -6.889 1.884 14.929 1.00 0.72 N ATOM 1443 CA ASP A 98 -6.711 3.141 15.638 1.00 0.78 C ATOM 1444 C ASP A 98 -7.680 4.166 15.067 1.00 0.79 C ATOM 1445 O ASP A 98 -8.307 4.931 15.793 1.00 0.92 O ATOM 1446 CB ASP A 98 -5.271 3.640 15.450 1.00 0.75 C ATOM 1447 CG ASP A 98 -4.261 2.996 16.400 1.00 1.36 C ATOM 1448 OD1 ASP A 98 -4.653 2.710 17.553 1.00 2.10 O ATOM 1449 OD2 ASP A 98 -3.099 2.831 15.965 1.00 2.56 O ATOM 0 H ASP A 98 -6.056 1.593 14.418 1.00 0.72 H new ATOM 0 HA ASP A 98 -6.904 2.996 16.701 1.00 0.78 H new ATOM 0 HB2 ASP A 98 -4.962 3.448 14.423 1.00 0.75 H new ATOM 0 HB3 ASP A 98 -5.250 4.721 15.592 1.00 0.75 H new ATOM 1454 N ASN A 99 -7.802 4.184 13.739 1.00 0.69 N ATOM 1455 CA ASN A 99 -8.719 5.076 13.055 1.00 0.72 C ATOM 1456 C ASN A 99 -10.109 4.449 12.905 1.00 0.74 C ATOM 1457 O ASN A 99 -11.022 5.098 12.401 1.00 0.79 O ATOM 1458 CB ASN A 99 -8.149 5.401 11.679 1.00 0.65 C ATOM 1459 CG ASN A 99 -7.595 6.814 11.596 1.00 0.97 C ATOM 1460 OD1 ASN A 99 -8.266 7.742 11.153 1.00 0.97 O ATOM 1461 ND2 ASN A 99 -6.343 6.997 11.987 1.00 2.73 N ATOM 0 H ASN A 99 -7.267 3.580 13.115 1.00 0.69 H new ATOM 0 HA ASN A 99 -8.830 5.984 13.647 1.00 0.72 H new ATOM 0 HB2 ASN A 99 -7.358 4.690 11.440 1.00 0.65 H new ATOM 0 HB3 ASN A 99 -8.929 5.275 10.928 1.00 0.65 H new ATOM 0 HD21 ASN A 99 -5.919 7.922 11.923 1.00 2.73 H new ATOM 0 HD22 ASN A 99 -5.803 6.213 12.352 1.00 2.73 H new ATOM 1468 N ASN A 100 -10.278 3.192 13.322 1.00 0.77 N ATOM 1469 CA ASN A 100 -11.528 2.451 13.281 1.00 0.84 C ATOM 1470 C ASN A 100 -12.158 2.437 11.889 1.00 0.74 C ATOM 1471 O ASN A 100 -13.370 2.592 11.745 1.00 0.74 O ATOM 1472 CB ASN A 100 -12.474 3.042 14.324 1.00 1.02 C ATOM 1473 CG ASN A 100 -13.668 2.137 14.579 1.00 1.27 C ATOM 1474 OD1 ASN A 100 -13.575 0.916 14.495 1.00 1.35 O ATOM 1475 ND2 ASN A 100 -14.831 2.707 14.863 1.00 2.66 N ATOM 0 H ASN A 100 -9.511 2.645 13.713 1.00 0.77 H new ATOM 0 HA ASN A 100 -11.326 1.406 13.516 1.00 0.84 H new ATOM 0 HB2 ASN A 100 -11.933 3.202 15.257 1.00 1.02 H new ATOM 0 HB3 ASN A 100 -12.823 4.018 13.987 1.00 1.02 H new ATOM 0 HD21 ASN A 100 -15.658 2.130 15.014 1.00 2.66 H new ATOM 0 HD22 ASN A 100 -14.898 3.723 14.931 1.00 2.66 H new ATOM 1482 N TYR A 101 -11.345 2.231 10.857 1.00 0.66 N ATOM 1483 CA TYR A 101 -11.804 2.274 9.479 1.00 0.66 C ATOM 1484 C TYR A 101 -12.605 1.045 9.086 1.00 0.83 C ATOM 1485 O TYR A 101 -12.296 -0.079 9.475 1.00 1.05 O ATOM 1486 CB TYR A 101 -10.603 2.360 8.559 1.00 0.71 C ATOM 1487 CG TYR A 101 -9.807 3.646 8.645 1.00 0.61 C ATOM 1488 CD1 TYR A 101 -8.408 3.606 8.530 1.00 1.65 C ATOM 1489 CD2 TYR A 101 -10.459 4.889 8.782 1.00 1.74 C ATOM 1490 CE1 TYR A 101 -7.662 4.795 8.483 1.00 1.68 C ATOM 1491 CE2 TYR A 101 -9.724 6.083 8.709 1.00 1.88 C ATOM 1492 CZ TYR A 101 -8.321 6.042 8.539 1.00 0.98 C ATOM 1493 OH TYR A 101 -7.597 7.194 8.515 1.00 1.33 O ATOM 0 H TYR A 101 -10.350 2.030 10.956 1.00 0.66 H new ATOM 0 HA TYR A 101 -12.452 3.146 9.387 1.00 0.66 H new ATOM 0 HB2 TYR A 101 -9.937 1.526 8.780 1.00 0.71 H new ATOM 0 HB3 TYR A 101 -10.944 2.232 7.532 1.00 0.71 H new ATOM 0 HD1 TYR A 101 -7.902 2.653 8.477 1.00 1.65 H new ATOM 0 HD2 TYR A 101 -11.526 4.923 8.943 1.00 1.74 H new ATOM 0 HE1 TYR A 101 -6.586 4.755 8.404 1.00 1.68 H new ATOM 0 HE2 TYR A 101 -10.231 7.034 8.783 1.00 1.88 H new ATOM 0 HH TYR A 101 -7.946 7.814 9.189 1.00 1.33 H new ATOM 1503 N LYS A 102 -13.674 1.278 8.321 1.00 0.92 N ATOM 1504 CA LYS A 102 -14.583 0.246 7.854 1.00 1.18 C ATOM 1505 C LYS A 102 -14.297 -0.144 6.408 1.00 1.10 C ATOM 1506 O LYS A 102 -14.854 -1.131 5.947 1.00 1.44 O ATOM 1507 CB LYS A 102 -16.036 0.706 8.023 1.00 1.54 C ATOM 1508 CG LYS A 102 -16.627 0.368 9.400 1.00 1.82 C ATOM 1509 CD LYS A 102 -15.874 0.978 10.588 1.00 2.50 C ATOM 1510 CE LYS A 102 -14.685 0.111 11.030 1.00 3.10 C ATOM 1511 NZ LYS A 102 -14.788 -0.309 12.439 1.00 4.49 N ATOM 0 H LYS A 102 -13.932 2.213 8.006 1.00 0.92 H new ATOM 0 HA LYS A 102 -14.425 -0.644 8.463 1.00 1.18 H new ATOM 0 HB2 LYS A 102 -16.088 1.784 7.868 1.00 1.54 H new ATOM 0 HB3 LYS A 102 -16.648 0.243 7.249 1.00 1.54 H new ATOM 0 HG2 LYS A 102 -17.662 0.709 9.430 1.00 1.82 H new ATOM 0 HG3 LYS A 102 -16.645 -0.716 9.516 1.00 1.82 H new ATOM 0 HD2 LYS A 102 -15.516 1.971 10.317 1.00 2.50 H new ATOM 0 HD3 LYS A 102 -16.561 1.104 11.425 1.00 2.50 H new ATOM 0 HE2 LYS A 102 -14.627 -0.772 10.394 1.00 3.10 H new ATOM 0 HE3 LYS A 102 -13.759 0.669 10.887 1.00 3.10 H new ATOM 0 HZ1 LYS A 102 -14.638 -1.336 12.507 1.00 4.49 H new ATOM 0 HZ2 LYS A 102 -14.066 0.184 13.002 1.00 4.49 H new ATOM 0 HZ3 LYS A 102 -15.733 -0.072 12.804 1.00 4.49 H new ATOM 1525 N SER A 103 -13.434 0.585 5.706 1.00 0.85 N ATOM 1526 CA SER A 103 -12.987 0.229 4.370 1.00 0.77 C ATOM 1527 C SER A 103 -11.607 0.844 4.171 1.00 0.65 C ATOM 1528 O SER A 103 -11.287 1.843 4.817 1.00 1.01 O ATOM 1529 CB SER A 103 -13.977 0.785 3.340 1.00 1.27 C ATOM 1530 OG SER A 103 -14.225 2.163 3.573 1.00 2.01 O ATOM 0 H SER A 103 -13.022 1.450 6.057 1.00 0.85 H new ATOM 0 HA SER A 103 -12.936 -0.853 4.245 1.00 0.77 H new ATOM 0 HB2 SER A 103 -13.579 0.647 2.335 1.00 1.27 H new ATOM 0 HB3 SER A 103 -14.913 0.229 3.391 1.00 1.27 H new ATOM 0 HG SER A 103 -13.499 2.696 3.187 1.00 2.01 H new ATOM 1536 N VAL A 104 -10.794 0.269 3.286 1.00 0.47 N ATOM 1537 CA VAL A 104 -9.475 0.783 2.949 1.00 0.68 C ATOM 1538 C VAL A 104 -9.219 0.405 1.498 1.00 0.51 C ATOM 1539 O VAL A 104 -9.518 -0.729 1.128 1.00 0.54 O ATOM 1540 CB VAL A 104 -8.413 0.132 3.853 1.00 1.09 C ATOM 1541 CG1 VAL A 104 -6.999 0.571 3.461 1.00 2.12 C ATOM 1542 CG2 VAL A 104 -8.615 0.492 5.326 1.00 1.38 C ATOM 0 H VAL A 104 -11.041 -0.580 2.777 1.00 0.47 H new ATOM 0 HA VAL A 104 -9.424 1.862 3.091 1.00 0.68 H new ATOM 0 HB VAL A 104 -8.528 -0.943 3.717 1.00 1.09 H new ATOM 0 HG11 VAL A 104 -6.274 0.093 4.119 1.00 2.12 H new ATOM 0 HG12 VAL A 104 -6.800 0.279 2.430 1.00 2.12 H new ATOM 0 HG13 VAL A 104 -6.915 1.654 3.554 1.00 2.12 H new ATOM 0 HG21 VAL A 104 -7.843 0.011 5.927 1.00 1.38 H new ATOM 0 HG22 VAL A 104 -8.549 1.573 5.449 1.00 1.38 H new ATOM 0 HG23 VAL A 104 -9.596 0.149 5.653 1.00 1.38 H new ATOM 1552 N ALA A 105 -8.647 1.309 0.698 1.00 0.54 N ATOM 1553 CA ALA A 105 -8.123 0.941 -0.605 1.00 0.50 C ATOM 1554 C ALA A 105 -6.645 0.613 -0.450 1.00 0.56 C ATOM 1555 O ALA A 105 -5.870 1.486 -0.060 1.00 0.61 O ATOM 1556 CB ALA A 105 -8.278 2.103 -1.585 1.00 0.55 C ATOM 0 H ALA A 105 -8.539 2.295 0.935 1.00 0.54 H new ATOM 0 HA ALA A 105 -8.671 0.081 -0.990 1.00 0.50 H new ATOM 0 HB1 ALA A 105 -7.881 1.814 -2.558 1.00 0.55 H new ATOM 0 HB2 ALA A 105 -9.333 2.357 -1.684 1.00 0.55 H new ATOM 0 HB3 ALA A 105 -7.730 2.969 -1.213 1.00 0.55 H new ATOM 1562 N ILE A 106 -6.230 -0.606 -0.799 1.00 0.70 N ATOM 1563 CA ILE A 106 -4.822 -0.934 -0.899 1.00 0.93 C ATOM 1564 C ILE A 106 -4.474 -1.070 -2.383 1.00 1.12 C ATOM 1565 O ILE A 106 -5.263 -1.622 -3.155 1.00 1.59 O ATOM 1566 CB ILE A 106 -4.458 -2.173 -0.055 1.00 1.42 C ATOM 1567 CG1 ILE A 106 -4.743 -3.558 -0.667 1.00 2.72 C ATOM 1568 CG2 ILE A 106 -5.035 -2.074 1.369 1.00 1.21 C ATOM 1569 CD1 ILE A 106 -6.203 -3.992 -0.709 1.00 4.54 C ATOM 0 H ILE A 106 -6.858 -1.380 -1.016 1.00 0.70 H new ATOM 0 HA ILE A 106 -4.213 -0.136 -0.475 1.00 0.93 H new ATOM 0 HB ILE A 106 -3.369 -2.130 -0.028 1.00 1.42 H new ATOM 0 HG12 ILE A 106 -4.354 -3.568 -1.685 1.00 2.72 H new ATOM 0 HG13 ILE A 106 -4.181 -4.303 -0.103 1.00 2.72 H new ATOM 0 HG21 ILE A 106 -4.759 -2.963 1.936 1.00 1.21 H new ATOM 0 HG22 ILE A 106 -4.633 -1.190 1.864 1.00 1.21 H new ATOM 0 HG23 ILE A 106 -6.121 -1.999 1.317 1.00 1.21 H new ATOM 0 HD11 ILE A 106 -6.276 -4.981 -1.161 1.00 4.54 H new ATOM 0 HD12 ILE A 106 -6.602 -4.026 0.305 1.00 4.54 H new ATOM 0 HD13 ILE A 106 -6.777 -3.280 -1.301 1.00 4.54 H new ATOM 1581 N PRO A 107 -3.322 -0.540 -2.814 1.00 0.95 N ATOM 1582 CA PRO A 107 -2.816 -0.759 -4.153 1.00 1.19 C ATOM 1583 C PRO A 107 -2.159 -2.141 -4.203 1.00 1.41 C ATOM 1584 O PRO A 107 -2.341 -2.969 -3.312 1.00 1.65 O ATOM 1585 CB PRO A 107 -1.818 0.386 -4.359 1.00 1.04 C ATOM 1586 CG PRO A 107 -1.205 0.531 -2.969 1.00 0.84 C ATOM 1587 CD PRO A 107 -2.401 0.284 -2.048 1.00 0.78 C ATOM 0 HA PRO A 107 -3.573 -0.754 -4.938 1.00 1.19 H new ATOM 0 HB2 PRO A 107 -1.068 0.142 -5.112 1.00 1.04 H new ATOM 0 HB3 PRO A 107 -2.311 1.302 -4.685 1.00 1.04 H new ATOM 0 HG2 PRO A 107 -0.408 -0.193 -2.800 1.00 0.84 H new ATOM 0 HG3 PRO A 107 -0.774 1.521 -2.817 1.00 0.84 H new ATOM 0 HD2 PRO A 107 -2.093 -0.221 -1.132 1.00 0.78 H new ATOM 0 HD3 PRO A 107 -2.869 1.223 -1.753 1.00 0.78 H new ATOM 1595 N LEU A 108 -1.351 -2.391 -5.230 1.00 1.57 N ATOM 1596 CA LEU A 108 -0.534 -3.580 -5.327 1.00 1.77 C ATOM 1597 C LEU A 108 0.904 -3.130 -5.122 1.00 1.43 C ATOM 1598 O LEU A 108 1.270 -2.015 -5.494 1.00 1.42 O ATOM 1599 CB LEU A 108 -0.731 -4.225 -6.698 1.00 2.30 C ATOM 1600 CG LEU A 108 -2.152 -4.783 -6.899 1.00 2.85 C ATOM 1601 CD1 LEU A 108 -2.311 -5.075 -8.393 1.00 3.53 C ATOM 1602 CD2 LEU A 108 -2.355 -6.081 -6.122 1.00 2.97 C ATOM 0 H LEU A 108 -1.250 -1.760 -6.025 1.00 1.57 H new ATOM 0 HA LEU A 108 -0.804 -4.327 -4.581 1.00 1.77 H new ATOM 0 HB2 LEU A 108 -0.522 -3.488 -7.474 1.00 2.30 H new ATOM 0 HB3 LEU A 108 -0.008 -5.032 -6.822 1.00 2.30 H new ATOM 0 HG LEU A 108 -2.884 -4.059 -6.540 1.00 2.85 H new ATOM 0 HD11 LEU A 108 -3.308 -5.474 -8.582 1.00 3.53 H new ATOM 0 HD12 LEU A 108 -2.175 -4.154 -8.960 1.00 3.53 H new ATOM 0 HD13 LEU A 108 -1.563 -5.805 -8.703 1.00 3.53 H new ATOM 0 HD21 LEU A 108 -3.368 -6.448 -6.285 1.00 2.97 H new ATOM 0 HD22 LEU A 108 -1.639 -6.827 -6.466 1.00 2.97 H new ATOM 0 HD23 LEU A 108 -2.203 -5.896 -5.059 1.00 2.97 H new ATOM 1614 N LEU A 109 1.703 -3.994 -4.505 1.00 1.58 N ATOM 1615 CA LEU A 109 3.095 -3.747 -4.174 1.00 1.34 C ATOM 1616 C LEU A 109 3.881 -5.007 -4.529 1.00 1.47 C ATOM 1617 O LEU A 109 3.293 -6.027 -4.884 1.00 1.75 O ATOM 1618 CB LEU A 109 3.278 -3.407 -2.681 1.00 1.49 C ATOM 1619 CG LEU A 109 2.398 -2.262 -2.145 1.00 1.37 C ATOM 1620 CD1 LEU A 109 1.054 -2.769 -1.605 1.00 2.30 C ATOM 1621 CD2 LEU A 109 3.113 -1.568 -0.983 1.00 1.37 C ATOM 0 H LEU A 109 1.384 -4.918 -4.213 1.00 1.58 H new ATOM 0 HA LEU A 109 3.456 -2.887 -4.738 1.00 1.34 H new ATOM 0 HB2 LEU A 109 3.073 -4.303 -2.095 1.00 1.49 H new ATOM 0 HB3 LEU A 109 4.323 -3.148 -2.512 1.00 1.49 H new ATOM 0 HG LEU A 109 2.220 -1.584 -2.979 1.00 1.37 H new ATOM 0 HD11 LEU A 109 0.468 -1.926 -1.238 1.00 2.30 H new ATOM 0 HD12 LEU A 109 0.507 -3.271 -2.403 1.00 2.30 H new ATOM 0 HD13 LEU A 109 1.231 -3.470 -0.790 1.00 2.30 H new ATOM 0 HD21 LEU A 109 2.490 -0.758 -0.604 1.00 1.37 H new ATOM 0 HD22 LEU A 109 3.296 -2.289 -0.186 1.00 1.37 H new ATOM 0 HD23 LEU A 109 4.063 -1.163 -1.331 1.00 1.37 H new ATOM 1633 N SER A 110 5.208 -4.939 -4.413 1.00 1.36 N ATOM 1634 CA SER A 110 6.098 -6.061 -4.677 1.00 1.48 C ATOM 1635 C SER A 110 5.961 -6.609 -6.096 1.00 1.65 C ATOM 1636 O SER A 110 6.089 -7.810 -6.327 1.00 2.04 O ATOM 1637 CB SER A 110 5.885 -7.171 -3.650 1.00 1.88 C ATOM 1638 OG SER A 110 5.932 -6.677 -2.330 1.00 1.73 O ATOM 0 H SER A 110 5.697 -4.090 -4.129 1.00 1.36 H new ATOM 0 HA SER A 110 7.115 -5.680 -4.586 1.00 1.48 H new ATOM 0 HB2 SER A 110 4.921 -7.649 -3.825 1.00 1.88 H new ATOM 0 HB3 SER A 110 6.649 -7.938 -3.779 1.00 1.88 H new ATOM 0 HG SER A 110 5.358 -7.225 -1.755 1.00 1.73 H new ATOM 1644 N THR A 111 5.787 -5.737 -7.085 1.00 1.59 N ATOM 1645 CA THR A 111 5.671 -6.163 -8.468 1.00 1.90 C ATOM 1646 C THR A 111 6.483 -5.221 -9.347 1.00 1.99 C ATOM 1647 O THR A 111 6.024 -4.122 -9.645 1.00 2.74 O ATOM 1648 CB THR A 111 4.189 -6.172 -8.857 1.00 2.14 C ATOM 1649 OG1 THR A 111 3.583 -4.960 -8.458 1.00 2.74 O ATOM 1650 CG2 THR A 111 3.443 -7.341 -8.206 1.00 1.73 C ATOM 0 H THR A 111 5.724 -4.728 -6.949 1.00 1.59 H new ATOM 0 HA THR A 111 6.065 -7.170 -8.603 1.00 1.90 H new ATOM 0 HB THR A 111 4.131 -6.286 -9.940 1.00 2.14 H new ATOM 0 HG1 THR A 111 4.150 -4.207 -8.727 1.00 2.74 H new ATOM 0 HG21 THR A 111 2.395 -7.315 -8.504 1.00 1.73 H new ATOM 0 HG22 THR A 111 3.889 -8.282 -8.528 1.00 1.73 H new ATOM 0 HG23 THR A 111 3.513 -7.259 -7.121 1.00 1.73 H new ATOM 1658 N GLY A 112 7.688 -5.639 -9.747 1.00 2.36 N ATOM 1659 CA GLY A 112 8.505 -4.886 -10.693 1.00 2.58 C ATOM 1660 C GLY A 112 8.947 -3.537 -10.132 1.00 1.82 C ATOM 1661 O GLY A 112 9.030 -2.557 -10.864 1.00 2.61 O ATOM 0 H GLY A 112 8.119 -6.505 -9.424 1.00 2.36 H new ATOM 0 HA2 GLY A 112 9.385 -5.473 -10.957 1.00 2.58 H new ATOM 0 HA3 GLY A 112 7.940 -4.727 -11.612 1.00 2.58 H new ATOM 1665 N ILE A 113 9.243 -3.490 -8.830 1.00 1.31 N ATOM 1666 CA ILE A 113 9.637 -2.257 -8.154 1.00 0.95 C ATOM 1667 C ILE A 113 10.453 -2.573 -6.893 1.00 0.81 C ATOM 1668 O ILE A 113 11.435 -1.894 -6.599 1.00 1.16 O ATOM 1669 CB ILE A 113 8.378 -1.403 -7.871 1.00 1.80 C ATOM 1670 CG1 ILE A 113 8.716 -0.021 -7.284 1.00 1.69 C ATOM 1671 CG2 ILE A 113 7.372 -2.114 -6.954 1.00 3.23 C ATOM 1672 CD1 ILE A 113 9.306 0.924 -8.335 1.00 2.27 C ATOM 0 H ILE A 113 9.215 -4.306 -8.218 1.00 1.31 H new ATOM 0 HA ILE A 113 10.291 -1.666 -8.796 1.00 0.95 H new ATOM 0 HB ILE A 113 7.914 -1.260 -8.847 1.00 1.80 H new ATOM 0 HG12 ILE A 113 7.814 0.424 -6.863 1.00 1.69 H new ATOM 0 HG13 ILE A 113 9.425 -0.139 -6.465 1.00 1.69 H new ATOM 0 HG21 ILE A 113 6.509 -1.468 -6.790 1.00 3.23 H new ATOM 0 HG22 ILE A 113 7.046 -3.043 -7.422 1.00 3.23 H new ATOM 0 HG23 ILE A 113 7.845 -2.336 -5.998 1.00 3.23 H new ATOM 0 HD11 ILE A 113 9.529 1.887 -7.875 1.00 2.27 H new ATOM 0 HD12 ILE A 113 10.223 0.493 -8.738 1.00 2.27 H new ATOM 0 HD13 ILE A 113 8.587 1.065 -9.142 1.00 2.27 H new ATOM 1684 N PHE A 114 10.057 -3.611 -6.148 1.00 0.67 N ATOM 1685 CA PHE A 114 10.619 -3.939 -4.850 1.00 0.70 C ATOM 1686 C PHE A 114 11.044 -5.400 -4.815 1.00 0.77 C ATOM 1687 O PHE A 114 12.111 -5.738 -4.319 1.00 0.97 O ATOM 1688 CB PHE A 114 9.577 -3.672 -3.755 1.00 0.78 C ATOM 1689 CG PHE A 114 9.117 -2.235 -3.588 1.00 0.80 C ATOM 1690 CD1 PHE A 114 7.795 -1.980 -3.180 1.00 2.12 C ATOM 1691 CD2 PHE A 114 9.979 -1.154 -3.841 1.00 2.07 C ATOM 1692 CE1 PHE A 114 7.331 -0.660 -3.070 1.00 2.21 C ATOM 1693 CE2 PHE A 114 9.525 0.167 -3.707 1.00 2.15 C ATOM 1694 CZ PHE A 114 8.196 0.416 -3.333 1.00 1.18 C ATOM 0 H PHE A 114 9.322 -4.254 -6.444 1.00 0.67 H new ATOM 0 HA PHE A 114 11.495 -3.315 -4.674 1.00 0.70 H new ATOM 0 HB2 PHE A 114 8.702 -4.288 -3.961 1.00 0.78 H new ATOM 0 HB3 PHE A 114 9.988 -4.010 -2.804 1.00 0.78 H new ATOM 0 HD1 PHE A 114 7.135 -2.803 -2.951 1.00 2.12 H new ATOM 0 HD2 PHE A 114 10.999 -1.342 -4.141 1.00 2.07 H new ATOM 0 HE1 PHE A 114 6.307 -0.471 -2.783 1.00 2.21 H new ATOM 0 HE2 PHE A 114 10.198 0.991 -3.892 1.00 2.15 H new ATOM 0 HZ PHE A 114 7.839 1.432 -3.247 1.00 1.18 H new ATOM 1704 N SER A 115 10.184 -6.281 -5.312 1.00 0.80 N ATOM 1705 CA SER A 115 10.378 -7.712 -5.314 1.00 1.05 C ATOM 1706 C SER A 115 11.711 -8.127 -5.931 1.00 0.95 C ATOM 1707 O SER A 115 12.511 -8.806 -5.295 1.00 1.06 O ATOM 1708 CB SER A 115 9.171 -8.354 -5.989 1.00 1.35 C ATOM 1709 OG SER A 115 8.732 -7.605 -7.107 1.00 3.17 O ATOM 0 H SER A 115 9.301 -6.000 -5.739 1.00 0.80 H new ATOM 0 HA SER A 115 10.442 -8.074 -4.288 1.00 1.05 H new ATOM 0 HB2 SER A 115 9.428 -9.365 -6.307 1.00 1.35 H new ATOM 0 HB3 SER A 115 8.357 -8.443 -5.269 1.00 1.35 H new ATOM 0 HG SER A 115 8.067 -8.123 -7.607 1.00 3.17 H new ATOM 1715 N GLY A 116 11.972 -7.722 -7.173 1.00 1.10 N ATOM 1716 CA GLY A 116 13.241 -8.012 -7.825 1.00 1.22 C ATOM 1717 C GLY A 116 13.256 -9.410 -8.436 1.00 1.61 C ATOM 1718 O GLY A 116 13.460 -9.560 -9.641 1.00 2.28 O ATOM 0 H GLY A 116 11.317 -7.191 -7.747 1.00 1.10 H new ATOM 0 HA2 GLY A 116 13.427 -7.273 -8.604 1.00 1.22 H new ATOM 0 HA3 GLY A 116 14.051 -7.923 -7.101 1.00 1.22 H new ATOM 1722 N ASN A 117 13.070 -10.453 -7.626 1.00 1.94 N ATOM 1723 CA ASN A 117 12.943 -11.798 -8.155 1.00 2.38 C ATOM 1724 C ASN A 117 12.106 -12.635 -7.200 1.00 2.30 C ATOM 1725 O ASN A 117 12.470 -12.766 -6.036 1.00 3.19 O ATOM 1726 CB ASN A 117 14.328 -12.430 -8.355 1.00 3.42 C ATOM 1727 CG ASN A 117 14.351 -13.182 -9.673 1.00 3.74 C ATOM 1728 OD1 ASN A 117 14.274 -14.408 -9.722 1.00 4.44 O ATOM 1729 ND2 ASN A 117 14.404 -12.437 -10.768 1.00 3.74 N ATOM 0 H ASN A 117 13.005 -10.387 -6.610 1.00 1.94 H new ATOM 0 HA ASN A 117 12.449 -11.759 -9.126 1.00 2.38 H new ATOM 0 HB2 ASN A 117 15.097 -11.657 -8.351 1.00 3.42 H new ATOM 0 HB3 ASN A 117 14.553 -13.108 -7.532 1.00 3.42 H new ATOM 0 HD21 ASN A 117 14.381 -12.879 -11.687 1.00 3.74 H new ATOM 0 HD22 ASN A 117 14.468 -11.422 -10.692 1.00 3.74 H new ATOM 1736 N LYS A 118 11.007 -13.215 -7.699 1.00 2.15 N ATOM 1737 CA LYS A 118 9.982 -13.861 -6.882 1.00 2.26 C ATOM 1738 C LYS A 118 9.416 -12.834 -5.882 1.00 2.02 C ATOM 1739 O LYS A 118 9.726 -11.652 -5.999 1.00 2.82 O ATOM 1740 CB LYS A 118 10.501 -15.175 -6.258 1.00 3.12 C ATOM 1741 CG LYS A 118 10.790 -16.292 -7.279 1.00 3.63 C ATOM 1742 CD LYS A 118 12.004 -16.030 -8.180 1.00 4.01 C ATOM 1743 CE LYS A 118 12.349 -17.262 -9.020 1.00 4.74 C ATOM 1744 NZ LYS A 118 13.549 -17.013 -9.847 1.00 5.06 N ATOM 0 H LYS A 118 10.806 -13.247 -8.698 1.00 2.15 H new ATOM 0 HA LYS A 118 9.144 -14.183 -7.500 1.00 2.26 H new ATOM 0 HB2 LYS A 118 11.414 -14.963 -5.701 1.00 3.12 H new ATOM 0 HB3 LYS A 118 9.766 -15.537 -5.539 1.00 3.12 H new ATOM 0 HG2 LYS A 118 10.947 -17.227 -6.741 1.00 3.63 H new ATOM 0 HG3 LYS A 118 9.910 -16.430 -7.907 1.00 3.63 H new ATOM 0 HD2 LYS A 118 11.796 -15.186 -8.837 1.00 4.01 H new ATOM 0 HD3 LYS A 118 12.862 -15.753 -7.567 1.00 4.01 H new ATOM 0 HE2 LYS A 118 12.523 -18.117 -8.366 1.00 4.74 H new ATOM 0 HE3 LYS A 118 11.506 -17.518 -9.662 1.00 4.74 H new ATOM 0 HZ1 LYS A 118 13.337 -17.233 -10.841 1.00 5.06 H new ATOM 0 HZ2 LYS A 118 13.826 -16.014 -9.765 1.00 5.06 H new ATOM 0 HZ3 LYS A 118 14.329 -17.617 -9.518 1.00 5.06 H new ATOM 1758 N ASP A 119 8.527 -13.269 -4.979 1.00 2.15 N ATOM 1759 CA ASP A 119 7.464 -12.449 -4.385 1.00 1.81 C ATOM 1760 C ASP A 119 6.579 -11.871 -5.493 1.00 1.14 C ATOM 1761 O ASP A 119 7.035 -11.180 -6.404 1.00 1.39 O ATOM 1762 CB ASP A 119 7.980 -11.385 -3.402 1.00 2.34 C ATOM 1763 CG ASP A 119 6.835 -10.591 -2.747 1.00 3.08 C ATOM 1764 OD1 ASP A 119 5.672 -11.057 -2.796 1.00 3.70 O ATOM 1765 OD2 ASP A 119 7.120 -9.501 -2.205 1.00 3.98 O ATOM 0 H ASP A 119 8.528 -14.228 -4.632 1.00 2.15 H new ATOM 0 HA ASP A 119 6.850 -13.100 -3.762 1.00 1.81 H new ATOM 0 HB2 ASP A 119 8.575 -11.868 -2.626 1.00 2.34 H new ATOM 0 HB3 ASP A 119 8.641 -10.697 -3.929 1.00 2.34 H new ATOM 1770 N ARG A 120 5.294 -12.213 -5.466 1.00 0.88 N ATOM 1771 CA ARG A 120 4.336 -11.728 -6.448 1.00 0.90 C ATOM 1772 C ARG A 120 3.190 -11.095 -5.692 1.00 0.82 C ATOM 1773 O ARG A 120 3.063 -11.234 -4.477 1.00 0.79 O ATOM 1774 CB ARG A 120 3.830 -12.857 -7.355 1.00 1.53 C ATOM 1775 CG ARG A 120 4.924 -13.487 -8.232 1.00 1.84 C ATOM 1776 CD ARG A 120 4.992 -12.817 -9.609 1.00 2.68 C ATOM 1777 NE ARG A 120 3.850 -13.209 -10.452 1.00 3.66 N ATOM 1778 CZ ARG A 120 3.562 -12.705 -11.661 1.00 4.88 C ATOM 1779 NH1 ARG A 120 2.525 -13.179 -12.354 1.00 6.24 N ATOM 1780 NH2 ARG A 120 4.314 -11.730 -12.173 1.00 5.42 N ATOM 0 H ARG A 120 4.891 -12.833 -4.763 1.00 0.88 H new ATOM 0 HA ARG A 120 4.817 -11.000 -7.101 1.00 0.90 H new ATOM 0 HB2 ARG A 120 3.382 -13.634 -6.736 1.00 1.53 H new ATOM 0 HB3 ARG A 120 3.041 -12.467 -7.999 1.00 1.53 H new ATOM 0 HG2 ARG A 120 5.889 -13.396 -7.734 1.00 1.84 H new ATOM 0 HG3 ARG A 120 4.727 -14.552 -8.353 1.00 1.84 H new ATOM 0 HD2 ARG A 120 5.003 -11.734 -9.489 1.00 2.68 H new ATOM 0 HD3 ARG A 120 5.923 -13.092 -10.104 1.00 2.68 H new ATOM 0 HE ARG A 120 3.224 -13.926 -10.085 1.00 3.66 H new ATOM 0 HH11 ARG A 120 1.950 -13.926 -11.964 1.00 6.24 H new ATOM 0 HH12 ARG A 120 2.307 -12.794 -13.273 1.00 6.24 H new ATOM 0 HH21 ARG A 120 5.108 -11.368 -11.645 1.00 5.42 H new ATOM 0 HH22 ARG A 120 4.095 -11.347 -13.092 1.00 5.42 H new ATOM 1794 N LEU A 121 2.285 -10.453 -6.419 1.00 0.88 N ATOM 1795 CA LEU A 121 1.221 -9.737 -5.754 1.00 0.88 C ATOM 1796 C LEU A 121 0.280 -10.695 -5.093 1.00 0.87 C ATOM 1797 O LEU A 121 -0.258 -10.368 -4.062 1.00 0.87 O ATOM 1798 CB LEU A 121 0.428 -8.824 -6.675 1.00 1.05 C ATOM 1799 CG LEU A 121 -0.324 -9.548 -7.813 1.00 1.06 C ATOM 1800 CD1 LEU A 121 -1.799 -9.805 -7.478 1.00 1.53 C ATOM 1801 CD2 LEU A 121 -0.276 -8.725 -9.099 1.00 1.61 C ATOM 0 H LEU A 121 2.269 -10.416 -7.438 1.00 0.88 H new ATOM 0 HA LEU A 121 1.711 -9.104 -5.015 1.00 0.88 H new ATOM 0 HB2 LEU A 121 -0.294 -8.267 -6.078 1.00 1.05 H new ATOM 0 HB3 LEU A 121 1.108 -8.095 -7.114 1.00 1.05 H new ATOM 0 HG LEU A 121 0.181 -10.505 -7.942 1.00 1.06 H new ATOM 0 HD11 LEU A 121 -2.278 -10.316 -8.313 1.00 1.53 H new ATOM 0 HD12 LEU A 121 -1.866 -10.427 -6.585 1.00 1.53 H new ATOM 0 HD13 LEU A 121 -2.302 -8.855 -7.297 1.00 1.53 H new ATOM 0 HD21 LEU A 121 -0.811 -9.252 -9.889 1.00 1.61 H new ATOM 0 HD22 LEU A 121 -0.744 -7.755 -8.928 1.00 1.61 H new ATOM 0 HD23 LEU A 121 0.762 -8.579 -9.399 1.00 1.61 H new ATOM 1813 N THR A 122 0.076 -11.872 -5.659 1.00 0.94 N ATOM 1814 CA THR A 122 -0.708 -12.923 -5.064 1.00 1.02 C ATOM 1815 C THR A 122 -0.195 -13.260 -3.670 1.00 0.94 C ATOM 1816 O THR A 122 -0.979 -13.568 -2.778 1.00 1.04 O ATOM 1817 CB THR A 122 -0.565 -14.083 -6.046 1.00 1.14 C ATOM 1818 OG1 THR A 122 -1.047 -13.645 -7.300 1.00 1.31 O ATOM 1819 CG2 THR A 122 -1.278 -15.358 -5.605 1.00 1.37 C ATOM 0 H THR A 122 0.464 -12.122 -6.568 1.00 0.94 H new ATOM 0 HA THR A 122 -1.753 -12.654 -4.913 1.00 1.02 H new ATOM 0 HB THR A 122 0.489 -14.357 -6.098 1.00 1.14 H new ATOM 0 HG1 THR A 122 -0.966 -14.371 -7.953 1.00 1.31 H new ATOM 0 HG21 THR A 122 -1.130 -16.135 -6.354 1.00 1.37 H new ATOM 0 HG22 THR A 122 -0.870 -15.691 -4.651 1.00 1.37 H new ATOM 0 HG23 THR A 122 -2.344 -15.159 -5.494 1.00 1.37 H new ATOM 1827 N GLN A 123 1.119 -13.187 -3.478 1.00 0.84 N ATOM 1828 CA GLN A 123 1.725 -13.502 -2.199 1.00 0.82 C ATOM 1829 C GLN A 123 1.485 -12.338 -1.255 1.00 0.70 C ATOM 1830 O GLN A 123 0.891 -12.500 -0.190 1.00 0.72 O ATOM 1831 CB GLN A 123 3.225 -13.781 -2.401 1.00 0.93 C ATOM 1832 CG GLN A 123 3.531 -15.237 -2.049 1.00 1.24 C ATOM 1833 CD GLN A 123 4.887 -15.699 -2.579 1.00 1.26 C ATOM 1834 OE1 GLN A 123 5.414 -15.166 -3.552 1.00 2.28 O ATOM 1835 NE2 GLN A 123 5.457 -16.733 -1.974 1.00 1.99 N ATOM 0 H GLN A 123 1.784 -12.910 -4.200 1.00 0.84 H new ATOM 0 HA GLN A 123 1.281 -14.397 -1.763 1.00 0.82 H new ATOM 0 HB2 GLN A 123 3.506 -13.580 -3.435 1.00 0.93 H new ATOM 0 HB3 GLN A 123 3.816 -13.113 -1.774 1.00 0.93 H new ATOM 0 HG2 GLN A 123 3.509 -15.357 -0.966 1.00 1.24 H new ATOM 0 HG3 GLN A 123 2.749 -15.877 -2.457 1.00 1.24 H new ATOM 0 HE21 GLN A 123 5.006 -17.164 -1.167 1.00 1.99 H new ATOM 0 HE22 GLN A 123 6.346 -17.097 -2.316 1.00 1.99 H new ATOM 1844 N SER A 124 1.912 -11.147 -1.667 1.00 0.66 N ATOM 1845 CA SER A 124 1.868 -9.976 -0.813 1.00 0.68 C ATOM 1846 C SER A 124 0.423 -9.680 -0.400 1.00 0.62 C ATOM 1847 O SER A 124 0.152 -9.355 0.754 1.00 0.64 O ATOM 1848 CB SER A 124 2.579 -8.821 -1.536 1.00 0.85 C ATOM 1849 OG SER A 124 3.989 -8.994 -1.482 1.00 1.49 O ATOM 0 H SER A 124 2.295 -10.973 -2.596 1.00 0.66 H new ATOM 0 HA SER A 124 2.402 -10.139 0.123 1.00 0.68 H new ATOM 0 HB2 SER A 124 2.251 -8.777 -2.575 1.00 0.85 H new ATOM 0 HB3 SER A 124 2.305 -7.872 -1.075 1.00 0.85 H new ATOM 0 HG SER A 124 4.246 -9.760 -2.036 1.00 1.49 H new ATOM 1855 N LEU A 125 -0.511 -9.878 -1.324 1.00 0.67 N ATOM 1856 CA LEU A 125 -1.947 -9.808 -1.148 1.00 0.75 C ATOM 1857 C LEU A 125 -2.387 -10.770 -0.082 1.00 0.74 C ATOM 1858 O LEU A 125 -3.130 -10.395 0.808 1.00 0.82 O ATOM 1859 CB LEU A 125 -2.606 -10.123 -2.506 1.00 0.84 C ATOM 1860 CG LEU A 125 -4.119 -10.346 -2.587 1.00 1.49 C ATOM 1861 CD1 LEU A 125 -4.555 -11.750 -2.154 1.00 1.19 C ATOM 1862 CD2 LEU A 125 -4.862 -9.274 -1.807 1.00 2.64 C ATOM 0 H LEU A 125 -0.259 -10.108 -2.285 1.00 0.67 H new ATOM 0 HA LEU A 125 -2.249 -8.813 -0.822 1.00 0.75 H new ATOM 0 HB2 LEU A 125 -2.362 -9.304 -3.183 1.00 0.84 H new ATOM 0 HB3 LEU A 125 -2.124 -11.018 -2.901 1.00 0.84 H new ATOM 0 HG LEU A 125 -4.385 -10.265 -3.641 1.00 1.49 H new ATOM 0 HD11 LEU A 125 -5.638 -11.836 -2.237 1.00 1.19 H new ATOM 0 HD12 LEU A 125 -4.082 -12.492 -2.797 1.00 1.19 H new ATOM 0 HD13 LEU A 125 -4.256 -11.921 -1.120 1.00 1.19 H new ATOM 0 HD21 LEU A 125 -5.935 -9.451 -1.877 1.00 2.64 H new ATOM 0 HD22 LEU A 125 -4.557 -9.307 -0.761 1.00 2.64 H new ATOM 0 HD23 LEU A 125 -4.628 -8.294 -2.222 1.00 2.64 H new ATOM 1874 N ASN A 126 -1.945 -12.010 -0.160 1.00 0.75 N ATOM 1875 CA ASN A 126 -2.426 -13.026 0.768 1.00 0.92 C ATOM 1876 C ASN A 126 -2.131 -12.600 2.196 1.00 0.84 C ATOM 1877 O ASN A 126 -2.974 -12.708 3.080 1.00 0.93 O ATOM 1878 CB ASN A 126 -1.794 -14.393 0.490 1.00 1.08 C ATOM 1879 CG ASN A 126 -2.735 -15.536 0.885 1.00 1.37 C ATOM 1880 OD1 ASN A 126 -3.945 -15.370 1.050 1.00 1.95 O ATOM 1881 ND2 ASN A 126 -2.194 -16.737 1.029 1.00 1.83 N ATOM 0 H ASN A 126 -1.264 -12.339 -0.844 1.00 0.75 H new ATOM 0 HA ASN A 126 -3.503 -13.123 0.628 1.00 0.92 H new ATOM 0 HB2 ASN A 126 -1.547 -14.473 -0.569 1.00 1.08 H new ATOM 0 HB3 ASN A 126 -0.859 -14.482 1.043 1.00 1.08 H new ATOM 0 HD21 ASN A 126 -2.780 -17.534 1.278 1.00 1.83 H new ATOM 0 HD22 ASN A 126 -1.192 -16.865 0.890 1.00 1.83 H new ATOM 1888 N HIS A 127 -0.926 -12.074 2.403 1.00 0.73 N ATOM 1889 CA HIS A 127 -0.486 -11.652 3.722 1.00 0.75 C ATOM 1890 C HIS A 127 -1.215 -10.383 4.126 1.00 0.63 C ATOM 1891 O HIS A 127 -1.494 -10.178 5.303 1.00 0.66 O ATOM 1892 CB HIS A 127 1.023 -11.411 3.706 1.00 0.84 C ATOM 1893 CG HIS A 127 1.826 -12.641 3.393 1.00 1.01 C ATOM 1894 ND1 HIS A 127 1.973 -13.756 4.186 1.00 1.29 N ATOM 1895 CD2 HIS A 127 2.561 -12.832 2.257 1.00 0.98 C ATOM 1896 CE1 HIS A 127 2.784 -14.605 3.528 1.00 1.40 C ATOM 1897 NE2 HIS A 127 3.156 -14.092 2.343 1.00 1.21 N ATOM 0 H HIS A 127 -0.236 -11.931 1.666 1.00 0.73 H new ATOM 0 HA HIS A 127 -0.713 -12.434 4.447 1.00 0.75 H new ATOM 0 HB2 HIS A 127 1.252 -10.641 2.969 1.00 0.84 H new ATOM 0 HB3 HIS A 127 1.331 -11.024 4.677 1.00 0.84 H new ATOM 0 HD2 HIS A 127 2.663 -12.134 1.439 1.00 0.98 H new ATOM 0 HE1 HIS A 127 3.094 -15.569 3.902 1.00 1.40 H new ATOM 0 HE2 HIS A 127 3.754 -14.535 1.645 1.00 1.21 H new ATOM 1905 N LEU A 128 -1.552 -9.533 3.159 1.00 0.58 N ATOM 1906 CA LEU A 128 -2.298 -8.320 3.429 1.00 0.62 C ATOM 1907 C LEU A 128 -3.707 -8.668 3.890 1.00 0.64 C ATOM 1908 O LEU A 128 -4.218 -8.059 4.823 1.00 0.66 O ATOM 1909 CB LEU A 128 -2.272 -7.439 2.177 1.00 0.75 C ATOM 1910 CG LEU A 128 -3.075 -6.145 2.342 1.00 0.94 C ATOM 1911 CD1 LEU A 128 -2.309 -4.993 1.693 1.00 1.71 C ATOM 1912 CD2 LEU A 128 -4.457 -6.299 1.695 1.00 1.31 C ATOM 0 H LEU A 128 -1.315 -9.669 2.176 1.00 0.58 H new ATOM 0 HA LEU A 128 -1.842 -7.753 4.241 1.00 0.62 H new ATOM 0 HB2 LEU A 128 -1.239 -7.191 1.935 1.00 0.75 H new ATOM 0 HB3 LEU A 128 -2.671 -8.003 1.334 1.00 0.75 H new ATOM 0 HG LEU A 128 -3.213 -5.933 3.402 1.00 0.94 H new ATOM 0 HD11 LEU A 128 -2.876 -4.069 1.807 1.00 1.71 H new ATOM 0 HD12 LEU A 128 -1.337 -4.885 2.175 1.00 1.71 H new ATOM 0 HD13 LEU A 128 -2.166 -5.202 0.633 1.00 1.71 H new ATOM 0 HD21 LEU A 128 -5.021 -5.374 1.817 1.00 1.31 H new ATOM 0 HD22 LEU A 128 -4.340 -6.515 0.633 1.00 1.31 H new ATOM 0 HD23 LEU A 128 -4.994 -7.117 2.174 1.00 1.31 H new ATOM 1924 N LEU A 129 -4.327 -9.671 3.271 1.00 0.68 N ATOM 1925 CA LEU A 129 -5.605 -10.203 3.702 1.00 0.78 C ATOM 1926 C LEU A 129 -5.456 -10.854 5.056 1.00 0.77 C ATOM 1927 O LEU A 129 -6.380 -10.773 5.836 1.00 0.84 O ATOM 1928 CB LEU A 129 -6.176 -11.227 2.711 1.00 0.87 C ATOM 1929 CG LEU A 129 -6.518 -10.650 1.334 1.00 2.08 C ATOM 1930 CD1 LEU A 129 -7.227 -11.724 0.505 1.00 3.05 C ATOM 1931 CD2 LEU A 129 -7.389 -9.399 1.448 1.00 2.81 C ATOM 0 H LEU A 129 -3.947 -10.138 2.448 1.00 0.68 H new ATOM 0 HA LEU A 129 -6.301 -9.366 3.755 1.00 0.78 H new ATOM 0 HB2 LEU A 129 -5.454 -12.034 2.585 1.00 0.87 H new ATOM 0 HB3 LEU A 129 -7.075 -11.668 3.141 1.00 0.87 H new ATOM 0 HG LEU A 129 -5.593 -10.353 0.840 1.00 2.08 H new ATOM 0 HD11 LEU A 129 -7.474 -11.321 -0.477 1.00 3.05 H new ATOM 0 HD12 LEU A 129 -6.571 -12.586 0.389 1.00 3.05 H new ATOM 0 HD13 LEU A 129 -8.142 -12.030 1.012 1.00 3.05 H new ATOM 0 HD21 LEU A 129 -7.611 -9.018 0.451 1.00 2.81 H new ATOM 0 HD22 LEU A 129 -8.320 -9.649 1.957 1.00 2.81 H new ATOM 0 HD23 LEU A 129 -6.858 -8.636 2.018 1.00 2.81 H new ATOM 1943 N THR A 130 -4.323 -11.469 5.383 1.00 0.72 N ATOM 1944 CA THR A 130 -4.157 -12.046 6.707 1.00 0.77 C ATOM 1945 C THR A 130 -4.166 -10.923 7.736 1.00 0.75 C ATOM 1946 O THR A 130 -4.832 -11.012 8.764 1.00 0.80 O ATOM 1947 CB THR A 130 -2.869 -12.880 6.767 1.00 0.80 C ATOM 1948 OG1 THR A 130 -2.942 -13.925 5.823 1.00 0.84 O ATOM 1949 CG2 THR A 130 -2.652 -13.502 8.147 1.00 0.94 C ATOM 0 H THR A 130 -3.522 -11.578 4.761 1.00 0.72 H new ATOM 0 HA THR A 130 -4.981 -12.724 6.932 1.00 0.77 H new ATOM 0 HB THR A 130 -2.038 -12.209 6.552 1.00 0.80 H new ATOM 0 HG1 THR A 130 -2.955 -13.548 4.918 1.00 0.84 H new ATOM 0 HG21 THR A 130 -1.730 -14.083 8.143 1.00 0.94 H new ATOM 0 HG22 THR A 130 -2.581 -12.712 8.895 1.00 0.94 H new ATOM 0 HG23 THR A 130 -3.491 -14.155 8.388 1.00 0.94 H new ATOM 1957 N ALA A 131 -3.450 -9.837 7.450 1.00 0.70 N ATOM 1958 CA ALA A 131 -3.409 -8.716 8.369 1.00 0.73 C ATOM 1959 C ALA A 131 -4.784 -8.070 8.501 1.00 0.75 C ATOM 1960 O ALA A 131 -5.185 -7.673 9.593 1.00 0.79 O ATOM 1961 CB ALA A 131 -2.345 -7.717 7.909 1.00 0.76 C ATOM 0 H ALA A 131 -2.900 -9.716 6.600 1.00 0.70 H new ATOM 0 HA ALA A 131 -3.134 -9.071 9.362 1.00 0.73 H new ATOM 0 HB1 ALA A 131 -2.314 -6.874 8.600 1.00 0.76 H new ATOM 0 HB2 ALA A 131 -1.371 -8.206 7.889 1.00 0.76 H new ATOM 0 HB3 ALA A 131 -2.591 -7.358 6.910 1.00 0.76 H new ATOM 1967 N LEU A 132 -5.519 -7.963 7.397 1.00 0.74 N ATOM 1968 CA LEU A 132 -6.822 -7.305 7.408 1.00 0.78 C ATOM 1969 C LEU A 132 -7.937 -8.279 7.774 1.00 0.81 C ATOM 1970 O LEU A 132 -9.037 -7.841 8.097 1.00 0.84 O ATOM 1971 CB LEU A 132 -7.066 -6.593 6.075 1.00 0.86 C ATOM 1972 CG LEU A 132 -6.255 -5.285 6.052 1.00 1.55 C ATOM 1973 CD1 LEU A 132 -5.881 -4.872 4.631 1.00 2.06 C ATOM 1974 CD2 LEU A 132 -7.043 -4.147 6.708 1.00 2.07 C ATOM 0 H LEU A 132 -5.235 -8.323 6.486 1.00 0.74 H new ATOM 0 HA LEU A 132 -6.825 -6.543 8.187 1.00 0.78 H new ATOM 0 HB2 LEU A 132 -6.770 -7.235 5.245 1.00 0.86 H new ATOM 0 HB3 LEU A 132 -8.128 -6.380 5.950 1.00 0.86 H new ATOM 0 HG LEU A 132 -5.339 -5.473 6.613 1.00 1.55 H new ATOM 0 HD11 LEU A 132 -5.310 -3.944 4.660 1.00 2.06 H new ATOM 0 HD12 LEU A 132 -5.278 -5.655 4.171 1.00 2.06 H new ATOM 0 HD13 LEU A 132 -6.788 -4.721 4.045 1.00 2.06 H new ATOM 0 HD21 LEU A 132 -6.451 -3.232 6.681 1.00 2.07 H new ATOM 0 HD22 LEU A 132 -7.976 -3.992 6.167 1.00 2.07 H new ATOM 0 HD23 LEU A 132 -7.263 -4.406 7.744 1.00 2.07 H new ATOM 1986 N ASP A 133 -7.658 -9.582 7.816 1.00 0.82 N ATOM 1987 CA ASP A 133 -8.586 -10.592 8.316 1.00 0.83 C ATOM 1988 C ASP A 133 -8.686 -10.417 9.842 1.00 0.75 C ATOM 1989 O ASP A 133 -9.654 -10.852 10.458 1.00 0.73 O ATOM 1990 CB ASP A 133 -8.143 -12.024 7.929 1.00 0.97 C ATOM 1991 CG ASP A 133 -8.554 -12.514 6.518 1.00 1.92 C ATOM 1992 OD1 ASP A 133 -9.599 -12.069 5.988 1.00 2.72 O ATOM 1993 OD2 ASP A 133 -7.852 -13.406 5.972 1.00 2.88 O ATOM 0 H ASP A 133 -6.769 -9.969 7.499 1.00 0.82 H new ATOM 0 HA ASP A 133 -9.566 -10.455 7.860 1.00 0.83 H new ATOM 0 HB2 ASP A 133 -7.057 -12.079 8.007 1.00 0.97 H new ATOM 0 HB3 ASP A 133 -8.551 -12.718 8.664 1.00 0.97 H new ATOM 1998 N THR A 134 -7.721 -9.724 10.465 1.00 0.81 N ATOM 1999 CA THR A 134 -7.791 -9.291 11.858 1.00 0.84 C ATOM 2000 C THR A 134 -8.874 -8.216 12.080 1.00 0.81 C ATOM 2001 O THR A 134 -9.161 -7.869 13.223 1.00 0.90 O ATOM 2002 CB THR A 134 -6.373 -8.895 12.326 1.00 0.98 C ATOM 2003 OG1 THR A 134 -5.987 -9.697 13.422 1.00 1.25 O ATOM 2004 CG2 THR A 134 -6.196 -7.434 12.727 1.00 1.36 C ATOM 0 H THR A 134 -6.856 -9.446 10.001 1.00 0.81 H new ATOM 0 HA THR A 134 -8.121 -10.114 12.493 1.00 0.84 H new ATOM 0 HB THR A 134 -5.744 -9.054 11.450 1.00 0.98 H new ATOM 0 HG1 THR A 134 -5.087 -9.442 13.713 1.00 1.25 H new ATOM 0 HG21 THR A 134 -5.165 -7.264 13.038 1.00 1.36 H new ATOM 0 HG22 THR A 134 -6.428 -6.793 11.877 1.00 1.36 H new ATOM 0 HG23 THR A 134 -6.868 -7.199 13.553 1.00 1.36 H new ATOM 2012 N THR A 135 -9.517 -7.697 11.027 1.00 0.76 N ATOM 2013 CA THR A 135 -10.575 -6.709 11.166 1.00 0.78 C ATOM 2014 C THR A 135 -11.814 -7.187 10.424 1.00 0.87 C ATOM 2015 O THR A 135 -11.747 -7.519 9.245 1.00 1.76 O ATOM 2016 CB THR A 135 -10.112 -5.345 10.643 1.00 0.94 C ATOM 2017 OG1 THR A 135 -9.784 -5.364 9.268 1.00 1.16 O ATOM 2018 CG2 THR A 135 -8.885 -4.851 11.404 1.00 1.20 C ATOM 0 H THR A 135 -9.314 -7.954 10.061 1.00 0.76 H new ATOM 0 HA THR A 135 -10.821 -6.591 12.221 1.00 0.78 H new ATOM 0 HB THR A 135 -10.959 -4.676 10.796 1.00 0.94 H new ATOM 0 HG1 THR A 135 -9.561 -6.279 8.997 1.00 1.16 H new ATOM 0 HG21 THR A 135 -8.579 -3.881 11.011 1.00 1.20 H new ATOM 0 HG22 THR A 135 -9.128 -4.754 12.462 1.00 1.20 H new ATOM 0 HG23 THR A 135 -8.070 -5.565 11.283 1.00 1.20 H new ATOM 2026 N ASP A 136 -12.976 -7.160 11.073 1.00 0.97 N ATOM 2027 CA ASP A 136 -14.211 -7.665 10.491 1.00 1.00 C ATOM 2028 C ASP A 136 -14.823 -6.706 9.456 1.00 1.17 C ATOM 2029 O ASP A 136 -15.953 -6.929 9.026 1.00 1.81 O ATOM 2030 CB ASP A 136 -15.201 -8.006 11.623 1.00 1.21 C ATOM 2031 CG ASP A 136 -15.250 -9.513 11.861 1.00 2.57 C ATOM 2032 OD1 ASP A 136 -15.677 -10.207 10.910 1.00 4.04 O ATOM 2033 OD2 ASP A 136 -14.854 -9.942 12.964 1.00 3.51 O ATOM 0 H ASP A 136 -13.085 -6.787 12.016 1.00 0.97 H new ATOM 0 HA ASP A 136 -13.979 -8.572 9.933 1.00 1.00 H new ATOM 0 HB2 ASP A 136 -14.902 -7.498 12.540 1.00 1.21 H new ATOM 0 HB3 ASP A 136 -16.195 -7.641 11.366 1.00 1.21 H new ATOM 2038 N ALA A 137 -14.092 -5.664 9.044 1.00 1.15 N ATOM 2039 CA ALA A 137 -14.572 -4.526 8.274 1.00 1.40 C ATOM 2040 C ALA A 137 -14.903 -4.879 6.817 1.00 1.32 C ATOM 2041 O ALA A 137 -16.028 -5.271 6.528 1.00 1.55 O ATOM 2042 CB ALA A 137 -13.518 -3.417 8.374 1.00 1.64 C ATOM 0 H ALA A 137 -13.096 -5.595 9.254 1.00 1.15 H new ATOM 0 HA ALA A 137 -15.519 -4.185 8.693 1.00 1.40 H new ATOM 0 HB1 ALA A 137 -13.849 -2.548 7.806 1.00 1.64 H new ATOM 0 HB2 ALA A 137 -13.382 -3.137 9.419 1.00 1.64 H new ATOM 0 HB3 ALA A 137 -12.572 -3.776 7.969 1.00 1.64 H new ATOM 2048 N ASP A 138 -13.955 -4.682 5.900 1.00 1.23 N ATOM 2049 CA ASP A 138 -14.078 -4.826 4.451 1.00 1.20 C ATOM 2050 C ASP A 138 -12.703 -4.462 3.890 1.00 1.18 C ATOM 2051 O ASP A 138 -11.927 -3.774 4.557 1.00 1.27 O ATOM 2052 CB ASP A 138 -15.123 -3.854 3.886 1.00 1.28 C ATOM 2053 CG ASP A 138 -15.071 -3.833 2.363 1.00 1.38 C ATOM 2054 OD1 ASP A 138 -15.205 -4.939 1.793 1.00 1.75 O ATOM 2055 OD2 ASP A 138 -14.825 -2.741 1.806 1.00 2.76 O ATOM 0 H ASP A 138 -13.014 -4.397 6.171 1.00 1.23 H new ATOM 0 HA ASP A 138 -14.393 -5.835 4.184 1.00 1.20 H new ATOM 0 HB2 ASP A 138 -16.119 -4.150 4.217 1.00 1.28 H new ATOM 0 HB3 ASP A 138 -14.943 -2.852 4.275 1.00 1.28 H new ATOM 2060 N VAL A 139 -12.380 -4.918 2.685 1.00 1.13 N ATOM 2061 CA VAL A 139 -11.140 -4.561 2.024 1.00 1.13 C ATOM 2062 C VAL A 139 -11.482 -4.191 0.593 1.00 1.10 C ATOM 2063 O VAL A 139 -12.282 -4.878 -0.033 1.00 1.33 O ATOM 2064 CB VAL A 139 -10.169 -5.745 2.150 1.00 1.18 C ATOM 2065 CG1 VAL A 139 -9.249 -5.934 0.936 1.00 1.72 C ATOM 2066 CG2 VAL A 139 -9.297 -5.538 3.386 1.00 2.33 C ATOM 0 H VAL A 139 -12.974 -5.545 2.143 1.00 1.13 H new ATOM 0 HA VAL A 139 -10.642 -3.702 2.474 1.00 1.13 H new ATOM 0 HB VAL A 139 -10.785 -6.641 2.223 1.00 1.18 H new ATOM 0 HG11 VAL A 139 -8.595 -6.790 1.105 1.00 1.72 H new ATOM 0 HG12 VAL A 139 -9.853 -6.109 0.046 1.00 1.72 H new ATOM 0 HG13 VAL A 139 -8.645 -5.038 0.795 1.00 1.72 H new ATOM 0 HG21 VAL A 139 -8.603 -6.373 3.486 1.00 2.33 H new ATOM 0 HG22 VAL A 139 -8.735 -4.610 3.284 1.00 2.33 H new ATOM 0 HG23 VAL A 139 -9.929 -5.484 4.272 1.00 2.33 H new ATOM 2076 N ALA A 140 -10.843 -3.158 0.044 1.00 0.86 N ATOM 2077 CA ALA A 140 -11.030 -2.764 -1.337 1.00 0.77 C ATOM 2078 C ALA A 140 -9.648 -2.607 -1.955 1.00 0.77 C ATOM 2079 O ALA A 140 -8.709 -2.230 -1.261 1.00 0.94 O ATOM 2080 CB ALA A 140 -11.834 -1.464 -1.399 1.00 0.75 C ATOM 0 H ALA A 140 -10.180 -2.574 0.554 1.00 0.86 H new ATOM 0 HA ALA A 140 -11.593 -3.513 -1.895 1.00 0.77 H new ATOM 0 HB1 ALA A 140 -11.972 -1.171 -2.440 1.00 0.75 H new ATOM 0 HB2 ALA A 140 -12.807 -1.615 -0.932 1.00 0.75 H new ATOM 0 HB3 ALA A 140 -11.296 -0.678 -0.869 1.00 0.75 H new ATOM 2086 N ILE A 141 -9.502 -2.916 -3.240 1.00 0.93 N ATOM 2087 CA ILE A 141 -8.236 -2.933 -3.936 1.00 0.91 C ATOM 2088 C ILE A 141 -8.393 -1.982 -5.114 1.00 0.96 C ATOM 2089 O ILE A 141 -9.442 -1.990 -5.743 1.00 1.17 O ATOM 2090 CB ILE A 141 -7.895 -4.371 -4.385 1.00 1.07 C ATOM 2091 CG1 ILE A 141 -8.499 -5.450 -3.461 1.00 1.65 C ATOM 2092 CG2 ILE A 141 -6.369 -4.503 -4.418 1.00 1.15 C ATOM 2093 CD1 ILE A 141 -8.021 -6.862 -3.809 1.00 1.39 C ATOM 0 H ILE A 141 -10.290 -3.168 -3.837 1.00 0.93 H new ATOM 0 HA ILE A 141 -7.410 -2.612 -3.301 1.00 0.91 H new ATOM 0 HB ILE A 141 -8.331 -4.537 -5.370 1.00 1.07 H new ATOM 0 HG12 ILE A 141 -8.235 -5.226 -2.427 1.00 1.65 H new ATOM 0 HG13 ILE A 141 -9.586 -5.412 -3.528 1.00 1.65 H new ATOM 0 HG21 ILE A 141 -6.098 -5.511 -4.732 1.00 1.15 H new ATOM 0 HG22 ILE A 141 -5.956 -3.780 -5.122 1.00 1.15 H new ATOM 0 HG23 ILE A 141 -5.966 -4.312 -3.423 1.00 1.15 H new ATOM 0 HD11 ILE A 141 -8.478 -7.579 -3.127 1.00 1.39 H new ATOM 0 HD12 ILE A 141 -8.308 -7.101 -4.833 1.00 1.39 H new ATOM 0 HD13 ILE A 141 -6.936 -6.912 -3.715 1.00 1.39 H new ATOM 2105 N TYR A 142 -7.387 -1.165 -5.409 1.00 0.87 N ATOM 2106 CA TYR A 142 -7.434 -0.128 -6.434 1.00 1.05 C ATOM 2107 C TYR A 142 -6.114 -0.109 -7.209 1.00 1.10 C ATOM 2108 O TYR A 142 -5.098 0.319 -6.670 1.00 1.29 O ATOM 2109 CB TYR A 142 -7.722 1.240 -5.786 1.00 1.16 C ATOM 2110 CG TYR A 142 -8.998 1.902 -6.268 1.00 2.05 C ATOM 2111 CD1 TYR A 142 -9.981 2.310 -5.346 1.00 3.08 C ATOM 2112 CD2 TYR A 142 -9.202 2.122 -7.642 1.00 3.21 C ATOM 2113 CE1 TYR A 142 -11.156 2.936 -5.795 1.00 4.60 C ATOM 2114 CE2 TYR A 142 -10.387 2.731 -8.093 1.00 4.90 C ATOM 2115 CZ TYR A 142 -11.364 3.151 -7.170 1.00 5.44 C ATOM 2116 OH TYR A 142 -12.500 3.763 -7.608 1.00 7.16 O ATOM 0 H TYR A 142 -6.489 -1.208 -4.927 1.00 0.87 H new ATOM 0 HA TYR A 142 -8.239 -0.344 -7.136 1.00 1.05 H new ATOM 0 HB2 TYR A 142 -7.779 1.112 -4.705 1.00 1.16 H new ATOM 0 HB3 TYR A 142 -6.883 1.907 -5.985 1.00 1.16 H new ATOM 0 HD1 TYR A 142 -9.831 2.141 -4.290 1.00 3.08 H new ATOM 0 HD2 TYR A 142 -8.446 1.822 -8.353 1.00 3.21 H new ATOM 0 HE1 TYR A 142 -11.903 3.253 -5.082 1.00 4.60 H new ATOM 0 HE2 TYR A 142 -10.548 2.877 -9.151 1.00 4.90 H new ATOM 0 HH TYR A 142 -12.479 3.831 -8.585 1.00 7.16 H new ATOM 2126 N CYS A 143 -6.121 -0.567 -8.464 1.00 0.99 N ATOM 2127 CA CYS A 143 -5.002 -0.465 -9.392 1.00 0.99 C ATOM 2128 C CYS A 143 -5.543 -0.636 -10.815 1.00 0.89 C ATOM 2129 O CYS A 143 -6.502 -1.373 -11.031 1.00 0.94 O ATOM 2130 CB CYS A 143 -3.963 -1.564 -9.110 1.00 1.10 C ATOM 2131 SG CYS A 143 -2.550 -0.894 -8.189 1.00 2.32 S ATOM 0 H CYS A 143 -6.933 -1.032 -8.870 1.00 0.99 H new ATOM 0 HA CYS A 143 -4.519 0.505 -9.274 1.00 0.99 H new ATOM 0 HB2 CYS A 143 -4.425 -2.370 -8.540 1.00 1.10 H new ATOM 0 HB3 CYS A 143 -3.619 -1.995 -10.050 1.00 1.10 H new ATOM 0 HG CYS A 143 -2.981 -0.143 -7.219 1.00 2.32 H new ATOM 2137 N ARG A 144 -4.934 0.016 -11.808 1.00 0.92 N ATOM 2138 CA ARG A 144 -5.159 -0.334 -13.208 1.00 0.95 C ATOM 2139 C ARG A 144 -4.121 -1.341 -13.683 1.00 1.03 C ATOM 2140 O ARG A 144 -2.924 -1.073 -13.556 1.00 1.33 O ATOM 2141 CB ARG A 144 -5.257 0.930 -14.071 1.00 1.29 C ATOM 2142 CG ARG A 144 -3.971 1.760 -14.163 1.00 1.57 C ATOM 2143 CD ARG A 144 -3.136 1.410 -15.402 1.00 2.71 C ATOM 2144 NE ARG A 144 -2.013 2.341 -15.543 1.00 3.29 N ATOM 2145 CZ ARG A 144 -0.898 2.315 -14.803 1.00 4.30 C ATOM 2146 NH1 ARG A 144 0.000 3.294 -14.944 1.00 5.41 N ATOM 2147 NH2 ARG A 144 -0.689 1.325 -13.932 1.00 4.96 N ATOM 0 H ARG A 144 -4.282 0.788 -11.667 1.00 0.92 H new ATOM 0 HA ARG A 144 -6.121 -0.835 -13.312 1.00 0.95 H new ATOM 0 HB2 ARG A 144 -5.556 0.640 -15.078 1.00 1.29 H new ATOM 0 HB3 ARG A 144 -6.050 1.562 -13.672 1.00 1.29 H new ATOM 0 HG2 ARG A 144 -4.227 2.819 -14.188 1.00 1.57 H new ATOM 0 HG3 ARG A 144 -3.372 1.598 -13.267 1.00 1.57 H new ATOM 0 HD2 ARG A 144 -2.762 0.389 -15.320 1.00 2.71 H new ATOM 0 HD3 ARG A 144 -3.763 1.449 -16.293 1.00 2.71 H new ATOM 0 HE ARG A 144 -2.087 3.063 -16.259 1.00 3.29 H new ATOM 0 HH11 ARG A 144 -0.169 4.049 -15.609 1.00 5.41 H new ATOM 0 HH12 ARG A 144 0.854 3.287 -14.386 1.00 5.41 H new ATOM 0 HH21 ARG A 144 -1.381 0.583 -13.828 1.00 4.96 H new ATOM 0 HH22 ARG A 144 0.163 1.311 -13.371 1.00 4.96 H new ATOM 2161 N ASP A 145 -4.587 -2.465 -14.239 1.00 1.01 N ATOM 2162 CA ASP A 145 -3.749 -3.554 -14.749 1.00 1.28 C ATOM 2163 C ASP A 145 -4.576 -4.541 -15.566 1.00 1.37 C ATOM 2164 O ASP A 145 -4.218 -4.893 -16.686 1.00 1.68 O ATOM 2165 CB ASP A 145 -3.089 -4.270 -13.556 1.00 1.40 C ATOM 2166 CG ASP A 145 -2.216 -5.447 -13.972 1.00 1.86 C ATOM 2167 OD1 ASP A 145 -0.993 -5.388 -13.730 1.00 2.58 O ATOM 2168 OD2 ASP A 145 -2.814 -6.422 -14.474 1.00 2.71 O ATOM 0 H ASP A 145 -5.585 -2.646 -14.349 1.00 1.01 H new ATOM 0 HA ASP A 145 -2.983 -3.141 -15.405 1.00 1.28 H new ATOM 0 HB2 ASP A 145 -2.483 -3.554 -13.001 1.00 1.40 H new ATOM 0 HB3 ASP A 145 -3.866 -4.624 -12.878 1.00 1.40 H new ATOM 2173 N LYS A 146 -5.698 -4.982 -15.000 1.00 1.28 N ATOM 2174 CA LYS A 146 -6.596 -6.000 -15.542 1.00 1.47 C ATOM 2175 C LYS A 146 -6.107 -7.442 -15.410 1.00 1.58 C ATOM 2176 O LYS A 146 -6.894 -8.275 -14.970 1.00 1.61 O ATOM 2177 CB LYS A 146 -7.066 -5.636 -16.947 1.00 1.60 C ATOM 2178 CG LYS A 146 -8.223 -6.544 -17.363 1.00 2.00 C ATOM 2179 CD LYS A 146 -9.048 -5.842 -18.438 1.00 2.39 C ATOM 2180 CE LYS A 146 -10.393 -5.447 -17.814 1.00 2.41 C ATOM 2181 NZ LYS A 146 -11.369 -4.975 -18.820 1.00 2.90 N ATOM 0 H LYS A 146 -6.022 -4.619 -14.103 1.00 1.28 H new ATOM 0 HA LYS A 146 -7.472 -5.988 -14.893 1.00 1.47 H new ATOM 0 HB2 LYS A 146 -7.383 -4.593 -16.975 1.00 1.60 H new ATOM 0 HB3 LYS A 146 -6.242 -5.737 -17.653 1.00 1.60 H new ATOM 0 HG2 LYS A 146 -7.840 -7.491 -17.742 1.00 2.00 H new ATOM 0 HG3 LYS A 146 -8.848 -6.775 -16.501 1.00 2.00 H new ATOM 0 HD2 LYS A 146 -8.524 -4.960 -18.806 1.00 2.39 H new ATOM 0 HD3 LYS A 146 -9.202 -6.501 -19.292 1.00 2.39 H new ATOM 0 HE2 LYS A 146 -10.809 -6.304 -17.283 1.00 2.41 H new ATOM 0 HE3 LYS A 146 -10.230 -4.663 -17.075 1.00 2.41 H new ATOM 0 HZ1 LYS A 146 -12.260 -4.721 -18.347 1.00 2.90 H new ATOM 0 HZ2 LYS A 146 -10.987 -4.141 -19.310 1.00 2.90 H new ATOM 0 HZ3 LYS A 146 -11.548 -5.731 -19.512 1.00 2.90 H new ATOM 2195 N LYS A 147 -4.841 -7.784 -15.652 1.00 1.71 N ATOM 2196 CA LYS A 147 -4.397 -9.106 -15.193 1.00 1.80 C ATOM 2197 C LYS A 147 -4.566 -9.240 -13.680 1.00 1.56 C ATOM 2198 O LYS A 147 -4.713 -10.357 -13.179 1.00 1.68 O ATOM 2199 CB LYS A 147 -2.959 -9.431 -15.615 1.00 2.02 C ATOM 2200 CG LYS A 147 -2.857 -9.592 -17.134 1.00 2.24 C ATOM 2201 CD LYS A 147 -1.604 -10.403 -17.485 1.00 3.02 C ATOM 2202 CE LYS A 147 -1.421 -10.552 -18.999 1.00 3.26 C ATOM 2203 NZ LYS A 147 -2.559 -11.245 -19.643 1.00 2.91 N ATOM 0 H LYS A 147 -4.144 -7.212 -16.129 1.00 1.71 H new ATOM 0 HA LYS A 147 -5.037 -9.839 -15.684 1.00 1.80 H new ATOM 0 HB2 LYS A 147 -2.291 -8.636 -15.284 1.00 2.02 H new ATOM 0 HB3 LYS A 147 -2.631 -10.348 -15.126 1.00 2.02 H new ATOM 0 HG2 LYS A 147 -3.746 -10.094 -17.517 1.00 2.24 H new ATOM 0 HG3 LYS A 147 -2.814 -8.613 -17.611 1.00 2.24 H new ATOM 0 HD2 LYS A 147 -0.726 -9.916 -17.060 1.00 3.02 H new ATOM 0 HD3 LYS A 147 -1.672 -11.391 -17.029 1.00 3.02 H new ATOM 0 HE2 LYS A 147 -1.301 -9.565 -19.446 1.00 3.26 H new ATOM 0 HE3 LYS A 147 -0.503 -11.106 -19.198 1.00 3.26 H new ATOM 0 HZ1 LYS A 147 -2.335 -11.426 -20.642 1.00 2.91 H new ATOM 0 HZ2 LYS A 147 -2.734 -12.148 -19.159 1.00 2.91 H new ATOM 0 HZ3 LYS A 147 -3.409 -10.648 -19.581 1.00 2.91 H new ATOM 2217 N TRP A 148 -4.606 -8.129 -12.942 1.00 1.24 N ATOM 2218 CA TRP A 148 -4.832 -8.194 -11.513 1.00 1.03 C ATOM 2219 C TRP A 148 -6.224 -8.701 -11.191 1.00 0.98 C ATOM 2220 O TRP A 148 -6.379 -9.382 -10.191 1.00 0.94 O ATOM 2221 CB TRP A 148 -4.567 -6.850 -10.815 1.00 1.06 C ATOM 2222 CG TRP A 148 -5.650 -5.818 -10.943 1.00 2.51 C ATOM 2223 CD1 TRP A 148 -6.397 -5.620 -12.046 1.00 3.49 C ATOM 2224 CD2 TRP A 148 -6.214 -4.926 -9.933 1.00 3.93 C ATOM 2225 NE1 TRP A 148 -7.416 -4.735 -11.793 1.00 5.39 N ATOM 2226 CE2 TRP A 148 -7.360 -4.289 -10.496 1.00 5.74 C ATOM 2227 CE3 TRP A 148 -5.914 -4.615 -8.591 1.00 4.03 C ATOM 2228 CZ2 TRP A 148 -8.184 -3.436 -9.760 1.00 7.48 C ATOM 2229 CZ3 TRP A 148 -6.692 -3.697 -7.868 1.00 5.71 C ATOM 2230 CH2 TRP A 148 -7.836 -3.125 -8.442 1.00 7.42 C ATOM 0 H TRP A 148 -4.485 -7.187 -13.313 1.00 1.24 H new ATOM 0 HA TRP A 148 -4.110 -8.910 -11.121 1.00 1.03 H new ATOM 0 HB2 TRP A 148 -4.397 -7.041 -9.755 1.00 1.06 H new ATOM 0 HB3 TRP A 148 -3.644 -6.431 -11.215 1.00 1.06 H new ATOM 0 HD1 TRP A 148 -6.219 -6.093 -13.000 1.00 3.49 H new ATOM 0 HE1 TRP A 148 -8.118 -4.448 -12.475 1.00 5.39 H new ATOM 0 HE3 TRP A 148 -5.072 -5.091 -8.111 1.00 4.03 H new ATOM 0 HZ2 TRP A 148 -9.078 -3.022 -10.202 1.00 7.48 H new ATOM 0 HZ3 TRP A 148 -6.407 -3.429 -6.861 1.00 5.71 H new ATOM 0 HH2 TRP A 148 -8.447 -2.445 -7.867 1.00 7.42 H new ATOM 2241 N GLU A 149 -7.243 -8.383 -11.988 1.00 1.22 N ATOM 2242 CA GLU A 149 -8.602 -8.733 -11.636 1.00 1.44 C ATOM 2243 C GLU A 149 -8.836 -10.180 -12.015 1.00 1.61 C ATOM 2244 O GLU A 149 -9.610 -10.862 -11.357 1.00 1.71 O ATOM 2245 CB GLU A 149 -9.613 -7.770 -12.267 1.00 1.64 C ATOM 2246 CG GLU A 149 -9.653 -7.799 -13.801 1.00 2.72 C ATOM 2247 CD GLU A 149 -11.061 -7.738 -14.399 1.00 3.66 C ATOM 2248 OE1 GLU A 149 -11.899 -8.571 -13.989 1.00 4.87 O ATOM 2249 OE2 GLU A 149 -11.260 -6.876 -15.291 1.00 3.82 O ATOM 0 H GLU A 149 -7.146 -7.887 -12.874 1.00 1.22 H new ATOM 0 HA GLU A 149 -8.750 -8.632 -10.561 1.00 1.44 H new ATOM 0 HB2 GLU A 149 -10.607 -8.007 -11.886 1.00 1.64 H new ATOM 0 HB3 GLU A 149 -9.380 -6.756 -11.942 1.00 1.64 H new ATOM 0 HG2 GLU A 149 -9.073 -6.959 -14.183 1.00 2.72 H new ATOM 0 HG3 GLU A 149 -9.163 -8.709 -14.148 1.00 2.72 H new ATOM 2256 N MET A 150 -8.116 -10.680 -13.024 1.00 1.76 N ATOM 2257 CA MET A 150 -8.170 -12.093 -13.326 1.00 2.09 C ATOM 2258 C MET A 150 -7.622 -12.844 -12.122 1.00 1.88 C ATOM 2259 O MET A 150 -8.337 -13.611 -11.487 1.00 1.89 O ATOM 2260 CB MET A 150 -7.395 -12.398 -14.611 1.00 2.41 C ATOM 2261 CG MET A 150 -8.343 -12.345 -15.813 1.00 2.63 C ATOM 2262 SD MET A 150 -7.675 -13.016 -17.361 1.00 3.39 S ATOM 2263 CE MET A 150 -6.267 -11.915 -17.625 1.00 5.64 C ATOM 0 H MET A 150 -7.504 -10.132 -13.628 1.00 1.76 H new ATOM 0 HA MET A 150 -9.195 -12.416 -13.509 1.00 2.09 H new ATOM 0 HB2 MET A 150 -6.588 -11.676 -14.740 1.00 2.41 H new ATOM 0 HB3 MET A 150 -6.933 -13.383 -14.543 1.00 2.41 H new ATOM 0 HG2 MET A 150 -9.252 -12.892 -15.562 1.00 2.63 H new ATOM 0 HG3 MET A 150 -8.632 -11.307 -15.981 1.00 2.63 H new ATOM 0 HE1 MET A 150 -5.782 -12.164 -18.569 1.00 5.64 H new ATOM 0 HE2 MET A 150 -6.614 -10.882 -17.657 1.00 5.64 H new ATOM 0 HE3 MET A 150 -5.555 -12.033 -16.809 1.00 5.64 H new ATOM 2273 N THR A 151 -6.367 -12.591 -11.759 1.00 1.72 N ATOM 2274 CA THR A 151 -5.724 -13.333 -10.691 1.00 1.70 C ATOM 2275 C THR A 151 -6.451 -13.175 -9.362 1.00 1.35 C ATOM 2276 O THR A 151 -6.657 -14.153 -8.646 1.00 1.42 O ATOM 2277 CB THR A 151 -4.260 -12.890 -10.591 1.00 1.80 C ATOM 2278 OG1 THR A 151 -3.682 -12.747 -11.875 1.00 2.05 O ATOM 2279 CG2 THR A 151 -3.448 -13.936 -9.841 1.00 2.00 C ATOM 0 H THR A 151 -5.780 -11.878 -12.191 1.00 1.72 H new ATOM 0 HA THR A 151 -5.765 -14.396 -10.928 1.00 1.70 H new ATOM 0 HB THR A 151 -4.246 -11.934 -10.067 1.00 1.80 H new ATOM 0 HG1 THR A 151 -3.910 -11.867 -12.240 1.00 2.05 H new ATOM 0 HG21 THR A 151 -2.409 -13.612 -9.775 1.00 2.00 H new ATOM 0 HG22 THR A 151 -3.854 -14.060 -8.837 1.00 2.00 H new ATOM 0 HG23 THR A 151 -3.499 -14.886 -10.373 1.00 2.00 H new ATOM 2287 N LEU A 152 -6.865 -11.956 -9.027 1.00 1.03 N ATOM 2288 CA LEU A 152 -7.614 -11.712 -7.809 1.00 0.79 C ATOM 2289 C LEU A 152 -8.939 -12.443 -7.875 1.00 0.96 C ATOM 2290 O LEU A 152 -9.379 -12.933 -6.851 1.00 0.90 O ATOM 2291 CB LEU A 152 -7.851 -10.218 -7.540 1.00 0.79 C ATOM 2292 CG LEU A 152 -6.766 -9.546 -6.681 1.00 1.06 C ATOM 2293 CD1 LEU A 152 -6.977 -9.896 -5.205 1.00 2.75 C ATOM 2294 CD2 LEU A 152 -5.330 -9.921 -7.063 1.00 1.92 C ATOM 0 H LEU A 152 -6.691 -11.122 -9.588 1.00 1.03 H new ATOM 0 HA LEU A 152 -7.014 -12.088 -6.980 1.00 0.79 H new ATOM 0 HB2 LEU A 152 -7.917 -9.696 -8.494 1.00 0.79 H new ATOM 0 HB3 LEU A 152 -8.815 -10.099 -7.045 1.00 0.79 H new ATOM 0 HG LEU A 152 -6.876 -8.477 -6.864 1.00 1.06 H new ATOM 0 HD11 LEU A 152 -6.205 -9.416 -4.603 1.00 2.75 H new ATOM 0 HD12 LEU A 152 -7.958 -9.544 -4.884 1.00 2.75 H new ATOM 0 HD13 LEU A 152 -6.919 -10.977 -5.075 1.00 2.75 H new ATOM 0 HD21 LEU A 152 -4.632 -9.402 -6.406 1.00 1.92 H new ATOM 0 HD22 LEU A 152 -5.195 -10.998 -6.958 1.00 1.92 H new ATOM 0 HD23 LEU A 152 -5.141 -9.630 -8.096 1.00 1.92 H new ATOM 2306 N LYS A 153 -9.597 -12.553 -9.029 1.00 1.30 N ATOM 2307 CA LYS A 153 -10.862 -13.281 -9.056 1.00 1.61 C ATOM 2308 C LYS A 153 -10.607 -14.775 -8.947 1.00 1.72 C ATOM 2309 O LYS A 153 -11.446 -15.491 -8.415 1.00 1.84 O ATOM 2310 CB LYS A 153 -11.686 -12.947 -10.302 1.00 2.01 C ATOM 2311 CG LYS A 153 -12.379 -11.588 -10.106 1.00 1.67 C ATOM 2312 CD LYS A 153 -13.249 -11.181 -11.304 1.00 2.47 C ATOM 2313 CE LYS A 153 -14.716 -11.596 -11.125 1.00 3.24 C ATOM 2314 NZ LYS A 153 -14.908 -13.063 -11.109 1.00 4.59 N ATOM 0 H LYS A 153 -9.291 -12.165 -9.921 1.00 1.30 H new ATOM 0 HA LYS A 153 -11.452 -12.964 -8.196 1.00 1.61 H new ATOM 0 HB2 LYS A 153 -11.041 -12.916 -11.180 1.00 2.01 H new ATOM 0 HB3 LYS A 153 -12.429 -13.724 -10.479 1.00 2.01 H new ATOM 0 HG2 LYS A 153 -12.999 -11.628 -9.210 1.00 1.67 H new ATOM 0 HG3 LYS A 153 -11.623 -10.822 -9.936 1.00 1.67 H new ATOM 0 HD2 LYS A 153 -13.193 -10.101 -11.441 1.00 2.47 H new ATOM 0 HD3 LYS A 153 -12.852 -11.638 -12.211 1.00 2.47 H new ATOM 0 HE2 LYS A 153 -15.095 -11.176 -10.193 1.00 3.24 H new ATOM 0 HE3 LYS A 153 -15.310 -11.167 -11.932 1.00 3.24 H new ATOM 0 HZ1 LYS A 153 -15.920 -13.282 -11.207 1.00 4.59 H new ATOM 0 HZ2 LYS A 153 -14.383 -13.490 -11.898 1.00 4.59 H new ATOM 0 HZ3 LYS A 153 -14.556 -13.449 -10.210 1.00 4.59 H new ATOM 2328 N GLU A 154 -9.462 -15.252 -9.420 1.00 1.77 N ATOM 2329 CA GLU A 154 -9.149 -16.673 -9.434 1.00 2.02 C ATOM 2330 C GLU A 154 -8.905 -17.127 -7.996 1.00 1.81 C ATOM 2331 O GLU A 154 -9.344 -18.192 -7.564 1.00 2.01 O ATOM 2332 CB GLU A 154 -7.912 -16.921 -10.318 1.00 2.26 C ATOM 2333 CG GLU A 154 -8.103 -18.136 -11.229 1.00 2.72 C ATOM 2334 CD GLU A 154 -9.135 -17.845 -12.320 1.00 2.09 C ATOM 2335 OE1 GLU A 154 -10.337 -18.037 -12.032 1.00 2.76 O ATOM 2336 OE2 GLU A 154 -8.708 -17.420 -13.416 1.00 3.23 O ATOM 0 H GLU A 154 -8.724 -14.662 -9.805 1.00 1.77 H new ATOM 0 HA GLU A 154 -9.976 -17.247 -9.851 1.00 2.02 H new ATOM 0 HB2 GLU A 154 -7.716 -16.038 -10.926 1.00 2.26 H new ATOM 0 HB3 GLU A 154 -7.037 -17.074 -9.686 1.00 2.26 H new ATOM 0 HG2 GLU A 154 -7.151 -18.406 -11.686 1.00 2.72 H new ATOM 0 HG3 GLU A 154 -8.426 -18.992 -10.637 1.00 2.72 H new ATOM 2343 N ALA A 155 -8.200 -16.289 -7.239 1.00 1.48 N ATOM 2344 CA ALA A 155 -7.880 -16.543 -5.850 1.00 1.34 C ATOM 2345 C ALA A 155 -9.081 -16.288 -4.967 1.00 1.10 C ATOM 2346 O ALA A 155 -9.346 -17.092 -4.089 1.00 1.11 O ATOM 2347 CB ALA A 155 -6.692 -15.673 -5.429 1.00 1.28 C ATOM 0 H ALA A 155 -7.833 -15.403 -7.586 1.00 1.48 H new ATOM 0 HA ALA A 155 -7.605 -17.591 -5.734 1.00 1.34 H new ATOM 0 HB1 ALA A 155 -6.453 -15.866 -4.383 1.00 1.28 H new ATOM 0 HB2 ALA A 155 -5.828 -15.912 -6.049 1.00 1.28 H new ATOM 0 HB3 ALA A 155 -6.949 -14.621 -5.555 1.00 1.28 H new ATOM 2353 N VAL A 156 -9.826 -15.208 -5.186 1.00 0.97 N ATOM 2354 CA VAL A 156 -11.015 -14.914 -4.412 1.00 0.93 C ATOM 2355 C VAL A 156 -12.093 -15.950 -4.733 1.00 1.10 C ATOM 2356 O VAL A 156 -12.971 -16.184 -3.914 1.00 1.10 O ATOM 2357 CB VAL A 156 -11.438 -13.460 -4.680 1.00 0.91 C ATOM 2358 CG1 VAL A 156 -12.792 -13.115 -4.077 1.00 0.94 C ATOM 2359 CG2 VAL A 156 -10.402 -12.503 -4.066 1.00 0.83 C ATOM 0 H VAL A 156 -9.618 -14.516 -5.906 1.00 0.97 H new ATOM 0 HA VAL A 156 -10.829 -14.990 -3.341 1.00 0.93 H new ATOM 0 HB VAL A 156 -11.504 -13.352 -5.763 1.00 0.91 H new ATOM 0 HG11 VAL A 156 -13.035 -12.076 -4.300 1.00 0.94 H new ATOM 0 HG12 VAL A 156 -13.556 -13.766 -4.502 1.00 0.94 H new ATOM 0 HG13 VAL A 156 -12.756 -13.256 -2.997 1.00 0.94 H new ATOM 0 HG21 VAL A 156 -10.701 -11.472 -4.256 1.00 0.83 H new ATOM 0 HG22 VAL A 156 -10.343 -12.672 -2.991 1.00 0.83 H new ATOM 0 HG23 VAL A 156 -9.426 -12.686 -4.516 1.00 0.83 H new ATOM 2369 N ALA A 157 -12.009 -16.621 -5.886 1.00 1.38 N ATOM 2370 CA ALA A 157 -12.884 -17.747 -6.169 1.00 1.72 C ATOM 2371 C ALA A 157 -12.413 -18.934 -5.339 1.00 1.71 C ATOM 2372 O ALA A 157 -13.194 -19.565 -4.643 1.00 1.76 O ATOM 2373 CB ALA A 157 -12.888 -18.077 -7.665 1.00 2.13 C ATOM 0 H ALA A 157 -11.346 -16.401 -6.630 1.00 1.38 H new ATOM 0 HA ALA A 157 -13.911 -17.498 -5.901 1.00 1.72 H new ATOM 0 HB1 ALA A 157 -13.550 -18.923 -7.849 1.00 2.13 H new ATOM 0 HB2 ALA A 157 -13.239 -17.212 -8.227 1.00 2.13 H new ATOM 0 HB3 ALA A 157 -11.877 -18.331 -7.984 1.00 2.13 H new ATOM 2379 N ARG A 158 -11.117 -19.249 -5.375 1.00 1.75 N ATOM 2380 CA ARG A 158 -10.595 -20.367 -4.601 1.00 1.90 C ATOM 2381 C ARG A 158 -10.742 -20.167 -3.092 1.00 1.60 C ATOM 2382 O ARG A 158 -10.705 -21.143 -2.350 1.00 1.72 O ATOM 2383 CB ARG A 158 -9.132 -20.636 -4.976 1.00 2.26 C ATOM 2384 CG ARG A 158 -8.863 -22.131 -5.164 1.00 2.88 C ATOM 2385 CD ARG A 158 -9.519 -22.645 -6.456 1.00 1.94 C ATOM 2386 NE ARG A 158 -8.651 -23.605 -7.155 1.00 2.23 N ATOM 2387 CZ ARG A 158 -7.552 -23.277 -7.849 1.00 2.81 C ATOM 2388 NH1 ARG A 158 -6.787 -24.232 -8.381 1.00 3.78 N ATOM 2389 NH2 ARG A 158 -7.211 -21.995 -8.000 1.00 3.30 N ATOM 0 H ARG A 158 -10.419 -18.750 -5.927 1.00 1.75 H new ATOM 0 HA ARG A 158 -11.197 -21.239 -4.855 1.00 1.90 H new ATOM 0 HB2 ARG A 158 -8.888 -20.104 -5.895 1.00 2.26 H new ATOM 0 HB3 ARG A 158 -8.478 -20.243 -4.197 1.00 2.26 H new ATOM 0 HG2 ARG A 158 -7.788 -22.310 -5.200 1.00 2.88 H new ATOM 0 HG3 ARG A 158 -9.250 -22.685 -4.309 1.00 2.88 H new ATOM 0 HD2 ARG A 158 -10.471 -23.120 -6.218 1.00 1.94 H new ATOM 0 HD3 ARG A 158 -9.738 -21.804 -7.114 1.00 1.94 H new ATOM 0 HE ARG A 158 -8.904 -24.592 -7.108 1.00 2.23 H new ATOM 0 HH11 ARG A 158 -7.038 -25.213 -8.260 1.00 3.78 H new ATOM 0 HH12 ARG A 158 -5.951 -23.981 -8.909 1.00 3.78 H new ATOM 0 HH21 ARG A 158 -7.787 -21.262 -7.587 1.00 3.30 H new ATOM 0 HH22 ARG A 158 -6.374 -21.749 -8.529 1.00 3.30 H new ATOM 2403 N ARG A 159 -10.874 -18.920 -2.637 1.00 1.31 N ATOM 2404 CA ARG A 159 -11.052 -18.561 -1.230 1.00 1.19 C ATOM 2405 C ARG A 159 -12.452 -18.001 -0.969 1.00 1.35 C ATOM 2406 O ARG A 159 -12.630 -17.240 -0.018 1.00 2.18 O ATOM 2407 CB ARG A 159 -9.975 -17.544 -0.817 1.00 1.46 C ATOM 2408 CG ARG A 159 -8.893 -18.140 0.095 1.00 2.41 C ATOM 2409 CD ARG A 159 -7.934 -17.072 0.654 1.00 2.39 C ATOM 2410 NE ARG A 159 -8.540 -16.277 1.739 1.00 3.38 N ATOM 2411 CZ ARG A 159 -7.882 -15.504 2.623 1.00 4.23 C ATOM 2412 NH1 ARG A 159 -8.547 -14.956 3.642 1.00 5.99 N ATOM 2413 NH2 ARG A 159 -6.569 -15.276 2.505 1.00 4.18 N ATOM 0 H ARG A 159 -10.860 -18.109 -3.255 1.00 1.31 H new ATOM 0 HA ARG A 159 -10.945 -19.463 -0.627 1.00 1.19 H new ATOM 0 HB2 ARG A 159 -9.503 -17.141 -1.713 1.00 1.46 H new ATOM 0 HB3 ARG A 159 -10.452 -16.708 -0.305 1.00 1.46 H new ATOM 0 HG2 ARG A 159 -9.370 -18.664 0.923 1.00 2.41 H new ATOM 0 HG3 ARG A 159 -8.320 -18.881 -0.463 1.00 2.41 H new ATOM 0 HD2 ARG A 159 -7.032 -17.558 1.025 1.00 2.39 H new ATOM 0 HD3 ARG A 159 -7.628 -16.406 -0.153 1.00 2.39 H new ATOM 0 HE ARG A 159 -9.555 -16.317 1.828 1.00 3.38 H new ATOM 0 HH11 ARG A 159 -9.548 -15.124 3.747 1.00 5.99 H new ATOM 0 HH12 ARG A 159 -8.055 -14.369 4.316 1.00 5.99 H new ATOM 0 HH21 ARG A 159 -6.047 -15.691 1.734 1.00 4.18 H new ATOM 0 HH22 ARG A 159 -6.090 -14.687 3.186 1.00 4.18 H new ATOM 2427 N GLU A 160 -13.417 -18.338 -1.819 1.00 1.18 N ATOM 2428 CA GLU A 160 -14.795 -17.908 -1.598 1.00 1.65 C ATOM 2429 C GLU A 160 -15.283 -18.303 -0.198 1.00 2.26 C ATOM 2430 O GLU A 160 -14.815 -19.348 0.312 1.00 2.60 O ATOM 2431 CB GLU A 160 -15.754 -18.388 -2.705 1.00 2.22 C ATOM 2432 CG GLU A 160 -15.939 -19.917 -2.774 1.00 2.84 C ATOM 2433 CD GLU A 160 -17.301 -20.352 -3.347 1.00 3.93 C ATOM 2434 OE1 GLU A 160 -17.314 -21.342 -4.114 1.00 5.04 O ATOM 2435 OE2 GLU A 160 -18.326 -19.716 -3.008 1.00 4.34 O ATOM 0 H GLU A 160 -13.274 -18.901 -2.658 1.00 1.18 H new ATOM 0 HA GLU A 160 -14.799 -16.819 -1.652 1.00 1.65 H new ATOM 0 HB2 GLU A 160 -16.728 -17.924 -2.550 1.00 2.22 H new ATOM 0 HB3 GLU A 160 -15.382 -18.036 -3.667 1.00 2.22 H new ATOM 0 HG2 GLU A 160 -15.145 -20.343 -3.387 1.00 2.84 H new ATOM 0 HG3 GLU A 160 -15.827 -20.333 -1.773 1.00 2.84 H new